A0A087XT72_POEFO Loading...

FACT complex subunit SSRP1

Component of the FACT complex, a general chromatin factor that acts to reorganize nucleosomes. The FACT complex is involved in multiple processes that require DNA as a template such as mRNA elongation, DNA replication and DNA repair. During transcription elongation the FACT complex acts as a histone chaperone that both destabilizes and restores nucleosomal structure. It facilitates the passage of RNA polymerase II and transcription by promoting the dissociation of one histone H2A-H2B dimer from the nucleosome, then subsequently promotes the reestablishment of the nucleosome following the passage of RNA polymerase II. Binds specifically to double-stranded DNA.

AlphaFold DB , UniProt , Accession A0A087XT72, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 709 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	49.3	Very low	79.2	Confident	171 Å²	171	79.1 Å²	79.1	84%	0.842	41%	0.407	S	S	*	.				0	154.6	0	-69	153.9	178.2	0	0	108.4	E87	M1-E87 VanDerWaalsContact CE-CD 3.49Å; M1-E87 WeakPolarHBondContact CE-OE1 3.2Å; M1-E87 WeakPolarHBondContact CE-OE2 3.49Å
2	G	55.4	Low	79.9	Confident	48 Å²	48	74 Å²	74	50%	0.495	38%	0.38	S	S	.	.			trans	-77.3	148.3	-177.7	0	0	0	0	0	113.1	M4	G2-M4 PolarHBondContact O-N 3.47Å
3	D	69.4	Low	80	Confident	107 Å²	107	71.8 Å²	71.8	57%	0.572	37%	0.367	S	S	*	.	S	Bend	trans	-70.9	-9.5	179.3	-82.3	12.8	0	0	0	114.2	K27	D3-K27 WeakPolarHBondContact OD1-CE 3.45Å; D3-K27 IonicContact OD1-NZ 3.76Å; D3-K27 PolarHBondContact OD1-NZ 2.93Å; D3-K27 IonicContact OD2-NZ 3.26Å; D3-K27 PolarHBondContact OD2-NZ 3.38Å
4	M	81.8	Confident	79.9	Confident	80 Å²	80	71 Å²	71	39%	0.394	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	139.8	176	176	176.3	-78.1	0	0	109.6	G2 R24 F25 S26	G2-M4 PolarHBondContact O-N 3.47Å; M4-R24 HydrophobicContact CE-CB 4.4Å; M4-R24 HydrophobicContact SD-CB 4.22Å; M4-R24 HydrophobicContact SD-CG 4.36Å; M4-F25 CarbonylContact C-O 3.56Å; M4-F25 VanDerWaalsContact CA-O 3.25Å; M4-F25 WeakPolarHBondContact CA-O 3.44Å; M4-F25 WeakPolarHBondContact CG-O 3.23Å; M4-S26 WeakPolarHBondContact CE-OG 3.25Å
5	L	87	Confident	79.4	Confident	40 Å²	40	71.7 Å²	71.7	21%	0.209	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.1	160.6	-66	177.2	0	0	0	109	F7 R24 F25 L85 F88	L5-F7 HydrophobicContact CB-CE2 4.08Å; L5-R24 CarbonylContact O-C 3.45Å; L5-R24 WeakPolarHBondContact O-CA 3.25Å; L5-F25 HydrophobicContact CB-CB 4.3Å; L5-F25 HydrophobicContact CB-CD2 4.28Å; L5-F25 PolarHBondContact N-O 2.95Å; L5-F25 PolarHBondContact O-N 3.08Å; L5-L85 HydrophobicContact CD1-CD2 4.08Å; L5-F88 HydrophobicContact CD1-CB 3.76Å; L5-F88 HydrophobicContact CD1-CD1 4.48Å; L5-F88 HydrophobicContact CD1-CD2 3.77Å; L5-F88 HydrophobicContact CD1-CE2 4.5Å; L5-F88 HydrophobicContact CD1-CG 3.75Å; L5-F88 HydrophobicContact CG-CD2 3.75Å; L5-F88 HydrophobicContact CG-CE2 4.08Å; L5-F88 HydrophobicContact CG-CG 4.23Å
6	E	89.6	Confident	79	Confident	72 Å²	72	69.3 Å²	69.3	34%	0.336	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.8	-178.5	173	171.4	115.9	0	0	111.3	N8 R22 R24	E6-N8 PolarHBondContact OE1-ND2 2.99Å; E6-R22 VanDerWaalsContact CD-CZ 3.44Å; E6-R22 HydrophobicContact CG-CG 4.41Å; E6-R22 IonicContact OE1-CZ 2.71Å; E6-R22 IonicContact OE1-NE 2.74Å; E6-R22 PolarHBondContact OE1-NE 3.27Å; E6-R22 IonicContact OE1-NH2 2.67Å; E6-R22 PolarHBondContact OE1-NH2 2.85Å; E6-R22 IonicContact OE2-CZ 2.76Å; E6-R22 IonicContact OE2-NE 3.16Å; E6-R22 PolarHBondContact OE2-NE 3.43Å; E6-R22 IonicContact OE2-NH2 3.16Å; E6-R22 PolarHBondContact OE2-NH2 3.46Å; E6-R24 HydrophobicContact CB-CG 4.09Å; E6-R24 HydrophobicContact CG-CG 3.88Å; E6-R24 WeakPolarHBondContact OE2-CD 3.29Å
7	F	89.1	Confident	78.9	Confident	31 Å²	31	65.9 Å²	65.9	14%	0.136	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	122.8	175	-56.1	-96.3	0	0	0	108.5	L5 I10 R22 L23 F25 F77 D81 L85	L5-F7 HydrophobicContact CB-CE2 4.08Å; F7-I10 HydrophobicContact CB-CD1 4.01Å; F7-I10 HydrophobicContact CB-CG1 3.39Å; F7-I10 HydrophobicContact CG-CD1 4.49Å; F7-I10 HydrophobicContact CG-CG1 4.27Å; F7-R22 CarbonylContact O-C 3.53Å; F7-R22 WeakPolarHBondContact O-CA 3.44Å; F7-L23 PolarHBondContact N-O 2.91Å; F7-L23 PolarHBondContact O-N 2.89Å; F7-F25 HydrophobicContact CD2-CD2 4.12Å; F7-F25 AromaticContact CD2-CE2 3.9Å; F7-F25 HydrophobicContact CD2-CE2 3.9Å; F7-F25 AromaticContact CE2-CD2 3.84Å; F7-F25 HydrophobicContact CE2-CD2 3.84Å; F7-F25 AromaticContact CE2-CE2 3.71Å; F7-F25 HydrophobicContact CE2-CE2 3.71Å; F7-F77 HydrophobicContact CD1-CD1 4.1Å; F7-F77 HydrophobicContact CD1-CE1 4.16Å; F7-F77 HydrophobicContact CD2-CE1 4.03Å; F7-F77 AromaticContact CE1-CD1 3.97Å; F7-F77 HydrophobicContact CE1-CD1 3.97Å; F7-F77 HydrophobicContact CE1-CE1 4.21Å; F7-F77 HydrophobicContact CE2-CE1 4.09Å; F7-F77 HydrophobicContact CG-CD1 4.47Å; F7-F77 HydrophobicContact CG-CE1 4.07Å; F7-F77 HydrophobicContact CZ-CD1 4.23Å; F7-F77 HydrophobicContact CZ-CE1 4.18Å; F7-D81 HydrophobicContact CE1-CB 4.16Å; F7-D81 HydrophobicContact CZ-CB 4.46Å; F7-L85 HydrophobicContact CE2-CD2 4.04Å; F7-L85 HydrophobicContact CZ-CD1 4.25Å; F7-L85 HydrophobicContact CZ-CD2 4.1Å; F7-L85 HydrophobicContact CZ-CG 4.28Å
8	N	85.9	Confident	79.1	Confident	81 Å²	81	68.2 Å²	68.2	43%	0.433	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-11.1	-174.1	-75.6	-76.3	0	0	0	114	E6 R22	E6-N8 PolarHBondContact OE1-ND2 2.99Å; N8-R22 WeakPolarHBondContact OD1-CD 3.37Å; N8-R22 VanDerWaalsContact OD1-CG 3.31Å; N8-R22 WeakPolarHBondContact OD1-CG 3.03Å; N8-R22 PolarHBondContact OD1-NE 3.45Å; N8-R22 PolarHBondContact OD1-NH1 2.64Å
9	E	84.8	Confident	79.4	Confident	147 Å²	147	66.1 Å²	66.1	69%	0.687	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	47	-174	-60.5	-179.8	149.6	0	0	110.9
10	I	90.6	Very high	79.8	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	144	180	-64.5	-60.8	0	0	0	110.5	F7 G21 L23 Y74 F77	F7-I10 HydrophobicContact CB-CD1 4.01Å; F7-I10 HydrophobicContact CB-CG1 3.39Å; F7-I10 HydrophobicContact CG-CD1 4.49Å; F7-I10 HydrophobicContact CG-CG1 4.27Å; I10-G21 PolarHBondContact N-O 2.69Å; I10-G21 PolarHBondContact O-N 3.46Å; I10-G21 VanDerWaalsContact O-O 3.08Å; I10-L23 HydrophobicContact CB-CB 4.28Å; I10-L23 HydrophobicContact CG1-CB 4.3Å; I10-L23 HydrophobicContact CG2-CB 4.31Å; I10-L23 HydrophobicContact CG2-CD2 4.2Å; I10-Y74 HydrophobicContact CG2-CD1 4.15Å; I10-Y74 HydrophobicContact CG2-CG 4.4Å; I10-F77 HydrophobicContact CD1-CD1 3.85Å; I10-F77 HydrophobicContact CD1-CD2 4.16Å; I10-F77 HydrophobicContact CD1-CE1 3.72Å; I10-F77 HydrophobicContact CD1-CE2 4.04Å; I10-F77 HydrophobicContact CD1-CG 4.08Å; I10-F77 HydrophobicContact CD1-CZ 3.83Å; I10-F77 HydrophobicContact CG1-CE1 4.3Å; I10-F77 HydrophobicContact CG1-CZ 4.28Å; I10-F77 HydrophobicContact CG2-CZ 4.39Å
11	Y	88.5	Confident	80.2	Confident	90 Å²	90	62 Å²	62	35%	0.353	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.9	177	-57.5	-87.6	0	0	0	110.8	W18 N19 D20 L58 Y74 D75	Y11-W18 HydrophobicContact CD1-CB 4.11Å; Y11-W18 HydrophobicContact CG-CB 4.36Å; Y11-N19 CarbonylContact C-O 3.59Å; Y11-N19 VanDerWaalsContact CA-O 3.32Å; Y11-N19 WeakPolarHBondContact CA-O 3.43Å; Y11-D20 HydrophobicContact CD1-CB 4.05Å; Y11-D20 HydrophobicContact CE1-CB 3.93Å; Y11-L58 HydrophobicContact CD2-CD1 3.8Å; Y11-L58 HydrophobicContact CE2-CD1 4.26Å; Y11-L58 HydrophobicContact CG-CD1 4.14Å; Y11-Y74 CarbonylContact O-C 3.6Å; Y11-Y74 WeakPolarHBondContact O-CA 3.49Å; Y11-D75 PolarHBondContact N-O 2.8Å; Y11-D75 PolarHBondContact O-N 3.17Å
12	Q	87.6	Confident	82.1	Confident	18 Å²	18	58.6 Å²	58.6	8%	0.084	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.5	169.3	-168.6	-173.4	35	0	0	109.3	V14 S17 N19 Y32 D41 K73 Y74	Q12-V14 HydrophobicContact CB-CG2 4.32Å; Q12-V14 HydrophobicContact CG-CG2 3.73Å; Q12-V14 PolarHBondContact O-N 3.03Å; Q12-S17 VanDerWaalsContact O-O 3.11Å; Q12-N19 PolarHBondContact N-O 3.07Å; Q12-N19 PolarHBondContact O-N 3.34Å; Q12-Y32 HydrophobicContact CB-CD1 4.31Å; Q12-Y32 HydrophobicContact CB-CE1 3.6Å; Q12-Y32 HydrophobicContact CB-CE2 4.35Å; Q12-Y32 HydrophobicContact CG-CD1 4.46Å; Q12-Y32 HydrophobicContact CG-CE1 4.16Å; Q12-D41 PolarHBondContact NE2-OD2 3.5Å; Q12-K73 WeakPolarHBondContact CA-O 3.27Å; Q12-Y74 HydrophobicContact CB-CD1 4.19Å; Q12-Y74 HydrophobicContact CB-CE1 4.17Å; Q12-Y74 HydrophobicContact CG-CD1 4.21Å; Q12-Y74 HydrophobicContact CG-CE1 3.88Å
13	E	81.4	Confident	83.8	Confident	45 Å²	45	56.3 Å²	56.3	21%	0.21	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	104.9	175.5	-174.7	-149.2	122.7	0	0	109.2	R54 K73	E13-R54 IonicContact OE2-CZ 2.64Å; E13-R54 IonicContact OE2-NH1 2.81Å; E13-R54 PolarHBondContact OE2-NH1 2.88Å; E13-R54 IonicContact OE2-NH2 2.69Å; E13-R54 PolarHBondContact OE2-NH2 2.88Å; E13-K73 HydrophobicContact CB-CB 3.96Å; E13-K73 HydrophobicContact CB-CD 4.39Å; E13-K73 HydrophobicContact CG-CD 4.43Å; E13-K73 PolarHBondContact N-O 3.35Å; E13-K73 VanDerWaalsContact N-O 3.07Å; E13-K73 WeakPolarHBondContact OE1-CD 3.31Å; E13-K73 IonicContact OE1-NZ 2.73Å; E13-K73 PolarHBondContact OE1-NZ 2.97Å; E13-K73 WeakPolarHBondContact OE2-CD 3.32Å; E13-K73 IonicContact OE2-NZ 3.78Å; E13-K73 PolarHBondContact OE2-NZ 3.24Å
14	V	77.6	Confident	84.8	Confident	61 Å²	61	55.2 Å²	55.2	37%	0.37	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	112.9	-179.1	-173.7	0	0	0	0	110	Q12 G16 S17	Q12-V14 HydrophobicContact CB-CG2 4.32Å; Q12-V14 HydrophobicContact CG-CG2 3.73Å; Q12-V14 PolarHBondContact O-N 3.03Å; V14-G16 PolarHBondContact O-N 3.15Å; V14-S17 PolarHBondContact N-O 3.38Å; V14-S17 PolarHBondContact O-N 2.8Å; V14-S17 PolarHBondContact O-OG 3.29Å; V14-S17 VanDerWaalsContact O-OG 3.1Å
15	K	72.6	Confident	85.2	Confident	82 Å²	82	51.4 Å²	51.4	36%	0.357	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	34.3	-176.1	-64.6	-167.5	171.4	-172	0	113	S134 N135 N153	K15-S134 VanDerWaalsContact CE-O 3.23Å; K15-S134 WeakPolarHBondContact CE-O 3.32Å; K15-S134 PolarHBondContact NZ-O 3.43Å; K15-N135 WeakPolarHBondContact CE-OD1 3.22Å; K15-N135 WeakPolarHBondContact CG-OD1 3.37Å; K15-N153 PolarHBondContact O-ND2 2.94Å
16	G	72.8	Confident	85.3	Confident	32 Å²	32	50.7 Å²	50.7	33%	0.33	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-5.4	-178.4	0	0	0	0	0	116.2	V14 T156	V14-G16 PolarHBondContact O-N 3.15Å; G16-T156 VanDerWaalsContact O-CG2 3.25Å; G16-T156 WeakPolarHBondContact O-CG2 3.25Å
17	S	77.8	Confident	85	Confident	12 Å²	12	51.7 Å²	51.7	8%	0.084	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.3	170.8	66.7	0	0	0	0	111	Q12 V14 N19	Q12-S17 VanDerWaalsContact O-O 3.11Å; V14-S17 PolarHBondContact N-O 3.38Å; V14-S17 PolarHBondContact O-N 2.8Å; V14-S17 PolarHBondContact O-OG 3.29Å; V14-S17 VanDerWaalsContact O-OG 3.1Å; S17-N19 PolarHBondContact O-N 3.3Å; S17-N19 PolarHBondContact O-ND2 2.87Å; S17-N19 PolarHBondContact OG-ND2 3.19Å
18	W	82.9	Confident	84.8	Confident	108 Å²	108	57.5 Å²	57.5	41%	0.409	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	106.8	169.5	-74	-85	0	0	0	108.9	Y11 K36 L58 D75	Y11-W18 HydrophobicContact CD1-CB 4.11Å; Y11-W18 HydrophobicContact CG-CB 4.36Å; W18-K36 PolarHBondContact O-NZ 2.85Å; W18-L58 HydrophobicContact CG-CD1 4.27Å; W18-D75 PolarHBondContact NE1-OD2 2.84Å
19	N	83.8	Confident	85	Confident	28 Å²	28	55.7 Å²	55.7	15%	0.15	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.4	178.3	-62	-76.8	0	0	0	107.8	Y11 Q12 S17 Y32	Y11-N19 CarbonylContact C-O 3.59Å; Y11-N19 VanDerWaalsContact CA-O 3.32Å; Y11-N19 WeakPolarHBondContact CA-O 3.43Å; Q12-N19 PolarHBondContact N-O 3.07Å; Q12-N19 PolarHBondContact O-N 3.34Å; S17-N19 PolarHBondContact O-N 3.3Å; S17-N19 PolarHBondContact O-ND2 2.87Å; S17-N19 PolarHBondContact OG-ND2 3.19Å; N19-Y32 PolarHBondContact O-OH 2.9Å
20	D	87.4	Confident	85.2	Confident	46 Å²	46	48.7 Å²	48.7	25%	0.246	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	146.5	-179.2	59	-66.2	0	0	0	111.6	Y11 Y32 N35 K36	Y11-D20 HydrophobicContact CD1-CB 4.05Å; Y11-D20 HydrophobicContact CE1-CB 3.93Å; D20-Y32 PolarHBondContact O-OH 3.16Å; D20-N35 WeakPolarHBondContact O-CB 3.09Å; D20-N35 PolarHBondContact O-N 2.84Å; D20-N35 WeakPolarHBondContact OD2-CB 3.4Å; D20-N35 PolarHBondContact OD2-ND2 2.81Å; D20-K36 VanDerWaalsContact OD1-CD 3.24Å; D20-K36 WeakPolarHBondContact OD1-CD 3.33Å; D20-K36 WeakPolarHBondContact OD1-CE 3.33Å; D20-K36 WeakPolarHBondContact OD1-CG 3.41Å; D20-K36 IonicContact OD1-NZ 2.7Å; D20-K36 PolarHBondContact OD1-NZ 3.21Å
21	G	88.2	Confident	85.2	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	176.2	-177.9	0	0	0	0	0	114.5	I10 Y32 K33	I10-G21 PolarHBondContact N-O 2.69Å; I10-G21 PolarHBondContact O-N 3.46Å; I10-G21 VanDerWaalsContact O-O 3.08Å; G21-Y32 WeakPolarHBondContact CA-OH 3.43Å; G21-Y32 PolarHBondContact N-OH 3.26Å; G21-Y32 VanDerWaalsContact N-OH 3.16Å; G21-K33 CarbonylContact C-O 3.54Å; G21-K33 WeakPolarHBondContact CA-O 3.13Å
22	R	89.3	Confident	85.3	Confident	99 Å²	99	45.2 Å²	45.2	37%	0.374	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.4	-178.8	-179	176.3	-178.8	151.6	-5.7	109.8	E6 F7 N8 R24 K33	E6-R22 VanDerWaalsContact CD-CZ 3.44Å; E6-R22 HydrophobicContact CG-CG 4.41Å; E6-R22 IonicContact OE1-CZ 2.71Å; E6-R22 IonicContact OE1-NE 2.74Å; E6-R22 PolarHBondContact OE1-NE 3.27Å; E6-R22 IonicContact OE1-NH2 2.67Å; E6-R22 PolarHBondContact OE1-NH2 2.85Å; E6-R22 IonicContact OE2-CZ 2.76Å; E6-R22 IonicContact OE2-NE 3.16Å; E6-R22 PolarHBondContact OE2-NE 3.43Å; E6-R22 IonicContact OE2-NH2 3.16Å; E6-R22 PolarHBondContact OE2-NH2 3.46Å; F7-R22 CarbonylContact O-C 3.53Å; F7-R22 WeakPolarHBondContact O-CA 3.44Å; N8-R22 WeakPolarHBondContact OD1-CD 3.37Å; N8-R22 VanDerWaalsContact OD1-CG 3.31Å; N8-R22 WeakPolarHBondContact OD1-CG 3.03Å; N8-R22 PolarHBondContact OD1-NE 3.45Å; N8-R22 PolarHBondContact OD1-NH1 2.64Å; R22-R24 HydrophobicContact CG-CG 4.29Å; R22-K33 PolarHBondContact N-O 2.81Å; R22-K33 PolarHBondContact O-N 3Å
23	L	91.7	Very high	85.3	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.9	176.6	-172.8	65.4	0	0	0	110.1	F7 I10 F25 V30 Y32 Y74 F77	F7-L23 PolarHBondContact N-O 2.91Å; F7-L23 PolarHBondContact O-N 2.89Å; I10-L23 HydrophobicContact CB-CB 4.28Å; I10-L23 HydrophobicContact CG1-CB 4.3Å; I10-L23 HydrophobicContact CG2-CB 4.31Å; I10-L23 HydrophobicContact CG2-CD2 4.2Å; L23-F25 HydrophobicContact CD2-CE1 4.42Å; L23-F25 HydrophobicContact CD2-CE2 3.62Å; L23-F25 HydrophobicContact CD2-CZ 3.48Å; L23-F25 VanDerWaalsContact CD2-CZ 3.48Å; L23-F25 HydrophobicContact CG-CE2 3.97Å; L23-F25 HydrophobicContact CG-CZ 4.07Å; L23-V30 HydrophobicContact CD1-CG1 3.8Å; L23-Y32 HydrophobicContact CB-CD2 4.08Å; L23-Y32 HydrophobicContact CD1-CD2 4.01Å; L23-Y32 HydrophobicContact CD1-CG 4.37Å; L23-Y74 HydrophobicContact CD1-CD1 4.32Å; L23-Y74 HydrophobicContact CD1-CD2 4.37Å; L23-Y74 HydrophobicContact CD1-CE1 3.99Å; L23-Y74 HydrophobicContact CD1-CE2 4.02Å; L23-Y74 HydrophobicContact CD2-CD1 4.26Å; L23-Y74 HydrophobicContact CD2-CD2 4.04Å; L23-Y74 HydrophobicContact CD2-CE2 4.49Å; L23-Y74 HydrophobicContact CD2-CG 3.91Å; L23-F77 HydrophobicContact CD2-CE1 4.35Å; L23-F77 HydrophobicContact CD2-CZ 3.69Å
24	R	90.6	Very high	85.5	Confident	84 Å²	84	46.2 Å²	46.2	32%	0.317	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	117.6	179.1	-61.9	-177.8	-58.3	163.2	3	110.9	M4 L5 E6 R22 V31	M4-R24 HydrophobicContact CE-CB 4.4Å; M4-R24 HydrophobicContact SD-CB 4.22Å; M4-R24 HydrophobicContact SD-CG 4.36Å; L5-R24 CarbonylContact O-C 3.45Å; L5-R24 WeakPolarHBondContact O-CA 3.25Å; E6-R24 HydrophobicContact CB-CG 4.09Å; E6-R24 HydrophobicContact CG-CG 3.88Å; E6-R24 WeakPolarHBondContact OE2-CD 3.29Å; R22-R24 HydrophobicContact CG-CG 4.29Å; R24-V31 PolarHBondContact N-O 2.82Å; R24-V31 PolarHBondContact O-N 2.81Å
25	F	89.5	Confident	85.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.5	171.4	-58.1	-86.1	0	0	0	108.6	M4 L5 F7 L23 V30 I62 L64 F77 L85 F88 F89 Y93	M4-F25 CarbonylContact C-O 3.56Å; M4-F25 VanDerWaalsContact CA-O 3.25Å; M4-F25 WeakPolarHBondContact CA-O 3.44Å; M4-F25 WeakPolarHBondContact CG-O 3.23Å; L5-F25 HydrophobicContact CB-CB 4.3Å; L5-F25 HydrophobicContact CB-CD2 4.28Å; L5-F25 PolarHBondContact N-O 2.95Å; L5-F25 PolarHBondContact O-N 3.08Å; F7-F25 HydrophobicContact CD2-CD2 4.12Å; F7-F25 AromaticContact CD2-CE2 3.9Å; F7-F25 HydrophobicContact CD2-CE2 3.9Å; F7-F25 AromaticContact CE2-CD2 3.84Å; F7-F25 HydrophobicContact CE2-CD2 3.84Å; F7-F25 AromaticContact CE2-CE2 3.71Å; F7-F25 HydrophobicContact CE2-CE2 3.71Å; L23-F25 HydrophobicContact CD2-CE1 4.42Å; L23-F25 HydrophobicContact CD2-CE2 3.62Å; L23-F25 HydrophobicContact CD2-CZ 3.48Å; L23-F25 VanDerWaalsContact CD2-CZ 3.48Å; L23-F25 HydrophobicContact CG-CE2 3.97Å; L23-F25 HydrophobicContact CG-CZ 4.07Å; F25-V30 HydrophobicContact CD1-CB 4.34Å; F25-V30 HydrophobicContact CD1-CG1 3.71Å; F25-V30 HydrophobicContact CD1-CG2 3.78Å; F25-V30 HydrophobicContact CE1-CG1 3.69Å; F25-V30 HydrophobicContact CE1-CG2 4.21Å; F25-I62 HydrophobicContact CZ-CD1 3.92Å; F25-L64 HydrophobicContact CE1-CD1 4.38Å; F25-F77 HydrophobicContact CE2-CE1 4.36Å; F25-F77 HydrophobicContact CZ-CZ 4.5Å; F25-L85 HydrophobicContact CD2-CD2 4.07Å; F25-L85 HydrophobicContact CE2-CD2 3.77Å; F25-L85 HydrophobicContact CZ-CD2 4.18Å; F25-F88 HydrophobicContact CB-CD1 4.23Å; F25-F88 HydrophobicContact CB-CE1 3.67Å; F25-F88 HydrophobicContact CB-CZ 4.1Å; F25-F89 AromaticContact CD1-CE2 3.76Å; F25-F89 HydrophobicContact CD1-CE2 3.76Å; F25-F89 HydrophobicContact CD1-CZ 4.02Å; F25-F89 AromaticContact CE1-CE2 3.69Å; F25-F89 HydrophobicContact CE1-CE2 3.69Å; F25-F89 AromaticContact CE1-CZ 3.63Å; F25-F89 HydrophobicContact CE1-CZ 3.63Å; F25-F89 HydrophobicContact CZ-CE2 4.35Å; F25-F89 HydrophobicContact CZ-CZ 4.43Å; F25-Y93 HydrophobicContact CD1-CE2 4.19Å
26	S	88.9	Confident	85.6	Confident	25 Å²	25	48.3 Å²	48.3	18%	0.175	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.3	175.5	-34.3	0	0	0	0	108.4	M4 Q28 N29 Y93	M4-S26 WeakPolarHBondContact CE-OG 3.25Å; S26-Q28 PolarHBondContact O-N 2.96Å; S26-N29 WeakPolarHBondContact CA-O 3.34Å; S26-N29 VanDerWaalsContact CB-O 3.26Å; S26-N29 WeakPolarHBondContact CB-O 3.48Å; S26-N29 PolarHBondContact N-O 2.67Å; S26-N29 PolarHBondContact O-N 2.93Å; S26-N29 VanDerWaalsContact O-O 3.09Å; S26-N29 PolarHBondContact OG-O 2.93Å; S26-Y93 PolarHBondContact N-OH 3.23Å; S26-Y93 WeakPolarHBondContact O-CE1 3.36Å; S26-Y93 PolarHBondContact O-OH 2.97Å
27	K	84.3	Confident	85.3	Confident	93 Å²	93	49.3 Å²	49.3	40%	0.404	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-34.1	-177.8	-53.5	-167.7	175.8	159.4	0	114.7	D3 N92	D3-K27 WeakPolarHBondContact OD1-CE 3.45Å; D3-K27 IonicContact OD1-NZ 3.76Å; D3-K27 PolarHBondContact OD1-NZ 2.93Å; D3-K27 IonicContact OD2-NZ 3.26Å; D3-K27 PolarHBondContact OD2-NZ 3.38Å; K27-N92 WeakPolarHBondContact CG-OD1 3.41Å
28	Q	84.9	Confident	85.2	Confident	153 Å²	153	49 Å²	49	72%	0.715	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-18.2	-178.8	-66.9	177.7	-18.5	0	0	115	S26 A45	S26-Q28 PolarHBondContact O-N 2.96Å; Q28-A45 WeakPolarHBondContact O-CB 3.36Å; Q28-A45 PolarHBondContact O-N 2.82Å
29	N	89.4	Confident	85	Confident	43 Å²	43	47.5 Å²	47.5	23%	0.23	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	139.1	-166.1	-74.4	-69.4	0	0	0	112	S26 V31 N42 I43	S26-N29 WeakPolarHBondContact CA-O 3.34Å; S26-N29 VanDerWaalsContact CB-O 3.26Å; S26-N29 WeakPolarHBondContact CB-O 3.48Å; S26-N29 PolarHBondContact N-O 2.67Å; S26-N29 PolarHBondContact O-N 2.93Å; S26-N29 VanDerWaalsContact O-O 3.09Å; S26-N29 PolarHBondContact OG-O 2.93Å; N29-V31 HydrophobicContact CB-CG2 4.25Å; N29-N42 WeakPolarHBondContact CB-OD1 3.31Å; N29-N42 PolarHBondContact OD1-ND2 3.43Å; N29-N42 VanDerWaalsContact OD1-ND2 3.08Å; N29-N42 PolarHBondContact OD1-OD1 3.07Å; N29-I43 CarbonylContact C-O 3.56Å; N29-I43 WeakPolarHBondContact CA-O 3.16Å
30	V	89.3	Confident	85	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119	163	-171.3	0	0	0	0	108.6	L23 F25 I43 L48 L64 Y93	L23-V30 HydrophobicContact CD1-CG1 3.8Å; F25-V30 HydrophobicContact CD1-CB 4.34Å; F25-V30 HydrophobicContact CD1-CG1 3.71Å; F25-V30 HydrophobicContact CD1-CG2 3.78Å; F25-V30 HydrophobicContact CE1-CG1 3.69Å; F25-V30 HydrophobicContact CE1-CG2 4.21Å; V30-I43 HydrophobicContact CB-CB 4.25Å; V30-I43 HydrophobicContact CB-CD1 4.48Å; V30-I43 PolarHBondContact N-O 3.11Å; V30-I43 PolarHBondContact O-N 3Å; V30-L48 HydrophobicContact CG2-CD1 4.04Å; V30-L64 HydrophobicContact CG1-CD1 4.27Å; V30-L64 HydrophobicContact CG2-CD1 4.44Å; V30-Y93 HydrophobicContact CG2-CE2 4.11Å
31	V	90.8	Very high	84.9	Confident	19 Å²	19	48.9 Å²	48.9	12%	0.115	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.3	-175.7	-176.2	0	0	0	0	109.9	R24 N29 V40 D41 N42	R24-V31 PolarHBondContact N-O 2.82Å; R24-V31 PolarHBondContact O-N 2.81Å; N29-V31 HydrophobicContact CB-CG2 4.25Å; V31-V40 HydrophobicContact CG1-CG1 3.66Å; V31-D41 WeakPolarHBondContact CA-O 3.45Å; V31-N42 WeakPolarHBondContact CG2-OD1 3.42Å
32	Y	90.5	Very high	84.9	Confident	1 Å²	1	52.7 Å²	52.7	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.9	170.5	-179.4	-107.6	0	0	0	110.7	Q12 N19 D20 G21 L23 V40 D41 Y74	Q12-Y32 HydrophobicContact CB-CD1 4.31Å; Q12-Y32 HydrophobicContact CB-CE1 3.6Å; Q12-Y32 HydrophobicContact CB-CE2 4.35Å; Q12-Y32 HydrophobicContact CG-CD1 4.46Å; Q12-Y32 HydrophobicContact CG-CE1 4.16Å; N19-Y32 PolarHBondContact O-OH 2.9Å; D20-Y32 PolarHBondContact O-OH 3.16Å; G21-Y32 WeakPolarHBondContact CA-OH 3.43Å; G21-Y32 PolarHBondContact N-OH 3.26Å; G21-Y32 VanDerWaalsContact N-OH 3.16Å; L23-Y32 HydrophobicContact CB-CD2 4.08Å; L23-Y32 HydrophobicContact CD1-CD2 4.01Å; L23-Y32 HydrophobicContact CD1-CG 4.37Å; Y32-V40 CarbonylContact O-C 3.49Å; Y32-V40 VanDerWaalsContact O-CA 3.31Å; Y32-V40 WeakPolarHBondContact O-CA 3.29Å; Y32-D41 PolarHBondContact N-O 2.86Å; Y32-D41 PolarHBondContact O-N 2.88Å; Y32-Y74 WeakPolarHBondContact CB-OH 3.29Å; Y32-Y74 HydrophobicContact CD1-CE1 4.13Å; Y32-Y74 HydrophobicContact CD2-CD1 4.17Å; Y32-Y74 AromaticContact CD2-CE1 3.66Å; Y32-Y74 HydrophobicContact CD2-CE1 3.66Å; Y32-Y74 HydrophobicContact CE2-CD1 4.45Å; Y32-Y74 HydrophobicContact CE2-CE1 4.25Å; Y32-Y74 AromaticContact CG-CE1 3.59Å; Y32-Y74 HydrophobicContact CG-CE1 3.59Å
33	K	88.3	Confident	84.9	Confident	77 Å²	77	48 Å²	48	34%	0.335	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	110.7	174.1	-178.4	170.1	-179.9	176.4	0	110.2	G21 R22 N35 K39 V40	G21-K33 CarbonylContact C-O 3.54Å; G21-K33 WeakPolarHBondContact CA-O 3.13Å; R22-K33 PolarHBondContact N-O 2.81Å; R22-K33 PolarHBondContact O-N 3Å; K33-N35 PolarHBondContact O-N 3.03Å; K33-K39 WeakPolarHBondContact CA-O 3.47Å; K33-V40 HydrophobicContact CB-CG2 4.24Å; K33-V40 HydrophobicContact CD-CG2 4.17Å; K33-V40 HydrophobicContact CG-CG2 3.98Å
34	S	84.9	Confident	84.7	Confident	6 Å²	6	50.1 Å²	50.1	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	128.1	170.1	164.6	0	0	0	0	110.2	T37 G38 K39	S34-T37 PolarHBondContact OG-N 2.91Å; S34-T37 PolarHBondContact OG-OG1 2.89Å; S34-G38 WeakPolarHBondContact O-CA 3.28Å; S34-G38 PolarHBondContact O-N 3.12Å; S34-K39 PolarHBondContact N-O 2.91Å
35	N	80.8	Confident	84.4	Confident	64 Å²	64	47.1 Å²	47.1	34%	0.342	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-44.8	173.6	-68.8	-25.4	0	0	0	110.9	D20 K33 Q398	D20-N35 WeakPolarHBondContact O-CB 3.09Å; D20-N35 PolarHBondContact O-N 2.84Å; D20-N35 WeakPolarHBondContact OD2-CB 3.4Å; D20-N35 PolarHBondContact OD2-ND2 2.81Å; K33-N35 PolarHBondContact O-N 3.03Å; N35-Q398 PolarHBondContact O-NE2 2.89Å
36	K	71.4	Confident	84.1	Confident	123 Å²	123	50.6 Å²	50.6	54%	0.535	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-50.7	-177.2	-77.3	164.5	172	161	0	113.1	W18 D20	W18-K36 PolarHBondContact O-NZ 2.85Å; D20-K36 VanDerWaalsContact OD1-CD 3.24Å; D20-K36 WeakPolarHBondContact OD1-CD 3.33Å; D20-K36 WeakPolarHBondContact OD1-CE 3.33Å; D20-K36 WeakPolarHBondContact OD1-CG 3.41Å; D20-K36 IonicContact OD1-NZ 2.7Å; D20-K36 PolarHBondContact OD1-NZ 3.21Å
37	T	67.5	Low	83.9	Confident	53 Å²	53	52.3 Å²	52.3	33%	0.325	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-13.7	-172.8	75.2	0	0	0	0	112.9	S34 K39 D261	S34-T37 PolarHBondContact OG-N 2.91Å; S34-T37 PolarHBondContact OG-OG1 2.89Å; T37-K39 PolarHBondContact O-N 3.15Å; T37-K39 VanDerWaalsContact O-N 3.16Å; T37-K39 WeakPolarHBondContact OG1-CB 3.08Å; T37-D261 WeakPolarHBondContact CB-OD2 3.29Å; T37-D261 WeakPolarHBondContact CG2-OD2 3.21Å; T37-D261 PolarHBondContact OG1-OD2 3.22Å
38	G	74.3	Confident	83.9	Confident	6 Å²	6	48.3 Å²	48.3	6%	0.062	27%	0.268	C	S	.	.			trans	72.2	4.5	178.6	0	0	0	0	0	115.1	S34 R371	S34-G38 WeakPolarHBondContact O-CA 3.28Å; S34-G38 PolarHBondContact O-N 3.12Å; G38-R371 PolarHBondContact O-NH1 3.43Å
39	K	79.6	Confident	83.9	Confident	77 Å²	77	46 Å²	46	34%	0.335	26%	0.26	S	S	.	.			trans	-60	140	170.9	-177.3	170.7	178.8	-87.7	0	109.5	K33 S34 T37 D41	K33-K39 WeakPolarHBondContact CA-O 3.47Å; S34-K39 PolarHBondContact N-O 2.91Å; T37-K39 PolarHBondContact O-N 3.15Å; T37-K39 VanDerWaalsContact O-N 3.16Å; T37-K39 WeakPolarHBondContact OG1-CB 3.08Å; K39-D41 WeakPolarHBondContact CE-OD1 3.35Å; K39-D41 IonicContact NZ-OD1 3.72Å; K39-D41 PolarHBondContact NZ-OD1 2.91Å; K39-D41 IonicContact NZ-OD2 3.83Å; K39-D41 PolarHBondContact NZ-OD2 2.85Å
40	V	84	Confident	83.6	Confident	79 Å²	79	47.4 Å²	47.4	48%	0.479	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	111.2	175.5	-179	0	0	0	0	107.4	V31 Y32 K33	V31-V40 HydrophobicContact CG1-CG1 3.66Å; Y32-V40 CarbonylContact O-C 3.49Å; Y32-V40 VanDerWaalsContact O-CA 3.31Å; Y32-V40 WeakPolarHBondContact O-CA 3.29Å; K33-V40 HydrophobicContact CB-CG2 4.24Å; K33-V40 HydrophobicContact CD-CG2 4.17Å; K33-V40 HydrophobicContact CG-CG2 3.98Å
41	D	85.4	Confident	83.6	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.123	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.2	167.5	-66.4	-22	0	0	0	107.7	Q12 V31 Y32 K39 Y72	Q12-D41 PolarHBondContact NE2-OD2 3.5Å; V31-D41 WeakPolarHBondContact CA-O 3.45Å; Y32-D41 PolarHBondContact N-O 2.86Å; Y32-D41 PolarHBondContact O-N 2.88Å; K39-D41 WeakPolarHBondContact CE-OD1 3.35Å; K39-D41 IonicContact NZ-OD1 3.72Å; K39-D41 PolarHBondContact NZ-OD1 2.91Å; K39-D41 IonicContact NZ-OD2 3.83Å; K39-D41 PolarHBondContact NZ-OD2 2.85Å; D41-Y72 HydrophobicContact CB-CE1 4.32Å
42	N	88.4	Confident	83.5	Confident	81 Å²	81	47.9 Å²	47.9	43%	0.433	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.2	177.5	-178.1	56.7	0	0	0	108.6	N29 V31	N29-N42 WeakPolarHBondContact CB-OD1 3.31Å; N29-N42 PolarHBondContact OD1-ND2 3.43Å; N29-N42 VanDerWaalsContact OD1-ND2 3.08Å; N29-N42 PolarHBondContact OD1-OD1 3.07Å; V31-N42 WeakPolarHBondContact CG2-OD1 3.42Å
43	I	88.4	Confident	83.5	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.4	-178.5	-50.9	164.7	0	0	0	107.2	N29 V30 L64 T66 Y72	N29-I43 CarbonylContact C-O 3.56Å; N29-I43 WeakPolarHBondContact CA-O 3.16Å; V30-I43 HydrophobicContact CB-CB 4.25Å; V30-I43 HydrophobicContact CB-CD1 4.48Å; V30-I43 PolarHBondContact N-O 3.11Å; V30-I43 PolarHBondContact O-N 3Å; I43-L64 HydrophobicContact CD1-CD1 4.47Å; I43-T66 HydrophobicContact CG2-CG2 3.68Å; I43-Y72 HydrophobicContact CD1-CD1 3.85Å; I43-Y72 HydrophobicContact CD1-CD2 3.47Å; I43-Y72 VanDerWaalsContact CD1-CD2 3.47Å; I43-Y72 HydrophobicContact CD1-CE1 4.12Å; I43-Y72 HydrophobicContact CD1-CE2 3.76Å; I43-Y72 HydrophobicContact CD1-CG 3.52Å; I43-Y72 HydrophobicContact CG1-CD1 4.48Å; I43-Y72 HydrophobicContact CG1-CD2 4.15Å; I43-Y72 HydrophobicContact CG1-CE1 4.25Å; I43-Y72 HydrophobicContact CG1-CE2 3.9Å; I43-Y72 HydrophobicContact CG1-CG 4.44Å
44	P	87.7	Confident	83.5	Confident	44 Å²	44	45.7 Å²	45.7	29%	0.286	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	142.8	174.7	-24.1	35.6	0	0	0	111.7	G46 E47	P44-G46 PolarHBondContact O-N 3.24Å; P44-E47 HydrophobicContact CB-CG 4.35Å; P44-E47 WeakPolarHBondContact CD-OE1 3.39Å; P44-E47 HydrophobicContact CG-CG 4.34Å; P44-E47 WeakPolarHBondContact CG-OE1 3.25Å; P44-E47 PolarHBondContact O-N 2.95Å
45	A	84.2	Confident	83.5	Confident	20 Å²	20	53.7 Å²	53.7	17%	0.165	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-55.4	-38.9	177.2	0	0	0	0	0	112.4	Q28 E47 L48 Y93	Q28-A45 WeakPolarHBondContact O-CB 3.36Å; Q28-A45 PolarHBondContact O-N 2.82Å; A45-E47 VanDerWaalsContact C-N 3.26Å; A45-E47 PolarHBondContact O-N 3.06Å; A45-L48 WeakPolarHBondContact O-CB 3.26Å; A45-L48 PolarHBondContact O-N 3.26Å; A45-Y93 HydrophobicContact CB-CD1 3.63Å; A45-Y93 HydrophobicContact CB-CE1 3.76Å
46	G	83	Confident	83.6	Confident	74 Å²	74	52.2 Å²	52.2	76%	0.763	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-74.4	-5.4	177.3	0	0	0	0	0	115.6	P44	P44-G46 PolarHBondContact O-N 3.24Å
47	E	84.8	Confident	83.6	Confident	61 Å²	61	52.2 Å²	52.2	29%	0.285	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-91.9	-14.7	167.5	-77	-170.6	-125.5	0	0	112.4	P44 A45 N49 T66 S67 T68	P44-E47 HydrophobicContact CB-CG 4.35Å; P44-E47 WeakPolarHBondContact CD-OE1 3.39Å; P44-E47 HydrophobicContact CG-CG 4.34Å; P44-E47 WeakPolarHBondContact CG-OE1 3.25Å; P44-E47 PolarHBondContact O-N 2.95Å; A45-E47 VanDerWaalsContact C-N 3.26Å; A45-E47 PolarHBondContact O-N 3.06Å; E47-N49 PolarHBondContact O-N 3.28Å; E47-T66 HydrophobicContact CB-CG2 4.38Å; E47-T66 CarbonylContact O-C 3.53Å; E47-T66 WeakPolarHBondContact O-CA 3.4Å; E47-T66 WeakPolarHBondContact O-CB 3.4Å; E47-S67 PolarHBondContact O-N 2.84Å; E47-T68 WeakPolarHBondContact OE2-CG2 3.04Å; E47-T68 PolarHBondContact OE2-OG1 2.76Å
48	L	84.5	Confident	84.1	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.042	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	99.3	-172	-157.3	170.9	0	0	0	109.9	V30 A45 L64 F89 Y93 V95	V30-L48 HydrophobicContact CG2-CD1 4.04Å; A45-L48 WeakPolarHBondContact O-CB 3.26Å; A45-L48 PolarHBondContact O-N 3.26Å; L48-L64 HydrophobicContact CD1-CD1 4.17Å; L48-L64 HydrophobicContact CD1-CD2 4.26Å; L48-L64 HydrophobicContact CD2-CD2 4.35Å; L48-F89 HydrophobicContact CD1-CE1 4.1Å; L48-F89 HydrophobicContact CD2-CE1 4.39Å; L48-Y93 HydrophobicContact CD1-CD2 4.02Å; L48-Y93 HydrophobicContact CD1-CE2 4.27Å; L48-Y93 HydrophobicContact CD1-CG 4.47Å; L48-V95 HydrophobicContact CD2-CB 4.38Å; L48-V95 HydrophobicContact CD2-CG1 4.23Å; L48-V95 HydrophobicContact CD2-CG2 4.04Å; L48-V95 VanDerWaalsContact O-CG2 3.29Å; L48-V95 WeakPolarHBondContact O-CG2 3.33Å
49	N	84.8	Confident	84.5	Confident	104 Å²	104	54.9 Å²	54.9	56%	0.556	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	-30.7	-178	-81.2	16.7	0	0	0	113.3	E47 G65 S67	E47-N49 PolarHBondContact O-N 3.28Å; N49-G65 PolarHBondContact N-O 2.73Å; N49-S67 WeakPolarHBondContact ND2-CA 3.17Å
50	H	83.6	Confident	85	Confident	74 Å²	74	52.1 Å²	52.1	34%	0.343	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	139	-169.5	-169.2	37.5	0	0	0	112.4	Q52 L64 G65	H50-Q52 WeakPolarHBondContact NE2-CG 3.29Å; H50-Q52 PolarHBondContact NE2-NE2 3.2Å; H50-Q52 VanDerWaalsContact NE2-NE2 3.16Å; H50-L64 WeakPolarHBondContact O-CA 3.49Å; H50-G65 PolarHBondContact N-O 2.83Å; H50-G65 VanDerWaalsContact N-O 3.09Å; H50-G65 PolarHBondContact O-N 2.83Å
51	A	88.6	Confident	85.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	123.7	176.7	0	0	0	0	0	110.7	L64 F89 V95 L97 S98	A51-L64 HydrophobicContact CB-CD2 4.13Å; A51-F89 HydrophobicContact CB-CD1 3.81Å; A51-F89 HydrophobicContact CB-CE1 3.72Å; A51-V95 HydrophobicContact CB-CG1 3.76Å; A51-L97 HydrophobicContact CB-CD1 3.95Å; A51-S98 PolarHBondContact O-N 2.86Å; A51-S98 PolarHBondContact O-OG 2.85Å
52	Q	88.7	Confident	85.4	Confident	29 Å²	29	47.3 Å²	47.3	14%	0.136	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.7	176.7	-87.6	171.9	-23.9	0	0	111	H50 I62 K63 S98	H50-Q52 WeakPolarHBondContact NE2-CG 3.29Å; H50-Q52 PolarHBondContact NE2-NE2 3.2Å; H50-Q52 VanDerWaalsContact NE2-NE2 3.16Å; Q52-I62 WeakPolarHBondContact O-CA 3.48Å; Q52-K63 HydrophobicContact CB-CB 4.16Å; Q52-K63 PolarHBondContact N-O 3.42Å; Q52-K63 PolarHBondContact O-N 3.35Å; Q52-S98 CarbonylContact C-O 3.55Å; Q52-S98 VanDerWaalsContact CA-O 3.29Å; Q52-S98 WeakPolarHBondContact CA-O 3.32Å; Q52-S98 VanDerWaalsContact CG-OG 3.29Å; Q52-S98 WeakPolarHBondContact CG-OG 3.11Å
53	W	90.4	Very high	85.5	Confident	6 Å²	6	44 Å²	44	2%	0.023	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	126.5	162.3	-170.5	-108	0	0	0	108.4	H60 I62 F77 F82 L85 L97 S98 K100	W53-H60 HydrophobicContact CD2-CB 4.44Å; W53-H60 AromaticContact CE2-CD2 3.96Å; W53-H60 AromaticContact CE2-CG 3.8Å; W53-H60 HydrophobicContact CH2-CB 3.84Å; W53-H60 HydrophobicContact CZ2-CB 3.31Å; W53-H60 AromaticContact CZ2-CG 3.69Å; W53-H60 AromaticContact NE1-CD2 3.46Å; W53-H60 PolarHBondContact NE1-CD2 3.27Å; W53-H60 AromaticContact NE1-CG 3.73Å; W53-I62 HydrophobicContact CE3-CG1 3.78Å; W53-I62 HydrophobicContact CZ3-CD1 4.31Å; W53-I62 HydrophobicContact CZ3-CG1 3.79Å; W53-F77 HydrophobicContact CH2-CB 3.6Å; W53-F77 HydrophobicContact CH2-CG 4.33Å; W53-F77 HydrophobicContact CZ3-CB 3.92Å; W53-F77 HydrophobicContact CZ3-CG 4.17Å; W53-F82 HydrophobicContact CB-CD2 4.08Å; W53-F82 HydrophobicContact CB-CE2 3.94Å; W53-F82 AromaticContact CD1-CD2 3.75Å; W53-F82 HydrophobicContact CD2-CB 4.49Å; W53-F82 AromaticContact CD2-CD2 3.63Å; W53-F82 HydrophobicContact CD2-CD2 3.63Å; W53-F82 HydrophobicContact CD2-CE2 4.39Å; W53-F82 HydrophobicContact CD2-CG 4.5Å; W53-F82 AromaticContact CE2-CD2 3.8Å; W53-F82 HydrophobicContact CE3-CD2 4.17Å; W53-F82 AromaticContact CG-CD2 3.6Å; W53-F82 HydrophobicContact CG-CD2 3.6Å; W53-F82 AromaticContact CG-CE2 3.91Å; W53-F82 HydrophobicContact CG-CE2 3.91Å; W53-F82 HydrophobicContact CH2-CB 4.17Å; W53-F82 HydrophobicContact CZ2-CB 3.76Å; W53-F82 HydrophobicContact CZ2-CD2 4.43Å; W53-F82 AromaticContact NE1-CD2 3.89Å; W53-L85 HydrophobicContact CH2-CD1 4.33Å; W53-L85 HydrophobicContact CZ3-CD1 3.76Å; W53-L97 HydrophobicContact CB-CD1 4.11Å; W53-L97 HydrophobicContact CB-CD2 4.45Å; W53-L97 HydrophobicContact CB-CG 4.06Å; W53-L97 HydrophobicContact CE3-CD2 4.12Å; W53-S98 PolarHBondContact N-O 2.86Å; W53-K100 PolarHBondContact O-N 3.33Å
54	R	88.1	Confident	85.5	Confident	25 Å²	25	43.9 Å²	43.9	9%	0.094	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.6	-176.5	57.3	167.9	-161.1	166.2	8.4	110.5	E13 V56 G61 D75	E13-R54 IonicContact OE2-CZ 2.64Å; E13-R54 IonicContact OE2-NH1 2.81Å; E13-R54 PolarHBondContact OE2-NH1 2.88Å; E13-R54 IonicContact OE2-NH2 2.69Å; E13-R54 PolarHBondContact OE2-NH2 2.88Å; R54-V56 HydrophobicContact CG-CG1 3.91Å; R54-G61 VanDerWaalsContact CG-O 3.28Å; R54-G61 WeakPolarHBondContact CG-O 3.43Å; R54-G61 PolarHBondContact N-O 2.91Å; R54-G61 PolarHBondContact O-N 2.87Å; R54-D75 IonicContact CZ-OD1 3.68Å; R54-D75 IonicContact NE-OD1 3.91Å; R54-D75 IonicContact NH2-OD1 2.7Å; R54-D75 PolarHBondContact NH2-OD1 2.84Å; R54-D75 IonicContact NH2-OD2 3.26Å; R54-D75 PolarHBondContact NH2-OD2 2.89Å
55	R	84.4	Confident	85.4	Confident	175 Å²	175	42.1 Å²	42.1	66%	0.66	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	134.8	169	-164.7	171.2	-176.7	174.8	4.3	110.4
56	V	82.9	Confident	85.4	Confident	33 Å²	33	41.7 Å²	41.7	20%	0.2	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	172.3	-172.3	-65.4	0	0	0	0	111.8	R54 L58 G59 D75	R54-V56 HydrophobicContact CG-CG1 3.91Å; V56-L58 PolarHBondContact O-N 3.09Å; V56-L58 VanDerWaalsContact O-N 3.15Å; V56-G59 WeakPolarHBondContact CG2-O 3.09Å; V56-G59 PolarHBondContact N-O 2.89Å; V56-G59 PolarHBondContact O-N 3.32Å; V56-D75 HydrophobicContact CG2-CB 4.08Å
57	C	73	Confident	85.3	Confident	123 Å²	123	41.3 Å²	41.3	83%	0.831	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.4	-178	-56.5	0	0	0	0	114.1
58	L	77.4	Confident	84.5	Confident	80 Å²	80	42.1 Å²	42.1	42%	0.419	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	31.5	-179.4	-60	176.8	0	0	0	112.5	Y11 W18 V56	Y11-L58 HydrophobicContact CD2-CD1 3.8Å; Y11-L58 HydrophobicContact CE2-CD1 4.26Å; Y11-L58 HydrophobicContact CG-CD1 4.14Å; W18-L58 HydrophobicContact CG-CD1 4.27Å; V56-L58 PolarHBondContact O-N 3.09Å; V56-L58 VanDerWaalsContact O-N 3.15Å
59	G	83.2	Confident	83.8	Confident	34 Å²	34	43 Å²	43	35%	0.351	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	96.9	-115.6	-176.8	0	0	0	0	0	111.3	V56	V56-G59 WeakPolarHBondContact CG2-O 3.09Å; V56-G59 PolarHBondContact N-O 2.89Å; V56-G59 PolarHBondContact O-N 3.32Å
60	H	88.8	Confident	83.3	Confident	20 Å²	20	43.3 Å²	43.3	9%	0.093	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	153.8	177	-71.7	100	0	0	0	112.6	W53 G76 F77 D79	W53-H60 HydrophobicContact CD2-CB 4.44Å; W53-H60 AromaticContact CE2-CD2 3.96Å; W53-H60 AromaticContact CE2-CG 3.8Å; W53-H60 HydrophobicContact CH2-CB 3.84Å; W53-H60 HydrophobicContact CZ2-CB 3.31Å; W53-H60 AromaticContact CZ2-CG 3.69Å; W53-H60 AromaticContact NE1-CD2 3.46Å; W53-H60 PolarHBondContact NE1-CD2 3.27Å; W53-H60 AromaticContact NE1-CG 3.73Å; H60-G76 PolarHBondContact O-N 2.77Å; H60-F77 HydrophobicContact CB-CB 4.42Å; H60-F77 PolarHBondContact N-O 2.79Å; H60-F77 VanDerWaalsContact N-O 3.12Å; H60-F77 PolarHBondContact O-N 2.86Å; H60-D79 VanDerWaalsContact CE1-CG 3.41Å; H60-D79 IonicContact CE1-OD1 2.76Å; H60-D79 PolarHBondContact CE1-OD1 2.88Å; H60-D79 VanDerWaalsContact CE1-OD1 3.26Å; H60-D79 IonicContact CE1-OD2 2.64Å; H60-D79 PolarHBondContact CE1-OD2 2.88Å; H60-D79 VanDerWaalsContact ND1-CG 3.34Å; H60-D79 IonicContact ND1-OD1 3.48Å; H60-D79 PolarHBondContact ND1-OD1 3.03Å; H60-D79 IonicContact ND1-OD2 2.61Å
61	G	89.2	Confident	83.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.4	-176.3	0	0	0	0	0	111.8	R54 Y74	R54-G61 VanDerWaalsContact CG-O 3.28Å; R54-G61 WeakPolarHBondContact CG-O 3.43Å; R54-G61 PolarHBondContact N-O 2.91Å; R54-G61 PolarHBondContact O-N 2.87Å; G61-Y74 CarbonylContact C-O 3.59Å; G61-Y74 WeakPolarHBondContact CA-O 3.31Å
62	I	90.4	Very high	83.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.7	171.6	-54	170.3	0	0	0	108.4	F25 Q52 W53 L64 Y74 F77 L85 L97	F25-I62 HydrophobicContact CZ-CD1 3.92Å; Q52-I62 WeakPolarHBondContact O-CA 3.48Å; W53-I62 HydrophobicContact CE3-CG1 3.78Å; W53-I62 HydrophobicContact CZ3-CD1 4.31Å; W53-I62 HydrophobicContact CZ3-CG1 3.79Å; I62-L64 HydrophobicContact CG2-CD2 3.45Å; I62-L64 VanDerWaalsContact CG2-CD2 3.45Å; I62-L64 HydrophobicContact CG2-CG 3.95Å; I62-Y74 PolarHBondContact N-O 2.72Å; I62-Y74 PolarHBondContact O-N 2.82Å; I62-F77 HydrophobicContact CB-CE2 3.98Å; I62-F77 HydrophobicContact CB-CZ 4.43Å; I62-F77 HydrophobicContact CD1-CD1 4.17Å; I62-F77 HydrophobicContact CD1-CD2 4.11Å; I62-F77 HydrophobicContact CD1-CE1 3.65Å; I62-F77 HydrophobicContact CD1-CE2 3.59Å; I62-F77 HydrophobicContact CD1-CG 4.37Å; I62-F77 HydrophobicContact CD1-CZ 3.33Å; I62-F77 HydrophobicContact CG1-CD2 3.84Å; I62-F77 HydrophobicContact CG1-CE1 4.44Å; I62-F77 HydrophobicContact CG1-CE2 3.55Å; I62-F77 HydrophobicContact CG1-CG 4.39Å; I62-F77 HydrophobicContact CG1-CZ 3.87Å; I62-L85 HydrophobicContact CD1-CD1 3.66Å; I62-L85 HydrophobicContact CD1-CD2 4.17Å; I62-L85 HydrophobicContact CD1-CG 4.49Å; I62-L97 HydrophobicContact CG2-CD1 4.4Å
63	K	88.9	Confident	83	Confident	12 Å²	12	43.8 Å²	43.8	5%	0.052	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.2	167.7	173.9	-173	159	-160	0	108.6	Q52 I71 Y72 E130	Q52-K63 HydrophobicContact CB-CB 4.16Å; Q52-K63 PolarHBondContact N-O 3.42Å; Q52-K63 PolarHBondContact O-N 3.35Å; K63-I71 HydrophobicContact CD-CG2 4.21Å; K63-I71 HydrophobicContact CG-CG2 3.6Å; K63-Y72 WeakPolarHBondContact CA-O 3.45Å; K63-E130 WeakPolarHBondContact CD-OE2 3.47Å; K63-E130 WeakPolarHBondContact CE-OE2 3.36Å; K63-E130 IonicContact NZ-OE1 3.73Å; K63-E130 PolarHBondContact NZ-OE1 2.87Å; K63-E130 IonicContact NZ-OE2 2.91Å; K63-E130 PolarHBondContact NZ-OE2 3.03Å
64	L	88.9	Confident	83.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.9	175	-56.3	-176.8	0	0	0	109.7	F25 V30 I43 L48 H50 A51 I62 I71 Y72 Y74 F89	F25-L64 HydrophobicContact CE1-CD1 4.38Å; V30-L64 HydrophobicContact CG1-CD1 4.27Å; V30-L64 HydrophobicContact CG2-CD1 4.44Å; I43-L64 HydrophobicContact CD1-CD1 4.47Å; L48-L64 HydrophobicContact CD1-CD1 4.17Å; L48-L64 HydrophobicContact CD1-CD2 4.26Å; L48-L64 HydrophobicContact CD2-CD2 4.35Å; H50-L64 WeakPolarHBondContact O-CA 3.49Å; A51-L64 HydrophobicContact CB-CD2 4.13Å; I62-L64 HydrophobicContact CG2-CD2 3.45Å; I62-L64 VanDerWaalsContact CG2-CD2 3.45Å; I62-L64 HydrophobicContact CG2-CG 3.95Å; L64-I71 CarbonylContact O-C 3.6Å; L64-I71 VanDerWaalsContact O-CA 3.31Å; L64-I71 WeakPolarHBondContact O-CA 3.37Å; L64-Y72 PolarHBondContact N-O 3.42Å; L64-Y72 PolarHBondContact O-N 2.87Å; L64-Y74 HydrophobicContact CD1-CD2 4.4Å; L64-Y74 HydrophobicContact CD1-CE2 4.09Å; L64-F89 HydrophobicContact CD2-CE1 3.61Å; L64-F89 HydrophobicContact CD2-CZ 3.81Å
65	G	85.5	Confident	83.2	Confident	7 Å²	7	42.4 Å²	42.4	7%	0.072	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.8	172.5	0	0	0	0	0	111.4	N49 H50	N49-G65 PolarHBondContact N-O 2.73Å; H50-G65 PolarHBondContact N-O 2.83Å; H50-G65 VanDerWaalsContact N-O 3.09Å; H50-G65 PolarHBondContact O-N 2.83Å
66	T	84.6	Confident	83.4	Confident	11 Å²	11	35.3 Å²	35.3	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	159	178.1	63	0	0	0	0	112.7	I43 E47 T68 G69 H70 Y72	I43-T66 HydrophobicContact CG2-CG2 3.68Å; E47-T66 HydrophobicContact CB-CG2 4.38Å; E47-T66 CarbonylContact O-C 3.53Å; E47-T66 WeakPolarHBondContact O-CA 3.4Å; E47-T66 WeakPolarHBondContact O-CB 3.4Å; T66-T68 WeakPolarHBondContact CB-OG1 3.41Å; T66-T68 PolarHBondContact O-N 2.71Å; T66-T68 PolarHBondContact OG1-OG1 2.89Å; T66-G69 PolarHBondContact O-N 2.64Å; T66-G69 PolarHBondContact OG1-N 2.79Å; T66-H70 PolarHBondContact N-O 3.48Å; T66-H70 PolarHBondContact OG1-N 2.84Å; T66-H70 VanDerWaalsContact OG1-N 3.14Å; T66-H70 PolarHBondContact OG1-O 3.28Å; T66-Y72 HydrophobicContact CG2-CD2 4.25Å; T66-Y72 HydrophobicContact CG2-CE2 3.86Å
67	S	79.8	Confident	83.7	Confident	66 Å²	66	33.9 Å²	33.9	46%	0.462	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.3	167.2	58	0	0	0	0	112.7	E47 N49 G69	E47-S67 PolarHBondContact O-N 2.84Å; N49-S67 WeakPolarHBondContact ND2-CA 3.17Å; S67-G69 PolarHBondContact O-N 2.59Å
68	T	69.8	Low	84.5	Confident	77 Å²	77	35.8 Å²	35.8	47%	0.472	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-0.6	171.6	46.7	0	0	0	0	114	E47 T66 H70	E47-T68 WeakPolarHBondContact OE2-CG2 3.04Å; E47-T68 PolarHBondContact OE2-OG1 2.76Å; T66-T68 WeakPolarHBondContact CB-OG1 3.41Å; T66-T68 PolarHBondContact O-N 2.71Å; T66-T68 PolarHBondContact OG1-OG1 2.89Å; T68-H70 PolarHBondContact O-N 2.87Å
69	G	69.4	Low	84.9	Confident	26 Å²	26	37.1 Å²	37.1	27%	0.268	21%	0.207	S	C	.	.	S	Bend	trans	79.2	-2.2	176.4	0	0	0	0	0	115	T66 S67 P117	T66-G69 PolarHBondContact O-N 2.64Å; T66-G69 PolarHBondContact OG1-N 2.79Å; S67-G69 PolarHBondContact O-N 2.59Å; G69-P117 WeakPolarHBondContact O-CG 3.32Å
70	H	74.1	Confident	85.1	Confident	111 Å²	111	39.8 Å²	39.8	51%	0.514	22%	0.216	S	C	.	.			trans	-70.2	143.4	171.9	-62.8	142.6	0	0	0	110.4	T66 T68 Y72	T66-H70 PolarHBondContact N-O 3.48Å; T66-H70 PolarHBondContact OG1-N 2.84Å; T66-H70 VanDerWaalsContact OG1-N 3.14Å; T66-H70 PolarHBondContact OG1-O 3.28Å; T68-H70 PolarHBondContact O-N 2.87Å; H70-Y72 HydrophobicContact CB-CD2 4.44Å; H70-Y72 HydrophobicContact CB-CE2 3.67Å
71	I	80.8	Confident	85.1	Confident	55 Å²	55	39.6 Å²	39.6	28%	0.282	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.5	173.5	-65.4	-158.4	0	0	0	110.2	K63 L64 K73 L118	K63-I71 HydrophobicContact CD-CG2 4.21Å; K63-I71 HydrophobicContact CG-CG2 3.6Å; L64-I71 CarbonylContact O-C 3.6Å; L64-I71 VanDerWaalsContact O-CA 3.31Å; L64-I71 WeakPolarHBondContact O-CA 3.37Å; I71-K73 HydrophobicContact CG2-CG 4.16Å; I71-L118 HydrophobicContact CB-CD1 4.3Å; I71-L118 HydrophobicContact CB-CD2 4.35Å; I71-L118 HydrophobicContact CD1-CD1 3.48Å; I71-L118 VanDerWaalsContact CD1-CD1 3.48Å; I71-L118 HydrophobicContact CD1-CD2 3.87Å; I71-L118 HydrophobicContact CD1-CG 4.32Å; I71-L118 HydrophobicContact CG1-CD1 3.67Å; I71-L118 HydrophobicContact CG1-CD2 4.37Å
72	Y	86.4	Confident	85	Confident	44 Å²	44	42.1 Å²	42.1	17%	0.173	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.7	178.6	-60.6	-96.1	0	0	0	108.4	D41 I43 K63 L64 T66 H70	D41-Y72 HydrophobicContact CB-CE1 4.32Å; I43-Y72 HydrophobicContact CD1-CD1 3.85Å; I43-Y72 HydrophobicContact CD1-CD2 3.47Å; I43-Y72 VanDerWaalsContact CD1-CD2 3.47Å; I43-Y72 HydrophobicContact CD1-CE1 4.12Å; I43-Y72 HydrophobicContact CD1-CE2 3.76Å; I43-Y72 HydrophobicContact CD1-CG 3.52Å; I43-Y72 HydrophobicContact CG1-CD1 4.48Å; I43-Y72 HydrophobicContact CG1-CD2 4.15Å; I43-Y72 HydrophobicContact CG1-CE1 4.25Å; I43-Y72 HydrophobicContact CG1-CE2 3.9Å; I43-Y72 HydrophobicContact CG1-CG 4.44Å; K63-Y72 WeakPolarHBondContact CA-O 3.45Å; L64-Y72 PolarHBondContact N-O 3.42Å; L64-Y72 PolarHBondContact O-N 2.87Å; T66-Y72 HydrophobicContact CG2-CD2 4.25Å; T66-Y72 HydrophobicContact CG2-CE2 3.86Å; H70-Y72 HydrophobicContact CB-CD2 4.44Å; H70-Y72 HydrophobicContact CB-CE2 3.67Å
73	K	88	Confident	85	Confident	14 Å²	14	49 Å²	49	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.4	-178.7	-63.2	-176.2	-174	-178.9	0	109	Q12 E13 I71	Q12-K73 WeakPolarHBondContact CA-O 3.27Å; E13-K73 HydrophobicContact CB-CB 3.96Å; E13-K73 HydrophobicContact CB-CD 4.39Å; E13-K73 HydrophobicContact CG-CD 4.43Å; E13-K73 PolarHBondContact N-O 3.35Å; E13-K73 VanDerWaalsContact N-O 3.07Å; E13-K73 WeakPolarHBondContact OE1-CD 3.31Å; E13-K73 IonicContact OE1-NZ 2.73Å; E13-K73 PolarHBondContact OE1-NZ 2.97Å; E13-K73 WeakPolarHBondContact OE2-CD 3.32Å; E13-K73 IonicContact OE2-NZ 3.78Å; E13-K73 PolarHBondContact OE2-NZ 3.24Å; I71-K73 HydrophobicContact CG2-CG 4.16Å
74	Y	90.9	Very high	85	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.4	179.9	-61.3	-65	0	0	0	109.6	I10 Y11 Q12 L23 Y32 G61 I62 L64 F77	I10-Y74 HydrophobicContact CG2-CD1 4.15Å; I10-Y74 HydrophobicContact CG2-CG 4.4Å; Y11-Y74 CarbonylContact O-C 3.6Å; Y11-Y74 WeakPolarHBondContact O-CA 3.49Å; Q12-Y74 HydrophobicContact CB-CD1 4.19Å; Q12-Y74 HydrophobicContact CB-CE1 4.17Å; Q12-Y74 HydrophobicContact CG-CD1 4.21Å; Q12-Y74 HydrophobicContact CG-CE1 3.88Å; L23-Y74 HydrophobicContact CD1-CD1 4.32Å; L23-Y74 HydrophobicContact CD1-CD2 4.37Å; L23-Y74 HydrophobicContact CD1-CE1 3.99Å; L23-Y74 HydrophobicContact CD1-CE2 4.02Å; L23-Y74 HydrophobicContact CD2-CD1 4.26Å; L23-Y74 HydrophobicContact CD2-CD2 4.04Å; L23-Y74 HydrophobicContact CD2-CE2 4.49Å; L23-Y74 HydrophobicContact CD2-CG 3.91Å; Y32-Y74 WeakPolarHBondContact CB-OH 3.29Å; Y32-Y74 HydrophobicContact CD1-CE1 4.13Å; Y32-Y74 HydrophobicContact CD2-CD1 4.17Å; Y32-Y74 AromaticContact CD2-CE1 3.66Å; Y32-Y74 HydrophobicContact CD2-CE1 3.66Å; Y32-Y74 HydrophobicContact CE2-CD1 4.45Å; Y32-Y74 HydrophobicContact CE2-CE1 4.25Å; Y32-Y74 AromaticContact CG-CE1 3.59Å; Y32-Y74 HydrophobicContact CG-CE1 3.59Å; G61-Y74 CarbonylContact C-O 3.59Å; G61-Y74 WeakPolarHBondContact CA-O 3.31Å; I62-Y74 PolarHBondContact N-O 2.72Å; I62-Y74 PolarHBondContact O-N 2.82Å; L64-Y74 HydrophobicContact CD1-CD2 4.4Å; L64-Y74 HydrophobicContact CD1-CE2 4.09Å; Y74-F77 WeakPolarHBondContact O-CE2 3.23Å
75	D	90.3	Very high	85	Confident	3 Å²	3	53 Å²	53	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.2	-177.9	-61.3	-23.3	0	0	0	110.6	Y11 W18 R54 V56	Y11-D75 PolarHBondContact N-O 2.8Å; Y11-D75 PolarHBondContact O-N 3.17Å; W18-D75 PolarHBondContact NE1-OD2 2.84Å; R54-D75 IonicContact CZ-OD1 3.68Å; R54-D75 IonicContact NE-OD1 3.91Å; R54-D75 IonicContact NH2-OD1 2.7Å; R54-D75 PolarHBondContact NH2-OD1 2.84Å; R54-D75 IonicContact NH2-OD2 3.26Å; R54-D75 PolarHBondContact NH2-OD2 2.89Å; V56-D75 HydrophobicContact CG2-CB 4.08Å
76	G	88.3	Confident	85.2	Confident	25 Å²	25	53.6 Å²	53.6	26%	0.258	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	113.9	13.3	176.7	0	0	0	0	0	115.3	H60	H60-G76 PolarHBondContact O-N 2.77Å
77	F	90.4	Very high	85.4	Confident	3 Å²	3	58 Å²	58	1%	0.013	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	154.1	176.1	-59.8	-87.5	0	0	0	111.9	F7 I10 L23 F25 W53 H60 I62 Y74 L85	F7-F77 HydrophobicContact CD1-CD1 4.1Å; F7-F77 HydrophobicContact CD1-CE1 4.16Å; F7-F77 HydrophobicContact CD2-CE1 4.03Å; F7-F77 AromaticContact CE1-CD1 3.97Å; F7-F77 HydrophobicContact CE1-CD1 3.97Å; F7-F77 HydrophobicContact CE1-CE1 4.21Å; F7-F77 HydrophobicContact CE2-CE1 4.09Å; F7-F77 HydrophobicContact CG-CD1 4.47Å; F7-F77 HydrophobicContact CG-CE1 4.07Å; F7-F77 HydrophobicContact CZ-CD1 4.23Å; F7-F77 HydrophobicContact CZ-CE1 4.18Å; I10-F77 HydrophobicContact CD1-CD1 3.85Å; I10-F77 HydrophobicContact CD1-CD2 4.16Å; I10-F77 HydrophobicContact CD1-CE1 3.72Å; I10-F77 HydrophobicContact CD1-CE2 4.04Å; I10-F77 HydrophobicContact CD1-CG 4.08Å; I10-F77 HydrophobicContact CD1-CZ 3.83Å; I10-F77 HydrophobicContact CG1-CE1 4.3Å; I10-F77 HydrophobicContact CG1-CZ 4.28Å; I10-F77 HydrophobicContact CG2-CZ 4.39Å; L23-F77 HydrophobicContact CD2-CE1 4.35Å; L23-F77 HydrophobicContact CD2-CZ 3.69Å; F25-F77 HydrophobicContact CE2-CE1 4.36Å; F25-F77 HydrophobicContact CZ-CZ 4.5Å; W53-F77 HydrophobicContact CH2-CB 3.6Å; W53-F77 HydrophobicContact CH2-CG 4.33Å; W53-F77 HydrophobicContact CZ3-CB 3.92Å; W53-F77 HydrophobicContact CZ3-CG 4.17Å; H60-F77 HydrophobicContact CB-CB 4.42Å; H60-F77 PolarHBondContact N-O 2.79Å; H60-F77 VanDerWaalsContact N-O 3.12Å; H60-F77 PolarHBondContact O-N 2.86Å; I62-F77 HydrophobicContact CB-CE2 3.98Å; I62-F77 HydrophobicContact CB-CZ 4.43Å; I62-F77 HydrophobicContact CD1-CD1 4.17Å; I62-F77 HydrophobicContact CD1-CD2 4.11Å; I62-F77 HydrophobicContact CD1-CE1 3.65Å; I62-F77 HydrophobicContact CD1-CE2 3.59Å; I62-F77 HydrophobicContact CD1-CG 4.37Å; I62-F77 HydrophobicContact CD1-CZ 3.33Å; I62-F77 HydrophobicContact CG1-CD2 3.84Å; I62-F77 HydrophobicContact CG1-CE1 4.44Å; I62-F77 HydrophobicContact CG1-CE2 3.55Å; I62-F77 HydrophobicContact CG1-CG 4.39Å; I62-F77 HydrophobicContact CG1-CZ 3.87Å; Y74-F77 WeakPolarHBondContact O-CE2 3.23Å; F77-L85 HydrophobicContact CD1-CD1 3.98Å; F77-L85 HydrophobicContact CE1-CD1 4.25Å
78	R	88.8	Confident	85.8	Confident	164 Å²	164	55.3 Å²	55.3	62%	0.619	28%	0.28	S	S	*	.			trans	-95.3	151.9	174.2	-52.4	177.2	-173.3	-178	2.8	109.8	T80 D81	R78-T80 PolarHBondContact O-N 2.83Å; R78-D81 WeakPolarHBondContact CB-OD2 3.47Å; R78-D81 PolarHBondContact N-OD2 2.95Å; R78-D81 WeakPolarHBondContact O-CB 3.18Å; R78-D81 PolarHBondContact O-N 2.94Å
79	D	86	Confident	86.6	Confident	108 Å²	108	51.7 Å²	51.7	58%	0.578	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-54.7	-39.1	179.3	-54.5	31.7	0	0	0	110.8	H60 D81 F82	H60-D79 VanDerWaalsContact CE1-CG 3.41Å; H60-D79 IonicContact CE1-OD1 2.76Å; H60-D79 PolarHBondContact CE1-OD1 2.88Å; H60-D79 VanDerWaalsContact CE1-OD1 3.26Å; H60-D79 IonicContact CE1-OD2 2.64Å; H60-D79 PolarHBondContact CE1-OD2 2.88Å; H60-D79 VanDerWaalsContact ND1-CG 3.34Å; H60-D79 IonicContact ND1-OD1 3.48Å; H60-D79 PolarHBondContact ND1-OD1 3.03Å; H60-D79 IonicContact ND1-OD2 2.61Å; D79-D81 PolarHBondContact O-N 2.93Å; D79-D81 VanDerWaalsContact O-N 3.07Å; D79-F82 WeakPolarHBondContact O-CB 3.21Å; D79-F82 PolarHBondContact O-N 3.17Å
80	T	88.3	Confident	87.5	Confident	89 Å²	89	55.2 Å²	55.2	55%	0.546	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-64.7	-6.1	175.1	58.3	0	0	0	0	115.4	R78 K84	R78-T80 PolarHBondContact O-N 2.83Å; T80-K84 WeakPolarHBondContact O-CE 3.5Å; T80-K84 PolarHBondContact O-NZ 3.43Å
81	D	87.8	Confident	88.1	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.091	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-98	-15.7	179	-56.6	-36.5	0	0	0	112.2	F7 R78 D79 E83 K84 L85	F7-D81 HydrophobicContact CE1-CB 4.16Å; F7-D81 HydrophobicContact CZ-CB 4.46Å; R78-D81 WeakPolarHBondContact CB-OD2 3.47Å; R78-D81 PolarHBondContact N-OD2 2.95Å; R78-D81 WeakPolarHBondContact O-CB 3.18Å; R78-D81 PolarHBondContact O-N 2.94Å; D79-D81 PolarHBondContact O-N 2.93Å; D79-D81 VanDerWaalsContact O-N 3.07Å; D81-E83 PolarHBondContact O-N 2.89Å; D81-K84 PolarHBondContact O-N 3.16Å; D81-K84 IonicContact OD1-NZ 3.38Å; D81-K84 PolarHBondContact OD1-NZ 2.87Å; D81-L85 HydrophobicContact CB-CD1 4.09Å; D81-L85 WeakPolarHBondContact O-CB 3.37Å; D81-L85 WeakPolarHBondContact O-CD1 3.38Å; D81-L85 VanDerWaalsContact O-CG 3.27Å; D81-L85 WeakPolarHBondContact O-CG 3.4Å; D81-L85 PolarHBondContact O-N 2.92Å
82	F	88.5	Confident	88.2	Confident	53 Å²	53	54.9 Å²	54.9	23%	0.232	27%	0.267	C	S	.	.	H	α-helix	trans	-55	-50.4	178.8	175.5	-107.8	0	0	0	112.5	W53 D79 L85 S86 L97	W53-F82 HydrophobicContact CB-CD2 4.08Å; W53-F82 HydrophobicContact CB-CE2 3.94Å; W53-F82 AromaticContact CD1-CD2 3.75Å; W53-F82 HydrophobicContact CD2-CB 4.49Å; W53-F82 AromaticContact CD2-CD2 3.63Å; W53-F82 HydrophobicContact CD2-CD2 3.63Å; W53-F82 HydrophobicContact CD2-CE2 4.39Å; W53-F82 HydrophobicContact CD2-CG 4.5Å; W53-F82 AromaticContact CE2-CD2 3.8Å; W53-F82 HydrophobicContact CE3-CD2 4.17Å; W53-F82 AromaticContact CG-CD2 3.6Å; W53-F82 HydrophobicContact CG-CD2 3.6Å; W53-F82 AromaticContact CG-CE2 3.91Å; W53-F82 HydrophobicContact CG-CE2 3.91Å; W53-F82 HydrophobicContact CH2-CB 4.17Å; W53-F82 HydrophobicContact CZ2-CB 3.76Å; W53-F82 HydrophobicContact CZ2-CD2 4.43Å; W53-F82 AromaticContact NE1-CD2 3.89Å; D79-F82 WeakPolarHBondContact O-CB 3.21Å; D79-F82 PolarHBondContact O-N 3.17Å; F82-L85 PolarHBondContact O-N 2.82Å; F82-S86 VanDerWaalsContact O-CB 3.25Å; F82-S86 WeakPolarHBondContact O-CB 3.35Å; F82-S86 PolarHBondContact O-N 3.38Å; F82-L97 HydrophobicContact CD2-CD2 3.73Å; F82-L97 HydrophobicContact CD2-CG 4.36Å; F82-L97 HydrophobicContact CE2-CD2 3.83Å; F82-L97 HydrophobicContact CE2-CG 3.99Å
83	E	89.4	Confident	88.1	Confident	143 Å²	143	53.6 Å²	53.6	67%	0.668	26%	0.262	S	S	*	.	H	α-helix	trans	-59.5	-52.3	-179.6	-62.7	179.5	151.8	0	0	111.1	D81 L85 S86 E87	D81-E83 PolarHBondContact O-N 2.89Å; E83-L85 VanDerWaalsContact C-N 3.28Å; E83-L85 PolarHBondContact O-N 3.07Å; E83-S86 PolarHBondContact O-N 2.69Å; E83-S86 VanDerWaalsContact O-N 3.15Å; E83-E87 WeakPolarHBondContact O-CG 3.07Å; E83-E87 PolarHBondContact O-N 2.86Å
84	K	89.5	Confident	87.9	Confident	96 Å²	96	62 Å²	62	42%	0.417	30%	0.299	S	S	.	.	H	α-helix	trans	-57.4	-40.7	179.6	-51.9	170	-162.8	149.9	0	111.9	T80 D81 F88	T80-K84 WeakPolarHBondContact O-CE 3.5Å; T80-K84 PolarHBondContact O-NZ 3.43Å; D81-K84 PolarHBondContact O-N 3.16Å; D81-K84 IonicContact OD1-NZ 3.38Å; D81-K84 PolarHBondContact OD1-NZ 2.87Å; K84-F88 VanDerWaalsContact O-CB 3.25Å; K84-F88 WeakPolarHBondContact O-CB 3.45Å; K84-F88 PolarHBondContact O-N 2.77Å; K84-F88 VanDerWaalsContact O-N 3.08Å
85	L	88.6	Confident	87.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-73.2	-42	178.6	-74.7	162.7	0	0	0	111.3	L5 F7 F25 W53 I62 F77 D81 F82 E83 F88 F89 L97	L5-L85 HydrophobicContact CD1-CD2 4.08Å; F7-L85 HydrophobicContact CE2-CD2 4.04Å; F7-L85 HydrophobicContact CZ-CD1 4.25Å; F7-L85 HydrophobicContact CZ-CD2 4.1Å; F7-L85 HydrophobicContact CZ-CG 4.28Å; F25-L85 HydrophobicContact CD2-CD2 4.07Å; F25-L85 HydrophobicContact CE2-CD2 3.77Å; F25-L85 HydrophobicContact CZ-CD2 4.18Å; W53-L85 HydrophobicContact CH2-CD1 4.33Å; W53-L85 HydrophobicContact CZ3-CD1 3.76Å; I62-L85 HydrophobicContact CD1-CD1 3.66Å; I62-L85 HydrophobicContact CD1-CD2 4.17Å; I62-L85 HydrophobicContact CD1-CG 4.49Å; F77-L85 HydrophobicContact CD1-CD1 3.98Å; F77-L85 HydrophobicContact CE1-CD1 4.25Å; D81-L85 HydrophobicContact CB-CD1 4.09Å; D81-L85 WeakPolarHBondContact O-CB 3.37Å; D81-L85 WeakPolarHBondContact O-CD1 3.38Å; D81-L85 VanDerWaalsContact O-CG 3.27Å; D81-L85 WeakPolarHBondContact O-CG 3.4Å; D81-L85 PolarHBondContact O-N 2.92Å; F82-L85 PolarHBondContact O-N 2.82Å; E83-L85 VanDerWaalsContact C-N 3.28Å; E83-L85 PolarHBondContact O-N 3.07Å; L85-F88 PolarHBondContact O-N 2.85Å; L85-F89 HydrophobicContact CD2-CE2 4.21Å; L85-F89 VanDerWaalsContact O-CB 3.31Å; L85-F89 WeakPolarHBondContact O-CB 3.42Å; L85-F89 WeakPolarHBondContact O-CD2 3.11Å; L85-F89 PolarHBondContact O-N 3.08Å; L85-L97 HydrophobicContact CB-CD2 4.01Å
86	S	88.8	Confident	87.4	Confident	20 Å²	20	68.7 Å²	68.7	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-46.6	176.9	-168	0	0	0	0	111.2	F82 E83 F89 K90	F82-S86 VanDerWaalsContact O-CB 3.25Å; F82-S86 WeakPolarHBondContact O-CB 3.35Å; F82-S86 PolarHBondContact O-N 3.38Å; E83-S86 PolarHBondContact O-N 2.69Å; E83-S86 VanDerWaalsContact O-N 3.15Å; S86-F89 PolarHBondContact O-N 3.21Å; S86-K90 WeakPolarHBondContact O-CB 3.35Å; S86-K90 VanDerWaalsContact O-CG 3.29Å; S86-K90 WeakPolarHBondContact O-CG 3.31Å; S86-K90 PolarHBondContact O-N 2.9Å
87	E	88.9	Confident	87.4	Confident	103 Å²	103	68 Å²	68	48%	0.481	32%	0.322	S	S	.	.	H	α-helix	trans	-58.1	-49	171.7	-70.2	-175.7	138.5	0	0	111.9	M1 E83 F89 K90 L91	M1-E87 VanDerWaalsContact CE-CD 3.49Å; M1-E87 WeakPolarHBondContact CE-OE1 3.2Å; M1-E87 WeakPolarHBondContact CE-OE2 3.49Å; E83-E87 WeakPolarHBondContact O-CG 3.07Å; E83-E87 PolarHBondContact O-N 2.86Å; E87-F89 PolarHBondContact O-N 2.84Å; E87-K90 PolarHBondContact O-N 3.06Å; E87-L91 VanDerWaalsContact O-CB 3.23Å; E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 3.29Å
88	F	88.1	Confident	87.3	Confident	11 Å²	11	70 Å²	70	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-38.9	-178.4	-170.3	-81.4	0	0	0	112.7	L5 F25 K84 L85 N92 Y93	L5-F88 HydrophobicContact CD1-CB 3.76Å; L5-F88 HydrophobicContact CD1-CD1 4.48Å; L5-F88 HydrophobicContact CD1-CD2 3.77Å; L5-F88 HydrophobicContact CD1-CE2 4.5Å; L5-F88 HydrophobicContact CD1-CG 3.75Å; L5-F88 HydrophobicContact CG-CD2 3.75Å; L5-F88 HydrophobicContact CG-CE2 4.08Å; L5-F88 HydrophobicContact CG-CG 4.23Å; F25-F88 HydrophobicContact CB-CD1 4.23Å; F25-F88 HydrophobicContact CB-CE1 3.67Å; F25-F88 HydrophobicContact CB-CZ 4.1Å; K84-F88 VanDerWaalsContact O-CB 3.25Å; K84-F88 WeakPolarHBondContact O-CB 3.45Å; K84-F88 PolarHBondContact O-N 2.77Å; K84-F88 VanDerWaalsContact O-N 3.08Å; L85-F88 PolarHBondContact O-N 2.85Å; F88-N92 HydrophobicContact CD1-CB 4.5Å; F88-N92 WeakPolarHBondContact CD2-ND2 3.43Å; F88-N92 HydrophobicContact CE1-CB 4.26Å; F88-N92 WeakPolarHBondContact CG-ND2 3.33Å; F88-N92 WeakPolarHBondContact O-CB 3.05Å; F88-N92 PolarHBondContact O-N 2.9Å; F88-N92 PolarHBondContact O-ND2 2.68Å; F88-Y93 HydrophobicContact CD1-CE2 4.17Å; F88-Y93 HydrophobicContact CE1-CE2 4.02Å; F88-Y93 AromaticContact CE1-CZ 3.82Å
89	F	88.6	Confident	87.2	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.335	C	S	.	.	I	π-helix	trans	-70.5	-44.9	178.8	-89	-122.1	0	0	0	111.6	F25 L48 A51 L64 L85 S86 E87 L91 Y93 K94 V95	F25-F89 AromaticContact CD1-CE2 3.76Å; F25-F89 HydrophobicContact CD1-CE2 3.76Å; F25-F89 HydrophobicContact CD1-CZ 4.02Å; F25-F89 AromaticContact CE1-CE2 3.69Å; F25-F89 HydrophobicContact CE1-CE2 3.69Å; F25-F89 AromaticContact CE1-CZ 3.63Å; F25-F89 HydrophobicContact CE1-CZ 3.63Å; F25-F89 HydrophobicContact CZ-CE2 4.35Å; F25-F89 HydrophobicContact CZ-CZ 4.43Å; L48-F89 HydrophobicContact CD1-CE1 4.1Å; L48-F89 HydrophobicContact CD2-CE1 4.39Å; A51-F89 HydrophobicContact CB-CD1 3.81Å; A51-F89 HydrophobicContact CB-CE1 3.72Å; L64-F89 HydrophobicContact CD2-CE1 3.61Å; L64-F89 HydrophobicContact CD2-CZ 3.81Å; L85-F89 HydrophobicContact CD2-CE2 4.21Å; L85-F89 VanDerWaalsContact O-CB 3.31Å; L85-F89 WeakPolarHBondContact O-CB 3.42Å; L85-F89 WeakPolarHBondContact O-CD2 3.11Å; L85-F89 PolarHBondContact O-N 3.08Å; S86-F89 PolarHBondContact O-N 3.21Å; E87-F89 PolarHBondContact O-N 2.84Å; F89-L91 VanDerWaalsContact C-N 3.35Å; F89-L91 PolarHBondContact O-N 3.23Å; F89-Y93 HydrophobicContact CB-CD2 4.41Å; F89-Y93 AromaticContact CD1-CD2 3.87Å; F89-Y93 HydrophobicContact CD1-CD2 3.87Å; F89-Y93 AromaticContact CD2-CD2 3.93Å; F89-Y93 HydrophobicContact CD2-CD2 3.93Å; F89-Y93 HydrophobicContact CD2-CE2 4.05Å; F89-Y93 HydrophobicContact CE1-CD2 4.04Å; F89-Y93 HydrophobicContact CE1-CE2 4.41Å; F89-Y93 HydrophobicContact CE2-CD2 4.11Å; F89-Y93 AromaticContact CE2-CE2 3.89Å; F89-Y93 HydrophobicContact CE2-CE2 3.89Å; F89-Y93 AromaticContact CG-CD2 3.81Å; F89-Y93 HydrophobicContact CG-CD2 3.81Å; F89-Y93 HydrophobicContact CG-CE2 4.4Å; F89-Y93 HydrophobicContact CZ-CD2 4.16Å; F89-Y93 HydrophobicContact CZ-CE2 4.08Å; F89-Y93 CarbonylContact O-C 3.59Å; F89-Y93 WeakPolarHBondContact O-CA 3.34Å; F89-Y93 WeakPolarHBondContact O-CB 3.46Å; F89-Y93 PolarHBondContact O-N 3.33Å; F89-K94 PolarHBondContact O-N 2.78Å; F89-V95 CarbonylContact C-O 3.47Å
90	K	87.5	Confident	87	Confident	101 Å²	101	66.1 Å²	66.1	44%	0.439	32%	0.32	S	S	.	.	I	π-helix	trans	-62.2	-41.9	175.3	-69.4	-176.4	-169.7	-147.3	0	111.7	S86 E87 E96	S86-K90 WeakPolarHBondContact O-CB 3.35Å; S86-K90 VanDerWaalsContact O-CG 3.29Å; S86-K90 WeakPolarHBondContact O-CG 3.31Å; S86-K90 PolarHBondContact O-N 2.9Å; E87-K90 PolarHBondContact O-N 3.06Å; K90-E96 VanDerWaalsContact CE-OE1 3.25Å; K90-E96 WeakPolarHBondContact CE-OE1 3.32Å; K90-E96 IonicContact NZ-OE1 3.16Å; K90-E96 PolarHBondContact NZ-OE1 3.29Å
91	L	85.7	Confident	86.6	Confident	122 Å²	122	66.4 Å²	66.4	64%	0.639	32%	0.319	S	S	*	.	I	π-helix	trans	-76.1	-41.1	-176.3	-169.3	149.4	0	0	0	113.6	E87 F89	E87-L91 VanDerWaalsContact O-CB 3.23Å; E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 3.29Å; F89-L91 VanDerWaalsContact C-N 3.35Å; F89-L91 PolarHBondContact O-N 3.23Å
92	N	84.5	Confident	86.3	Confident	37 Å²	37	68 Å²	68	20%	0.198	33%	0.326	C	S	.	.	I	π-helix	trans	-100.5	-39.3	-174.4	-60.8	-75.5	0	0	0	114.1	K27 F88	K27-N92 WeakPolarHBondContact CG-OD1 3.41Å; F88-N92 HydrophobicContact CD1-CB 4.5Å; F88-N92 WeakPolarHBondContact CD2-ND2 3.43Å; F88-N92 HydrophobicContact CE1-CB 4.26Å; F88-N92 WeakPolarHBondContact CG-ND2 3.33Å; F88-N92 WeakPolarHBondContact O-CB 3.05Å; F88-N92 PolarHBondContact O-N 2.9Å; F88-N92 PolarHBondContact O-ND2 2.68Å
93	Y	83.4	Confident	86.1	Confident	17 Å²	17	66.1 Å²	66.1	7%	0.067	32%	0.32	C	S	.	.	I	π-helix	trans	-102.1	-16.5	-173.1	-54.4	-35	0	0	0	113.2	F25 S26 V30 A45 L48 F88 F89 V95	F25-Y93 HydrophobicContact CD1-CE2 4.19Å; S26-Y93 PolarHBondContact N-OH 3.23Å; S26-Y93 WeakPolarHBondContact O-CE1 3.36Å; S26-Y93 PolarHBondContact O-OH 2.97Å; V30-Y93 HydrophobicContact CG2-CE2 4.11Å; A45-Y93 HydrophobicContact CB-CD1 3.63Å; A45-Y93 HydrophobicContact CB-CE1 3.76Å; L48-Y93 HydrophobicContact CD1-CD2 4.02Å; L48-Y93 HydrophobicContact CD1-CE2 4.27Å; L48-Y93 HydrophobicContact CD1-CG 4.47Å; F88-Y93 HydrophobicContact CD1-CE2 4.17Å; F88-Y93 HydrophobicContact CE1-CE2 4.02Å; F88-Y93 AromaticContact CE1-CZ 3.82Å; F89-Y93 HydrophobicContact CB-CD2 4.41Å; F89-Y93 AromaticContact CD1-CD2 3.87Å; F89-Y93 HydrophobicContact CD1-CD2 3.87Å; F89-Y93 AromaticContact CD2-CD2 3.93Å; F89-Y93 HydrophobicContact CD2-CD2 3.93Å; F89-Y93 HydrophobicContact CD2-CE2 4.05Å; F89-Y93 HydrophobicContact CE1-CD2 4.04Å; F89-Y93 HydrophobicContact CE1-CE2 4.41Å; F89-Y93 HydrophobicContact CE2-CD2 4.11Å; F89-Y93 AromaticContact CE2-CE2 3.89Å; F89-Y93 HydrophobicContact CE2-CE2 3.89Å; F89-Y93 AromaticContact CG-CD2 3.81Å; F89-Y93 HydrophobicContact CG-CD2 3.81Å; F89-Y93 HydrophobicContact CG-CE2 4.4Å; F89-Y93 HydrophobicContact CZ-CD2 4.16Å; F89-Y93 HydrophobicContact CZ-CE2 4.08Å; F89-Y93 CarbonylContact O-C 3.59Å; F89-Y93 WeakPolarHBondContact O-CA 3.34Å; F89-Y93 WeakPolarHBondContact O-CB 3.46Å; F89-Y93 PolarHBondContact O-N 3.33Å; Y93-V95 PolarHBondContact O-N 3.26Å
94	K	84.3	Confident	85.8	Confident	189 Å²	189	66.1 Å²	66.1	82%	0.822	33%	0.329	S	S	*	.			trans	59.4	22.1	-173	-51.7	-179.6	-178.4	179.6	0	113.8	F89	F89-K94 PolarHBondContact O-N 2.78Å
95	V	84.8	Confident	85.5	Confident	18 Å²	18	66.7 Å²	66.7	11%	0.109	33%	0.332	C	S	.	.			trans	-104.5	135.9	175.5	-179.2	0	0	0	0	108.3	L48 A51 F89 Y93	L48-V95 HydrophobicContact CD2-CB 4.38Å; L48-V95 HydrophobicContact CD2-CG1 4.23Å; L48-V95 HydrophobicContact CD2-CG2 4.04Å; L48-V95 VanDerWaalsContact O-CG2 3.29Å; L48-V95 WeakPolarHBondContact O-CG2 3.33Å; A51-V95 HydrophobicContact CB-CG1 3.76Å; F89-V95 CarbonylContact C-O 3.47Å; Y93-V95 PolarHBondContact O-N 3.26Å
96	E	86.1	Confident	85.2	Confident	127 Å²	127	69.7 Å²	69.7	59%	0.593	36%	0.363	S	S	*	.			trans	-84.4	131.1	172.5	-59.8	-149.4	116.2	0	0	110.7	K90 S98	K90-E96 VanDerWaalsContact CE-OE1 3.25Å; K90-E96 WeakPolarHBondContact CE-OE1 3.32Å; K90-E96 IonicContact NZ-OE1 3.16Å; K90-E96 PolarHBondContact NZ-OE1 3.29Å; E96-S98 PolarHBondContact O-N 3.22Å
97	L	88	Confident	85.1	Confident	10 Å²	10	73.2 Å²	73.2	5%	0.052	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	92.6	175.3	-177.9	61.4	0	0	0	109.2	A51 W53 I62 F82 L85	A51-L97 HydrophobicContact CB-CD1 3.95Å; W53-L97 HydrophobicContact CB-CD1 4.11Å; W53-L97 HydrophobicContact CB-CD2 4.45Å; W53-L97 HydrophobicContact CB-CG 4.06Å; W53-L97 HydrophobicContact CE3-CD2 4.12Å; I62-L97 HydrophobicContact CG2-CD1 4.4Å; F82-L97 HydrophobicContact CD2-CD2 3.73Å; F82-L97 HydrophobicContact CD2-CG 4.36Å; F82-L97 HydrophobicContact CE2-CD2 3.83Å; F82-L97 HydrophobicContact CE2-CG 3.99Å; L85-L97 HydrophobicContact CB-CD2 4.01Å
98	S	87.6	Confident	84.9	Confident	45 Å²	45	75.2 Å²	75.2	32%	0.315	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123	-177.4	59.3	0	0	0	0	111.7	A51 Q52 W53 E96	A51-S98 PolarHBondContact O-N 2.86Å; A51-S98 PolarHBondContact O-OG 2.85Å; Q52-S98 CarbonylContact C-O 3.55Å; Q52-S98 VanDerWaalsContact CA-O 3.29Å; Q52-S98 WeakPolarHBondContact CA-O 3.32Å; Q52-S98 VanDerWaalsContact CG-OG 3.29Å; Q52-S98 WeakPolarHBondContact CG-OG 3.11Å; W53-S98 PolarHBondContact N-O 2.86Å; E96-S98 PolarHBondContact O-N 3.22Å
99	E	86.4	Confident	84.8	Confident	130 Å²	130	82.2 Å²	82.2	61%	0.607	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	120.4	171.3	-175.1	162.2	-130.4	0	0	109.6
100	K	82.9	Confident	84.8	Confident	60 Å²	60	84.2 Å²	84.2	26%	0.261	43%	0.434	S	S	.	.			trans	-134.5	111.3	173.6	-166.9	-179.2	-173.6	-174.2	0	110.9	W53 D125 T127	W53-K100 PolarHBondContact O-N 3.33Å; K100-D125 WeakPolarHBondContact CE-O 3.5Å; K100-D125 PolarHBondContact NZ-O 3.35Å; K100-T127 PolarHBondContact NZ-OG1 3.14Å
101	D	80.3	Confident	84.8	Confident	95 Å²	95	83 Å²	83	51%	0.508	44%	0.435	S	S	.	.			trans	-69.1	142.8	172.2	-103.6	-30.5	0	0	0	112.3
102	M	81.3	Confident	84.9	Confident	51 Å²	51	79 Å²	79	25%	0.251	42%	0.42	S	S	.	.			trans	-82.2	148.7	175.4	-62	-63.7	-65.3	0	0	110.7	V104 T127 A128	M102-V104 PolarHBondContact O-N 3.47Å; M102-T127 CarbonylContact C-O 3.59Å; M102-T127 WeakPolarHBondContact CA-O 3.36Å; M102-T127 HydrophobicContact CE-CG2 4.41Å; M102-T127 VanDerWaalsContact CE-O 3.29Å; M102-T127 WeakPolarHBondContact CE-O 3.25Å; M102-A128 VanDerWaalsContact CE-O 3.32Å; M102-A128 WeakPolarHBondContact CE-O 3.47Å
103	S	82.9	Confident	85	Confident	14 Å²	14	81 Å²	81	10%	0.098	43%	0.426	C	S	.	.			trans	-75.5	86.9	-177.2	-161	0	0	0	0	112.8	K105 T127	S103-K105 PolarHBondContact O-N 3.36Å; S103-K105 VanDerWaalsContact O-N 3.11Å; S103-T127 PolarHBondContact N-O 3.41Å
104	V	83	Confident	85	Confident	143 Å²	143	82.8 Å²	82.8	87%	0.867	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	7.5	179.1	-61.4	0	0	0	0	115.1	M102 G106	M102-V104 PolarHBondContact O-N 3.47Å; V104-G106 VanDerWaalsContact C-N 3.27Å; V104-G106 PolarHBondContact O-N 3.03Å
105	K	83.4	Confident	84.6	Confident	108 Å²	108	77.3 Å²	77.3	47%	0.47	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.9	-173.3	-68.4	179.6	179.3	172.3	0	114.8	S103 W107	S103-K105 PolarHBondContact O-N 3.36Å; S103-K105 VanDerWaalsContact O-N 3.11Å; K105-W107 HydrophobicContact CB-CD2 4.19Å; K105-W107 HydrophobicContact CB-CG 4.03Å; K105-W107 HydrophobicContact CD-CD2 4.26Å; K105-W107 HydrophobicContact CD-CE3 4.28Å; K105-W107 HydrophobicContact CD-CH2 4.4Å; K105-W107 HydrophobicContact CD-CZ2 4.36Å; K105-W107 HydrophobicContact CD-CZ3 4.36Å; K105-W107 VanDerWaalsContact O-CD1 3.26Å; K105-W107 PolarHBondContact O-N 2.95Å
106	G	82.2	Confident	84.1	Confident	63 Å²	63	78.8 Å²	78.8	65%	0.649	44%	0.439	S	S	*	.			trans	65.5	17.7	-177.2	0	0	0	0	0	114.6	V104	V104-G106 VanDerWaalsContact C-N 3.27Å; V104-G106 PolarHBondContact O-N 3.03Å
107	W	87.3	Confident	83.7	Confident	93 Å²	93	75 Å²	75	35%	0.352	43%	0.425	S	S	.	.			trans	-78.2	144.5	175.3	-64.4	-1	0	0	0	109.8	K105 W109 I123	K105-W107 HydrophobicContact CB-CD2 4.19Å; K105-W107 HydrophobicContact CB-CG 4.03Å; K105-W107 HydrophobicContact CD-CD2 4.26Å; K105-W107 HydrophobicContact CD-CE3 4.28Å; K105-W107 HydrophobicContact CD-CH2 4.4Å; K105-W107 HydrophobicContact CD-CZ2 4.36Å; K105-W107 HydrophobicContact CD-CZ3 4.36Å; K105-W107 VanDerWaalsContact O-CD1 3.26Å; K105-W107 PolarHBondContact O-N 2.95Å; W107-W109 HydrophobicContact CB-CD2 4.11Å; W107-W109 HydrophobicContact CB-CE3 4.18Å; W107-W109 HydrophobicContact CB-CH2 3.92Å; W107-W109 HydrophobicContact CB-CZ2 3.85Å; W107-W109 HydrophobicContact CB-CZ3 4.08Å; W107-W109 AromaticContact CD1-CH2 3.68Å; W107-W109 AromaticContact CD1-CZ2 3.9Å; W107-W109 AromaticContact CD2-CE2 3.81Å; W107-W109 AromaticContact CD2-CH2 3.89Å; W107-W109 HydrophobicContact CD2-CH2 3.89Å; W107-W109 AromaticContact CD2-CZ2 3.26Å; W107-W109 HydrophobicContact CD2-CZ2 3.26Å; W107-W109 AromaticContact CE2-CZ2 3.72Å; W107-W109 AromaticContact CE3-CE2 3.7Å; W107-W109 AromaticContact CE3-CZ2 3.56Å; W107-W109 HydrophobicContact CE3-CZ2 3.56Å; W107-W109 AromaticContact CE3-NE1 3.56Å; W107-W109 AromaticContact CG-CE2 3.94Å; W107-W109 AromaticContact CG-CH2 3.56Å; W107-W109 HydrophobicContact CG-CH2 3.56Å; W107-W109 AromaticContact CG-CZ2 3.41Å; W107-W109 HydrophobicContact CG-CZ2 3.41Å; W107-W109 VanDerWaalsContact CG-CZ2 3.41Å; W107-W109 HydrophobicContact CG-CZ3 4.21Å; W107-W109 HydrophobicContact CZ2-CZ2 4.36Å; W107-W109 HydrophobicContact CZ3-CZ2 4.21Å; W107-I123 HydrophobicContact CB-CD1 4.22Å; W107-I123 HydrophobicContact CB-CG2 4.13Å; W107-I123 HydrophobicContact CD2-CG2 4.49Å; W107-I123 HydrophobicContact CE3-CG2 3.78Å; W107-I123 WeakPolarHBondContact O-CD1 3.29Å
108	N	85.7	Confident	83.4	Confident	145 Å²	145	75 Å²	75	78%	0.775	43%	0.425	S	S	*	.			trans	-111.2	9	-177.1	-62.5	-50.3	0	0	0	113
109	W	85.9	Confident	83.4	Confident	158 Å²	158	72.8 Å²	72.8	60%	0.598	41%	0.41	S	S	*	.			trans	-109.4	139.4	172.4	58.8	91.7	0	0	0	109.4	W107	W107-W109 HydrophobicContact CB-CD2 4.11Å; W107-W109 HydrophobicContact CB-CE3 4.18Å; W107-W109 HydrophobicContact CB-CH2 3.92Å; W107-W109 HydrophobicContact CB-CZ2 3.85Å; W107-W109 HydrophobicContact CB-CZ3 4.08Å; W107-W109 AromaticContact CD1-CH2 3.68Å; W107-W109 AromaticContact CD1-CZ2 3.9Å; W107-W109 AromaticContact CD2-CE2 3.81Å; W107-W109 AromaticContact CD2-CH2 3.89Å; W107-W109 HydrophobicContact CD2-CH2 3.89Å; W107-W109 AromaticContact CD2-CZ2 3.26Å; W107-W109 HydrophobicContact CD2-CZ2 3.26Å; W107-W109 AromaticContact CE2-CZ2 3.72Å; W107-W109 AromaticContact CE3-CE2 3.7Å; W107-W109 AromaticContact CE3-CZ2 3.56Å; W107-W109 HydrophobicContact CE3-CZ2 3.56Å; W107-W109 AromaticContact CE3-NE1 3.56Å; W107-W109 AromaticContact CG-CE2 3.94Å; W107-W109 AromaticContact CG-CH2 3.56Å; W107-W109 HydrophobicContact CG-CH2 3.56Å; W107-W109 AromaticContact CG-CZ2 3.41Å; W107-W109 HydrophobicContact CG-CZ2 3.41Å; W107-W109 VanDerWaalsContact CG-CZ2 3.41Å; W107-W109 HydrophobicContact CG-CZ3 4.21Å; W107-W109 HydrophobicContact CZ2-CZ2 4.36Å; W107-W109 HydrophobicContact CZ3-CZ2 4.21Å
110	G	88.4	Confident	83.5	Confident	42 Å²	42	67 Å²	67	43%	0.433	38%	0.384	S	S	.	.			trans	174.9	-174.8	-171.1	0	0	0	0	0	111	D122	G110-D122 CarbonylContact C-O 3.39Å; G110-D122 WeakPolarHBondContact CA-O 3.24Å
111	T	87.3	Confident	83.8	Confident	76 Å²	76	65.1 Å²	65.1	47%	0.466	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130	177.7	54.7	0	0	0	0	110.4	K113 D122	T111-K113 VanDerWaalsContact OG1-CE 3.31Å; T111-K113 WeakPolarHBondContact OG1-CE 3.31Å; T111-D122 PolarHBondContact N-O 3.32Å; T111-D122 PolarHBondContact O-N 3.32Å
112	A	87.5	Confident	84.3	Confident	39 Å²	39	61.2 Å²	61.2	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.5	174.7	0	0	0	0	0	109.3	L119 S120 F121 F182	A112-L119 HydrophobicContact CB-CD1 4.04Å; A112-S120 CarbonylContact C-O 3.55Å; A112-S120 WeakPolarHBondContact CA-O 3.13Å; A112-F121 HydrophobicContact CB-CD2 4.27Å; A112-F182 HydrophobicContact CB-CE2 3.74Å; A112-F182 HydrophobicContact CB-CZ 4.36Å
113	K	86.9	Confident	84.6	Confident	78 Å²	78	58.9 Å²	58.9	34%	0.339	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.5	-176.4	-60.2	177.6	-169.8	165.6	0	110	T111 S120 D122 D125	T111-K113 VanDerWaalsContact OG1-CE 3.31Å; T111-K113 WeakPolarHBondContact OG1-CE 3.31Å; K113-S120 PolarHBondContact N-O 3.05Å; K113-S120 PolarHBondContact O-N 3.01Å; K113-S120 PolarHBondContact O-OG 2.94Å; K113-D122 WeakPolarHBondContact CD-OD2 3.4Å; K113-D122 VanDerWaalsContact CE-OD2 3.32Å; K113-D122 WeakPolarHBondContact CE-OD2 2.97Å; K113-D122 IonicContact NZ-OD2 2.75Å; K113-D122 PolarHBondContact NZ-OD2 3.12Å; K113-D125 IonicContact NZ-OD1 2.9Å
114	F	82.9	Confident	84.5	Confident	55 Å²	55	63.3 Å²	63.3	24%	0.241	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	102.6	178.6	-69.1	-87	0	0	0	110.5	L118 L119 L133 F182 N185 V186	F114-L118 CarbonylContact C-O 3.58Å; F114-L118 WeakPolarHBondContact CA-O 3.15Å; F114-L119 HydrophobicContact CD1-CD1 4.29Å; F114-L119 HydrophobicContact CE1-CD1 3.99Å; F114-L119 HydrophobicContact CE2-CD1 4.42Å; F114-L119 HydrophobicContact CZ-CD1 4.07Å; F114-L133 HydrophobicContact CD1-CD1 4.18Å; F114-L133 HydrophobicContact CE1-CD1 4.39Å; F114-F182 AromaticContact CE2-CD2 3.66Å; F114-F182 HydrophobicContact CE2-CD2 3.66Å; F114-F182 AromaticContact CE2-CE2 3.66Å; F114-F182 HydrophobicContact CE2-CE2 3.66Å; F114-F182 HydrophobicContact CE2-CG 4.29Å; F114-F182 HydrophobicContact CE2-CZ 4.3Å; F114-F182 HydrophobicContact CZ-CD1 4.18Å; F114-F182 AromaticContact CZ-CD2 3.75Å; F114-F182 HydrophobicContact CZ-CD2 3.75Å; F114-F182 HydrophobicContact CZ-CE1 4.06Å; F114-F182 AromaticContact CZ-CE2 3.59Å; F114-F182 HydrophobicContact CZ-CE2 3.59Å; F114-F182 HydrophobicContact CZ-CG 4.05Å; F114-F182 AromaticContact CZ-CZ 3.77Å; F114-F182 HydrophobicContact CZ-CZ 3.77Å; F114-N185 HydrophobicContact CD1-CB 4.41Å; F114-N185 HydrophobicContact CD2-CB 4.38Å; F114-N185 HydrophobicContact CE1-CB 4.05Å; F114-N185 HydrophobicContact CE2-CB 4.03Å; F114-N185 HydrophobicContact CZ-CB 3.84Å; F114-V186 HydrophobicContact CE1-CG2 3.83Å; F114-V186 HydrophobicContact CZ-CG2 4.01Å
115	S	76.4	Confident	84.4	Confident	74 Å²	74	62 Å²	62	52%	0.517	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	92.1	177.7	-62.4	0	0	0	0	109.8	L118	S115-L118 PolarHBondContact N-O 3.47Å; S115-L118 PolarHBondContact O-N 2.91Å; S115-L118 VanDerWaalsContact O-N 3.12Å
116	G	74.8	Confident	84.3	Confident	48 Å²	48	60.2 Å²	60.2	50%	0.495	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	-127.7	-173.3	0	0	0	0	0	110.8	L118	G116-L118 PolarHBondContact O-N 3.01Å
117	P	77.4	Confident	84.5	Confident	47 Å²	47	57.5 Å²	57.5	31%	0.305	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	21.4	177.1	36.6	-35.3	0	0	0	113.9	G69 L133	G69-P117 WeakPolarHBondContact O-CG 3.32Å; P117-L133 WeakPolarHBondContact O-CB 3.19Å; P117-L133 WeakPolarHBondContact O-CG 3.48Å; P117-L133 PolarHBondContact O-N 3.1Å
118	L	81.4	Confident	84.4	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.052	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.8	175.3	-65	94.8	0	0	0	112.4	I71 F114 S115 G116 I131 P132	I71-L118 HydrophobicContact CB-CD1 4.3Å; I71-L118 HydrophobicContact CB-CD2 4.35Å; I71-L118 HydrophobicContact CD1-CD1 3.48Å; I71-L118 VanDerWaalsContact CD1-CD1 3.48Å; I71-L118 HydrophobicContact CD1-CD2 3.87Å; I71-L118 HydrophobicContact CD1-CG 4.32Å; I71-L118 HydrophobicContact CG1-CD1 3.67Å; I71-L118 HydrophobicContact CG1-CD2 4.37Å; F114-L118 CarbonylContact C-O 3.58Å; F114-L118 WeakPolarHBondContact CA-O 3.15Å; S115-L118 PolarHBondContact N-O 3.47Å; S115-L118 PolarHBondContact O-N 2.91Å; S115-L118 VanDerWaalsContact O-N 3.12Å; G116-L118 PolarHBondContact O-N 3.01Å; L118-I131 WeakPolarHBondContact CA-O 3.4Å; L118-P132 HydrophobicContact CD2-CG 4.27Å
119	L	87.8	Confident	84.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111	167.5	173	61.9	0	0	0	108.6	A112 F114 I131 L133 L148 F165 F182	A112-L119 HydrophobicContact CB-CD1 4.04Å; F114-L119 HydrophobicContact CD1-CD1 4.29Å; F114-L119 HydrophobicContact CE1-CD1 3.99Å; F114-L119 HydrophobicContact CE2-CD1 4.42Å; F114-L119 HydrophobicContact CZ-CD1 4.07Å; L119-I131 HydrophobicContact CB-CB 4.4Å; L119-I131 PolarHBondContact N-O 3.33Å; L119-I131 PolarHBondContact O-N 3Å; L119-L133 HydrophobicContact CB-CD2 3.93Å; L119-L148 HydrophobicContact CD2-CD2 3.79Å; L119-F165 HydrophobicContact CD2-CE2 3.71Å; L119-F165 HydrophobicContact CD2-CZ 3.82Å; L119-F165 HydrophobicContact CG-CZ 4.49Å; L119-F182 HydrophobicContact CD1-CE2 4.2Å; L119-F182 HydrophobicContact CD1-CZ 3.91Å; L119-F182 HydrophobicContact CD2-CE1 4.5Å; L119-F182 HydrophobicContact CD2-CZ 3.95Å
120	S	88.1	Confident	84.4	Confident	8 Å²	8	45.2 Å²	45.2	6%	0.056	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144	173	53.8	0	0	0	0	110.5	A112 K113	A112-S120 CarbonylContact C-O 3.55Å; A112-S120 WeakPolarHBondContact CA-O 3.13Å; K113-S120 PolarHBondContact N-O 3.05Å; K113-S120 PolarHBondContact O-N 3.01Å; K113-S120 PolarHBondContact O-OG 2.94Å
121	F	89.9	Confident	84.3	Confident	21 Å²	21	43.9 Å²	43.9	9%	0.092	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	108.3	174.6	-169	-101.1	0	0	0	109.5	A112 I123 A128 F129 F165	A112-F121 HydrophobicContact CB-CD2 4.27Å; F121-I123 HydrophobicContact CD1-CD1 4.32Å; F121-I123 HydrophobicContact CD1-CG1 4.05Å; F121-I123 HydrophobicContact CE1-CD1 4.12Å; F121-I123 HydrophobicContact CE1-CG1 3.93Å; F121-A128 HydrophobicContact CD1-CB 4.25Å; F121-A128 PolarHBondContact O-N 2.94Å; F121-F129 HydrophobicContact CB-CD1 4.11Å; F121-F129 HydrophobicContact CB-CD2 4.27Å; F121-F129 HydrophobicContact CB-CE1 3.69Å; F121-F129 HydrophobicContact CB-CE2 3.87Å; F121-F129 HydrophobicContact CB-CG 4.39Å; F121-F129 HydrophobicContact CB-CZ 3.57Å; F121-F129 HydrophobicContact CD1-CD1 4.41Å; F121-F129 AromaticContact CD1-CE1 3.75Å; F121-F129 HydrophobicContact CD1-CE1 3.75Å; F121-F129 HydrophobicContact CD1-CZ 4.24Å; F121-F129 HydrophobicContact CD2-CZ 4.46Å; F121-F129 AromaticContact CG-CE1 3.83Å; F121-F129 HydrophobicContact CG-CE1 3.83Å; F121-F129 AromaticContact CG-CZ 3.86Å; F121-F129 HydrophobicContact CG-CZ 3.86Å; F121-F129 PolarHBondContact N-O 3.42Å; F121-F165 HydrophobicContact CD2-CD1 4.35Å; F121-F165 AromaticContact CD2-CE1 3.84Å; F121-F165 HydrophobicContact CD2-CE1 3.84Å; F121-F165 HydrophobicContact CE2-CD1 4.38Å; F121-F165 HydrophobicContact CE2-CE1 4.29Å
122	D	89.5	Confident	84.1	Confident	12 Å²	12	41.5 Å²	41.5	6%	0.064	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.5	-175.1	-78.2	-10.8	0	0	0	112	G110 T111 K113 T127	G110-D122 CarbonylContact C-O 3.39Å; G110-D122 WeakPolarHBondContact CA-O 3.24Å; T111-D122 PolarHBondContact N-O 3.32Å; T111-D122 PolarHBondContact O-N 3.32Å; K113-D122 WeakPolarHBondContact CD-OD2 3.4Å; K113-D122 VanDerWaalsContact CE-OD2 3.32Å; K113-D122 WeakPolarHBondContact CE-OD2 2.97Å; K113-D122 IonicContact NZ-OD2 2.75Å; K113-D122 PolarHBondContact NZ-OD2 3.12Å; D122-T127 WeakPolarHBondContact OD1-CA 3.43Å; D122-T127 VanDerWaalsContact OD1-CB 3.23Å; D122-T127 WeakPolarHBondContact OD1-CB 3.4Å; D122-T127 WeakPolarHBondContact OD1-CG2 3.2Å; D122-T127 PolarHBondContact OD1-OG1 3.33Å
123	I	87.8	Confident	83.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	103.6	178.6	-53.9	179.1	0	0	0	107.9	W107 F121 N126 A128	W107-I123 HydrophobicContact CB-CD1 4.22Å; W107-I123 HydrophobicContact CB-CG2 4.13Å; W107-I123 HydrophobicContact CD2-CG2 4.49Å; W107-I123 HydrophobicContact CE3-CG2 3.78Å; W107-I123 WeakPolarHBondContact O-CD1 3.29Å; F121-I123 HydrophobicContact CD1-CD1 4.32Å; F121-I123 HydrophobicContact CD1-CG1 4.05Å; F121-I123 HydrophobicContact CE1-CD1 4.12Å; F121-I123 HydrophobicContact CE1-CG1 3.93Å; I123-N126 PolarHBondContact N-O 3.02Å; I123-N126 PolarHBondContact O-N 2.99Å; I123-A128 HydrophobicContact CD1-CB 3.55Å; I123-A128 HydrophobicContact CG1-CB 3.92Å
124	N	81.4	Confident	83.2	Confident	107 Å²	107	38 Å²	38	57%	0.572	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	56.3	-171.8	-58.5	32	0	0	0	110.6	N126	N124-N126 PolarHBondContact O-N 3.21Å
125	D	80.1	Confident	82.9	Confident	116 Å²	116	36.8 Å²	36.8	62%	0.62	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	-13.4	179.8	-56.2	-57.9	0	0	0	117.6	K100 K113	K100-D125 WeakPolarHBondContact CE-O 3.5Å; K100-D125 PolarHBondContact NZ-O 3.35Å; K113-D125 IonicContact NZ-OD1 2.9Å
126	N	82.8	Confident	83.1	Confident	70 Å²	70	33.2 Å²	33.2	37%	0.374	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	127.3	166.5	-73.5	1.8	0	0	0	110.5	I123 N124 A128	I123-N126 PolarHBondContact N-O 3.02Å; I123-N126 PolarHBondContact O-N 2.99Å; N124-N126 PolarHBondContact O-N 3.21Å; N126-A128 PolarHBondContact O-N 3.02Å
127	T	85.1	Confident	83.2	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.043	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.7	-178.2	-50.8	0	0	0	0	109.5	K100 M102 S103 D122 E130	K100-T127 PolarHBondContact NZ-OG1 3.14Å; M102-T127 CarbonylContact C-O 3.59Å; M102-T127 WeakPolarHBondContact CA-O 3.36Å; M102-T127 HydrophobicContact CE-CG2 4.41Å; M102-T127 VanDerWaalsContact CE-O 3.29Å; M102-T127 WeakPolarHBondContact CE-O 3.25Å; S103-T127 PolarHBondContact N-O 3.41Å; D122-T127 WeakPolarHBondContact OD1-CA 3.43Å; D122-T127 VanDerWaalsContact OD1-CB 3.23Å; D122-T127 WeakPolarHBondContact OD1-CB 3.4Å; D122-T127 WeakPolarHBondContact OD1-CG2 3.2Å; D122-T127 PolarHBondContact OD1-OG1 3.33Å; T127-E130 HydrophobicContact CG2-CG 3.66Å
128	A	85.9	Confident	83.2	Confident	27 Å²	27	35.5 Å²	35.5	22%	0.223	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-42.2	-179.6	0	0	0	0	0	111.7	M102 F121 I123 N126	M102-A128 VanDerWaalsContact CE-O 3.32Å; M102-A128 WeakPolarHBondContact CE-O 3.47Å; F121-A128 HydrophobicContact CD1-CB 4.25Å; F121-A128 PolarHBondContact O-N 2.94Å; I123-A128 HydrophobicContact CD1-CB 3.55Å; I123-A128 HydrophobicContact CG1-CB 3.92Å; N126-A128 PolarHBondContact O-N 3.02Å
129	F	85.9	Confident	83.3	Confident	76 Å²	76	35.7 Å²	35.7	33%	0.333	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	163.1	174.1	62.2	-95.6	0	0	0	111.5	F121 I131 F165	F121-F129 HydrophobicContact CB-CD1 4.11Å; F121-F129 HydrophobicContact CB-CD2 4.27Å; F121-F129 HydrophobicContact CB-CE1 3.69Å; F121-F129 HydrophobicContact CB-CE2 3.87Å; F121-F129 HydrophobicContact CB-CG 4.39Å; F121-F129 HydrophobicContact CB-CZ 3.57Å; F121-F129 HydrophobicContact CD1-CD1 4.41Å; F121-F129 AromaticContact CD1-CE1 3.75Å; F121-F129 HydrophobicContact CD1-CE1 3.75Å; F121-F129 HydrophobicContact CD1-CZ 4.24Å; F121-F129 HydrophobicContact CD2-CZ 4.46Å; F121-F129 AromaticContact CG-CE1 3.83Å; F121-F129 HydrophobicContact CG-CE1 3.83Å; F121-F129 AromaticContact CG-CZ 3.86Å; F121-F129 HydrophobicContact CG-CZ 3.86Å; F121-F129 PolarHBondContact N-O 3.42Å; F129-I131 HydrophobicContact CD2-CD1 4.07Å; F129-I131 HydrophobicContact CD2-CG1 3.94Å; F129-I131 HydrophobicContact CE2-CD1 3.72Å; F129-I131 HydrophobicContact CE2-CG1 4.08Å; F129-F165 HydrophobicContact CE2-CE1 4.23Å; F129-F165 AromaticContact CE2-CZ 3.87Å; F129-F165 HydrophobicContact CE2-CZ 3.87Å; F129-F165 AromaticContact CZ-CE1 3.8Å; F129-F165 HydrophobicContact CZ-CE1 3.8Å; F129-F165 AromaticContact CZ-CZ 3.87Å; F129-F165 HydrophobicContact CZ-CZ 3.87Å
130	E	85.3	Confident	83.1	Confident	35 Å²	35	37.3 Å²	37.3	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.9	-179.2	-60.4	-173.4	145.2	0	0	110.9	K63 T127	K63-E130 WeakPolarHBondContact CD-OE2 3.47Å; K63-E130 WeakPolarHBondContact CE-OE2 3.36Å; K63-E130 IonicContact NZ-OE1 3.73Å; K63-E130 PolarHBondContact NZ-OE1 2.87Å; K63-E130 IonicContact NZ-OE2 2.91Å; K63-E130 PolarHBondContact NZ-OE2 3.03Å; T127-E130 HydrophobicContact CG2-CG 3.66Å
131	I	85.6	Confident	83	Confident	13 Å²	13	41.2 Å²	41.2	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.6	-178.9	-62.2	178.9	0	0	0	109	L118 L119 F129 L133 V136 F150 V163 F165	L118-I131 WeakPolarHBondContact CA-O 3.4Å; L119-I131 HydrophobicContact CB-CB 4.4Å; L119-I131 PolarHBondContact N-O 3.33Å; L119-I131 PolarHBondContact O-N 3Å; F129-I131 HydrophobicContact CD2-CD1 4.07Å; F129-I131 HydrophobicContact CD2-CG1 3.94Å; F129-I131 HydrophobicContact CE2-CD1 3.72Å; F129-I131 HydrophobicContact CE2-CG1 4.08Å; I131-L133 PolarHBondContact O-N 2.91Å; I131-V136 HydrophobicContact CG2-CG2 4.39Å; I131-F150 HydrophobicContact CD1-CZ 4.01Å; I131-F150 HydrophobicContact CG2-CE1 3.46Å; I131-F150 VanDerWaalsContact CG2-CE1 3.46Å; I131-F150 HydrophobicContact CG2-CZ 3.75Å; I131-V163 HydrophobicContact CD1-CG2 4.39Å; I131-F165 HydrophobicContact CD1-CZ 4.44Å
132	P	82.7	Confident	82.6	Confident	26 Å²	26	41.8 Å²	41.8	17%	0.169	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	126.6	165.1	-19.1	32	0	0	0	110.1	L118 S134 N135	L118-P132 HydrophobicContact CD2-CG 4.27Å; P132-S134 PolarHBondContact O-N 2.9Å; P132-N135 VanDerWaalsContact O-CB 3.29Å; P132-N135 WeakPolarHBondContact O-CB 3.43Å; P132-N135 PolarHBondContact O-N 3.07Å
133	L	81.5	Confident	82.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-69.4	-23.6	-176.6	-63.3	175.3	0	0	0	111.9	F114 P117 L119 I131 N135 V136 V186 K189 A190	F114-L133 HydrophobicContact CD1-CD1 4.18Å; F114-L133 HydrophobicContact CE1-CD1 4.39Å; P117-L133 WeakPolarHBondContact O-CB 3.19Å; P117-L133 WeakPolarHBondContact O-CG 3.48Å; P117-L133 PolarHBondContact O-N 3.1Å; L119-L133 HydrophobicContact CB-CD2 3.93Å; I131-L133 PolarHBondContact O-N 2.91Å; L133-N135 PolarHBondContact O-N 2.8Å; L133-V136 HydrophobicContact CD2-CG2 4.25Å; L133-V136 WeakPolarHBondContact O-CB 3.48Å; L133-V136 PolarHBondContact O-N 3.06Å; L133-V186 HydrophobicContact CD2-CG1 4.29Å; L133-V186 HydrophobicContact CD2-CG2 4.4Å; L133-K189 HydrophobicContact CB-CB 4.47Å; L133-K189 WeakPolarHBondContact CB-O 3.2Å; L133-K189 HydrophobicContact CD1-CB 3.58Å; L133-K189 HydrophobicContact CD1-CD 4.11Å; L133-A190 HydrophobicContact CB-CB 4.2Å; L133-A190 VanDerWaalsContact O-CA 3.25Å; L133-A190 WeakPolarHBondContact O-CA 3.37Å; L133-A190 VanDerWaalsContact O-CB 3.26Å; L133-A190 WeakPolarHBondContact O-CB 3.46Å
134	S	75.5	Confident	82.3	Confident	44 Å²	44	52.5 Å²	52.5	31%	0.308	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-60.6	-6.6	166.3	49.8	0	0	0	0	115	K15 P132 D191	K15-S134 VanDerWaalsContact CE-O 3.23Å; K15-S134 WeakPolarHBondContact CE-O 3.32Å; K15-S134 PolarHBondContact NZ-O 3.43Å; P132-S134 PolarHBondContact O-N 2.9Å; S134-D191 WeakPolarHBondContact CA-OD2 3.31Å; S134-D191 WeakPolarHBondContact CB-OD2 3.44Å
135	N	77	Confident	82.6	Confident	29 Å²	29	51.2 Å²	51.2	16%	0.155	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-93.7	-18.2	172	-59	-6.4	0	0	0	112.8	K15 P132 L133 F150 H151	K15-N135 WeakPolarHBondContact CE-OD1 3.22Å; K15-N135 WeakPolarHBondContact CG-OD1 3.37Å; P132-N135 VanDerWaalsContact O-CB 3.29Å; P132-N135 WeakPolarHBondContact O-CB 3.43Å; P132-N135 PolarHBondContact O-N 3.07Å; L133-N135 PolarHBondContact O-N 2.8Å; N135-F150 HydrophobicContact CB-CD1 4.03Å; N135-F150 HydrophobicContact CB-CE1 4.42Å; N135-F150 WeakPolarHBondContact O-CD1 3.3Å; N135-H151 PolarHBondContact O-N 3.38Å; N135-H151 VanDerWaalsContact O-N 3.12Å
136	V	80.3	Confident	83.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.1	-177.1	-177.6	0	0	0	0	109.2	I131 L133 Q138 L148 E149 F150 V186 A190	I131-V136 HydrophobicContact CG2-CG2 4.39Å; L133-V136 HydrophobicContact CD2-CG2 4.25Å; L133-V136 WeakPolarHBondContact O-CB 3.48Å; L133-V136 PolarHBondContact O-N 3.06Å; V136-Q138 VanDerWaalsContact CG1-O 3.28Å; V136-Q138 WeakPolarHBondContact CG1-O 3.49Å; V136-L148 HydrophobicContact CG1-CB 4.35Å; V136-L148 HydrophobicContact CG2-CD2 3.95Å; V136-E149 CarbonylContact C-O 3.51Å; V136-F150 HydrophobicContact CB-CE1 4.5Å; V136-F150 HydrophobicContact CG2-CD1 4.26Å; V136-F150 HydrophobicContact CG2-CE1 3.58Å; V136-F150 HydrophobicContact CG2-CZ 4.11Å; V136-V186 HydrophobicContact CG1-CG1 4.09Å; V136-A190 HydrophobicContact CB-CB 3.95Å; V136-A190 HydrophobicContact CG1-CB 4.36Å
137	S	75.4	Confident	83.3	Confident	46 Å²	46	43.4 Å²	43.4	32%	0.322	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-30.6	177.8	-172	0	0	0	0	112.7	E149 H151	S137-E149 PolarHBondContact N-O 2.77Å; S137-H151 VanDerWaalsContact CB-CE1 3.42Å; S137-H151 WeakPolarHBondContact CB-CE1 3.49Å; S137-H151 WeakPolarHBondContact CB-ND1 3.1Å; S137-H151 PolarHBondContact OG-CE1 3.36Å; S137-H151 PolarHBondContact OG-ND1 2.78Å
138	Q	77.9	Confident	83.4	Confident	96 Å²	96	43 Å²	43	45%	0.449	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	149.1	-178.6	-177.8	168.7	-65.3	0	0	109.4	V136 E149	V136-Q138 VanDerWaalsContact CG1-O 3.28Å; V136-Q138 WeakPolarHBondContact CG1-O 3.49Å; Q138-E149 HydrophobicContact CB-CB 4.22Å; Q138-E149 PolarHBondContact N-O 3.2Å; Q138-E149 PolarHBondContact NE2-OE2 2.99Å; Q138-E149 PolarHBondContact O-N 3.47Å
139	C	83.6	Confident	83.3	Confident	15 Å²	15	45.3 Å²	45.3	10%	0.101	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.4	170.3	-169.8	0	0	0	0	108.1	V146 T147 V186 L187	C139-V146 WeakPolarHBondContact SG-CG1 3.37Å; C139-T147 CarbonylContact C-O 3.59Å; C139-T147 WeakPolarHBondContact CA-O 3.22Å; C139-V186 HydrophobicContact CB-CB 4.38Å; C139-V186 HydrophobicContact CB-CG1 3.78Å; C139-L187 HydrophobicContact CB-CD2 3.72Å; C139-L187 HydrophobicContact CB-CG 3.95Å
140	A	82.9	Confident	83.2	Confident	34 Å²	34	42.8 Å²	42.8	28%	0.281	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.1	178.7	0	0	0	0	0	110.4	T147	A140-T147 PolarHBondContact N-O 2.91Å; A140-T147 PolarHBondContact O-N 3.12Å
141	T	85.9	Confident	82.8	Confident	89 Å²	89	44.5 Å²	44.5	55%	0.546	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	144.3	179.1	48.3	0	0	0	0	111.4	V179 A183	T141-V179 HydrophobicContact CG2-CG1 3.93Å; T141-A183 HydrophobicContact CG2-CB 3.36Å
142	G	83.1	Confident	82.1	Confident	34 Å²	34	49.2 Å²	49.2	35%	0.351	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	174.7	171.9	0	0	0	0	0	110	N144 E145	G142-N144 PolarHBondContact O-N 3.28Å; G142-E145 CarbonylContact C-O 3.53Å; G142-E145 PolarHBondContact N-O 2.9Å; G142-E145 PolarHBondContact O-N 3.34Å; G142-E145 VanDerWaalsContact O-N 3.11Å; G142-E145 VanDerWaalsContact O-O 3.08Å
143	K	83.8	Confident	81.6	Confident	195 Å²	195	48.9 Å²	48.9	85%	0.848	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	107.4	-178	-174.7	176.1	-178	175.4	0	110.6	E145	K143-E145 PolarHBondContact O-N 3.45Å
144	N	86.3	Confident	80.9	Confident	43 Å²	43	52.3 Å²	52.3	23%	0.23	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	21.4	-173.4	-53.7	4.3	0	0	0	113.6	G142 Y166 V167	G142-N144 PolarHBondContact O-N 3.28Å; N144-Y166 HydrophobicContact CB-CD2 4.25Å; N144-Y166 HydrophobicContact CB-CE2 3.74Å; N144-Y166 WeakPolarHBondContact O-CA 3.25Å; N144-Y166 VanDerWaalsContact O-CD2 3.3Å; N144-Y166 WeakPolarHBondContact O-CD2 3.41Å; N144-V167 WeakPolarHBondContact CB-O 3.21Å; N144-V167 PolarHBondContact O-N 2.96Å
145	E	89	Confident	80.5	Confident	80 Å²	80	54.1 Å²	54.1	37%	0.374	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.6	-179.5	-70.4	-171	-175.6	0	0	111.1	G142 K143 R164 F165 V179	G142-E145 CarbonylContact C-O 3.53Å; G142-E145 PolarHBondContact N-O 2.9Å; G142-E145 PolarHBondContact O-N 3.34Å; G142-E145 VanDerWaalsContact O-N 3.11Å; G142-E145 VanDerWaalsContact O-O 3.08Å; K143-E145 PolarHBondContact O-N 3.45Å; E145-R164 WeakPolarHBondContact OE2-CD 3.37Å; E145-F165 CarbonylContact C-O 3.58Å; E145-F165 VanDerWaalsContact CA-O 3.31Å; E145-F165 WeakPolarHBondContact CA-O 3.26Å; E145-V179 WeakPolarHBondContact O-CG1 3.48Å
146	V	89.1	Confident	80.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.2	167.9	-172.6	0	0	0	0	109.4	C139 L148 R164 F165 V167 V179 F182 A183	C139-V146 WeakPolarHBondContact SG-CG1 3.37Å; V146-L148 HydrophobicContact CG1-CD1 4.07Å; V146-R164 WeakPolarHBondContact O-CA 3.07Å; V146-F165 PolarHBondContact N-O 2.97Å; V146-F165 PolarHBondContact O-N 3.05Å; V146-V167 HydrophobicContact CG2-CG2 3.87Å; V146-V179 HydrophobicContact CG2-CG1 3.67Å; V146-F182 HydrophobicContact CB-CD1 4.03Å; V146-F182 HydrophobicContact CB-CE1 4.26Å; V146-F182 HydrophobicContact CG1-CD1 3.89Å; V146-F182 HydrophobicContact CG1-CE1 4.13Å; V146-F182 HydrophobicContact CG2-CB 4.41Å; V146-F182 HydrophobicContact CG2-CD1 3.82Å; V146-F182 HydrophobicContact CG2-CE1 4.5Å; V146-F182 HydrophobicContact CG2-CG 4.37Å; V146-A183 HydrophobicContact CG1-CB 4.34Å
147	T	87.1	Confident	79.7	Confident	22 Å²	22	63.7 Å²	63.7	14%	0.135	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.7	177.9	-53	0	0	0	0	109.5	C139 A140 E149 E162 R164	C139-T147 CarbonylContact C-O 3.59Å; C139-T147 WeakPolarHBondContact CA-O 3.22Å; A140-T147 PolarHBondContact N-O 2.91Å; A140-T147 PolarHBondContact O-N 3.12Å; T147-E149 HydrophobicContact CG2-CG 4.29Å; T147-E162 HydrophobicContact CG2-CG 3.69Å; T147-R164 HydrophobicContact CG2-CG 4.04Å; T147-R164 WeakPolarHBondContact OG1-CD 3.39Å; T147-R164 WeakPolarHBondContact OG1-CG 3.33Å
148	L	88.3	Confident	79.9	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.8	169.9	-66.8	74.6	0	0	0	107.9	L119 V136 V146 F150 E162 V163 F165 F182 V186	L119-L148 HydrophobicContact CD2-CD2 3.79Å; V136-L148 HydrophobicContact CG1-CB 4.35Å; V136-L148 HydrophobicContact CG2-CD2 3.95Å; V146-L148 HydrophobicContact CG1-CD1 4.07Å; L148-F150 HydrophobicContact CB-CE2 3.81Å; L148-F150 HydrophobicContact CB-CZ 3.76Å; L148-F150 HydrophobicContact CD2-CZ 4.24Å; L148-F150 VanDerWaalsContact O-CE2 3.28Å; L148-F150 WeakPolarHBondContact O-CE2 3.42Å; L148-E162 CarbonylContact O-C 3.52Å; L148-E162 WeakPolarHBondContact O-CA 3.38Å; L148-V163 PolarHBondContact N-O 2.89Å; L148-V163 PolarHBondContact O-N 2.71Å; L148-F165 HydrophobicContact CD1-CD2 3.59Å; L148-F165 HydrophobicContact CD1-CE2 3.74Å; L148-F165 HydrophobicContact CD2-CE2 4.34Å; L148-F182 HydrophobicContact CD1-CE1 4.41Å; L148-V186 HydrophobicContact CD2-CG1 4.35Å; L148-V186 HydrophobicContact CD2-CG2 4.36Å; L148-V186 HydrophobicContact CG-CG1 4.43Å
149	E	83.7	Confident	80	Confident	75 Å²	75	64.4 Å²	64.4	35%	0.35	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.5	174.1	-63.6	176.8	-170.9	0	0	109.4	V136 S137 Q138 T147	V136-E149 CarbonylContact C-O 3.51Å; S137-E149 PolarHBondContact N-O 2.77Å; Q138-E149 HydrophobicContact CB-CB 4.22Å; Q138-E149 PolarHBondContact N-O 3.2Å; Q138-E149 PolarHBondContact NE2-OE2 2.99Å; Q138-E149 PolarHBondContact O-N 3.47Å; T147-E149 HydrophobicContact CG2-CG 4.29Å
150	F	83.8	Confident	80	Confident	23 Å²	23	68.6 Å²	68.6	10%	0.101	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	150.6	-171.8	-67.7	-81.6	0	0	0	112.3	I131 N135 V136 L148 Q152 L160 M161 V163	I131-F150 HydrophobicContact CD1-CZ 4.01Å; I131-F150 HydrophobicContact CG2-CE1 3.46Å; I131-F150 VanDerWaalsContact CG2-CE1 3.46Å; I131-F150 HydrophobicContact CG2-CZ 3.75Å; N135-F150 HydrophobicContact CB-CD1 4.03Å; N135-F150 HydrophobicContact CB-CE1 4.42Å; N135-F150 WeakPolarHBondContact O-CD1 3.3Å; V136-F150 HydrophobicContact CB-CE1 4.5Å; V136-F150 HydrophobicContact CG2-CD1 4.26Å; V136-F150 HydrophobicContact CG2-CE1 3.58Å; V136-F150 HydrophobicContact CG2-CZ 4.11Å; L148-F150 HydrophobicContact CB-CE2 3.81Å; L148-F150 HydrophobicContact CB-CZ 3.76Å; L148-F150 HydrophobicContact CD2-CZ 4.24Å; L148-F150 VanDerWaalsContact O-CE2 3.28Å; L148-F150 WeakPolarHBondContact O-CE2 3.42Å; F150-Q152 PolarHBondContact O-N 2.8Å; F150-Q152 VanDerWaalsContact O-N 3.16Å; F150-L160 WeakPolarHBondContact CB-O 3.23Å; F150-L160 HydrophobicContact CD2-CD2 4.23Å; F150-L160 HydrophobicContact CD2-CG 4.07Å; F150-L160 HydrophobicContact CE2-CD2 4.17Å; F150-L160 HydrophobicContact CE2-CG 4.39Å; F150-L160 HydrophobicContact CZ-CD2 4.49Å; F150-M161 PolarHBondContact N-O 2.96Å; F150-V163 HydrophobicContact CE2-CB 3.94Å; F150-V163 HydrophobicContact CE2-CG2 3.7Å; F150-V163 HydrophobicContact CZ-CG2 4.34Å
151	H	75.5	Confident	80	Confident	71 Å²	71	71.1 Å²	71.1	33%	0.329	37%	0.37	S	S	.	.			trans	-65.7	114	172.5	-69.3	-66.6	0	0	0	111.1	N135 S137 N153	N135-H151 PolarHBondContact O-N 3.38Å; N135-H151 VanDerWaalsContact O-N 3.12Å; S137-H151 VanDerWaalsContact CB-CE1 3.42Å; S137-H151 WeakPolarHBondContact CB-CE1 3.49Å; S137-H151 WeakPolarHBondContact CB-ND1 3.1Å; S137-H151 PolarHBondContact OG-CE1 3.36Å; S137-H151 PolarHBondContact OG-ND1 2.78Å; H151-N153 PolarHBondContact O-N 3.47Å
152	Q	72.8	Confident	80.1	Confident	111 Å²	111	71.2 Å²	71.2	52%	0.519	36%	0.364	S	S	.	.			trans	-54	120.1	178.5	171.8	166.2	-6.1	0	0	112.5	F150 D154 M161 K265	F150-Q152 PolarHBondContact O-N 2.8Å; F150-Q152 VanDerWaalsContact O-N 3.16Å; Q152-D154 PolarHBondContact NE2-OD1 3.32Å; Q152-M161 HydrophobicContact CB-CE 4.37Å; Q152-M161 HydrophobicContact CB-SD 3.98Å; Q152-M161 HydrophobicContact CG-CE 3.84Å; Q152-M161 HydrophobicContact CG-SD 4.11Å; Q152-K265 PolarHBondContact O-NZ 2.73Å
153	N	71.4	Confident	80.4	Confident	19 Å²	19	71 Å²	71	10%	0.102	36%	0.356	C	S	.	.			trans	-110.5	78.1	-176	-168.6	12.4	0	0	0	112.4	K15 H151 D155 T156 S159	K15-N153 PolarHBondContact O-ND2 2.94Å; H151-N153 PolarHBondContact O-N 3.47Å; N153-D155 PolarHBondContact O-N 2.89Å; N153-D155 WeakPolarHBondContact OD1-CB 3.41Å; N153-D155 PolarHBondContact OD1-N 3.3Å; N153-D155 PolarHBondContact OD1-OD2 2.95Å; N153-T156 HydrophobicContact CB-CG2 4.47Å; N153-T156 PolarHBondContact O-N 2.61Å; N153-T156 PolarHBondContact O-OG1 3.16Å; N153-T156 VanDerWaalsContact O-OG1 3.12Å; N153-S159 VanDerWaalsContact C-OG 3.27Å; N153-S159 PolarHBondContact N-OG 3.38Å; N153-S159 PolarHBondContact O-OG 3.16Å
154	D	66.6	Low	80.7	Confident	72 Å²	72	68.5 Å²	68.5	39%	0.385	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	6.5	175.8	-41	-81.7	0	0	0	115.9	Q152 T156 K265 R270	Q152-D154 PolarHBondContact NE2-OD1 3.32Å; D154-T156 VanDerWaalsContact C-N 3.26Å; D154-K265 WeakPolarHBondContact OD2-CD 3.36Å; D154-K265 WeakPolarHBondContact OD2-CE 3.5Å; D154-K265 IonicContact OD2-NZ 2.64Å; D154-K265 PolarHBondContact OD2-NZ 2.55Å; D154-R270 PolarHBondContact O-NH2 3.46Å
155	D	66.7	Low	80.9	Confident	82 Å²	82	67.2 Å²	67.2	44%	0.439	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	0.7	163.5	-64.6	-60.9	0	0	0	112.3	N153 R270	N153-D155 PolarHBondContact O-N 2.89Å; N153-D155 WeakPolarHBondContact OD1-CB 3.41Å; N153-D155 PolarHBondContact OD1-N 3.3Å; N153-D155 PolarHBondContact OD1-OD2 2.95Å; D155-R270 IonicContact OD1-CZ 3.6Å; D155-R270 IonicContact OD1-NH1 3.42Å; D155-R270 PolarHBondContact OD1-NH1 3.11Å; D155-R270 IonicContact OD1-NH2 3.76Å; D155-R270 PolarHBondContact OD1-NH2 2.64Å; D155-R270 IonicContact OD2-CZ 2.67Å; D155-R270 IonicContact OD2-NH1 2.69Å; D155-R270 PolarHBondContact OD2-NH1 2.96Å; D155-R270 IonicContact OD2-NH2 3.35Å; D155-R270 PolarHBondContact OD2-NH2 2.64Å
156	T	70.1	Confident	80.9	Confident	26 Å²	26	70.7 Å²	70.7	16%	0.16	34%	0.344	C	S	.	.	S	Bend	trans	-118.2	143.4	171.7	76.6	0	0	0	0	110.8	G16 N153 D154 V158 S159	G16-T156 VanDerWaalsContact O-CG2 3.25Å; G16-T156 WeakPolarHBondContact O-CG2 3.25Å; N153-T156 HydrophobicContact CB-CG2 4.47Å; N153-T156 PolarHBondContact O-N 2.61Å; N153-T156 PolarHBondContact O-OG1 3.16Å; N153-T156 VanDerWaalsContact O-OG1 3.12Å; D154-T156 VanDerWaalsContact C-N 3.26Å; T156-V158 VanDerWaalsContact C-N 3.26Å; T156-V158 WeakPolarHBondContact CB-O 3.33Å; T156-V158 PolarHBondContact OG1-O 2.9Å; T156-S159 WeakPolarHBondContact OG1-CA 3.21Å; T156-S159 PolarHBondContact OG1-N 2.97Å; T156-S159 PolarHBondContact OG1-OG 2.79Å
157	E	70.5	Confident	80.8	Confident	204 Å²	204	71.5 Å²	71.5	95%	0.953	35%	0.35	S	S	*	.	S	Bend	trans	-70.3	-28.8	170.1	-59.6	-171.6	160.7	0	0	111.7
158	V	81.1	Confident	80.6	Confident	129 Å²	129	74.6 Å²	74.6	78%	0.782	37%	0.37	S	S	*	.	S	Bend	trans	-122.1	106	175.9	-177.4	0	0	0	0	108.3	T156	T156-V158 VanDerWaalsContact C-N 3.26Å; T156-V158 WeakPolarHBondContact CB-O 3.33Å; T156-V158 PolarHBondContact OG1-O 2.9Å
159	S	80	Confident	80.1	Confident	29 Å²	29	78.2 Å²	78.2	20%	0.203	39%	0.393	C	S	.	.			trans	-98.3	132.1	172.9	-88.4	0	0	0	0	110	N153 T156 M161	N153-S159 VanDerWaalsContact C-OG 3.27Å; N153-S159 PolarHBondContact N-OG 3.38Å; N153-S159 PolarHBondContact O-OG 3.16Å; T156-S159 WeakPolarHBondContact OG1-CA 3.21Å; T156-S159 PolarHBondContact OG1-N 2.97Å; T156-S159 PolarHBondContact OG1-OG 2.79Å; S159-M161 PolarHBondContact O-N 2.94Å
160	L	83.2	Confident	79.3	Confident	102 Å²	102	77.3 Å²	77.3	53%	0.534	40%	0.395	S	S	.	.			trans	-72.2	120.7	163.5	-176.5	64.8	0	0	0	108.1	F150 V163	F150-L160 WeakPolarHBondContact CB-O 3.23Å; F150-L160 HydrophobicContact CD2-CD2 4.23Å; F150-L160 HydrophobicContact CD2-CG 4.07Å; F150-L160 HydrophobicContact CE2-CD2 4.17Å; F150-L160 HydrophobicContact CE2-CG 4.39Å; F150-L160 HydrophobicContact CZ-CD2 4.49Å; L160-V163 HydrophobicContact CD1-CG2 3.82Å; L160-V163 HydrophobicContact CD2-CG2 3.83Å; L160-V163 HydrophobicContact CG-CG2 4.12Å
161	M	82.1	Confident	78	Confident	87 Å²	87	85.6 Å²	85.6	43%	0.429	43%	0.434	S	S	.	.			trans	-104.3	-36.8	-178	-57.4	-62	-166.7	0	0	112.6	F150 Q152 S159	F150-M161 PolarHBondContact N-O 2.96Å; Q152-M161 HydrophobicContact CB-CE 4.37Å; Q152-M161 HydrophobicContact CB-SD 3.98Å; Q152-M161 HydrophobicContact CG-CE 3.84Å; Q152-M161 HydrophobicContact CG-SD 4.11Å; S159-M161 PolarHBondContact O-N 2.94Å
162	E	87.9	Confident	77.1	Confident	92 Å²	92	88 Å²	88	43%	0.43	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	136.5	-168.4	-169.4	-163.6	132.4	0	0	109.1	T147 L148 R164	T147-E162 HydrophobicContact CG2-CG 3.69Å; L148-E162 CarbonylContact O-C 3.52Å; L148-E162 WeakPolarHBondContact O-CA 3.38Å; E162-R164 IonicContact OE1-CZ 2.72Å; E162-R164 IonicContact OE1-NE 3.76Å; E162-R164 PolarHBondContact OE1-NE 2.84Å; E162-R164 IonicContact OE1-NH2 3.6Å; E162-R164 PolarHBondContact OE1-NH2 2.72Å
163	V	89.6	Confident	76	Confident	29 Å²	29	87.9 Å²	87.9	18%	0.176	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.6	166.3	175.1	0	0	0	0	108.3	I131 L148 F150 L160 F165	I131-V163 HydrophobicContact CD1-CG2 4.39Å; L148-V163 PolarHBondContact N-O 2.89Å; L148-V163 PolarHBondContact O-N 2.71Å; F150-V163 HydrophobicContact CE2-CB 3.94Å; F150-V163 HydrophobicContact CE2-CG2 3.7Å; F150-V163 HydrophobicContact CZ-CG2 4.34Å; L160-V163 HydrophobicContact CD1-CG2 3.82Å; L160-V163 HydrophobicContact CD2-CG2 3.83Å; L160-V163 HydrophobicContact CG-CG2 4.12Å; V163-F165 HydrophobicContact CG1-CD2 4.07Å; V163-F165 HydrophobicContact CG1-CE2 3.65Å; V163-F165 HydrophobicContact CG1-CZ 4.01Å
164	R	90.3	Very high	75.3	Confident	142 Å²	142	96.8 Å²	96.8	54%	0.536	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.8	170.8	-98.4	176.4	-79.6	146.1	-0.3	110.9	E145 V146 T147 E162	E145-R164 WeakPolarHBondContact OE2-CD 3.37Å; V146-R164 WeakPolarHBondContact O-CA 3.07Å; T147-R164 HydrophobicContact CG2-CG 4.04Å; T147-R164 WeakPolarHBondContact OG1-CD 3.39Å; T147-R164 WeakPolarHBondContact OG1-CG 3.33Å; E162-R164 IonicContact OE1-CZ 2.72Å; E162-R164 IonicContact OE1-NE 3.76Å; E162-R164 PolarHBondContact OE1-NE 2.84Å; E162-R164 IonicContact OE1-NH2 3.6Å; E162-R164 PolarHBondContact OE1-NH2 2.72Å
165	F	90.3	Very high	74.9	Confident	17 Å²	17	104.2 Å²	104.2	8%	0.075	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.2	167.7	-67.3	-87.9	0	0	0	109.4	L119 F121 F129 I131 E145 V146 L148 V163 F182	L119-F165 HydrophobicContact CD2-CE2 3.71Å; L119-F165 HydrophobicContact CD2-CZ 3.82Å; L119-F165 HydrophobicContact CG-CZ 4.49Å; F121-F165 HydrophobicContact CD2-CD1 4.35Å; F121-F165 AromaticContact CD2-CE1 3.84Å; F121-F165 HydrophobicContact CD2-CE1 3.84Å; F121-F165 HydrophobicContact CE2-CD1 4.38Å; F121-F165 HydrophobicContact CE2-CE1 4.29Å; F129-F165 HydrophobicContact CE2-CE1 4.23Å; F129-F165 AromaticContact CE2-CZ 3.87Å; F129-F165 HydrophobicContact CE2-CZ 3.87Å; F129-F165 AromaticContact CZ-CE1 3.8Å; F129-F165 HydrophobicContact CZ-CE1 3.8Å; F129-F165 AromaticContact CZ-CZ 3.87Å; F129-F165 HydrophobicContact CZ-CZ 3.87Å; I131-F165 HydrophobicContact CD1-CZ 4.44Å; E145-F165 CarbonylContact C-O 3.58Å; E145-F165 VanDerWaalsContact CA-O 3.31Å; E145-F165 WeakPolarHBondContact CA-O 3.26Å; V146-F165 PolarHBondContact N-O 2.97Å; V146-F165 PolarHBondContact O-N 3.05Å; L148-F165 HydrophobicContact CD1-CD2 3.59Å; L148-F165 HydrophobicContact CD1-CE2 3.74Å; L148-F165 HydrophobicContact CD2-CE2 4.34Å; V163-F165 HydrophobicContact CG1-CD2 4.07Å; V163-F165 HydrophobicContact CG1-CE2 3.65Å; V163-F165 HydrophobicContact CG1-CZ 4.01Å; F165-F182 HydrophobicContact CD2-CZ 4.38Å
166	Y	89.6	Confident	74.8	Confident	152 Å²	152	106 Å²	106	60%	0.596	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	126.3	161.1	177.7	-100.3	0	0	0	108.8	N144 P168	N144-Y166 HydrophobicContact CB-CD2 4.25Å; N144-Y166 HydrophobicContact CB-CE2 3.74Å; N144-Y166 WeakPolarHBondContact O-CA 3.25Å; N144-Y166 VanDerWaalsContact O-CD2 3.3Å; N144-Y166 WeakPolarHBondContact O-CD2 3.41Å; Y166-P168 HydrophobicContact CD1-CG 4.16Å; Y166-P168 HydrophobicContact CE1-CB 4.18Å; Y166-P168 HydrophobicContact CE1-CG 3.91Å
167	V	85.9	Confident	75.2	Confident	18 Å²	18	108.9 Å²	108.9	11%	0.109	54%	0.541	C	S	.	.			trans	-109.1	111.2	175.9	178.7	0	0	0	0	107.4	N144 V146 P178 V179	N144-V167 WeakPolarHBondContact CB-O 3.21Å; N144-V167 PolarHBondContact O-N 2.96Å; V146-V167 HydrophobicContact CG2-CG2 3.87Å; V167-P178 HydrophobicContact CG1-CB 4.01Å; V167-P178 HydrophobicContact CG1-CG 4.35Å; V167-V179 HydrophobicContact CB-CG2 4.19Å; V167-V179 HydrophobicContact CG1-CG2 4.34Å
168	P	83.1	Confident	75.7	Confident	87 Å²	87	100.9 Å²	100.9	57%	0.565	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-60.5	138.8	178	-22.1	32.6	0	0	0	111.4	Y166 S170	Y166-P168 HydrophobicContact CD1-CG 4.16Å; Y166-P168 HydrophobicContact CE1-CB 4.18Å; Y166-P168 HydrophobicContact CE1-CG 3.91Å; P168-S170 PolarHBondContact O-N 3.11Å
169	P	77.4	Confident	75.8	Confident	75 Å²	75	95 Å²	95	49%	0.487	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-68.6	124.1	176.6	28.4	-33.2	0	0	0	110.2
170	S	66.6	Low	75.9	Confident	57 Å²	57	98.2 Å²	98.2	40%	0.399	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-71.1	127.4	175.9	46.1	0	0	0	0	111	P168 T172 P178	P168-S170 PolarHBondContact O-N 3.11Å; S170-T172 VanDerWaalsContact C-N 3.31Å; S170-P178 WeakPolarHBondContact OG-CG 3.44Å
171	Q	57.5	Low	76	Confident	196 Å²	196	94.5 Å²	94.5	92%	0.916	47%	0.467	S	S	*	.	S	Bend	trans	-84	-1.7	179.1	-65.4	-174.2	-3.3	0	0	114
172	T	56.9	Low	76.1	Confident	123 Å²	123	91.5 Å²	91.5	76%	0.755	45%	0.452	S	S	*	.	S	Bend	trans	-122.1	-6.9	-159.2	45.3	0	0	0	0	116.8	S170	S170-T172 VanDerWaalsContact C-N 3.31Å
173	D	48.7	Very low	75.9	Confident	107 Å²	107	87.3 Å²	87.3	57%	0.572	43%	0.433	S	S	*	.			trans	-145.9	115.5	176.4	-98.1	-63.8	0	0	0	111.6	R175	D173-R175 PolarHBondContact O-N 3.3Å
174	E	56.9	Low	75.5	Confident	207 Å²	207	90.1 Å²	90.1	97%	0.967	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	6.2	178.1	-61.1	-173.6	130.9	0	0	113.5
175	R	59.1	Low	75.2	Confident	228 Å²	228	86.3 Å²	86.3	86%	0.86	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-17.1	-166.5	-66.4	-178	175.9	-171.8	0.2	115.1	D173	D173-R175 PolarHBondContact O-N 3.3Å
176	Q	63.6	Low	74.8	Confident	120 Å²	120	85.5 Å²	85.5	56%	0.561	43%	0.431	S	S	*	.	S	Bend	trans	-158.6	131.9	175.5	-130.5	171.5	0.8	0	0	109.5
177	D	79.1	Confident	74.2	Confident	85 Å²	85	81.4 Å²	81.4	46%	0.455	42%	0.419	S	S	.	.			trans	-64.7	123.9	174	-177	-21.5	0	0	0	108.9	V179 E180 A181	D177-V179 PolarHBondContact O-N 3.33Å; D177-V179 WeakPolarHBondContact OD1-CB 3.43Å; D177-V179 VanDerWaalsContact OD1-CG2 3.3Å; D177-V179 WeakPolarHBondContact OD1-CG2 3.49Å; D177-V179 PolarHBondContact OD1-N 2.91Å; D177-E180 HydrophobicContact CB-CB 4.04Å; D177-E180 PolarHBondContact O-N 2.69Å; D177-A181 PolarHBondContact O-N 3.14Å
178	P	80.7	Confident	73.7	Confident	37 Å²	37	84.8 Å²	84.8	24%	0.24	44%	0.443	C	S	.	.	H	α-helix	trans	-60.7	-26.9	178.7	26.7	-37	0	0	0	113	V167 S170 F182	V167-P178 HydrophobicContact CG1-CB 4.01Å; V167-P178 HydrophobicContact CG1-CG 4.35Å; S170-P178 WeakPolarHBondContact OG-CG 3.44Å; P178-F182 WeakPolarHBondContact O-CB 3.39Å; P178-F182 PolarHBondContact O-N 3.49Å
179	V	83.2	Confident	73.2	Confident	4 Å²	4	84.3 Å²	84.3	2%	0.024	43%	0.432	C	S	.	.	H	α-helix	trans	-65.7	-45.2	172.7	-176.1	0	0	0	0	110.1	T141 E145 V146 V167 D177 A183	T141-V179 HydrophobicContact CG2-CG1 3.93Å; E145-V179 WeakPolarHBondContact O-CG1 3.48Å; V146-V179 HydrophobicContact CG2-CG1 3.67Å; V167-V179 HydrophobicContact CB-CG2 4.19Å; V167-V179 HydrophobicContact CG1-CG2 4.34Å; D177-V179 PolarHBondContact O-N 3.33Å; D177-V179 WeakPolarHBondContact OD1-CB 3.43Å; D177-V179 VanDerWaalsContact OD1-CG2 3.3Å; D177-V179 WeakPolarHBondContact OD1-CG2 3.49Å; D177-V179 PolarHBondContact OD1-N 2.91Å; V179-A183 WeakPolarHBondContact O-CB 3.38Å; V179-A183 PolarHBondContact O-N 3.26Å
180	E	83	Confident	72.7	Confident	97 Å²	97	81.5 Å²	81.5	45%	0.453	42%	0.416	S	S	.	.	H	α-helix	trans	-73.8	-43.7	-179.3	-166.8	179	176.3	0	0	111.7	D177 F182 A183 Q184	D177-E180 HydrophobicContact CB-CB 4.04Å; D177-E180 PolarHBondContact O-N 2.69Å; E180-F182 VanDerWaalsContact C-N 3.27Å; E180-F182 PolarHBondContact O-N 3.18Å; E180-A183 CarbonylContact O-C 3.55Å; E180-A183 PolarHBondContact O-N 3.47Å; E180-A183 VanDerWaalsContact O-N 3.11Å; E180-Q184 HydrophobicContact CG-CG 4.23Å; E180-Q184 WeakPolarHBondContact O-CB 3.34Å; E180-Q184 WeakPolarHBondContact O-CG 3.28Å; E180-Q184 PolarHBondContact O-N 2.9Å; E180-Q184 PolarHBondContact OE1-NE2 3.43Å
181	A	84.6	Confident	72.2	Confident	25 Å²	25	82.7 Å²	82.7	21%	0.207	42%	0.417	C	S	.	.	H	α-helix	trans	-59.8	-36.4	174.5	0	0	0	0	0	112.4	D177 N185	D177-A181 PolarHBondContact O-N 3.14Å; A181-N185 WeakPolarHBondContact O-CB 3.28Å; A181-N185 PolarHBondContact O-N 3.12Å; A181-N185 VanDerWaalsContact O-N 3.14Å; A181-N185 PolarHBondContact O-ND2 3.49Å
182	F	84.4	Confident	72.2	Confident	23 Å²	23	74.8 Å²	74.8	10%	0.101	38%	0.383	C	S	.	.	H	α-helix	trans	-66.7	-47.8	171.4	-173.6	-77.8	0	0	0	111.4	A112 F114 L119 V146 L148 F165 P178 E180 Q184 N185 V186	A112-F182 HydrophobicContact CB-CE2 3.74Å; A112-F182 HydrophobicContact CB-CZ 4.36Å; F114-F182 AromaticContact CE2-CD2 3.66Å; F114-F182 HydrophobicContact CE2-CD2 3.66Å; F114-F182 AromaticContact CE2-CE2 3.66Å; F114-F182 HydrophobicContact CE2-CE2 3.66Å; F114-F182 HydrophobicContact CE2-CG 4.29Å; F114-F182 HydrophobicContact CE2-CZ 4.3Å; F114-F182 HydrophobicContact CZ-CD1 4.18Å; F114-F182 AromaticContact CZ-CD2 3.75Å; F114-F182 HydrophobicContact CZ-CD2 3.75Å; F114-F182 HydrophobicContact CZ-CE1 4.06Å; F114-F182 AromaticContact CZ-CE2 3.59Å; F114-F182 HydrophobicContact CZ-CE2 3.59Å; F114-F182 HydrophobicContact CZ-CG 4.05Å; F114-F182 AromaticContact CZ-CZ 3.77Å; F114-F182 HydrophobicContact CZ-CZ 3.77Å; L119-F182 HydrophobicContact CD1-CE2 4.2Å; L119-F182 HydrophobicContact CD1-CZ 3.91Å; L119-F182 HydrophobicContact CD2-CE1 4.5Å; L119-F182 HydrophobicContact CD2-CZ 3.95Å; V146-F182 HydrophobicContact CB-CD1 4.03Å; V146-F182 HydrophobicContact CB-CE1 4.26Å; V146-F182 HydrophobicContact CG1-CD1 3.89Å; V146-F182 HydrophobicContact CG1-CE1 4.13Å; V146-F182 HydrophobicContact CG2-CB 4.41Å; V146-F182 HydrophobicContact CG2-CD1 3.82Å; V146-F182 HydrophobicContact CG2-CE1 4.5Å; V146-F182 HydrophobicContact CG2-CG 4.37Å; L148-F182 HydrophobicContact CD1-CE1 4.41Å; F165-F182 HydrophobicContact CD2-CZ 4.38Å; P178-F182 WeakPolarHBondContact O-CB 3.39Å; P178-F182 PolarHBondContact O-N 3.49Å; E180-F182 VanDerWaalsContact C-N 3.27Å; E180-F182 PolarHBondContact O-N 3.18Å; F182-Q184 PolarHBondContact O-N 2.76Å; F182-N185 WeakPolarHBondContact O-CB 3.36Å; F182-N185 PolarHBondContact O-N 3Å; F182-V186 HydrophobicContact CD1-CG2 4.06Å; F182-V186 HydrophobicContact CE1-CG2 3.77Å; F182-V186 PolarHBondContact O-N 2.78Å
183	A	83.5	Confident	72.1	Confident	4 Å²	4	71 Å²	71	3%	0.033	36%	0.357	C	S	.	.	H	α-helix	trans	-64.5	-39.2	-180	0	0	0	0	0	112.9	T141 V146 V179 E180 N185 V186 L187	T141-A183 HydrophobicContact CG2-CB 3.36Å; V146-A183 HydrophobicContact CG1-CB 4.34Å; V179-A183 WeakPolarHBondContact O-CB 3.38Å; V179-A183 PolarHBondContact O-N 3.26Å; E180-A183 CarbonylContact O-C 3.55Å; E180-A183 PolarHBondContact O-N 3.47Å; E180-A183 VanDerWaalsContact O-N 3.11Å; A183-N185 VanDerWaalsContact C-N 3.33Å; A183-N185 PolarHBondContact O-N 3.19Å; A183-V186 PolarHBondContact O-N 3.11Å; A183-L187 WeakPolarHBondContact O-CB 3.42Å; A183-L187 VanDerWaalsContact O-CG 3.28Å; A183-L187 WeakPolarHBondContact O-CG 3.3Å; A183-L187 PolarHBondContact O-N 3.34Å
184	Q	82.2	Confident	72.2	Confident	88 Å²	88	71 Å²	71	41%	0.411	35%	0.354	S	S	.	.	H	α-helix	trans	-65.2	-35.6	173.3	-69.1	-175.6	14.1	0	0	111.5	E180 F182 V186 L187 S188	E180-Q184 HydrophobicContact CG-CG 4.23Å; E180-Q184 WeakPolarHBondContact O-CB 3.34Å; E180-Q184 WeakPolarHBondContact O-CG 3.28Å; E180-Q184 PolarHBondContact O-N 2.9Å; E180-Q184 PolarHBondContact OE1-NE2 3.43Å; F182-Q184 PolarHBondContact O-N 2.76Å; Q184-V186 VanDerWaalsContact C-N 3.34Å; Q184-L187 PolarHBondContact O-N 2.76Å; Q184-S188 VanDerWaalsContact O-CB 3.29Å; Q184-S188 WeakPolarHBondContact O-CB 3.44Å; Q184-S188 PolarHBondContact O-N 3.05Å; Q184-S188 PolarHBondContact O-OG 2.84Å
185	N	82.9	Confident	71.9	Confident	63 Å²	63	63.5 Å²	63.5	34%	0.337	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-30.7	171.6	-93.7	-80.8	0	0	0	113.7	F114 A181 F182 A183 K189	F114-N185 HydrophobicContact CD1-CB 4.41Å; F114-N185 HydrophobicContact CD2-CB 4.38Å; F114-N185 HydrophobicContact CE1-CB 4.05Å; F114-N185 HydrophobicContact CE2-CB 4.03Å; F114-N185 HydrophobicContact CZ-CB 3.84Å; A181-N185 WeakPolarHBondContact O-CB 3.28Å; A181-N185 PolarHBondContact O-N 3.12Å; A181-N185 VanDerWaalsContact O-N 3.14Å; A181-N185 PolarHBondContact O-ND2 3.49Å; F182-N185 WeakPolarHBondContact O-CB 3.36Å; F182-N185 PolarHBondContact O-N 3Å; A183-N185 VanDerWaalsContact C-N 3.33Å; A183-N185 PolarHBondContact O-N 3.19Å; N185-K189 WeakPolarHBondContact O-CD 3.13Å; N185-K189 PolarHBondContact OD1-NZ 2.86Å
186	V	82.4	Confident	71	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-72.1	-54.7	170.1	172	0	0	0	0	110.2	F114 L133 V136 C139 L148 F182 A183 Q184 S188 K189 A190	F114-V186 HydrophobicContact CE1-CG2 3.83Å; F114-V186 HydrophobicContact CZ-CG2 4.01Å; L133-V186 HydrophobicContact CD2-CG1 4.29Å; L133-V186 HydrophobicContact CD2-CG2 4.4Å; V136-V186 HydrophobicContact CG1-CG1 4.09Å; C139-V186 HydrophobicContact CB-CB 4.38Å; C139-V186 HydrophobicContact CB-CG1 3.78Å; L148-V186 HydrophobicContact CD2-CG1 4.35Å; L148-V186 HydrophobicContact CD2-CG2 4.36Å; L148-V186 HydrophobicContact CG-CG1 4.43Å; F182-V186 HydrophobicContact CD1-CG2 4.06Å; F182-V186 HydrophobicContact CE1-CG2 3.77Å; F182-V186 PolarHBondContact O-N 2.78Å; A183-V186 PolarHBondContact O-N 3.11Å; Q184-V186 VanDerWaalsContact C-N 3.34Å; V186-S188 VanDerWaalsContact C-N 3.34Å; V186-S188 PolarHBondContact O-N 3Å; V186-K189 PolarHBondContact O-N 3.21Å; V186-K189 VanDerWaalsContact O-N 3.11Å; V186-A190 HydrophobicContact CG1-CB 4.42Å; V186-A190 WeakPolarHBondContact O-CB 3.4Å; V186-A190 PolarHBondContact O-N 2.81Å
187	L	77.1	Confident	70.8	Confident	65 Å²	65	54.7 Å²	54.7	34%	0.34	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-37.1	-173.7	-72.2	171.5	0	0	0	113.4	C139 A183 Q184 K189 V192	C139-L187 HydrophobicContact CB-CD2 3.72Å; C139-L187 HydrophobicContact CB-CG 3.95Å; A183-L187 WeakPolarHBondContact O-CB 3.42Å; A183-L187 VanDerWaalsContact O-CG 3.28Å; A183-L187 WeakPolarHBondContact O-CG 3.3Å; A183-L187 PolarHBondContact O-N 3.34Å; Q184-L187 PolarHBondContact O-N 2.76Å; L187-K189 PolarHBondContact O-N 3.02Å; L187-V192 HydrophobicContact CD2-CG1 4.41Å; L187-V192 HydrophobicContact CD2-CG2 4.06Å
188	S	75.7	Confident	70.4	Confident	90 Å²	90	56.9 Å²	56.9	63%	0.629	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-11	178.3	53.9	0	0	0	0	114.7	Q184 V186	Q184-S188 VanDerWaalsContact O-CB 3.29Å; Q184-S188 WeakPolarHBondContact O-CB 3.44Å; Q184-S188 PolarHBondContact O-N 3.05Å; Q184-S188 PolarHBondContact O-OG 2.84Å; V186-S188 VanDerWaalsContact C-N 3.34Å; V186-S188 PolarHBondContact O-N 3Å
189	K	72.6	Confident	70.5	Confident	77 Å²	77	55.8 Å²	55.8	34%	0.335	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-4.2	-173.1	-62.9	175	-174	162	0	113.9	L133 N185 V186 L187	L133-K189 HydrophobicContact CB-CB 4.47Å; L133-K189 WeakPolarHBondContact CB-O 3.2Å; L133-K189 HydrophobicContact CD1-CB 3.58Å; L133-K189 HydrophobicContact CD1-CD 4.11Å; N185-K189 WeakPolarHBondContact O-CD 3.13Å; N185-K189 PolarHBondContact OD1-NZ 2.86Å; V186-K189 PolarHBondContact O-N 3.21Å; V186-K189 VanDerWaalsContact O-N 3.11Å; L187-K189 PolarHBondContact O-N 3.02Å
190	A	65.5	Low	70.6	Confident	16 Å²	16	56.1 Å²	56.1	13%	0.132	33%	0.325	C	S	.	.	S	Bend	trans	-93.8	157.4	179.9	0	0	0	0	0	111.9	L133 V136 V186 V192	L133-A190 HydrophobicContact CB-CB 4.2Å; L133-A190 VanDerWaalsContact O-CA 3.25Å; L133-A190 WeakPolarHBondContact O-CA 3.37Å; L133-A190 VanDerWaalsContact O-CB 3.26Å; L133-A190 WeakPolarHBondContact O-CB 3.46Å; V136-A190 HydrophobicContact CB-CB 3.95Å; V136-A190 HydrophobicContact CG1-CB 4.36Å; V186-A190 HydrophobicContact CG1-CB 4.42Å; V186-A190 WeakPolarHBondContact O-CB 3.4Å; V186-A190 PolarHBondContact O-N 2.81Å; A190-V192 HydrophobicContact CB-CG2 3.82Å; A190-V192 PolarHBondContact O-N 2.96Å
191	D	57.5	Low	70.9	Confident	81 Å²	81	51.9 Å²	51.9	43%	0.433	31%	0.306	S	S	.	.			trans	-74.7	37.6	172.4	-85.4	-37.3	0	0	0	111.9	S134 I193	S134-D191 WeakPolarHBondContact CA-OD2 3.31Å; S134-D191 WeakPolarHBondContact CB-OD2 3.44Å; D191-I193 VanDerWaalsContact C-N 3.29Å; D191-I193 WeakPolarHBondContact O-CG1 3.4Å; D191-I193 PolarHBondContact O-N 2.85Å
192	V	56	Low	71.2	Confident	31 Å²	31	53.9 Å²	53.9	19%	0.188	31%	0.312	C	S	.	.			trans	-72.9	89.3	172.4	-174.7	0	0	0	0	107.6	L187 A190 Q194	L187-V192 HydrophobicContact CD2-CG1 4.41Å; L187-V192 HydrophobicContact CD2-CG2 4.06Å; A190-V192 HydrophobicContact CB-CG2 3.82Å; A190-V192 PolarHBondContact O-N 2.96Å; V192-Q194 HydrophobicContact CG1-CG 3.91Å; V192-Q194 PolarHBondContact O-N 3.22Å
193	I	55.1	Low	71.6	Confident	42 Å²	42	52.9 Å²	52.9	22%	0.215	31%	0.308	C	S	.	.			trans	-69.8	71.2	-179.3	-42.2	-178.9	0	0	0	110.2	D191 F223 K234 P236	D191-I193 VanDerWaalsContact C-N 3.29Å; D191-I193 WeakPolarHBondContact O-CG1 3.4Å; D191-I193 PolarHBondContact O-N 2.85Å; I193-F223 HydrophobicContact CG2-CD1 3.49Å; I193-F223 VanDerWaalsContact CG2-CD1 3.49Å; I193-F223 HydrophobicContact CG2-CD2 3.75Å; I193-F223 HydrophobicContact CG2-CE1 3.35Å; I193-F223 HydrophobicContact CG2-CE2 3.6Å; I193-F223 HydrophobicContact CG2-CG 3.7Å; I193-F223 HydrophobicContact CG2-CZ 3.41Å; I193-F223 VanDerWaalsContact CG2-CZ 3.41Å; I193-K234 HydrophobicContact CB-CD 3.91Å; I193-K234 HydrophobicContact CD1-CB 4.03Å; I193-K234 HydrophobicContact CG2-CB 4.36Å; I193-K234 HydrophobicContact CG2-CD 3.83Å; I193-K234 WeakPolarHBondContact O-CD 3.34Å; I193-K234 PolarHBondContact O-NZ 3.19Å; I193-P236 HydrophobicContact CD1-CG 3.88Å
194	Q	50.3	Low	72	Confident	108 Å²	108	59.8 Å²	59.8	51%	0.505	34%	0.337	S	S	.	.			trans	-64.1	138.5	167.6	-62.5	-162	-5.9	0	0	108.9	V192 T196	V192-Q194 HydrophobicContact CG1-CG 3.91Å; V192-Q194 PolarHBondContact O-N 3.22Å; Q194-T196 HydrophobicContact CB-CG2 3.96Å; Q194-T196 WeakPolarHBondContact CB-OG1 3.31Å; Q194-T196 PolarHBondContact O-N 2.87Å; Q194-T196 VanDerWaalsContact O-N 3.13Å
195	A	50.9	Low	72.4	Confident	50 Å²	50	59.6 Å²	59.6	41%	0.413	34%	0.336	S	S	.	.			trans	-87.3	46.4	174.8	0	0	0	0	0	110.2	G197	A195-G197 PolarHBondContact O-N 2.89Å
196	T	41.3	Very low	72.9	Confident	113 Å²	113	57 Å²	57	69%	0.693	32%	0.322	S	S	*	.			trans	-87.6	88.4	-176.2	37.8	0	0	0	0	110.1	Q194	Q194-T196 HydrophobicContact CB-CG2 3.96Å; Q194-T196 WeakPolarHBondContact CB-OG1 3.31Å; Q194-T196 PolarHBondContact O-N 2.87Å; Q194-T196 VanDerWaalsContact O-N 3.13Å
197	G	59.3	Low	73.5	Confident	50 Å²	50	61.1 Å²	61.1	52%	0.515	34%	0.341	S	S	.	.	S	Bend	trans	145	163.8	-179.8	0	0	0	0	0	111.1	A195 Y220	A195-G197 PolarHBondContact O-N 2.89Å; G197-Y220 WeakPolarHBondContact O-CE1 3.42Å
198	D	69.2	Low	74.3	Confident	130 Å²	130	58.1 Å²	58.1	70%	0.695	33%	0.326	S	S	*	.			trans	-73.2	153.1	173	-73.7	-38.3	0	0	0	111.7	N289	D198-N289 VanDerWaalsContact CB-ND2 3.33Å; D198-N289 WeakPolarHBondContact CB-ND2 3.38Å
199	A	83.3	Confident	75.1	Confident	14 Å²	14	55.1 Å²	55.1	12%	0.116	30%	0.303	C	S	.	.			trans	-74	134.6	169.8	0	0	0	0	0	109.8	C201 I202 R218 I219 Y220	A199-C201 PolarHBondContact O-N 2.83Å; A199-I202 HydrophobicContact CB-CD1 4.12Å; A199-I202 HydrophobicContact CB-CG1 3.73Å; A199-R218 HydrophobicContact CB-CB 4.03Å; A199-I219 CarbonylContact C-O 3.58Å; A199-I219 VanDerWaalsContact CA-O 3.3Å; A199-I219 WeakPolarHBondContact CA-O 2.98Å; A199-Y220 HydrophobicContact CB-CE1 4.23Å
200	V	86	Confident	75.9	Confident	12 Å²	12	52.2 Å²	52.2	7%	0.073	29%	0.292	C	S	.	.	S	Bend	trans	-59.1	-38.2	175.9	177.8	0	0	0	0	110.6	I219 P221 L288 N289 M290	V200-I219 HydrophobicContact CB-CG2 4.11Å; V200-I219 PolarHBondContact N-O 2.92Å; V200-P221 HydrophobicContact CG2-CG 4.2Å; V200-L288 HydrophobicContact CG1-CB 4.45Å; V200-L288 HydrophobicContact CG1-CD2 4.43Å; V200-L288 CarbonylContact O-C 3.47Å; V200-L288 WeakPolarHBondContact O-CA 3.45Å; V200-N289 PolarHBondContact O-N 3.4Å; V200-M290 HydrophobicContact CG1-CG 4.1Å; V200-M290 HydrophobicContact CG1-SD 3.69Å; V200-M290 HydrophobicContact CG2-SD 4.04Å
201	C	88.9	Confident	77.1	Confident	7 Å²	7	51.5 Å²	51.5	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	165.1	166.6	64.5	0	0	0	0	110.8	A199 I219 L286 L288	A199-C201 PolarHBondContact O-N 2.83Å; C201-I219 PolarHBondContact O-N 2.88Å; C201-I219 VanDerWaalsContact SG-CG1 3.53Å; C201-L286 HydrophobicContact CB-CD1 4.06Å; C201-L286 HydrophobicContact CB-CD2 4.09Å; C201-L286 HydrophobicContact CB-CG 4.18Å; C201-L288 HydrophobicContact CB-CD2 3.97Å
202	I	91.3	Very high	78.7	Confident	67 Å²	67	57.6 Å²	57.6	34%	0.344	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	117	179.4	-54.9	178.7	0	0	0	109.9	A199 K204 I217 R218	A199-I202 HydrophobicContact CB-CD1 4.12Å; A199-I202 HydrophobicContact CB-CG1 3.73Å; I202-K204 HydrophobicContact CG2-CG 3.91Å; I202-I217 WeakPolarHBondContact CA-O 3.37Å; I202-R218 HydrophobicContact CD1-CG 4.19Å; I202-R218 HydrophobicContact CG1-CB 4.27Å; I202-R218 HydrophobicContact CG1-CG 4.03Å; I202-R218 HydrophobicContact CG2-CG 3.97Å
203	F	92.2	Very high	80.4	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.009	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.5	165.9	-55.9	-80.1	0	0	0	108.6	L206 D216 I217 I219 I284 L286 L311 M314 V315 V318	F203-L206 HydrophobicContact CB-CD1 3.75Å; F203-L206 HydrophobicContact CB-CD2 4.09Å; F203-L206 HydrophobicContact CB-CG 3.99Å; F203-D216 CarbonylContact O-C 3.48Å; F203-D216 VanDerWaalsContact O-CA 3.26Å; F203-D216 WeakPolarHBondContact O-CA 3.25Å; F203-I217 HydrophobicContact CB-CB 4.45Å; F203-I217 HydrophobicContact CD2-CB 4.47Å; F203-I217 PolarHBondContact N-O 3.36Å; F203-I217 PolarHBondContact O-N 2.86Å; F203-I219 HydrophobicContact CD2-CG1 4.43Å; F203-I219 HydrophobicContact CE2-CG1 4.13Å; F203-I284 HydrophobicContact CD1-CD1 4.11Å; F203-L286 HydrophobicContact CD1-CD1 4.35Å; F203-L286 HydrophobicContact CE1-CD1 3.94Å; F203-L286 HydrophobicContact CE1-CD2 3.94Å; F203-L286 HydrophobicContact CZ-CD1 4.39Å; F203-L286 HydrophobicContact CZ-CD2 3.77Å; F203-L311 HydrophobicContact CD1-CD1 3.82Å; F203-L311 HydrophobicContact CE1-CD1 4.36Å; F203-M314 HydrophobicContact CE1-CB 4.39Å; F203-M314 HydrophobicContact CE1-CG 4.05Å; F203-M314 HydrophobicContact CZ-CG 4.46Å; F203-V315 HydrophobicContact CD1-CG2 3.6Å; F203-V315 HydrophobicContact CD2-CG2 4.15Å; F203-V315 HydrophobicContact CE1-CG2 3.58Å; F203-V315 HydrophobicContact CE2-CG2 4.12Å; F203-V315 HydrophobicContact CG-CG2 3.89Å; F203-V315 HydrophobicContact CZ-CG2 3.84Å; F203-V318 HydrophobicContact CE2-CG1 4.24Å; F203-V318 HydrophobicContact CZ-CB 4.24Å; F203-V318 HydrophobicContact CZ-CG1 4.37Å; F203-V318 HydrophobicContact CZ-CG2 4.2Å
204	K	91.4	Very high	82.2	Confident	149 Å²	149	62.3 Å²	62.3	65%	0.648	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	149.8	-172.4	-64.5	-179.7	-179.3	174.2	0	112.6	I202 L206 D216	I202-K204 HydrophobicContact CG2-CG 3.91Å; K204-L206 PolarHBondContact O-N 2.81Å; K204-L206 VanDerWaalsContact O-N 3.1Å; K204-D216 VanDerWaalsContact CA-OD1 3.29Å; K204-D216 WeakPolarHBondContact CA-OD1 3.33Å
205	E	91.3	Very high	84.3	Confident	85 Å²	85	57.9 Å²	57.9	40%	0.397	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.8	20.3	171.2	-69.7	-119	164.3	0	0	116.5	Q207 R214 D216 K229	E205-Q207 PolarHBondContact O-N 3.32Å; E205-R214 WeakPolarHBondContact O-CD 3.42Å; E205-R214 WeakPolarHBondContact O-CG 3.44Å; E205-R214 VanDerWaalsContact OE2-CD 3.26Å; E205-R214 WeakPolarHBondContact OE2-CD 3.41Å; E205-R214 IonicContact OE2-CZ 3.12Å; E205-R214 IonicContact OE2-NE 2.71Å; E205-R214 IonicContact OE2-NH1 2.64Å; E205-R214 PolarHBondContact OE2-NH1 3.28Å; E205-D216 PolarHBondContact N-OD1 2.8Å; E205-K229 IonicContact OE1-NZ 3.95Å
206	L	93.1	Very high	86.3	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	129.8	-174	-59.3	-164.2	0	0	0	112.9	F203 K204 C208 R214 Y215 I217 L276 F278 L311 V315	F203-L206 HydrophobicContact CB-CD1 3.75Å; F203-L206 HydrophobicContact CB-CD2 4.09Å; F203-L206 HydrophobicContact CB-CG 3.99Å; K204-L206 PolarHBondContact O-N 2.81Å; K204-L206 VanDerWaalsContact O-N 3.1Å; L206-C208 PolarHBondContact O-N 2.98Å; L206-C208 VanDerWaalsContact O-N 3.15Å; L206-R214 WeakPolarHBondContact O-CA 3.04Å; L206-Y215 WeakPolarHBondContact CB-O 3.33Å; L206-Y215 PolarHBondContact N-O 3.17Å; L206-Y215 PolarHBondContact O-N 3.11Å; L206-Y215 VanDerWaalsContact O-N 3.07Å; L206-I217 HydrophobicContact CD1-CB 4.44Å; L206-I217 HydrophobicContact CD1-CD1 3.87Å; L206-I217 HydrophobicContact CD1-CG1 4.09Å; L206-L276 HydrophobicContact CD1-CD1 4.13Å; L206-F278 HydrophobicContact CD1-CE1 4.11Å; L206-F278 HydrophobicContact CD1-CZ 4.23Å; L206-F278 HydrophobicContact CD2-CE1 3.95Å; L206-L311 HydrophobicContact CD2-CD1 4.37Å; L206-L311 HydrophobicContact CD2-CD2 3.85Å; L206-L311 HydrophobicContact CD2-CG 4.48Å; L206-V315 HydrophobicContact CD1-CG2 4.47Å
207	Q	94.5	Very high	88.8	Confident	87 Å²	87	52 Å²	52	41%	0.407	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	105.1	-179.6	179.7	166.6	-38.2	0	0	111.5	E205 L276 L277	E205-Q207 PolarHBondContact O-N 3.32Å; Q207-L276 WeakPolarHBondContact O-CA 3.4Å; Q207-L277 PolarHBondContact O-N 3.39Å
208	C	94	Very high	90.3	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.1	175.3	-58.3	0	0	0	0	110.3	L206 P211 R212 G213 Y215 I275 L276	L206-C208 PolarHBondContact O-N 2.98Å; L206-C208 VanDerWaalsContact O-N 3.15Å; C208-P211 CarbonylContact C-O 3.5Å; C208-P211 WeakPolarHBondContact CB-O 3.42Å; C208-R212 WeakPolarHBondContact O-CA 3.42Å; C208-G213 PolarHBondContact N-O 2.71Å; C208-G213 PolarHBondContact O-N 2.74Å; C208-G213 VanDerWaalsContact O-O 3.13Å; C208-Y215 HydrophobicContact CB-CD2 3.72Å; C208-Y215 HydrophobicContact CB-CE2 4.05Å; C208-Y215 VanDerWaalsContact SG-CD2 3.53Å; C208-I275 CarbonylContact C-O 3.22Å; C208-I275 WeakPolarHBondContact CA-O 3.46Å; C208-L276 HydrophobicContact CB-CD2 4.43Å; C208-L276 WeakPolarHBondContact SG-CD2 3.34Å
209	L	92.9	Very high	91.3	Very high	28 Å²	28	46.7 Å²	46.7	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-25.5	172.9	-60.9	-177.6	0	0	0	112.1	F255 I275 L277 H364	L209-F255 HydrophobicContact CD1-CD1 4.02Å; L209-F255 HydrophobicContact CD1-CE1 3.68Å; L209-I275 HydrophobicContact CB-CB 4.32Å; L209-I275 HydrophobicContact CB-CG2 4.01Å; L209-I275 HydrophobicContact CD1-CG2 4.05Å; L209-I275 HydrophobicContact CG-CG2 4.34Å; L209-I275 PolarHBondContact N-O 2.92Å; L209-L277 HydrophobicContact CD1-CB 4.06Å; L209-L277 HydrophobicContact CD1-CD2 4.36Å; L209-L277 HydrophobicContact CD2-CB 4.4Å; L209-L277 HydrophobicContact CD2-CD2 4.33Å; L209-L277 HydrophobicContact CG-CB 4.04Å; L209-H364 HydrophobicContact CB-CB 4.35Å; L209-H364 HydrophobicContact CD1-CB 3.99Å
210	T	90.1	Very high	91.6	Very high	16 Å²	16	47 Å²	47	10%	0.098	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	116.1	179.5	-65.1	0	0	0	0	108.7	Y271 F273 L274 I275 P367	T210-Y271 HydrophobicContact CG2-CD1 3.38Å; T210-Y271 HydrophobicContact CG2-CE1 3.87Å; T210-Y271 HydrophobicContact CG2-CG 4.21Å; T210-F273 WeakPolarHBondContact CG2-O 3.34Å; T210-L274 WeakPolarHBondContact O-CA 3.3Å; T210-L274 WeakPolarHBondContact O-CD1 3.44Å; T210-I275 PolarHBondContact O-N 3.31Å; T210-P367 HydrophobicContact CG2-CG 4.4Å
211	P	90.1	Very high	91.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	cis	-50.9	146.1	-19.2	24.2	-34.7	0	0	0	111.6	C208 G213 Y215 L226 Y233 I264 Y271	C208-P211 CarbonylContact C-O 3.5Å; C208-P211 WeakPolarHBondContact CB-O 3.42Å; P211-G213 PolarHBondContact O-N 3.39Å; P211-Y215 HydrophobicContact CB-CE2 4.47Å; P211-Y215 HydrophobicContact CG-CE2 4.14Å; P211-L226 HydrophobicContact CG-CD2 4.48Å; P211-Y233 HydrophobicContact CG-CE2 4.36Å; P211-I264 HydrophobicContact CG-CD1 4.36Å; P211-Y271 HydrophobicContact CB-CD2 4.01Å; P211-Y271 HydrophobicContact CB-CE2 3.62Å; P211-Y271 HydrophobicContact CG-CD2 4.35Å; P211-Y271 HydrophobicContact CG-CE2 4.41Å
212	R	91.3	Very high	91	Very high	210 Å²	210	54.2 Å²	54.2	79%	0.792	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	117.1	-175.2	-176.3	177.2	175	130.9	-1.2	111.1	C208	C208-R212 WeakPolarHBondContact O-CA 3.42Å
213	G	91.1	Very high	90.8	Very high	29 Å²	29	51.7 Å²	51.7	30%	0.299	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-172.2	177.7	0	0	0	0	0	113.3	C208 P211	C208-G213 PolarHBondContact N-O 2.71Å; C208-G213 PolarHBondContact O-N 2.74Å; C208-G213 VanDerWaalsContact O-O 3.13Å; P211-G213 PolarHBondContact O-N 3.39Å
214	R	93.4	Very high	90.7	Very high	143 Å²	143	51.6 Å²	51.6	54%	0.54	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.3	159.1	-75.9	-170.6	175.6	-171	-5.4	108.4	E205 L206	E205-R214 WeakPolarHBondContact O-CD 3.42Å; E205-R214 WeakPolarHBondContact O-CG 3.44Å; E205-R214 VanDerWaalsContact OE2-CD 3.26Å; E205-R214 WeakPolarHBondContact OE2-CD 3.41Å; E205-R214 IonicContact OE2-CZ 3.12Å; E205-R214 IonicContact OE2-NE 2.71Å; E205-R214 IonicContact OE2-NH1 2.64Å; E205-R214 PolarHBondContact OE2-NH1 3.28Å; L206-R214 WeakPolarHBondContact O-CA 3.04Å
215	Y	94	Very high	90.6	Very high	14 Å²	14	45.2 Å²	45.2	6%	0.055	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	144.8	-177.9	-66	-98.6	0	0	0	110.2	L206 C208 P211 L226 H227 Y233	L206-Y215 WeakPolarHBondContact CB-O 3.33Å; L206-Y215 PolarHBondContact N-O 3.17Å; L206-Y215 PolarHBondContact O-N 3.11Å; L206-Y215 VanDerWaalsContact O-N 3.07Å; C208-Y215 HydrophobicContact CB-CD2 3.72Å; C208-Y215 HydrophobicContact CB-CE2 4.05Å; C208-Y215 VanDerWaalsContact SG-CD2 3.53Å; P211-Y215 HydrophobicContact CB-CE2 4.47Å; P211-Y215 HydrophobicContact CG-CE2 4.14Å; Y215-L226 VanDerWaalsContact CB-CD1 3.44Å; Y215-L226 HydrophobicContact CD1-CD1 4.24Å; Y215-L226 HydrophobicContact CD1-CD2 4.4Å; Y215-L226 HydrophobicContact CD1-CG 3.83Å; Y215-L226 HydrophobicContact CG-CD1 3.91Å; Y215-L226 HydrophobicContact CG-CG 4.01Å; Y215-H227 CarbonylContact C-O 3.46Å; Y215-H227 WeakPolarHBondContact CA-O 3.2Å; Y215-H227 WeakPolarHBondContact CB-O 3.44Å; Y215-Y233 HydrophobicContact CE1-CD2 4.4Å; Y215-Y233 AromaticContact CE1-CE2 3.94Å; Y215-Y233 HydrophobicContact CE1-CE2 3.94Å
216	D	93.3	Very high	90.6	Very high	37 Å²	37	41.2 Å²	41.2	20%	0.198	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.2	165.9	-61.6	-18.5	0	0	0	108.7	F203 K204 E205 L226 H227	F203-D216 CarbonylContact O-C 3.48Å; F203-D216 VanDerWaalsContact O-CA 3.26Å; F203-D216 WeakPolarHBondContact O-CA 3.25Å; K204-D216 VanDerWaalsContact CA-OD1 3.29Å; K204-D216 WeakPolarHBondContact CA-OD1 3.33Å; E205-D216 PolarHBondContact N-OD1 2.8Å; D216-L226 CarbonylContact O-C 3.51Å; D216-L226 WeakPolarHBondContact O-CA 3.41Å; D216-H227 HydrophobicContact CB-CB 4.38Å; D216-H227 PolarHBondContact N-O 3.45Å; D216-H227 PolarHBondContact O-N 3.07Å; D216-H227 IonicContact OD2-CD2 2.87Å
217	I	93.5	Very high	90.4	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	106.5	168.5	-63.2	-175.1	0	0	0	108.1	I202 F203 L206 I219 L224 L226 L276	I202-I217 WeakPolarHBondContact CA-O 3.37Å; F203-I217 HydrophobicContact CB-CB 4.45Å; F203-I217 HydrophobicContact CD2-CB 4.47Å; F203-I217 PolarHBondContact N-O 3.36Å; F203-I217 PolarHBondContact O-N 2.86Å; L206-I217 HydrophobicContact CD1-CB 4.44Å; L206-I217 HydrophobicContact CD1-CD1 3.87Å; L206-I217 HydrophobicContact CD1-CG1 4.09Å; I217-I219 HydrophobicContact CG2-CD1 3.73Å; I217-I219 HydrophobicContact CG2-CG1 4.47Å; I217-L224 HydrophobicContact CG2-CB 4.25Å; I217-L224 HydrophobicContact CG2-CD1 4.32Å; I217-L226 HydrophobicContact CD1-CD1 4.07Å; I217-L226 HydrophobicContact CG1-CD1 3.63Å; I217-L276 HydrophobicContact CD1-CD1 3.92Å; I217-L276 HydrophobicContact CD1-CD2 4.3Å
218	R	91.1	Very high	90	Very high	68 Å²	68	39.7 Å²	39.7	26%	0.257	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.2	171.4	-51.6	-178.9	-174.7	164.7	5.8	108.7	A199 I202 Y220 H225 H227	A199-R218 HydrophobicContact CB-CB 4.03Å; I202-R218 HydrophobicContact CD1-CG 4.19Å; I202-R218 HydrophobicContact CG1-CB 4.27Å; I202-R218 HydrophobicContact CG1-CG 4.03Å; I202-R218 HydrophobicContact CG2-CG 3.97Å; R218-Y220 HydrophobicContact CB-CE2 3.97Å; R218-H225 HydrophobicContact CB-CB 4.28Å; R218-H225 PolarHBondContact N-O 2.91Å; R218-H225 PolarHBondContact O-N 2.88Å; R218-H227 PolarHBondContact NH2-CD2 3.23Å; R218-H227 PolarHBondContact NH2-NE2 3.16Å
219	I	90.8	Very high	89.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.9	-177.8	-65.1	-55.5	0	0	0	109.7	A199 V200 C201 F203 I217 L224 V318 M319 L322	A199-I219 CarbonylContact C-O 3.58Å; A199-I219 VanDerWaalsContact CA-O 3.3Å; A199-I219 WeakPolarHBondContact CA-O 2.98Å; V200-I219 HydrophobicContact CB-CG2 4.11Å; V200-I219 PolarHBondContact N-O 2.92Å; C201-I219 PolarHBondContact O-N 2.88Å; C201-I219 VanDerWaalsContact SG-CG1 3.53Å; F203-I219 HydrophobicContact CD2-CG1 4.43Å; F203-I219 HydrophobicContact CE2-CG1 4.13Å; I217-I219 HydrophobicContact CG2-CD1 3.73Å; I217-I219 HydrophobicContact CG2-CG1 4.47Å; I219-L224 HydrophobicContact CD1-CB 3.92Å; I219-V318 HydrophobicContact CG1-CG1 4.33Å; I219-M319 HydrophobicContact CD1-SD 4.45Å; I219-L322 HydrophobicContact CD1-CD1 4.06Å; I219-L322 HydrophobicContact CG1-CD1 4.38Å; I219-L322 HydrophobicContact CG2-CD1 3.48Å; I219-L322 VanDerWaalsContact CG2-CD1 3.48Å; I219-L322 HydrophobicContact CG2-CD2 4.03Å; I219-L322 HydrophobicContact CG2-CG 4.41Å
220	Y	88.6	Confident	89	Confident	21 Å²	21	52.1 Å²	52.1	8%	0.082	26%	0.255	C	S	.	.			trans	-116.3	166.4	169.4	-63	-87	0	0	0	110.1	G197 A199 R218 T222 F223 H225 Y237	G197-Y220 WeakPolarHBondContact O-CE1 3.42Å; A199-Y220 HydrophobicContact CB-CE1 4.23Å; R218-Y220 HydrophobicContact CB-CE2 3.97Å; Y220-T222 VanDerWaalsContact C-N 3.25Å; Y220-T222 PolarHBondContact O-N 3.25Å; Y220-F223 CarbonylContact C-O 3.57Å; Y220-F223 WeakPolarHBondContact CA-O 3.44Å; Y220-F223 VanDerWaalsContact CB-O 3.31Å; Y220-F223 WeakPolarHBondContact CB-O 3.32Å; Y220-F223 HydrophobicContact CD1-CZ 4.24Å; Y220-F223 HydrophobicContact CD2-CD2 4.05Å; Y220-F223 HydrophobicContact CD2-CE1 4.17Å; Y220-F223 AromaticContact CD2-CE2 3.39Å; Y220-F223 HydrophobicContact CD2-CE2 3.39Å; Y220-F223 AromaticContact CD2-CZ 3.45Å; Y220-F223 HydrophobicContact CD2-CZ 3.45Å; Y220-F223 VanDerWaalsContact CD2-CZ 3.45Å; Y220-F223 AromaticContact CE2-CE2 3.88Å; Y220-F223 HydrophobicContact CE2-CE2 3.88Å; Y220-F223 HydrophobicContact CE2-CZ 4Å; Y220-F223 AromaticContact CG-CE1 3.91Å; Y220-F223 HydrophobicContact CG-CE1 3.91Å; Y220-F223 AromaticContact CG-CE2 3.99Å; Y220-F223 HydrophobicContact CG-CE2 3.99Å; Y220-F223 AromaticContact CG-CZ 3.58Å; Y220-F223 HydrophobicContact CG-CZ 3.58Å; Y220-F223 PolarHBondContact N-O 3.21Å; Y220-F223 VanDerWaalsContact O-O 3.14Å; Y220-H225 HydrophobicContact CD2-CB 4.19Å; Y220-H225 HydrophobicContact CE2-CB 3.79Å; Y220-Y237 VanDerWaalsContact O-CE2 3.26Å; Y220-Y237 WeakPolarHBondContact O-CE2 3.28Å; Y220-Y237 PolarHBondContact O-OH 2.83Å
221	P	82.9	Confident	88.5	Confident	69 Å²	69	55.5 Å²	55.5	45%	0.448	27%	0.268	S	S	.	.	S	Bend	trans	-62.8	-21.9	-175.1	-27	36.9	0	0	0	116.1	V200	V200-P221 HydrophobicContact CG2-CG 4.2Å
222	T	79.6	Confident	88.2	Confident	101 Å²	101	59.5 Å²	59.5	62%	0.62	29%	0.29	S	S	*	.	S	Bend	trans	-124.1	-15.5	-175.8	50.2	0	0	0	0	114.6	Y220 Y237	Y220-T222 VanDerWaalsContact C-N 3.25Å; Y220-T222 PolarHBondContact O-N 3.25Å; T222-Y237 VanDerWaalsContact C-CE2 3.43Å; T222-Y237 VanDerWaalsContact O-CD2 3.31Å; T222-Y237 WeakPolarHBondContact O-CD2 3.4Å; T222-Y237 PolarHBondContact O-N 2.96Å
223	F	87.8	Confident	88	Confident	13 Å²	13	50.4 Å²	50.4	6%	0.057	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	159.3	-179.7	67.7	-79.4	0	0	0	111.1	I193 Y220 H225 K234 I235 Y237	I193-F223 HydrophobicContact CG2-CD1 3.49Å; I193-F223 VanDerWaalsContact CG2-CD1 3.49Å; I193-F223 HydrophobicContact CG2-CD2 3.75Å; I193-F223 HydrophobicContact CG2-CE1 3.35Å; I193-F223 HydrophobicContact CG2-CE2 3.6Å; I193-F223 HydrophobicContact CG2-CG 3.7Å; I193-F223 HydrophobicContact CG2-CZ 3.41Å; I193-F223 VanDerWaalsContact CG2-CZ 3.41Å; Y220-F223 CarbonylContact C-O 3.57Å; Y220-F223 WeakPolarHBondContact CA-O 3.44Å; Y220-F223 VanDerWaalsContact CB-O 3.31Å; Y220-F223 WeakPolarHBondContact CB-O 3.32Å; Y220-F223 HydrophobicContact CD1-CZ 4.24Å; Y220-F223 HydrophobicContact CD2-CD2 4.05Å; Y220-F223 HydrophobicContact CD2-CE1 4.17Å; Y220-F223 AromaticContact CD2-CE2 3.39Å; Y220-F223 HydrophobicContact CD2-CE2 3.39Å; Y220-F223 AromaticContact CD2-CZ 3.45Å; Y220-F223 HydrophobicContact CD2-CZ 3.45Å; Y220-F223 VanDerWaalsContact CD2-CZ 3.45Å; Y220-F223 AromaticContact CE2-CE2 3.88Å; Y220-F223 HydrophobicContact CE2-CE2 3.88Å; Y220-F223 HydrophobicContact CE2-CZ 4Å; Y220-F223 AromaticContact CG-CE1 3.91Å; Y220-F223 HydrophobicContact CG-CE1 3.91Å; Y220-F223 AromaticContact CG-CE2 3.99Å; Y220-F223 HydrophobicContact CG-CE2 3.99Å; Y220-F223 AromaticContact CG-CZ 3.58Å; Y220-F223 HydrophobicContact CG-CZ 3.58Å; Y220-F223 PolarHBondContact N-O 3.21Å; Y220-F223 VanDerWaalsContact O-O 3.14Å; F223-H225 HydrophobicContact CD2-CB 4.46Å; F223-H225 HydrophobicContact CE2-CB 4.13Å; F223-K234 HydrophobicContact CD2-CB 4.14Å; F223-K234 HydrophobicContact CD2-CG 4.36Å; F223-K234 HydrophobicContact CE2-CB 4.44Å; F223-K234 HydrophobicContact CE2-CD 4.37Å; F223-K234 HydrophobicContact CE2-CG 4.18Å; F223-I235 WeakPolarHBondContact CA-O 3.42Å; F223-Y237 VanDerWaalsContact C-CZ 3.45Å; F223-Y237 PolarHBondContact O-OH 2.75Å
224	L	89.6	Confident	87.7	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.9	162.8	68	88.9	0	0	0	110.2	I217 I219 L226 I235 Y237 M319	I217-L224 HydrophobicContact CG2-CB 4.25Å; I217-L224 HydrophobicContact CG2-CD1 4.32Å; I219-L224 HydrophobicContact CD1-CB 3.92Å; L224-L226 HydrophobicContact CD1-CB 4.34Å; L224-I235 HydrophobicContact CD1-CB 3.91Å; L224-I235 HydrophobicContact CD1-CD1 4.04Å; L224-I235 HydrophobicContact CD1-CG1 4.23Å; L224-I235 HydrophobicContact CG-CB 4.04Å; L224-I235 PolarHBondContact N-O 3.1Å; L224-I235 PolarHBondContact O-N 3.39Å; L224-Y237 HydrophobicContact CB-CE1 4Å; L224-Y237 HydrophobicContact CD2-CE1 4.15Å; L224-Y237 HydrophobicContact CG-CE1 4.4Å; L224-M319 HydrophobicContact CD2-CE 3.65Å; L224-M319 HydrophobicContact CD2-SD 3.79Å
225	H	89.4	Confident	87.5	Confident	15 Å²	15	46.7 Å²	46.7	7%	0.069	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	105.8	176.2	-177	-163.8	0	0	0	108.7	R218 Y220 F223 H227 Y233	R218-H225 HydrophobicContact CB-CB 4.28Å; R218-H225 PolarHBondContact N-O 2.91Å; R218-H225 PolarHBondContact O-N 2.88Å; Y220-H225 HydrophobicContact CD2-CB 4.19Å; Y220-H225 HydrophobicContact CE2-CB 3.79Å; F223-H225 HydrophobicContact CD2-CB 4.46Å; F223-H225 HydrophobicContact CE2-CB 4.13Å; H225-H227 PolarHBondContact O-N 3.22Å; H225-Y233 WeakPolarHBondContact CA-O 3.29Å
226	L	91.3	Very high	87.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	91.1	173.5	-176.7	70.7	0	0	0	107.8	P211 Y215 D216 I217 L224 Y233 I235 I264 L274	P211-L226 HydrophobicContact CG-CD2 4.48Å; Y215-L226 VanDerWaalsContact CB-CD1 3.44Å; Y215-L226 HydrophobicContact CD1-CD1 4.24Å; Y215-L226 HydrophobicContact CD1-CD2 4.4Å; Y215-L226 HydrophobicContact CD1-CG 3.83Å; Y215-L226 HydrophobicContact CG-CD1 3.91Å; Y215-L226 HydrophobicContact CG-CG 4.01Å; D216-L226 CarbonylContact O-C 3.51Å; D216-L226 WeakPolarHBondContact O-CA 3.41Å; I217-L226 HydrophobicContact CD1-CD1 4.07Å; I217-L226 HydrophobicContact CG1-CD1 3.63Å; L224-L226 HydrophobicContact CD1-CB 4.34Å; L226-Y233 HydrophobicContact CB-CD2 4.47Å; L226-Y233 HydrophobicContact CD2-CD2 3.87Å; L226-Y233 HydrophobicContact CG-CD2 4.31Å; L226-Y233 PolarHBondContact N-O 2.92Å; L226-Y233 PolarHBondContact O-N 3.27Å; L226-I235 HydrophobicContact CB-CD1 4.43Å; L226-I235 HydrophobicContact CD2-CD1 4.49Å; L226-I264 HydrophobicContact CD2-CD1 4.32Å; L226-L274 HydrophobicContact CD1-CD2 4.41Å; L226-L274 HydrophobicContact CD2-CD1 3.95Å; L226-L274 HydrophobicContact CD2-CD2 3.99Å
227	H	89.3	Confident	86.8	Confident	53 Å²	53	46.9 Å²	46.9	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.8	-177.1	174.2	63.2	0	0	0	111	Y215 D216 R218 H225 D232	Y215-H227 CarbonylContact C-O 3.46Å; Y215-H227 WeakPolarHBondContact CA-O 3.2Å; Y215-H227 WeakPolarHBondContact CB-O 3.44Å; D216-H227 HydrophobicContact CB-CB 4.38Å; D216-H227 PolarHBondContact N-O 3.45Å; D216-H227 PolarHBondContact O-N 3.07Å; D216-H227 IonicContact OD2-CD2 2.87Å; R218-H227 PolarHBondContact NH2-CD2 3.23Å; R218-H227 PolarHBondContact NH2-NE2 3.16Å; H225-H227 PolarHBondContact O-N 3.22Å; H227-D232 WeakPolarHBondContact CA-OD1 3.35Å; H227-D232 IonicContact CE1-OD1 2.76Å; H227-D232 IonicContact CE1-OD2 3.15Å; H227-D232 IonicContact CG-OD1 3.85Å; H227-D232 VanDerWaalsContact ND1-CG 3.3Å; H227-D232 IonicContact ND1-OD1 2.9Å; H227-D232 PolarHBondContact ND1-OD1 2.91Å; H227-D232 IonicContact ND1-OD2 3.87Å; H227-D232 PolarHBondContact ND1-OD2 3.32Å
228	G	86.9	Confident	86.3	Confident	9 Å²	9	52.7 Å²	52.7	9%	0.093	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	159.9	-176.3	0	0	0	0	0	113.2	T230 F231 D232	G228-T230 PolarHBondContact O-N 2.7Å; G228-F231 WeakPolarHBondContact CA-O 3.26Å; G228-F231 PolarHBondContact N-O 2.79Å; G228-D232 PolarHBondContact N-OD1 3.23Å
229	K	83.5	Confident	86.1	Confident	179 Å²	179	50.3 Å²	50.3	78%	0.778	27%	0.266	S	S	*	.	S	Bend	trans	-63.4	3.4	-176.7	-59	-173	-178.9	-179.4	0	115.3	E205	E205-K229 IonicContact OE1-NZ 3.95Å
230	T	80.6	Confident	86	Confident	113 Å²	113	50.4 Å²	50.4	69%	0.693	27%	0.267	S	S	*	.	S	Bend	trans	-158.1	-23.7	-175.9	-42.8	0	0	0	0	113	G228	G228-T230 PolarHBondContact O-N 2.7Å
231	F	81.2	Confident	86	Confident	86 Å²	86	51.8 Å²	51.8	38%	0.377	28%	0.275	S	S	.	.			trans	-144.7	135.2	-179.1	-59.2	-86	0	0	0	109.9	G228 Y233 Q266	G228-F231 WeakPolarHBondContact CA-O 3.26Å; G228-F231 PolarHBondContact N-O 2.79Å; F231-Y233 HydrophobicContact CB-CE1 4.47Å; F231-Y233 HydrophobicContact CB-CE2 3.81Å; F231-Y233 VanDerWaalsContact CB-OH 3.31Å; F231-Y233 WeakPolarHBondContact CB-OH 3.42Å; F231-Q266 HydrophobicContact CD1-CG 3.98Å; F231-Q266 HydrophobicContact CD2-CG 4.45Å; F231-Q266 HydrophobicContact CE1-CG 3.93Å; F231-Q266 HydrophobicContact CE2-CG 4.42Å; F231-Q266 HydrophobicContact CG-CG 4.25Å; F231-Q266 HydrophobicContact CZ-CG 4.16Å
232	D	84.1	Confident	86.4	Confident	85 Å²	85	52.2 Å²	52.2	46%	0.455	27%	0.268	S	S	.	.			trans	-121.7	135.4	-179.2	-72	-24.2	0	0	0	109.7	H227 G228	H227-D232 WeakPolarHBondContact CA-OD1 3.35Å; H227-D232 IonicContact CE1-OD1 2.76Å; H227-D232 IonicContact CE1-OD2 3.15Å; H227-D232 IonicContact CG-OD1 3.85Å; H227-D232 VanDerWaalsContact ND1-CG 3.3Å; H227-D232 IonicContact ND1-OD1 2.9Å; H227-D232 PolarHBondContact ND1-OD1 2.91Å; H227-D232 IonicContact ND1-OD2 3.87Å; H227-D232 PolarHBondContact ND1-OD2 3.32Å; G228-D232 PolarHBondContact N-OD1 3.23Å
233	Y	86	Confident	87.1	Confident	19 Å²	19	47.4 Å²	47.4	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.1	-178.8	-47.3	-83	0	0	0	111.2	P211 Y215 H225 L226 F231 I264 K265 Q266	P211-Y233 HydrophobicContact CG-CE2 4.36Å; Y215-Y233 HydrophobicContact CE1-CD2 4.4Å; Y215-Y233 AromaticContact CE1-CE2 3.94Å; Y215-Y233 HydrophobicContact CE1-CE2 3.94Å; H225-Y233 WeakPolarHBondContact CA-O 3.29Å; L226-Y233 HydrophobicContact CB-CD2 4.47Å; L226-Y233 HydrophobicContact CD2-CD2 3.87Å; L226-Y233 HydrophobicContact CG-CD2 4.31Å; L226-Y233 PolarHBondContact N-O 2.92Å; L226-Y233 PolarHBondContact O-N 3.27Å; F231-Y233 HydrophobicContact CB-CE1 4.47Å; F231-Y233 HydrophobicContact CB-CE2 3.81Å; F231-Y233 VanDerWaalsContact CB-OH 3.31Å; F231-Y233 WeakPolarHBondContact CB-OH 3.42Å; Y233-I264 HydrophobicContact CD1-CB 4.17Å; Y233-I264 HydrophobicContact CD1-CD1 4.41Å; Y233-I264 HydrophobicContact CD2-CD1 4.27Å; Y233-I264 HydrophobicContact CG-CD1 4.15Å; Y233-K265 WeakPolarHBondContact CE1-O 3.46Å; Y233-Q266 WeakPolarHBondContact OH-CB 3.44Å; Y233-Q266 VanDerWaalsContact OH-CG 3.29Å; Y233-Q266 WeakPolarHBondContact OH-CG 3.26Å; Y233-Q266 PolarHBondContact OH-OE1 3.46Å
234	K	84.9	Confident	87.4	Confident	90 Å²	90	46.8 Å²	46.8	39%	0.391	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.1	170.3	-62.3	174.7	-174.6	172.2	0	108.1	I193 F223	I193-K234 HydrophobicContact CB-CD 3.91Å; I193-K234 HydrophobicContact CD1-CB 4.03Å; I193-K234 HydrophobicContact CG2-CB 4.36Å; I193-K234 HydrophobicContact CG2-CD 3.83Å; I193-K234 WeakPolarHBondContact O-CD 3.34Å; I193-K234 PolarHBondContact O-NZ 3.19Å; F223-K234 HydrophobicContact CD2-CB 4.14Å; F223-K234 HydrophobicContact CD2-CG 4.36Å; F223-K234 HydrophobicContact CE2-CB 4.44Å; F223-K234 HydrophobicContact CE2-CD 4.37Å; F223-K234 HydrophobicContact CE2-CG 4.18Å
235	I	88.4	Confident	87.7	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	98.9	-169.7	-54.8	-177.2	0	0	0	108	F223 L224 L226 T239 L260 I264 L274	F223-I235 WeakPolarHBondContact CA-O 3.42Å; L224-I235 HydrophobicContact CD1-CB 3.91Å; L224-I235 HydrophobicContact CD1-CD1 4.04Å; L224-I235 HydrophobicContact CD1-CG1 4.23Å; L224-I235 HydrophobicContact CG-CB 4.04Å; L224-I235 PolarHBondContact N-O 3.1Å; L224-I235 PolarHBondContact O-N 3.39Å; L226-I235 HydrophobicContact CB-CD1 4.43Å; L226-I235 HydrophobicContact CD2-CD1 4.49Å; I235-T239 WeakPolarHBondContact CG2-OG1 3.32Å; I235-L260 HydrophobicContact CD1-CD1 4.19Å; I235-L260 HydrophobicContact CG2-CD2 3.74Å; I235-I264 HydrophobicContact CD1-CD1 4.18Å; I235-I264 HydrophobicContact CD1-CG2 3.68Å; I235-I264 HydrophobicContact CG1-CG2 3.77Å; I235-L274 HydrophobicContact CD1-CD2 4.47Å
236	P	86.2	Confident	87.9	Confident	34 Å²	34	47.1 Å²	47.1	22%	0.221	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	142.5	175.7	-22.5	33.6	0	0	0	111.6	I193 T238 T239	I193-P236 HydrophobicContact CD1-CG 3.88Å; P236-T238 PolarHBondContact O-N 3.32Å; P236-T238 VanDerWaalsContact O-N 3.15Å; P236-T239 HydrophobicContact CB-CG2 4.25Å; P236-T239 HydrophobicContact CG-CG2 4.36Å; P236-T239 WeakPolarHBondContact O-CB 3.41Å; P236-T239 PolarHBondContact O-N 3.01Å; P236-T239 PolarHBondContact O-OG1 2.96Å
237	Y	87.1	Confident	88	Confident	21 Å²	21	47.7 Å²	47.7	8%	0.082	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-63	-24.3	-178.5	-59	-52	0	0	0	113.1	Y220 T222 F223 L224 T239 V240 L322 V323	Y220-Y237 VanDerWaalsContact O-CE2 3.26Å; Y220-Y237 WeakPolarHBondContact O-CE2 3.28Å; Y220-Y237 PolarHBondContact O-OH 2.83Å; T222-Y237 VanDerWaalsContact C-CE2 3.43Å; T222-Y237 VanDerWaalsContact O-CD2 3.31Å; T222-Y237 WeakPolarHBondContact O-CD2 3.4Å; T222-Y237 PolarHBondContact O-N 2.96Å; F223-Y237 VanDerWaalsContact C-CZ 3.45Å; F223-Y237 PolarHBondContact O-OH 2.75Å; L224-Y237 HydrophobicContact CB-CE1 4Å; L224-Y237 HydrophobicContact CD2-CE1 4.15Å; L224-Y237 HydrophobicContact CG-CE1 4.4Å; Y237-T239 PolarHBondContact O-N 3.24Å; Y237-V240 PolarHBondContact O-N 2.75Å; Y237-V240 VanDerWaalsContact O-N 3.1Å; Y237-L322 HydrophobicContact CD1-CB 4.44Å; Y237-L322 HydrophobicContact CD2-CB 4.43Å; Y237-L322 HydrophobicContact CE1-CB 4.11Å; Y237-L322 HydrophobicContact CE1-CD1 4.29Å; Y237-L322 HydrophobicContact CE2-CB 4.12Å; Y237-L322 HydrophobicContact CE2-CD2 3.99Å; Y237-V323 HydrophobicContact CD1-CG2 3.83Å; Y237-V323 HydrophobicContact CG-CG2 4.34Å
238	T	83.1	Confident	88.2	Confident	125 Å²	125	46.9 Å²	46.9	77%	0.767	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-59.9	-23.4	172.2	51.7	0	0	0	0	113.8	P236	P236-T238 PolarHBondContact O-N 3.32Å; P236-T238 VanDerWaalsContact O-N 3.15Å
239	T	86.1	Confident	88.3	Confident	18 Å²	18	49.1 Å²	49.1	11%	0.11	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-82	-12.6	177.2	69.7	0	0	0	0	113.6	I235 P236 Y237 L241 L260 D261	I235-T239 WeakPolarHBondContact CG2-OG1 3.32Å; P236-T239 HydrophobicContact CB-CG2 4.25Å; P236-T239 HydrophobicContact CG-CG2 4.36Å; P236-T239 WeakPolarHBondContact O-CB 3.41Å; P236-T239 PolarHBondContact O-N 3.01Å; P236-T239 PolarHBondContact O-OG1 2.96Å; Y237-T239 PolarHBondContact O-N 3.24Å; T239-L241 PolarHBondContact O-N 2.79Å; T239-L260 WeakPolarHBondContact O-CA 3.31Å; T239-D261 WeakPolarHBondContact CA-O 3.37Å; T239-D261 PolarHBondContact O-N 2.83Å
240	V	90.1	Very high	88.5	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	101.3	-176.1	-178.2	0	0	0	0	110.3	Y237 L243 I258 S259 L260 V323	Y237-V240 PolarHBondContact O-N 2.75Å; Y237-V240 VanDerWaalsContact O-N 3.1Å; V240-L243 HydrophobicContact CG1-CD2 3.75Å; V240-L243 HydrophobicContact CG1-CG 4.25Å; V240-I258 HydrophobicContact CB-CG2 4.45Å; V240-I258 HydrophobicContact CG1-CG2 3.71Å; V240-I258 HydrophobicContact CG2-CG2 3.97Å; V240-S259 CarbonylContact C-O 3.55Å; V240-S259 WeakPolarHBondContact CA-O 3.18Å; V240-L260 HydrophobicContact CG2-CD2 3.99Å; V240-V323 HydrophobicContact CB-CG1 3.75Å; V240-V323 HydrophobicContact CB-CG2 4.38Å; V240-V323 HydrophobicContact CG1-CG1 3.78Å; V240-V323 HydrophobicContact CG1-CG2 4.37Å; V240-V323 HydrophobicContact CG2-CG2 4.44Å
241	L	88.1	Confident	88.8	Confident	49 Å²	49	44.3 Å²	44.3	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-41.7	179.3	-66.6	-171.4	0	0	0	113	T239 S259 D261	T239-L241 PolarHBondContact O-N 2.79Å; L241-S259 PolarHBondContact N-O 2.95Å; L241-D261 HydrophobicContact CD1-CB 3.49Å; L241-D261 VanDerWaalsContact CD1-CB 3.49Å; L241-D261 HydrophobicContact CD2-CB 4.02Å; L241-D261 HydrophobicContact CG-CB 3.63Å
242	R	90.7	Very high	89.2	Confident	78 Å²	78	47.9 Å²	47.9	29%	0.294	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	148.9	-178.5	-76.5	-169.4	178.8	78.9	2.8	111.9	F244 S259	R242-F244 HydrophobicContact CB-CD2 4.31Å; R242-F244 HydrophobicContact CB-CE2 3.56Å; R242-F244 HydrophobicContact CB-CZ 3.76Å; R242-F244 VanDerWaalsContact CD-CZ 3.5Å; R242-F244 HydrophobicContact CG-CZ 4.28Å; R242-S259 PolarHBondContact O-N 2.79Å
243	L	94.2	Very high	89.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.3	165.7	-58.6	174.8	0	0	0	108.4	V240 F256 V257 I258 M319 V323 I327 T328	V240-L243 HydrophobicContact CG1-CD2 3.75Å; V240-L243 HydrophobicContact CG1-CG 4.25Å; L243-F256 HydrophobicContact CB-CE2 4.49Å; L243-F256 HydrophobicContact CB-CZ 4.23Å; L243-F256 HydrophobicContact CD1-CZ 4.35Å; L243-F256 HydrophobicContact CD2-CE1 4.16Å; L243-F256 HydrophobicContact CD2-CZ 3.92Å; L243-F256 HydrophobicContact CG-CZ 4.4Å; L243-V257 CarbonylContact C-O 3.6Å; L243-I258 HydrophobicContact CD2-CB 4.36Å; L243-I258 HydrophobicContact CD2-CG1 3.88Å; L243-I258 HydrophobicContact CD2-CG2 4.1Å; L243-M319 HydrophobicContact CD1-CB 3.9Å; L243-M319 HydrophobicContact CD2-CB 4.49Å; L243-M319 HydrophobicContact CD2-CE 3.9Å; L243-V323 HydrophobicContact CD1-CB 4.44Å; L243-I327 HydrophobicContact CB-CG1 4.44Å; L243-T328 PolarHBondContact O-N 3.5Å; L243-T328 PolarHBondContact O-OG1 2.84Å
244	F	94.8	Very high	90.1	Very high	1 Å²	1	47 Å²	47	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.7	172.6	-48.2	-104	0	0	0	110.2	R242 L246 F256 V257 T328 L356 I361 H369	R242-F244 HydrophobicContact CB-CD2 4.31Å; R242-F244 HydrophobicContact CB-CE2 3.56Å; R242-F244 HydrophobicContact CB-CZ 3.76Å; R242-F244 VanDerWaalsContact CD-CZ 3.5Å; R242-F244 HydrophobicContact CG-CZ 4.28Å; F244-L246 HydrophobicContact CB-CD1 4.49Å; F244-L246 HydrophobicContact CB-CD2 4.31Å; F244-L246 HydrophobicContact CB-CG 4.23Å; F244-F256 WeakPolarHBondContact O-CA 3.33Å; F244-F256 WeakPolarHBondContact O-CD2 3.14Å; F244-V257 HydrophobicContact CB-CB 4.14Å; F244-V257 HydrophobicContact CD2-CB 4.05Å; F244-V257 HydrophobicContact CD2-CG1 4.23Å; F244-V257 HydrophobicContact CG-CB 4.49Å; F244-V257 PolarHBondContact N-O 2.91Å; F244-V257 PolarHBondContact O-N 2.82Å; F244-T328 VanDerWaalsContact CA-O 3.22Å; F244-T328 WeakPolarHBondContact CA-O 3.46Å; F244-T328 HydrophobicContact CD1-CG2 3.84Å; F244-T328 HydrophobicContact CE1-CG2 4.08Å; F244-L356 HydrophobicContact CD1-CD1 3.69Å; F244-L356 HydrophobicContact CE1-CD1 3.62Å; F244-I361 HydrophobicContact CD1-CD1 4.04Å; F244-I361 HydrophobicContact CD2-CD1 3.9Å; F244-I361 HydrophobicContact CE1-CD1 4.14Å; F244-I361 HydrophobicContact CE2-CD1 3.99Å; F244-I361 HydrophobicContact CG-CD1 3.94Å; F244-I361 HydrophobicContact CZ-CD1 4.11Å; F244-H369 AromaticContact CE1-CD2 3.48Å; F244-H369 VanDerWaalsContact CE1-CD2 3.48Å; F244-H369 WeakPolarHBondContact CE1-CD2 3.23Å; F244-H369 AromaticContact CE1-NE2 3.69Å; F244-H369 AromaticContact CZ-CD2 3.3Å; F244-H369 WeakPolarHBondContact CZ-CD2 3.41Å; F244-H369 AromaticContact CZ-CG 3.95Å; F244-H369 AromaticContact CZ-NE2 3.54Å
245	L	95.1	Very high	90.6	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.115	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114	172.9	178.2	65.2	0	0	0	108.2	M254 F256 Y312 I327 T328 P330	L245-M254 HydrophobicContact CD1-CB 4.29Å; L245-M254 HydrophobicContact CD1-CE 3.67Å; L245-M254 HydrophobicContact CD2-CE 4.24Å; L245-M254 HydrophobicContact CG-CE 3.68Å; L245-F256 HydrophobicContact CB-CD2 4.27Å; L245-F256 HydrophobicContact CD1-CD2 4.11Å; L245-Y312 HydrophobicContact CD1-CD2 3.97Å; L245-Y312 HydrophobicContact CD2-CD2 4.25Å; L245-I327 HydrophobicContact CB-CG2 3.62Å; L245-T328 PolarHBondContact N-O 2.95Å; L245-P330 WeakPolarHBondContact O-CD 3.44Å
246	L	94.1	Very high	91	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.1	-167.1	-50.8	172.6	0	0	0	110.2	F244 F255 V257 P330 Y354 L356 I361 V363	F244-L246 HydrophobicContact CB-CD1 4.49Å; F244-L246 HydrophobicContact CB-CD2 4.31Å; F244-L246 HydrophobicContact CB-CG 4.23Å; L246-F255 HydrophobicContact CB-CB 4.32Å; L246-F255 PolarHBondContact N-O 2.89Å; L246-F255 PolarHBondContact O-N 2.91Å; L246-V257 HydrophobicContact CD1-CG2 4.18Å; L246-P330 HydrophobicContact CD2-CG 4.12Å; L246-Y354 HydrophobicContact CB-CD1 4.12Å; L246-Y354 HydrophobicContact CB-CE1 3.78Å; L246-Y354 HydrophobicContact CB-CE2 4.33Å; L246-Y354 HydrophobicContact CD1-CD2 4.03Å; L246-Y354 HydrophobicContact CD1-CE2 4.27Å; L246-Y354 HydrophobicContact CD1-CG 4.23Å; L246-Y354 HydrophobicContact CD2-CD1 4.14Å; L246-Y354 HydrophobicContact CD2-CG 4.27Å; L246-L356 HydrophobicContact CD2-CD2 3.93Å; L246-I361 HydrophobicContact CD1-CD1 4.45Å; L246-I361 HydrophobicContact CD1-CG2 3.66Å; L246-I361 HydrophobicContact CD2-CG2 4.24Å; L246-V363 HydrophobicContact CD1-CG1 4.28Å
247	P	93.4	Very high	91.4	Very high	13 Å²	13	41.4 Å²	41.4	8%	0.084	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	138.4	177.1	30.3	-31.3	0	0	0	111.6	M254 P330 Y354	P247-M254 VanDerWaalsContact CA-SD 3.57Å; P247-M254 HydrophobicContact CB-CE 4.13Å; P247-M254 HydrophobicContact CB-SD 3.72Å; P247-P330 HydrophobicContact CG-CG 4.41Å; P247-Y354 VanDerWaalsContact O-CE1 3.24Å; P247-Y354 WeakPolarHBondContact O-CE1 3.48Å; P247-Y354 PolarHBondContact O-OH 3.1Å
248	H	93.1	Very high	91.8	Very high	36 Å²	36	40.5 Å²	40.5	17%	0.167	20%	0.195	C	C	.	.			trans	-65.4	152.3	174.2	-159.7	-82.6	0	0	0	111.4	D250 Q251 Q253 F255	H248-D250 IonicContact CE1-OD1 3.47Å; H248-D250 PolarHBondContact CE1-OD1 3.48Å; H248-D250 IonicContact CE1-OD2 3.86Å; H248-D250 PolarHBondContact ND1-N 2.87Å; H248-D250 IonicContact ND1-OD1 3.64Å; H248-D250 PolarHBondContact ND1-OD1 2.98Å; H248-D250 IonicContact ND1-OD2 3.82Å; H248-D250 PolarHBondContact O-N 3.49Å; H248-Q251 WeakPolarHBondContact O-CA 3.41Å; H248-Q251 PolarHBondContact O-N 2.83Å; H248-Q253 HydrophobicContact CB-CB 3.81Å; H248-Q253 WeakPolarHBondContact CB-O 3.5Å; H248-Q253 PolarHBondContact N-O 2.97Å; H248-F255 HydrophobicContact CB-CE2 4.34Å; H248-F255 AromaticContact CD2-CE2 3.46Å; H248-F255 VanDerWaalsContact CD2-CE2 3.46Å; H248-F255 WeakPolarHBondContact CD2-CE2 3.33Å; H248-F255 AromaticContact CD2-CZ 3.42Å; H248-F255 VanDerWaalsContact CD2-CZ 3.42Å; H248-F255 WeakPolarHBondContact CD2-CZ 3.04Å; H248-F255 AromaticContact NE2-CZ 3.99Å
249	K	88.9	Confident	92.3	Very high	55 Å²	55	35.1 Å²	35.1	24%	0.239	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-46.5	177.6	-176.6	157.8	176.6	163.6	0	111.3	Q251 A339 T343 L352 E411	K249-Q251 PolarHBondContact O-N 2.66Å; K249-Q251 VanDerWaalsContact O-N 3.09Å; K249-A339 HydrophobicContact CD-CB 4.44Å; K249-A339 HydrophobicContact CG-CB 3.99Å; K249-T343 VanDerWaalsContact CD-OG1 3.26Å; K249-T343 WeakPolarHBondContact CD-OG1 3.24Å; K249-T343 PolarHBondContact NZ-OG1 2.86Å; K249-L352 HydrophobicContact CB-CD1 4.46Å; K249-L352 HydrophobicContact CB-CD2 4.3Å; K249-L352 HydrophobicContact CD-CD2 4.47Å; K249-E411 IonicContact NZ-OE1 3.08Å; K249-E411 PolarHBondContact NZ-OE1 3.04Å; K249-E411 VanDerWaalsContact NZ-OE1 3.15Å
250	D	88.6	Confident	92.4	Very high	108 Å²	108	34.4 Å²	34.4	58%	0.578	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-6.4	176.2	-48.7	28.5	0	0	0	115.4	H248 R252	H248-D250 IonicContact CE1-OD1 3.47Å; H248-D250 PolarHBondContact CE1-OD1 3.48Å; H248-D250 IonicContact CE1-OD2 3.86Å; H248-D250 PolarHBondContact ND1-N 2.87Å; H248-D250 IonicContact ND1-OD1 3.64Å; H248-D250 PolarHBondContact ND1-OD1 2.98Å; H248-D250 IonicContact ND1-OD2 3.82Å; H248-D250 PolarHBondContact O-N 3.49Å; D250-R252 PolarHBondContact O-N 3.15Å
251	Q	86.4	Confident	92.1	Very high	83 Å²	83	35.8 Å²	35.8	39%	0.388	17%	0.165	S	C	.	.	S	Bend	trans	55.5	-0.7	-177.5	-67.3	-64.9	-13.4	0	0	117.8	H248 K249 K280	H248-Q251 WeakPolarHBondContact O-CA 3.41Å; H248-Q251 PolarHBondContact O-N 2.83Å; K249-Q251 PolarHBondContact O-N 2.66Å; K249-Q251 VanDerWaalsContact O-N 3.09Å; Q251-K280 WeakPolarHBondContact O-CD 3.39Å; Q251-K280 WeakPolarHBondContact O-CE 3.4Å; Q251-K280 PolarHBondContact O-NZ 2.62Å
252	R	90.8	Very high	91.8	Very high	162 Å²	162	37.2 Å²	37.2	61%	0.611	18%	0.177	S	C	*	.	S	Bend	trans	-84.1	-18	175.9	-68.5	174.3	178.3	-94	4.2	114.8	D250 K280 E281	D250-R252 PolarHBondContact O-N 3.15Å; R252-K280 PolarHBondContact O-N 3.24Å; R252-E281 IonicContact NH1-OE1 2.69Å; R252-E281 PolarHBondContact NH1-OE1 2.85Å
253	Q	93.7	Very high	91.5	Very high	71 Å²	71	34 Å²	34	33%	0.332	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	157.2	-171.7	-69.6	176.2	-3.5	0	0	111.8	H248 L277 F278	H248-Q253 HydrophobicContact CB-CB 3.81Å; H248-Q253 WeakPolarHBondContact CB-O 3.5Å; H248-Q253 PolarHBondContact N-O 2.97Å; Q253-L277 HydrophobicContact CB-CD1 4.06Å; Q253-F278 CarbonylContact C-O 3.6Å; Q253-F278 VanDerWaalsContact CA-O 3.26Å; Q253-F278 WeakPolarHBondContact CA-O 3.32Å; Q253-F278 WeakPolarHBondContact CB-O 3.28Å
254	M	94.4	Very high	91.1	Very high	15 Å²	15	35 Å²	35	7%	0.074	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131	174.7	-60.8	-62.8	-66	0	0	109.7	L245 P247 F278 K280 Y312	L245-M254 HydrophobicContact CD1-CB 4.29Å; L245-M254 HydrophobicContact CD1-CE 3.67Å; L245-M254 HydrophobicContact CD2-CE 4.24Å; L245-M254 HydrophobicContact CG-CE 3.68Å; P247-M254 VanDerWaalsContact CA-SD 3.57Å; P247-M254 HydrophobicContact CB-CE 4.13Å; P247-M254 HydrophobicContact CB-SD 3.72Å; M254-F278 PolarHBondContact N-O 2.76Å; M254-F278 PolarHBondContact O-N 2.82Å; M254-K280 HydrophobicContact CG-CD 4.5Å; M254-K280 HydrophobicContact CG-CG 3.79Å; M254-K280 HydrophobicContact SD-CD 4.33Å; M254-K280 WeakPolarHBondContact SD-CE 3.4Å; M254-K280 HydrophobicContact SD-CG 4.24Å; M254-Y312 HydrophobicContact CB-CD2 4.25Å; M254-Y312 HydrophobicContact CB-CG 4.02Å; M254-Y312 HydrophobicContact CE-CD2 4.28Å; M254-Y312 HydrophobicContact CE-CE2 4.24Å; M254-Y312 HydrophobicContact CG-CD1 3.94Å; M254-Y312 HydrophobicContact CG-CD2 3.79Å; M254-Y312 HydrophobicContact CG-CE1 4.22Å; M254-Y312 HydrophobicContact CG-CE2 4.06Å; M254-Y312 HydrophobicContact CG-CG 3.73Å
255	F	95.6	Very high	90.4	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.6	163	-56	-84.7	0	0	0	109.5	L209 L246 H248 V257 I275 L276 L277 L352 V363	L209-F255 HydrophobicContact CD1-CD1 4.02Å; L209-F255 HydrophobicContact CD1-CE1 3.68Å; L246-F255 HydrophobicContact CB-CB 4.32Å; L246-F255 PolarHBondContact N-O 2.89Å; L246-F255 PolarHBondContact O-N 2.91Å; H248-F255 HydrophobicContact CB-CE2 4.34Å; H248-F255 AromaticContact CD2-CE2 3.46Å; H248-F255 VanDerWaalsContact CD2-CE2 3.46Å; H248-F255 WeakPolarHBondContact CD2-CE2 3.33Å; H248-F255 AromaticContact CD2-CZ 3.42Å; H248-F255 VanDerWaalsContact CD2-CZ 3.42Å; H248-F255 WeakPolarHBondContact CD2-CZ 3.04Å; H248-F255 AromaticContact NE2-CZ 3.99Å; F255-V257 HydrophobicContact CB-CG2 4.45Å; F255-I275 HydrophobicContact CD1-CG2 4.12Å; F255-L276 WeakPolarHBondContact CA-O 3.4Å; F255-L277 HydrophobicContact CD1-CD1 3.73Å; F255-L277 HydrophobicContact CE1-CD1 3.74Å; F255-L277 HydrophobicContact CG-CD1 4.33Å; F255-L277 HydrophobicContact CZ-CD1 4.33Å; F255-L352 HydrophobicContact CE2-CD1 3.97Å; F255-L352 HydrophobicContact CZ-CD1 4.34Å; F255-V363 HydrophobicContact CD2-CG2 4.14Å; F255-V363 HydrophobicContact CE1-CG2 4.32Å; F255-V363 HydrophobicContact CE2-CG2 3.95Å; F255-V363 HydrophobicContact CG-CG2 4.41Å; F255-V363 HydrophobicContact CZ-CG2 4.04Å
256	F	96.1	Very high	89.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.2	163.4	-169.6	-108.7	0	0	0	108.4	L243 F244 L245 I258 L276 F278 V315 M319	L243-F256 HydrophobicContact CB-CE2 4.49Å; L243-F256 HydrophobicContact CB-CZ 4.23Å; L243-F256 HydrophobicContact CD1-CZ 4.35Å; L243-F256 HydrophobicContact CD2-CE1 4.16Å; L243-F256 HydrophobicContact CD2-CZ 3.92Å; L243-F256 HydrophobicContact CG-CZ 4.4Å; F244-F256 WeakPolarHBondContact O-CA 3.33Å; F244-F256 WeakPolarHBondContact O-CD2 3.14Å; L245-F256 HydrophobicContact CB-CD2 4.27Å; L245-F256 HydrophobicContact CD1-CD2 4.11Å; F256-I258 HydrophobicContact CD1-CD1 4.09Å; F256-I258 HydrophobicContact CD1-CG1 3.87Å; F256-I258 HydrophobicContact CE1-CD1 3.86Å; F256-I258 HydrophobicContact CE1-CG1 3.65Å; F256-L276 HydrophobicContact CB-CB 4.3Å; F256-L276 HydrophobicContact CD1-CD1 4.09Å; F256-L276 PolarHBondContact N-O 2.7Å; F256-L276 PolarHBondContact O-N 2.86Å; F256-F278 HydrophobicContact CB-CD2 4.23Å; F256-F278 HydrophobicContact CB-CE2 3.65Å; F256-F278 HydrophobicContact CG-CE2 4.46Å; F256-V315 HydrophobicContact CD1-CG1 4.1Å; F256-V315 HydrophobicContact CE1-CG1 4.05Å; F256-M319 HydrophobicContact CE1-CB 4.24Å; F256-M319 HydrophobicContact CE1-CG 4Å; F256-M319 HydrophobicContact CZ-CB 3.91Å; F256-M319 HydrophobicContact CZ-CG 4.17Å
257	V	95.3	Very high	88.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127	-176.1	-173.1	0	0	0	0	109.4	L243 F244 L246 F255 F273 L274 I275 I361 V363	L243-V257 CarbonylContact C-O 3.6Å; F244-V257 HydrophobicContact CB-CB 4.14Å; F244-V257 HydrophobicContact CD2-CB 4.05Å; F244-V257 HydrophobicContact CD2-CG1 4.23Å; F244-V257 HydrophobicContact CG-CB 4.49Å; F244-V257 PolarHBondContact N-O 2.91Å; F244-V257 PolarHBondContact O-N 2.82Å; L246-V257 HydrophobicContact CD1-CG2 4.18Å; F255-V257 HydrophobicContact CB-CG2 4.45Å; V257-F273 HydrophobicContact CG1-CB 4.2Å; V257-F273 HydrophobicContact CG1-CD1 3.95Å; V257-F273 HydrophobicContact CG1-CG 4.49Å; V257-L274 WeakPolarHBondContact CA-O 3.48Å; V257-I275 HydrophobicContact CB-CG1 4.45Å; V257-I275 HydrophobicContact CG1-CD1 4.45Å; V257-I275 HydrophobicContact CG1-CG1 3.95Å; V257-I275 HydrophobicContact CG2-CD1 4.28Å; V257-I275 HydrophobicContact CG2-CG1 4.03Å; V257-I275 HydrophobicContact CG2-CG2 4.5Å; V257-I361 HydrophobicContact CB-CD1 4.4Å; V257-I361 HydrophobicContact CG1-CD1 4.13Å; V257-V363 HydrophobicContact CG2-CG1 4.07Å
258	I	94.7	Very high	88.1	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.6	177.7	-55.6	168.3	0	0	0	106.6	V240 L243 F256 L260 F273 L274 M319	V240-I258 HydrophobicContact CB-CG2 4.45Å; V240-I258 HydrophobicContact CG1-CG2 3.71Å; V240-I258 HydrophobicContact CG2-CG2 3.97Å; L243-I258 HydrophobicContact CD2-CB 4.36Å; L243-I258 HydrophobicContact CD2-CG1 3.88Å; L243-I258 HydrophobicContact CD2-CG2 4.1Å; F256-I258 HydrophobicContact CD1-CD1 4.09Å; F256-I258 HydrophobicContact CD1-CG1 3.87Å; F256-I258 HydrophobicContact CE1-CD1 3.86Å; F256-I258 HydrophobicContact CE1-CG1 3.65Å; I258-L260 HydrophobicContact CG2-CD2 3.72Å; I258-L260 HydrophobicContact CG2-CG 4.35Å; I258-F273 CarbonylContact O-C 3.58Å; I258-F273 VanDerWaalsContact O-CA 3.29Å; I258-F273 WeakPolarHBondContact O-CA 3.37Å; I258-L274 HydrophobicContact CB-CB 4.24Å; I258-L274 HydrophobicContact CD1-CD2 3.93Å; I258-L274 HydrophobicContact CD1-CG 4.3Å; I258-L274 PolarHBondContact N-O 2.89Å; I258-L274 PolarHBondContact O-N 3.16Å; I258-M319 HydrophobicContact CD1-CE 3.92Å; I258-M319 HydrophobicContact CG1-CE 4.47Å
259	S	93.4	Very high	87.5	Confident	11 Å²	11	52.6 Å²	52.6	8%	0.077	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.3	176.8	-178.2	0	0	0	0	110.2	V240 L241 R242 F273	V240-S259 CarbonylContact C-O 3.55Å; V240-S259 WeakPolarHBondContact CA-O 3.18Å; L241-S259 PolarHBondContact N-O 2.95Å; R242-S259 PolarHBondContact O-N 2.79Å; S259-F273 WeakPolarHBondContact OG-CE1 3.46Å
260	L	89.8	Confident	87.4	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.8	-168.1	-59.8	176	0	0	0	111.7	I235 T239 V240 I258 P262 I264 H272 L274	I235-L260 HydrophobicContact CD1-CD1 4.19Å; I235-L260 HydrophobicContact CG2-CD2 3.74Å; T239-L260 WeakPolarHBondContact O-CA 3.31Å; V240-L260 HydrophobicContact CG2-CD2 3.99Å; I258-L260 HydrophobicContact CG2-CD2 3.72Å; I258-L260 HydrophobicContact CG2-CG 4.35Å; L260-P262 CarbonylContact C-O 3.47Å; L260-I264 HydrophobicContact CD1-CD1 4.45Å; L260-I264 HydrophobicContact CD1-CG1 4.3Å; L260-I264 HydrophobicContact CD1-CG2 4.2Å; L260-H272 PolarHBondContact N-O 3.31Å; L260-L274 HydrophobicContact CD1-CB 4.13Å
261	D	82.4	Confident	87.5	Confident	33 Å²	33	50.6 Å²	50.6	18%	0.176	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	109.8	172.4	-175.7	24.8	0	0	0	109.3	T37 T239 L241	T37-D261 WeakPolarHBondContact CB-OD2 3.29Å; T37-D261 WeakPolarHBondContact CG2-OD2 3.21Å; T37-D261 PolarHBondContact OG1-OD2 3.22Å; T239-D261 WeakPolarHBondContact CA-O 3.37Å; T239-D261 PolarHBondContact O-N 2.83Å; L241-D261 HydrophobicContact CD1-CB 3.49Å; L241-D261 VanDerWaalsContact CD1-CB 3.49Å; L241-D261 HydrophobicContact CD2-CB 4.02Å; L241-D261 HydrophobicContact CG-CB 3.63Å
262	P	81.7	Confident	87.7	Confident	79 Å²	79	51 Å²	51	51%	0.513	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-69.6	159.3	0.6	30	-37	0	0	0	113.8	L260	L260-P262 CarbonylContact C-O 3.47Å
263	P	85.4	Confident	87.8	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.078	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	148.2	174.8	30.8	-37.8	0	0	0	112.5	R270 Y271 H272	P263-R270 HydrophobicContact CB-CB 4.16Å; P263-R270 HydrophobicContact CG-CB 4.15Å; P263-R270 HydrophobicContact CG-CG 4.38Å; P263-Y271 WeakPolarHBondContact CA-O 3.3Å; P263-Y271 WeakPolarHBondContact CB-O 3.33Å; P263-H272 HydrophobicContact CB-CB 4.42Å
264	I	85.9	Confident	87.9	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.097	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	148.1	167.5	60.7	176.4	0	0	0	110.9	P211 L226 Y233 I235 L260 R270 Y271	P211-I264 HydrophobicContact CG-CD1 4.36Å; L226-I264 HydrophobicContact CD2-CD1 4.32Å; Y233-I264 HydrophobicContact CD1-CB 4.17Å; Y233-I264 HydrophobicContact CD1-CD1 4.41Å; Y233-I264 HydrophobicContact CD2-CD1 4.27Å; Y233-I264 HydrophobicContact CG-CD1 4.15Å; I235-I264 HydrophobicContact CD1-CD1 4.18Å; I235-I264 HydrophobicContact CD1-CG2 3.68Å; I235-I264 HydrophobicContact CG1-CG2 3.77Å; L260-I264 HydrophobicContact CD1-CD1 4.45Å; L260-I264 HydrophobicContact CD1-CG1 4.3Å; L260-I264 HydrophobicContact CD1-CG2 4.2Å; I264-R270 WeakPolarHBondContact O-CA 3.44Å; I264-Y271 HydrophobicContact CG1-CD2 4.25Å; I264-Y271 PolarHBondContact N-O 2.74Å; I264-Y271 PolarHBondContact O-N 2.95Å
265	K	80.3	Confident	87.9	Confident	61 Å²	61	40.5 Å²	40.5	27%	0.265	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.4	-170.3	-56.5	179.7	-177.3	179.3	0	111.2	Q152 D154 Y233 R270	Q152-K265 PolarHBondContact O-NZ 2.73Å; D154-K265 WeakPolarHBondContact OD2-CD 3.36Å; D154-K265 WeakPolarHBondContact OD2-CE 3.5Å; D154-K265 IonicContact OD2-NZ 2.64Å; D154-K265 PolarHBondContact OD2-NZ 2.55Å; Y233-K265 WeakPolarHBondContact CE1-O 3.46Å; K265-R270 HydrophobicContact CG-CG 4.46Å
266	Q	80.3	Confident	87.9	Confident	42 Å²	42	40 Å²	40	20%	0.196	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	91.9	173.7	-170.8	174.7	1.9	0	0	108.6	F231 Y233 Q268 T269 Y271	F231-Q266 HydrophobicContact CD1-CG 3.98Å; F231-Q266 HydrophobicContact CD2-CG 4.45Å; F231-Q266 HydrophobicContact CE1-CG 3.93Å; F231-Q266 HydrophobicContact CE2-CG 4.42Å; F231-Q266 HydrophobicContact CG-CG 4.25Å; F231-Q266 HydrophobicContact CZ-CG 4.16Å; Y233-Q266 WeakPolarHBondContact OH-CB 3.44Å; Y233-Q266 VanDerWaalsContact OH-CG 3.29Å; Y233-Q266 WeakPolarHBondContact OH-CG 3.26Å; Y233-Q266 PolarHBondContact OH-OE1 3.46Å; Q266-Q268 PolarHBondContact O-N 3.03Å; Q266-T269 PolarHBondContact N-O 3.09Å; Q266-T269 PolarHBondContact O-N 3.43Å; Q266-T269 VanDerWaalsContact O-N 3.1Å; Q266-T269 PolarHBondContact O-OG1 3.17Å; Q266-Y271 HydrophobicContact CB-CD2 4.49Å; Q266-Y271 HydrophobicContact CB-CE2 3.72Å; Q266-Y271 PolarHBondContact OE1-OH 2.89Å
267	G	77.3	Confident	87.8	Confident	71 Å²	71	41.1 Å²	41.1	73%	0.732	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	-125.9	-165.1	0	0	0	0	0	110.4
268	Q	75.3	Confident	87.8	Confident	194 Å²	194	41.3 Å²	41.3	91%	0.907	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.3	178.7	-162.2	175.7	15.2	0	0	113.9	Q266	Q266-Q268 PolarHBondContact O-N 3.03Å
269	T	82.4	Confident	87.7	Confident	74 Å²	74	42.9 Å²	42.9	45%	0.454	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.9	-177.9	53.6	0	0	0	0	112.1	Q266	Q266-T269 PolarHBondContact N-O 3.09Å; Q266-T269 PolarHBondContact O-N 3.43Å; Q266-T269 VanDerWaalsContact O-N 3.1Å; Q266-T269 PolarHBondContact O-OG1 3.17Å
270	R	85.6	Confident	87.6	Confident	72 Å²	72	45.5 Å²	45.5	27%	0.272	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	138	179.3	-66	166.7	173.1	-114.6	18.6	110.9	D154 D155 P263 I264 K265	D154-R270 PolarHBondContact O-NH2 3.46Å; D155-R270 IonicContact OD1-CZ 3.6Å; D155-R270 IonicContact OD1-NH1 3.42Å; D155-R270 PolarHBondContact OD1-NH1 3.11Å; D155-R270 IonicContact OD1-NH2 3.76Å; D155-R270 PolarHBondContact OD1-NH2 2.64Å; D155-R270 IonicContact OD2-CZ 2.67Å; D155-R270 IonicContact OD2-NH1 2.69Å; D155-R270 PolarHBondContact OD2-NH1 2.96Å; D155-R270 IonicContact OD2-NH2 3.35Å; D155-R270 PolarHBondContact OD2-NH2 2.64Å; P263-R270 HydrophobicContact CB-CB 4.16Å; P263-R270 HydrophobicContact CG-CB 4.15Å; P263-R270 HydrophobicContact CG-CG 4.38Å; I264-R270 WeakPolarHBondContact O-CA 3.44Å; K265-R270 HydrophobicContact CG-CG 4.46Å
271	Y	90.8	Very high	87.7	Confident	50 Å²	50	52 Å²	52	20%	0.196	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	100.4	175.3	-55.9	-68.2	0	0	0	110.6	T210 P211 P263 I264 Q266 F273	T210-Y271 HydrophobicContact CG2-CD1 3.38Å; T210-Y271 HydrophobicContact CG2-CE1 3.87Å; T210-Y271 HydrophobicContact CG2-CG 4.21Å; P211-Y271 HydrophobicContact CB-CD2 4.01Å; P211-Y271 HydrophobicContact CB-CE2 3.62Å; P211-Y271 HydrophobicContact CG-CD2 4.35Å; P211-Y271 HydrophobicContact CG-CE2 4.41Å; P263-Y271 WeakPolarHBondContact CA-O 3.3Å; P263-Y271 WeakPolarHBondContact CB-O 3.33Å; I264-Y271 HydrophobicContact CG1-CD2 4.25Å; I264-Y271 PolarHBondContact N-O 2.74Å; I264-Y271 PolarHBondContact O-N 2.95Å; Q266-Y271 HydrophobicContact CB-CD2 4.49Å; Q266-Y271 HydrophobicContact CB-CE2 3.72Å; Q266-Y271 PolarHBondContact OE1-OH 2.89Å; Y271-F273 PolarHBondContact O-N 3.13Å
272	H	90.3	Very high	88.1	Confident	91 Å²	91	54.7 Å²	54.7	42%	0.421	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-8.2	172.3	-61	-96.6	0	0	0	112.9	L260 P263	L260-H272 PolarHBondContact N-O 3.31Å; P263-H272 HydrophobicContact CB-CB 4.42Å
273	F	93.9	Very high	88.5	Confident	26 Å²	26	56.4 Å²	56.4	11%	0.114	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	127.8	177.7	-58.5	-87.2	0	0	0	109.4	T210 V257 I258 S259 Y271 P367 H369	T210-F273 WeakPolarHBondContact CG2-O 3.34Å; V257-F273 HydrophobicContact CG1-CB 4.2Å; V257-F273 HydrophobicContact CG1-CD1 3.95Å; V257-F273 HydrophobicContact CG1-CG 4.49Å; I258-F273 CarbonylContact O-C 3.58Å; I258-F273 VanDerWaalsContact O-CA 3.29Å; I258-F273 WeakPolarHBondContact O-CA 3.37Å; S259-F273 WeakPolarHBondContact OG-CE1 3.46Å; Y271-F273 PolarHBondContact O-N 3.13Å; F273-P367 HydrophobicContact CB-CB 4.06Å; F273-P367 HydrophobicContact CB-CG 3.84Å; F273-P367 HydrophobicContact CD2-CB 4.01Å; F273-P367 HydrophobicContact CD2-CG 3.84Å; F273-P367 HydrophobicContact CG-CB 4.14Å; F273-P367 HydrophobicContact CG-CG 4.16Å; F273-H369 HydrophobicContact CE1-CB 3.92Å; F273-H369 HydrophobicContact CZ-CB 3.84Å
274	L	94.1	Very high	88.8	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	121.6	164.9	167.2	60	0	0	0	107.6	T210 L226 I235 V257 I258 L260 L276	T210-L274 WeakPolarHBondContact O-CA 3.3Å; T210-L274 WeakPolarHBondContact O-CD1 3.44Å; L226-L274 HydrophobicContact CD1-CD2 4.41Å; L226-L274 HydrophobicContact CD2-CD1 3.95Å; L226-L274 HydrophobicContact CD2-CD2 3.99Å; I235-L274 HydrophobicContact CD1-CD2 4.47Å; V257-L274 WeakPolarHBondContact CA-O 3.48Å; I258-L274 HydrophobicContact CB-CB 4.24Å; I258-L274 HydrophobicContact CD1-CD2 3.93Å; I258-L274 HydrophobicContact CD1-CG 4.3Å; I258-L274 PolarHBondContact N-O 2.89Å; I258-L274 PolarHBondContact O-N 3.16Å; L260-L274 HydrophobicContact CD1-CB 4.13Å; L274-L276 HydrophobicContact CD1-CD2 3.92Å; L274-L276 HydrophobicContact CG-CD2 4.17Å
275	I	95.3	Very high	89	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.2	179.5	-62.1	-171.7	0	0	0	109.7	C208 L209 T210 F255 V257 V363 H364 P367	C208-I275 CarbonylContact C-O 3.22Å; C208-I275 WeakPolarHBondContact CA-O 3.46Å; L209-I275 HydrophobicContact CB-CB 4.32Å; L209-I275 HydrophobicContact CB-CG2 4.01Å; L209-I275 HydrophobicContact CD1-CG2 4.05Å; L209-I275 HydrophobicContact CG-CG2 4.34Å; L209-I275 PolarHBondContact N-O 2.92Å; T210-I275 PolarHBondContact O-N 3.31Å; F255-I275 HydrophobicContact CD1-CG2 4.12Å; V257-I275 HydrophobicContact CB-CG1 4.45Å; V257-I275 HydrophobicContact CG1-CD1 4.45Å; V257-I275 HydrophobicContact CG1-CG1 3.95Å; V257-I275 HydrophobicContact CG2-CD1 4.28Å; V257-I275 HydrophobicContact CG2-CG1 4.03Å; V257-I275 HydrophobicContact CG2-CG2 4.5Å; I275-V363 HydrophobicContact CD1-CB 4.28Å; I275-V363 HydrophobicContact CD1-CG1 3.92Å; I275-H364 HydrophobicContact CD1-CB 4.16Å; I275-P367 HydrophobicContact CD1-CB 3.72Å; I275-P367 HydrophobicContact CD1-CG 4.37Å
276	L	95.1	Very high	89.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146.4	168.9	-45.1	-178.6	0	0	0	109.4	L206 Q207 C208 I217 F255 F256 L274 F278 V315	L206-L276 HydrophobicContact CD1-CD1 4.13Å; Q207-L276 WeakPolarHBondContact O-CA 3.4Å; C208-L276 HydrophobicContact CB-CD2 4.43Å; C208-L276 WeakPolarHBondContact SG-CD2 3.34Å; I217-L276 HydrophobicContact CD1-CD1 3.92Å; I217-L276 HydrophobicContact CD1-CD2 4.3Å; F255-L276 WeakPolarHBondContact CA-O 3.4Å; F256-L276 HydrophobicContact CB-CB 4.3Å; F256-L276 HydrophobicContact CD1-CD1 4.09Å; F256-L276 PolarHBondContact N-O 2.7Å; F256-L276 PolarHBondContact O-N 2.86Å; L274-L276 HydrophobicContact CD1-CD2 3.92Å; L274-L276 HydrophobicContact CG-CD2 4.17Å; L276-F278 HydrophobicContact CB-CE2 3.83Å; L276-F278 HydrophobicContact CB-CZ 3.89Å; L276-F278 HydrophobicContact CD1-CE2 4.08Å; L276-F278 HydrophobicContact CD1-CZ 3.65Å; L276-F278 HydrophobicContact CG-CZ 4.43Å; L276-V315 HydrophobicContact CD1-CG1 4.34Å
277	L	94.8	Very high	89.7	Confident	22 Å²	22	61.5 Å²	61.5	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.8	170.2	-176.7	69.9	0	0	0	109	Q207 L209 Q253 F255	Q207-L277 PolarHBondContact O-N 3.39Å; L209-L277 HydrophobicContact CD1-CB 4.06Å; L209-L277 HydrophobicContact CD1-CD2 4.36Å; L209-L277 HydrophobicContact CD2-CB 4.4Å; L209-L277 HydrophobicContact CD2-CD2 4.33Å; L209-L277 HydrophobicContact CG-CB 4.04Å; Q253-L277 HydrophobicContact CB-CD1 4.06Å; F255-L277 HydrophobicContact CD1-CD1 3.73Å; F255-L277 HydrophobicContact CE1-CD1 3.74Å; F255-L277 HydrophobicContact CG-CD1 4.33Å; F255-L277 HydrophobicContact CZ-CD1 4.33Å
278	F	94.5	Very high	90.1	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	151.2	179.2	-59.9	-70	0	0	0	110.9	L206 Q253 M254 F256 L276 L311 V315	L206-F278 HydrophobicContact CD1-CE1 4.11Å; L206-F278 HydrophobicContact CD1-CZ 4.23Å; L206-F278 HydrophobicContact CD2-CE1 3.95Å; Q253-F278 CarbonylContact C-O 3.6Å; Q253-F278 VanDerWaalsContact CA-O 3.26Å; Q253-F278 WeakPolarHBondContact CA-O 3.32Å; Q253-F278 WeakPolarHBondContact CB-O 3.28Å; M254-F278 PolarHBondContact N-O 2.76Å; M254-F278 PolarHBondContact O-N 2.82Å; F256-F278 HydrophobicContact CB-CD2 4.23Å; F256-F278 HydrophobicContact CB-CE2 3.65Å; F256-F278 HydrophobicContact CG-CE2 4.46Å; L276-F278 HydrophobicContact CB-CE2 3.83Å; L276-F278 HydrophobicContact CB-CZ 3.89Å; L276-F278 HydrophobicContact CD1-CE2 4.08Å; L276-F278 HydrophobicContact CD1-CZ 3.65Å; L276-F278 HydrophobicContact CG-CZ 4.43Å; F278-L311 HydrophobicContact CD1-CD2 3.75Å; F278-L311 HydrophobicContact CD1-CG 3.83Å; F278-L311 HydrophobicContact CE1-CD2 3.89Å; F278-L311 HydrophobicContact CE1-CG 3.78Å; F278-V315 HydrophobicContact CE1-CG2 4.33Å; F278-V315 HydrophobicContact CE2-CG1 4.48Å; F278-V315 HydrophobicContact CZ-CB 4.1Å; F278-V315 HydrophobicContact CZ-CG1 4.1Å; F278-V315 HydrophobicContact CZ-CG2 3.91Å
279	S	94.3	Very high	90.7	Very high	35 Å²	35	53.8 Å²	53.8	25%	0.245	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	153.9	159	-168.1	0	0	0	0	110	E281 E282	S279-E281 VanDerWaalsContact C-N 3.3Å; S279-E281 PolarHBondContact OG-N 3.18Å; S279-E282 PolarHBondContact N-OE2 3.26Å
280	K	90.9	Very high	90.6	Very high	66 Å²	66	52.4 Å²	52.4	29%	0.287	26%	0.261	S	S	.	.	S	Bend	trans	-78.3	-17.5	164.4	-72.4	-166.8	-169.7	163.3	0	112.8	Q251 R252 M254 E282 Y312	Q251-K280 WeakPolarHBondContact O-CD 3.39Å; Q251-K280 WeakPolarHBondContact O-CE 3.4Å; Q251-K280 PolarHBondContact O-NZ 2.62Å; R252-K280 PolarHBondContact O-N 3.24Å; M254-K280 HydrophobicContact CG-CD 4.5Å; M254-K280 HydrophobicContact CG-CG 3.79Å; M254-K280 HydrophobicContact SD-CD 4.33Å; M254-K280 WeakPolarHBondContact SD-CE 3.4Å; M254-K280 HydrophobicContact SD-CG 4.24Å; K280-E282 VanDerWaalsContact C-N 3.29Å; K280-Y312 HydrophobicContact CB-CE1 4.44Å; K280-Y312 HydrophobicContact CG-CE1 4.17Å
281	E	90.6	Very high	90.6	Very high	141 Å²	141	51.1 Å²	51.1	66%	0.659	26%	0.263	S	S	*	.	S	Bend	trans	-88.5	5.9	-179.7	-59.7	164.2	-165.1	0	0	112.3	R252 S279	R252-E281 IonicContact NH1-OE1 2.69Å; R252-E281 PolarHBondContact NH1-OE1 2.85Å; S279-E281 VanDerWaalsContact C-N 3.3Å; S279-E281 PolarHBondContact OG-N 3.18Å
282	E	90.6	Very high	90.2	Very high	89 Å²	89	54.5 Å²	54.5	42%	0.416	28%	0.28	S	S	.	.			trans	-106.8	102.3	-173.4	-178.3	173.7	-154.7	0	0	109.9	S279 K280 L311	S279-E282 PolarHBondContact N-OE2 3.26Å; K280-E282 VanDerWaalsContact C-N 3.29Å; E282-L311 VanDerWaalsContact CD-CD2 3.46Å; E282-L311 HydrophobicContact CG-CB 4.11Å; E282-L311 HydrophobicContact CG-CD2 3.76Å; E282-L311 VanDerWaalsContact O-CB 3.27Å; E282-L311 WeakPolarHBondContact O-CB 3.26Å; E282-L311 PolarHBondContact O-N 3.39Å
283	D	90.9	Very high	89.8	Confident	115 Å²	115	58 Å²	58	62%	0.615	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	152.6	-179.7	-66.4	-40.2	0	0	0	113	S310	D283-S310 WeakPolarHBondContact OD1-CA 3.22Å; D283-S310 VanDerWaalsContact OD1-CB 3.32Å; D283-S310 WeakPolarHBondContact OD1-CB 3.14Å; D283-S310 PolarHBondContact OD1-N 2.7Å; D283-S310 PolarHBondContact OD1-OG 3.23Å
284	I	91.9	Very high	89.2	Confident	42 Å²	42	60.4 Å²	60.4	22%	0.215	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.2	177.3	-166.7	167.7	0	0	0	110.9	F203 L286 G309 L311 M314	F203-I284 HydrophobicContact CD1-CD1 4.11Å; I284-L286 HydrophobicContact CD1-CD1 4.21Å; I284-G309 PolarHBondContact N-O 2.87Å; I284-G309 PolarHBondContact O-N 2.81Å; I284-G309 VanDerWaalsContact O-N 3.09Å; I284-L311 HydrophobicContact CB-CD1 4.17Å; I284-L311 HydrophobicContact CD1-CD1 3.87Å; I284-L311 HydrophobicContact CG2-CB 4.33Å; I284-L311 HydrophobicContact CG2-CD1 3.89Å; I284-M314 HydrophobicContact CG2-CB 3.64Å; I284-M314 HydrophobicContact CG2-CE 4.37Å; I284-M314 HydrophobicContact CG2-CG 3.77Å
285	N	89.8	Confident	88.6	Confident	107 Å²	107	60.5 Å²	60.5	57%	0.572	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.6	162.1	-173	-8.7	0	0	0	107.7	M307 S308	N285-M307 PolarHBondContact OD1-O 2.91Å; N285-S308 PolarHBondContact OD1-OG 2.85Å
286	L	88.6	Confident	88	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.047	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	111.3	-172.8	-163.3	79.2	0	0	0	110	C201 F203 I284 L288 M307 M314 V318	C201-L286 HydrophobicContact CB-CD1 4.06Å; C201-L286 HydrophobicContact CB-CD2 4.09Å; C201-L286 HydrophobicContact CB-CG 4.18Å; F203-L286 HydrophobicContact CD1-CD1 4.35Å; F203-L286 HydrophobicContact CE1-CD1 3.94Å; F203-L286 HydrophobicContact CE1-CD2 3.94Å; F203-L286 HydrophobicContact CZ-CD1 4.39Å; F203-L286 HydrophobicContact CZ-CD2 3.77Å; I284-L286 HydrophobicContact CD1-CD1 4.21Å; L286-L288 HydrophobicContact CD2-CD2 4Å; L286-L288 HydrophobicContact CG-CD2 4.47Å; L286-M307 HydrophobicContact CD2-CE 4.28Å; L286-M307 PolarHBondContact N-O 2.79Å; L286-M307 PolarHBondContact O-N 3.42Å; L286-M314 HydrophobicContact CB-CG 4Å; L286-M314 HydrophobicContact CB-SD 4.1Å; L286-M314 HydrophobicContact CD2-CG 3.83Å; L286-M314 HydrophobicContact CD2-SD 4.27Å; L286-M314 HydrophobicContact CG-CG 4.47Å; L286-V318 HydrophobicContact CD2-CG2 3.93Å
287	T	86.8	Confident	87.5	Confident	83 Å²	83	74.1 Å²	74.1	51%	0.509	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	127.5	164.9	-56.8	0	0	0	0	109.2	K305 N306	T287-K305 CarbonylContact C-O 3.39Å; T287-K305 VanDerWaalsContact CA-O 3.32Å; T287-K305 WeakPolarHBondContact CA-O 3.2Å; T287-N306 WeakPolarHBondContact CB-OD1 3.14Å; T287-N306 WeakPolarHBondContact CG2-OD1 3.14Å; T287-N306 PolarHBondContact OG1-OD1 2.9Å
288	L	86.5	Confident	86.8	Confident	3 Å²	3	80.7 Å²	80.7	2%	0.016	40%	0.396	C	S	.	.			trans	-82.1	134.2	171.4	-54.5	-176.9	0	0	0	109.5	V200 C201 L286 M290 V295 L303 S304 K305 M307	V200-L288 HydrophobicContact CG1-CB 4.45Å; V200-L288 HydrophobicContact CG1-CD2 4.43Å; V200-L288 CarbonylContact O-C 3.47Å; V200-L288 WeakPolarHBondContact O-CA 3.45Å; C201-L288 HydrophobicContact CB-CD2 3.97Å; L286-L288 HydrophobicContact CD2-CD2 4Å; L286-L288 HydrophobicContact CG-CD2 4.47Å; L288-M290 PolarHBondContact O-N 3.35Å; L288-V295 HydrophobicContact CD1-CG1 4.35Å; L288-V295 HydrophobicContact CD1-CG2 4.04Å; L288-L303 HydrophobicContact CD1-CB 4.21Å; L288-L303 HydrophobicContact CD1-CD1 4.22Å; L288-S304 WeakPolarHBondContact CD1-O 3.16Å; L288-K305 PolarHBondContact N-O 3.23Å; L288-M307 HydrophobicContact CD1-CE 3.99Å; L288-M307 HydrophobicContact CD2-CE 3.98Å; L288-M307 HydrophobicContact CG-CE 4.05Å
289	N	86.6	Confident	86.2	Confident	99 Å²	99	81.3 Å²	81.3	53%	0.529	40%	0.398	S	S	.	.	S	Bend	trans	-80.1	58.6	178.4	-168	28.3	0	0	0	111.7	D198 V200	D198-N289 VanDerWaalsContact CB-ND2 3.33Å; D198-N289 WeakPolarHBondContact CB-ND2 3.38Å; V200-N289 PolarHBondContact O-N 3.4Å
290	M	81	Confident	85.5	Confident	45 Å²	45	86 Å²	86	22%	0.222	42%	0.417	C	S	.	.	S	Bend	trans	-148.3	162.8	-176.6	-66.1	-171.4	66.2	0	0	110.8	V200 L288 D294 V295 R298 F299 K305	V200-M290 HydrophobicContact CG1-CG 4.1Å; V200-M290 HydrophobicContact CG1-SD 3.69Å; V200-M290 HydrophobicContact CG2-SD 4.04Å; L288-M290 PolarHBondContact O-N 3.35Å; M290-D294 HydrophobicContact CE-CB 3.76Å; M290-V295 HydrophobicContact CB-CG2 3.75Å; M290-R298 HydrophobicContact CE-CG 4.07Å; M290-F299 HydrophobicContact SD-CE2 4.3Å; M290-K305 WeakPolarHBondContact O-CD 3.37Å
291	S	84.9	Confident	84.9	Confident	46 Å²	46	84.9 Å²	84.9	32%	0.322	42%	0.424	S	S	.	.			trans	-71.5	160.8	169.5	83.1	0	0	0	0	111	D294 V295	S291-D294 WeakPolarHBondContact CB-OD2 3.41Å; S291-D294 VanDerWaalsContact OG-CB 3.26Å; S291-D294 WeakPolarHBondContact OG-CB 3.45Å; S291-D294 PolarHBondContact OG-N 2.95Å; S291-D294 PolarHBondContact OG-OD2 2.8Å; S291-V295 WeakPolarHBondContact O-CB 3.37Å; S291-V295 VanDerWaalsContact O-CG2 3.26Å; S291-V295 WeakPolarHBondContact O-CG2 3.47Å; S291-V295 PolarHBondContact O-N 3.23Å
292	E	83.2	Confident	84.5	Confident	120 Å²	120	82.3 Å²	82.3	56%	0.561	41%	0.41	S	S	*	.	H	α-helix	trans	-72.5	-36.3	-179	-66.6	172.1	-148.6	0	0	110.7	V295 E296 K305	E292-V295 PolarHBondContact O-N 3.39Å; E292-E296 PolarHBondContact O-N 2.79Å; E292-K305 HydrophobicContact CG-CB 3.77Å; E292-K305 HydrophobicContact CG-CD 3.31Å; E292-K305 HydrophobicContact CG-CG 4.25Å; E292-K305 WeakPolarHBondContact OE1-CD 3.11Å; E292-K305 IonicContact OE1-NZ 3.66Å; E292-K305 PolarHBondContact OE1-NZ 2.93Å
293	E	81.9	Confident	84.3	Confident	166 Å²	166	78.5 Å²	78.5	78%	0.776	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-43.8	172.7	-62.5	172.7	-151.4	0	0	112.3	V295 E296 K297	E293-V295 VanDerWaalsContact C-N 3.35Å; E293-E296 PolarHBondContact O-N 2.83Å; E293-K297 WeakPolarHBondContact O-CB 3.46Å; E293-K297 PolarHBondContact O-N 2.9Å
294	D	80.4	Confident	84.1	Confident	75 Å²	75	76.1 Å²	76.1	40%	0.401	39%	0.385	S	S	.	.	H	α-helix	trans	-67.2	-35.8	176.2	-73.5	-60.1	0	0	0	112	M290 S291 R298	M290-D294 HydrophobicContact CE-CB 3.76Å; S291-D294 WeakPolarHBondContact CB-OD2 3.41Å; S291-D294 VanDerWaalsContact OG-CB 3.26Å; S291-D294 WeakPolarHBondContact OG-CB 3.45Å; S291-D294 PolarHBondContact OG-N 2.95Å; S291-D294 PolarHBondContact OG-OD2 2.8Å; D294-R298 WeakPolarHBondContact O-CB 3.44Å; D294-R298 WeakPolarHBondContact O-CG 3.34Å; D294-R298 PolarHBondContact O-N 3.07Å
295	V	81.8	Confident	83.9	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.018	39%	0.388	C	S	.	.	H	α-helix	trans	-64.4	-48.3	175.8	164.9	0	0	0	0	110.3	L288 M290 S291 E292 E293 K297 R298 F299 L303	L288-V295 HydrophobicContact CD1-CG1 4.35Å; L288-V295 HydrophobicContact CD1-CG2 4.04Å; M290-V295 HydrophobicContact CB-CG2 3.75Å; S291-V295 WeakPolarHBondContact O-CB 3.37Å; S291-V295 VanDerWaalsContact O-CG2 3.26Å; S291-V295 WeakPolarHBondContact O-CG2 3.47Å; S291-V295 PolarHBondContact O-N 3.23Å; E292-V295 PolarHBondContact O-N 3.39Å; E293-V295 VanDerWaalsContact C-N 3.35Å; V295-K297 PolarHBondContact O-N 3.38Å; V295-R298 PolarHBondContact O-N 3.12Å; V295-F299 HydrophobicContact CB-CD2 4.46Å; V295-F299 HydrophobicContact CG1-CD2 4.13Å; V295-F299 WeakPolarHBondContact O-CB 3.23Å; V295-F299 WeakPolarHBondContact O-CD2 3.5Å; V295-F299 PolarHBondContact O-N 3.46Å; V295-L303 HydrophobicContact CG1-CB 4.37Å; V295-L303 WeakPolarHBondContact CG1-O 3.48Å
296	E	83.7	Confident	83.8	Confident	107 Å²	107	76.2 Å²	76.2	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-49.6	176.9	-170.9	55	-134.2	0	0	111.1	E292 E293 R298 F299 E300 G301	E292-E296 PolarHBondContact O-N 2.79Å; E293-E296 PolarHBondContact O-N 2.83Å; E296-R298 PolarHBondContact O-N 2.97Å; E296-F299 PolarHBondContact O-N 3.29Å; E296-E300 WeakPolarHBondContact O-CA 3.37Å; E296-E300 PolarHBondContact O-N 3.41Å; E296-G301 VanDerWaalsContact OE1-CA 3.22Å; E296-G301 WeakPolarHBondContact OE1-CA 3.06Å; E296-G301 PolarHBondContact OE1-N 3.48Å; E296-G301 VanDerWaalsContact OE2-CA 3.32Å; E296-G301 WeakPolarHBondContact OE2-CA 3.23Å
297	K	84.6	Confident	83.8	Confident	179 Å²	179	76.4 Å²	76.4	78%	0.778	38%	0.384	S	S	*	.	H	α-helix	trans	-65.6	-29.8	-179.9	-173.8	176.5	-178.7	178.1	0	114.2	E293 V295	E293-K297 WeakPolarHBondContact O-CB 3.46Å; E293-K297 PolarHBondContact O-N 2.9Å; V295-K297 PolarHBondContact O-N 3.38Å
298	R	79.5	Confident	83.9	Confident	161 Å²	161	76.7 Å²	76.7	61%	0.608	39%	0.39	S	S	*	.	H	α-helix	trans	-86	-34	177.8	-79	-81.2	-170.8	166.2	-0.2	113.6	M290 D294 V295 E296	M290-R298 HydrophobicContact CE-CG 4.07Å; D294-R298 WeakPolarHBondContact O-CB 3.44Å; D294-R298 WeakPolarHBondContact O-CG 3.34Å; D294-R298 PolarHBondContact O-N 3.07Å; V295-R298 PolarHBondContact O-N 3.12Å; E296-R298 PolarHBondContact O-N 2.97Å
299	F	81.2	Confident	84.2	Confident	16 Å²	16	77.7 Å²	77.7	7%	0.07	40%	0.4	C	S	.	.	H	α-helix	trans	-117.6	0.4	-166.6	-59.1	-65.7	0	0	0	114.4	M290 V295 E296 G301 K302 L303 A321 L322	M290-F299 HydrophobicContact SD-CE2 4.3Å; V295-F299 HydrophobicContact CB-CD2 4.46Å; V295-F299 HydrophobicContact CG1-CD2 4.13Å; V295-F299 WeakPolarHBondContact O-CB 3.23Å; V295-F299 WeakPolarHBondContact O-CD2 3.5Å; V295-F299 PolarHBondContact O-N 3.46Å; E296-F299 PolarHBondContact O-N 3.29Å; F299-G301 PolarHBondContact O-N 2.89Å; F299-K302 WeakPolarHBondContact O-CB 3.47Å; F299-K302 WeakPolarHBondContact O-CD 3.47Å; F299-K302 WeakPolarHBondContact O-CG 3.46Å; F299-K302 PolarHBondContact O-N 2.91Å; F299-K302 VanDerWaalsContact O-N 3.16Å; F299-L303 HydrophobicContact CB-CB 4.42Å; F299-L303 HydrophobicContact CB-CG 4.39Å; F299-L303 HydrophobicContact CD1-CD1 4.01Å; F299-L303 HydrophobicContact CD2-CB 4.47Å; F299-L303 HydrophobicContact CD2-CD1 3.98Å; F299-L303 HydrophobicContact CE1-CD1 4.18Å; F299-L303 HydrophobicContact CE2-CD1 4.15Å; F299-L303 HydrophobicContact CG-CD1 3.9Å; F299-L303 HydrophobicContact CG-CG 4.31Å; F299-L303 HydrophobicContact CZ-CD1 4.25Å; F299-A321 HydrophobicContact CD1-CB 3.89Å; F299-A321 HydrophobicContact CE1-CB 4.49Å; F299-L322 HydrophobicContact CE1-CD2 3.85Å; F299-L322 HydrophobicContact CE1-CG 4.3Å; F299-L322 HydrophobicContact CZ-CD2 4.1Å
300	E	81	Confident	84.5	Confident	134 Å²	134	74 Å²	74	63%	0.626	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	51	177.4	-55.2	163.9	-159.5	0	0	111.3	E296 K302	E296-E300 WeakPolarHBondContact O-CA 3.37Å; E296-E300 PolarHBondContact O-N 3.41Å; E300-K302 PolarHBondContact O-N 3.23Å; E300-K302 IonicContact OE1-NZ 3.49Å; E300-K302 VanDerWaalsContact OE2-CE 3.32Å; E300-K302 WeakPolarHBondContact OE2-CE 3.45Å; E300-K302 IonicContact OE2-NZ 2.74Å; E300-K302 PolarHBondContact OE2-NZ 3.13Å
301	G	77.8	Confident	85	Confident	43 Å²	43	72.3 Å²	72.3	44%	0.443	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	3.8	-178.1	0	0	0	0	0	116.4	E296 F299 L303	E296-G301 VanDerWaalsContact OE1-CA 3.22Å; E296-G301 WeakPolarHBondContact OE1-CA 3.06Å; E296-G301 PolarHBondContact OE1-N 3.48Å; E296-G301 VanDerWaalsContact OE2-CA 3.32Å; E296-G301 WeakPolarHBondContact OE2-CA 3.23Å; F299-G301 PolarHBondContact O-N 2.89Å; G301-L303 VanDerWaalsContact C-N 3.31Å; G301-L303 PolarHBondContact O-N 2.89Å
302	K	82.6	Confident	85.4	Confident	86 Å²	86	72.4 Å²	72.4	37%	0.374	37%	0.368	S	S	.	.	S	Bend	trans	-75.4	-16.4	-174.8	-62.6	163.9	-158.1	149.3	0	114.1	F299 E300 A321	F299-K302 WeakPolarHBondContact O-CB 3.47Å; F299-K302 WeakPolarHBondContact O-CD 3.47Å; F299-K302 WeakPolarHBondContact O-CG 3.46Å; F299-K302 PolarHBondContact O-N 2.91Å; F299-K302 VanDerWaalsContact O-N 3.16Å; E300-K302 PolarHBondContact O-N 3.23Å; E300-K302 IonicContact OE1-NZ 3.49Å; E300-K302 VanDerWaalsContact OE2-CE 3.32Å; E300-K302 WeakPolarHBondContact OE2-CE 3.45Å; E300-K302 IonicContact OE2-NZ 2.74Å; E300-K302 PolarHBondContact OE2-NZ 3.13Å; K302-A321 HydrophobicContact CB-CB 4.35Å
303	L	85.9	Confident	85.9	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.052	36%	0.356	C	S	.	.			trans	-135.8	146.9	177.6	-58.8	178.9	0	0	0	108.9	L288 V295 F299 G301 M307 R317 V318 A321	L288-L303 HydrophobicContact CD1-CB 4.21Å; L288-L303 HydrophobicContact CD1-CD1 4.22Å; V295-L303 HydrophobicContact CG1-CB 4.37Å; V295-L303 WeakPolarHBondContact CG1-O 3.48Å; F299-L303 HydrophobicContact CB-CB 4.42Å; F299-L303 HydrophobicContact CB-CG 4.39Å; F299-L303 HydrophobicContact CD1-CD1 4.01Å; F299-L303 HydrophobicContact CD2-CB 4.47Å; F299-L303 HydrophobicContact CD2-CD1 3.98Å; F299-L303 HydrophobicContact CE1-CD1 4.18Å; F299-L303 HydrophobicContact CE2-CD1 4.15Å; F299-L303 HydrophobicContact CG-CD1 3.9Å; F299-L303 HydrophobicContact CG-CG 4.31Å; F299-L303 HydrophobicContact CZ-CD1 4.25Å; G301-L303 VanDerWaalsContact C-N 3.31Å; G301-L303 PolarHBondContact O-N 2.89Å; L303-M307 HydrophobicContact CB-CE 4.25Å; L303-M307 HydrophobicContact CB-SD 4.1Å; L303-M307 HydrophobicContact CD2-CE 4.05Å; L303-M307 HydrophobicContact CD2-SD 3.82Å; L303-R317 HydrophobicContact CD2-CB 4.29Å; L303-V318 HydrophobicContact CD1-CG2 4.43Å; L303-V318 HydrophobicContact CD2-CG2 4.15Å; L303-A321 HydrophobicContact CD1-CB 3.77Å; L303-A321 HydrophobicContact CD2-CB 4.1Å; L303-A321 HydrophobicContact CG-CB 3.77Å
304	S	86.1	Confident	86.3	Confident	64 Å²	64	62.1 Å²	62.1	45%	0.448	32%	0.32	S	S	.	.			trans	-104.9	157.8	165.6	52.3	0	0	0	0	110	L288 N306 M307	L288-S304 WeakPolarHBondContact CD1-O 3.16Å; S304-N306 VanDerWaalsContact C-N 3.29Å; S304-N306 PolarHBondContact O-N 3.27Å; S304-N306 PolarHBondContact OG-O 3.1Å; S304-M307 WeakPolarHBondContact O-CE 3.13Å; S304-M307 WeakPolarHBondContact O-CG 3.31Å; S304-M307 WeakPolarHBondContact OG-CG 3.35Å
305	K	87	Confident	86.9	Confident	64 Å²	64	58.7 Å²	58.7	28%	0.278	30%	0.302	S	S	.	.	S	Bend	trans	-62.1	-35.1	179.9	176	179.7	165.1	-162.4	0	113.4	T287 L288 M290 E292	T287-K305 CarbonylContact C-O 3.39Å; T287-K305 VanDerWaalsContact CA-O 3.32Å; T287-K305 WeakPolarHBondContact CA-O 3.2Å; L288-K305 PolarHBondContact N-O 3.23Å; M290-K305 WeakPolarHBondContact O-CD 3.37Å; E292-K305 HydrophobicContact CG-CB 3.77Å; E292-K305 HydrophobicContact CG-CD 3.31Å; E292-K305 HydrophobicContact CG-CG 4.25Å; E292-K305 WeakPolarHBondContact OE1-CD 3.11Å; E292-K305 IonicContact OE1-NZ 3.66Å; E292-K305 PolarHBondContact OE1-NZ 2.93Å
306	N	88.7	Confident	87.3	Confident	88 Å²	88	59 Å²	59	47%	0.471	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.8	169	-64.9	-61.3	0	0	0	108.6	T287 S304	T287-N306 WeakPolarHBondContact CB-OD1 3.14Å; T287-N306 WeakPolarHBondContact CG2-OD1 3.14Å; T287-N306 PolarHBondContact OG1-OD1 2.9Å; S304-N306 VanDerWaalsContact C-N 3.29Å; S304-N306 PolarHBondContact O-N 3.27Å; S304-N306 PolarHBondContact OG-O 3.1Å
307	M	88.4	Confident	87.7	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.059	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.1	178.5	-67.5	176.5	-70	0	0	110.2	N285 L286 L288 L303 S304 M314 V318	N285-M307 PolarHBondContact OD1-O 2.91Å; L286-M307 HydrophobicContact CD2-CE 4.28Å; L286-M307 PolarHBondContact N-O 2.79Å; L286-M307 PolarHBondContact O-N 3.42Å; L288-M307 HydrophobicContact CD1-CE 3.99Å; L288-M307 HydrophobicContact CD2-CE 3.98Å; L288-M307 HydrophobicContact CG-CE 4.05Å; L303-M307 HydrophobicContact CB-CE 4.25Å; L303-M307 HydrophobicContact CB-SD 4.1Å; L303-M307 HydrophobicContact CD2-CE 4.05Å; L303-M307 HydrophobicContact CD2-SD 3.82Å; S304-M307 WeakPolarHBondContact O-CE 3.13Å; S304-M307 WeakPolarHBondContact O-CG 3.31Å; S304-M307 WeakPolarHBondContact OG-CG 3.35Å; M307-M314 VanDerWaalsContact C-CE 3.48Å; M307-M314 HydrophobicContact CB-CE 3.68Å; M307-M314 HydrophobicContact CB-SD 3.49Å; M307-M314 WeakPolarHBondContact CB-SD 3.4Å; M307-M314 HydrophobicContact CE-SD 4.16Å; M307-M314 HydrophobicContact CG-SD 4.42Å; M307-M314 VanDerWaalsContact O-CE 3.24Å; M307-M314 WeakPolarHBondContact O-CE 3.26Å; M307-M314 HydrophobicContact SD-SD 4.21Å; M307-V318 HydrophobicContact CE-CG2 4.1Å
308	S	89.5	Confident	87.9	Confident	90 Å²	90	51 Å²	51	63%	0.629	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	141.2	173.8	-60.8	0	0	0	0	110.6	N285 M314	N285-S308 PolarHBondContact OD1-OG 2.85Å; S308-M314 VanDerWaalsContact C-CE 3.48Å
309	G	91.5	Very high	88.5	Confident	23 Å²	23	43.5 Å²	43.5	24%	0.237	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.3	-176	175.5	0	0	0	0	0	112.4	I284	I284-G309 PolarHBondContact N-O 2.87Å; I284-G309 PolarHBondContact O-N 2.81Å; I284-G309 VanDerWaalsContact O-N 3.09Å
310	S	93.4	Very high	88.9	Confident	22 Å²	22	47.9 Å²	47.9	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	139.8	-176.9	-52	0	0	0	0	112.7	D283 Y312 E313 M314	D283-S310 WeakPolarHBondContact OD1-CA 3.22Å; D283-S310 VanDerWaalsContact OD1-CB 3.32Å; D283-S310 WeakPolarHBondContact OD1-CB 3.14Å; D283-S310 PolarHBondContact OD1-N 2.7Å; D283-S310 PolarHBondContact OD1-OG 3.23Å; S310-Y312 VanDerWaalsContact C-N 3.3Å; S310-Y312 PolarHBondContact O-N 3.15Å; S310-E313 CarbonylContact O-C 3.59Å; S310-E313 WeakPolarHBondContact O-CA 3.4Å; S310-E313 WeakPolarHBondContact O-CB 3.44Å; S310-E313 PolarHBondContact O-N 3.24Å; S310-M314 PolarHBondContact O-N 3.1Å
311	L	92.9	Very high	89.3	Confident	9 Å²	9	42.1 Å²	42.1	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-56.3	-42.4	-171.1	177.7	60.7	0	0	0	112.6	F203 L206 F278 E282 I284 E313 M314 V315	F203-L311 HydrophobicContact CD1-CD1 3.82Å; F203-L311 HydrophobicContact CE1-CD1 4.36Å; L206-L311 HydrophobicContact CD2-CD1 4.37Å; L206-L311 HydrophobicContact CD2-CD2 3.85Å; L206-L311 HydrophobicContact CD2-CG 4.48Å; F278-L311 HydrophobicContact CD1-CD2 3.75Å; F278-L311 HydrophobicContact CD1-CG 3.83Å; F278-L311 HydrophobicContact CE1-CD2 3.89Å; F278-L311 HydrophobicContact CE1-CG 3.78Å; E282-L311 VanDerWaalsContact CD-CD2 3.46Å; E282-L311 HydrophobicContact CG-CB 4.11Å; E282-L311 HydrophobicContact CG-CD2 3.76Å; E282-L311 VanDerWaalsContact O-CB 3.27Å; E282-L311 WeakPolarHBondContact O-CB 3.26Å; E282-L311 PolarHBondContact O-N 3.39Å; I284-L311 HydrophobicContact CB-CD1 4.17Å; I284-L311 HydrophobicContact CD1-CD1 3.87Å; I284-L311 HydrophobicContact CG2-CB 4.33Å; I284-L311 HydrophobicContact CG2-CD1 3.89Å; L311-E313 VanDerWaalsContact C-N 3.3Å; L311-E313 PolarHBondContact O-N 2.72Å; L311-M314 PolarHBondContact O-N 2.82Å; L311-V315 HydrophobicContact CD1-CG2 4.08Å; L311-V315 WeakPolarHBondContact O-CB 3.31Å; L311-V315 VanDerWaalsContact O-CG2 3.32Å; L311-V315 WeakPolarHBondContact O-CG2 3.28Å; L311-V315 PolarHBondContact O-N 3.44Å
312	Y	93.3	Very high	89.7	Confident	48 Å²	48	41.3 Å²	41.3	19%	0.188	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-37	175.7	75.3	-91.4	0	0	0	112.2	L245 M254 K280 S310 S316	L245-Y312 HydrophobicContact CD1-CD2 3.97Å; L245-Y312 HydrophobicContact CD2-CD2 4.25Å; M254-Y312 HydrophobicContact CB-CD2 4.25Å; M254-Y312 HydrophobicContact CB-CG 4.02Å; M254-Y312 HydrophobicContact CE-CD2 4.28Å; M254-Y312 HydrophobicContact CE-CE2 4.24Å; M254-Y312 HydrophobicContact CG-CD1 3.94Å; M254-Y312 HydrophobicContact CG-CD2 3.79Å; M254-Y312 HydrophobicContact CG-CE1 4.22Å; M254-Y312 HydrophobicContact CG-CE2 4.06Å; M254-Y312 HydrophobicContact CG-CG 3.73Å; K280-Y312 HydrophobicContact CB-CE1 4.44Å; K280-Y312 HydrophobicContact CG-CE1 4.17Å; S310-Y312 VanDerWaalsContact C-N 3.3Å; S310-Y312 PolarHBondContact O-N 3.15Å; Y312-S316 VanDerWaalsContact O-CB 3.27Å; Y312-S316 WeakPolarHBondContact O-CB 3.47Å; Y312-S316 PolarHBondContact O-N 3.49Å; Y312-S316 VanDerWaalsContact O-N 3.09Å; Y312-S316 PolarHBondContact O-OG 2.7Å
313	E	91.7	Very high	89.9	Confident	68 Å²	68	38 Å²	38	32%	0.318	20%	0.202	S	C	.	.	H	α-helix	trans	-71	-47	177.3	-167.3	-172.9	177.9	0	0	109.7	S310 L311 V315 S316 R317	S310-E313 CarbonylContact O-C 3.59Å; S310-E313 WeakPolarHBondContact O-CA 3.4Å; S310-E313 WeakPolarHBondContact O-CB 3.44Å; S310-E313 PolarHBondContact O-N 3.24Å; L311-E313 VanDerWaalsContact C-N 3.3Å; L311-E313 PolarHBondContact O-N 2.72Å; E313-V315 PolarHBondContact O-N 2.83Å; E313-S316 CarbonylContact O-C 3.59Å; E313-S316 WeakPolarHBondContact O-CA 3.4Å; E313-S316 WeakPolarHBondContact O-CB 3.43Å; E313-S316 PolarHBondContact O-N 3.24Å; E313-S316 PolarHBondContact O-OG 3.13Å; E313-R317 HydrophobicContact CG-CG 4.29Å; E313-R317 WeakPolarHBondContact O-CG 3.38Å; E313-R317 PolarHBondContact O-N 2.95Å; E313-R317 IonicContact OE1-CZ 3.87Å; E313-R317 IonicContact OE1-NE 3.32Å; E313-R317 PolarHBondContact OE1-NE 3.02Å; E313-R317 IonicContact OE1-NH2 3.38Å; E313-R317 PolarHBondContact OE1-NH2 3.28Å; E313-R317 IonicContact OE2-NH2 2.69Å
314	M	91.4	Very high	89.9	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-50.5	179.5	-162.1	63.8	64.6	0	0	112	F203 I284 L286 M307 S308 S310 L311 S316 R317 V318	F203-M314 HydrophobicContact CE1-CB 4.39Å; F203-M314 HydrophobicContact CE1-CG 4.05Å; F203-M314 HydrophobicContact CZ-CG 4.46Å; I284-M314 HydrophobicContact CG2-CB 3.64Å; I284-M314 HydrophobicContact CG2-CE 4.37Å; I284-M314 HydrophobicContact CG2-CG 3.77Å; L286-M314 HydrophobicContact CB-CG 4Å; L286-M314 HydrophobicContact CB-SD 4.1Å; L286-M314 HydrophobicContact CD2-CG 3.83Å; L286-M314 HydrophobicContact CD2-SD 4.27Å; L286-M314 HydrophobicContact CG-CG 4.47Å; M307-M314 VanDerWaalsContact C-CE 3.48Å; M307-M314 HydrophobicContact CB-CE 3.68Å; M307-M314 HydrophobicContact CB-SD 3.49Å; M307-M314 WeakPolarHBondContact CB-SD 3.4Å; M307-M314 HydrophobicContact CE-SD 4.16Å; M307-M314 HydrophobicContact CG-SD 4.42Å; M307-M314 VanDerWaalsContact O-CE 3.24Å; M307-M314 WeakPolarHBondContact O-CE 3.26Å; M307-M314 HydrophobicContact SD-SD 4.21Å; S308-M314 VanDerWaalsContact C-CE 3.48Å; S310-M314 PolarHBondContact O-N 3.1Å; L311-M314 PolarHBondContact O-N 2.82Å; M314-S316 VanDerWaalsContact C-N 3.28Å; M314-S316 PolarHBondContact O-N 3.4Å; M314-R317 PolarHBondContact O-N 3.46Å; M314-V318 WeakPolarHBondContact O-CB 3.46Å; M314-V318 WeakPolarHBondContact O-CG2 3.11Å; M314-V318 PolarHBondContact O-N 2.99Å
315	V	92.4	Very high	89.8	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-42.6	174.3	170.7	0	0	0	0	110.3	F203 L206 F256 L276 F278 L311 E313 M319	F203-V315 HydrophobicContact CD1-CG2 3.6Å; F203-V315 HydrophobicContact CD2-CG2 4.15Å; F203-V315 HydrophobicContact CE1-CG2 3.58Å; F203-V315 HydrophobicContact CE2-CG2 4.12Å; F203-V315 HydrophobicContact CG-CG2 3.89Å; F203-V315 HydrophobicContact CZ-CG2 3.84Å; L206-V315 HydrophobicContact CD1-CG2 4.47Å; F256-V315 HydrophobicContact CD1-CG1 4.1Å; F256-V315 HydrophobicContact CE1-CG1 4.05Å; L276-V315 HydrophobicContact CD1-CG1 4.34Å; F278-V315 HydrophobicContact CE1-CG2 4.33Å; F278-V315 HydrophobicContact CE2-CG1 4.48Å; F278-V315 HydrophobicContact CZ-CB 4.1Å; F278-V315 HydrophobicContact CZ-CG1 4.1Å; F278-V315 HydrophobicContact CZ-CG2 3.91Å; L311-V315 HydrophobicContact CD1-CG2 4.08Å; L311-V315 WeakPolarHBondContact O-CB 3.31Å; L311-V315 VanDerWaalsContact O-CG2 3.32Å; L311-V315 WeakPolarHBondContact O-CG2 3.28Å; L311-V315 PolarHBondContact O-N 3.44Å; E313-V315 PolarHBondContact O-N 2.83Å; V315-M319 HydrophobicContact CG1-CG 4.18Å; V315-M319 WeakPolarHBondContact O-CB 3.31Å; V315-M319 WeakPolarHBondContact O-CG 3.46Å; V315-M319 PolarHBondContact O-N 2.92Å
316	S	91.6	Very high	89.9	Confident	8 Å²	8	52.9 Å²	52.9	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-67	-40.5	179.7	83.2	0	0	0	0	113.4	Y312 E313 M314 K320	Y312-S316 VanDerWaalsContact O-CB 3.27Å; Y312-S316 WeakPolarHBondContact O-CB 3.47Å; Y312-S316 PolarHBondContact O-N 3.49Å; Y312-S316 VanDerWaalsContact O-N 3.09Å; Y312-S316 PolarHBondContact O-OG 2.7Å; E313-S316 CarbonylContact O-C 3.59Å; E313-S316 WeakPolarHBondContact O-CA 3.4Å; E313-S316 WeakPolarHBondContact O-CB 3.43Å; E313-S316 PolarHBondContact O-N 3.24Å; E313-S316 PolarHBondContact O-OG 3.13Å; M314-S316 VanDerWaalsContact C-N 3.28Å; M314-S316 PolarHBondContact O-N 3.4Å; S316-K320 WeakPolarHBondContact O-CB 3.15Å; S316-K320 PolarHBondContact O-N 3.35Å
317	R	90.3	Very high	90	Very high	117 Å²	117	50.5 Å²	50.5	44%	0.442	25%	0.247	S	C	.	.	H	α-helix	trans	-63.1	-51.2	176.9	-73.3	179.1	178.9	-154.7	9	110.6	L303 E313 M314 K320 A321	L303-R317 HydrophobicContact CD2-CB 4.29Å; E313-R317 HydrophobicContact CG-CG 4.29Å; E313-R317 WeakPolarHBondContact O-CG 3.38Å; E313-R317 PolarHBondContact O-N 2.95Å; E313-R317 IonicContact OE1-CZ 3.87Å; E313-R317 IonicContact OE1-NE 3.32Å; E313-R317 PolarHBondContact OE1-NE 3.02Å; E313-R317 IonicContact OE1-NH2 3.38Å; E313-R317 PolarHBondContact OE1-NH2 3.28Å; E313-R317 IonicContact OE2-NH2 2.69Å; M314-R317 PolarHBondContact O-N 3.46Å; R317-K320 PolarHBondContact O-N 3.1Å; R317-A321 PolarHBondContact O-N 3.1Å
318	V	90.8	Very high	90.2	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-48.8	178.7	170.2	0	0	0	0	111.1	F203 I219 L286 L303 M307 M314 K320 A321 L322	F203-V318 HydrophobicContact CE2-CG1 4.24Å; F203-V318 HydrophobicContact CZ-CB 4.24Å; F203-V318 HydrophobicContact CZ-CG1 4.37Å; F203-V318 HydrophobicContact CZ-CG2 4.2Å; I219-V318 HydrophobicContact CG1-CG1 4.33Å; L286-V318 HydrophobicContact CD2-CG2 3.93Å; L303-V318 HydrophobicContact CD1-CG2 4.43Å; L303-V318 HydrophobicContact CD2-CG2 4.15Å; M307-V318 HydrophobicContact CE-CG2 4.1Å; M314-V318 WeakPolarHBondContact O-CB 3.46Å; M314-V318 WeakPolarHBondContact O-CG2 3.11Å; M314-V318 PolarHBondContact O-N 2.99Å; V318-K320 PolarHBondContact O-N 3.43Å; V318-A321 PolarHBondContact O-N 3.02Å; V318-L322 HydrophobicContact CG1-CD1 3.49Å; V318-L322 VanDerWaalsContact CG1-CD1 3.49Å; V318-L322 HydrophobicContact CG1-CG 4.44Å; V318-L322 WeakPolarHBondContact O-CD1 3.44Å; V318-L322 WeakPolarHBondContact O-CG 3.29Å; V318-L322 PolarHBondContact O-N 3Å
319	M	90.2	Very high	90.3	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-36.9	177.6	-71.7	-67.6	-61.5	0	0	113.1	I219 L224 L243 F256 I258 V315 A321 V323	I219-M319 HydrophobicContact CD1-SD 4.45Å; L224-M319 HydrophobicContact CD2-CE 3.65Å; L224-M319 HydrophobicContact CD2-SD 3.79Å; L243-M319 HydrophobicContact CD1-CB 3.9Å; L243-M319 HydrophobicContact CD2-CB 4.49Å; L243-M319 HydrophobicContact CD2-CE 3.9Å; F256-M319 HydrophobicContact CE1-CB 4.24Å; F256-M319 HydrophobicContact CE1-CG 4Å; F256-M319 HydrophobicContact CZ-CB 3.91Å; F256-M319 HydrophobicContact CZ-CG 4.17Å; I258-M319 HydrophobicContact CD1-CE 3.92Å; I258-M319 HydrophobicContact CG1-CE 4.47Å; V315-M319 HydrophobicContact CG1-CG 4.18Å; V315-M319 WeakPolarHBondContact O-CB 3.31Å; V315-M319 WeakPolarHBondContact O-CG 3.46Å; V315-M319 PolarHBondContact O-N 2.92Å; M319-A321 VanDerWaalsContact C-N 3.34Å; M319-V323 HydrophobicContact CE-CG2 3.93Å; M319-V323 VanDerWaalsContact O-CB 3.28Å; M319-V323 WeakPolarHBondContact O-CB 3.4Å; M319-V323 VanDerWaalsContact O-CG2 3.26Å; M319-V323 WeakPolarHBondContact O-CG2 3.41Å; M319-V323 PolarHBondContact O-N 3.47Å
320	K	90.9	Very high	90.2	Very high	108 Å²	108	51.1 Å²	51.1	47%	0.47	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-40.5	174.9	176.7	-171.8	173.2	-167.4	0	111.7	S316 R317 V318 N324 I327	S316-K320 WeakPolarHBondContact O-CB 3.15Å; S316-K320 PolarHBondContact O-N 3.35Å; R317-K320 PolarHBondContact O-N 3.1Å; V318-K320 PolarHBondContact O-N 3.43Å; K320-N324 WeakPolarHBondContact O-CA 3.1Å; K320-N324 PolarHBondContact O-N 3.45Å; K320-N324 VanDerWaalsContact O-N 3.13Å; K320-I327 HydrophobicContact CB-CD1 4.04Å; K320-I327 HydrophobicContact CB-CG1 4.18Å; K320-I327 HydrophobicContact CD-CD1 4.12Å; K320-I327 HydrophobicContact CG-CD1 4.45Å
321	A	89.3	Confident	89.6	Confident	12 Å²	12	50.9 Å²	50.9	10%	0.099	24%	0.244	C	C	.	.	H	α-helix	trans	-69.9	-49.4	178.3	0	0	0	0	0	112	F299 K302 L303 R317 V318 M319 N324	F299-A321 HydrophobicContact CD1-CB 3.89Å; F299-A321 HydrophobicContact CE1-CB 4.49Å; K302-A321 HydrophobicContact CB-CB 4.35Å; L303-A321 HydrophobicContact CD1-CB 3.77Å; L303-A321 HydrophobicContact CD2-CB 4.1Å; L303-A321 HydrophobicContact CG-CB 3.77Å; R317-A321 PolarHBondContact O-N 3.1Å; V318-A321 PolarHBondContact O-N 3.02Å; M319-A321 VanDerWaalsContact C-N 3.34Å; A321-N324 PolarHBondContact O-N 3.26Å
322	L	86.7	Confident	89.3	Confident	27 Å²	27	58.8 Å²	58.8	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-43.9	-178.1	-68.5	158.1	0	0	0	113.6	I219 Y237 F299 V318	I219-L322 HydrophobicContact CD1-CD1 4.06Å; I219-L322 HydrophobicContact CG1-CD1 4.38Å; I219-L322 HydrophobicContact CG2-CD1 3.48Å; I219-L322 VanDerWaalsContact CG2-CD1 3.48Å; I219-L322 HydrophobicContact CG2-CD2 4.03Å; I219-L322 HydrophobicContact CG2-CG 4.41Å; Y237-L322 HydrophobicContact CD1-CB 4.44Å; Y237-L322 HydrophobicContact CD2-CB 4.43Å; Y237-L322 HydrophobicContact CE1-CB 4.11Å; Y237-L322 HydrophobicContact CE1-CD1 4.29Å; Y237-L322 HydrophobicContact CE2-CB 4.12Å; Y237-L322 HydrophobicContact CE2-CD2 3.99Å; F299-L322 HydrophobicContact CE1-CD2 3.85Å; F299-L322 HydrophobicContact CE1-CG 4.3Å; F299-L322 HydrophobicContact CZ-CD2 4.1Å; V318-L322 HydrophobicContact CG1-CD1 3.49Å; V318-L322 VanDerWaalsContact CG1-CD1 3.49Å; V318-L322 HydrophobicContact CG1-CG 4.44Å; V318-L322 WeakPolarHBondContact O-CD1 3.44Å; V318-L322 WeakPolarHBondContact O-CG 3.29Å; V318-L322 PolarHBondContact O-N 3Å
323	V	86.5	Confident	89.1	Confident	16 Å²	16	56.8 Å²	56.8	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-85.2	-14.6	-176.8	-172.1	0	0	0	0	111.3	Y237 V240 L243 M319 R325	Y237-V323 HydrophobicContact CD1-CG2 3.83Å; Y237-V323 HydrophobicContact CG-CG2 4.34Å; V240-V323 HydrophobicContact CB-CG1 3.75Å; V240-V323 HydrophobicContact CB-CG2 4.38Å; V240-V323 HydrophobicContact CG1-CG1 3.78Å; V240-V323 HydrophobicContact CG1-CG2 4.37Å; V240-V323 HydrophobicContact CG2-CG2 4.44Å; L243-V323 HydrophobicContact CD1-CB 4.44Å; M319-V323 HydrophobicContact CE-CG2 3.93Å; M319-V323 VanDerWaalsContact O-CB 3.28Å; M319-V323 WeakPolarHBondContact O-CB 3.4Å; M319-V323 VanDerWaalsContact O-CG2 3.26Å; M319-V323 WeakPolarHBondContact O-CG2 3.41Å; M319-V323 PolarHBondContact O-N 3.47Å; V323-R325 HydrophobicContact CG1-CB 4.19Å; V323-R325 HydrophobicContact CG1-CG 3.75Å; V323-R325 PolarHBondContact O-N 3.17Å
324	N	85.8	Confident	89	Confident	109 Å²	109	59.7 Å²	59.7	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	41	-174.1	-156.6	11.2	0	0	0	113.6	K320 A321	K320-N324 WeakPolarHBondContact O-CA 3.1Å; K320-N324 PolarHBondContact O-N 3.45Å; K320-N324 VanDerWaalsContact O-N 3.13Å; A321-N324 PolarHBondContact O-N 3.26Å
325	R	83.4	Confident	88.8	Confident	152 Å²	152	59.8 Å²	59.8	57%	0.574	29%	0.293	S	S	*	.			trans	-121.7	143.3	177.4	-65.9	-65.5	-170.6	-165	-0.1	110.6	V323 I327	V323-R325 HydrophobicContact CG1-CB 4.19Å; V323-R325 HydrophobicContact CG1-CG 3.75Å; V323-R325 PolarHBondContact O-N 3.17Å; R325-I327 PolarHBondContact O-N 2.82Å
326	K	89.1	Confident	88.4	Confident	189 Å²	189	65.8 Å²	65.8	82%	0.822	32%	0.321	S	S	*	.			trans	-65.3	131.9	172.7	-64.2	-173.6	178.8	-175.1	0	109.9
327	I	92	Very high	88	Confident	39 Å²	39	69 Å²	69	20%	0.2	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.5	169.8	-56.5	157.8	0	0	0	108	L243 L245 K320 R325	L243-I327 HydrophobicContact CB-CG1 4.44Å; L245-I327 HydrophobicContact CB-CG2 3.62Å; K320-I327 HydrophobicContact CB-CD1 4.04Å; K320-I327 HydrophobicContact CB-CG1 4.18Å; K320-I327 HydrophobicContact CD-CD1 4.12Å; K320-I327 HydrophobicContact CG-CD1 4.45Å; R325-I327 PolarHBondContact O-N 2.82Å
328	T	92.3	Very high	87.7	Confident	40 Å²	40	65.5 Å²	65.5	25%	0.245	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	112.4	174.3	-50.2	0	0	0	0	109.1	L243 F244 L245 L356	L243-T328 PolarHBondContact O-N 3.5Å; L243-T328 PolarHBondContact O-OG1 2.84Å; F244-T328 VanDerWaalsContact CA-O 3.22Å; F244-T328 WeakPolarHBondContact CA-O 3.46Å; F244-T328 HydrophobicContact CD1-CG2 3.84Å; F244-T328 HydrophobicContact CE1-CG2 4.08Å; L245-T328 PolarHBondContact N-O 2.95Å; T328-L356 HydrophobicContact CG2-CD1 3.96Å
329	V	91.8	Very high	87.6	Confident	82 Å²	82	65.7 Å²	65.7	50%	0.497	35%	0.346	S	S	.	.			trans	-95.4	166.1	172	-66	0	0	0	0	110.1
330	P	88.5	Confident	87.6	Confident	15 Å²	15	68.6 Å²	68.6	10%	0.097	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-56.8	148.3	168.2	-22.6	34.6	0	0	0	111.3	L245 L246 P247 Q340 Y354	L245-P330 WeakPolarHBondContact O-CD 3.44Å; L246-P330 HydrophobicContact CD2-CG 4.12Å; P247-P330 HydrophobicContact CG-CG 4.41Å; P330-Q340 HydrophobicContact CB-CB 4.01Å; P330-Q340 HydrophobicContact CB-CG 4.47Å; P330-Q340 HydrophobicContact CG-CB 4.32Å; P330-Y354 HydrophobicContact CG-CD1 4.11Å
331	G	80.9	Confident	87.6	Confident	17 Å²	17	63.5 Å²	63.5	18%	0.175	34%	0.337	C	S	.	.			trans	-80.8	-165.2	173.5	0	0	0	0	0	112	F333	G331-F333 PolarHBondContact O-N 2.69Å
332	N	86.1	Confident	87.7	Confident	176 Å²	176	62.9 Å²	62.9	94%	0.941	33%	0.332	S	S	*	.	S	Bend	trans	-69.3	22.6	177.2	-55.2	5.5	0	0	0	113.8
333	F	90.1	Very high	88	Confident	6 Å²	6	63.5 Å²	63.5	3%	0.026	34%	0.337	C	S	.	.			trans	-78.4	129.3	176.4	178.6	-95.3	0	0	0	110.5	G331 I342 P355 K414 F418	G331-F333 PolarHBondContact O-N 2.69Å; F333-I342 HydrophobicContact CE1-CD1 4.26Å; F333-I342 HydrophobicContact CE1-CG1 3.98Å; F333-I342 HydrophobicContact CZ-CD1 3.78Å; F333-I342 HydrophobicContact CZ-CG1 3.91Å; F333-P355 HydrophobicContact CB-CB 4.06Å; F333-P355 HydrophobicContact CB-CG 4.43Å; F333-P355 HydrophobicContact CD1-CB 4.22Å; F333-P355 HydrophobicContact CD1-CG 3.65Å; F333-P355 HydrophobicContact CD2-CB 4.09Å; F333-P355 HydrophobicContact CD2-CG 3.94Å; F333-P355 HydrophobicContact CE1-CG 3.85Å; F333-P355 HydrophobicContact CE2-CG 4.12Å; F333-P355 HydrophobicContact CG-CB 3.83Å; F333-P355 HydrophobicContact CG-CG 3.71Å; F333-P355 HydrophobicContact CZ-CG 4.09Å; F333-K414 HydrophobicContact CE2-CB 4.09Å; F333-K414 HydrophobicContact CZ-CB 4.26Å; F333-F418 HydrophobicContact CB-CD2 4.04Å; F333-F418 HydrophobicContact CB-CE2 4.08Å; F333-F418 HydrophobicContact CD2-CB 3.85Å; F333-F418 AromaticContact CD2-CD2 3.76Å; F333-F418 HydrophobicContact CD2-CD2 3.76Å; F333-F418 HydrophobicContact CD2-CE2 4.5Å; F333-F418 AromaticContact CD2-CG 3.85Å; F333-F418 HydrophobicContact CD2-CG 3.85Å; F333-F418 HydrophobicContact CE2-CB 4.15Å; F333-F418 HydrophobicContact CG-CD2 4.33Å
334	Q	89.3	Confident	88.3	Confident	129 Å²	129	62.9 Å²	62.9	60%	0.603	33%	0.333	S	S	*	.			trans	-131.3	118.6	170.8	-66.9	178	-8.4	0	0	108.2	K414	Q334-K414 WeakPolarHBondContact O-CG 3.43Å
335	G	87.3	Confident	88.6	Confident	4 Å²	4	59 Å²	59	4%	0.041	32%	0.315	C	S	.	.			trans	-71.8	180	171.4	0	0	0	0	0	111.9	S337 G338 A339	G335-S337 PolarHBondContact O-N 3.49Å; G335-G338 PolarHBondContact O-N 3.03Å; G335-A339 PolarHBondContact N-O 2.67Å
336	H	84.6	Confident	89	Confident	130 Å²	130	52.5 Å²	52.5	60%	0.602	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-38.7	-174.8	-175.9	82.5	0	0	0	113.5	G338 E410 E411	H336-G338 VanDerWaalsContact C-N 3.3Å; H336-G338 PolarHBondContact O-N 3.5Å; H336-E410 HydrophobicContact CB-CB 4.21Å; H336-E411 HydrophobicContact CB-CG 4.12Å
337	S	82.1	Confident	89	Confident	74 Å²	74	50 Å²	50	52%	0.517	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	9.9	179.9	52.5	0	0	0	0	114.5	G335 A339	G335-S337 PolarHBondContact O-N 3.49Å; S337-A339 PolarHBondContact O-N 2.92Å
338	G	83.7	Confident	88.8	Confident	45 Å²	45	53 Å²	53	46%	0.464	31%	0.311	S	S	.	.	S	Bend	trans	74	-3.4	-171.1	0	0	0	0	0	114.4	G335 H336	G335-G338 PolarHBondContact O-N 3.03Å; H336-G338 VanDerWaalsContact C-N 3.3Å; H336-G338 PolarHBondContact O-N 3.5Å
339	A	88.5	Confident	88.7	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	31%	0.311	C	S	.	.			trans	-65.8	143.4	174.8	0	0	0	0	0	111.9	K249 G335 S337 C341	K249-A339 HydrophobicContact CD-CB 4.44Å; K249-A339 HydrophobicContact CG-CB 3.99Å; G335-A339 PolarHBondContact N-O 2.67Å; S337-A339 PolarHBondContact O-N 2.92Å; A339-C341 PolarHBondContact O-N 2.94Å
340	Q	90.2	Very high	88.7	Confident	64 Å²	64	52.7 Å²	52.7	30%	0.299	31%	0.314	S	S	.	.	S	Bend	trans	-82.2	9.1	175.7	-66.7	177.7	-18.4	0	0	113.2	P330	P330-Q340 HydrophobicContact CB-CB 4.01Å; P330-Q340 HydrophobicContact CB-CG 4.47Å; P330-Q340 HydrophobicContact CG-CB 4.32Å
341	C	91.8	Very high	88.9	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.007	32%	0.315	C	S	.	.	S	Bend	trans	-143.7	152.7	-179.1	55.1	0	0	0	0	111.9	A339 L352 L353 Y354	A339-C341 PolarHBondContact O-N 2.94Å; C341-L352 HydrophobicContact CB-CB 4.35Å; C341-L353 CarbonylContact C-O 3.6Å; C341-L353 VanDerWaalsContact CA-O 3.3Å; C341-L353 WeakPolarHBondContact CA-O 3.45Å; C341-L353 WeakPolarHBondContact CB-O 3.32Å; C341-Y354 HydrophobicContact CB-CD1 3.62Å; C341-Y354 HydrophobicContact CB-CD2 3.99Å; C341-Y354 HydrophobicContact CB-CE1 3.48Å; C341-Y354 VanDerWaalsContact CB-CE1 3.48Å; C341-Y354 HydrophobicContact CB-CE2 3.85Å; C341-Y354 HydrophobicContact CB-CG 3.86Å
342	I	92.3	Very high	89.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.4	179.1	-71.4	174.1	0	0	0	108.5	F333 L352 L353 P355 I407 E411 L415	F333-I342 HydrophobicContact CE1-CD1 4.26Å; F333-I342 HydrophobicContact CE1-CG1 3.98Å; F333-I342 HydrophobicContact CZ-CD1 3.78Å; F333-I342 HydrophobicContact CZ-CG1 3.91Å; I342-L352 WeakPolarHBondContact O-CA 3.49Å; I342-L353 HydrophobicContact CB-CB 4.31Å; I342-L353 PolarHBondContact N-O 2.86Å; I342-L353 PolarHBondContact O-N 3.37Å; I342-P355 HydrophobicContact CD1-CG 4.4Å; I342-I407 HydrophobicContact CG2-CB 4.44Å; I342-I407 HydrophobicContact CG2-CD1 4.2Å; I342-I407 HydrophobicContact CG2-CG1 4.07Å; I342-I407 HydrophobicContact CG2-CG2 3.53Å; I342-E411 VanDerWaalsContact CA-OE2 3.28Å; I342-E411 WeakPolarHBondContact CA-OE2 3.38Å; I342-E411 WeakPolarHBondContact CG2-OE2 3.34Å; I342-L415 HydrophobicContact CD1-CB 3.86Å; I342-L415 HydrophobicContact CD1-CD1 3.84Å; I342-L415 HydrophobicContact CD1-CD2 3.84Å; I342-L415 HydrophobicContact CD1-CG 4.04Å
343	T	92.4	Very high	89.9	Confident	40 Å²	40	44 Å²	44	25%	0.245	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	121.9	174.4	-54.4	0	0	0	0	109.5	K249 E411	K249-T343 VanDerWaalsContact CD-OG1 3.26Å; K249-T343 WeakPolarHBondContact CD-OG1 3.24Å; K249-T343 PolarHBondContact NZ-OG1 2.86Å; T343-E411 PolarHBondContact N-OE2 2.85Å
344	C	91.8	Very high	90.2	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	166.9	-175.1	70.7	0	0	0	0	112.3	G351 Y362 F404 I407	C344-G351 PolarHBondContact N-O 2.81Å; C344-G351 PolarHBondContact O-N 3.42Å; C344-G351 VanDerWaalsContact O-O 3.12Å; C344-Y362 VanDerWaalsContact SG-CE2 3.55Å; C344-F404 HydrophobicContact CB-CB 4.37Å; C344-I407 HydrophobicContact CB-CD1 4.32Å; C344-I407 HydrophobicContact CB-CG1 3.66Å
345	S	92.4	Very high	90.4	Very high	29 Å²	29	37.5 Å²	37.5	20%	0.203	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134.3	167.3	-62.5	0	0	0	0	110.7	S349 F404 S405	S345-S349 CarbonylContact C-O 3.58Å; S345-S349 WeakPolarHBondContact CA-O 3.32Å; S345-F404 CarbonylContact O-C 3.53Å; S345-F404 WeakPolarHBondContact O-CA 3.48Å; S345-S405 PolarHBondContact N-O 3.16Å; S345-S405 PolarHBondContact O-N 3.49Å
346	Y	92.2	Very high	90.7	Very high	15 Å²	15	37.5 Å²	37.5	6%	0.059	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.3	170.7	-176.9	-115.4	0	0	0	109.8	A348 S349 Y362 P366 V368 Y402 T403 F404	Y346-A348 PolarHBondContact O-N 3.35Å; Y346-S349 PolarHBondContact N-O 3.46Å; Y346-S349 PolarHBondContact O-N 3.39Å; Y346-Y362 VanDerWaalsContact CB-CZ 3.48Å; Y346-Y362 HydrophobicContact CD1-CD1 4.11Å; Y346-Y362 HydrophobicContact CD1-CE1 4.05Å; Y346-Y362 HydrophobicContact CG-CD1 4.34Å; Y346-Y362 HydrophobicContact CG-CE1 4.22Å; Y346-P366 HydrophobicContact CD1-CG 3.97Å; Y346-P366 HydrophobicContact CE1-CG 3.78Å; Y346-V368 HydrophobicContact CD1-CG2 4.09Å; Y346-V368 HydrophobicContact CE1-CG2 3.53Å; Y346-Y402 HydrophobicContact CE2-CD1 4.23Å; Y346-Y402 AromaticContact CZ-CD1 3.9Å; Y346-Y402 VanDerWaalsContact OH-CD1 3.26Å; Y346-Y402 WeakPolarHBondContact OH-CD1 3.48Å; Y346-T403 WeakPolarHBondContact CD2-O 3.45Å; Y346-F404 AromaticContact CD2-CD1 3.83Å; Y346-F404 HydrophobicContact CD2-CD1 3.83Å; Y346-F404 AromaticContact CD2-CE1 3.71Å; Y346-F404 HydrophobicContact CD2-CE1 3.71Å; Y346-F404 HydrophobicContact CD2-CG 4.46Å; Y346-F404 HydrophobicContact CD2-CZ 4.27Å; Y346-F404 HydrophobicContact CE2-CE1 4.4Å; Y346-F404 HydrophobicContact CG-CD1 4.09Å; Y346-F404 AromaticContact CG-CE1 3.87Å; Y346-F404 HydrophobicContact CG-CE1 3.87Å
347	K	88.9	Confident	90.9	Very high	136 Å²	136	37.5 Å²	37.5	59%	0.591	23%	0.234	S	C	*	.	S	Bend	trans	50.4	-137.6	-164.6	-50	-60.4	-179.5	-173.4	0	109.4	S349	K347-S349 VanDerWaalsContact C-N 3.32Å; K347-S349 PolarHBondContact O-N 2.91Å
348	A	87.5	Confident	91.3	Very high	103 Å²	103	41.7 Å²	41.7	85%	0.851	24%	0.238	S	C	*	.	S	Bend	trans	-90.1	43.1	-179.5	0	0	0	0	0	113.6	Y346	Y346-A348 PolarHBondContact O-N 3.35Å
349	S	90.6	Very high	91.7	Very high	36 Å²	36	39.6 Å²	39.6	25%	0.252	22%	0.217	S	C	.	.			trans	-153.9	141.2	177.1	-71.4	0	0	0	0	111.7	S345 Y346 K347 Y362 K365	S345-S349 CarbonylContact C-O 3.58Å; S345-S349 WeakPolarHBondContact CA-O 3.32Å; Y346-S349 PolarHBondContact N-O 3.46Å; Y346-S349 PolarHBondContact O-N 3.39Å; K347-S349 VanDerWaalsContact C-N 3.32Å; K347-S349 PolarHBondContact O-N 2.91Å; S349-Y362 PolarHBondContact O-OH 2.81Å; S349-Y362 VanDerWaalsContact O-OH 3.05Å; S349-K365 WeakPolarHBondContact CB-O 3.41Å
350	S	91.8	Very high	92	Very high	79 Å²	79	39.4 Å²	39.4	55%	0.552	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	150.6	171.8	178.7	0	0	0	0	110.7
351	G	92.6	Very high	92.2	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	-163.1	-177.3	0	0	0	0	0	112.5	C344 Y362 V363	C344-G351 PolarHBondContact N-O 2.81Å; C344-G351 PolarHBondContact O-N 3.42Å; C344-G351 VanDerWaalsContact O-O 3.12Å; G351-Y362 PolarHBondContact N-OH 3.07Å; G351-V363 VanDerWaalsContact CA-O 3.29Å; G351-V363 WeakPolarHBondContact CA-O 3.46Å
352	L	94.1	Very high	92.4	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.068	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.4	-175.1	-63.7	174.3	0	0	0	110.4	K249 F255 C341 I342 Y354 Y362 V363	K249-L352 HydrophobicContact CB-CD1 4.46Å; K249-L352 HydrophobicContact CB-CD2 4.3Å; K249-L352 HydrophobicContact CD-CD2 4.47Å; F255-L352 HydrophobicContact CE2-CD1 3.97Å; F255-L352 HydrophobicContact CZ-CD1 4.34Å; C341-L352 HydrophobicContact CB-CB 4.35Å; I342-L352 WeakPolarHBondContact O-CA 3.49Å; L352-Y354 HydrophobicContact CB-CD2 4.36Å; L352-Y354 HydrophobicContact CB-CE2 3.65Å; L352-Y354 HydrophobicContact CD1-CE2 4.5Å; L352-Y362 WeakPolarHBondContact O-CA 3.37Å; L352-V363 HydrophobicContact CB-CG2 4.19Å; L352-V363 PolarHBondContact N-O 2.92Å; L352-V363 PolarHBondContact O-N 2.82Å
353	L	94.8	Very high	92.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.2	174.9	179	68	0	0	0	109.3	C341 I342 F360 Y362 F392 F404	C341-L353 CarbonylContact C-O 3.6Å; C341-L353 VanDerWaalsContact CA-O 3.3Å; C341-L353 WeakPolarHBondContact CA-O 3.45Å; C341-L353 WeakPolarHBondContact CB-O 3.32Å; I342-L353 HydrophobicContact CB-CB 4.31Å; I342-L353 PolarHBondContact N-O 2.86Å; I342-L353 PolarHBondContact O-N 3.37Å; L353-F360 HydrophobicContact CD1-CB 4.04Å; L353-F360 HydrophobicContact CD1-CD1 4.4Å; L353-Y362 HydrophobicContact CB-CD2 4.43Å; L353-F392 HydrophobicContact CD2-CD1 4.05Å; L353-F392 HydrophobicContact CD2-CE1 4.37Å; L353-F404 HydrophobicContact CD1-CD1 4.34Å; L353-F404 HydrophobicContact CD1-CE1 4.08Å; L353-F404 HydrophobicContact CD1-CE2 4.43Å; L353-F404 HydrophobicContact CD1-CZ 4.12Å; L353-F404 HydrophobicContact CD2-CD2 4.43Å; L353-F404 HydrophobicContact CD2-CG 4.25Å
354	Y	94.9	Very high	92.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.1	179.5	-69	-100.9	0	0	0	110.1	L246 P247 P330 C341 L352 L356 F360 I361 V363	L246-Y354 HydrophobicContact CB-CD1 4.12Å; L246-Y354 HydrophobicContact CB-CE1 3.78Å; L246-Y354 HydrophobicContact CB-CE2 4.33Å; L246-Y354 HydrophobicContact CD1-CD2 4.03Å; L246-Y354 HydrophobicContact CD1-CE2 4.27Å; L246-Y354 HydrophobicContact CD1-CG 4.23Å; L246-Y354 HydrophobicContact CD2-CD1 4.14Å; L246-Y354 HydrophobicContact CD2-CG 4.27Å; P247-Y354 VanDerWaalsContact O-CE1 3.24Å; P247-Y354 WeakPolarHBondContact O-CE1 3.48Å; P247-Y354 PolarHBondContact O-OH 3.1Å; P330-Y354 HydrophobicContact CG-CD1 4.11Å; C341-Y354 HydrophobicContact CB-CD1 3.62Å; C341-Y354 HydrophobicContact CB-CD2 3.99Å; C341-Y354 HydrophobicContact CB-CE1 3.48Å; C341-Y354 VanDerWaalsContact CB-CE1 3.48Å; C341-Y354 HydrophobicContact CB-CE2 3.85Å; C341-Y354 HydrophobicContact CB-CG 3.86Å; L352-Y354 HydrophobicContact CB-CD2 4.36Å; L352-Y354 HydrophobicContact CB-CE2 3.65Å; L352-Y354 HydrophobicContact CD1-CE2 4.5Å; Y354-L356 PolarHBondContact O-N 3.17Å; Y354-F360 WeakPolarHBondContact O-CA 3.45Å; Y354-I361 HydrophobicContact CG-CG2 4.43Å; Y354-I361 PolarHBondContact N-O 3.47Å; Y354-I361 PolarHBondContact O-N 3.15Å; Y354-V363 HydrophobicContact CD2-CG2 4.31Å; Y354-V363 HydrophobicContact CE2-CG2 3.74Å
355	P	93.9	Very high	91.9	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	109.7	166.3	-18.1	34	0	0	0	110.5	F333 I342 F360 F418	F333-P355 HydrophobicContact CB-CB 4.06Å; F333-P355 HydrophobicContact CB-CG 4.43Å; F333-P355 HydrophobicContact CD1-CB 4.22Å; F333-P355 HydrophobicContact CD1-CG 3.65Å; F333-P355 HydrophobicContact CD2-CB 4.09Å; F333-P355 HydrophobicContact CD2-CG 3.94Å; F333-P355 HydrophobicContact CE1-CG 3.85Å; F333-P355 HydrophobicContact CE2-CG 4.12Å; F333-P355 HydrophobicContact CG-CB 3.83Å; F333-P355 HydrophobicContact CG-CG 3.71Å; F333-P355 HydrophobicContact CZ-CG 4.09Å; I342-P355 HydrophobicContact CD1-CG 4.4Å; P355-F360 HydrophobicContact CB-CD1 4.13Å; P355-F360 HydrophobicContact CB-CE1 3.93Å; P355-F360 HydrophobicContact CG-CD1 4.33Å; P355-F360 HydrophobicContact CG-CE1 4.16Å; P355-F418 HydrophobicContact CB-CD1 3.93Å; P355-F418 HydrophobicContact CB-CD2 4.38Å; P355-F418 HydrophobicContact CB-CE1 3.52Å; P355-F418 HydrophobicContact CB-CE2 4Å; P355-F418 HydrophobicContact CB-CG 4.35Å; P355-F418 HydrophobicContact CB-CZ 3.54Å
356	L	92.9	Very high	91.8	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	167.6	179	-50.7	-179.8	0	0	0	110.7	F244 L246 T328 Y354 R358 G359 I361 F372 F418	F244-L356 HydrophobicContact CD1-CD1 3.69Å; F244-L356 HydrophobicContact CE1-CD1 3.62Å; L246-L356 HydrophobicContact CD2-CD2 3.93Å; T328-L356 HydrophobicContact CG2-CD1 3.96Å; Y354-L356 PolarHBondContact O-N 3.17Å; L356-R358 PolarHBondContact O-N 3.42Å; L356-R358 VanDerWaalsContact O-N 3.12Å; L356-G359 CarbonylContact C-O 3.56Å; L356-G359 WeakPolarHBondContact CA-O 3.5Å; L356-G359 VanDerWaalsContact CB-O 3.3Å; L356-G359 WeakPolarHBondContact CB-O 3.49Å; L356-G359 PolarHBondContact N-O 2.84Å; L356-I361 HydrophobicContact CD1-CB 4.09Å; L356-I361 HydrophobicContact CD1-CG2 3.66Å; L356-I361 HydrophobicContact CD2-CG2 4.04Å; L356-I361 HydrophobicContact CG-CG2 3.96Å; L356-F372 VanDerWaalsContact O-CZ 3.26Å; L356-F372 WeakPolarHBondContact O-CZ 3.5Å; L356-F418 WeakPolarHBondContact O-CZ 3.44Å
357	E	90.3	Very high	91.8	Very high	130 Å²	130	45.1 Å²	45.1	61%	0.607	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.6	-177.5	-160.4	-159.7	168.6	0	0	114.4	F372 K422	E357-F372 WeakPolarHBondContact O-CE2 3.48Å; E357-K422 WeakPolarHBondContact O-CE 3.35Å; E357-K422 PolarHBondContact O-NZ 3.49Å
358	R	89.4	Confident	92	Very high	162 Å²	162	39.5 Å²	39.5	61%	0.611	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.1	13.9	-175.7	-68.5	-177.1	64.6	160.5	-0.3	114.3	L356 F372 E373	L356-R358 PolarHBondContact O-N 3.42Å; L356-R358 VanDerWaalsContact O-N 3.12Å; R358-F372 VanDerWaalsContact C-CD2 3.42Å; R358-F372 PolarHBondContact O-N 3.36Å; R358-E373 IonicContact CZ-OE1 3.03Å; R358-E373 IonicContact NE-OE1 2.62Å; R358-E373 IonicContact NH2-OE1 3.13Å; R358-E373 PolarHBondContact NH2-OE1 3Å
359	G	92.2	Very high	92.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	-177.3	-175.9	0	0	0	0	0	113.9	L356 L370 F372	L356-G359 CarbonylContact C-O 3.56Å; L356-G359 WeakPolarHBondContact CA-O 3.5Å; L356-G359 VanDerWaalsContact CB-O 3.3Å; L356-G359 WeakPolarHBondContact CB-O 3.49Å; L356-G359 PolarHBondContact N-O 2.84Å; G359-L370 CarbonylContact C-O 3.55Å; G359-L370 WeakPolarHBondContact CA-O 3.43Å; G359-F372 VanDerWaalsContact CA-CD1 3.5Å; G359-F372 VanDerWaalsContact N-CZ 3.31Å; G359-F372 WeakPolarHBondContact O-CE1 3.37Å; G359-F372 WeakPolarHBondContact O-CZ 3.42Å
360	F	94.4	Very high	92.4	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.4	165.8	-64.4	-79.6	0	0	0	109.2	L353 Y354 P355 H369 L370 F372 I375 F392 I394 L415 F418 V419 L424	L353-F360 HydrophobicContact CD1-CB 4.04Å; L353-F360 HydrophobicContact CD1-CD1 4.4Å; Y354-F360 WeakPolarHBondContact O-CA 3.45Å; P355-F360 HydrophobicContact CB-CD1 4.13Å; P355-F360 HydrophobicContact CB-CE1 3.93Å; P355-F360 HydrophobicContact CG-CD1 4.33Å; P355-F360 HydrophobicContact CG-CE1 4.16Å; F360-H369 CarbonylContact O-C 3.57Å; F360-H369 WeakPolarHBondContact O-CA 3.29Å; F360-L370 PolarHBondContact N-O 3.01Å; F360-L370 PolarHBondContact O-N 3.19Å; F360-F372 HydrophobicContact CD2-CD1 4.32Å; F360-F372 AromaticContact CD2-CE1 3.74Å; F360-F372 HydrophobicContact CD2-CE1 3.74Å; F360-F372 HydrophobicContact CE2-CD1 4.21Å; F360-F372 AromaticContact CE2-CE1 3.58Å; F360-F372 HydrophobicContact CE2-CE1 3.58Å; F360-F372 HydrophobicContact CG-CE1 4.35Å; F360-F372 HydrophobicContact CZ-CE1 4.07Å; F360-I375 HydrophobicContact CD2-CD1 4.03Å; F360-I375 HydrophobicContact CE2-CD1 3.95Å; F360-F392 HydrophobicContact CE1-CE1 4.13Å; F360-F392 HydrophobicContact CE1-CZ 4.43Å; F360-F392 HydrophobicContact CE2-CE1 4.25Å; F360-F392 HydrophobicContact CE2-CZ 4.17Å; F360-F392 AromaticContact CZ-CE1 3.92Å; F360-F392 HydrophobicContact CZ-CE1 3.92Å; F360-F392 AromaticContact CZ-CZ 3.83Å; F360-F392 HydrophobicContact CZ-CZ 3.83Å; F360-I394 HydrophobicContact CD2-CD1 3.45Å; F360-I394 VanDerWaalsContact CD2-CD1 3.45Å; F360-I394 HydrophobicContact CE2-CD1 3.76Å; F360-I394 HydrophobicContact CG-CD1 4.1Å; F360-L415 HydrophobicContact CE1-CD1 4.14Å; F360-F418 HydrophobicContact CE1-CD1 4.43Å; F360-F418 HydrophobicContact CE1-CE1 4.08Å; F360-F418 HydrophobicContact CZ-CD1 4.5Å; F360-F418 HydrophobicContact CZ-CE1 4.2Å; F360-V419 HydrophobicContact CZ-CG2 4.34Å; F360-L424 HydrophobicContact CE2-CD1 3.97Å; F360-L424 HydrophobicContact CZ-CD1 4.28Å
361	I	95.4	Very high	92.4	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.4	166.2	-169.5	166.6	0	0	0	110.4	F244 L246 V257 Y354 L356 V363 V368 H369	F244-I361 HydrophobicContact CD1-CD1 4.04Å; F244-I361 HydrophobicContact CD2-CD1 3.9Å; F244-I361 HydrophobicContact CE1-CD1 4.14Å; F244-I361 HydrophobicContact CE2-CD1 3.99Å; F244-I361 HydrophobicContact CG-CD1 3.94Å; F244-I361 HydrophobicContact CZ-CD1 4.11Å; L246-I361 HydrophobicContact CD1-CD1 4.45Å; L246-I361 HydrophobicContact CD1-CG2 3.66Å; L246-I361 HydrophobicContact CD2-CG2 4.24Å; V257-I361 HydrophobicContact CB-CD1 4.4Å; V257-I361 HydrophobicContact CG1-CD1 4.13Å; Y354-I361 HydrophobicContact CG-CG2 4.43Å; Y354-I361 PolarHBondContact N-O 3.47Å; Y354-I361 PolarHBondContact O-N 3.15Å; L356-I361 HydrophobicContact CD1-CB 4.09Å; L356-I361 HydrophobicContact CD1-CG2 3.66Å; L356-I361 HydrophobicContact CD2-CG2 4.04Å; L356-I361 HydrophobicContact CG-CG2 3.96Å; I361-V363 HydrophobicContact CG1-CG1 4.48Å; I361-V368 CarbonylContact C-O 3.47Å; I361-V368 WeakPolarHBondContact CA-O 3.18Å; I361-H369 HydrophobicContact CB-CB 4.44Å; I361-H369 HydrophobicContact CD1-CB 4.27Å; I361-H369 HydrophobicContact CG1-CB 4.12Å
362	Y	95.5	Very high	92.4	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.2	175.6	171.5	-95.9	0	0	0	110.1	C344 Y346 S349 G351 L352 L353 P366 P367 V368 F404	C344-Y362 VanDerWaalsContact SG-CE2 3.55Å; Y346-Y362 VanDerWaalsContact CB-CZ 3.48Å; Y346-Y362 HydrophobicContact CD1-CD1 4.11Å; Y346-Y362 HydrophobicContact CD1-CE1 4.05Å; Y346-Y362 HydrophobicContact CG-CD1 4.34Å; Y346-Y362 HydrophobicContact CG-CE1 4.22Å; S349-Y362 PolarHBondContact O-OH 2.81Å; S349-Y362 VanDerWaalsContact O-OH 3.05Å; G351-Y362 PolarHBondContact N-OH 3.07Å; L352-Y362 WeakPolarHBondContact O-CA 3.37Å; L353-Y362 HydrophobicContact CB-CD2 4.43Å; Y362-P366 WeakPolarHBondContact CD1-O 3.47Å; Y362-P366 WeakPolarHBondContact CE1-O 3.41Å; Y362-P367 WeakPolarHBondContact O-CA 3.31Å; Y362-V368 PolarHBondContact N-O 3.48Å; Y362-V368 PolarHBondContact O-N 3.31Å; Y362-V368 VanDerWaalsContact O-N 3.17Å; Y362-F404 HydrophobicContact CD1-CE1 4.5Å; Y362-F404 HydrophobicContact CD2-CD1 4.15Å; Y362-F404 HydrophobicContact CD2-CE1 4.02Å; Y362-F404 HydrophobicContact CG-CD1 4.39Å; Y362-F404 AromaticContact CG-CE1 3.81Å; Y362-F404 HydrophobicContact CG-CE1 3.81Å
363	V	93.5	Very high	92.2	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.9	178.9	-61.9	0	0	0	0	111.4	L246 F255 V257 I275 G351 L352 Y354 I361	L246-V363 HydrophobicContact CD1-CG1 4.28Å; F255-V363 HydrophobicContact CD2-CG2 4.14Å; F255-V363 HydrophobicContact CE1-CG2 4.32Å; F255-V363 HydrophobicContact CE2-CG2 3.95Å; F255-V363 HydrophobicContact CG-CG2 4.41Å; F255-V363 HydrophobicContact CZ-CG2 4.04Å; V257-V363 HydrophobicContact CG2-CG1 4.07Å; I275-V363 HydrophobicContact CD1-CB 4.28Å; I275-V363 HydrophobicContact CD1-CG1 3.92Å; G351-V363 VanDerWaalsContact CA-O 3.29Å; G351-V363 WeakPolarHBondContact CA-O 3.46Å; L352-V363 HydrophobicContact CB-CG2 4.19Å; L352-V363 PolarHBondContact N-O 2.92Å; L352-V363 PolarHBondContact O-N 2.82Å; Y354-V363 HydrophobicContact CD2-CG2 4.31Å; Y354-V363 HydrophobicContact CE2-CG2 3.74Å; I361-V363 HydrophobicContact CG1-CG1 4.48Å
364	H	84.1	Confident	91.9	Very high	55 Å²	55	38.9 Å²	38.9	26%	0.255	18%	0.181	S	C	.	.	S	Bend	cis	-119	-3.7	4.9	70.4	-83.6	0	0	0	114	L209 I275 P367	L209-H364 HydrophobicContact CB-CB 4.35Å; L209-H364 HydrophobicContact CD1-CB 3.99Å; I275-H364 HydrophobicContact CD1-CB 4.16Å; H364-P367 WeakPolarHBondContact O-CD 3.32Å
365	K	89.3	Confident	91.8	Very high	122 Å²	122	39.2 Å²	39.2	53%	0.53	18%	0.182	S	C	.	.	S	Bend	trans	-145.1	117.9	-169.2	-168.7	-174.4	178.1	-166.4	0	114.5	S349	S349-K365 WeakPolarHBondContact CB-O 3.41Å
366	P	90.2	Very high	91.7	Very high	62 Å²	62	41.3 Å²	41.3	40%	0.403	20%	0.197	S	C	.	.	S	Bend	cis	-61.7	149.6	-27.9	31.9	-36	0	0	0	109.5	Y346 Y362	Y346-P366 HydrophobicContact CD1-CG 3.97Å; Y346-P366 HydrophobicContact CE1-CG 3.78Å; Y362-P366 WeakPolarHBondContact CD1-O 3.47Å; Y362-P366 WeakPolarHBondContact CE1-O 3.41Å
367	P	92.3	Very high	91.6	Very high	27 Å²	27	41.6 Å²	41.6	18%	0.175	20%	0.199	C	C	.	.			trans	-70.7	138.4	172.7	30.6	-33.6	0	0	0	110.7	T210 F273 I275 Y362 H364	T210-P367 HydrophobicContact CG2-CG 4.4Å; F273-P367 HydrophobicContact CB-CB 4.06Å; F273-P367 HydrophobicContact CB-CG 3.84Å; F273-P367 HydrophobicContact CD2-CB 4.01Å; F273-P367 HydrophobicContact CD2-CG 3.84Å; F273-P367 HydrophobicContact CG-CB 4.14Å; F273-P367 HydrophobicContact CG-CG 4.16Å; I275-P367 HydrophobicContact CD1-CB 3.72Å; I275-P367 HydrophobicContact CD1-CG 4.37Å; Y362-P367 WeakPolarHBondContact O-CA 3.31Å; H364-P367 WeakPolarHBondContact O-CD 3.32Å
368	V	92.9	Very high	91.7	Very high	18 Å²	18	35.4 Å²	35.4	11%	0.109	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	134.7	-178.7	179.2	0	0	0	0	109.1	Y346 I361 Y362 L370 Y402	Y346-V368 HydrophobicContact CD1-CG2 4.09Å; Y346-V368 HydrophobicContact CE1-CG2 3.53Å; I361-V368 CarbonylContact C-O 3.47Å; I361-V368 WeakPolarHBondContact CA-O 3.18Å; Y362-V368 PolarHBondContact N-O 3.48Å; Y362-V368 PolarHBondContact O-N 3.31Å; Y362-V368 VanDerWaalsContact O-N 3.17Å; V368-L370 HydrophobicContact CG1-CD1 4.32Å; V368-L370 HydrophobicContact CG1-CD2 4.16Å; V368-L370 HydrophobicContact CG1-CG 3.95Å; V368-Y402 HydrophobicContact CG1-CD1 3.83Å; V368-Y402 HydrophobicContact CG1-CE1 3.73Å
369	H	93.9	Very high	91.8	Very high	32 Å²	32	29.1 Å²	29.1	15%	0.148	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.5	172.2	162.9	-85.5	0	0	0	109.5	F244 F273 F360 I361	F244-H369 AromaticContact CE1-CD2 3.48Å; F244-H369 VanDerWaalsContact CE1-CD2 3.48Å; F244-H369 WeakPolarHBondContact CE1-CD2 3.23Å; F244-H369 AromaticContact CE1-NE2 3.69Å; F244-H369 AromaticContact CZ-CD2 3.3Å; F244-H369 WeakPolarHBondContact CZ-CD2 3.41Å; F244-H369 AromaticContact CZ-CG 3.95Å; F244-H369 AromaticContact CZ-NE2 3.54Å; F273-H369 HydrophobicContact CE1-CB 3.92Å; F273-H369 HydrophobicContact CZ-CB 3.84Å; F360-H369 CarbonylContact O-C 3.57Å; F360-H369 WeakPolarHBondContact O-CA 3.29Å; I361-H369 HydrophobicContact CB-CB 4.44Å; I361-H369 HydrophobicContact CD1-CB 4.27Å; I361-H369 HydrophobicContact CG1-CB 4.12Å
370	L	92.4	Very high	91.7	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.3	-176.4	-60.2	170.6	0	0	0	109.3	G359 F360 V368 I394 T396 Y402	G359-L370 CarbonylContact C-O 3.55Å; G359-L370 WeakPolarHBondContact CA-O 3.43Å; F360-L370 PolarHBondContact N-O 3.01Å; F360-L370 PolarHBondContact O-N 3.19Å; V368-L370 HydrophobicContact CG1-CD1 4.32Å; V368-L370 HydrophobicContact CG1-CD2 4.16Å; V368-L370 HydrophobicContact CG1-CG 3.95Å; L370-I394 HydrophobicContact CD1-CB 4.23Å; L370-I394 HydrophobicContact CD1-CD1 3.94Å; L370-I394 HydrophobicContact CD1-CG2 4.1Å; L370-T396 HydrophobicContact CD2-CG2 4.25Å; L370-Y402 HydrophobicContact CD1-CD1 4.24Å; L370-Y402 HydrophobicContact CD1-CD2 3.99Å; L370-Y402 HydrophobicContact CD1-CG 3.85Å; L370-Y402 HydrophobicContact CD2-CD1 4.4Å; L370-Y402 HydrophobicContact CD2-CD2 4.02Å; L370-Y402 HydrophobicContact CD2-CE1 4.11Å; L370-Y402 HydrophobicContact CD2-CE2 3.7Å; L370-Y402 HydrophobicContact CD2-CG 4.37Å
371	R	92.1	Very high	91.3	Very high	28 Å²	28	31.1 Å²	31.1	11%	0.106	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.4	175.9	-59.9	179.8	-73.6	-179.6	2.4	109.7	G38 E373 E374 I375	G38-R371 PolarHBondContact O-NH1 3.43Å; R371-E373 PolarHBondContact O-N 2.89Å; R371-E373 VanDerWaalsContact O-N 3.11Å; R371-E374 HydrophobicContact CB-CG 4.1Å; R371-E374 WeakPolarHBondContact CB-OE2 2.92Å; R371-E374 IonicContact CZ-OE1 2.83Å; R371-E374 PolarHBondContact N-OE2 3.24Å; R371-E374 IonicContact NE-OE1 3.42Å; R371-E374 PolarHBondContact NE-OE1 3.05Å; R371-E374 IonicContact NE-OE2 3.48Å; R371-E374 IonicContact NH2-OE1 3.14Å; R371-E374 PolarHBondContact NH2-OE1 3.32Å; R371-E374 WeakPolarHBondContact O-CB 3.41Å; R371-E374 PolarHBondContact O-N 2.98Å; R371-I375 PolarHBondContact O-N 3.42Å
372	F	91.2	Very high	90.5	Very high	30 Å²	30	40.6 Å²	40.6	13%	0.132	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.1	175.7	-61.8	-22.4	0	0	0	112.9	L356 E357 R358 G359 F360 E374 I375 F418 K422 L424	L356-F372 VanDerWaalsContact O-CZ 3.26Å; L356-F372 WeakPolarHBondContact O-CZ 3.5Å; E357-F372 WeakPolarHBondContact O-CE2 3.48Å; R358-F372 VanDerWaalsContact C-CD2 3.42Å; R358-F372 PolarHBondContact O-N 3.36Å; G359-F372 VanDerWaalsContact CA-CD1 3.5Å; G359-F372 VanDerWaalsContact N-CZ 3.31Å; G359-F372 WeakPolarHBondContact O-CE1 3.37Å; G359-F372 WeakPolarHBondContact O-CZ 3.42Å; F360-F372 HydrophobicContact CD2-CD1 4.32Å; F360-F372 AromaticContact CD2-CE1 3.74Å; F360-F372 HydrophobicContact CD2-CE1 3.74Å; F360-F372 HydrophobicContact CE2-CD1 4.21Å; F360-F372 AromaticContact CE2-CE1 3.58Å; F360-F372 HydrophobicContact CE2-CE1 3.58Å; F360-F372 HydrophobicContact CG-CE1 4.35Å; F360-F372 HydrophobicContact CZ-CE1 4.07Å; F372-E374 PolarHBondContact O-N 3.38Å; F372-I375 HydrophobicContact CD1-CD1 3.91Å; F372-I375 PolarHBondContact O-N 2.95Å; F372-F418 HydrophobicContact CE2-CZ 4.5Å; F372-F418 AromaticContact CZ-CE1 3.79Å; F372-F418 HydrophobicContact CZ-CE1 3.79Å; F372-F418 AromaticContact CZ-CZ 3.94Å; F372-F418 HydrophobicContact CZ-CZ 3.94Å; F372-K422 HydrophobicContact CD2-CB 4.42Å; F372-K422 HydrophobicContact CD2-CD 4.37Å; F372-K422 HydrophobicContact CD2-CG 4.47Å; F372-K422 HydrophobicContact CE2-CB 4.1Å; F372-K422 HydrophobicContact CE2-CD 3.75Å; F372-K422 HydrophobicContact CE2-CG 3.73Å; F372-K422 HydrophobicContact CZ-CG 4.21Å; F372-L424 HydrophobicContact CB-CD2 4.08Å; F372-L424 HydrophobicContact CD1-CD1 4.11Å; F372-L424 HydrophobicContact CD1-CD2 4.26Å; F372-L424 HydrophobicContact CE1-CD1 4.21Å; F372-L424 HydrophobicContact CG-CD2 4.21Å
373	E	89.9	Confident	89.2	Confident	85 Å²	85	40.9 Å²	40.9	40%	0.397	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.3	172.6	-68.1	165.1	-135.1	0	0	113.5	R358 R371 K397	R358-E373 IonicContact CZ-OE1 3.03Å; R358-E373 IonicContact NE-OE1 2.62Å; R358-E373 IonicContact NH2-OE1 3.13Å; R358-E373 PolarHBondContact NH2-OE1 3Å; R371-E373 PolarHBondContact O-N 2.89Å; R371-E373 VanDerWaalsContact O-N 3.11Å; E373-K397 PolarHBondContact O-NZ 2.84Å
374	E	89.5	Confident	87.8	Confident	49 Å²	49	47.2 Å²	47.2	23%	0.229	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-23.5	-179.6	-63.1	161.1	162.9	0	0	112.5	R371 F372 S376 T396 K397	R371-E374 HydrophobicContact CB-CG 4.1Å; R371-E374 WeakPolarHBondContact CB-OE2 2.92Å; R371-E374 IonicContact CZ-OE1 2.83Å; R371-E374 PolarHBondContact N-OE2 3.24Å; R371-E374 IonicContact NE-OE1 3.42Å; R371-E374 PolarHBondContact NE-OE1 3.05Å; R371-E374 IonicContact NE-OE2 3.48Å; R371-E374 IonicContact NH2-OE1 3.14Å; R371-E374 PolarHBondContact NH2-OE1 3.32Å; R371-E374 WeakPolarHBondContact O-CB 3.41Å; R371-E374 PolarHBondContact O-N 2.98Å; F372-E374 PolarHBondContact O-N 3.38Å; E374-S376 PolarHBondContact O-N 3.24Å; E374-T396 CarbonylContact O-C 3.54Å; E374-T396 VanDerWaalsContact O-CA 3.22Å; E374-T396 WeakPolarHBondContact O-CA 3.26Å; E374-T396 WeakPolarHBondContact O-CB 3.49Å; E374-K397 PolarHBondContact O-N 3.26Å
375	I	92.3	Very high	86.8	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.9	-178	-58.5	-178.9	0	0	0	109.4	F360 R371 F372 C377 V378 I394 K397 L424	F360-I375 HydrophobicContact CD2-CD1 4.03Å; F360-I375 HydrophobicContact CE2-CD1 3.95Å; R371-I375 PolarHBondContact O-N 3.42Å; F372-I375 HydrophobicContact CD1-CD1 3.91Å; F372-I375 PolarHBondContact O-N 2.95Å; I375-C377 WeakPolarHBondContact CG2-O 3.41Å; I375-V378 HydrophobicContact CG2-CG1 3.97Å; I375-I394 HydrophobicContact CB-CG2 4.35Å; I375-I394 HydrophobicContact CD1-CG2 3.66Å; I375-I394 HydrophobicContact CG1-CG2 3.62Å; I375-I394 HydrophobicContact CG2-CG2 3.96Å; I375-K397 WeakPolarHBondContact O-CE 3.26Å; I375-K397 PolarHBondContact O-NZ 3.28Å; I375-L424 HydrophobicContact CB-CD2 4.33Å; I375-L424 HydrophobicContact CD1-CD1 4.2Å; I375-L424 HydrophobicContact CD1-CD2 4.26Å; I375-L424 HydrophobicContact CG2-CD2 4.34Å
376	S	91.4	Very high	85.5	Confident	43 Å²	43	47.3 Å²	47.3	30%	0.301	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-52.7	170.2	-177	0	0	0	0	109.7	E374 E395 N425	E374-S376 PolarHBondContact O-N 3.24Å; S376-E395 WeakPolarHBondContact CB-O 3.33Å; S376-E395 PolarHBondContact N-O 3.37Å; S376-N425 PolarHBondContact O-ND2 3.45Å
377	C	90.6	Very high	84.1	Confident	9 Å²	9	50 Å²	50	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	169.3	174.4	62.2	0	0	0	0	110.9	I375 E395 N425 K427	I375-C377 WeakPolarHBondContact CG2-O 3.41Å; C377-E395 PolarHBondContact N-O 3.24Å; C377-E395 PolarHBondContact O-N 3.48Å; C377-N425 CarbonylContact C-O 3.38Å; C377-N425 VanDerWaalsContact CA-O 3.22Å; C377-N425 WeakPolarHBondContact CA-O 3.29Å; C377-N425 HydrophobicContact CB-CB 4.01Å; C377-N425 WeakPolarHBondContact CB-O 3.22Å; C377-K427 HydrophobicContact CB-CG 4.23Å; C377-K427 VanDerWaalsContact SG-CD 3.54Å; C377-K427 WeakPolarHBondContact SG-CE 3.36Å
378	V	93.4	Very high	83.2	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.1	168.7	-55	0	0	0	0	110.5	I375 F380 F392 E393 I394 V419 L424 N425 I426 K427	I375-V378 HydrophobicContact CG2-CG1 3.97Å; V378-F380 HydrophobicContact CG2-CE2 4.31Å; V378-F392 HydrophobicContact CB-CE2 3.78Å; V378-F392 HydrophobicContact CB-CZ 4.27Å; V378-F392 HydrophobicContact CG1-CE2 4.13Å; V378-F392 HydrophobicContact CG1-CZ 4.1Å; V378-F392 HydrophobicContact CG2-CE2 4.02Å; V378-E393 CarbonylContact C-O 3.59Å; V378-E393 WeakPolarHBondContact CA-O 3.37Å; V378-E393 WeakPolarHBondContact CB-O 3.48Å; V378-I394 HydrophobicContact CG1-CG1 4.12Å; V378-I394 HydrophobicContact CG1-CG2 4.37Å; V378-V419 HydrophobicContact CG2-CG1 3.57Å; V378-L424 HydrophobicContact CG1-CD1 4.41Å; V378-N425 PolarHBondContact N-O 3.35Å; V378-I426 HydrophobicContact CG2-CG1 3.86Å; V378-I426 WeakPolarHBondContact O-CA 3.44Å; V378-K427 PolarHBondContact O-N 3.08Å
379	N	91.6	Very high	82.9	Confident	29 Å²	29	57.2 Å²	57.2	16%	0.155	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	150.3	177.5	-168.4	25.8	0	0	0	110.7	E393 N428	N379-E393 HydrophobicContact CB-CB 3.95Å; N379-E393 HydrophobicContact CB-CG 4.02Å; N379-E393 PolarHBondContact N-O 2.81Å; N379-E393 PolarHBondContact ND2-OE2 3.05Å; N379-E393 PolarHBondContact O-N 2.98Å; N379-N428 PolarHBondContact OD1-ND2 2.92Å; N379-N428 PolarHBondContact OD1-OD1 3.4Å
380	F	90.4	Very high	82.7	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.075	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	111.1	170.7	-67.8	-80.8	0	0	0	107.7	V378 F390 F392 Y412 L415 F416 V419 I426 N428	V378-F380 HydrophobicContact CG2-CE2 4.31Å; F380-F390 HydrophobicContact CD1-CD2 4.01Å; F380-F390 AromaticContact CD1-CE2 3.74Å; F380-F390 HydrophobicContact CD1-CE2 3.74Å; F380-F390 AromaticContact CE1-CE2 3.98Å; F380-F390 HydrophobicContact CE1-CE2 3.98Å; F380-F392 AromaticContact CD1-CD2 3.83Å; F380-F392 HydrophobicContact CD1-CD2 3.83Å; F380-F392 AromaticContact CE1-CD2 3.44Å; F380-F392 HydrophobicContact CE1-CD2 3.44Å; F380-F392 VanDerWaalsContact CE1-CD2 3.44Å; F380-F392 AromaticContact CE1-CE2 3.81Å; F380-F392 HydrophobicContact CE1-CE2 3.81Å; F380-F392 HydrophobicContact CE1-CG 4.36Å; F380-F392 HydrophobicContact CE2-CE2 4.36Å; F380-F392 AromaticContact CZ-CD2 3.86Å; F380-F392 HydrophobicContact CZ-CD2 3.86Å; F380-F392 AromaticContact CZ-CE2 3.72Å; F380-F392 HydrophobicContact CZ-CE2 3.72Å; F380-Y412 HydrophobicContact CB-CE2 3.97Å; F380-Y412 HydrophobicContact CD1-CD2 4.02Å; F380-Y412 AromaticContact CD1-CE2 3.51Å; F380-Y412 HydrophobicContact CD1-CE2 3.51Å; F380-Y412 HydrophobicContact CE1-CD2 4.36Å; F380-Y412 HydrophobicContact CE1-CE2 4.05Å; F380-Y412 AromaticContact CG-CE2 3.76Å; F380-Y412 HydrophobicContact CG-CE2 3.76Å; F380-L415 HydrophobicContact CE1-CD2 4Å; F380-L415 HydrophobicContact CE1-CG 4.14Å; F380-L415 HydrophobicContact CZ-CG 4.38Å; F380-F416 HydrophobicContact CD2-CD2 4.35Å; F380-F416 AromaticContact CE2-CD2 3.89Å; F380-F416 HydrophobicContact CE2-CD2 3.89Å; F380-F416 HydrophobicContact CZ-CB 4.45Å; F380-F416 HydrophobicContact CZ-CD2 4.33Å; F380-V419 HydrophobicContact CE2-CG1 4.41Å; F380-V419 HydrophobicContact CZ-CG2 4.24Å; F380-I426 HydrophobicContact CD2-CG2 4.01Å; F380-I426 HydrophobicContact CE2-CD1 4.23Å; F380-I426 HydrophobicContact CE2-CG1 4.28Å; F380-I426 HydrophobicContact CE2-CG2 4.31Å; F380-N428 PolarHBondContact O-ND2 3.16Å
381	A	85.8	Confident	82.6	Confident	29 Å²	29	57 Å²	57	24%	0.24	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.7	177.6	0	0	0	0	0	110.1	G383 F390 D391	A381-G383 PolarHBondContact O-N 2.8Å; A381-F390 WeakPolarHBondContact O-CB 3.47Å; A381-D391 HydrophobicContact CB-CB 4.42Å; A381-D391 PolarHBondContact N-O 2.99Å; A381-D391 PolarHBondContact O-N 2.83Å
382	R	79.1	Confident	82.7	Confident	200 Å²	200	55.7 Å²	55.7	76%	0.755	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	123.3	172.8	-173.5	174.5	-175.7	169.5	0.1	108.5	T384	R382-T384 PolarHBondContact O-N 3.03Å
383	G	68.1	Low	82.8	Confident	8 Å²	8	55.7 Å²	55.7	8%	0.082	29%	0.289	C	S	.	.			trans	-65.4	129	-170.8	0	0	0	0	0	111.8	A381 T385 S389 D391	A381-G383 PolarHBondContact O-N 2.8Å; G383-T385 VanDerWaalsContact C-N 3.29Å; G383-T385 PolarHBondContact O-N 2.68Å; G383-S389 WeakPolarHBondContact CA-O 3.49Å; G383-S389 PolarHBondContact N-O 2.93Å; G383-D391 WeakPolarHBondContact CA-OD2 3.44Å
384	T	63	Low	83	Confident	134 Å²	134	51.7 Å²	51.7	82%	0.822	27%	0.27	S	S	*	.	S	Bend	trans	-73.6	-19.6	-177.7	50.6	0	0	0	0	113.5	R382	R382-T384 PolarHBondContact O-N 3.03Å
385	T	62.5	Low	83.2	Confident	106 Å²	106	52.2 Å²	52.2	65%	0.65	27%	0.273	S	S	*	.	S	Bend	trans	-87.3	-34	-170.1	-58.3	0	0	0	0	113.5	G383	G383-T385 VanDerWaalsContact C-N 3.29Å; G383-T385 PolarHBondContact O-N 2.68Å
386	T	63.4	Low	83.2	Confident	74 Å²	74	52.2 Å²	52.2	45%	0.454	27%	0.273	S	S	.	.			trans	-144.6	150.6	174.1	83.5	0	0	0	0	111.7	R388 S389	T386-R388 PolarHBondContact O-N 2.93Å; T386-R388 VanDerWaalsContact O-N 3.09Å; T386-R388 PolarHBondContact OG1-N 2.97Å; T386-S389 PolarHBondContact N-OG 2.97Å; T386-S389 PolarHBondContact O-N 2.87Å; T386-S389 PolarHBondContact O-OG 3.17Å; T386-S389 WeakPolarHBondContact OG1-CB 3.46Å; T386-S389 PolarHBondContact OG1-N 2.88Å; T386-S389 PolarHBondContact OG1-OG 2.95Å
387	T	60.8	Low	83	Confident	117 Å²	117	56.9 Å²	56.9	72%	0.718	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.8	179.5	53.5	0	0	0	0	114.7
388	R	73.8	Confident	82.7	Confident	186 Å²	186	62.1 Å²	62.1	70%	0.702	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	0.5	-180	-59.5	-171.8	-177.2	-163.9	0.3	114	T386 R409	T386-R388 PolarHBondContact O-N 2.93Å; T386-R388 VanDerWaalsContact O-N 3.09Å; T386-R388 PolarHBondContact OG1-N 2.97Å; R388-R409 VanDerWaalsContact O-CB 3.29Å; R388-R409 WeakPolarHBondContact O-CB 3.46Å; R388-R409 PolarHBondContact O-N 3.17Å; R388-R409 VanDerWaalsContact O-N 3.1Å
389	S	85.2	Confident	82.3	Confident	12 Å²	12	65 Å²	65	8%	0.084	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	150.8	-179.7	50.7	0	0	0	0	113.3	G383 T386 I407	G383-S389 WeakPolarHBondContact CA-O 3.49Å; G383-S389 PolarHBondContact N-O 2.93Å; T386-S389 PolarHBondContact N-OG 2.97Å; T386-S389 PolarHBondContact O-N 2.87Å; T386-S389 PolarHBondContact O-OG 3.17Å; T386-S389 WeakPolarHBondContact OG1-CB 3.46Å; T386-S389 PolarHBondContact OG1-N 2.88Å; T386-S389 PolarHBondContact OG1-OG 2.95Å; S389-I407 CarbonylContact C-O 3.45Å; S389-I407 VanDerWaalsContact CA-O 3.22Å; S389-I407 WeakPolarHBondContact CA-O 3.5Å
390	F	89.3	Confident	82.2	Confident	14 Å²	14	67.1 Å²	67.1	6%	0.061	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	161.8	164.5	77.4	-84.7	0	0	0	111.2	F380 A381 F392 I407 E408 Y412 L415	F380-F390 HydrophobicContact CD1-CD2 4.01Å; F380-F390 AromaticContact CD1-CE2 3.74Å; F380-F390 HydrophobicContact CD1-CE2 3.74Å; F380-F390 AromaticContact CE1-CE2 3.98Å; F380-F390 HydrophobicContact CE1-CE2 3.98Å; A381-F390 WeakPolarHBondContact O-CB 3.47Å; F390-F392 HydrophobicContact CE2-CB 4.09Å; F390-I407 HydrophobicContact CD1-CB 4.01Å; F390-I407 HydrophobicContact CD1-CG2 4.16Å; F390-I407 WeakPolarHBondContact CD1-O 3.27Å; F390-I407 HydrophobicContact CE1-CB 3.65Å; F390-I407 HydrophobicContact CE1-CG2 3.34Å; F390-I407 HydrophobicContact CE2-CB 4.21Å; F390-I407 HydrophobicContact CE2-CD1 3.93Å; F390-I407 HydrophobicContact CE2-CG2 4.32Å; F390-I407 HydrophobicContact CG-CB 4.44Å; F390-I407 HydrophobicContact CZ-CB 3.76Å; F390-I407 HydrophobicContact CZ-CD1 4.05Å; F390-I407 HydrophobicContact CZ-CG2 3.44Å; F390-I407 VanDerWaalsContact CZ-CG2 3.44Å; F390-I407 PolarHBondContact N-O 3.03Å; F390-I407 PolarHBondContact O-N 3.43Å; F390-E408 WeakPolarHBondContact CE1-O 3.27Å; F390-Y412 HydrophobicContact CD1-CD2 4.01Å; F390-Y412 HydrophobicContact CD1-CG 4.45Å; F390-Y412 AromaticContact CD2-CD2 3.89Å; F390-Y412 HydrophobicContact CD2-CD2 3.89Å; F390-Y412 HydrophobicContact CD2-CE2 4.48Å; F390-Y412 VanDerWaalsContact CE1-CA 3.46Å; F390-Y412 VanDerWaalsContact CE1-CB 3.49Å; F390-Y412 AromaticContact CE1-CD2 3.94Å; F390-Y412 HydrophobicContact CE1-CD2 3.94Å; F390-Y412 HydrophobicContact CE1-CG 4.23Å; F390-Y412 AromaticContact CE2-CD2 3.82Å; F390-Y412 HydrophobicContact CE2-CD2 3.82Å; F390-Y412 AromaticContact CG-CD2 3.97Å; F390-Y412 HydrophobicContact CG-CD2 3.97Å; F390-Y412 AromaticContact CZ-CD2 3.85Å; F390-Y412 HydrophobicContact CZ-CD2 3.85Å; F390-Y412 HydrophobicContact CZ-CG 4.4Å; F390-L415 HydrophobicContact CE2-CD2 4.15Å; F390-L415 HydrophobicContact CZ-CD2 4.09Å
391	D	91.4	Very high	82.3	Confident	19 Å²	19	71.3 Å²	71.3	10%	0.102	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.8	177.7	-54.6	-30.9	0	0	0	108.6	A381 G383 T403 F404 S405 S406	A381-D391 HydrophobicContact CB-CB 4.42Å; A381-D391 PolarHBondContact N-O 2.99Å; A381-D391 PolarHBondContact O-N 2.83Å; G383-D391 WeakPolarHBondContact CA-OD2 3.44Å; D391-T403 HydrophobicContact CB-CG2 4.3Å; D391-F404 WeakPolarHBondContact CA-O 3.33Å; D391-S405 WeakPolarHBondContact OD1-CA 3.44Å; D391-S405 WeakPolarHBondContact OD1-CB 3.46Å; D391-S406 PolarHBondContact OD1-N 2.82Å
392	F	93.3	Very high	82.6	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.5	179.2	177.7	-129.3	0	0	0	109.4	L353 F360 V378 F380 F390 I394 F404 I407 L415 V419	L353-F392 HydrophobicContact CD2-CD1 4.05Å; L353-F392 HydrophobicContact CD2-CE1 4.37Å; F360-F392 HydrophobicContact CE1-CE1 4.13Å; F360-F392 HydrophobicContact CE1-CZ 4.43Å; F360-F392 HydrophobicContact CE2-CE1 4.25Å; F360-F392 HydrophobicContact CE2-CZ 4.17Å; F360-F392 AromaticContact CZ-CE1 3.92Å; F360-F392 HydrophobicContact CZ-CE1 3.92Å; F360-F392 AromaticContact CZ-CZ 3.83Å; F360-F392 HydrophobicContact CZ-CZ 3.83Å; V378-F392 HydrophobicContact CB-CE2 3.78Å; V378-F392 HydrophobicContact CB-CZ 4.27Å; V378-F392 HydrophobicContact CG1-CE2 4.13Å; V378-F392 HydrophobicContact CG1-CZ 4.1Å; V378-F392 HydrophobicContact CG2-CE2 4.02Å; F380-F392 AromaticContact CD1-CD2 3.83Å; F380-F392 HydrophobicContact CD1-CD2 3.83Å; F380-F392 AromaticContact CE1-CD2 3.44Å; F380-F392 HydrophobicContact CE1-CD2 3.44Å; F380-F392 VanDerWaalsContact CE1-CD2 3.44Å; F380-F392 AromaticContact CE1-CE2 3.81Å; F380-F392 HydrophobicContact CE1-CE2 3.81Å; F380-F392 HydrophobicContact CE1-CG 4.36Å; F380-F392 HydrophobicContact CE2-CE2 4.36Å; F380-F392 AromaticContact CZ-CD2 3.86Å; F380-F392 HydrophobicContact CZ-CD2 3.86Å; F380-F392 AromaticContact CZ-CE2 3.72Å; F380-F392 HydrophobicContact CZ-CE2 3.72Å; F390-F392 HydrophobicContact CE2-CB 4.09Å; F392-I394 HydrophobicContact CD1-CD1 4.43Å; F392-I394 HydrophobicContact CD1-CG1 4.35Å; F392-I394 HydrophobicContact CE1-CD1 3.71Å; F392-I394 HydrophobicContact CE1-CG1 3.85Å; F392-I394 HydrophobicContact CZ-CD1 4.15Å; F392-I394 HydrophobicContact CZ-CG1 4.03Å; F392-F404 HydrophobicContact CD1-CD2 4.32Å; F392-F404 PolarHBondContact N-O 2.82Å; F392-F404 PolarHBondContact O-N 2.88Å; F392-I407 HydrophobicContact CB-CD1 3.53Å; F392-L415 HydrophobicContact CB-CD2 4.18Å; F392-L415 HydrophobicContact CD1-CD2 3.81Å; F392-L415 HydrophobicContact CD2-CD2 4Å; F392-L415 HydrophobicContact CE1-CD1 4.24Å; F392-L415 HydrophobicContact CE1-CD2 4.09Å; F392-L415 HydrophobicContact CE2-CD2 4.28Å; F392-L415 HydrophobicContact CG-CD2 3.75Å; F392-L415 HydrophobicContact CZ-CD1 4.27Å; F392-L415 HydrophobicContact CZ-CD2 4.32Å; F392-V419 HydrophobicContact CE2-CG2 4.11Å; F392-V419 HydrophobicContact CZ-CG2 3.96Å
393	E	93.2	Very high	83.3	Confident	31 Å²	31	64.9 Å²	64.9	15%	0.145	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.6	-178	-26.6	-165.9	81.3	0	0	111.3	V378 N379 Q401 Y402 T403	V378-E393 CarbonylContact C-O 3.59Å; V378-E393 WeakPolarHBondContact CA-O 3.37Å; V378-E393 WeakPolarHBondContact CB-O 3.48Å; N379-E393 HydrophobicContact CB-CB 3.95Å; N379-E393 HydrophobicContact CB-CG 4.02Å; N379-E393 PolarHBondContact N-O 2.81Å; N379-E393 PolarHBondContact ND2-OE2 3.05Å; N379-E393 PolarHBondContact O-N 2.98Å; E393-Q401 PolarHBondContact OE1-NE2 3.21Å; E393-Q401 PolarHBondContact OE2-NE2 2.73Å; E393-Y402 WeakPolarHBondContact CA-O 3.32Å; E393-T403 HydrophobicContact CG-CG2 4.06Å; E393-T403 WeakPolarHBondContact OE1-CG2 3.22Å; E393-T403 PolarHBondContact OE1-OG1 2.83Å
394	I	94.4	Very high	84.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.4	176.7	-54.2	-178.8	0	0	0	108.5	F360 L370 I375 V378 F392 Q401 Y402 F404	F360-I394 HydrophobicContact CD2-CD1 3.45Å; F360-I394 VanDerWaalsContact CD2-CD1 3.45Å; F360-I394 HydrophobicContact CE2-CD1 3.76Å; F360-I394 HydrophobicContact CG-CD1 4.1Å; L370-I394 HydrophobicContact CD1-CB 4.23Å; L370-I394 HydrophobicContact CD1-CD1 3.94Å; L370-I394 HydrophobicContact CD1-CG2 4.1Å; I375-I394 HydrophobicContact CB-CG2 4.35Å; I375-I394 HydrophobicContact CD1-CG2 3.66Å; I375-I394 HydrophobicContact CG1-CG2 3.62Å; I375-I394 HydrophobicContact CG2-CG2 3.96Å; V378-I394 HydrophobicContact CG1-CG1 4.12Å; V378-I394 HydrophobicContact CG1-CG2 4.37Å; F392-I394 HydrophobicContact CD1-CD1 4.43Å; F392-I394 HydrophobicContact CD1-CG1 4.35Å; F392-I394 HydrophobicContact CE1-CD1 3.71Å; F392-I394 HydrophobicContact CE1-CG1 3.85Å; F392-I394 HydrophobicContact CZ-CD1 4.15Å; F392-I394 HydrophobicContact CZ-CG1 4.03Å; I394-Q401 CarbonylContact O-C 3.54Å; I394-Q401 WeakPolarHBondContact O-CA 3.18Å; I394-Y402 PolarHBondContact N-O 3.13Å; I394-Y402 PolarHBondContact O-N 3.5Å; I394-F404 HydrophobicContact CD1-CE2 4.01Å; I394-F404 HydrophobicContact CG1-CE2 4.4Å
395	E	93.3	Very high	85.9	Confident	60 Å²	60	59.7 Å²	59.7	28%	0.28	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.8	176.2	-176.3	-179.5	131.3	0	0	109	S376 C377 K427	S376-E395 WeakPolarHBondContact CB-O 3.33Å; S376-E395 PolarHBondContact N-O 3.37Å; C377-E395 PolarHBondContact N-O 3.24Å; C377-E395 PolarHBondContact O-N 3.48Å; E395-K427 VanDerWaalsContact CD-NZ 3.27Å; E395-K427 IonicContact OE1-NZ 3.53Å; E395-K427 PolarHBondContact OE1-NZ 2.81Å; E395-K427 VanDerWaalsContact OE1-NZ 3.16Å; E395-K427 IonicContact OE2-NZ 3.27Å; E395-K427 PolarHBondContact OE2-NZ 2.87Å
396	T	92.3	Very high	87.2	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	159.7	176.8	76.4	0	0	0	0	111.7	L370 E374 Q398 G399 N400 Y402	L370-T396 HydrophobicContact CD2-CG2 4.25Å; E374-T396 CarbonylContact O-C 3.54Å; E374-T396 VanDerWaalsContact O-CA 3.22Å; E374-T396 WeakPolarHBondContact O-CA 3.26Å; E374-T396 WeakPolarHBondContact O-CB 3.49Å; T396-Q398 PolarHBondContact O-N 3.46Å; T396-Q398 PolarHBondContact OG1-N 3.04Å; T396-G399 PolarHBondContact O-N 3.38Å; T396-N400 PolarHBondContact N-O 3.28Å; T396-N400 PolarHBondContact OG1-N 2.92Å; T396-Y402 HydrophobicContact CG2-CD2 4.19Å; T396-Y402 HydrophobicContact CG2-CE2 3.79Å
397	K	88.9	Confident	88.5	Confident	141 Å²	141	53.3 Å²	53.3	61%	0.613	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-6.8	173.5	-67.8	166.5	-178.5	151.8	0	113.9	E373 E374 I375	E373-K397 PolarHBondContact O-NZ 2.84Å; E374-K397 PolarHBondContact O-N 3.26Å; I375-K397 WeakPolarHBondContact O-CE 3.26Å; I375-K397 PolarHBondContact O-NZ 3.28Å
398	Q	83.9	Confident	89.9	Confident	119 Å²	119	52.4 Å²	52.4	56%	0.556	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	3.7	172.3	-66.1	173.3	-25	0	0	112.6	N35 T396	N35-Q398 PolarHBondContact O-NE2 2.89Å; T396-Q398 PolarHBondContact O-N 3.46Å; T396-Q398 PolarHBondContact OG1-N 3.04Å
399	G	84.9	Confident	90.5	Very high	61 Å²	61	51.9 Å²	51.9	63%	0.629	26%	0.264	S	S	*	.	S	Bend	trans	81.2	7.8	-178	0	0	0	0	0	115.1	T396	T396-G399 PolarHBondContact O-N 3.38Å
400	N	89.2	Confident	90.6	Very high	75 Å²	75	55.9 Å²	55.9	40%	0.401	28%	0.281	S	S	.	.			trans	-84.7	123.4	179	-69.1	-53.3	0	0	0	111	T396 Y402	T396-N400 PolarHBondContact N-O 3.28Å; T396-N400 PolarHBondContact OG1-N 2.92Å; N400-Y402 HydrophobicContact CB-CD2 4.46Å; N400-Y402 HydrophobicContact CB-CE2 3.61Å
401	Q	91.6	Very high	90.6	Very high	105 Å²	105	55.2 Å²	55.2	49%	0.491	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.8	178.4	-175.2	176.1	-6.1	0	0	112.2	E393 I394	E393-Q401 PolarHBondContact OE1-NE2 3.21Å; E393-Q401 PolarHBondContact OE2-NE2 2.73Å; I394-Q401 CarbonylContact O-C 3.54Å; I394-Q401 WeakPolarHBondContact O-CA 3.18Å
402	Y	93.9	Very high	90.4	Very high	50 Å²	50	58.2 Å²	58.2	20%	0.196	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	94.5	-178.7	-62.9	-99.4	0	0	0	110.2	Y346 V368 L370 E393 I394 T396 N400	Y346-Y402 HydrophobicContact CE2-CD1 4.23Å; Y346-Y402 AromaticContact CZ-CD1 3.9Å; Y346-Y402 VanDerWaalsContact OH-CD1 3.26Å; Y346-Y402 WeakPolarHBondContact OH-CD1 3.48Å; V368-Y402 HydrophobicContact CG1-CD1 3.83Å; V368-Y402 HydrophobicContact CG1-CE1 3.73Å; L370-Y402 HydrophobicContact CD1-CD1 4.24Å; L370-Y402 HydrophobicContact CD1-CD2 3.99Å; L370-Y402 HydrophobicContact CD1-CG 3.85Å; L370-Y402 HydrophobicContact CD2-CD1 4.4Å; L370-Y402 HydrophobicContact CD2-CD2 4.02Å; L370-Y402 HydrophobicContact CD2-CE1 4.11Å; L370-Y402 HydrophobicContact CD2-CE2 3.7Å; L370-Y402 HydrophobicContact CD2-CG 4.37Å; E393-Y402 WeakPolarHBondContact CA-O 3.32Å; I394-Y402 PolarHBondContact N-O 3.13Å; I394-Y402 PolarHBondContact O-N 3.5Å; T396-Y402 HydrophobicContact CG2-CD2 4.19Å; T396-Y402 HydrophobicContact CG2-CE2 3.79Å; N400-Y402 HydrophobicContact CB-CD2 4.46Å; N400-Y402 HydrophobicContact CB-CE2 3.61Å
403	T	93.1	Very high	90.2	Very high	44 Å²	44	59.7 Å²	59.7	27%	0.27	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.2	177.1	-48.3	0	0	0	0	110.9	Y346 D391 E393	Y346-T403 WeakPolarHBondContact CD2-O 3.45Å; D391-T403 HydrophobicContact CB-CG2 4.3Å; E393-T403 HydrophobicContact CG-CG2 4.06Å; E393-T403 WeakPolarHBondContact OE1-CG2 3.22Å; E393-T403 PolarHBondContact OE1-OG1 2.83Å
404	F	93.8	Very high	90.1	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.009	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	104.8	170.9	-59.8	-83.7	0	0	0	108.5	C344 S345 Y346 L353 Y362 D391 F392 I394 I407	C344-F404 HydrophobicContact CB-CB 4.37Å; S345-F404 CarbonylContact O-C 3.53Å; S345-F404 WeakPolarHBondContact O-CA 3.48Å; Y346-F404 AromaticContact CD2-CD1 3.83Å; Y346-F404 HydrophobicContact CD2-CD1 3.83Å; Y346-F404 AromaticContact CD2-CE1 3.71Å; Y346-F404 HydrophobicContact CD2-CE1 3.71Å; Y346-F404 HydrophobicContact CD2-CG 4.46Å; Y346-F404 HydrophobicContact CD2-CZ 4.27Å; Y346-F404 HydrophobicContact CE2-CE1 4.4Å; Y346-F404 HydrophobicContact CG-CD1 4.09Å; Y346-F404 AromaticContact CG-CE1 3.87Å; Y346-F404 HydrophobicContact CG-CE1 3.87Å; L353-F404 HydrophobicContact CD1-CD1 4.34Å; L353-F404 HydrophobicContact CD1-CE1 4.08Å; L353-F404 HydrophobicContact CD1-CE2 4.43Å; L353-F404 HydrophobicContact CD1-CZ 4.12Å; L353-F404 HydrophobicContact CD2-CD2 4.43Å; L353-F404 HydrophobicContact CD2-CG 4.25Å; Y362-F404 HydrophobicContact CD1-CE1 4.5Å; Y362-F404 HydrophobicContact CD2-CD1 4.15Å; Y362-F404 HydrophobicContact CD2-CE1 4.02Å; Y362-F404 HydrophobicContact CG-CD1 4.39Å; Y362-F404 AromaticContact CG-CE1 3.81Å; Y362-F404 HydrophobicContact CG-CE1 3.81Å; D391-F404 WeakPolarHBondContact CA-O 3.33Å; F392-F404 HydrophobicContact CD1-CD2 4.32Å; F392-F404 PolarHBondContact N-O 2.82Å; F392-F404 PolarHBondContact O-N 2.88Å; I394-F404 HydrophobicContact CD1-CE2 4.01Å; I394-F404 HydrophobicContact CG1-CE2 4.4Å; F404-I407 HydrophobicContact CB-CD1 4.4Å
405	S	91.9	Very high	89.9	Confident	31 Å²	31	63.2 Å²	63.2	22%	0.217	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	170	-173.5	63.1	0	0	0	0	113.5	S345 D391 I407	S345-S405 PolarHBondContact N-O 3.16Å; S345-S405 PolarHBondContact O-N 3.49Å; D391-S405 WeakPolarHBondContact OD1-CA 3.44Å; D391-S405 WeakPolarHBondContact OD1-CB 3.46Å; S405-I407 PolarHBondContact O-N 3.07Å
406	S	89.4	Confident	89.8	Confident	46 Å²	46	63.4 Å²	63.4	32%	0.322	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.4	37.7	171.7	-53.4	0	0	0	0	114.3	D391	D391-S406 PolarHBondContact OD1-N 2.82Å
407	I	90.9	Very high	89.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.3	174.6	-56	168.7	0	0	0	109.6	I342 C344 S389 F390 F392 F404 S405 E411	I342-I407 HydrophobicContact CG2-CB 4.44Å; I342-I407 HydrophobicContact CG2-CD1 4.2Å; I342-I407 HydrophobicContact CG2-CG1 4.07Å; I342-I407 HydrophobicContact CG2-CG2 3.53Å; C344-I407 HydrophobicContact CB-CD1 4.32Å; C344-I407 HydrophobicContact CB-CG1 3.66Å; S389-I407 CarbonylContact C-O 3.45Å; S389-I407 VanDerWaalsContact CA-O 3.22Å; S389-I407 WeakPolarHBondContact CA-O 3.5Å; F390-I407 HydrophobicContact CD1-CB 4.01Å; F390-I407 HydrophobicContact CD1-CG2 4.16Å; F390-I407 WeakPolarHBondContact CD1-O 3.27Å; F390-I407 HydrophobicContact CE1-CB 3.65Å; F390-I407 HydrophobicContact CE1-CG2 3.34Å; F390-I407 HydrophobicContact CE2-CB 4.21Å; F390-I407 HydrophobicContact CE2-CD1 3.93Å; F390-I407 HydrophobicContact CE2-CG2 4.32Å; F390-I407 HydrophobicContact CG-CB 4.44Å; F390-I407 HydrophobicContact CZ-CB 3.76Å; F390-I407 HydrophobicContact CZ-CD1 4.05Å; F390-I407 HydrophobicContact CZ-CG2 3.44Å; F390-I407 VanDerWaalsContact CZ-CG2 3.44Å; F390-I407 PolarHBondContact N-O 3.03Å; F390-I407 PolarHBondContact O-N 3.43Å; F392-I407 HydrophobicContact CB-CD1 3.53Å; F404-I407 HydrophobicContact CB-CD1 4.4Å; S405-I407 PolarHBondContact O-N 3.07Å; I407-E411 HydrophobicContact CG2-CB 4.27Å
408	E	89.4	Confident	90	Very high	98 Å²	98	61.8 Å²	61.8	46%	0.458	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	130.6	177.4	-66.8	175.1	166.2	0	0	111	F390 E410 E411	F390-E408 WeakPolarHBondContact CE1-O 3.27Å; E408-E410 PolarHBondContact O-N 3.41Å; E408-E410 VanDerWaalsContact O-N 3.08Å; E408-E411 PolarHBondContact O-N 2.94Å
409	R	86.2	Confident	90.4	Very high	175 Å²	175	56.1 Å²	56.1	66%	0.66	29%	0.289	S	S	*	.	H	α-helix	trans	-56.9	-27.6	-177.8	179.5	175.5	179.7	-178.4	-1.8	112.8	R388 E411 Y412	R388-R409 VanDerWaalsContact O-CB 3.29Å; R388-R409 WeakPolarHBondContact O-CB 3.46Å; R388-R409 PolarHBondContact O-N 3.17Å; R388-R409 VanDerWaalsContact O-N 3.1Å; R409-E411 VanDerWaalsContact C-N 3.3Å; R409-E411 PolarHBondContact O-N 3.37Å; R409-Y412 WeakPolarHBondContact O-CB 3.47Å; R409-Y412 PolarHBondContact O-N 3.25Å
410	E	88.3	Confident	90.7	Very high	95 Å²	95	55.2 Å²	55.2	44%	0.444	27%	0.27	S	S	.	.	H	α-helix	trans	-65.3	-31.5	177	-64	70.2	-158.1	0	0	111.9	H336 E408	H336-E410 HydrophobicContact CB-CB 4.21Å; E408-E410 PolarHBondContact O-N 3.41Å; E408-E410 VanDerWaalsContact O-N 3.08Å
411	E	88.4	Confident	90.8	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-83.2	-10.3	175.2	-62.8	-173.6	161.8	0	0	112.5	K249 H336 I342 T343 I407 E408 R409 L415	K249-E411 IonicContact NZ-OE1 3.08Å; K249-E411 PolarHBondContact NZ-OE1 3.04Å; K249-E411 VanDerWaalsContact NZ-OE1 3.15Å; H336-E411 HydrophobicContact CB-CG 4.12Å; I342-E411 VanDerWaalsContact CA-OE2 3.28Å; I342-E411 WeakPolarHBondContact CA-OE2 3.38Å; I342-E411 WeakPolarHBondContact CG2-OE2 3.34Å; T343-E411 PolarHBondContact N-OE2 2.85Å; I407-E411 HydrophobicContact CG2-CB 4.27Å; E408-E411 PolarHBondContact O-N 2.94Å; R409-E411 VanDerWaalsContact C-N 3.3Å; R409-E411 PolarHBondContact O-N 3.37Å; E411-L415 PolarHBondContact O-N 3.24Å; E411-L415 VanDerWaalsContact O-N 3.15Å
412	Y	87.3	Confident	90.8	Very high	82 Å²	82	54 Å²	54	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-56.6	-53.1	179.8	178.4	-96.8	0	0	0	113	F380 F390 R409 K414 L415 F416	F380-Y412 HydrophobicContact CB-CE2 3.97Å; F380-Y412 HydrophobicContact CD1-CD2 4.02Å; F380-Y412 AromaticContact CD1-CE2 3.51Å; F380-Y412 HydrophobicContact CD1-CE2 3.51Å; F380-Y412 HydrophobicContact CE1-CD2 4.36Å; F380-Y412 HydrophobicContact CE1-CE2 4.05Å; F380-Y412 AromaticContact CG-CE2 3.76Å; F380-Y412 HydrophobicContact CG-CE2 3.76Å; F390-Y412 HydrophobicContact CD1-CD2 4.01Å; F390-Y412 HydrophobicContact CD1-CG 4.45Å; F390-Y412 AromaticContact CD2-CD2 3.89Å; F390-Y412 HydrophobicContact CD2-CD2 3.89Å; F390-Y412 HydrophobicContact CD2-CE2 4.48Å; F390-Y412 VanDerWaalsContact CE1-CA 3.46Å; F390-Y412 VanDerWaalsContact CE1-CB 3.49Å; F390-Y412 AromaticContact CE1-CD2 3.94Å; F390-Y412 HydrophobicContact CE1-CD2 3.94Å; F390-Y412 HydrophobicContact CE1-CG 4.23Å; F390-Y412 AromaticContact CE2-CD2 3.82Å; F390-Y412 HydrophobicContact CE2-CD2 3.82Å; F390-Y412 AromaticContact CG-CD2 3.97Å; F390-Y412 HydrophobicContact CG-CD2 3.97Å; F390-Y412 AromaticContact CZ-CD2 3.85Å; F390-Y412 HydrophobicContact CZ-CD2 3.85Å; F390-Y412 HydrophobicContact CZ-CG 4.4Å; R409-Y412 WeakPolarHBondContact O-CB 3.47Å; R409-Y412 PolarHBondContact O-N 3.25Å; Y412-K414 PolarHBondContact O-N 3.05Å; Y412-L415 PolarHBondContact O-N 3.35Å; Y412-F416 HydrophobicContact CE1-CB 4.19Å; Y412-F416 HydrophobicContact CE1-CD2 4.44Å; Y412-F416 HydrophobicContact CE1-CG 4.36Å; Y412-F416 WeakPolarHBondContact O-CB 3.38Å; Y412-F416 PolarHBondContact O-N 2.87Å
413	G	89.1	Confident	90.6	Very high	31 Å²	31	60.5 Å²	60.5	32%	0.32	30%	0.303	S	S	.	.	H	α-helix	trans	-58.4	-49.6	-174.4	0	0	0	0	0	111.4	L415 F416 D417	G413-L415 VanDerWaalsContact C-N 3.34Å; G413-L415 PolarHBondContact O-N 3.41Å; G413-F416 PolarHBondContact O-N 3.31Å; G413-D417 WeakPolarHBondContact O-CB 3.44Å; G413-D417 PolarHBondContact O-N 3.15Å
414	K	91.3	Very high	90.5	Very high	104 Å²	104	59.3 Å²	59.3	45%	0.452	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-39.6	178	-63.4	-58.8	-174.3	-173.1	0	112.9	F333 Q334 Y412 F418	F333-K414 HydrophobicContact CE2-CB 4.09Å; F333-K414 HydrophobicContact CZ-CB 4.26Å; Q334-K414 WeakPolarHBondContact O-CG 3.43Å; Y412-K414 PolarHBondContact O-N 3.05Å; K414-F418 VanDerWaalsContact O-CB 3.31Å; K414-F418 WeakPolarHBondContact O-CB 3.28Å; K414-F418 PolarHBondContact O-N 2.69Å; K414-F418 VanDerWaalsContact O-N 3.07Å
415	L	91.8	Very high	90.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.4	-41.7	175.8	-178.9	58.2	0	0	0	111.7	I342 F360 F380 F390 F392 E411 Y412 G413 F418 V419	I342-L415 HydrophobicContact CD1-CB 3.86Å; I342-L415 HydrophobicContact CD1-CD1 3.84Å; I342-L415 HydrophobicContact CD1-CD2 3.84Å; I342-L415 HydrophobicContact CD1-CG 4.04Å; F360-L415 HydrophobicContact CE1-CD1 4.14Å; F380-L415 HydrophobicContact CE1-CD2 4Å; F380-L415 HydrophobicContact CE1-CG 4.14Å; F380-L415 HydrophobicContact CZ-CG 4.38Å; F390-L415 HydrophobicContact CE2-CD2 4.15Å; F390-L415 HydrophobicContact CZ-CD2 4.09Å; F392-L415 HydrophobicContact CB-CD2 4.18Å; F392-L415 HydrophobicContact CD1-CD2 3.81Å; F392-L415 HydrophobicContact CD2-CD2 4Å; F392-L415 HydrophobicContact CE1-CD1 4.24Å; F392-L415 HydrophobicContact CE1-CD2 4.09Å; F392-L415 HydrophobicContact CE2-CD2 4.28Å; F392-L415 HydrophobicContact CG-CD2 3.75Å; F392-L415 HydrophobicContact CZ-CD1 4.27Å; F392-L415 HydrophobicContact CZ-CD2 4.32Å; E411-L415 PolarHBondContact O-N 3.24Å; E411-L415 VanDerWaalsContact O-N 3.15Å; Y412-L415 PolarHBondContact O-N 3.35Å; G413-L415 VanDerWaalsContact C-N 3.34Å; G413-L415 PolarHBondContact O-N 3.41Å; L415-F418 PolarHBondContact O-N 2.87Å; L415-V419 HydrophobicContact CD1-CG2 4.12Å; L415-V419 HydrophobicContact CG-CG2 4.41Å; L415-V419 WeakPolarHBondContact O-CB 3.3Å; L415-V419 WeakPolarHBondContact O-CG2 3.24Å; L415-V419 PolarHBondContact O-N 3.45Å
416	F	91.1	Very high	90.3	Very high	65 Å²	65	64 Å²	64	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-62.6	-47.4	176.4	-177.5	-96.5	0	0	0	111.4	F380 Y412 G413 F418 V419 N420 I426	F380-F416 HydrophobicContact CD2-CD2 4.35Å; F380-F416 AromaticContact CE2-CD2 3.89Å; F380-F416 HydrophobicContact CE2-CD2 3.89Å; F380-F416 HydrophobicContact CZ-CB 4.45Å; F380-F416 HydrophobicContact CZ-CD2 4.33Å; Y412-F416 HydrophobicContact CE1-CB 4.19Å; Y412-F416 HydrophobicContact CE1-CD2 4.44Å; Y412-F416 HydrophobicContact CE1-CG 4.36Å; Y412-F416 WeakPolarHBondContact O-CB 3.38Å; Y412-F416 PolarHBondContact O-N 2.87Å; G413-F416 PolarHBondContact O-N 3.31Å; F416-F418 VanDerWaalsContact C-N 3.33Å; F416-F418 PolarHBondContact O-N 3.13Å; F416-V419 PolarHBondContact O-N 2.95Å; F416-N420 VanDerWaalsContact CD1-ND2 3.31Å; F416-N420 WeakPolarHBondContact CD1-ND2 3.42Å; F416-N420 WeakPolarHBondContact CE1-ND2 3.33Å; F416-N420 WeakPolarHBondContact CZ-ND2 3.41Å; F416-N420 PolarHBondContact O-N 3.46Å; F416-N420 PolarHBondContact O-ND2 3.12Å; F416-I426 HydrophobicContact CD2-CD1 4.07Å; F416-I426 HydrophobicContact CE2-CD1 3.72Å; F416-I426 HydrophobicContact CZ-CD1 4.42Å
417	D	91.9	Very high	90	Very high	91 Å²	91	67.6 Å²	67.6	49%	0.487	33%	0.327	S	S	.	.	H	α-helix	trans	-55.9	-47.8	174.8	-63.1	-23.4	0	0	0	110.9	G413 N420 A421	G413-D417 WeakPolarHBondContact O-CB 3.44Å; G413-D417 PolarHBondContact O-N 3.15Å; D417-N420 PolarHBondContact O-N 3.45Å; D417-A421 VanDerWaalsContact O-CB 3.28Å; D417-A421 WeakPolarHBondContact O-CB 3.16Å; D417-A421 PolarHBondContact O-N 3.4Å
418	F	92.4	Very high	89.2	Confident	22 Å²	22	71.5 Å²	71.5	10%	0.096	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-44.2	178.7	178.5	-88.7	0	0	0	112.9	F333 P355 L356 F360 F372 K414 L415 F416 A421 K422	F333-F418 HydrophobicContact CB-CD2 4.04Å; F333-F418 HydrophobicContact CB-CE2 4.08Å; F333-F418 HydrophobicContact CD2-CB 3.85Å; F333-F418 AromaticContact CD2-CD2 3.76Å; F333-F418 HydrophobicContact CD2-CD2 3.76Å; F333-F418 HydrophobicContact CD2-CE2 4.5Å; F333-F418 AromaticContact CD2-CG 3.85Å; F333-F418 HydrophobicContact CD2-CG 3.85Å; F333-F418 HydrophobicContact CE2-CB 4.15Å; F333-F418 HydrophobicContact CG-CD2 4.33Å; P355-F418 HydrophobicContact CB-CD1 3.93Å; P355-F418 HydrophobicContact CB-CD2 4.38Å; P355-F418 HydrophobicContact CB-CE1 3.52Å; P355-F418 HydrophobicContact CB-CE2 4Å; P355-F418 HydrophobicContact CB-CG 4.35Å; P355-F418 HydrophobicContact CB-CZ 3.54Å; L356-F418 WeakPolarHBondContact O-CZ 3.44Å; F360-F418 HydrophobicContact CE1-CD1 4.43Å; F360-F418 HydrophobicContact CE1-CE1 4.08Å; F360-F418 HydrophobicContact CZ-CD1 4.5Å; F360-F418 HydrophobicContact CZ-CE1 4.2Å; F372-F418 HydrophobicContact CE2-CZ 4.5Å; F372-F418 AromaticContact CZ-CE1 3.79Å; F372-F418 HydrophobicContact CZ-CE1 3.79Å; F372-F418 AromaticContact CZ-CZ 3.94Å; F372-F418 HydrophobicContact CZ-CZ 3.94Å; K414-F418 VanDerWaalsContact O-CB 3.31Å; K414-F418 WeakPolarHBondContact O-CB 3.28Å; K414-F418 PolarHBondContact O-N 2.69Å; K414-F418 VanDerWaalsContact O-N 3.07Å; L415-F418 PolarHBondContact O-N 2.87Å; F416-F418 VanDerWaalsContact C-N 3.33Å; F416-F418 PolarHBondContact O-N 3.13Å; F418-A421 PolarHBondContact O-N 3.31Å; F418-K422 HydrophobicContact CD1-CG 4.34Å; F418-K422 HydrophobicContact CE1-CG 3.92Å; F418-K422 HydrophobicContact CE2-CG 4.26Å; F418-K422 HydrophobicContact CZ-CG 3.89Å; F418-K422 WeakPolarHBondContact O-CB 3.21Å; F418-K422 WeakPolarHBondContact O-CG 3.41Å; F418-K422 PolarHBondContact O-N 3.32Å
419	V	92	Very high	87.9	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-43.5	177.7	163.4	0	0	0	0	111	F360 V378 F380 F392 L415 F416 K422 K423 L424 I426	F360-V419 HydrophobicContact CZ-CG2 4.34Å; V378-V419 HydrophobicContact CG2-CG1 3.57Å; F380-V419 HydrophobicContact CE2-CG1 4.41Å; F380-V419 HydrophobicContact CZ-CG2 4.24Å; F392-V419 HydrophobicContact CE2-CG2 4.11Å; F392-V419 HydrophobicContact CZ-CG2 3.96Å; L415-V419 HydrophobicContact CD1-CG2 4.12Å; L415-V419 HydrophobicContact CG-CG2 4.41Å; L415-V419 WeakPolarHBondContact O-CB 3.3Å; L415-V419 WeakPolarHBondContact O-CG2 3.24Å; L415-V419 PolarHBondContact O-N 3.45Å; F416-V419 PolarHBondContact O-N 2.95Å; V419-K422 PolarHBondContact O-N 3.03Å; V419-K423 PolarHBondContact O-N 3.35Å; V419-L424 HydrophobicContact CG1-CB 3.94Å; V419-L424 HydrophobicContact CG2-CD1 4.44Å; V419-L424 PolarHBondContact O-N 3.17Å; V419-L424 VanDerWaalsContact O-N 3.1Å; V419-I426 HydrophobicContact CG1-CD1 3.78Å; V419-I426 HydrophobicContact CG1-CG1 3.67Å
420	N	91	Very high	86	Confident	43 Å²	43	68.5 Å²	68.5	23%	0.23	35%	0.349	C	S	.	.	H	α-helix	trans	-67.4	-43.5	175.1	-74.2	-73.5	0	0	0	111.9	F416 D417 K422 K423 R429	F416-N420 VanDerWaalsContact CD1-ND2 3.31Å; F416-N420 WeakPolarHBondContact CD1-ND2 3.42Å; F416-N420 WeakPolarHBondContact CE1-ND2 3.33Å; F416-N420 WeakPolarHBondContact CZ-ND2 3.41Å; F416-N420 PolarHBondContact O-N 3.46Å; F416-N420 PolarHBondContact O-ND2 3.12Å; D417-N420 PolarHBondContact O-N 3.45Å; N420-K422 VanDerWaalsContact C-N 3.26Å; N420-K422 PolarHBondContact O-N 2.95Å; N420-K423 WeakPolarHBondContact O-CA 3.49Å; N420-K423 PolarHBondContact O-N 2.89Å; N420-R429 PolarHBondContact OD1-NH2 3.46Å
421	A	92.3	Very high	83.7	Confident	80 Å²	80	73.4 Å²	73.4	66%	0.661	37%	0.37	S	S	*	.	H	α-helix	trans	-62.4	-31.6	176.9	0	0	0	0	0	112.9	D417 F418 K423	D417-A421 VanDerWaalsContact O-CB 3.28Å; D417-A421 WeakPolarHBondContact O-CB 3.16Å; D417-A421 PolarHBondContact O-N 3.4Å; F418-A421 PolarHBondContact O-N 3.31Å; A421-K423 VanDerWaalsContact C-N 3.29Å
422	K	91.2	Very high	81.6	Confident	75 Å²	75	83.4 Å²	83.4	33%	0.326	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	5.3	171.8	-65.9	-63.2	-176.5	173.5	0	114.1	E357 F372 F418 V419 N420 L424	E357-K422 WeakPolarHBondContact O-CE 3.35Å; E357-K422 PolarHBondContact O-NZ 3.49Å; F372-K422 HydrophobicContact CD2-CB 4.42Å; F372-K422 HydrophobicContact CD2-CD 4.37Å; F372-K422 HydrophobicContact CD2-CG 4.47Å; F372-K422 HydrophobicContact CE2-CB 4.1Å; F372-K422 HydrophobicContact CE2-CD 3.75Å; F372-K422 HydrophobicContact CE2-CG 3.73Å; F372-K422 HydrophobicContact CZ-CG 4.21Å; F418-K422 HydrophobicContact CD1-CG 4.34Å; F418-K422 HydrophobicContact CE1-CG 3.92Å; F418-K422 HydrophobicContact CE2-CG 4.26Å; F418-K422 HydrophobicContact CZ-CG 3.89Å; F418-K422 WeakPolarHBondContact O-CB 3.21Å; F418-K422 WeakPolarHBondContact O-CG 3.41Å; F418-K422 PolarHBondContact O-N 3.32Å; V419-K422 PolarHBondContact O-N 3.03Å; N420-K422 VanDerWaalsContact C-N 3.26Å; N420-K422 PolarHBondContact O-N 2.95Å; K422-L424 HydrophobicContact CB-CG 4.33Å; K422-L424 PolarHBondContact O-N 3.45Å
423	K	90.2	Very high	79.1	Confident	186 Å²	186	87.1 Å²	87.1	81%	0.809	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	37.7	177.2	-56.3	-173.9	180	-175.2	0	113.6	V419 N420 A421	V419-K423 PolarHBondContact O-N 3.35Å; N420-K423 WeakPolarHBondContact O-CA 3.49Å; N420-K423 PolarHBondContact O-N 2.89Å; A421-K423 VanDerWaalsContact C-N 3.29Å
424	L	91.1	Very high	76.5	Confident	18 Å²	18	89.3 Å²	89.3	9%	0.094	46%	0.456	C	S	.	.			trans	-80.4	133.7	173.3	-63.6	176.8	0	0	0	109.8	F360 F372 I375 V378 V419 K422 I426	F360-L424 HydrophobicContact CE2-CD1 3.97Å; F360-L424 HydrophobicContact CZ-CD1 4.28Å; F372-L424 HydrophobicContact CB-CD2 4.08Å; F372-L424 HydrophobicContact CD1-CD1 4.11Å; F372-L424 HydrophobicContact CD1-CD2 4.26Å; F372-L424 HydrophobicContact CE1-CD1 4.21Å; F372-L424 HydrophobicContact CG-CD2 4.21Å; I375-L424 HydrophobicContact CB-CD2 4.33Å; I375-L424 HydrophobicContact CD1-CD1 4.2Å; I375-L424 HydrophobicContact CD1-CD2 4.26Å; I375-L424 HydrophobicContact CG2-CD2 4.34Å; V378-L424 HydrophobicContact CG1-CD1 4.41Å; V419-L424 HydrophobicContact CG1-CB 3.94Å; V419-L424 HydrophobicContact CG2-CD1 4.44Å; V419-L424 PolarHBondContact O-N 3.17Å; V419-L424 VanDerWaalsContact O-N 3.1Å; K422-L424 HydrophobicContact CB-CG 4.33Å; K422-L424 PolarHBondContact O-N 3.45Å; L424-I426 PolarHBondContact O-N 3.41Å
425	N	89.3	Confident	74	Confident	114 Å²	114	93.1 Å²	93.1	61%	0.61	48%	0.478	S	S	*	.			trans	-64.9	126.6	179	-65	-30.5	0	0	0	110.8	S376 C377 V378	S376-N425 PolarHBondContact O-ND2 3.45Å; C377-N425 CarbonylContact C-O 3.38Å; C377-N425 VanDerWaalsContact CA-O 3.22Å; C377-N425 WeakPolarHBondContact CA-O 3.29Å; C377-N425 HydrophobicContact CB-CB 4.01Å; C377-N425 WeakPolarHBondContact CB-O 3.22Å; V378-N425 PolarHBondContact N-O 3.35Å
426	I	91	Very high	71.2	Confident	19 Å²	19	103.6 Å²	103.6	10%	0.097	52%	0.523	C	S	.	.	B	Isolated β-bridge	trans	-105.3	116.8	177.4	-61.3	165.2	0	0	0	108.9	V378 F380 F416 V419 L424 R429	V378-I426 HydrophobicContact CG2-CG1 3.86Å; V378-I426 WeakPolarHBondContact O-CA 3.44Å; F380-I426 HydrophobicContact CD2-CG2 4.01Å; F380-I426 HydrophobicContact CE2-CD1 4.23Å; F380-I426 HydrophobicContact CE2-CG1 4.28Å; F380-I426 HydrophobicContact CE2-CG2 4.31Å; F416-I426 HydrophobicContact CD2-CD1 4.07Å; F416-I426 HydrophobicContact CE2-CD1 3.72Å; F416-I426 HydrophobicContact CZ-CD1 4.42Å; V419-I426 HydrophobicContact CG1-CD1 3.78Å; V419-I426 HydrophobicContact CG1-CG1 3.67Å; L424-I426 PolarHBondContact O-N 3.41Å; I426-R429 HydrophobicContact CB-CG 4.21Å; I426-R429 HydrophobicContact CG2-CG 4.3Å
427	K	84.3	Confident	68.3	Low	120 Å²	120	103.9 Å²	103.9	52%	0.522	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-62.1	-43.3	179.5	-95.9	179.9	175.1	169.9	0	112.6	C377 V378 E395 R429	C377-K427 HydrophobicContact CB-CG 4.23Å; C377-K427 VanDerWaalsContact SG-CD 3.54Å; C377-K427 WeakPolarHBondContact SG-CE 3.36Å; V378-K427 PolarHBondContact O-N 3.08Å; E395-K427 VanDerWaalsContact CD-NZ 3.27Å; E395-K427 IonicContact OE1-NZ 3.53Å; E395-K427 PolarHBondContact OE1-NZ 2.81Å; E395-K427 VanDerWaalsContact OE1-NZ 3.16Å; E395-K427 IonicContact OE2-NZ 3.27Å; E395-K427 PolarHBondContact OE2-NZ 2.87Å; K427-R429 VanDerWaalsContact C-N 3.33Å; K427-R429 PolarHBondContact O-N 3.06Å
428	N	73.6	Confident	65.3	Low	82 Å²	82	107 Å²	107	44%	0.439	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-85.4	27.7	-172.1	-85.7	8.2	0	0	0	115.9	N379 F380 G430	N379-N428 PolarHBondContact OD1-ND2 2.92Å; N379-N428 PolarHBondContact OD1-OD1 3.4Å; F380-N428 PolarHBondContact O-ND2 3.16Å; N428-G430 VanDerWaalsContact C-N 3.32Å; N428-G430 PolarHBondContact O-N 3Å
429	R	62.3	Low	62.4	Low	157 Å²	157	113.7 Å²	113.7	59%	0.592	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-63.7	-36.5	173.8	-82.8	-173.7	169.5	-154.4	-1.7	112.7	N420 I426 K427 F431	N420-R429 PolarHBondContact OD1-NH2 3.46Å; I426-R429 HydrophobicContact CB-CG 4.21Å; I426-R429 HydrophobicContact CG2-CG 4.3Å; K427-R429 VanDerWaalsContact C-N 3.33Å; K427-R429 PolarHBondContact O-N 3.06Å; R429-F431 PolarHBondContact O-N 3.37Å
430	G	45.7	Very low	59.5	Low	53 Å²	53	121.5 Å²	121.5	55%	0.546	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-87.8	35.9	-166.7	0	0	0	0	0	118.2	N428	N428-G430 VanDerWaalsContact C-N 3.32Å; N428-G430 PolarHBondContact O-N 3Å
431	F	41	Very low	56.7	Low	199 Å²	199	126 Å²	126	87%	0.873	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-94.1	2.5	166.2	-116	-75.9	0	0	0	113.5	R429	R429-F431 PolarHBondContact O-N 3.37Å
432	K	43.8	Very low	53.8	Low	210 Å²	210	131.7 Å²	131.7	91%	0.913	66%	0.663	S	S	*	*	S	Bend	trans	-139.4	33.7	170.3	-91.1	-158.1	172.6	-165	0	112.5
433	E	34.8	Very low	50.9	Low	161 Å²	161	133 Å²	133	75%	0.752	68%	0.682	S	S	*	*			trans	-143.3	81.8	178.1	-116.3	166.1	-164.4	0	0	109.3
434	G	33.7	Very low	48	Very low	77 Å²	77	132 Å²	132	79%	0.794	69%	0.685	S	S	*	*	S	Bend	trans	-156.2	6.2	-171.7	0	0	0	0	0	116.2
435	M	40	Very low	45	Very low	184 Å²	184	135.7 Å²	135.7	91%	0.906	71%	0.713	S	S	*	*	S	Bend	trans	-162.8	88.1	170.2	-157.2	66.6	145	0	0	112
436	K	32	Very low	42.3	Very low	220 Å²	220	137.2 Å²	137.2	96%	0.957	72%	0.721	S	S	*	*			trans	-173.8	107.4	151.7	-110.1	-180	-178.8	-168.8	0	109.5
437	G	30.1	Very low	39.6	Very low	70 Å²	70	144.9 Å²	144.9	72%	0.722	76%	0.756	S	S	*	*			trans	-118.7	137.3	162.5	0	0	0	0	0	108.4
438	N	30.2	Very low	37.7	Very low	158 Å²	158	146.8 Å²	146.8	85%	0.845	77%	0.772	S	S	*	*			trans	39.4	103.1	167.7	-59	8.1	0	0	0	118.2
439	I	29.9	Very low	36	Very low	162 Å²	162	152.2 Å²	152.2	83%	0.831	80%	0.795	S	S	*	*				-150.4	127.7	115	-112.4	169.4	0	0	0	108.1
440	D	33	Very low	35	Very low	164 Å²	164	151.4 Å²	151.4	88%	0.877	80%	0.797	S	S	*	*			trans	-114.7	99.8	171.9	-74.4	-48	0	0	0	107.3
441	E	32.1	Very low	35.4	Very low	136 Å²	136	154 Å²	154	64%	0.636	80%	0.799	S	S	*	*			trans	-161.3	130.6	165.7	-124.8	-178.3	140.5	0	0	111.2
442	Y	29.7	Very low	36	Very low	200 Å²	200	147.7 Å²	147.7	78%	0.784	78%	0.784	S	S	*	*			trans	60.8	151.5	177.5	-45.9	-77.5	0	0	0	117.5
443	S	31	Very low	36.4	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	77%	0.768	S	S	*	*			cis	166.5	98.8	-34.1	169	0	0	0	0	106.1
444	D	28.5	Very low	37.4	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	76%	0.762	S	S	*	*			trans	72.2	164.5	156.5	-142.4	-1.8	0	0	0	119.8
445	S	29.8	Very low	38.7	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	75%	0.749	S	S	*	*			trans	73.9	105.7	172.2	-141.1	0	0	0	0	120.2
446	D	31.1	Very low	39.6	Very low	146 Å²	146	145 Å²	145	78%	0.781	74%	0.741	S	S	*	*				38.3	139.7	129.7	-62.2	-25	0	0	0	125.4
447	E	35.1	Very low	41	Very low	180 Å²	180	139.6 Å²	139.6	84%	0.841	72%	0.721	S	S	*	*			trans	69.7	137.8	149.2	-69.1	-177.2	166	0	0	123.2
448	D	44.4	Very low	42.7	Very low	159 Å²	159	144.4 Å²	144.4	85%	0.85	72%	0.722	S	S	*	*			trans	23.9	95.6	162.7	-70.6	-11.2	0	0	0	120.8
449	Q	37.7	Very low	44	Very low	196 Å²	196	139.4 Å²	139.4	92%	0.916	70%	0.702	S	S	*	*			trans	-96.5	111.5	165.1	-154.7	86.8	108	0	0	113.2
450	H	42.2	Very low	45.4	Very low	140 Å²	140	138.3 Å²	138.3	65%	0.648	69%	0.694	S	S	*	*			trans	-56.9	132.3	-179.6	-153	-122.4	0	0	0	114	A452 E455	H450-A452 PolarHBondContact O-N 3.05Å; H450-E455 IonicContact CE1-OE1 2.84Å; H450-E455 IonicContact CE1-OE2 2.68Å; H450-E455 PolarHBondContact CE1-OE2 3.09Å; H450-E455 IonicContact ND1-OE2 3.83Å; H450-E455 PolarHBondContact ND1-OE2 3.04Å
451	D	52.6	Low	46.5	Very low	107 Å²	107	132.2 Å²	132.2	57%	0.572	67%	0.669	S	S	*	*			trans	-83.9	90.9	175.7	-170.6	-6.5	0	0	0	111.5	Y453 L454	D451-Y453 PolarHBondContact O-N 2.6Å; D451-Y453 WeakPolarHBondContact OD1-CB 3.47Å; D451-Y453 PolarHBondContact OD1-N 2.83Å; D451-L454 PolarHBondContact O-N 3.3Å; D451-L454 VanDerWaalsContact O-N 3.1Å
452	A	54.8	Low	47.6	Very low	68 Å²	68	131.3 Å²	131.3	56%	0.562	66%	0.663	S	S	*	*	H	α-helix	trans	-58.4	-11.2	-177.4	0	0	0	0	0	115.1	H450 R456	H450-A452 PolarHBondContact O-N 3.05Å; A452-R456 PolarHBondContact O-N 2.95Å
453	Y	50.8	Low	48.8	Very low	148 Å²	148	127.8 Å²	127.8	58%	0.58	66%	0.657	S	S	*	*	H	α-helix	trans	-69.7	-38.8	173.5	-173.1	-102.6	0	0	0	112.5	D451 E455 R456 M457	D451-Y453 PolarHBondContact O-N 2.6Å; D451-Y453 WeakPolarHBondContact OD1-CB 3.47Å; D451-Y453 PolarHBondContact OD1-N 2.83Å; Y453-E455 VanDerWaalsContact C-N 3.33Å; Y453-E455 PolarHBondContact O-N 3.32Å; Y453-R456 PolarHBondContact O-N 3.38Å; Y453-M457 HydrophobicContact CE1-CE 4.02Å; Y453-M457 HydrophobicContact CE1-CG 4.45Å; Y453-M457 HydrophobicContact CE1-SD 3.82Å; Y453-M457 PolarHBondContact O-N 2.57Å; Y453-M457 WeakPolarHBondContact OH-CE 3.29Å
454	L	56	Low	49.9	Very low	119 Å²	119	133.4 Å²	133.4	62%	0.623	66%	0.662	S	S	*	*	H	α-helix	trans	-63.1	-41.9	178	-104.7	73.9	0	0	0	111.6	D451 M457 K458	D451-L454 PolarHBondContact O-N 3.3Å; D451-L454 VanDerWaalsContact O-N 3.1Å; L454-M457 PolarHBondContact O-N 3.09Å; L454-K458 WeakPolarHBondContact O-CB 3.3Å; L454-K458 PolarHBondContact O-N 2.8Å
455	E	61.5	Low	50.8	Low	114 Å²	114	133.5 Å²	133.5	53%	0.533	66%	0.657	S	S	.	*	H	α-helix	trans	-67	-38.4	-176.5	-165.5	153.4	-129	0	0	111.8	H450 Y453 K458 A459	H450-E455 IonicContact CE1-OE1 2.84Å; H450-E455 IonicContact CE1-OE2 2.68Å; H450-E455 PolarHBondContact CE1-OE2 3.09Å; H450-E455 IonicContact ND1-OE2 3.83Å; H450-E455 PolarHBondContact ND1-OE2 3.04Å; Y453-E455 VanDerWaalsContact C-N 3.33Å; Y453-E455 PolarHBondContact O-N 3.32Å; E455-K458 PolarHBondContact O-N 2.74Å; E455-A459 PolarHBondContact O-N 3.45Å
456	R	60	Low	51.5	Low	193 Å²	193	135.2 Å²	135.2	73%	0.728	66%	0.655	S	S	*	*	H	α-helix	trans	-63.6	-45.5	173.7	-164.4	176.1	-166.4	156.7	6.1	112.4	A452 Y453 K458 A459 E460	A452-R456 PolarHBondContact O-N 2.95Å; Y453-R456 PolarHBondContact O-N 3.38Å; R456-K458 VanDerWaalsContact C-N 3.28Å; R456-K458 PolarHBondContact O-N 2.93Å; R456-A459 PolarHBondContact O-N 3.01Å; R456-E460 WeakPolarHBondContact O-CB 3.39Å; R456-E460 PolarHBondContact O-N 3.47Å
457	M	59.5	Low	52.1	Low	108 Å²	108	131.5 Å²	131.5	53%	0.532	65%	0.651	S	S	.	*	H	α-helix	trans	-61.9	-35.9	173.8	-86.3	-170.3	156.4	0	0	112.4	Y453 L454 G461	Y453-M457 HydrophobicContact CE1-CE 4.02Å; Y453-M457 HydrophobicContact CE1-CG 4.45Å; Y453-M457 HydrophobicContact CE1-SD 3.82Å; Y453-M457 PolarHBondContact O-N 2.57Å; Y453-M457 WeakPolarHBondContact OH-CE 3.29Å; L454-M457 PolarHBondContact O-N 3.09Å; M457-G461 PolarHBondContact O-N 3.18Å
458	K	65.8	Low	52.6	Low	171 Å²	171	129.1 Å²	129.1	74%	0.743	64%	0.644	S	S	*	*	H	α-helix	trans	-70.3	-38.1	179.3	-150.8	173.7	-173.2	-177.8	0	112.1	L454 E455 R456 K462	L454-K458 WeakPolarHBondContact O-CB 3.3Å; L454-K458 PolarHBondContact O-N 2.8Å; E455-K458 PolarHBondContact O-N 2.74Å; R456-K458 VanDerWaalsContact C-N 3.28Å; R456-K458 PolarHBondContact O-N 2.93Å; K458-K462 WeakPolarHBondContact O-CB 3.5Å; K458-K462 PolarHBondContact O-N 3.44Å; K458-K462 VanDerWaalsContact O-N 3.13Å
459	A	59.4	Low	52	Low	52 Å²	52	129.1 Å²	129.1	43%	0.43	64%	0.644	S	S	.	*	H	α-helix	trans	-67.7	-45	173	0	0	0	0	0	112.3	E455 R456 G461 K462 I463	E455-A459 PolarHBondContact O-N 3.45Å; R456-A459 PolarHBondContact O-N 3.01Å; A459-G461 VanDerWaalsContact C-N 3.32Å; A459-G461 PolarHBondContact O-N 3.13Å; A459-K462 PolarHBondContact O-N 2.98Å; A459-I463 WeakPolarHBondContact O-CG1 3.35Å; A459-I463 PolarHBondContact O-N 3.17Å; A459-I463 VanDerWaalsContact O-N 3.09Å
460	E	58.7	Low	51.7	Low	140 Å²	140	125.7 Å²	125.7	65%	0.654	64%	0.641	S	S	*	*	H	α-helix	trans	-65.6	-33.4	179.1	-170.6	169	-150.8	0	0	112.5	R456	R456-E460 WeakPolarHBondContact O-CB 3.39Å; R456-E460 PolarHBondContact O-N 3.47Å
461	G	55.2	Low	51.2	Low	36 Å²	36	126.7 Å²	126.7	37%	0.371	65%	0.651	S	S	.	*	H	α-helix	trans	-65.7	-45.8	168.8	0	0	0	0	0	113	M457 A459 I463 R464 E465	M457-G461 PolarHBondContact O-N 3.18Å; A459-G461 VanDerWaalsContact C-N 3.32Å; A459-G461 PolarHBondContact O-N 3.13Å; G461-I463 PolarHBondContact O-N 2.6Å; G461-R464 WeakPolarHBondContact O-CA 3.35Å; G461-R464 WeakPolarHBondContact O-CB 3.5Å; G461-R464 PolarHBondContact O-N 2.91Å; G461-E465 PolarHBondContact O-N 2.93Å
462	K	56.6	Low	50.2	Low	116 Å²	116	128 Å²	128	50%	0.504	66%	0.658	S	S	.	*	H	α-helix	trans	-64.2	-40.7	-176.4	-164.8	166.8	-174.9	-75.2	0	112.9	K458 A459 R464 E465 E466	K458-K462 WeakPolarHBondContact O-CB 3.5Å; K458-K462 PolarHBondContact O-N 3.44Å; K458-K462 VanDerWaalsContact O-N 3.13Å; A459-K462 PolarHBondContact O-N 2.98Å; K462-R464 PolarHBondContact O-N 3.01Å; K462-R464 VanDerWaalsContact O-N 3.13Å; K462-E465 PolarHBondContact O-N 3.08Å; K462-E465 VanDerWaalsContact O-N 3.12Å; K462-E466 HydrophobicContact CG-CG 4.37Å; K462-E466 IonicContact NZ-OE1 2.8Å; K462-E466 PolarHBondContact NZ-OE1 2.82Å; K462-E466 IonicContact NZ-OE2 3.17Å; K462-E466 WeakPolarHBondContact O-CG 3.37Å; K462-E466 PolarHBondContact O-N 3.26Å
463	I	53.2	Low	49.1	Very low	127 Å²	127	129.6 Å²	129.6	65%	0.651	67%	0.666	S	S	*	*	H	α-helix	trans	-59	-24.6	173.6	-66.9	163.8	0	0	0	112.1	A459 G461	A459-I463 WeakPolarHBondContact O-CG1 3.35Å; A459-I463 PolarHBondContact O-N 3.17Å; A459-I463 VanDerWaalsContact O-N 3.09Å; G461-I463 PolarHBondContact O-N 2.6Å
464	R	53.9	Low	48.1	Very low	221 Å²	221	130.4 Å²	130.4	83%	0.834	68%	0.68	S	S	*	*	H	α-helix	trans	-88.6	-20.7	-180	-164	172.4	-175.9	158.1	3.2	113.9	G461 K462	G461-R464 WeakPolarHBondContact O-CA 3.35Å; G461-R464 WeakPolarHBondContact O-CB 3.5Å; G461-R464 PolarHBondContact O-N 2.91Å; K462-R464 PolarHBondContact O-N 3.01Å; K462-R464 VanDerWaalsContact O-N 3.13Å
465	E	49.1	Very low	46.8	Very low	167 Å²	167	128 Å²	128	78%	0.78	68%	0.684	S	S	*	*	H	α-helix	trans	-91	-30.1	172.7	-67.7	-177.4	153.6	0	0	111.6	G461 K462 G467	G461-E465 PolarHBondContact O-N 2.93Å; K462-E465 PolarHBondContact O-N 3.08Å; K462-E465 VanDerWaalsContact O-N 3.12Å; E465-G467 PolarHBondContact O-N 2.92Å
466	E	44.3	Very low	45.3	Very low	132 Å²	132	128.6 Å²	128.6	62%	0.617	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	2.5	176.4	-69.1	178.9	152.8	0	0	114.5	K462	K462-E466 HydrophobicContact CG-CG 4.37Å; K462-E466 IonicContact NZ-OE1 2.8Å; K462-E466 PolarHBondContact NZ-OE1 2.82Å; K462-E466 IonicContact NZ-OE2 3.17Å; K462-E466 WeakPolarHBondContact O-CG 3.37Å; K462-E466 PolarHBondContact O-N 3.26Å
467	G	43.5	Very low	43.8	Very low	67 Å²	67	123.4 Å²	123.4	69%	0.691	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-1.6	-179	0	0	0	0	0	115.8	E465	E465-G467 PolarHBondContact O-N 2.92Å
468	N	45.4	Very low	42.3	Very low	131 Å²	131	123.5 Å²	123.5	70%	0.701	72%	0.719	S	S	*	*	S	Bend	trans	-155.1	82.6	-172.6	-172.4	105.7	0	0	0	112.1
469	D	31.8	Very low	40.5	Very low	159 Å²	159	122 Å²	122	85%	0.85	72%	0.719	S	S	*	*			trans	-178.4	102.9	149	-94	-15.9	0	0	0	111.8
470	S	32.2	Very low	39.2	Very low	123 Å²	123	127.2 Å²	127.2	86%	0.86	73%	0.734	S	S	*	*			trans	172.7	136.7	158.7	60.7	0	0	0	0	110
471	D	31.3	Very low	38	Very low	161 Å²	161	125.6 Å²	125.6	86%	0.861	74%	0.738	S	S	*	*			cis	-156.6	-176.4	-16.7	-159	1.4	0	0	0	108.9
472	D	30.4	Very low	36.7	Very low	135 Å²	135	133.7 Å²	133.7	72%	0.722	76%	0.764	S	S	*	*			trans	-61.3	157.3	-160.2	-136.8	-47.8	0	0	0	120.7
473	S	31.6	Very low	35.8	Very low	102 Å²	102	133.3 Å²	133.3	71%	0.713	77%	0.767	S	S	*	*			trans	53.4	118.5	151.2	-73	0	0	0	0	123.1
474	D	30.6	Very low	35.1	Very low	165 Å²	165	132.9 Å²	132.9	88%	0.882	77%	0.773	S	S	*	*				-175.1	-166.3	94.7	79.2	2.3	0	0	0	113.3
475	G	29.4	Very low	33.9	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	75%	0.752	S	S	*	*			trans	95.1	111.3	148.8	0	0	0	0	0	119.3
476	S	30.3	Very low	33.2	Very low	127 Å²	127	123.7 Å²	123.7	89%	0.888	75%	0.75	S	S	*	*			trans	-92.3	137.9	167.7	59.8	0	0	0	0	112.6
477	G	27.8	Very low	32.5	Very low	84 Å²	84	124.7 Å²	124.7	87%	0.866	76%	0.755	S	S	*	*			trans	-165	137.3	169.5	0	0	0	0	0	114
478	S	27.9	Very low	31.9	Very low	110 Å²	110	128 Å²	128	77%	0.769	76%	0.756	S	S	*	*			trans	-95.2	150.8	167.4	51.2	0	0	0	0	110.1
479	D	27.8	Very low	31.3	Very low	140 Å²	140	129.2 Å²	129.2	75%	0.749	76%	0.758	S	S	*	*				168.9	166.2	87.4	-143.8	-7.9	0	0	0	114.1
480	E	31.8	Very low	31.3	Very low	160 Å²	160	128.2 Å²	128.2	75%	0.748	75%	0.748	S	S	*	*			trans	21.3	117.4	158.8	-83.2	-179.9	178.6	0	0	124.1
481	S	33.2	Very low	31.3	Very low	107 Å²	107	129.2 Å²	129.2	75%	0.748	74%	0.742	S	S	*	*				79.2	125.4	125.1	79.8	0	0	0	0	122.1
482	F	28.8	Very low	31.3	Very low	205 Å²	205	124.8 Å²	124.8	90%	0.899	73%	0.728	S	S	*	*				-161.8	139.2	106.4	-156.7	-108.1	0	0	0	110.8
483	N	37.7	Very low	31.4	Very low	108 Å²	108	126.6 Å²	126.6	58%	0.578	73%	0.732	S	S	*	*			trans	-95.6	149.8	176.4	-151.6	24.2	0	0	0	110	G485	N483-G485 PolarHBondContact OD1-N 2.78Å
484	P	39.3	Very low	31.5	Very low	119 Å²	119	128.6 Å²	128.6	77%	0.773	73%	0.73	S	S	*	*				-133.8	153.1	80.4	39	-26.9	0	0	0	112.5
485	G	28.1	Very low	31.4	Very low	39 Å²	39	130.6 Å²	130.6	40%	0.402	73%	0.727	S	S	.	*			cis	90.3	111.8	33.8	0	0	0	0	0	108.1	N483	N483-G485 PolarHBondContact OD1-N 2.78Å
486	E	34.5	Very low	31.4	Very low	155 Å²	155	133.3 Å²	133.3	72%	0.724	73%	0.725	S	S	*	*				61.1	132.8	64	-58.7	164	144.7	0	0	110.4
487	E	30.2	Very low	31.3	Very low	154 Å²	154	131.3 Å²	131.3	72%	0.72	71%	0.711	S	S	*	*			cis	-118.4	160.5	2.8	-89.1	104.8	-148.6	0	0	110
488	D	30.2	Very low	31.4	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	71%	0.707	S	S	*	*				64.9	161.9	54.4	-71.6	-64.7	0	0	0	111.9
489	E	33.2	Very low	31.5	Very low	155 Å²	155	133 Å²	133	72%	0.724	70%	0.704	S	S	*	*			cis	-155.6	-158.6	15.6	-137.9	161.4	-170.1	0	0	107.1
490	E	31.2	Very low	31.4	Very low	139 Å²	139	131.7 Å²	131.7	65%	0.65	71%	0.706	S	S	*	*			cis	-164.2	163.7	12.9	-142.2	-172.2	163.6	0	0	111.2
491	I	31.5	Very low	31.3	Very low	143 Å²	143	129.1 Å²	129.1	73%	0.733	71%	0.711	S	S	*	*			trans	62.8	137.8	144.8	-87.8	168.5	0	0	0	120.5
492	A	32.3	Very low	31	Very low	69 Å²	69	128.8 Å²	128.8	57%	0.57	71%	0.709	S	S	*	*			cis	-159.3	155.1	-19.4	0	0	0	0	0	108.3
493	E	32.3	Very low	30.7	Very low	172 Å²	172	126 Å²	126	80%	0.804	70%	0.704	S	S	*	*				59.7	142.3	81.7	-51.4	-170.2	166.4	0	0	115.1
494	E	34.1	Very low	30.1	Very low	145 Å²	145	125.3 Å²	125.3	68%	0.678	71%	0.707	S	S	*	*			cis	-163.4	-176.6	-8.7	-123.3	-162.5	166	0	0	111.6
495	Y	28.8	Very low	29.5	Very low	207 Å²	207	124.7 Å²	124.7	81%	0.812	71%	0.706	S	S	*	*			trans	68.5	170.4	154.5	-104.3	-101.2	0	0	0	120.1
496	D	28.2	Very low	29.4	Very low	124 Å²	124	129.8 Å²	129.8	66%	0.663	72%	0.724	S	S	*	*				-150	-178.7	-80.4	-175.7	38	0	0	0	109.4
497	S	29.4	Very low	29.1	Very low	85 Å²	85	131 Å²	131	59%	0.594	73%	0.73	S	S	*	*			trans	-13	152.4	164.2	68.7	0	0	0	0	119.1
498	N	29.7	Very low	28.8	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	73%	0.733	S	S	*	*			cis	-177.2	176.1	48.8	-158.2	-9.3	0	0	0	113.1
499	A	29.3	Very low	28.6	Very low	85 Å²	85	128.3 Å²	128.3	70%	0.702	74%	0.738	S	S	*	*			trans	71.8	161.9	153.2	0	0	0	0	0	121.8
500	S	26.3	Very low	28.3	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	74%	0.738	S	S	*	*				-179	144.7	-51	-98.9	0	0	0	0	112.7
501	A	28.5	Very low	28.1	Very low	105 Å²	105	124.8 Å²	124.8	87%	0.868	74%	0.736	S	S	*	*			trans	59.3	166.7	162.6	0	0	0	0	0	118.4
502	S	26.5	Very low	27.9	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	74%	0.744	S	S	*	*			cis	-126.4	-178.4	-14.7	64.9	0	0	0	0	108.6
503	D	23.7	Very low	27.6	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	76%	0.758	S	S	*	*			cis	-173.9	151.7	39.1	-138.4	70.9	0	0	0	106.3
504	S	24.2	Very low	27.2	Very low	94 Å²	94	130.6 Å²	130.6	66%	0.657	75%	0.753	S	S	*	*			cis	-145.9	-139.3	-19.7	-164.8	0	0	0	0	105
505	S	27.4	Very low	26.8	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	75%	0.752	S	S	*	*			cis	-173.4	156.1	-9	27.5	0	0	0	0	105.2
506	D	25.9	Very low	26.7	Very low	147 Å²	147	122.4 Å²	122.4	79%	0.786	75%	0.748	S	S	*	*			cis	-156.8	-164.2	-20.5	-143.9	-15.8	0	0	0	105
507	E	27.8	Very low	26.6	Very low	181 Å²	181	125.5 Å²	125.5	85%	0.846	76%	0.755	S	S	*	*			cis	-144.8	130.6	9.5	-57.2	167.9	67.5	0	0	109.8
508	G	25.5	Very low	26.5	Very low	77 Å²	77	130.7 Å²	130.7	79%	0.794	77%	0.767	S	S	*	*			trans	66.3	159.8	161.6	0	0	0	0	0	121
509	D	25.1	Very low	26.3	Very low	156 Å²	156	133.1 Å²	133.1	83%	0.834	77%	0.771	S	S	*	*			cis	-175.1	155.4	-22.4	-172.3	21.4	0	0	0	109.2
510	D	26.8	Very low	26.1	Very low	135 Å²	135	138.9 Å²	138.9	72%	0.722	78%	0.78	S	S	*	*			trans	95.2	133.7	153.6	-140.2	-5.4	0	0	0	123.6
511	S	27.4	Very low	26.1	Very low	86 Å²	86	138.5 Å²	138.5	60%	0.601	78%	0.783	S	S	*	*			trans	43.7	104.1	160.7	17.2	0	0	0	0	125.4
512	E	26.8	Very low	26.1	Very low	192 Å²	192	143.1 Å²	143.1	90%	0.897	78%	0.784	S	S	*	*				61	119.9	106.8	-69.3	-170.3	164.1	0	0	124.6
513	D	25.7	Very low	26.2	Very low	161 Å²	161	148.2 Å²	148.2	86%	0.861	79%	0.793	S	S	*	*				117	161.1	122.9	-147	33.3	0	0	0	122.6
514	E	25.1	Very low	26.5	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	79%	0.793	S	S	*	*			trans	-72.2	173.6	-152.6	-104.2	-80.2	174.7	0	0	120.9
515	S	24.6	Very low	26.7	Very low	93 Å²	93	152.8 Å²	152.8	65%	0.65	81%	0.806	S	S	*	*			trans	93.5	83	142	76.6	0	0	0	0	121.9
516	A	26.3	Very low	26.8	Very low	87 Å²	87	154 Å²	154	72%	0.719	81%	0.809	S	S	*	*				68.2	159.6	114.4	0	0	0	0	0	123.6
517	K	26.4	Very low	27.4	Very low	188 Å²	188	153.1 Å²	153.1	82%	0.817	81%	0.809	S	S	*	*			trans	84.5	102.4	159.5	-65.9	164.3	-174.7	159.6	0	120.9
518	K	27.1	Very low	27.5	Very low	194 Å²	194	154 Å²	154	84%	0.843	81%	0.81	S	S	*	*				67.3	105.8	125.2	-66	-178.9	178.8	178.6	0	120.7
519	K	25.4	Very low	27.8	Very low	197 Å²	197	159.2 Å²	159.2	86%	0.857	81%	0.814	S	S	*	*				34.8	117.6	122.4	-58.1	179.3	179.7	-179.4	0	118.6
520	K	24.7	Very low	28	Very low	206 Å²	206	161.6 Å²	161.6	90%	0.896	82%	0.817	S	S	*	*				178.5	171.4	103	-100.7	-178.5	-178.5	-178.8	0	114.4
521	A	27.2	Very low	28.3	Very low	104 Å²	104	164.8 Å²	164.8	86%	0.86	82%	0.824	S	S	*	*			trans	76.7	135	161.7	0	0	0	0	0	119.6
522	K	28.7	Very low	28.6	Very low	203 Å²	203	169.9 Å²	169.9	88%	0.883	84%	0.838	S	S	*	*			trans	-120.7	129.8	170.5	-66.7	176.3	178.5	175.4	0	109
523	K	28.1	Very low	29.1	Very low	207 Å²	207	172.5 Å²	172.5	90%	0.9	84%	0.84	S	S	*	*			trans	162.2	158.5	154.3	-96.2	166.3	-176.6	-176.3	0	108.7
524	P	29.8	Very low	29.8	Very low	118 Å²	118	174.4 Å²	174.4	77%	0.766	84%	0.84	S	S	*	*			cis	-113.1	154.9	-49.4	36.6	-25.4	0	0	0	110.4
525	K	28	Very low	30.2	Very low	217 Å²	217	172.9 Å²	172.9	94%	0.943	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-88.4	117.7	174.8	-88.4	-170.2	174.2	179.7	0	111.9
526	V	30.7	Very low	30.8	Very low	131 Å²	131	180.2 Å²	180.2	79%	0.794	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-64.4	155.7	167.6	176	0	0	0	0	110.5
527	V	37.3	Very low	31.3	Very low	130 Å²	130	185.8 Å²	185.8	79%	0.788	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-54.5	138.1	-179.2	-178.4	0	0	0	0	112
528	K	30.6	Very low	31.9	Very low	200 Å²	200	185.8 Å²	185.8	87%	0.87	87%	0.868	S	S	*	*			trans	-126.5	145.2	156.4	-94.2	-168.6	172.4	-175.5	0	109.9
529	E	31.3	Very low	32.5	Very low	186 Å²	186	186.4 Å²	186.4	87%	0.869	87%	0.871	S	S	*	*			trans	-68.2	147.9	-169.6	-59.5	158.1	113.8	0	0	112.8	K531	E529-K531 PolarHBondContact O-N 3.13Å
530	K	30.2	Very low	33	Very low	206 Å²	206	186.5 Å²	186.5	90%	0.896	87%	0.871	S	S	*	*			trans	-84.7	104.3	171.1	-76	178.9	178.4	169.9	0	109.7
531	K	32.6	Very low	33.6	Very low	202 Å²	202	185.8 Å²	185.8	88%	0.878	87%	0.871	S	S	*	*			trans	-53.3	140.4	164.6	-80.1	-173.1	173	-178.9	0	110.7	E529	E529-K531 PolarHBondContact O-N 3.13Å
532	E	34.6	Very low	34.3	Very low	192 Å²	192	187.5 Å²	187.5	90%	0.897	86%	0.859	S	S	*	*			trans	-63.8	150.3	-174.7	-58.5	-176.4	115.8	0	0	113.4
533	R	35.8	Very low	34.8	Very low	247 Å²	247	183.9 Å²	183.9	93%	0.932	85%	0.849	S	S	*	*			trans	-87.2	114.2	171.9	-79.1	-179.2	160.3	-176.7	-6.3	109.9
534	K	40.9	Very low	36.2	Very low	201 Å²	201	184.4 Å²	184.4	87%	0.874	85%	0.852	S	S	*	*			trans	-49.3	137.8	175.9	-67.9	-175.7	177	-178.4	0	111.6
535	P	35	Very low	37.6	Very low	122 Å²	122	182.6 Å²	182.6	79%	0.792	85%	0.847	S	S	*	*			trans	-65.1	143.2	-176.4	25.6	-34.3	0	0	0	112.4	K537	P535-K537 PolarHBondContact O-N 3.01Å
536	R	36.7	Very low	39.3	Very low	246 Å²	246	173.3 Å²	173.3	93%	0.928	81%	0.813	S	S	*	*			trans	-77.2	103.1	-178.6	-169.3	-177.9	-161.9	174	6.8	109.5	E538	R536-E538 PolarHBondContact O-N 3.46Å
537	K	36.9	Very low	40.8	Very low	205 Å²	205	168.6 Å²	168.6	89%	0.891	79%	0.785	S	S	*	*			trans	-45.7	130.4	178.8	-78.4	-171.2	176.9	-177.9	0	111.7	P535	P535-K537 PolarHBondContact O-N 3.01Å
538	E	38.6	Very low	42.6	Very low	187 Å²	187	171.6 Å²	171.6	87%	0.874	79%	0.787	S	S	*	*			trans	-63.6	145.5	179.6	-59.2	-176.2	128.4	0	0	111.5	R536 K540	R536-E538 PolarHBondContact O-N 3.46Å; E538-K540 PolarHBondContact O-N 2.97Å
539	K	39.4	Very low	44.9	Very low	208 Å²	208	171.5 Å²	171.5	90%	0.904	78%	0.781	S	S	*	*			trans	-75.6	105.1	168.1	-73.5	-179.7	178	175.8	0	108	Q541	K539-Q541 PolarHBondContact O-N 3.3Å
540	K	35.2	Very low	47.3	Very low	199 Å²	199	164.9 Å²	164.9	87%	0.865	76%	0.755	S	S	*	*			trans	-45.8	131.6	163.4	-76.3	-166.1	173	-168.3	0	108.9	E538 K542	E538-K540 PolarHBondContact O-N 2.97Å; K540-K542 PolarHBondContact O-N 3.12Å
541	Q	38.9	Very low	49.9	Very low	191 Å²	191	159.5 Å²	159.5	89%	0.893	73%	0.734	S	S	*	*			trans	-57.2	140.7	170.5	-63.3	-169.6	13.8	0	0	108.5	K539	K539-Q541 PolarHBondContact O-N 3.3Å
542	K	40.5	Very low	52.4	Low	139 Å²	139	153.3 Å²	153.3	60%	0.604	72%	0.716	S	S	*	*			trans	-107	129.2	-176.6	-165.8	-167.1	178.8	-145.1	0	109.3	K540 K544	K540-K542 PolarHBondContact O-N 3.12Å; K542-K544 PolarHBondContact O-N 3.1Å
543	D	39.9	Very low	54.6	Low	127 Å²	127	144.5 Å²	144.5	68%	0.679	68%	0.676	S	S	*	*			trans	-56.1	127	-170.9	-50	-75.6	0	0	0	112.5	A545 G546	D543-A545 PolarHBondContact O-N 3.4Å; D543-A545 VanDerWaalsContact O-N 3.15Å; D543-G546 PolarHBondContact O-N 2.9Å
544	K	57.3	Low	56.8	Low	219 Å²	219	135.8 Å²	135.8	95%	0.952	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-6.1	-172.7	-151.7	170.7	-174.9	173.2	0	113.4	K542	K542-K544 PolarHBondContact O-N 3.1Å
545	A	58.8	Low	58.8	Low	79 Å²	79	131 Å²	131	65%	0.653	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-19.5	-179.7	0	0	0	0	0	114.2	D543 Y614	D543-A545 PolarHBondContact O-N 3.4Å; D543-A545 VanDerWaalsContact O-N 3.15Å; A545-Y614 WeakPolarHBondContact O-CE2 3.41Å
546	G	63.6	Low	61	Low	23 Å²	23	127 Å²	127	24%	0.237	60%	0.597	C	S	.	*	S	Bend	trans	-73.9	150.3	-179.8	0	0	0	0	0	112.9	D543 K548	D543-G546 PolarHBondContact O-N 2.9Å; G546-K548 PolarHBondContact O-N 3.19Å
547	P	63.7	Low	63.3	Low	32 Å²	32	115.7 Å²	115.7	21%	0.208	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-58.5	140.4	-177.5	22.5	-32.8	0	0	0	112.3	Y607 K611	P547-Y607 HydrophobicContact CB-CD2 4.23Å; P547-Y607 HydrophobicContact CB-CE2 3.8Å; P547-Y607 HydrophobicContact CG-CE2 4.06Å; P547-Y607 WeakPolarHBondContact O-CE2 3.21Å; P547-Y607 PolarHBondContact O-OH 2.93Å; P547-K611 HydrophobicContact CG-CB 4.23Å
548	K	74.1	Confident	65.6	Low	192 Å²	192	107.1 Å²	107.1	84%	0.835	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-71.4	139.6	178.4	-67.7	179.5	-179.1	175	0	110.3	G546 Y607	G546-K548 PolarHBondContact O-N 3.19Å; K548-Y607 VanDerWaalsContact C-CE2 3.48Å; K548-Y607 WeakPolarHBondContact O-CD2 3.32Å; K548-Y607 WeakPolarHBondContact O-CE2 3.06Å
549	R	78.7	Confident	67.7	Low	198 Å²	198	102.3 Å²	102.3	75%	0.747	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-58.5	145.6	177.1	-74.7	-179.4	174	171.2	-3.7	110.6
550	P	82.1	Confident	69.7	Low	48 Å²	48	95.4 Å²	95.4	31%	0.312	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-66.6	154.7	176	31.9	-36.5	0	0	0	110.1	A603 K604 Y607	P550-A603 HydrophobicContact CB-CB 4.19Å; P550-K604 HydrophobicContact CG-CB 4.29Å; P550-Y607 HydrophobicContact CG-CD1 4.34Å; P550-Y607 HydrophobicContact CG-CG 4.29Å
551	M	84.8	Confident	71.8	Confident	93 Å²	93	86.5 Å²	86.5	46%	0.458	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-83.2	147.5	174.2	-73.8	-178.6	-77.2	0	0	110.4	M555 L556 N559	M551-M555 HydrophobicContact CB-CB 3.98Å; M551-M555 HydrophobicContact CG-CB 4.43Å; M551-L556 HydrophobicContact CB-CD2 3.87Å; M551-L556 HydrophobicContact CB-CG 4.11Å; M551-L556 HydrophobicContact CE-CD2 4.12Å; M551-N559 PolarHBondContact SD-ND2 3.39Å; M551-N559 VanDerWaalsContact SD-ND2 3.43Å
552	S	84.8	Confident	73.7	Confident	72 Å²	72	81.3 Å²	81.3	50%	0.503	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-70.8	159.9	174.2	-174.7	0	0	0	0	111.2	Y554 M555 L556	S552-Y554 VanDerWaalsContact C-N 3.33Å; S552-Y554 PolarHBondContact O-N 2.9Å; S552-M555 WeakPolarHBondContact O-CA 3.36Å; S552-M555 WeakPolarHBondContact O-CB 3.01Å; S552-M555 PolarHBondContact O-N 2.82Å; S552-L556 PolarHBondContact O-N 3.29Å
553	A	81.8	Confident	75.5	Confident	6 Å²	6	82.2 Å²	82.2	5%	0.05	42%	0.418	C	S	.	.	H	α-helix	trans	-48.9	-51.8	177.1	0	0	0	0	0	112.2	M555 L556 W557 W585 W596 E597 A600	A553-M555 VanDerWaalsContact C-N 3.27Å; A553-M555 PolarHBondContact O-N 2.92Å; A553-L556 PolarHBondContact O-N 2.89Å; A553-L556 VanDerWaalsContact O-N 3.13Å; A553-W557 PolarHBondContact O-N 3.28Å; A553-W585 HydrophobicContact CB-CH2 4.09Å; A553-W585 HydrophobicContact CB-CZ2 4.33Å; A553-W596 HydrophobicContact CB-CB 4.13Å; A553-W596 WeakPolarHBondContact CB-O 3.11Å; A553-E597 HydrophobicContact CB-CB 4.44Å; A553-E597 HydrophobicContact CB-CG 3.71Å; A553-A600 HydrophobicContact CB-CB 4.01Å
554	Y	81.5	Confident	77.5	Confident	65 Å²	65	81.8 Å²	81.8	26%	0.255	41%	0.407	S	S	.	.	H	α-helix	trans	-56.1	-36.6	174.2	175	-119.1	0	0	0	113.4	S552 W557 L558 G582 W585	S552-Y554 VanDerWaalsContact C-N 3.33Å; S552-Y554 PolarHBondContact O-N 2.9Å; Y554-W557 AromaticContact CD2-CE3 3.98Å; Y554-W557 HydrophobicContact CD2-CE3 3.98Å; Y554-W557 HydrophobicContact CD2-CZ3 4.25Å; Y554-W557 HydrophobicContact CE2-CE3 4.02Å; Y554-W557 AromaticContact CE2-CZ3 3.83Å; Y554-W557 HydrophobicContact CE2-CZ3 3.83Å; Y554-L558 HydrophobicContact CE1-CD2 4.43Å; Y554-L558 WeakPolarHBondContact O-CB 3.08Å; Y554-L558 PolarHBondContact O-N 3.26Å; Y554-G582 PolarHBondContact OH-N 2.99Å; Y554-W585 HydrophobicContact CD2-CB 3.71Å; Y554-W585 AromaticContact CD2-CD1 3.73Å; Y554-W585 AromaticContact CD2-CD2 3.62Å; Y554-W585 HydrophobicContact CD2-CD2 3.62Å; Y554-W585 HydrophobicContact CD2-CE3 4.15Å; Y554-W585 AromaticContact CD2-CG 3.38Å; Y554-W585 HydrophobicContact CD2-CG 3.38Å; Y554-W585 HydrophobicContact CE2-CB 3.65Å; Y554-W585 HydrophobicContact CE2-CD2 4.47Å; Y554-W585 AromaticContact CE2-CG 3.86Å; Y554-W585 HydrophobicContact CE2-CG 3.86Å; Y554-W585 HydrophobicContact CG-CD2 4.42Å; Y554-W585 HydrophobicContact CG-CG 4.37Å
555	M	82.7	Confident	78.4	Confident	99 Å²	99	71.4 Å²	71.4	49%	0.488	36%	0.362	S	S	.	.	H	α-helix	trans	-76.1	-31.7	179.4	-66.8	175.5	177.9	0	0	112.6	M551 S552 A553 N559	M551-M555 HydrophobicContact CB-CB 3.98Å; M551-M555 HydrophobicContact CG-CB 4.43Å; S552-M555 WeakPolarHBondContact O-CA 3.36Å; S552-M555 WeakPolarHBondContact O-CB 3.01Å; S552-M555 PolarHBondContact O-N 2.82Å; A553-M555 VanDerWaalsContact C-N 3.27Å; A553-M555 PolarHBondContact O-N 2.92Å; M555-N559 PolarHBondContact O-N 3.09Å; M555-N559 PolarHBondContact O-ND2 3.28Å; M555-N559 VanDerWaalsContact O-ND2 3.1Å
556	L	82.1	Confident	79.5	Confident	38 Å²	38	74 Å²	74	20%	0.199	36%	0.358	C	S	.	.	H	α-helix	trans	-67.9	-49.7	172.8	-66	174.2	0	0	0	110.3	M551 S552 A553 L558 N559 S560 W596 K599 A600	M551-L556 HydrophobicContact CB-CD2 3.87Å; M551-L556 HydrophobicContact CB-CG 4.11Å; M551-L556 HydrophobicContact CE-CD2 4.12Å; S552-L556 PolarHBondContact O-N 3.29Å; A553-L556 PolarHBondContact O-N 2.89Å; A553-L556 VanDerWaalsContact O-N 3.13Å; L556-L558 PolarHBondContact O-N 3.46Å; L556-N559 PolarHBondContact O-N 2.81Å; L556-S560 PolarHBondContact O-N 3.05Å; L556-S560 PolarHBondContact O-OG 2.81Å; L556-W596 HydrophobicContact CB-CE3 4.04Å; L556-W596 HydrophobicContact CB-CZ3 4.38Å; L556-K599 HydrophobicContact CD1-CB 4.35Å; L556-A600 HydrophobicContact CD1-CB 4.06Å
557	W	85.1	Confident	80.2	Confident	9 Å²	9	77.2 Å²	77.2	3%	0.034	38%	0.377	C	S	.	.	H	α-helix	trans	-63.4	-38	175.5	172.4	89.3	0	0	0	113.1	A553 Y554 N559 S560 S561 I565 A581 M584 W585 L588 W596	A553-W557 PolarHBondContact O-N 3.28Å; Y554-W557 AromaticContact CD2-CE3 3.98Å; Y554-W557 HydrophobicContact CD2-CE3 3.98Å; Y554-W557 HydrophobicContact CD2-CZ3 4.25Å; Y554-W557 HydrophobicContact CE2-CE3 4.02Å; Y554-W557 AromaticContact CE2-CZ3 3.83Å; Y554-W557 HydrophobicContact CE2-CZ3 3.83Å; W557-N559 VanDerWaalsContact C-N 3.3Å; W557-N559 PolarHBondContact O-N 2.96Å; W557-S560 PolarHBondContact O-N 2.9Å; W557-S560 PolarHBondContact O-OG 2.97Å; W557-S561 PolarHBondContact NE1-OG 3.23Å; W557-S561 VanDerWaalsContact NE1-OG 3.1Å; W557-S561 VanDerWaalsContact O-CB 3.24Å; W557-S561 WeakPolarHBondContact O-CB 3.21Å; W557-S561 PolarHBondContact O-N 3.28Å; W557-S561 PolarHBondContact O-OG 3.38Å; W557-I565 HydrophobicContact CH2-CD1 4.47Å; W557-A581 HydrophobicContact CH2-CB 4.21Å; W557-A581 VanDerWaalsContact CH2-O 3.23Å; W557-A581 WeakPolarHBondContact CH2-O 3.4Å; W557-A581 HydrophobicContact CZ3-CB 3.97Å; W557-A581 WeakPolarHBondContact CZ3-O 3.32Å; W557-M584 HydrophobicContact CH2-CB 3.83Å; W557-M584 HydrophobicContact CZ2-CB 4.13Å; W557-W585 HydrophobicContact CB-CE3 3.88Å; W557-W585 HydrophobicContact CB-CZ3 3.5Å; W557-W585 AromaticContact CD2-CE3 3.5Å; W557-W585 HydrophobicContact CD2-CE3 3.5Å; W557-W585 VanDerWaalsContact CD2-CE3 3.5Å; W557-W585 HydrophobicContact CD2-CZ3 4.03Å; W557-W585 HydrophobicContact CE3-CB 4.17Å; W557-W585 HydrophobicContact CE3-CD2 4.35Å; W557-W585 AromaticContact CE3-CE3 3.66Å; W557-W585 HydrophobicContact CE3-CE3 3.66Å; W557-W585 HydrophobicContact CE3-CZ3 4.48Å; W557-W585 AromaticContact CG-CE3 3.58Å; W557-W585 HydrophobicContact CG-CE3 3.58Å; W557-W585 AromaticContact CG-CZ3 3.57Å; W557-W585 HydrophobicContact CG-CZ3 3.57Å; W557-W585 HydrophobicContact CH2-CB 4.14Å; W557-W585 HydrophobicContact CZ3-CB 3.82Å; W557-W585 HydrophobicContact CZ3-CE3 4.44Å; W557-L588 HydrophobicContact CD2-CD1 4.27Å; W557-L588 HydrophobicContact CG-CD1 4.39Å; W557-L588 HydrophobicContact CZ2-CD1 4.18Å; W557-W596 HydrophobicContact CB-CD2 3.89Å; W557-W596 HydrophobicContact CB-CE3 4.28Å; W557-W596 HydrophobicContact CB-CG 3.97Å; W557-W596 AromaticContact CD1-CD1 3.89Å; W557-W596 AromaticContact CD1-CE2 3.86Å; W557-W596 AromaticContact CD1-NE1 3.55Å
558	L	83.7	Confident	80.8	Confident	25 Å²	25	80.3 Å²	80.3	13%	0.131	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-40.2	176.1	175.5	64.6	0	0	0	110.5	Y554 L556 R562 A581	Y554-L558 HydrophobicContact CE1-CD2 4.43Å; Y554-L558 WeakPolarHBondContact O-CB 3.08Å; Y554-L558 PolarHBondContact O-N 3.26Å; L556-L558 PolarHBondContact O-N 3.46Å; L558-R562 WeakPolarHBondContact O-CB 3.36Å; L558-R562 PolarHBondContact O-N 3.28Å; L558-A581 HydrophobicContact CD1-CB 3.38Å
559	N	83.3	Confident	80.7	Confident	86 Å²	86	72.5 Å²	72.5	46%	0.46	36%	0.356	S	S	.	.	H	α-helix	trans	-67.6	-37.4	179.8	-73.9	-27.4	0	0	0	112.7	M551 M555 L556 W557	M551-N559 PolarHBondContact SD-ND2 3.39Å; M551-N559 VanDerWaalsContact SD-ND2 3.43Å; M555-N559 PolarHBondContact O-N 3.09Å; M555-N559 PolarHBondContact O-ND2 3.28Å; M555-N559 VanDerWaalsContact O-ND2 3.1Å; L556-N559 PolarHBondContact O-N 2.81Å; W557-N559 VanDerWaalsContact C-N 3.3Å; W557-N559 PolarHBondContact O-N 2.96Å
560	S	81.3	Confident	80.4	Confident	63 Å²	63	68.4 Å²	68.4	44%	0.441	36%	0.355	S	S	.	.	H	α-helix	trans	-74.5	-42.1	174.5	51.8	0	0	0	0	112.5	L556 W557	L556-S560 PolarHBondContact O-N 3.05Å; L556-S560 PolarHBondContact O-OG 2.81Å; W557-S560 PolarHBondContact O-N 2.9Å; W557-S560 PolarHBondContact O-OG 2.97Å
561	S	78.6	Confident	80	Confident	12 Å²	12	70.1 Å²	70.1	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-78.5	-19.6	-176.2	-58.3	0	0	0	0	113.9	W557 E563 R564 I565	W557-S561 PolarHBondContact NE1-OG 3.23Å; W557-S561 VanDerWaalsContact NE1-OG 3.1Å; W557-S561 VanDerWaalsContact O-CB 3.24Å; W557-S561 WeakPolarHBondContact O-CB 3.21Å; W557-S561 PolarHBondContact O-N 3.28Å; W557-S561 PolarHBondContact O-OG 3.38Å; S561-E563 VanDerWaalsContact C-N 3.3Å; S561-E563 PolarHBondContact O-N 2.81Å; S561-R564 PolarHBondContact O-N 2.74Å; S561-I565 WeakPolarHBondContact O-CG1 3.46Å; S561-I565 PolarHBondContact O-N 2.82Å
562	R	79.9	Confident	79.7	Confident	82 Å²	82	68.4 Å²	68.4	31%	0.309	37%	0.374	S	S	.	.	H	α-helix	trans	-60.4	-34.8	-178	174.7	175.3	-170.2	135.4	2.3	113.7	L558 K566 I577	L558-R562 WeakPolarHBondContact O-CB 3.36Å; L558-R562 PolarHBondContact O-N 3.28Å; R562-K566 VanDerWaalsContact O-CB 3.25Å; R562-K566 WeakPolarHBondContact O-CB 3.38Å; R562-K566 PolarHBondContact O-N 3.37Å; R562-K566 VanDerWaalsContact O-N 3.07Å; R562-I577 HydrophobicContact CG-CG2 4.37Å
563	E	78.9	Confident	79.4	Confident	158 Å²	158	67.4 Å²	67.4	74%	0.738	37%	0.367	S	S	*	.	H	α-helix	trans	-71	-43.5	177.5	-62.6	-165.4	154.1	0	0	110.7	S561 K566 S567	S561-E563 VanDerWaalsContact C-N 3.3Å; S561-E563 PolarHBondContact O-N 2.81Å; E563-K566 PolarHBondContact O-N 3.15Å; E563-S567 PolarHBondContact O-N 3.31Å; E563-S567 PolarHBondContact O-OG 2.83Å
564	R	80	Confident	79.1	Confident	118 Å²	118	72.3 Å²	72.3	45%	0.445	39%	0.391	S	S	.	.	H	α-helix	trans	-58.9	-50.3	173.1	-178.6	171.8	74.3	82.2	-7.3	112.4	S561 K566 S567 E568	S561-R564 PolarHBondContact O-N 2.74Å; R564-K566 PolarHBondContact O-N 3.34Å; R564-S567 WeakPolarHBondContact CA-OG 3.47Å; R564-S567 PolarHBondContact O-N 3.48Å; R564-S567 VanDerWaalsContact O-N 3.16Å; R564-S567 PolarHBondContact O-OG 3.05Å; R564-E568 WeakPolarHBondContact CD-OE1 3.34Å; R564-E568 HydrophobicContact CG-CG 4.39Å; R564-E568 WeakPolarHBondContact CG-OE1 3.33Å; R564-E568 IonicContact CZ-OE1 2.57Å; R564-E568 IonicContact NE-OE1 3.28Å; R564-E568 VanDerWaalsContact NH1-CD 3.31Å; R564-E568 IonicContact NH1-OE1 3.82Å; R564-E568 PolarHBondContact NH1-OE1 3.25Å; R564-E568 IonicContact NH1-OE2 3.65Å; R564-E568 PolarHBondContact NH1-OE2 3.4Å; R564-E568 VanDerWaalsContact NH1-OE2 3.13Å; R564-E568 WeakPolarHBondContact O-CB 3.43Å; R564-E568 WeakPolarHBondContact O-CG 3.13Å; R564-E568 PolarHBondContact O-N 2.94Å
565	I	78.2	Confident	79	Confident	1 Å²	1	74 Å²	74	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-60.2	-34.9	178.4	-66.1	167.6	0	0	0	110.8	W557 S561 N569 I577 A581 M584	W557-I565 HydrophobicContact CH2-CD1 4.47Å; S561-I565 WeakPolarHBondContact O-CG1 3.46Å; S561-I565 PolarHBondContact O-N 2.82Å; I565-N569 VanDerWaalsContact O-CB 3.31Å; I565-N569 WeakPolarHBondContact O-CB 3.44Å; I565-N569 PolarHBondContact O-N 3.45Å; I565-N569 VanDerWaalsContact O-N 3.17Å; I565-N569 PolarHBondContact O-ND2 2.97Å; I565-I577 HydrophobicContact CG2-CG2 4.09Å; I565-A581 HydrophobicContact CD1-CB 3.75Å; I565-M584 HydrophobicContact CD1-SD 3.77Å; I565-M584 HydrophobicContact CG1-CE 4.39Å; I565-M584 HydrophobicContact CG1-SD 3.79Å
566	K	80.1	Confident	78.9	Confident	134 Å²	134	73.8 Å²	73.8	58%	0.583	41%	0.406	S	S	*	.	H	α-helix	trans	-75.2	-35.4	176.9	-170.9	-170.8	174.5	-161.8	0	113	R562 E563 R564 N569 I577	R562-K566 VanDerWaalsContact O-CB 3.25Å; R562-K566 WeakPolarHBondContact O-CB 3.38Å; R562-K566 PolarHBondContact O-N 3.37Å; R562-K566 VanDerWaalsContact O-N 3.07Å; E563-K566 PolarHBondContact O-N 3.15Å; R564-K566 PolarHBondContact O-N 3.34Å; K566-N569 CarbonylContact O-C 3.57Å; K566-N569 PolarHBondContact O-N 2.95Å; K566-I577 HydrophobicContact CB-CD1 4.46Å; K566-I577 HydrophobicContact CG-CD1 4.45Å
567	S	79.6	Confident	78.8	Confident	91 Å²	91	72.3 Å²	72.3	64%	0.636	40%	0.398	S	S	*	.	H	α-helix	trans	-71.8	-33.9	173.8	51.6	0	0	0	0	112.6	E563 R564 N569	E563-S567 PolarHBondContact O-N 3.31Å; E563-S567 PolarHBondContact O-OG 2.83Å; R564-S567 WeakPolarHBondContact CA-OG 3.47Å; R564-S567 PolarHBondContact O-N 3.48Å; R564-S567 VanDerWaalsContact O-N 3.16Å; R564-S567 PolarHBondContact O-OG 3.05Å; S567-N569 PolarHBondContact O-N 3.23Å
568	E	75.9	Confident	78.6	Confident	96 Å²	96	74.3 Å²	74.3	45%	0.449	41%	0.413	S	S	.	.	S	Bend	trans	-72.7	-16.2	172.6	-70.2	166.1	-175.2	0	0	112.7	R564	R564-E568 WeakPolarHBondContact CD-OE1 3.34Å; R564-E568 HydrophobicContact CG-CG 4.39Å; R564-E568 WeakPolarHBondContact CG-OE1 3.33Å; R564-E568 IonicContact CZ-OE1 2.57Å; R564-E568 IonicContact NE-OE1 3.28Å; R564-E568 VanDerWaalsContact NH1-CD 3.31Å; R564-E568 IonicContact NH1-OE1 3.82Å; R564-E568 PolarHBondContact NH1-OE1 3.25Å; R564-E568 IonicContact NH1-OE2 3.65Å; R564-E568 PolarHBondContact NH1-OE2 3.4Å; R564-E568 VanDerWaalsContact NH1-OE2 3.13Å; R564-E568 WeakPolarHBondContact O-CB 3.43Å; R564-E568 WeakPolarHBondContact O-CG 3.13Å; R564-E568 PolarHBondContact O-N 2.94Å
569	N	72.2	Confident	78.6	Confident	29 Å²	29	79.6 Å²	79.6	16%	0.155	44%	0.436	C	S	.	.	S	Bend	trans	-141.7	64.9	-175.4	-59.3	-102.8	0	0	0	111.8	I565 K566 S567 G571 I572 K580	I565-N569 VanDerWaalsContact O-CB 3.31Å; I565-N569 WeakPolarHBondContact O-CB 3.44Å; I565-N569 PolarHBondContact O-N 3.45Å; I565-N569 VanDerWaalsContact O-N 3.17Å; I565-N569 PolarHBondContact O-ND2 2.97Å; K566-N569 CarbonylContact O-C 3.57Å; K566-N569 PolarHBondContact O-N 2.95Å; S567-N569 PolarHBondContact O-N 3.23Å; N569-G571 PolarHBondContact O-N 3.27Å; N569-I572 HydrophobicContact CB-CB 4.28Å; N569-I572 HydrophobicContact CB-CD1 3.7Å; N569-I572 HydrophobicContact CB-CG1 3.92Å; N569-I572 PolarHBondContact O-N 3.03Å; N569-K580 PolarHBondContact OD1-NZ 3.36Å
570	P	72.6	Confident	78.4	Confident	111 Å²	111	79.1 Å²	79.1	72%	0.721	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	126	-179.8	26	-34	0	0	0	111.1
571	G	72.8	Confident	78.5	Confident	84 Å²	84	76.1 Å²	76.1	87%	0.866	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	-14.5	177.4	0	0	0	0	0	116.3	N569	N569-G571 PolarHBondContact O-N 3.27Å
572	I	77.9	Confident	78.7	Confident	57 Å²	57	76.7 Å²	76.7	29%	0.292	42%	0.416	S	S	.	.			trans	-66.7	144.3	-179.5	-66.8	-161.4	0	0	0	112.1	N569 E576 I577	N569-I572 HydrophobicContact CB-CB 4.28Å; N569-I572 HydrophobicContact CB-CD1 3.7Å; N569-I572 HydrophobicContact CB-CG1 3.92Å; N569-I572 PolarHBondContact O-N 3.03Å; I572-E576 HydrophobicContact CG2-CB 3.38Å; I572-E576 HydrophobicContact CG2-CG 4.42Å; I572-I577 HydrophobicContact CG2-CG1 4.08Å
573	S	78.4	Confident	78.9	Confident	51 Å²	51	78.1 Å²	78.1	36%	0.357	43%	0.426	S	S	.	.			trans	-70.8	157.1	-177.5	80.1	0	0	0	0	113.2	T575 E576 I577	S573-T575 PolarHBondContact O-N 3.45Å; S573-E576 WeakPolarHBondContact CB-OE2 3.39Å; S573-E576 PolarHBondContact N-OE2 3.3Å; S573-E576 PolarHBondContact O-N 3.06Å; S573-E576 VanDerWaalsContact O-N 3.09Å; S573-E576 VanDerWaalsContact OG-CD 3.25Å; S573-E576 WeakPolarHBondContact OG-CG 3.42Å; S573-E576 PolarHBondContact OG-N 3.41Å; S573-E576 PolarHBondContact OG-OE2 3.23Å; S573-I577 WeakPolarHBondContact O-CG1 3.14Å; S573-I577 PolarHBondContact O-N 2.92Å
574	I	75.6	Confident	79	Confident	109 Å²	109	72.9 Å²	72.9	56%	0.559	40%	0.403	S	S	*	.	H	α-helix	trans	-58.2	-32.3	178.3	-66.7	174.6	0	0	0	112.1	S578	I574-S578 WeakPolarHBondContact O-CB 3.44Å; I574-S578 PolarHBondContact O-N 2.86Å; I574-S578 VanDerWaalsContact O-N 3.13Å; I574-S578 PolarHBondContact O-OG 3.02Å
575	T	81.3	Confident	79.1	Confident	101 Å²	101	69.2 Å²	69.2	62%	0.62	39%	0.389	S	S	*	.	H	α-helix	trans	-67.8	-39.9	178.3	-49.6	0	0	0	0	111.6	S573 S578 K579	S573-T575 PolarHBondContact O-N 3.45Å; T575-S578 WeakPolarHBondContact O-CB 3.49Å; T575-S578 PolarHBondContact O-N 3.44Å; T575-K579 PolarHBondContact O-N 2.98Å
576	E	79.7	Confident	79.3	Confident	94 Å²	94	79.1 Å²	79.1	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-79.9	-37.2	-178.8	-68.2	155.2	142.6	0	0	112	I572 S573 S578 K579 K580	I572-E576 HydrophobicContact CG2-CB 3.38Å; I572-E576 HydrophobicContact CG2-CG 4.42Å; S573-E576 WeakPolarHBondContact CB-OE2 3.39Å; S573-E576 PolarHBondContact N-OE2 3.3Å; S573-E576 PolarHBondContact O-N 3.06Å; S573-E576 VanDerWaalsContact O-N 3.09Å; S573-E576 VanDerWaalsContact OG-CD 3.25Å; S573-E576 WeakPolarHBondContact OG-CG 3.42Å; S573-E576 PolarHBondContact OG-N 3.41Å; S573-E576 PolarHBondContact OG-OE2 3.23Å; E576-S578 PolarHBondContact O-N 3.23Å; E576-K579 WeakPolarHBondContact O-CB 3.32Å; E576-K579 PolarHBondContact O-N 3.07Å; E576-K580 PolarHBondContact O-N 2.84Å
577	I	79.8	Confident	79.4	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.036	43%	0.433	C	S	.	.	H	α-helix	trans	-54.3	-40.3	166.9	-68.2	169.4	0	0	0	110	R562 I565 K566 I572 S573 K579 A581	R562-I577 HydrophobicContact CG-CG2 4.37Å; I565-I577 HydrophobicContact CG2-CG2 4.09Å; K566-I577 HydrophobicContact CB-CD1 4.46Å; K566-I577 HydrophobicContact CG-CD1 4.45Å; I572-I577 HydrophobicContact CG2-CG1 4.08Å; S573-I577 WeakPolarHBondContact O-CG1 3.14Å; S573-I577 PolarHBondContact O-N 2.92Å; I577-K579 VanDerWaalsContact C-N 3.33Å; I577-K579 PolarHBondContact O-N 2.92Å; I577-A581 VanDerWaalsContact O-CB 3.23Å; I577-A581 WeakPolarHBondContact O-CB 3.32Å; I577-A581 PolarHBondContact O-N 2.89Å
578	S	80.7	Confident	79.5	Confident	51 Å²	51	77.1 Å²	77.1	36%	0.357	41%	0.409	S	S	.	.	H	α-helix	trans	-70.8	-24.2	178.4	-55.1	0	0	0	0	113.7	I574 T575 E576 G582	I574-S578 WeakPolarHBondContact O-CB 3.44Å; I574-S578 PolarHBondContact O-N 2.86Å; I574-S578 VanDerWaalsContact O-N 3.13Å; I574-S578 PolarHBondContact O-OG 3.02Å; T575-S578 WeakPolarHBondContact O-CB 3.49Å; T575-S578 PolarHBondContact O-N 3.44Å; E576-S578 PolarHBondContact O-N 3.23Å; S578-G582 PolarHBondContact O-N 3.26Å
579	K	83.4	Confident	79.9	Confident	137 Å²	137	77.7 Å²	77.7	60%	0.596	42%	0.416	S	S	*	.	H	α-helix	trans	-76.1	-55.3	171	-70.7	-178.3	176.8	-178	0	111.1	T575 E576 I577 A581 G582 E583	T575-K579 PolarHBondContact O-N 2.98Å; E576-K579 WeakPolarHBondContact O-CB 3.32Å; E576-K579 PolarHBondContact O-N 3.07Å; I577-K579 VanDerWaalsContact C-N 3.33Å; I577-K579 PolarHBondContact O-N 2.92Å; K579-A581 PolarHBondContact O-N 2.85Å; K579-G582 WeakPolarHBondContact O-CA 3.38Å; K579-G582 PolarHBondContact O-N 3.19Å; K579-E583 PolarHBondContact O-N 2.68Å
580	K	80.5	Confident	80.1	Confident	76 Å²	76	83.9 Å²	83.9	33%	0.33	44%	0.441	S	S	.	.	H	α-helix	trans	-55	-39.6	178.8	-72.1	-161.7	176	-165	0	112.1	N569 E576 E583 M584	N569-K580 PolarHBondContact OD1-NZ 3.36Å; E576-K580 PolarHBondContact O-N 2.84Å; K580-E583 PolarHBondContact O-N 2.73Å; K580-M584 WeakPolarHBondContact O-CB 3.4Å; K580-M584 WeakPolarHBondContact O-CG 3.34Å; K580-M584 PolarHBondContact O-N 3.47Å
581	A	82.7	Confident	80.2	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-66.9	-34.3	175.8	0	0	0	0	0	113.2	W557 L558 I565 I577 K579 W585	W557-A581 HydrophobicContact CH2-CB 4.21Å; W557-A581 VanDerWaalsContact CH2-O 3.23Å; W557-A581 WeakPolarHBondContact CH2-O 3.4Å; W557-A581 HydrophobicContact CZ3-CB 3.97Å; W557-A581 WeakPolarHBondContact CZ3-O 3.32Å; L558-A581 HydrophobicContact CD1-CB 3.38Å; I565-A581 HydrophobicContact CD1-CB 3.75Å; I577-A581 VanDerWaalsContact O-CB 3.23Å; I577-A581 WeakPolarHBondContact O-CB 3.32Å; I577-A581 PolarHBondContact O-N 2.89Å; K579-A581 PolarHBondContact O-N 2.85Å; A581-W585 WeakPolarHBondContact O-CB 3.41Å; A581-W585 PolarHBondContact O-N 3.41Å
582	G	82.6	Confident	80.4	Confident	24 Å²	24	84.7 Å²	84.7	25%	0.247	42%	0.417	C	S	.	.	H	α-helix	trans	-68.2	-36.7	173.9	0	0	0	0	0	112.8	Y554 S578 K579 R586	Y554-G582 PolarHBondContact OH-N 2.99Å; S578-G582 PolarHBondContact O-N 3.26Å; K579-G582 WeakPolarHBondContact O-CA 3.38Å; K579-G582 PolarHBondContact O-N 3.19Å; G582-R586 WeakPolarHBondContact O-CG 3.26Å; G582-R586 PolarHBondContact O-N 3.24Å
583	E	83.2	Confident	80.5	Confident	112 Å²	112	84.5 Å²	84.5	52%	0.523	41%	0.414	S	S	.	.	H	α-helix	trans	-67.1	-52	174.1	-71.3	150.2	-165.9	0	0	111.1	K579 K580 W585 R586 Q587	K579-E583 PolarHBondContact O-N 2.68Å; K580-E583 PolarHBondContact O-N 2.73Å; E583-W585 VanDerWaalsContact C-N 3.34Å; E583-W585 PolarHBondContact O-N 3.18Å; E583-R586 WeakPolarHBondContact O-CB 3.47Å; E583-R586 PolarHBondContact O-N 2.87Å; E583-R586 VanDerWaalsContact O-N 3.07Å; E583-Q587 PolarHBondContact O-N 3.36Å; E583-Q587 VanDerWaalsContact O-N 3.16Å
584	M	81.1	Confident	80.7	Confident	48 Å²	48	87.2 Å²	87.2	24%	0.236	42%	0.421	C	S	.	.	H	α-helix	trans	-57.3	-42.8	175.5	-74.1	179.4	178.1	0	0	112.3	W557 I565 K580 R586 Q587 L588	W557-M584 HydrophobicContact CH2-CB 3.83Å; W557-M584 HydrophobicContact CZ2-CB 4.13Å; I565-M584 HydrophobicContact CD1-SD 3.77Å; I565-M584 HydrophobicContact CG1-CE 4.39Å; I565-M584 HydrophobicContact CG1-SD 3.79Å; K580-M584 WeakPolarHBondContact O-CB 3.4Å; K580-M584 WeakPolarHBondContact O-CG 3.34Å; K580-M584 PolarHBondContact O-N 3.47Å; M584-R586 VanDerWaalsContact C-N 3.29Å; M584-R586 PolarHBondContact O-N 2.78Å; M584-Q587 PolarHBondContact O-N 3.15Å; M584-L588 PolarHBondContact O-N 2.89Å
585	W	83.6	Confident	81	Confident	40 Å²	40	86.8 Å²	86.8	15%	0.152	42%	0.416	C	S	.	.	H	α-helix	trans	-62.7	-33.2	176.6	177.3	-99.1	0	0	0	112.9	A553 Y554 W557 A581 E583 Q587 L588 K593 W596	A553-W585 HydrophobicContact CB-CH2 4.09Å; A553-W585 HydrophobicContact CB-CZ2 4.33Å; Y554-W585 HydrophobicContact CD2-CB 3.71Å; Y554-W585 AromaticContact CD2-CD1 3.73Å; Y554-W585 AromaticContact CD2-CD2 3.62Å; Y554-W585 HydrophobicContact CD2-CD2 3.62Å; Y554-W585 HydrophobicContact CD2-CE3 4.15Å; Y554-W585 AromaticContact CD2-CG 3.38Å; Y554-W585 HydrophobicContact CD2-CG 3.38Å; Y554-W585 HydrophobicContact CE2-CB 3.65Å; Y554-W585 HydrophobicContact CE2-CD2 4.47Å; Y554-W585 AromaticContact CE2-CG 3.86Å; Y554-W585 HydrophobicContact CE2-CG 3.86Å; Y554-W585 HydrophobicContact CG-CD2 4.42Å; Y554-W585 HydrophobicContact CG-CG 4.37Å; W557-W585 HydrophobicContact CB-CE3 3.88Å; W557-W585 HydrophobicContact CB-CZ3 3.5Å; W557-W585 AromaticContact CD2-CE3 3.5Å; W557-W585 HydrophobicContact CD2-CE3 3.5Å; W557-W585 VanDerWaalsContact CD2-CE3 3.5Å; W557-W585 HydrophobicContact CD2-CZ3 4.03Å; W557-W585 HydrophobicContact CE3-CB 4.17Å; W557-W585 HydrophobicContact CE3-CD2 4.35Å; W557-W585 AromaticContact CE3-CE3 3.66Å; W557-W585 HydrophobicContact CE3-CE3 3.66Å; W557-W585 HydrophobicContact CE3-CZ3 4.48Å; W557-W585 AromaticContact CG-CE3 3.58Å; W557-W585 HydrophobicContact CG-CE3 3.58Å; W557-W585 AromaticContact CG-CZ3 3.57Å; W557-W585 HydrophobicContact CG-CZ3 3.57Å; W557-W585 HydrophobicContact CH2-CB 4.14Å; W557-W585 HydrophobicContact CZ3-CB 3.82Å; W557-W585 HydrophobicContact CZ3-CE3 4.44Å; A581-W585 WeakPolarHBondContact O-CB 3.41Å; A581-W585 PolarHBondContact O-N 3.41Å; E583-W585 VanDerWaalsContact C-N 3.34Å; E583-W585 PolarHBondContact O-N 3.18Å; W585-Q587 VanDerWaalsContact C-N 3.32Å; W585-L588 HydrophobicContact CD2-CD1 4.21Å; W585-L588 HydrophobicContact CE3-CD1 3.4Å; W585-L588 VanDerWaalsContact CE3-CD1 3.4Å; W585-L588 HydrophobicContact CZ3-CD1 3.8Å; W585-K593 HydrophobicContact CH2-CB 4.49Å; W585-K593 HydrophobicContact CH2-CG 4.19Å; W585-K593 HydrophobicContact CZ2-CG 4.19Å; W585-K593 WeakPolarHBondContact O-CE 3.44Å; W585-K593 PolarHBondContact O-NZ 3.42Å; W585-W596 HydrophobicContact CH2-CB 3.97Å; W585-W596 HydrophobicContact CZ3-CB 4.22Å; W585-W596 HydrophobicContact CZ3-CG 4.28Å
586	R	81.4	Confident	81.2	Confident	209 Å²	209	84.4 Å²	84.4	79%	0.789	40%	0.396	S	S	*	.	H	α-helix	trans	-66.3	-38.3	172.6	-69.9	177.4	80.6	-170	4.2	110.9	G582 E583 M584 K593	G582-R586 WeakPolarHBondContact O-CG 3.26Å; G582-R586 PolarHBondContact O-N 3.24Å; E583-R586 WeakPolarHBondContact O-CB 3.47Å; E583-R586 PolarHBondContact O-N 2.87Å; E583-R586 VanDerWaalsContact O-N 3.07Å; M584-R586 VanDerWaalsContact C-N 3.29Å; M584-R586 PolarHBondContact O-N 2.78Å; R586-K593 PolarHBondContact O-NZ 2.92Å
587	Q	82.7	Confident	81.4	Confident	155 Å²	155	85.7 Å²	85.7	72%	0.724	40%	0.402	S	S	*	.	H	α-helix	trans	-77.1	-20.6	-177.1	-69.2	172.7	-24.9	0	0	115.9	E583 M584 W585	E583-Q587 PolarHBondContact O-N 3.36Å; E583-Q587 VanDerWaalsContact O-N 3.16Å; M584-Q587 PolarHBondContact O-N 3.15Å; W585-Q587 VanDerWaalsContact C-N 3.32Å
588	L	81.8	Confident	81.6	Confident	28 Å²	28	89.3 Å²	89.3	15%	0.147	42%	0.424	C	S	.	.	S	Bend	trans	-55.1	151.4	177	-67.5	170.1	0	0	0	112.8	W557 M584 W585 K593	W557-L588 HydrophobicContact CD2-CD1 4.27Å; W557-L588 HydrophobicContact CG-CD1 4.39Å; W557-L588 HydrophobicContact CZ2-CD1 4.18Å; M584-L588 PolarHBondContact O-N 2.89Å; W585-L588 HydrophobicContact CD2-CD1 4.21Å; W585-L588 HydrophobicContact CE3-CD1 3.4Å; W585-L588 VanDerWaalsContact CE3-CD1 3.4Å; W585-L588 HydrophobicContact CZ3-CD1 3.8Å; L588-K593 HydrophobicContact CB-CD 4.46Å; L588-K593 HydrophobicContact CB-CG 4.16Å; L588-K593 WeakPolarHBondContact O-CE 3.49Å; L588-K593 PolarHBondContact O-NZ 2.89Å
589	N	84.3	Confident	81.7	Confident	109 Å²	109	90 Å²	90	58%	0.583	42%	0.421	S	S	*	.			trans	-70.1	162.3	175.4	-73.4	-35.6	0	0	0	112.1	D591 E592 K593	N589-D591 VanDerWaalsContact C-N 3.34Å; N589-D591 PolarHBondContact O-N 2.91Å; N589-E592 HydrophobicContact CB-CG 4.3Å; N589-E592 PolarHBondContact N-OE2 2.84Å; N589-E592 PolarHBondContact O-N 3.26Å; N589-K593 WeakPolarHBondContact O-CG 3.32Å; N589-K593 PolarHBondContact O-N 2.9Å; N589-K593 VanDerWaalsContact O-N 3.15Å
590	K	75.7	Confident	81.8	Confident	158 Å²	158	84.2 Å²	84.2	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-60.5	-45.2	-177.7	-169.5	-174	174.8	-164.7	0	111.2	E592 K593 E594	K590-E592 PolarHBondContact O-N 2.95Å; K590-K593 WeakPolarHBondContact O-CB 3.46Å; K590-K593 PolarHBondContact O-N 3.34Å; K590-K593 VanDerWaalsContact O-N 3.17Å; K590-E594 WeakPolarHBondContact O-CB 3.33Å; K590-E594 PolarHBondContact O-N 2.81Å
591	D	75.8	Confident	81.9	Confident	125 Å²	125	81.9 Å²	81.9	67%	0.668	40%	0.397	S	S	*	.	H	α-helix	trans	-65.6	-38.8	-176	-38.1	-28.7	0	0	0	111.5	N589 E594 E595	N589-D591 VanDerWaalsContact C-N 3.34Å; N589-D591 PolarHBondContact O-N 2.91Å; D591-E594 PolarHBondContact O-N 2.92Å; D591-E595 PolarHBondContact O-N 2.82Å; D591-E595 VanDerWaalsContact O-N 3.08Å
592	E	76.5	Confident	82.1	Confident	88 Å²	88	86.8 Å²	86.8	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-45	173.5	-61	179.8	108.7	0	0	111.2	N589 K590 E594 E595 W596	N589-E592 HydrophobicContact CB-CG 4.3Å; N589-E592 PolarHBondContact N-OE2 2.84Å; N589-E592 PolarHBondContact O-N 3.26Å; K590-E592 PolarHBondContact O-N 2.95Å; E592-E594 VanDerWaalsContact C-N 3.33Å; E592-E594 PolarHBondContact O-N 3.15Å; E592-E595 WeakPolarHBondContact O-CB 3.42Å; E592-E595 PolarHBondContact O-N 2.91Å; E592-W596 PolarHBondContact O-N 2.93Å
593	K	79.3	Confident	82.1	Confident	52 Å²	52	87 Å²	87	23%	0.226	42%	0.419	C	S	.	.	H	α-helix	trans	-61.4	-42.1	175.7	-74.2	160.6	171	149	0	111.3	W585 R586 L588 N589 K590 E595 W596 E597	W585-K593 HydrophobicContact CH2-CB 4.49Å; W585-K593 HydrophobicContact CH2-CG 4.19Å; W585-K593 HydrophobicContact CZ2-CG 4.19Å; W585-K593 WeakPolarHBondContact O-CE 3.44Å; W585-K593 PolarHBondContact O-NZ 3.42Å; R586-K593 PolarHBondContact O-NZ 2.92Å; L588-K593 HydrophobicContact CB-CD 4.46Å; L588-K593 HydrophobicContact CB-CG 4.16Å; L588-K593 WeakPolarHBondContact O-CE 3.49Å; L588-K593 PolarHBondContact O-NZ 2.89Å; N589-K593 WeakPolarHBondContact O-CG 3.32Å; N589-K593 PolarHBondContact O-N 2.9Å; N589-K593 VanDerWaalsContact O-N 3.15Å; K590-K593 WeakPolarHBondContact O-CB 3.46Å; K590-K593 PolarHBondContact O-N 3.34Å; K590-K593 VanDerWaalsContact O-N 3.17Å; K593-E595 VanDerWaalsContact C-N 3.3Å; K593-E595 PolarHBondContact O-N 3.18Å; K593-W596 PolarHBondContact O-N 2.88Å; K593-W596 VanDerWaalsContact O-N 3.12Å; K593-E597 WeakPolarHBondContact O-CG 3.39Å; K593-E597 PolarHBondContact O-N 2.88Å
594	E	83.1	Confident	82.1	Confident	109 Å²	109	87.7 Å²	87.7	51%	0.509	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-32.9	179.6	-168.9	161.9	171.9	0	0	112.5	K590 D591 E592 E597 T598	K590-E594 WeakPolarHBondContact O-CB 3.33Å; K590-E594 PolarHBondContact O-N 2.81Å; D591-E594 PolarHBondContact O-N 2.92Å; E592-E594 VanDerWaalsContact C-N 3.33Å; E592-E594 PolarHBondContact O-N 3.15Å; E594-E597 PolarHBondContact O-N 3.21Å; E594-T598 WeakPolarHBondContact O-CB 3.44Å; E594-T598 PolarHBondContact O-N 2.85Å; E594-T598 PolarHBondContact O-OG1 3.36Å
595	E	82.9	Confident	82.3	Confident	99 Å²	99	94.3 Å²	94.3	46%	0.463	44%	0.443	S	S	.	.	H	α-helix	trans	-62.4	-43.6	171.1	-156.5	-145.1	-179.6	0	0	112	D591 E592 K593 K599	D591-E595 PolarHBondContact O-N 2.82Å; D591-E595 VanDerWaalsContact O-N 3.08Å; E592-E595 WeakPolarHBondContact O-CB 3.42Å; E592-E595 PolarHBondContact O-N 2.91Å; K593-E595 VanDerWaalsContact C-N 3.3Å; K593-E595 PolarHBondContact O-N 3.18Å; E595-K599 VanDerWaalsContact CD-CE 3.5Å; E595-K599 WeakPolarHBondContact O-CD 3.49Å; E595-K599 VanDerWaalsContact O-CG 3.27Å; E595-K599 WeakPolarHBondContact O-CG 3.26Å; E595-K599 PolarHBondContact O-N 3.07Å; E595-K599 VanDerWaalsContact OE1-CE 3.23Å; E595-K599 WeakPolarHBondContact OE1-CE 3.48Å; E595-K599 IonicContact OE1-NZ 2.71Å; E595-K599 PolarHBondContact OE1-NZ 2.81Å; E595-K599 IonicContact OE2-NZ 2.84Å; E595-K599 PolarHBondContact OE2-NZ 3.28Å
596	W	83.9	Confident	82.2	Confident	52 Å²	52	98.3 Å²	98.3	20%	0.197	46%	0.463	C	S	.	.	H	α-helix	trans	-74.6	-31	177.7	-64.9	105.3	0	0	0	113.3	A553 L556 W557 W585 E592 K593 K599 A600	A553-W596 HydrophobicContact CB-CB 4.13Å; A553-W596 WeakPolarHBondContact CB-O 3.11Å; L556-W596 HydrophobicContact CB-CE3 4.04Å; L556-W596 HydrophobicContact CB-CZ3 4.38Å; W557-W596 HydrophobicContact CB-CD2 3.89Å; W557-W596 HydrophobicContact CB-CE3 4.28Å; W557-W596 HydrophobicContact CB-CG 3.97Å; W557-W596 AromaticContact CD1-CD1 3.89Å; W557-W596 AromaticContact CD1-CE2 3.86Å; W557-W596 AromaticContact CD1-NE1 3.55Å; W585-W596 HydrophobicContact CH2-CB 3.97Å; W585-W596 HydrophobicContact CZ3-CB 4.22Å; W585-W596 HydrophobicContact CZ3-CG 4.28Å; E592-W596 PolarHBondContact O-N 2.93Å; K593-W596 PolarHBondContact O-N 2.88Å; K593-W596 VanDerWaalsContact O-N 3.12Å; W596-K599 HydrophobicContact CD2-CD 4.28Å; W596-K599 HydrophobicContact CE3-CD 3.72Å; W596-K599 HydrophobicContact CZ3-CD 3.89Å; W596-A600 WeakPolarHBondContact O-CB 3.37Å; W596-A600 PolarHBondContact O-N 2.82Å
597	E	84.6	Confident	82.4	Confident	121 Å²	121	89.9 Å²	89.9	57%	0.565	43%	0.432	S	S	*	.	H	α-helix	trans	-69.4	-38.4	171.8	-72.3	-171.3	179.3	0	0	111.9	A553 K593 E594 A600 G601	A553-E597 HydrophobicContact CB-CB 4.44Å; A553-E597 HydrophobicContact CB-CG 3.71Å; K593-E597 WeakPolarHBondContact O-CG 3.39Å; K593-E597 PolarHBondContact O-N 2.88Å; E594-E597 PolarHBondContact O-N 3.21Å; E597-A600 PolarHBondContact O-N 3.48Å; E597-G601 PolarHBondContact O-N 2.76Å
598	T	84.6	Confident	82.3	Confident	82 Å²	82	85.2 Å²	85.2	50%	0.503	41%	0.412	S	S	.	.	H	α-helix	trans	-59.9	-51.4	170.9	-61.5	0	0	0	0	110.8	E594 A600 G601 E602	E594-T598 WeakPolarHBondContact O-CB 3.44Å; E594-T598 PolarHBondContact O-N 2.85Å; E594-T598 PolarHBondContact O-OG1 3.36Å; T598-A600 VanDerWaalsContact C-N 3.3Å; T598-A600 PolarHBondContact O-N 2.79Å; T598-G601 WeakPolarHBondContact O-CA 3.38Å; T598-G601 PolarHBondContact O-N 3.1Å; T598-E602 PolarHBondContact O-N 2.98Å
599	K	82.7	Confident	82.4	Confident	66 Å²	66	90.7 Å²	90.7	29%	0.287	43%	0.434	S	S	.	.	H	α-helix	trans	-57.6	-39.1	175.7	-70.7	163.9	-176.2	171.4	0	112.6	L556 E595 W596 A603	L556-K599 HydrophobicContact CD1-CB 4.35Å; E595-K599 VanDerWaalsContact CD-CE 3.5Å; E595-K599 WeakPolarHBondContact O-CD 3.49Å; E595-K599 VanDerWaalsContact O-CG 3.27Å; E595-K599 WeakPolarHBondContact O-CG 3.26Å; E595-K599 PolarHBondContact O-N 3.07Å; E595-K599 VanDerWaalsContact OE1-CE 3.23Å; E595-K599 WeakPolarHBondContact OE1-CE 3.48Å; E595-K599 IonicContact OE1-NZ 2.71Å; E595-K599 PolarHBondContact OE1-NZ 2.81Å; E595-K599 IonicContact OE2-NZ 2.84Å; E595-K599 PolarHBondContact OE2-NZ 3.28Å; W596-K599 HydrophobicContact CD2-CD 4.28Å; W596-K599 HydrophobicContact CE3-CD 3.72Å; W596-K599 HydrophobicContact CZ3-CD 3.89Å; K599-A603 WeakPolarHBondContact O-CB 3.21Å; K599-A603 PolarHBondContact O-N 2.97Å
600	A	84.9	Confident	82.3	Confident	15 Å²	15	89.9 Å²	89.9	12%	0.124	43%	0.43	C	S	.	.	H	α-helix	trans	-69.5	-36.7	174.8	0	0	0	0	0	112.7	A553 L556 W596 E597 T598 A603 K604	A553-A600 HydrophobicContact CB-CB 4.01Å; L556-A600 HydrophobicContact CD1-CB 4.06Å; W596-A600 WeakPolarHBondContact O-CB 3.37Å; W596-A600 PolarHBondContact O-N 2.82Å; E597-A600 PolarHBondContact O-N 3.48Å; T598-A600 VanDerWaalsContact C-N 3.3Å; T598-A600 PolarHBondContact O-N 2.79Å; A600-A603 PolarHBondContact O-N 2.87Å; A600-K604 WeakPolarHBondContact O-CB 3.4Å; A600-K604 PolarHBondContact O-N 2.92Å
601	G	83.7	Confident	82.6	Confident	28 Å²	28	86.3 Å²	86.3	29%	0.289	41%	0.414	S	S	.	.	H	α-helix	trans	-61.9	-42.3	172.9	0	0	0	0	0	112.5	E597 T598 K604 R605	E597-G601 PolarHBondContact O-N 2.76Å; T598-G601 WeakPolarHBondContact O-CA 3.38Å; T598-G601 PolarHBondContact O-N 3.1Å; G601-K604 PolarHBondContact O-N 2.98Å; G601-R605 WeakPolarHBondContact O-CG 3.35Å; G601-R605 PolarHBondContact O-N 2.69Å
602	E	85.1	Confident	82.8	Confident	102 Å²	102	86.8 Å²	86.8	48%	0.477	41%	0.41	S	S	.	.	H	α-helix	trans	-65.6	-47.3	173.4	-66.5	-163.1	143	0	0	112.5	T598 K604 R605 Q606	T598-E602 PolarHBondContact O-N 2.98Å; E602-K604 PolarHBondContact O-N 2.9Å; E602-R605 PolarHBondContact O-N 3.24Å; E602-Q606 WeakPolarHBondContact O-CG 3.42Å; E602-Q606 PolarHBondContact O-N 3.39Å
603	A	83.2	Confident	82.9	Confident	30 Å²	30	87.5 Å²	87.5	25%	0.248	41%	0.413	C	S	.	.	H	α-helix	trans	-57.8	-35.5	175.5	0	0	0	0	0	112.1	P550 K599 A600 Y607	P550-A603 HydrophobicContact CB-CB 4.19Å; K599-A603 WeakPolarHBondContact O-CB 3.21Å; K599-A603 PolarHBondContact O-N 2.97Å; A600-A603 PolarHBondContact O-N 2.87Å; A603-Y607 WeakPolarHBondContact O-CB 3.49Å; A603-Y607 PolarHBondContact O-N 2.81Å
604	K	83.6	Confident	82.8	Confident	126 Å²	126	89 Å²	89	55%	0.548	42%	0.418	S	S	.	.	H	α-helix	trans	-68.6	-45	172.6	-174.8	-176.5	175.9	-171.8	0	112.3	P550 A600 G601 E602 Q606 Y607 D608	P550-K604 HydrophobicContact CG-CB 4.29Å; A600-K604 WeakPolarHBondContact O-CB 3.4Å; A600-K604 PolarHBondContact O-N 2.92Å; G601-K604 PolarHBondContact O-N 2.98Å; E602-K604 PolarHBondContact O-N 2.9Å; K604-Q606 VanDerWaalsContact C-N 3.34Å; K604-Q606 PolarHBondContact O-N 2.76Å; K604-Y607 WeakPolarHBondContact O-CB 3.05Å; K604-Y607 PolarHBondContact O-N 3.45Å; K604-D608 PolarHBondContact O-N 3.09Å
605	R	85	Confident	82.4	Confident	186 Å²	186	91.5 Å²	91.5	70%	0.702	43%	0.428	S	S	*	.	H	α-helix	trans	-60	-41.5	175	-73.8	168.8	176.1	170.1	-0.4	111.9	G601 E602 K609	G601-R605 WeakPolarHBondContact O-CG 3.35Å; G601-R605 PolarHBondContact O-N 2.69Å; E602-R605 PolarHBondContact O-N 3.24Å; R605-K609 PolarHBondContact O-N 3.25Å
606	Q	81.8	Confident	81.9	Confident	124 Å²	124	94.1 Å²	94.1	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-65.6	-43.7	174.1	-69.2	-178.7	9.5	0	0	111.7	E602 K604 D608 K609 L610	E602-Q606 WeakPolarHBondContact O-CG 3.42Å; E602-Q606 PolarHBondContact O-N 3.39Å; K604-Q606 VanDerWaalsContact C-N 3.34Å; K604-Q606 PolarHBondContact O-N 2.76Å; Q606-D608 PolarHBondContact O-N 2.83Å; Q606-K609 PolarHBondContact O-N 2.89Å; Q606-L610 WeakPolarHBondContact O-CG 3.26Å; Q606-L610 PolarHBondContact O-N 3.09Å
607	Y	84.7	Confident	81.1	Confident	32 Å²	32	95.9 Å²	95.9	13%	0.125	46%	0.46	C	S	.	.	H	α-helix	trans	-58.1	-46.4	176	178.2	-111.7	0	0	0	112.8	P547 K548 P550 A603 K604 K609 L610 K611	P547-Y607 HydrophobicContact CB-CD2 4.23Å; P547-Y607 HydrophobicContact CB-CE2 3.8Å; P547-Y607 HydrophobicContact CG-CE2 4.06Å; P547-Y607 WeakPolarHBondContact O-CE2 3.21Å; P547-Y607 PolarHBondContact O-OH 2.93Å; K548-Y607 VanDerWaalsContact C-CE2 3.48Å; K548-Y607 WeakPolarHBondContact O-CD2 3.32Å; K548-Y607 WeakPolarHBondContact O-CE2 3.06Å; P550-Y607 HydrophobicContact CG-CD1 4.34Å; P550-Y607 HydrophobicContact CG-CG 4.29Å; A603-Y607 WeakPolarHBondContact O-CB 3.49Å; A603-Y607 PolarHBondContact O-N 2.81Å; K604-Y607 WeakPolarHBondContact O-CB 3.05Å; K604-Y607 PolarHBondContact O-N 3.45Å; Y607-K609 VanDerWaalsContact C-N 3.3Å; Y607-K609 PolarHBondContact O-N 2.77Å; Y607-L610 PolarHBondContact O-N 2.79Å; Y607-K611 HydrophobicContact CD1-CD 4.27Å; Y607-K611 HydrophobicContact CE1-CD 3.56Å; Y607-K611 WeakPolarHBondContact O-CB 3.19Å; Y607-K611 PolarHBondContact O-N 3.08Å
608	D	81.6	Confident	79.9	Confident	58 Å²	58	92.9 Å²	92.9	31%	0.31	46%	0.461	S	S	.	.	H	α-helix	trans	-73.8	-19.2	-178.2	-75.8	-45.3	0	0	0	113.1	K604 Q606 K611 K612	K604-D608 PolarHBondContact O-N 3.09Å; Q606-D608 PolarHBondContact O-N 2.83Å; D608-K611 IonicContact OD1-NZ 3.35Å; D608-K611 PolarHBondContact OD1-NZ 3.42Å; D608-K612 WeakPolarHBondContact O-CG 3.24Å; D608-K612 PolarHBondContact O-N 3.1Å
609	K	84.3	Confident	78.3	Confident	143 Å²	143	91.9 Å²	91.9	62%	0.622	47%	0.468	S	S	*	.	H	α-helix	trans	-70.1	-58.2	163.7	-74.8	-175.6	176.9	-172.5	0	111.7	R605 Q606 Y607 K611 K612 E613	R605-K609 PolarHBondContact O-N 3.25Å; Q606-K609 PolarHBondContact O-N 2.89Å; Y607-K609 VanDerWaalsContact C-N 3.3Å; Y607-K609 PolarHBondContact O-N 2.77Å; K609-K611 PolarHBondContact O-N 2.87Å; K609-K612 WeakPolarHBondContact O-CA 3.36Å; K609-K612 WeakPolarHBondContact O-CB 3.45Å; K609-K612 PolarHBondContact O-N 3.44Å; K609-E613 PolarHBondContact O-N 2.89Å
610	L	81.2	Confident	76.6	Confident	92 Å²	92	92 Å²	92	48%	0.482	49%	0.488	S	S	.	.	H	α-helix	trans	-55.7	-30.1	179.3	-69	167.3	0	0	0	112.8	Q606 Y607 Y614	Q606-L610 WeakPolarHBondContact O-CG 3.26Å; Q606-L610 PolarHBondContact O-N 3.09Å; Y607-L610 PolarHBondContact O-N 2.79Å; L610-Y614 WeakPolarHBondContact O-CB 3.44Å; L610-Y614 PolarHBondContact O-N 3.47Å
611	K	82.1	Confident	74.1	Confident	83 Å²	83	96.4 Å²	96.4	36%	0.361	52%	0.518	S	S	.	.	H	α-helix	trans	-80.9	-19.5	177	179.6	178	136.6	-138.7	0	114.1	P547 Y607 D608 K609 K615	P547-K611 HydrophobicContact CG-CB 4.23Å; Y607-K611 HydrophobicContact CD1-CD 4.27Å; Y607-K611 HydrophobicContact CE1-CD 3.56Å; Y607-K611 WeakPolarHBondContact O-CB 3.19Å; Y607-K611 PolarHBondContact O-N 3.08Å; D608-K611 IonicContact OD1-NZ 3.35Å; D608-K611 PolarHBondContact OD1-NZ 3.42Å; K609-K611 PolarHBondContact O-N 2.87Å; K611-K615 WeakPolarHBondContact O-CG 3.29Å
612	K	80.8	Confident	71.7	Confident	135 Å²	135	101.3 Å²	101.3	59%	0.587	54%	0.542	S	S	*	.	H	α-helix	trans	-78.4	-49.5	165.9	-75.8	179.3	177.8	-168.3	0	110.1	D608 K609 Y614 K615 E616	D608-K612 WeakPolarHBondContact O-CG 3.24Å; D608-K612 PolarHBondContact O-N 3.1Å; K609-K612 WeakPolarHBondContact O-CA 3.36Å; K609-K612 WeakPolarHBondContact O-CB 3.45Å; K609-K612 PolarHBondContact O-N 3.44Å; K612-Y614 VanDerWaalsContact C-N 3.32Å; K612-Y614 PolarHBondContact O-N 3.19Å; K612-K615 WeakPolarHBondContact O-CA 3.38Å; K612-K615 WeakPolarHBondContact O-CB 3.42Å; K612-K615 PolarHBondContact O-N 2.69Å; K612-E616 PolarHBondContact O-N 2.85Å
613	E	79.1	Confident	69.1	Low	102 Å²	102	101.6 Å²	101.6	48%	0.477	56%	0.555	S	S	.	*	H	α-helix	trans	-53.4	-47.1	175.7	-67.3	159.1	-156.9	0	0	111.4	K609 K615 E616 S617	K609-E613 PolarHBondContact O-N 2.89Å; E613-K615 PolarHBondContact O-N 3.32Å; E613-E616 PolarHBondContact O-N 3.26Å; E613-S617 WeakPolarHBondContact O-CB 3.27Å; E613-S617 PolarHBondContact O-N 3.19Å; E613-S617 PolarHBondContact O-OG 3.47Å
614	Y	76.4	Confident	66.5	Low	83 Å²	83	106 Å²	106	33%	0.325	58%	0.584	S	S	.	*	H	α-helix	trans	-64.7	-19.2	175.5	-176	-91.5	0	0	0	114.9	A545 L610 K612	A545-Y614 WeakPolarHBondContact O-CE2 3.41Å; L610-Y614 WeakPolarHBondContact O-CB 3.44Å; L610-Y614 PolarHBondContact O-N 3.47Å; K612-Y614 VanDerWaalsContact C-N 3.32Å; K612-Y614 PolarHBondContact O-N 3.19Å
615	K	73.5	Confident	64	Low	163 Å²	163	105.8 Å²	105.8	71%	0.709	60%	0.596	S	S	*	*	H	α-helix	trans	-86.4	-41.5	172.2	-82.6	-175.6	162.7	-156.2	0	111.7	K611 K612 E613 S617	K611-K615 WeakPolarHBondContact O-CG 3.29Å; K612-K615 WeakPolarHBondContact O-CA 3.38Å; K612-K615 WeakPolarHBondContact O-CB 3.42Å; K612-K615 PolarHBondContact O-N 2.69Å; E613-K615 PolarHBondContact O-N 3.32Å; K615-S617 VanDerWaalsContact C-N 3.33Å
616	E	73.3	Confident	61.2	Low	153 Å²	153	108.4 Å²	108.4	72%	0.715	61%	0.606	S	S	*	*	H	α-helix	trans	-69.7	-31.7	-179.3	-71.8	157.1	-161.5	0	0	111.2	K612 E613 G618	K612-E616 PolarHBondContact O-N 2.85Å; E613-E616 PolarHBondContact O-N 3.26Å; E616-G618 PolarHBondContact O-N 3.21Å; E616-G618 VanDerWaalsContact O-N 3.1Å
617	S	66.8	Low	58.6	Low	90 Å²	90	112.5 Å²	112.5	63%	0.629	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	16.5	177.8	75.3	0	0	0	0	115.6	E613 K615	E613-S617 WeakPolarHBondContact O-CB 3.27Å; E613-S617 PolarHBondContact O-N 3.19Å; E613-S617 PolarHBondContact O-OG 3.47Å; K615-S617 VanDerWaalsContact C-N 3.33Å
618	G	58.8	Low	55.9	Low	57 Å²	57	120.1 Å²	120.1	59%	0.588	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.5	92.4	178.7	0	0	0	0	0	113.7	E616 G620	E616-G618 PolarHBondContact O-N 3.21Å; E616-G618 VanDerWaalsContact O-N 3.1Å; G618-G620 VanDerWaalsContact C-N 3.33Å; G618-G620 PolarHBondContact O-N 2.85Å
619	G	50.8	Low	53.4	Low	62 Å²	62	127.3 Å²	127.3	64%	0.639	69%	0.687	S	S	*	*			trans	-70.4	67.8	-171.3	0	0	0	0	0	117.2
620	G	47.1	Very low	50.8	Low	69 Å²	69	132.6 Å²	132.6	71%	0.711	70%	0.703	S	S	*	*			trans	97.7	99.8	156.1	0	0	0	0	0	117	G618	G618-G620 VanDerWaalsContact C-N 3.33Å; G618-G620 PolarHBondContact O-N 2.85Å
621	S	34	Very low	48.3	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	72%	0.723	S	S	*	*			trans	-142.7	161.2	157	69.1	0	0	0	0	110.9
622	T	32.8	Very low	45.6	Very low	130 Å²	130	140.3 Å²	140.3	80%	0.798	75%	0.748	S	S	*	*	S	Bend	trans	73.1	124.4	179	71.1	0	0	0	0	118.8
623	S	30.9	Very low	43	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	76%	0.76	S	S	*	*			trans	1	132.4	153.6	51.6	0	0	0	0	120.9	P625	S623-P625 WeakPolarHBondContact O-CD 3.26Å
624	S	28.8	Very low	40.5	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-83.4	131.8	161.7	-58.3	0	0	0	0	112.9
625	P	29.2	Very low	38.1	Very low	123 Å²	123	142.4 Å²	142.4	80%	0.799	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-93	173.5	149.6	33.8	-30.7	0	0	0	112	S623	S623-P625 WeakPolarHBondContact O-CD 3.26Å
626	R	26.6	Very low	35.9	Very low	240 Å²	240	142.4 Å²	142.4	91%	0.906	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-60	152.2	-166.9	-68.8	171.1	169	165	-5.4	115.3
627	K	28.2	Very low	33.7	Very low	211 Å²	211	140.5 Å²	140.5	92%	0.917	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-67.4	133.2	155.1	-87.1	-175.6	171.6	-176.3	0	110.2
628	E	27.7	Very low	31.8	Very low	192 Å²	192	140.9 Å²	140.9	90%	0.897	79%	0.794	S	S	*	*			trans	-111.6	160.3	149.3	-73.2	-154.7	123.6	0	0	111.4
629	K	29.9	Very low	30.3	Very low	209 Å²	209	147.2 Å²	147.2	91%	0.909	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-91.6	125.2	-178.8	-63.4	172.8	-178.6	171.9	0	109.8
630	R	28.2	Very low	29.1	Very low	253 Å²	253	150.9 Å²	150.9	96%	0.955	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80.5	126.8	160.7	-89.5	-172.7	160.7	-168	-7.5	110.4
631	K	28.4	Very low	28.1	Very low	210 Å²	210	158.2 Å²	158.2	91%	0.913	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71	160.7	158.9	-80.3	-176.8	174.8	179.7	0	110
632	S	26.6	Very low	27.7	Very low	127 Å²	127	162.1 Å²	162.1	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-86.4	153.4	176.6	40.9	0	0	0	0	112.8
633	G	26.4	Very low	27.2	Very low	81 Å²	81	160 Å²	160	84%	0.835	80%	0.803	S	S	*	*			trans	147.5	137.9	164.8	0	0	0	0	0	115.6
634	G	26.6	Very low	26.8	Very low	81 Å²	81	159.6 Å²	159.6	84%	0.835	80%	0.801	S	S	*	*			trans	92.2	100.4	152	0	0	0	0	0	120.3
635	K	26.1	Very low	26.6	Very low	202 Å²	202	159.2 Å²	159.2	88%	0.878	80%	0.798	S	S	*	*			trans	-75.3	164.5	139.3	-72.6	171.5	177.6	173.8	0	107.9
636	K	25.8	Very low	26.3	Very low	164 Å²	164	156.9 Å²	156.9	71%	0.713	80%	0.796	S	S	*	*			cis	-158.6	-176.7	4.9	-121.2	173.3	161.9	-78	0	105.7
637	D	27.1	Very low	26.3	Very low	113 Å²	113	152.9 Å²	152.9	60%	0.604	79%	0.788	S	S	*	*			cis	-153.6	138.7	0.7	-123.9	-22.7	0	0	0	108.6
638	D	27.5	Very low	26.2	Very low	98 Å²	98	150.8 Å²	150.8	52%	0.524	78%	0.779	S	S	.	*				63.8	99.6	104.2	-166.1	28.6	0	0	0	119.5	K640	D638-K640 IonicContact OD2-NZ 3.16Å
639	K	27.4	Very low	26	Very low	190 Å²	190	148.8 Å²	148.8	83%	0.826	77%	0.769	S	S	*	*				-171.1	114.5	123.8	-97.5	156.3	-174.6	175.5	0	108.8
640	K	25.5	Very low	25.9	Very low	138 Å²	138	146.2 Å²	146.2	60%	0.6	76%	0.758	S	S	*	*				67.5	107.9	84.7	-78	174.3	-179.4	146.9	0	113.2	D638	D638-K640 IonicContact OD2-NZ 3.16Å
641	R	26.5	Very low	25.7	Very low	223 Å²	223	140.9 Å²	140.9	84%	0.842	74%	0.744	S	S	*	*				78.7	140.1	96.9	-78.5	-179.4	-178.2	-172.2	-1.3	111.8
642	K	25.5	Very low	25.5	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.826	74%	0.74	S	S	*	*			cis	-158.4	179.4	23	-114	-170	178.5	-176.6	0	106.8
643	S	23.5	Very low	25.4	Very low	85 Å²	85	139.3 Å²	139.3	59%	0.594	74%	0.739	S	S	*	*			cis	-173.2	172.4	-10.5	44.8	0	0	0	0	110.7
644	S	22.3	Very low	25.3	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	74%	0.738	S	S	*	*			trans	64.1	151	140.5	51.1	0	0	0	0	121.4
645	S	23.4	Very low	25.2	Very low	114 Å²	114	142.4 Å²	142.4	80%	0.797	74%	0.736	S	S	*	*			cis	178.3	150.1	-18.9	51.9	0	0	0	0	112
646	G	23.9	Very low	25.3	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	73%	0.726	S	S	*	*			trans	79.8	169.6	158.2	0	0	0	0	0	117.5
647	E	25.8	Very low	25.3	Very low	155 Å²	155	136.3 Å²	136.3	72%	0.724	73%	0.73	S	S	*	*			cis	-163.4	152.5	-11.5	-114.8	-154.4	149.7	0	0	113.2
648	K	26.5	Very low	25.3	Very low	168 Å²	168	138.8 Å²	138.8	73%	0.73	74%	0.735	S	S	*	*			trans	71.1	168.9	145	-75.8	176.1	-178.1	134.9	0	124.3
649	E	24.1	Very low	25.3	Very low	149 Å²	149	141.4 Å²	141.4	70%	0.696	74%	0.742	S	S	*	*			trans	-79	-174	-170.7	-44.2	171.2	104.5	0	0	113.2
650	K	26.1	Very low	25.4	Very low	155 Å²	155	137.4 Å²	137.4	67%	0.674	74%	0.738	S	S	*	*			cis	-168.4	176.6	20.3	-146.2	156.4	-163.4	142	0	112.2
651	E	24.7	Very low	25.7	Very low	142 Å²	142	139.9 Å²	139.9	66%	0.664	74%	0.744	S	S	*	*			trans	69.1	153.9	160	-65.7	-146.1	134.5	0	0	119.6
652	R	24.3	Very low	25.9	Very low	220 Å²	220	136 Å²	136	83%	0.83	74%	0.735	S	S	*	*			cis	-161.3	146.2	-29.7	-121.1	-174.9	174.8	149.5	-14.5	110.5
653	G	24.7	Very low	26	Very low	84 Å²	84	134.8 Å²	134.8	87%	0.866	73%	0.73	S	S	*	*			trans	78.6	143.9	165.2	0	0	0	0	0	116.5
654	G	23.2	Very low	26.4	Very low	79 Å²	79	138.8 Å²	138.8	81%	0.814	74%	0.743	S	S	*	*			cis	146.2	118.9	-18.1	0	0	0	0	0	114.8
655	N	25.5	Very low	26.6	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	74%	0.743	S	S	*	*				-165.4	155.7	126.9	-158.4	26	0	0	0	113.7
656	D	27.3	Very low	26.7	Very low	123 Å²	123	142.2 Å²	142.2	66%	0.658	75%	0.745	S	S	*	*			trans	58.6	115.6	153.8	-96	-48	0	0	0	126.6
657	S	27.4	Very low	26.9	Very low	115 Å²	115	143.3 Å²	143.3	80%	0.804	74%	0.741	S	S	*	*			trans	88.3	158.9	131.8	83.5	0	0	0	0	121.3
658	F	25.5	Very low	26.9	Very low	164 Å²	164	143.6 Å²	143.6	72%	0.719	75%	0.747	S	S	*	*			trans	-153	127.1	-150.2	175	-84.2	0	0	0	113.9
659	K	28.8	Very low	26.9	Very low	153 Å²	153	142.2 Å²	142.2	67%	0.665	75%	0.748	S	S	*	*			trans	24.2	124.2	153	-45.6	179.2	-167.2	169	0	121.4
660	S	29.1	Very low	26.9	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	75%	0.747	S	S	*	*				69.3	171.8	129.2	77.3	0	0	0	0	117.7
661	R	31.6	Very low	26.8	Very low	191 Å²	191	136.8 Å²	136.8	72%	0.721	75%	0.746	S	S	*	*			cis	-166.6	157.6	5.3	-146.1	168.3	160.3	-175.7	-23.6	110.8
662	E	30.6	Very low	26.8	Very low	142 Å²	142	135.4 Å²	135.4	66%	0.664	75%	0.752	S	S	*	*			trans	56.3	169.2	153.3	-83.1	141.2	-162.8	0	0	117.3
663	F	28.1	Very low	26.9	Very low	164 Å²	164	132 Å²	132	72%	0.719	75%	0.751	S	S	*	*			cis	163	143.2	-24	-166.9	-85.6	0	0	0	104.9	E665	F663-E665 HydrophobicContact CD1-CG 4.37Å; F663-E665 HydrophobicContact CE1-CG 3.77Å
664	I	30.4	Very low	27	Very low	169 Å²	169	132.8 Å²	132.8	87%	0.867	74%	0.743	S	S	*	*			trans	-163.9	154.1	163.6	-106.4	153.7	0	0	0	109.1
665	E	26.8	Very low	27.3	Very low	148 Å²	148	135.6 Å²	135.6	69%	0.692	74%	0.739	S	S	*	*			trans	-110	-174.5	-167.7	-59.7	177.2	109.7	0	0	113.6	F663	F663-E665 HydrophobicContact CD1-CG 4.37Å; F663-E665 HydrophobicContact CE1-CG 3.77Å
666	T	25.7	Very low	27.4	Very low	137 Å²	137	134.8 Å²	134.8	84%	0.84	73%	0.73	S	S	*	*			trans	75.2	144.5	164	66.5	0	0	0	0	117.9
667	S	28.4	Very low	27.3	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	73%	0.731	S	S	*	*			cis	-168	147.1	-14.7	45.9	0	0	0	0	112.5
668	D	26.1	Very low	27.2	Very low	161 Å²	161	135.5 Å²	135.5	86%	0.861	73%	0.726	S	S	*	*			trans	58.3	144.2	144.8	-76.6	-61.4	0	0	0	126.3
669	D	26.3	Very low	27.2	Very low	139 Å²	139	137 Å²	137	74%	0.743	73%	0.732	S	S	*	*			trans	80.5	142	146.1	-154	-121.2	0	0	0	124.7
670	S	24.3	Very low	27.2	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	73%	0.733	S	S	*	*			trans	62.5	151.8	158.8	-80.5	0	0	0	0	120.8
671	S	24.4	Very low	27	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	74%	0.737	S	S	*	*			cis	-171.3	156.9	-23.3	-176.6	0	0	0	0	109.5
672	S	24.6	Very low	26.7	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	74%	0.738	S	S	*	*			trans	61.3	163.3	160.1	65.2	0	0	0	0	119.4
673	D	25.8	Very low	26.5	Very low	148 Å²	148	138 Å²	138	79%	0.791	74%	0.738	S	S	*	*			cis	-168	168	-38	-169.8	10.1	0	0	0	107.6
674	S	28	Very low	26.5	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	74%	0.74	S	S	*	*			trans	72	150.4	166.2	85.9	0	0	0	0	117.7
675	D	27.7	Very low	26.3	Very low	137 Å²	137	139 Å²	139	73%	0.733	73%	0.731	S	S	*	*			cis	-152.6	159.6	-10.1	-145.4	-18.7	0	0	0	114.1
676	H	28.6	Very low	26.4	Very low	132 Å²	132	138.4 Å²	138.4	61%	0.611	73%	0.726	S	S	*	*			trans	23.9	139.6	150	-93.1	-32	0	0	0	125.8
677	K	25.7	Very low	26.5	Very low	153 Å²	153	139.3 Å²	139.3	67%	0.665	72%	0.718	S	S	*	*			trans	76.3	99.3	134	-75	165.2	178.4	136.5	0	121
678	S	25	Very low	26.6	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	71%	0.709	S	S	*	*				36.2	132.8	111.5	70.8	0	0	0	0	121.9
679	K	25.2	Very low	26.7	Very low	195 Å²	195	136.3 Å²	136.3	85%	0.848	70%	0.698	S	S	*	*			trans	76.9	108	150.1	-71.1	-177.5	176.3	-179.6	0	120
680	S	28.8	Very low	26.8	Very low	98 Å²	98	136.8 Å²	136.8	69%	0.685	70%	0.696	S	S	*	*				93.6	164.4	120.9	81.9	0	0	0	0	120.5
681	K	25.2	Very low	27.1	Very low	193 Å²	193	140.7 Å²	140.7	84%	0.839	70%	0.703	S	S	*	*			trans	81.3	151	-175.4	-57.9	164.5	-176.4	166	0	111.6
682	K	25.3	Very low	27.3	Very low	168 Å²	168	145.1 Å²	145.1	73%	0.73	71%	0.714	S	S	*	*			cis	-162.9	125.7	33.3	-154.6	163.4	-173.3	176.1	0	113.7
683	K	26.3	Very low	27.5	Very low	156 Å²	156	148.2 Å²	148.2	68%	0.678	72%	0.716	S	S	*	*			trans	67.6	161	153.3	-67.2	178.9	178.6	-179.4	0	115.7
684	R	27.4	Very low	27.6	Very low	197 Å²	197	149.6 Å²	149.6	74%	0.743	72%	0.718	S	S	*	*			cis	-172.2	165.2	-9.8	-111.9	-178.4	178.3	177.4	-4.5	107.4
685	K	27.7	Very low	27.6	Very low	156 Å²	156	153.5 Å²	153.5	68%	0.678	73%	0.725	S	S	*	*			cis	-170.7	139.3	-2.7	-174.3	-168.8	-178.3	-164.4	0	109.5
686	K	28.6	Very low	27.8	Very low	136 Å²	136	155.5 Å²	155.5	59%	0.591	73%	0.729	S	S	*	*			trans	64	158.5	158.2	-87.4	-173.1	175.7	-98.7	0	117.6	E688	K686-E688 WeakPolarHBondContact CE-OE1 3.44Å; K686-E688 WeakPolarHBondContact CG-OE1 3.36Å; K686-E688 IonicContact NZ-OE1 2.72Å; K686-E688 PolarHBondContact NZ-OE1 2.72Å; K686-E688 IonicContact NZ-OE2 2.85Å; K686-E688 PolarHBondContact NZ-OE2 3.39Å
687	K	27	Very low	27.9	Very low	156 Å²	156	156.2 Å²	156.2	68%	0.678	74%	0.743	S	S	*	*			cis	-140.2	145.3	6.5	-154.1	176.8	172.3	-57.3	0	112.7
688	E	30	Very low	28.2	Very low	103 Å²	103	154.6 Å²	154.6	48%	0.481	75%	0.746	S	S	.	*			trans	-8.4	154.9	154.5	-55.9	105.3	-120.1	0	0	118.9	K686	K686-E688 WeakPolarHBondContact CE-OE1 3.44Å; K686-E688 WeakPolarHBondContact CG-OE1 3.36Å; K686-E688 IonicContact NZ-OE1 2.72Å; K686-E688 PolarHBondContact NZ-OE1 2.72Å; K686-E688 IonicContact NZ-OE2 2.85Å; K686-E688 PolarHBondContact NZ-OE2 3.39Å
689	S	27.9	Very low	28.4	Very low	91 Å²	91	155.7 Å²	155.7	64%	0.636	75%	0.753	S	S	*	*			cis	-157.3	151.9	37.8	46.4	0	0	0	0	116.7
690	E	29.6	Very low	28.9	Very low	150 Å²	150	152.1 Å²	152.1	70%	0.701	75%	0.748	S	S	*	*			trans	45.2	135.2	149.5	-66.2	102.4	-113.4	0	0	120.6
691	E	29.6	Very low	29.3	Very low	177 Å²	177	153.3 Å²	153.3	83%	0.827	75%	0.753	S	S	*	*			cis	71.8	137.7	48.6	-60.2	175.2	168.8	0	0	111.7
692	E	29.5	Very low	29.5	Very low	187 Å²	187	149.1 Å²	149.1	87%	0.874	75%	0.754	S	S	*	*			cis	-130.6	-141.3	20.1	-64.9	175.9	127.2	0	0	114.3
693	E	29.1	Very low	29.8	Very low	180 Å²	180	147 Å²	147	84%	0.841	76%	0.761	S	S	*	*			trans	-105.6	-165.8	-154.7	-53.8	-177.4	108.5	0	0	115.7
694	E	28.1	Very low	30.4	Very low	177 Å²	177	144.6 Å²	144.6	83%	0.827	76%	0.764	S	S	*	*			trans	89.9	126.9	155.3	-76.2	-171.9	165	0	0	124
695	E	27.7	Very low	31.1	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	77%	0.769	S	S	*	*			trans	72.8	159.3	145.3	-65.6	-148.6	144.5	0	0	124.8
696	E	32.2	Very low	31.7	Very low	178 Å²	178	145.7 Å²	145.7	83%	0.832	78%	0.78	S	S	*	*			trans	-88.6	153.8	-171.6	-44	-179	138.4	0	0	112.1
697	V	29.3	Very low	32.7	Very low	147 Å²	147	148.2 Å²	148.2	89%	0.891	79%	0.794	S	S	*	*				-148.1	137.6	129.9	-124.8	0	0	0	0	113.7
698	V	33.2	Very low	33.4	Very low	120 Å²	120	146.4 Å²	146.4	73%	0.727	80%	0.801	S	S	*	*			trans	-64.5	148.2	158	170.8	0	0	0	0	109.9	T700	V698-T700 HydrophobicContact CG1-CG2 4.2Å
699	S	29.4	Very low	34	Very low	121 Å²	121	153.3 Å²	153.3	85%	0.846	84%	0.841	S	S	*	*			trans	-131.9	129.4	158.5	42.9	0	0	0	0	111.3
700	T	34.7	Very low	34.3	Very low	120 Å²	120	156.4 Å²	156.4	74%	0.736	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-96.3	162.7	-174.7	44.7	0	0	0	0	112.2	V698	V698-T700 HydrophobicContact CG1-CG2 4.2Å
701	P	36.8	Very low	34.6	Very low	123 Å²	123	156.7 Å²	156.7	80%	0.799	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-65.1	155.4	167.4	30	-36	0	0	0	111.7
702	A	30.1	Very low	34.8	Very low	105 Å²	105	155.6 Å²	155.6	87%	0.868	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-89.8	159.1	-177.7	0	0	0	0	0	113.4
703	S	31.9	Very low	35.2	Very low	123 Å²	123	153.8 Å²	153.8	86%	0.86	86%	0.86	S	S	*	*			trans	-116.5	158.8	169.7	-171.2	0	0	0	0	109.7
704	S	37.7	Very low	35.5	Very low	107 Å²	107	152.1 Å²	152.1	75%	0.748	86%	0.861	S	S	*	*			trans	-136.1	145.4	167.6	55.9	0	0	0	0	109.5
705	E	42.9	Very low	36	Very low	181 Å²	181	150.5 Å²	150.5	85%	0.846	86%	0.863	S	S	*	*			trans	-83.1	161.3	-165.5	-58.8	128.2	127.4	0	0	114.4
706	E	41	Very low	36.6	Very low	194 Å²	194	148.1 Å²	148.1	91%	0.907	86%	0.864	S	S	*	*				-176.8	157.3	104	-94.8	-172.1	153.7	0	0	111.8
707	E	49	Very low	37	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	87%	0.866	S	S	*	*			trans	-103.4	148	172.9	-70.5	-176.6	109.5	0	0	111.4
708	S	42.2	Very low	37.6	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	86%	0.864	S	S	*	*			trans	-162.7	130.9	157.2	-65.9	0	0	0	0	110.4
709	D	42.3	Very low	38	Very low	248 Å²	248	148.1 Å²	148.1	100%	1.326	88%	0.877	S	S	*	*			trans	15.1	0	170.3	-73.3	-63.7	0	0	0	119.9

Retrieved 709 of 709 residues in 564.1 ms (Link to these results)

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