A0A3Q0KTJ6_SCHMA Loading...

Selenocysteine-specific elongation factor

Translation factor required for the incorporation of the rare amino acid selenocysteine encoded by UGA codons. Replaces the eRF1-eRF3-GTP ternary complex for the insertion of selenocysteine directed by the UGA codon. Insertion of selenocysteine at UGA codons is mediated by SECISBP2 and EEFSEC: SECISBP2 (1) specifically binds the SECIS sequence once the 80S ribosome encounters an in-frame UGA codon and (2) contacts the RPS27A/eS31 of the 40S ribosome before ribosome stalling. (3) GTP-bound EEFSEC then delivers selenocysteinyl-tRNA(Sec) to the 80S ribosome and adopts a preaccommodated state conformation. (4) After GTP hydrolysis, EEFSEC dissociates from the assembly, selenocysteinyl-tRNA(Sec) accommodates, and peptide bond synthesis and selenoprotein elongation occur.

AlphaFold DB , UniProt , Accession A0A3Q0KTJ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 546 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	87.3	Confident	92.6	Very high	83 Å²	83	11.9 Å²	11.9	41%	0.409	6%	0.059	S	C	.	.				0	129.8	0	-175.7	-173.8	-64.5	0	0	108.7	K71 Q73	M1-K71 CarbonylContact C-O 3.52Å; M1-K71 WeakPolarHBondContact CA-O 3.44Å; M1-K71 HydrophobicContact CE-CB 4.47Å; M1-K71 HydrophobicContact CG-CB 4.23Å; M1-Q73 HydrophobicContact CG-CB 4.29Å; M1-Q73 HydrophobicContact SD-CB 4.04Å
2	L	92	Very high	92.1	Very high	9 Å²	9	13.2 Å²	13.2	5%	0.047	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132	175.1	176.9	64.5	0	0	0	109.5	I4 I65 F69 K71 V72 Q73 P207	L2-I4 HydrophobicContact CD2-CD1 4.12Å; L2-I4 HydrophobicContact CD2-CG1 4.26Å; L2-I4 HydrophobicContact CG-CG1 4.19Å; L2-I65 HydrophobicContact CD2-CD1 4.14Å; L2-I65 HydrophobicContact CD2-CG1 4.03Å; L2-I65 HydrophobicContact CD2-CG2 4.08Å; L2-F69 HydrophobicContact CB-CB 4.19Å; L2-F69 HydrophobicContact CB-CD1 3.83Å; L2-F69 HydrophobicContact CB-CD2 3.93Å; L2-F69 HydrophobicContact CB-CE1 4.14Å; L2-F69 HydrophobicContact CB-CE2 4.26Å; L2-F69 HydrophobicContact CB-CG 3.7Å; L2-F69 HydrophobicContact CB-CZ 4.35Å; L2-F69 HydrophobicContact CD1-CE2 4.32Å; L2-F69 HydrophobicContact CD1-CZ 4.17Å; L2-F69 HydrophobicContact CD2-CD2 4.19Å; L2-F69 HydrophobicContact CD2-CE2 4.27Å; L2-K71 PolarHBondContact N-O 2.92Å; L2-V72 WeakPolarHBondContact O-CA 3.36Å; L2-Q73 PolarHBondContact O-N 3.42Å; L2-P207 HydrophobicContact CD1-CG 4.48Å
3	N	93.6	Very high	91.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.5	171.4	-174.9	61.2	0	0	0	111	N5 Q73 T75 R211 G278	N3-N5 PolarHBondContact ND2-OD1 3Å; N3-Q73 CarbonylContact C-O 3.56Å; N3-Q73 WeakPolarHBondContact CA-O 3.15Å; N3-Q73 PolarHBondContact OD1-NE2 3.16Å; N3-Q73 PolarHBondContact OD1-O 3.43Å; N3-T75 PolarHBondContact ND2-OG1 3.1Å; N3-T75 PolarHBondContact OD1-OG1 3.36Å; N3-R211 VanDerWaalsContact O-CZ 3.25Å; N3-R211 PolarHBondContact O-NH1 3.43Å; N3-R211 PolarHBondContact O-NH2 3.26Å; N3-G278 PolarHBondContact ND2-O 3.36Å
4	I	94	Very high	91.6	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	124.8	175.7	-61.6	-176.3	0	0	0	108.3	L2 V6 V72 Q73 F74 T75 D97 I98 I204	L2-I4 HydrophobicContact CD2-CD1 4.12Å; L2-I4 HydrophobicContact CD2-CG1 4.26Å; L2-I4 HydrophobicContact CG-CG1 4.19Å; I4-V6 HydrophobicContact CG2-CG2 4.34Å; I4-V72 HydrophobicContact CD1-CG1 3.88Å; I4-V72 HydrophobicContact CG1-CG1 4.24Å; I4-Q73 PolarHBondContact N-O 3.34Å; I4-F74 HydrophobicContact CB-CD1 4.32Å; I4-F74 HydrophobicContact CG2-CD1 4.45Å; I4-F74 CarbonylContact O-C 3.59Å; I4-F74 WeakPolarHBondContact O-CA 3.42Å; I4-T75 PolarHBondContact O-N 3.22Å; I4-D97 HydrophobicContact CG2-CB 4.1Å; I4-I98 HydrophobicContact CG2-CG2 4.27Å; I4-I204 HydrophobicContact CD1-CD1 3.53Å; I4-I204 HydrophobicContact CD1-CG1 4.2Å; I4-I204 HydrophobicContact CD1-CG2 3.68Å; I4-I204 HydrophobicContact CG2-CD1 4.41Å
5	N	93.8	Very high	91.5	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.011	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.1	178.4	-61.1	-38.8	0	0	0	109.3	N3 T75 I95 D97 I98 T239 G278	N3-N5 PolarHBondContact ND2-OD1 3Å; N5-T75 CarbonylContact C-O 3.56Å; N5-T75 WeakPolarHBondContact CA-O 3.48Å; N5-T75 WeakPolarHBondContact OD1-CB 3.44Å; N5-I95 WeakPolarHBondContact CB-O 3.2Å; N5-I95 PolarHBondContact ND2-O 2.95Å; N5-D97 PolarHBondContact N-OD2 2.93Å; N5-D97 PolarHBondContact O-N 2.91Å; N5-I98 PolarHBondContact O-N 2.81Å; N5-T239 WeakPolarHBondContact ND2-CG2 3.4Å; N5-G278 PolarHBondContact ND2-O 3.04Å
6	V	94.7	Very high	91.5	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116	-177	-177.3	0	0	0	0	109	I4 F74 T75 L76 V77 I98 V100 L200	I4-V6 HydrophobicContact CG2-CG2 4.34Å; V6-F74 HydrophobicContact CG2-CB 4.45Å; V6-F74 HydrophobicContact CG2-CD1 3.6Å; V6-F74 HydrophobicContact CG2-CE1 4.34Å; V6-T75 PolarHBondContact N-O 2.72Å; V6-L76 HydrophobicContact CB-CD2 3.78Å; V6-L76 HydrophobicContact CG1-CD2 4.04Å; V6-L76 HydrophobicContact CG2-CD2 4.31Å; V6-V77 PolarHBondContact O-N 3.19Å; V6-I98 WeakPolarHBondContact CA-O 3.45Å; V6-I98 HydrophobicContact CB-CG2 4.29Å; V6-I98 HydrophobicContact CG1-CG2 4.21Å; V6-I98 HydrophobicContact CG2-CG2 3.8Å; V6-V100 HydrophobicContact CG1-CB 4.21Å; V6-V100 HydrophobicContact CG1-CG2 3.42Å; V6-V100 VanDerWaalsContact CG1-CG2 3.42Å; V6-L200 HydrophobicContact CG1-CD1 4.37Å; V6-L200 HydrophobicContact CG2-CD2 4.37Å
7	G	93.9	Very high	91.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	122.2	174.6	0	0	0	0	0	110.7	I98 V100	G7-I98 PolarHBondContact N-O 3.5Å; G7-V100 PolarHBondContact O-N 3.41Å
8	V	94.1	Very high	91	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.012	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	101.5	172.4	-170	0	0	0	0	107.9	K16 L19 L76 V77 C79 V102	V8-K16 HydrophobicContact CG1-CB 3.78Å; V8-K16 HydrophobicContact CG1-CG 4.1Å; V8-L19 HydrophobicContact CG1-CD2 4.38Å; V8-L76 HydrophobicContact CG2-CB 4.43Å; V8-L76 HydrophobicContact CG2-CD2 4.38Å; V8-V77 PolarHBondContact N-O 3.5Å; V8-C79 WeakPolarHBondContact O-CB 3.49Å; V8-C79 PolarHBondContact O-N 3.3Å; V8-C79 VanDerWaalsContact O-N 3.13Å; V8-V102 HydrophobicContact CG1-CG2 3.63Å
9	L	93.7	Very high	90.9	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	160.8	-176.3	-71.3	96.3	0	0	0	111.4	C79 V89 I96 V99 V100 V102 C116 I119	L9-C79 HydrophobicContact CG-CB 4.25Å; L9-V89 HydrophobicContact CD2-CG1 3.53Å; L9-V89 HydrophobicContact CG-CG1 4.37Å; L9-I96 HydrophobicContact CD1-CD1 4.36Å; L9-V99 HydrophobicContact CB-CG1 4.27Å; L9-V99 HydrophobicContact CD1-CB 4.26Å; L9-V99 HydrophobicContact CD1-CG1 3.63Å; L9-V99 HydrophobicContact CD1-CG2 3.79Å; L9-V99 HydrophobicContact CG-CG1 4.47Å; L9-V100 PolarHBondContact N-O 2.89Å; L9-V102 PolarHBondContact O-N 3.3Å; L9-C116 HydrophobicContact CB-CB 3.9Å; L9-C116 HydrophobicContact CD2-CB 4.02Å; L9-I119 HydrophobicContact CD2-CB 4.37Å; L9-I119 HydrophobicContact CD2-CG2 4.1Å
10	G	92.1	Very high	90.8	Very high	1 Å²	1	17 Å²	17	1%	0.01	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.4	173.1	-179.4	0	0	0	0	0	113.6	K16	G10-K16 PolarHBondContact O-NZ 3.37Å
11	H	89.7	Confident	90.5	Very high	30 Å²	30	18.3 Å²	18.3	14%	0.139	10%	0.1	C	C	.	.	S	Bend	trans	-62	167.1	-177.8	-169.4	73.7	0	0	0	113.6	S14 K16 Q110 Q112	H11-S14 PolarHBondContact O-N 2.97Å; H11-S14 PolarHBondContact O-OG 3.31Å; H11-S14 VanDerWaalsContact O-OG 3.08Å; H11-K16 PolarHBondContact O-NZ 3.12Å; H11-Q110 HydrophobicContact CB-CB 4.22Å; H11-Q110 PolarHBondContact CD2-NE2 3.27Å; H11-Q110 PolarHBondContact CD2-OE1 3.1Å; H11-Q110 VanDerWaalsContact CG-OE1 3.26Å; H11-Q110 PolarHBondContact NE2-NE2 3.21Å; H11-Q110 VanDerWaalsContact NE2-NE2 3.12Å; H11-Q112 PolarHBondContact CE1-OE1 3.43Å; H11-Q112 PolarHBondContact ND1-OE1 2.71Å
12	V	86.3	Confident	90.5	Very high	27 Å²	27	15.7 Å²	15.7	16%	0.164	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	139.2	169.1	-174.4	0	0	0	0	109.2	S14 G81 H82	V12-S14 PolarHBondContact O-N 3.13Å; V12-G81 VanDerWaalsContact CG2-C 3.47Å; V12-G81 WeakPolarHBondContact CG2-O 3.32Å; V12-H82 HydrophobicContact CG2-CB 4.33Å
13	D	86.6	Confident	90.1	Very high	102 Å²	102	15.6 Å²	15.6	55%	0.545	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	17.6	179.3	-53.5	-26.9	0	0	0	116.3	G15 K133	D13-G15 PolarHBondContact O-N 3.17Å; D13-K133 WeakPolarHBondContact O-CE 3.29Å; D13-K133 PolarHBondContact O-NZ 3.26Å
14	S	91	Very high	89.6	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.007	9%	0.092	C	C	.	.	S	Bend	trans	-70.8	-11.1	170.3	66.9	0	0	0	0	112.9	H11 V12 V102 N132	H11-S14 PolarHBondContact O-N 2.97Å; H11-S14 PolarHBondContact O-OG 3.31Å; H11-S14 VanDerWaalsContact O-OG 3.08Å; V12-S14 PolarHBondContact O-N 3.13Å; S14-V102 WeakPolarHBondContact CB-O 3.46Å; S14-V102 WeakPolarHBondContact O-CG1 3.16Å; S14-V102 PolarHBondContact OG-O 3.49Å; S14-N132 PolarHBondContact O-ND2 3.25Å
15	G	89.4	Confident	88.6	Confident	14 Å²	14	19.1 Å²	19.1	14%	0.144	11%	0.111	C	C	.	.			trans	91.2	27.3	177.6	0	0	0	0	0	115.1	D13 T17 S18 L19	D13-G15 PolarHBondContact O-N 3.17Å; G15-T17 PolarHBondContact O-N 2.9Å; G15-S18 PolarHBondContact O-N 3.31Å; G15-L19 WeakPolarHBondContact O-CB 3.39Å; G15-L19 PolarHBondContact O-N 3.03Å
16	K	91.3	Very high	87.2	Confident	10 Å²	10	21.5 Å²	21.5	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-50.6	-53.1	175.3	-61.3	-179.8	-61.6	-59.7	0	113.1	V8 G10 H11 S18 L19 A20 D78 C79 V102	V8-K16 HydrophobicContact CG1-CB 3.78Å; V8-K16 HydrophobicContact CG1-CG 4.1Å; G10-K16 PolarHBondContact O-NZ 3.37Å; H11-K16 PolarHBondContact O-NZ 3.12Å; K16-S18 PolarHBondContact O-N 3.5Å; K16-L19 WeakPolarHBondContact O-CB 3.24Å; K16-L19 PolarHBondContact O-N 2.91Å; K16-A20 PolarHBondContact O-N 3.21Å; K16-D78 WeakPolarHBondContact CB-OD1 3.46Å; K16-C79 WeakPolarHBondContact CE-O 3.33Å; K16-V102 HydrophobicContact CG-CB 4.15Å; K16-V102 HydrophobicContact CG-CG2 4.17Å
17	T	87	Confident	85.7	Confident	18 Å²	18	21.7 Å²	21.7	11%	0.11	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-37.6	-179.9	-47	0	0	0	0	112.3	G15 A20 K21 T44 D78	G15-T17 PolarHBondContact O-N 2.9Å; T17-A20 PolarHBondContact O-N 3.43Å; T17-K21 VanDerWaalsContact O-CG 3.31Å; T17-K21 WeakPolarHBondContact O-CG 3.42Å; T17-K21 PolarHBondContact O-N 3.12Å; T17-T44 PolarHBondContact OG1-OG1 2.96Å; T17-T44 VanDerWaalsContact OG1-OG1 3.1Å; T17-D78 VanDerWaalsContact CA-OD2 3.25Å; T17-D78 WeakPolarHBondContact CA-OD2 3.38Å; T17-D78 VanDerWaalsContact CB-OD2 3.26Å; T17-D78 WeakPolarHBondContact CB-OD2 3.46Å; T17-D78 WeakPolarHBondContact CG2-OD2 3.35Å; T17-D78 PolarHBondContact OG1-OD2 3.23Å
18	S	87.8	Confident	84.3	Confident	35 Å²	35	23.8 Å²	23.8	25%	0.245	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-43.2	173.9	-55.5	0	0	0	0	111.3	G15 K16 K21 V22	G15-S18 PolarHBondContact O-N 3.31Å; K16-S18 PolarHBondContact O-N 3.5Å; S18-K21 WeakPolarHBondContact O-CB 3.31Å; S18-K21 PolarHBondContact O-N 3.03Å; S18-V22 WeakPolarHBondContact O-CG2 3.44Å; S18-V22 PolarHBondContact O-N 2.81Å
19	L	89.3	Confident	82.6	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-46.3	175.2	-175.3	67.2	0	0	0	111.2	V8 G15 K16 K21 V22 L23 V100 V102 V130 I170 A172 L196	V8-L19 HydrophobicContact CG1-CD2 4.38Å; G15-L19 WeakPolarHBondContact O-CB 3.39Å; G15-L19 PolarHBondContact O-N 3.03Å; K16-L19 WeakPolarHBondContact O-CB 3.24Å; K16-L19 PolarHBondContact O-N 2.91Å; L19-K21 VanDerWaalsContact C-N 3.31Å; L19-K21 PolarHBondContact O-N 3.41Å; L19-V22 PolarHBondContact O-N 3.39Å; L19-L23 HydrophobicContact CD1-CD1 4.46Å; L19-L23 HydrophobicContact CG-CD1 4.18Å; L19-L23 PolarHBondContact O-N 3.42Å; L19-V100 HydrophobicContact CD2-CG1 4.06Å; L19-V102 HydrophobicContact CD2-CG1 4.49Å; L19-V102 HydrophobicContact CD2-CG2 3.48Å; L19-V102 VanDerWaalsContact CD2-CG2 3.48Å; L19-V130 HydrophobicContact CD1-CG1 4.33Å; L19-V130 HydrophobicContact CD2-CB 4.38Å; L19-V130 HydrophobicContact CD2-CG1 4.05Å; L19-V130 HydrophobicContact CD2-CG2 4.38Å; L19-I170 HydrophobicContact CD1-CD1 3.84Å; L19-I170 HydrophobicContact CD1-CG2 3.89Å; L19-A172 HydrophobicContact CB-CB 4.37Å; L19-A172 HydrophobicContact CD1-CB 4.4Å; L19-L196 HydrophobicContact CD1-CD2 3.66Å
20	A	88.8	Confident	81	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-40.5	177.5	0	0	0	0	0	111.8	K16 T17 S24 L76	K16-A20 PolarHBondContact O-N 3.21Å; T17-A20 PolarHBondContact O-N 3.43Å; A20-S24 WeakPolarHBondContact O-CB 3.47Å; A20-S24 PolarHBondContact O-N 3.12Å; A20-S24 PolarHBondContact O-OG 3.43Å; A20-L76 HydrophobicContact CB-CD1 4.07Å
21	K	84.9	Confident	79.3	Confident	45 Å²	45	26.8 Å²	26.8	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-48	174.7	-77.5	174.5	173.3	-173	0	112.5	T17 S18 L19 L23 S24 F32 V179	T17-K21 VanDerWaalsContact O-CG 3.31Å; T17-K21 WeakPolarHBondContact O-CG 3.42Å; T17-K21 PolarHBondContact O-N 3.12Å; S18-K21 WeakPolarHBondContact O-CB 3.31Å; S18-K21 PolarHBondContact O-N 3.03Å; L19-K21 VanDerWaalsContact C-N 3.31Å; L19-K21 PolarHBondContact O-N 3.41Å; K21-L23 VanDerWaalsContact C-N 3.31Å; K21-L23 PolarHBondContact O-N 2.9Å; K21-S24 PolarHBondContact O-N 3.45Å; K21-F32 HydrophobicContact CB-CD1 4.35Å; K21-F32 HydrophobicContact CB-CE1 4.17Å; K21-F32 HydrophobicContact CD-CD1 4.28Å; K21-F32 HydrophobicContact CD-CG 4.47Å; K21-F32 HydrophobicContact CG-CB 4.32Å; K21-F32 HydrophobicContact CG-CD1 3.24Å; K21-F32 HydrophobicContact CG-CD2 4.39Å; K21-F32 HydrophobicContact CG-CE1 3.51Å; K21-F32 HydrophobicContact CG-CG 3.74Å; K21-F32 HydrophobicContact CG-CZ 4.19Å; K21-V179 HydrophobicContact CD-CB 4.46Å; K21-V179 WeakPolarHBondContact CD-O 3.42Å; K21-V179 PolarHBondContact NZ-O 2.64Å
22	V	85.4	Confident	78.2	Confident	28 Å²	28	26.1 Å²	26.1	17%	0.17	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-37.7	-178.1	168.7	0	0	0	0	111.9	S18 L19 A172 V193	S18-V22 WeakPolarHBondContact O-CG2 3.44Å; S18-V22 PolarHBondContact O-N 2.81Å; L19-V22 PolarHBondContact O-N 3.39Å; V22-A172 HydrophobicContact CG2-CB 4.31Å; V22-A172 WeakPolarHBondContact CG2-O 3.45Å; V22-V193 HydrophobicContact CG1-CG1 4.47Å; V22-V193 HydrophobicContact CG1-CG2 3.29Å
23	L	85.7	Confident	76.9	Confident	7 Å²	7	26.3 Å²	26.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-74.7	-35.6	178	-75.2	171	0	0	0	113	L19 K21 F52 L76 V193 L196 I197	L19-L23 HydrophobicContact CD1-CD1 4.46Å; L19-L23 HydrophobicContact CG-CD1 4.18Å; L19-L23 PolarHBondContact O-N 3.42Å; K21-L23 VanDerWaalsContact C-N 3.31Å; K21-L23 PolarHBondContact O-N 2.9Å; L23-F52 HydrophobicContact CB-CD1 3.99Å; L23-F52 HydrophobicContact CB-CE1 3.87Å; L23-F52 HydrophobicContact CD1-CE1 4.43Å; L23-F52 HydrophobicContact CD2-CE1 4.4Å; L23-F52 HydrophobicContact CD2-CZ 4.36Å; L23-F52 HydrophobicContact CG-CE1 4.48Å; L23-F52 WeakPolarHBondContact O-CB 3.35Å; L23-F52 WeakPolarHBondContact O-CD1 3.44Å; L23-F52 VanDerWaalsContact O-CG 3.31Å; L23-F52 WeakPolarHBondContact O-CG 3.33Å; L23-L76 HydrophobicContact CB-CD1 3.78Å; L23-L76 HydrophobicContact CD1-CD1 4.14Å; L23-V193 HydrophobicContact CD2-CG1 4.15Å; L23-L196 HydrophobicContact CD1-CD2 4.05Å; L23-L196 HydrophobicContact CD2-CD2 3.97Å; L23-L196 HydrophobicContact CD2-CG 4.39Å; L23-L196 HydrophobicContact CG-CD2 4.26Å; L23-I197 HydrophobicContact CD2-CD1 4.33Å; L23-I197 HydrophobicContact CD2-CG1 3.82Å
24	S	82.6	Confident	75.6	Confident	12 Å²	12	27.6 Å²	27.6	8%	0.084	16%	0.157	C	C	.	.			trans	-75.9	142.3	-167.3	-67.2	0	0	0	0	114.1	A20 K21 S50 F181	A20-S24 WeakPolarHBondContact O-CB 3.47Å; A20-S24 PolarHBondContact O-N 3.12Å; A20-S24 PolarHBondContact O-OG 3.43Å; K21-S24 PolarHBondContact O-N 3.45Å; S24-S50 WeakPolarHBondContact OG-CB 3.46Å; S24-S50 PolarHBondContact OG-OG 3.45Å; S24-F181 WeakPolarHBondContact O-CE2 3.38Å
25	T	72.3	Confident	74.1	Confident	65 Å²	65	31.2 Å²	31.2	40%	0.399	18%	0.176	S	C	.	.	S	Bend	trans	-106.5	-21.4	167.2	60.3	0	0	0	0	112.3	S51 F52 F181	T25-S51 PolarHBondContact N-O 3.41Å; T25-F52 HydrophobicContact CG2-CB 4.11Å; T25-F181 WeakPolarHBondContact O-CZ 3.38Å
26	I	65.4	Low	72.2	Confident	51 Å²	51	34.8 Å²	34.8	26%	0.262	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.9	-178.5	-58.1	173.5	0	0	0	110.1	S50 S51 F268	I26-S50 CarbonylContact O-C 3.51Å; I26-S50 WeakPolarHBondContact O-CA 3.49Å; I26-S51 PolarHBondContact N-O 3.25Å; I26-S51 PolarHBondContact O-N 3.48Å; I26-F268 HydrophobicContact CG2-CB 4.26Å; I26-F268 HydrophobicContact CG2-CD1 4.23Å
27	A	61.5	Low	70.7	Confident	6 Å²	6	40.1 Å²	40.1	5%	0.05	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.9	172.2	0	0	0	0	0	111.8	A31 F32	A27-A31 HydrophobicContact CB-CB 4.08Å; A27-F32 HydrophobicContact CB-CD2 4.08Å; A27-F32 HydrophobicContact CB-CE2 3.56Å; A27-F32 HydrophobicContact CB-CZ 4.41Å
28	S	65.3	Low	69.4	Low	44 Å²	44	39.6 Å²	39.6	31%	0.308	22%	0.219	S	C	.	.			trans	-114.8	-147.4	173.3	-169.1	0	0	0	0	110.7	F49	S28-F49 CarbonylContact C-O 3.49Å; S28-F49 WeakPolarHBondContact CA-O 3.21Å; S28-F49 VanDerWaalsContact CB-O 3.24Å; S28-F49 WeakPolarHBondContact CB-O 3.28Å; S28-F49 PolarHBondContact N-O 2.96Å
29	T	59.2	Low	67.9	Low	24 Å²	24	44.6 Å²	44.6	15%	0.147	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	137.9	-177.1	-38.5	0	0	0	0	112.2	A31 F49 H225 T237	T29-A31 PolarHBondContact O-N 3.39Å; T29-F49 PolarHBondContact O-N 2.96Å; T29-H225 HydrophobicContact CG2-CB 4Å; T29-T237 PolarHBondContact OG1-OG1 2.93Å
30	S	59.8	Low	66.2	Low	40 Å²	40	53.7 Å²	53.7	28%	0.28	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	13.4	176.4	-62.2	0	0	0	0	115.7	L47 G48 H225	S30-L47 WeakPolarHBondContact CB-O 3.48Å; S30-G48 WeakPolarHBondContact O-CA 3.08Å; S30-H225 PolarHBondContact OG-NE2 2.8Å
31	A	55.7	Low	64.6	Low	2 Å²	2	62 Å²	62	2%	0.017	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-61.6	143.2	-179.7	0	0	0	0	0	111.3	A27 T29 D33 K34 F49	A27-A31 HydrophobicContact CB-CB 4.08Å; T29-A31 PolarHBondContact O-N 3.39Å; A31-D33 VanDerWaalsContact C-N 3.27Å; A31-D33 PolarHBondContact O-N 2.91Å; A31-K34 WeakPolarHBondContact O-CG 3.26Å; A31-K34 PolarHBondContact O-N 2.93Å; A31-F49 VanDerWaalsContact CB-O 3.24Å; A31-F49 WeakPolarHBondContact CB-O 3.21Å
32	F	66.4	Low	63.4	Low	17 Å²	17	62.5 Å²	62.5	8%	0.075	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	60.9	34.1	165.1	-46.6	-37.8	0	0	0	114.1	K21 A27 K34 F181	K21-F32 HydrophobicContact CB-CD1 4.35Å; K21-F32 HydrophobicContact CB-CE1 4.17Å; K21-F32 HydrophobicContact CD-CD1 4.28Å; K21-F32 HydrophobicContact CD-CG 4.47Å; K21-F32 HydrophobicContact CG-CB 4.32Å; K21-F32 HydrophobicContact CG-CD1 3.24Å; K21-F32 HydrophobicContact CG-CD2 4.39Å; K21-F32 HydrophobicContact CG-CE1 3.51Å; K21-F32 HydrophobicContact CG-CG 3.74Å; K21-F32 HydrophobicContact CG-CZ 4.19Å; A27-F32 HydrophobicContact CB-CD2 4.08Å; A27-F32 HydrophobicContact CB-CE2 3.56Å; A27-F32 HydrophobicContact CB-CZ 4.41Å; F32-K34 PolarHBondContact O-N 2.81Å; F32-K34 VanDerWaalsContact O-N 3.14Å; F32-F181 HydrophobicContact CD2-CB 4.38Å; F32-F181 HydrophobicContact CD2-CD2 4.21Å; F32-F181 HydrophobicContact CD2-CG 4.28Å; F32-F181 HydrophobicContact CE2-CB 4.34Å; F32-F181 HydrophobicContact CE2-CD1 4.4Å; F32-F181 AromaticContact CE2-CD2 3.39Å; F32-F181 HydrophobicContact CE2-CD2 3.39Å; F32-F181 AromaticContact CE2-CE2 3.65Å; F32-F181 HydrophobicContact CE2-CE2 3.65Å; F32-F181 AromaticContact CE2-CG 3.79Å; F32-F181 HydrophobicContact CE2-CG 3.79Å; F32-F181 HydrophobicContact CE2-CZ 4.25Å; F32-F181 AromaticContact CZ-CD2 3.78Å; F32-F181 HydrophobicContact CZ-CD2 3.78Å; F32-F181 AromaticContact CZ-CE2 3.82Å; F32-F181 HydrophobicContact CZ-CE2 3.82Å
33	D	59.8	Low	62.2	Low	31 Å²	31	62.9 Å²	62.9	17%	0.166	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	52.9	36.9	177.6	-59.7	-33.6	0	0	0	113.3	A31 N35 K39 T44	A31-D33 VanDerWaalsContact C-N 3.27Å; A31-D33 PolarHBondContact O-N 2.91Å; D33-N35 PolarHBondContact O-N 2.9Å; D33-K39 WeakPolarHBondContact O-CG 3.41Å; D33-T44 WeakPolarHBondContact OD1-CA 3.11Å; D33-T44 WeakPolarHBondContact OD1-CB 3.04Å; D33-T44 PolarHBondContact OD1-OG1 2.58Å; D33-T44 PolarHBondContact OD2-OG1 3.45Å
34	K	58	Low	61.1	Low	129 Å²	129	63 Å²	63	56%	0.561	33%	0.327	S	S	*	.			trans	-61.2	-26.1	-179.8	-82.5	-176.8	179.1	-176.2	0	113.8	A31 F32	A31-K34 WeakPolarHBondContact O-CG 3.26Å; A31-K34 PolarHBondContact O-N 2.93Å; F32-K34 PolarHBondContact O-N 2.81Å; F32-K34 VanDerWaalsContact O-N 3.14Å
35	N	61.4	Low	60.4	Low	76 Å²	76	63.9 Å²	63.9	41%	0.406	33%	0.33	S	S	.	.	S	Bend	trans	-63.6	128.6	179.4	-172.5	-25.3	0	0	0	110.4	D33 Q37 S38 K39	D33-N35 PolarHBondContact O-N 2.9Å; N35-Q37 PolarHBondContact O-N 2.81Å; N35-Q37 VanDerWaalsContact O-N 3.11Å; N35-Q37 PolarHBondContact OD1-N 3.23Å; N35-Q37 VanDerWaalsContact OD1-N 3.13Å; N35-S38 WeakPolarHBondContact O-CB 3.18Å; N35-S38 PolarHBondContact O-N 3.45Å; N35-K39 PolarHBondContact O-N 3.18Å
36	P	48.6	Very low	60.6	Low	89 Å²	89	62.7 Å²	62.7	58%	0.578	32%	0.321	S	S	*	.	H	α-helix	trans	-55.2	-29.5	179.9	18.4	-32	0	0	0	113.9	K40	P36-K40 WeakPolarHBondContact O-CB 3.33Å; P36-K40 WeakPolarHBondContact O-CG 3.48Å; P36-K40 PolarHBondContact O-N 3.29Å
37	Q	60.3	Low	61.3	Low	122 Å²	122	60.3 Å²	60.3	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-67.5	-42.5	174.1	-70.5	-170.7	-3.9	0	0	112.5	N35 K40 R41 L45	N35-Q37 PolarHBondContact O-N 2.81Å; N35-Q37 VanDerWaalsContact O-N 3.11Å; N35-Q37 PolarHBondContact OD1-N 3.23Å; N35-Q37 VanDerWaalsContact OD1-N 3.13Å; Q37-K40 PolarHBondContact O-N 2.97Å; Q37-R41 PolarHBondContact O-N 3.14Å; Q37-R41 VanDerWaalsContact O-N 3.13Å; Q37-L45 HydrophobicContact CB-CD1 3.65Å
38	S	59.5	Low	62.3	Low	7 Å²	7	60 Å²	60	5%	0.049	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-44.5	176	-53.9	0	0	0	0	110.7	N35 K40 R41 G42 I43	N35-S38 WeakPolarHBondContact O-CB 3.18Å; N35-S38 PolarHBondContact O-N 3.45Å; S38-K40 PolarHBondContact O-N 2.9Å; S38-R41 PolarHBondContact O-N 3.21Å; S38-G42 PolarHBondContact O-N 2.96Å; S38-I43 WeakPolarHBondContact CA-O 3.49Å; S38-I43 WeakPolarHBondContact CB-O 3.03Å; S38-I43 PolarHBondContact O-N 3.43Å
39	K	56.8	Low	63.3	Low	140 Å²	140	58 Å²	58	61%	0.609	29%	0.293	S	S	*	.	H	α-helix	trans	-60.4	-45.6	175.9	-65.4	-166.3	178.3	-177.6	0	112.8	D33 N35 R41 G42	D33-K39 WeakPolarHBondContact O-CG 3.41Å; N35-K39 PolarHBondContact O-N 3.18Å; K39-R41 VanDerWaalsContact C-N 3.28Å; K39-R41 PolarHBondContact O-N 3.45Å; K39-G42 PolarHBondContact O-N 2.98Å
40	K	53.4	Low	64.7	Low	192 Å²	192	56.9 Å²	56.9	84%	0.835	29%	0.286	S	S	*	.	H	α-helix	trans	-62	-37	179.3	-84.9	-174.7	177.9	-176	0	112.5	P36 Q37 S38	P36-K40 WeakPolarHBondContact O-CB 3.33Å; P36-K40 WeakPolarHBondContact O-CG 3.48Å; P36-K40 PolarHBondContact O-N 3.29Å; Q37-K40 PolarHBondContact O-N 2.97Å; S38-K40 PolarHBondContact O-N 2.9Å
41	R	54.1	Low	66.2	Low	176 Å²	176	55 Å²	55	66%	0.664	27%	0.273	S	S	*	.	H	α-helix	trans	-88.4	-10.4	-179.3	-66.8	-174.5	171	-180	-0.7	113.3	Q37 S38 K39 I43	Q37-R41 PolarHBondContact O-N 3.14Å; Q37-R41 VanDerWaalsContact O-N 3.13Å; S38-R41 PolarHBondContact O-N 3.21Å; K39-R41 VanDerWaalsContact C-N 3.28Å; K39-R41 PolarHBondContact O-N 3.45Å; R41-I43 HydrophobicContact CB-CD1 4.25Å; R41-I43 HydrophobicContact CB-CG1 3.74Å; R41-I43 PolarHBondContact O-N 3.33Å
42	G	60.1	Low	67.8	Low	54 Å²	54	54.9 Å²	54.9	56%	0.557	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	21.5	-175.6	0	0	0	0	0	113.7	S38 K39	S38-G42 PolarHBondContact O-N 2.96Å; K39-G42 PolarHBondContact O-N 2.98Å
43	I	59.4	Low	69	Low	37 Å²	37	56.1 Å²	56.1	19%	0.19	28%	0.281	C	S	.	.	S	Bend	trans	-136.5	145.9	-177.3	63.6	177.4	0	0	0	111	S38 R41 L45 H82	S38-I43 WeakPolarHBondContact CA-O 3.49Å; S38-I43 WeakPolarHBondContact CB-O 3.03Å; S38-I43 PolarHBondContact O-N 3.43Å; R41-I43 HydrophobicContact CB-CD1 4.25Å; R41-I43 HydrophobicContact CB-CG1 3.74Å; R41-I43 PolarHBondContact O-N 3.33Å; I43-L45 HydrophobicContact CD1-CD2 3.95Å; I43-L45 HydrophobicContact CG1-CD2 3.92Å; I43-L45 PolarHBondContact O-N 2.84Å; I43-H82 HydrophobicContact CD1-CB 4.36Å
44	T	62.7	Low	70.5	Confident	10 Å²	10	55 Å²	55	6%	0.061	28%	0.276	C	S	.	.			trans	-66.1	120.4	168.4	-47.5	0	0	0	0	110	T17 D33 D46 P80 L85	T17-T44 PolarHBondContact OG1-OG1 2.96Å; T17-T44 VanDerWaalsContact OG1-OG1 3.1Å; D33-T44 WeakPolarHBondContact OD1-CA 3.11Å; D33-T44 WeakPolarHBondContact OD1-CB 3.04Å; D33-T44 PolarHBondContact OD1-OG1 2.58Å; D33-T44 PolarHBondContact OD2-OG1 3.45Å; T44-D46 WeakPolarHBondContact CG2-O 3.26Å; T44-P80 WeakPolarHBondContact O-CB 3.5Å; T44-L85 VanDerWaalsContact O-CD1 3.26Å; T44-L85 WeakPolarHBondContact O-CD1 3.31Å
45	L	68	Low	72.1	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.152	27%	0.272	C	S	.	.			trans	-97.9	-25.8	-178.7	-66.1	176.3	0	0	0	113	Q37 I43 L85	Q37-L45 HydrophobicContact CB-CD1 3.65Å; I43-L45 HydrophobicContact CD1-CD2 3.95Å; I43-L45 HydrophobicContact CG1-CD2 3.92Å; I43-L45 PolarHBondContact O-N 2.84Å; L45-L85 HydrophobicContact CD2-CD1 4.2Å
46	D	77.1	Confident	73.4	Confident	40 Å²	40	49.9 Å²	49.9	21%	0.214	25%	0.254	C	S	.	.	S	Bend	trans	-136	166.7	-175.7	-152.7	-12.3	0	0	0	111	T44 G48 H225 R295	T44-D46 WeakPolarHBondContact CG2-O 3.26Å; D46-G48 PolarHBondContact O-N 3.07Å; D46-G48 VanDerWaalsContact O-N 3.13Å; D46-H225 IonicContact OD2-NE2 3.49Å; D46-R295 IonicContact OD1-CZ 2.89Å; D46-R295 IonicContact OD1-NH1 3.85Å; D46-R295 IonicContact OD1-NH2 3.41Å; D46-R295 PolarHBondContact OD1-NH2 2.69Å; D46-R295 IonicContact OD2-CZ 3.68Å; D46-R295 IonicContact OD2-NH2 3.95Å; D46-R295 PolarHBondContact OD2-NH2 3.11Å
47	L	80.7	Confident	75.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.262	C	S	.	.			trans	-61.4	114.4	173.7	-62	176.2	0	0	0	109.8	S30 F49 V77 D78 C79 T88	S30-L47 WeakPolarHBondContact CB-O 3.48Å; L47-F49 HydrophobicContact CB-CD2 4.44Å; L47-F49 HydrophobicContact CB-CE2 3.59Å; L47-F49 HydrophobicContact CB-CZ 3.77Å; L47-F49 HydrophobicContact CD1-CZ 4.16Å; L47-F49 WeakPolarHBondContact O-CD2 3.29Å; L47-F49 WeakPolarHBondContact O-CE2 3.39Å; L47-V77 HydrophobicContact CB-CG1 4.47Å; L47-V77 HydrophobicContact CD2-CG1 4.05Å; L47-D78 WeakPolarHBondContact CA-O 3.48Å; L47-C79 HydrophobicContact CD2-CB 4.49Å; L47-T88 HydrophobicContact CD2-CG2 3.95Å; L47-T88 HydrophobicContact CG-CG2 3.73Å
48	G	82	Confident	76.5	Confident	1 Å²	1	47 Å²	47	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	129.9	173.7	0	0	0	0	0	110.5	S30 D46 D78	S30-G48 WeakPolarHBondContact O-CA 3.08Å; D46-G48 PolarHBondContact O-N 3.07Å; D46-G48 VanDerWaalsContact O-N 3.13Å; G48-D78 PolarHBondContact N-O 3.43Å; G48-D78 PolarHBondContact O-N 3.3Å
49	F	85.7	Confident	78	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.9	-179.2	-64.2	-87.5	0	0	0	111.8	S28 T29 A31 L47 T75 L76 V77 I95 D224 R280	S28-F49 CarbonylContact C-O 3.49Å; S28-F49 WeakPolarHBondContact CA-O 3.21Å; S28-F49 VanDerWaalsContact CB-O 3.24Å; S28-F49 WeakPolarHBondContact CB-O 3.28Å; S28-F49 PolarHBondContact N-O 2.96Å; T29-F49 PolarHBondContact O-N 2.96Å; A31-F49 VanDerWaalsContact CB-O 3.24Å; A31-F49 WeakPolarHBondContact CB-O 3.21Å; L47-F49 HydrophobicContact CB-CD2 4.44Å; L47-F49 HydrophobicContact CB-CE2 3.59Å; L47-F49 HydrophobicContact CB-CZ 3.77Å; L47-F49 HydrophobicContact CD1-CZ 4.16Å; L47-F49 WeakPolarHBondContact O-CD2 3.29Å; L47-F49 WeakPolarHBondContact O-CE2 3.39Å; F49-T75 HydrophobicContact CD1-CG2 4.38Å; F49-L76 WeakPolarHBondContact CA-O 3.49Å; F49-V77 HydrophobicContact CD1-CG1 4.46Å; F49-V77 HydrophobicContact CD1-CG2 4.06Å; F49-V77 HydrophobicContact CE1-CB 4.32Å; F49-V77 HydrophobicContact CE1-CG1 3.85Å; F49-V77 HydrophobicContact CE1-CG2 3.82Å; F49-V77 HydrophobicContact CZ-CG1 4.29Å; F49-I95 HydrophobicContact CE1-CD1 3.77Å; F49-I95 HydrophobicContact CZ-CD1 4.09Å; F49-D224 HydrophobicContact CE2-CB 4.35Å; F49-D224 WeakPolarHBondContact CE2-OD2 3.38Å; F49-D224 HydrophobicContact CZ-CB 4.44Å; F49-D224 WeakPolarHBondContact CZ-OD2 3.5Å; F49-R280 VanDerWaalsContact CD2-CZ 3.46Å
50	S	88.9	Confident	79.7	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	170.1	175.7	54.3	0	0	0	0	109.9	S24 I26 T75 L76	S24-S50 WeakPolarHBondContact OG-CB 3.46Å; S24-S50 PolarHBondContact OG-OG 3.45Å; I26-S50 CarbonylContact O-C 3.51Å; I26-S50 WeakPolarHBondContact O-CA 3.49Å; S50-T75 CarbonylContact O-C 3.38Å; S50-T75 WeakPolarHBondContact O-CA 3.48Å; S50-L76 PolarHBondContact N-O 2.77Å; S50-L76 PolarHBondContact O-N 3.24Å
51	S	90.9	Very high	81.5	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.7	-179.8	64.6	0	0	0	0	113.4	T25 I26 F74 F268	T25-S51 PolarHBondContact N-O 3.41Å; I26-S51 PolarHBondContact N-O 3.25Å; I26-S51 PolarHBondContact O-N 3.48Å; S51-F74 CarbonylContact C-O 3.51Å; S51-F74 WeakPolarHBondContact CA-O 3.34Å; S51-F74 WeakPolarHBondContact CB-O 3.2Å; S51-F268 VanDerWaalsContact CB-CE1 3.42Å; S51-F268 WeakPolarHBondContact OG-CD1 3.41Å; S51-F268 VanDerWaalsContact OG-CE1 3.23Å; S51-F268 WeakPolarHBondContact OG-CE1 3.44Å
52	F	91	Very high	83.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.4	164.1	63.9	-83.5	0	0	0	109.8	L23 T25 V54 F74 L76 I197 L200	L23-F52 HydrophobicContact CB-CD1 3.99Å; L23-F52 HydrophobicContact CB-CE1 3.87Å; L23-F52 HydrophobicContact CD1-CE1 4.43Å; L23-F52 HydrophobicContact CD2-CE1 4.4Å; L23-F52 HydrophobicContact CD2-CZ 4.36Å; L23-F52 HydrophobicContact CG-CE1 4.48Å; L23-F52 WeakPolarHBondContact O-CB 3.35Å; L23-F52 WeakPolarHBondContact O-CD1 3.44Å; L23-F52 VanDerWaalsContact O-CG 3.31Å; L23-F52 WeakPolarHBondContact O-CG 3.33Å; T25-F52 HydrophobicContact CG2-CB 4.11Å; F52-V54 HydrophobicContact CD2-CG1 4.05Å; F52-V54 HydrophobicContact CE2-CG1 4.14Å; F52-F74 HydrophobicContact CD1-CB 3.95Å; F52-F74 HydrophobicContact CD2-CB 4.34Å; F52-F74 AromaticContact CD2-CD2 4Å; F52-F74 HydrophobicContact CD2-CD2 4Å; F52-F74 HydrophobicContact CE1-CB 3.49Å; F52-F74 VanDerWaalsContact CE1-CB 3.49Å; F52-F74 HydrophobicContact CE1-CD2 4.4Å; F52-F74 HydrophobicContact CE1-CG 4.1Å; F52-F74 HydrophobicContact CE2-CB 3.94Å; F52-F74 AromaticContact CE2-CD2 3.3Å; F52-F74 HydrophobicContact CE2-CD2 3.3Å; F52-F74 AromaticContact CE2-CE2 3.96Å; F52-F74 HydrophobicContact CE2-CE2 3.96Å; F52-F74 AromaticContact CE2-CG 3.82Å; F52-F74 HydrophobicContact CE2-CG 3.82Å; F52-F74 HydrophobicContact CG-CB 4.35Å; F52-F74 HydrophobicContact CZ-CB 3.49Å; F52-F74 VanDerWaalsContact CZ-CB 3.49Å; F52-F74 HydrophobicContact CZ-CD1 4.36Å; F52-F74 AromaticContact CZ-CD2 3.54Å; F52-F74 HydrophobicContact CZ-CD2 3.54Å; F52-F74 HydrophobicContact CZ-CE2 4.29Å; F52-F74 AromaticContact CZ-CG 3.55Å; F52-F74 HydrophobicContact CZ-CG 3.55Å; F52-F74 PolarHBondContact N-O 3.12Å; F52-F74 PolarHBondContact O-N 2.9Å; F52-L76 HydrophobicContact CD1-CD1 4.21Å; F52-L76 HydrophobicContact CD1-CG 4.31Å; F52-L76 HydrophobicContact CE1-CD1 4.09Å; F52-L76 HydrophobicContact CE1-CD2 3.91Å; F52-L76 HydrophobicContact CE1-CG 4.08Å; F52-I197 HydrophobicContact CE2-CD1 4.27Å; F52-I197 HydrophobicContact CE2-CG1 4.07Å; F52-I197 HydrophobicContact CE2-CG2 4.34Å; F52-I197 HydrophobicContact CZ-CG1 4.43Å; F52-L200 HydrophobicContact CZ-CD2 4.17Å
53	T	90.2	Very high	84.5	Confident	43 Å²	43	29.8 Å²	29.8	26%	0.264	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.4	-178.4	-54.6	0	0	0	0	109.2	K71 V72	T53-K71 HydrophobicContact CG2-CB 4.02Å; T53-K71 HydrophobicContact CG2-CD 4.33Å; T53-V72 WeakPolarHBondContact CA-O 3.34Å
54	V	91.3	Very high	85.9	Confident	8 Å²	8	30 Å²	30	5%	0.048	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.1	174.8	-61.4	0	0	0	0	110.5	F52 Y59 F61 K71 V72 F74 I197	F52-V54 HydrophobicContact CD2-CG1 4.05Å; F52-V54 HydrophobicContact CE2-CG1 4.14Å; V54-Y59 HydrophobicContact CB-CD2 3.76Å; V54-Y59 HydrophobicContact CB-CE2 3.54Å; V54-Y59 HydrophobicContact CG1-CD2 4.31Å; V54-Y59 HydrophobicContact CG1-CE2 3.73Å; V54-Y59 HydrophobicContact CG2-CD2 3.98Å; V54-Y59 HydrophobicContact CG2-CE2 4.24Å; V54-F61 HydrophobicContact CG2-CE2 3.91Å; V54-F61 HydrophobicContact CG2-CZ 3.8Å; V54-K71 WeakPolarHBondContact O-CA 3.44Å; V54-V72 HydrophobicContact CG2-CB 4.18Å; V54-V72 PolarHBondContact N-O 3.5Å; V54-V72 PolarHBondContact O-N 3.18Å; V54-F74 HydrophobicContact CG2-CD2 4.28Å; V54-F74 HydrophobicContact CG2-CE2 3.73Å; V54-I197 HydrophobicContact CG1-CG2 3.94Å
55	D	91.6	Very high	87.2	Confident	91 Å²	91	29.6 Å²	29.6	49%	0.487	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.3	172.5	-62.2	-41.9	0	0	0	109.4	A57 G58 Y59 K71	D55-A57 PolarHBondContact O-N 2.98Å; D55-G58 PolarHBondContact O-N 2.98Å; D55-G58 VanDerWaalsContact O-N 3.16Å; D55-Y59 WeakPolarHBondContact O-CD2 3.23Å; D55-K71 VanDerWaalsContact OD1-CE 3.22Å; D55-K71 WeakPolarHBondContact OD1-CE 2.97Å
56	S	88.7	Confident	88.1	Confident	5 Å²	5	33.9 Å²	33.9	4%	0.035	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-64	-30.3	-172.6	66.7	0	0	0	0	112.8	G58 F69 E70	S56-G58 VanDerWaalsContact C-N 3.27Å; S56-G58 PolarHBondContact O-N 3.35Å; S56-F69 WeakPolarHBondContact CB-O 3.32Å; S56-F69 PolarHBondContact OG-O 3.28Å; S56-E70 PolarHBondContact N-O 2.61Å; S56-E70 PolarHBondContact OG-O 3.34Å; S56-E70 VanDerWaalsContact OG-O 3.1Å
57	A	87.5	Confident	88.7	Confident	90 Å²	90	39.5 Å²	39.5	74%	0.744	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-66.7	-26.3	178.9	0	0	0	0	0	113.3	D55	D55-A57 PolarHBondContact O-N 2.98Å
58	G	87.3	Confident	89.1	Confident	61 Å²	61	44.8 Å²	44.8	63%	0.629	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-82.5	-11	-176.6	0	0	0	0	0	114.9	D55 S56	D55-G58 PolarHBondContact O-N 2.98Å; D55-G58 VanDerWaalsContact O-N 3.16Å; S56-G58 VanDerWaalsContact C-N 3.27Å; S56-G58 PolarHBondContact O-N 3.35Å
59	Y	90.3	Very high	89.6	Confident	29 Å²	29	46.8 Å²	46.8	11%	0.114	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	156.9	-169.8	-69.2	-79.3	0	0	0	112.5	V54 D55 F61 E194 I197	V54-Y59 HydrophobicContact CB-CD2 3.76Å; V54-Y59 HydrophobicContact CB-CE2 3.54Å; V54-Y59 HydrophobicContact CG1-CD2 4.31Å; V54-Y59 HydrophobicContact CG1-CE2 3.73Å; V54-Y59 HydrophobicContact CG2-CD2 3.98Å; V54-Y59 HydrophobicContact CG2-CE2 4.24Å; D55-Y59 WeakPolarHBondContact O-CD2 3.23Å; Y59-F61 HydrophobicContact CG-CE2 4.43Å; Y59-F61 PolarHBondContact O-N 3.43Å; Y59-E194 WeakPolarHBondContact CE1-OE1 2.96Å; Y59-E194 PolarHBondContact OH-OE1 2.89Å; Y59-E194 PolarHBondContact OH-OE2 3.46Å; Y59-E194 VanDerWaalsContact OH-OE2 3.07Å; Y59-I197 HydrophobicContact CD1-CG2 3.91Å; Y59-I197 HydrophobicContact CE1-CB 4.1Å; Y59-I197 HydrophobicContact CE1-CG2 3.43Å; Y59-I197 VanDerWaalsContact CE1-CG2 3.43Å; Y59-I197 HydrophobicContact CE2-CG2 4.31Å
60	P	92.3	Very high	89.9	Confident	51 Å²	51	53.8 Å²	53.8	33%	0.331	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	53.8	-172.9	35.1	-39.3	0	0	0	113	T198 A201 R202	P60-T198 HydrophobicContact CG-CG2 3.86Å; P60-T198 WeakPolarHBondContact CG-O 3.35Å; P60-A201 HydrophobicContact CG-CB 4.38Å; P60-R202 HydrophobicContact CG-CB 4.06Å
61	F	91.3	Very high	90.1	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.026	32%	0.322	C	S	.	.			trans	-72.9	161.3	171.2	-63.8	-71.2	0	0	0	111.7	V54 Y59 I65 R66 V72 F74 A201 I204	V54-F61 HydrophobicContact CG2-CE2 3.91Å; V54-F61 HydrophobicContact CG2-CZ 3.8Å; Y59-F61 HydrophobicContact CG-CE2 4.43Å; Y59-F61 PolarHBondContact O-N 3.43Å; F61-I65 HydrophobicContact CB-CB 4.12Å; F61-I65 HydrophobicContact CB-CG2 3.99Å; F61-I65 HydrophobicContact CD1-CD1 4.47Å; F61-I65 HydrophobicContact CD1-CG2 4.43Å; F61-I65 HydrophobicContact CG-CG2 4.16Å; F61-R66 HydrophobicContact CB-CG 3.93Å; F61-R66 PolarHBondContact O-NE 3.44Å; F61-V72 HydrophobicContact CD2-CG2 4.21Å; F61-V72 HydrophobicContact CE1-CB 4.31Å; F61-V72 HydrophobicContact CE1-CG1 4.02Å; F61-V72 HydrophobicContact CE1-CG2 4.19Å; F61-V72 HydrophobicContact CE2-CB 4.11Å; F61-V72 HydrophobicContact CE2-CG2 3.82Å; F61-V72 HydrophobicContact CZ-CB 3.76Å; F61-V72 HydrophobicContact CZ-CG1 3.89Å; F61-V72 HydrophobicContact CZ-CG2 3.82Å; F61-F74 HydrophobicContact CE1-CE2 4.36Å; F61-F74 AromaticContact CE1-CZ 3.83Å; F61-F74 HydrophobicContact CE1-CZ 3.83Å; F61-F74 AromaticContact CZ-CE2 3.93Å; F61-F74 HydrophobicContact CZ-CE2 3.93Å; F61-F74 AromaticContact CZ-CZ 3.86Å; F61-F74 HydrophobicContact CZ-CZ 3.86Å; F61-A201 HydrophobicContact CD1-CB 3.87Å; F61-A201 HydrophobicContact CD2-CB 4.48Å; F61-A201 HydrophobicContact CE1-CB 3.51Å; F61-A201 HydrophobicContact CE2-CB 4.17Å; F61-A201 HydrophobicContact CG-CB 4.35Å; F61-A201 HydrophobicContact CZ-CB 3.68Å; F61-I204 HydrophobicContact CD1-CD1 4.29Å; F61-I204 HydrophobicContact CE1-CD1 3.74Å
62	T	90.5	Very high	90.2	Very high	47 Å²	47	57.5 Å²	57.5	29%	0.288	32%	0.322	S	S	.	.			trans	-57.6	150.8	173.4	58.6	0	0	0	0	111.3	S64 I65 R66	T62-S64 PolarHBondContact O-N 3.21Å; T62-S64 PolarHBondContact OG1-OG 3.15Å; T62-I65 PolarHBondContact O-N 3.44Å; T62-I65 VanDerWaalsContact O-N 3.09Å; T62-I65 WeakPolarHBondContact OG1-CD1 3.46Å; T62-I65 WeakPolarHBondContact OG1-CG1 3.28Å; T62-R66 PolarHBondContact O-N 3.45Å; T62-R66 VanDerWaalsContact O-N 3.15Å
63	P	87.8	Confident	90.3	Very high	74 Å²	74	57.9 Å²	57.9	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-53.1	-42.7	178.2	-26.4	34.6	0	0	0	112.8	I65 R66 E67	P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 2.9Å; P63-R66 PolarHBondContact O-N 2.97Å; P63-R66 VanDerWaalsContact O-N 3.14Å; P63-E67 WeakPolarHBondContact O-CB 3.35Å; P63-E67 WeakPolarHBondContact O-CG 3.44Å; P63-E67 PolarHBondContact O-N 3.4Å
64	S	88.2	Confident	90.4	Very high	42 Å²	42	55.8 Å²	55.8	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-56.9	-39.1	177	50.9	0	0	0	0	113.7	T62 N68 D206	T62-S64 PolarHBondContact O-N 3.21Å; T62-S64 PolarHBondContact OG1-OG 3.15Å; S64-N68 WeakPolarHBondContact O-CB 3.43Å; S64-N68 PolarHBondContact O-N 3.09Å; S64-N68 PolarHBondContact O-ND2 2.95Å; S64-D206 WeakPolarHBondContact CB-OD2 3.41Å; S64-D206 PolarHBondContact OG-OD2 3.46Å
65	I	90	Very high	90.6	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-71.6	-45.4	176.1	-68.4	172.9	0	0	0	110.4	L2 F61 T62 P63 E67 N68 F69 V72 I204 D206	L2-I65 HydrophobicContact CD2-CD1 4.14Å; L2-I65 HydrophobicContact CD2-CG1 4.03Å; L2-I65 HydrophobicContact CD2-CG2 4.08Å; F61-I65 HydrophobicContact CB-CB 4.12Å; F61-I65 HydrophobicContact CB-CG2 3.99Å; F61-I65 HydrophobicContact CD1-CD1 4.47Å; F61-I65 HydrophobicContact CD1-CG2 4.43Å; F61-I65 HydrophobicContact CG-CG2 4.16Å; T62-I65 PolarHBondContact O-N 3.44Å; T62-I65 VanDerWaalsContact O-N 3.09Å; T62-I65 WeakPolarHBondContact OG1-CD1 3.46Å; T62-I65 WeakPolarHBondContact OG1-CG1 3.28Å; P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 2.9Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 2.84Å; I65-N68 PolarHBondContact O-N 3.14Å; I65-F69 HydrophobicContact CG2-CD2 4.48Å; I65-F69 PolarHBondContact O-N 2.98Å; I65-V72 HydrophobicContact CG2-CG2 3.74Å; I65-I204 HydrophobicContact CD1-CG2 4.18Å; I65-D206 HydrophobicContact CD1-CB 4.13Å; I65-D206 HydrophobicContact CG1-CB 4.21Å
66	R	87.9	Confident	90.6	Very high	120 Å²	120	51.1 Å²	51.1	45%	0.453	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-36.6	-176	-68.2	-170.8	-68.5	161.1	4.3	112.8	F61 T62 P63	F61-R66 HydrophobicContact CB-CG 3.93Å; F61-R66 PolarHBondContact O-NE 3.44Å; T62-R66 PolarHBondContact O-N 3.45Å; T62-R66 VanDerWaalsContact O-N 3.15Å; P63-R66 PolarHBondContact O-N 2.97Å; P63-R66 VanDerWaalsContact O-N 3.14Å
67	E	88.2	Confident	90.8	Very high	158 Å²	158	50.9 Å²	50.9	74%	0.738	28%	0.284	S	S	*	.	H	α-helix	trans	-76	-35.3	-179.9	-70.7	170.1	-167.5	0	0	112.7	P63 I65	P63-E67 WeakPolarHBondContact O-CB 3.35Å; P63-E67 WeakPolarHBondContact O-CG 3.44Å; P63-E67 PolarHBondContact O-N 3.4Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 2.84Å
68	N	90	Very high	90.9	Very high	111 Å²	111	46.7 Å²	46.7	59%	0.594	25%	0.249	S	C	*	.	H	α-helix	trans	-94.2	-18.2	-174.5	-67.9	-56.3	0	0	0	113.9	S64 I65	S64-N68 WeakPolarHBondContact O-CB 3.43Å; S64-N68 PolarHBondContact O-N 3.09Å; S64-N68 PolarHBondContact O-ND2 2.95Å; I65-N68 PolarHBondContact O-N 3.14Å
69	F	91.6	Very high	90.8	Very high	44 Å²	44	43.9 Å²	43.9	19%	0.193	22%	0.219	C	C	.	.			trans	-138.5	122	-176	-52.4	-82.4	0	0	0	112	L2 S56 I65 T208	L2-F69 HydrophobicContact CB-CB 4.19Å; L2-F69 HydrophobicContact CB-CD1 3.83Å; L2-F69 HydrophobicContact CB-CD2 3.93Å; L2-F69 HydrophobicContact CB-CE1 4.14Å; L2-F69 HydrophobicContact CB-CE2 4.26Å; L2-F69 HydrophobicContact CB-CG 3.7Å; L2-F69 HydrophobicContact CB-CZ 4.35Å; L2-F69 HydrophobicContact CD1-CE2 4.32Å; L2-F69 HydrophobicContact CD1-CZ 4.17Å; L2-F69 HydrophobicContact CD2-CD2 4.19Å; L2-F69 HydrophobicContact CD2-CE2 4.27Å; S56-F69 WeakPolarHBondContact CB-O 3.32Å; S56-F69 PolarHBondContact OG-O 3.28Å; I65-F69 HydrophobicContact CG2-CD2 4.48Å; I65-F69 PolarHBondContact O-N 2.98Å; F69-T208 HydrophobicContact CE2-CG2 3.42Å; F69-T208 VanDerWaalsContact CE2-CG2 3.42Å; F69-T208 HydrophobicContact CZ-CG2 3.6Å
70	E	92.4	Very high	90.6	Very high	147 Å²	147	42.7 Å²	42.7	69%	0.687	22%	0.215	S	C	*	.	S	Bend	trans	-66.8	-36.1	173.9	-170.7	-168.4	160.3	0	0	112.7	S56	S56-E70 PolarHBondContact N-O 2.61Å; S56-E70 PolarHBondContact OG-O 3.34Å; S56-E70 VanDerWaalsContact OG-O 3.1Å
71	K	92.5	Very high	89.8	Confident	80 Å²	80	40.7 Å²	40.7	35%	0.348	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	138.6	-175.7	-63.9	-172.5	-179.6	-175.5	0	111.8	M1 L2 T53 V54 D55	M1-K71 CarbonylContact C-O 3.52Å; M1-K71 WeakPolarHBondContact CA-O 3.44Å; M1-K71 HydrophobicContact CE-CB 4.47Å; M1-K71 HydrophobicContact CG-CB 4.23Å; L2-K71 PolarHBondContact N-O 2.92Å; T53-K71 HydrophobicContact CG2-CB 4.02Å; T53-K71 HydrophobicContact CG2-CD 4.33Å; V54-K71 WeakPolarHBondContact O-CA 3.44Å; D55-K71 VanDerWaalsContact OD1-CE 3.22Å; D55-K71 WeakPolarHBondContact OD1-CE 2.97Å
72	V	93.3	Very high	89.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124	173.2	-176.7	0	0	0	0	108.5	L2 I4 T53 V54 F61 I65 F74	L2-V72 WeakPolarHBondContact O-CA 3.36Å; I4-V72 HydrophobicContact CD1-CG1 3.88Å; I4-V72 HydrophobicContact CG1-CG1 4.24Å; T53-V72 WeakPolarHBondContact CA-O 3.34Å; V54-V72 HydrophobicContact CG2-CB 4.18Å; V54-V72 PolarHBondContact N-O 3.5Å; V54-V72 PolarHBondContact O-N 3.18Å; F61-V72 HydrophobicContact CD2-CG2 4.21Å; F61-V72 HydrophobicContact CE1-CB 4.31Å; F61-V72 HydrophobicContact CE1-CG1 4.02Å; F61-V72 HydrophobicContact CE1-CG2 4.19Å; F61-V72 HydrophobicContact CE2-CB 4.11Å; F61-V72 HydrophobicContact CE2-CG2 3.82Å; F61-V72 HydrophobicContact CZ-CB 3.76Å; F61-V72 HydrophobicContact CZ-CG1 3.89Å; F61-V72 HydrophobicContact CZ-CG2 3.82Å; I65-V72 HydrophobicContact CG2-CG2 3.74Å; V72-F74 HydrophobicContact CG1-CD2 4.48Å; V72-F74 HydrophobicContact CG1-CE2 4.11Å; V72-F74 HydrophobicContact CG1-CZ 4.31Å
73	Q	92.6	Very high	88.2	Confident	7 Å²	7	42.6 Å²	42.6	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.4	175.5	-174.5	-175	-91	0	0	109	M1 L2 N3 I4	M1-Q73 HydrophobicContact CG-CB 4.29Å; M1-Q73 HydrophobicContact SD-CB 4.04Å; L2-Q73 PolarHBondContact O-N 3.42Å; N3-Q73 CarbonylContact C-O 3.56Å; N3-Q73 WeakPolarHBondContact CA-O 3.15Å; N3-Q73 PolarHBondContact OD1-NE2 3.16Å; N3-Q73 PolarHBondContact OD1-O 3.43Å; I4-Q73 PolarHBondContact N-O 3.34Å
74	F	93.8	Very high	87.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.3	172.4	-69.5	-85	0	0	0	109.1	I4 V6 S51 F52 V54 F61 V72 L200 I204	I4-F74 HydrophobicContact CB-CD1 4.32Å; I4-F74 HydrophobicContact CG2-CD1 4.45Å; I4-F74 CarbonylContact O-C 3.59Å; I4-F74 WeakPolarHBondContact O-CA 3.42Å; V6-F74 HydrophobicContact CG2-CB 4.45Å; V6-F74 HydrophobicContact CG2-CD1 3.6Å; V6-F74 HydrophobicContact CG2-CE1 4.34Å; S51-F74 CarbonylContact C-O 3.51Å; S51-F74 WeakPolarHBondContact CA-O 3.34Å; S51-F74 WeakPolarHBondContact CB-O 3.2Å; F52-F74 HydrophobicContact CD1-CB 3.95Å; F52-F74 HydrophobicContact CD2-CB 4.34Å; F52-F74 AromaticContact CD2-CD2 4Å; F52-F74 HydrophobicContact CD2-CD2 4Å; F52-F74 HydrophobicContact CE1-CB 3.49Å; F52-F74 VanDerWaalsContact CE1-CB 3.49Å; F52-F74 HydrophobicContact CE1-CD2 4.4Å; F52-F74 HydrophobicContact CE1-CG 4.1Å; F52-F74 HydrophobicContact CE2-CB 3.94Å; F52-F74 AromaticContact CE2-CD2 3.3Å; F52-F74 HydrophobicContact CE2-CD2 3.3Å; F52-F74 AromaticContact CE2-CE2 3.96Å; F52-F74 HydrophobicContact CE2-CE2 3.96Å; F52-F74 AromaticContact CE2-CG 3.82Å; F52-F74 HydrophobicContact CE2-CG 3.82Å; F52-F74 HydrophobicContact CG-CB 4.35Å; F52-F74 HydrophobicContact CZ-CB 3.49Å; F52-F74 VanDerWaalsContact CZ-CB 3.49Å; F52-F74 HydrophobicContact CZ-CD1 4.36Å; F52-F74 AromaticContact CZ-CD2 3.54Å; F52-F74 HydrophobicContact CZ-CD2 3.54Å; F52-F74 HydrophobicContact CZ-CE2 4.29Å; F52-F74 AromaticContact CZ-CG 3.55Å; F52-F74 HydrophobicContact CZ-CG 3.55Å; F52-F74 PolarHBondContact N-O 3.12Å; F52-F74 PolarHBondContact O-N 2.9Å; V54-F74 HydrophobicContact CG2-CD2 4.28Å; V54-F74 HydrophobicContact CG2-CE2 3.73Å; F61-F74 HydrophobicContact CE1-CE2 4.36Å; F61-F74 AromaticContact CE1-CZ 3.83Å; F61-F74 HydrophobicContact CE1-CZ 3.83Å; F61-F74 AromaticContact CZ-CE2 3.93Å; F61-F74 HydrophobicContact CZ-CE2 3.93Å; F61-F74 AromaticContact CZ-CZ 3.86Å; F61-F74 HydrophobicContact CZ-CZ 3.86Å; V72-F74 HydrophobicContact CG1-CD2 4.48Å; V72-F74 HydrophobicContact CG1-CE2 4.11Å; V72-F74 HydrophobicContact CG1-CZ 4.31Å; F74-L200 HydrophobicContact CD1-CD2 3.8Å; F74-L200 HydrophobicContact CD1-CG 4.42Å; F74-L200 HydrophobicContact CE1-CD2 3.59Å; F74-L200 HydrophobicContact CE1-CG 3.77Å; F74-L200 HydrophobicContact CG-CD2 4.43Å; F74-L200 HydrophobicContact CZ-CD2 4.14Å; F74-L200 HydrophobicContact CZ-CG 4.26Å; F74-I204 HydrophobicContact CD1-CD1 4.46Å; F74-I204 HydrophobicContact CE1-CD1 3.27Å; F74-I204 HydrophobicContact CE1-CG1 4.39Å; F74-I204 HydrophobicContact CZ-CD1 3.53Å
75	T	94	Very high	87.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.8	169.1	-66.2	0	0	0	0	108.3	N3 I4 N5 V6 F49 S50 F268 R280	N3-T75 PolarHBondContact ND2-OG1 3.1Å; N3-T75 PolarHBondContact OD1-OG1 3.36Å; I4-T75 PolarHBondContact O-N 3.22Å; N5-T75 CarbonylContact C-O 3.56Å; N5-T75 WeakPolarHBondContact CA-O 3.48Å; N5-T75 WeakPolarHBondContact OD1-CB 3.44Å; V6-T75 PolarHBondContact N-O 2.72Å; F49-T75 HydrophobicContact CD1-CG2 4.38Å; S50-T75 CarbonylContact O-C 3.38Å; S50-T75 WeakPolarHBondContact O-CA 3.48Å; T75-F268 HydrophobicContact CG2-CZ 3.89Å; T75-F268 WeakPolarHBondContact OG1-CE2 3.42Å; T75-F268 VanDerWaalsContact OG1-CZ 3.22Å; T75-F268 WeakPolarHBondContact OG1-CZ 3.26Å; T75-R280 HydrophobicContact CG2-CB 4.23Å
76	L	93.4	Very high	86.8	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124.9	175.6	-58.2	-176.8	0	0	0	109.9	V6 V8 A20 L23 F49 S50 F52	V6-L76 HydrophobicContact CB-CD2 3.78Å; V6-L76 HydrophobicContact CG1-CD2 4.04Å; V6-L76 HydrophobicContact CG2-CD2 4.31Å; V8-L76 HydrophobicContact CG2-CB 4.43Å; V8-L76 HydrophobicContact CG2-CD2 4.38Å; A20-L76 HydrophobicContact CB-CD1 4.07Å; L23-L76 HydrophobicContact CB-CD1 3.78Å; L23-L76 HydrophobicContact CD1-CD1 4.14Å; F49-L76 WeakPolarHBondContact CA-O 3.49Å; S50-L76 PolarHBondContact N-O 2.77Å; S50-L76 PolarHBondContact O-N 3.24Å; F52-L76 HydrophobicContact CD1-CD1 4.21Å; F52-L76 HydrophobicContact CD1-CG 4.31Å; F52-L76 HydrophobicContact CE1-CD1 4.09Å; F52-L76 HydrophobicContact CE1-CD2 3.91Å; F52-L76 HydrophobicContact CE1-CG 4.08Å
77	V	91.4	Very high	86.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	93.2	174.5	-172.7	0	0	0	0	107.4	V6 V8 L47 F49 C79 I95 I96	V6-V77 PolarHBondContact O-N 3.19Å; V8-V77 PolarHBondContact N-O 3.5Å; L47-V77 HydrophobicContact CB-CG1 4.47Å; L47-V77 HydrophobicContact CD2-CG1 4.05Å; F49-V77 HydrophobicContact CD1-CG1 4.46Å; F49-V77 HydrophobicContact CD1-CG2 4.06Å; F49-V77 HydrophobicContact CE1-CB 4.32Å; F49-V77 HydrophobicContact CE1-CG1 3.85Å; F49-V77 HydrophobicContact CE1-CG2 3.82Å; F49-V77 HydrophobicContact CZ-CG1 4.29Å; V77-C79 PolarHBondContact O-N 2.71Å; V77-I95 HydrophobicContact CG1-CD1 4.27Å; V77-I95 HydrophobicContact CG2-CD1 4.12Å; V77-I96 HydrophobicContact CB-CD1 4.44Å; V77-I96 HydrophobicContact CB-CG1 4.33Å; V77-I96 HydrophobicContact CG1-CD1 4.49Å; V77-I96 HydrophobicContact CG2-CG1 4.3Å
78	D	89.6	Confident	86.3	Confident	2 Å²	2	34 Å²	34	1%	0.011	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	109.6	178.4	-170.2	15.5	0	0	0	109.6	K16 T17 L47 G48	K16-D78 WeakPolarHBondContact CB-OD1 3.46Å; T17-D78 VanDerWaalsContact CA-OD2 3.25Å; T17-D78 WeakPolarHBondContact CA-OD2 3.38Å; T17-D78 VanDerWaalsContact CB-OD2 3.26Å; T17-D78 WeakPolarHBondContact CB-OD2 3.46Å; T17-D78 WeakPolarHBondContact CG2-OD2 3.35Å; T17-D78 PolarHBondContact OG1-OD2 3.23Å; L47-D78 WeakPolarHBondContact CA-O 3.48Å; G48-D78 PolarHBondContact N-O 3.43Å; G48-D78 PolarHBondContact O-N 3.3Å
79	C	86.6	Confident	86.1	Confident	1 Å²	1	29 Å²	29	1%	0.007	15%	0.147	C	C	.	.			trans	-91.2	143.2	-177.8	-70	0	0	0	0	111.4	V8 L9 K16 L47 V77 V89	V8-C79 WeakPolarHBondContact O-CB 3.49Å; V8-C79 PolarHBondContact O-N 3.3Å; V8-C79 VanDerWaalsContact O-N 3.13Å; L9-C79 HydrophobicContact CG-CB 4.25Å; K16-C79 WeakPolarHBondContact CE-O 3.33Å; L47-C79 HydrophobicContact CD2-CB 4.49Å; V77-C79 PolarHBondContact O-N 2.71Å; C79-V89 HydrophobicContact CB-CG1 4.25Å; C79-V89 HydrophobicContact CB-CG2 4.31Å
80	P	84.3	Confident	85.9	Confident	4 Å²	4	26.9 Å²	26.9	3%	0.026	14%	0.138	C	C	.	.			trans	-64.5	140	175.8	27	-34.1	0	0	0	111.7	T44 L85 T88 V89	T44-P80 WeakPolarHBondContact O-CB 3.5Å; P80-L85 HydrophobicContact CB-CB 3.7Å; P80-L85 HydrophobicContact CB-CD1 3.49Å; P80-L85 VanDerWaalsContact CB-CD1 3.49Å; P80-L85 HydrophobicContact CB-CG 4.24Å; P80-L85 HydrophobicContact CG-CB 3.65Å; P80-L85 HydrophobicContact CG-CD1 4.23Å; P80-T88 HydrophobicContact CG-CG2 3.86Å; P80-V89 HydrophobicContact CG-CG2 3.87Å; P80-V89 VanDerWaalsContact O-CG2 3.26Å; P80-V89 WeakPolarHBondContact O-CG2 3.37Å
81	G	77.2	Confident	85.3	Confident	10 Å²	10	20 Å²	20	10%	0.103	11%	0.106	C	C	.	.			trans	-91.9	-14.8	179.7	0	0	0	0	0	114.8	V12	V12-G81 VanDerWaalsContact CG2-C 3.47Å; V12-G81 WeakPolarHBondContact CG2-O 3.32Å
82	H	78.4	Confident	84.9	Confident	79 Å²	79	16.2 Å²	16.2	37%	0.366	9%	0.09	S	C	.	.	S	Bend	trans	-74.8	134.8	-175	-166.4	-88.2	0	0	0	110.7	V12 I43 S84 L85	V12-H82 HydrophobicContact CG2-CB 4.33Å; I43-H82 HydrophobicContact CD1-CB 4.36Å; H82-S84 WeakPolarHBondContact ND1-CB 3.38Å; H82-S84 PolarHBondContact ND1-N 2.84Å; H82-S84 PolarHBondContact ND1-OG 2.97Å; H82-S84 PolarHBondContact O-N 2.83Å; H82-S84 VanDerWaalsContact O-N 3.08Å; H82-L85 HydrophobicContact CB-CD1 4.15Å; H82-L85 HydrophobicContact CB-CG 4.42Å; H82-L85 WeakPolarHBondContact O-CB 3.5Å; H82-L85 PolarHBondContact O-N 2.86Å
83	G	68.9	Low	84.5	Confident	13 Å²	13	16.4 Å²	16.4	13%	0.134	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-59	-28.7	-173.6	0	0	0	0	0	113.8	L85 I86 R417	G83-L85 PolarHBondContact O-N 2.86Å; G83-I86 PolarHBondContact O-N 2.99Å; G83-R417 PolarHBondContact O-NH1 2.99Å; G83-R417 PolarHBondContact O-NH2 2.8Å
84	S	72.8	Confident	84	Confident	56 Å²	56	17.8 Å²	17.8	39%	0.392	10%	0.098	S	C	.	.	G	3₁₀ helix	trans	-66	-18.1	175.3	71.2	0	0	0	0	114.3	H82 Y411	H82-S84 WeakPolarHBondContact ND1-CB 3.38Å; H82-S84 PolarHBondContact ND1-N 2.84Å; H82-S84 PolarHBondContact ND1-OG 2.97Å; H82-S84 PolarHBondContact O-N 2.83Å; H82-S84 VanDerWaalsContact O-N 3.08Å; S84-Y411 WeakPolarHBondContact CA-OH 3.24Å; S84-Y411 WeakPolarHBondContact CB-OH 3.23Å
85	L	80.8	Confident	83.6	Confident	28 Å²	28	18.2 Å²	18.2	15%	0.147	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-102.8	16.9	-174.4	-59.6	173.5	0	0	0	112.3	T44 L45 P80 H82 G83 K87 T88 V89	T44-L85 VanDerWaalsContact O-CD1 3.26Å; T44-L85 WeakPolarHBondContact O-CD1 3.31Å; L45-L85 HydrophobicContact CD2-CD1 4.2Å; P80-L85 HydrophobicContact CB-CB 3.7Å; P80-L85 HydrophobicContact CB-CD1 3.49Å; P80-L85 VanDerWaalsContact CB-CD1 3.49Å; P80-L85 HydrophobicContact CB-CG 4.24Å; P80-L85 HydrophobicContact CG-CB 3.65Å; P80-L85 HydrophobicContact CG-CD1 4.23Å; H82-L85 HydrophobicContact CB-CD1 4.15Å; H82-L85 HydrophobicContact CB-CG 4.42Å; H82-L85 WeakPolarHBondContact O-CB 3.5Å; H82-L85 PolarHBondContact O-N 2.86Å; G83-L85 PolarHBondContact O-N 2.86Å; L85-K87 PolarHBondContact O-N 3.13Å; L85-K87 VanDerWaalsContact O-N 3.12Å; L85-T88 WeakPolarHBondContact O-CB 3.43Å; L85-T88 PolarHBondContact O-N 3.45Å; L85-V89 PolarHBondContact O-N 3.42Å
86	I	82.4	Confident	83.4	Confident	14 Å²	14	18.7 Å²	18.7	7%	0.072	10%	0.102	C	C	.	.	H	α-helix	trans	-54	-33.4	177.9	-165.7	64.7	0	0	0	112.3	G83 T88 V89 L90 I119 L408	G83-I86 PolarHBondContact O-N 2.99Å; I86-T88 VanDerWaalsContact C-N 3.33Å; I86-T88 PolarHBondContact O-N 2.93Å; I86-V89 PolarHBondContact O-N 3.22Å; I86-L90 HydrophobicContact CG1-CD1 4.2Å; I86-L90 HydrophobicContact CG1-CG 4.4Å; I86-L90 WeakPolarHBondContact O-CG 3.09Å; I86-L90 PolarHBondContact O-N 2.87Å; I86-I119 HydrophobicContact CD1-CD1 3.83Å; I86-L408 HydrophobicContact CG2-CD2 3.67Å
87	K	83.9	Confident	83.3	Confident	102 Å²	102	21.1 Å²	21.1	44%	0.443	12%	0.115	S	C	.	.	H	α-helix	trans	-57.5	-46.5	175.3	161.8	155.2	-178.6	-179.6	0	111.6	L85 V89 L90 C91 F337 T342	L85-K87 PolarHBondContact O-N 3.13Å; L85-K87 VanDerWaalsContact O-N 3.12Å; K87-V89 PolarHBondContact O-N 2.91Å; K87-L90 PolarHBondContact O-N 2.83Å; K87-C91 PolarHBondContact O-N 2.91Å; K87-C91 VanDerWaalsContact O-N 3.08Å; K87-C91 PolarHBondContact O-SG 3.15Å; K87-C91 VanDerWaalsContact O-SG 3.34Å; K87-F337 HydrophobicContact CB-CE1 3.73Å; K87-F337 HydrophobicContact CB-CZ 4.07Å; K87-F337 HydrophobicContact CD-CE1 4.25Å; K87-F337 HydrophobicContact CG-CE1 3.76Å; K87-F337 HydrophobicContact CG-CZ 4.47Å; K87-T342 HydrophobicContact CD-CG2 4.38Å; K87-T342 WeakPolarHBondContact CE-OG1 3.45Å
88	T	83.2	Confident	83.4	Confident	16 Å²	16	21.3 Å²	21.3	10%	0.098	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-40.2	177.8	-52.1	0	0	0	0	111.6	L47 P80 L85 I86 G92	L47-T88 HydrophobicContact CD2-CG2 3.95Å; L47-T88 HydrophobicContact CG-CG2 3.73Å; P80-T88 HydrophobicContact CG-CG2 3.86Å; L85-T88 WeakPolarHBondContact O-CB 3.43Å; L85-T88 PolarHBondContact O-N 3.45Å; I86-T88 VanDerWaalsContact C-N 3.33Å; I86-T88 PolarHBondContact O-N 2.93Å; T88-G92 PolarHBondContact O-N 2.84Å
89	V	85.5	Confident	83.6	Confident	5 Å²	5	21.3 Å²	21.3	3%	0.03	12%	0.116	C	C	.	.	H	α-helix	trans	-64.5	-43.6	177.2	-171.8	0	0	0	0	111.2	L9 C79 P80 L85 I86 K87 G92 S93 I119	L9-V89 HydrophobicContact CD2-CG1 3.53Å; L9-V89 HydrophobicContact CG-CG1 4.37Å; C79-V89 HydrophobicContact CB-CG1 4.25Å; C79-V89 HydrophobicContact CB-CG2 4.31Å; P80-V89 HydrophobicContact CG-CG2 3.87Å; P80-V89 VanDerWaalsContact O-CG2 3.26Å; P80-V89 WeakPolarHBondContact O-CG2 3.37Å; L85-V89 PolarHBondContact O-N 3.42Å; I86-V89 PolarHBondContact O-N 3.22Å; K87-V89 PolarHBondContact O-N 2.91Å; V89-G92 PolarHBondContact O-N 3.31Å; V89-S93 PolarHBondContact O-N 3.46Å; V89-I119 HydrophobicContact CB-CD1 4.25Å; V89-I119 HydrophobicContact CG1-CD1 3.61Å
90	L	86.4	Confident	84.1	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-43	178.8	-72	170.7	0	0	0	112	I86 K87 G92 S93 I119 F337 I404 A406 I418	I86-L90 HydrophobicContact CG1-CD1 4.2Å; I86-L90 HydrophobicContact CG1-CG 4.4Å; I86-L90 WeakPolarHBondContact O-CG 3.09Å; I86-L90 PolarHBondContact O-N 2.87Å; K87-L90 PolarHBondContact O-N 2.83Å; L90-G92 VanDerWaalsContact C-N 3.32Å; L90-G92 PolarHBondContact O-N 3.49Å; L90-S93 PolarHBondContact O-N 2.98Å; L90-S93 PolarHBondContact O-OG 3.48Å; L90-I119 HydrophobicContact CD2-CD1 3.91Å; L90-I119 HydrophobicContact CD2-CG1 3.83Å; L90-I119 HydrophobicContact CG-CD1 4.37Å; L90-F337 HydrophobicContact CB-CD1 3.83Å; L90-F337 HydrophobicContact CB-CE1 4.11Å; L90-F337 HydrophobicContact CB-CG 4.1Å; L90-F337 HydrophobicContact CD1-CD1 4.15Å; L90-F337 HydrophobicContact CD1-CD2 3.7Å; L90-F337 HydrophobicContact CD1-CE1 3.95Å; L90-F337 HydrophobicContact CD1-CE2 3.49Å; L90-F337 VanDerWaalsContact CD1-CE2 3.49Å; L90-F337 HydrophobicContact CD1-CG 4.02Å; L90-F337 HydrophobicContact CD1-CZ 3.6Å; L90-I404 HydrophobicContact CD2-CD1 3.77Å; L90-I404 HydrophobicContact CD2-CG2 4.06Å; L90-A406 HydrophobicContact CD1-CB 4.48Å; L90-I418 HydrophobicContact CD2-CD1 4.1Å
91	C	80.7	Confident	84.6	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-38.7	173.6	-63.5	0	0	0	0	112	K87 S93 Q94	K87-C91 PolarHBondContact O-N 2.91Å; K87-C91 VanDerWaalsContact O-N 3.08Å; K87-C91 PolarHBondContact O-SG 3.15Å; K87-C91 VanDerWaalsContact O-SG 3.34Å; C91-S93 VanDerWaalsContact C-N 3.32Å; C91-S93 PolarHBondContact O-N 3.28Å; C91-Q94 PolarHBondContact O-N 3.37Å
92	G	82.9	Confident	85.5	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.3	-34.7	175.4	0	0	0	0	0	113.2	T88 V89 L90 Q94 I95 I96	T88-G92 PolarHBondContact O-N 2.84Å; V89-G92 PolarHBondContact O-N 3.31Å; L90-G92 VanDerWaalsContact C-N 3.32Å; L90-G92 PolarHBondContact O-N 3.49Å; G92-Q94 PolarHBondContact O-N 3.12Å; G92-Q94 VanDerWaalsContact O-N 3.12Å; G92-I95 WeakPolarHBondContact O-CG1 3.4Å; G92-I95 PolarHBondContact O-N 2.69Å; G92-I96 VanDerWaalsContact O-CD1 3.26Å; G92-I96 WeakPolarHBondContact O-CD1 3.21Å; G92-I96 WeakPolarHBondContact O-CG1 3.08Å
93	S	85.1	Confident	86.3	Confident	3 Å²	3	17.1 Å²	17.1	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-59	-27.2	-178.7	75.7	0	0	0	0	113.8	V89 L90 C91 I95 A123	V89-S93 PolarHBondContact O-N 3.46Å; L90-S93 PolarHBondContact O-N 2.98Å; L90-S93 PolarHBondContact O-OG 3.48Å; C91-S93 VanDerWaalsContact C-N 3.32Å; C91-S93 PolarHBondContact O-N 3.28Å; S93-I95 VanDerWaalsContact C-N 3.3Å; S93-I95 PolarHBondContact O-N 3.46Å; S93-A123 WeakPolarHBondContact O-CB 3.49Å
94	Q	82.1	Confident	87.5	Confident	37 Å²	37	16.7 Å²	16.7	17%	0.173	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-17.7	-176.2	-53	-153.6	1.5	0	0	114.4	C91 G92 G339 L402	C91-Q94 PolarHBondContact O-N 3.37Å; G92-Q94 PolarHBondContact O-N 3.12Å; G92-Q94 VanDerWaalsContact O-N 3.12Å; Q94-G339 PolarHBondContact OE1-O 3.29Å; Q94-L402 PolarHBondContact NE2-O 3.44Å
95	I	86.6	Confident	88.6	Confident	8 Å²	8	14.2 Å²	14.2	4%	0.041	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-4.1	-178.2	58.1	163.3	0	0	0	113	N5 F49 V77 G92 S93 T239 L241	N5-I95 WeakPolarHBondContact CB-O 3.2Å; N5-I95 PolarHBondContact ND2-O 2.95Å; F49-I95 HydrophobicContact CE1-CD1 3.77Å; F49-I95 HydrophobicContact CZ-CD1 4.09Å; V77-I95 HydrophobicContact CG1-CD1 4.27Å; V77-I95 HydrophobicContact CG2-CD1 4.12Å; G92-I95 WeakPolarHBondContact O-CG1 3.4Å; G92-I95 PolarHBondContact O-N 2.69Å; S93-I95 VanDerWaalsContact C-N 3.3Å; S93-I95 PolarHBondContact O-N 3.46Å; I95-T239 HydrophobicContact CB-CG2 4.22Å; I95-T239 HydrophobicContact CG2-CG2 4.28Å; I95-L241 HydrophobicContact CG2-CD2 4.04Å
96	I	90.2	Very high	89.1	Confident	10 Å²	10	16.1 Å²	16.1	5%	0.051	8%	0.084	C	C	.	.			trans	-92.8	134.7	-170.8	-68.3	161.9	0	0	0	110.5	L9 V77 G92 I98 V99	L9-I96 HydrophobicContact CD1-CD1 4.36Å; V77-I96 HydrophobicContact CB-CD1 4.44Å; V77-I96 HydrophobicContact CB-CG1 4.33Å; V77-I96 HydrophobicContact CG1-CD1 4.49Å; V77-I96 HydrophobicContact CG2-CG1 4.3Å; G92-I96 VanDerWaalsContact O-CD1 3.26Å; G92-I96 WeakPolarHBondContact O-CD1 3.21Å; G92-I96 WeakPolarHBondContact O-CG1 3.08Å; I96-I98 VanDerWaalsContact CG2-C 3.44Å; I96-I98 WeakPolarHBondContact CG2-O 3.3Å; I96-V99 HydrophobicContact CG2-CG2 4.24Å
97	D	91.4	Very high	89.6	Confident	52 Å²	52	20.6 Å²	20.6	28%	0.278	10%	0.103	S	C	.	.	S	Bend	trans	-89.9	-32	173.5	-54.5	-77.3	0	0	0	112	I4 N5 R211	I4-D97 HydrophobicContact CG2-CB 4.1Å; N5-D97 PolarHBondContact N-OD2 2.93Å; N5-D97 PolarHBondContact O-N 2.91Å; D97-R211 IonicContact OD1-CZ 3.82Å; D97-R211 IonicContact OD1-NE 3.16Å; D97-R211 IonicContact OD1-NH2 2.96Å; D97-R211 PolarHBondContact OD1-NH2 3.16Å; D97-R211 IonicContact OD2-CZ 3.94Å; D97-R211 IonicContact OD2-NH2 3.86Å; D97-R211 PolarHBondContact OD2-NH2 3.14Å
98	I	93.4	Very high	89.9	Confident	4 Å²	4	15.7 Å²	15.7	2%	0.021	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.4	179.9	-174.4	167.7	0	0	0	111.6	I4 N5 V6 G7 I96 K126 L200 I204	I4-I98 HydrophobicContact CG2-CG2 4.27Å; N5-I98 PolarHBondContact O-N 2.81Å; V6-I98 WeakPolarHBondContact CA-O 3.45Å; V6-I98 HydrophobicContact CB-CG2 4.29Å; V6-I98 HydrophobicContact CG1-CG2 4.21Å; V6-I98 HydrophobicContact CG2-CG2 3.8Å; G7-I98 PolarHBondContact N-O 3.5Å; I96-I98 VanDerWaalsContact CG2-C 3.44Å; I96-I98 WeakPolarHBondContact CG2-O 3.3Å; I98-K126 HydrophobicContact CD1-CB 4.37Å; I98-L200 HydrophobicContact CD1-CD1 4.14Å; I98-L200 HydrophobicContact CG2-CD1 4.35Å; I98-I204 HydrophobicContact CD1-CG1 4.31Å
99	V	93.9	Very high	90.2	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.012	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	134	174.5	170.7	0	0	0	0	111.2	L9 I96 C124 M127 L128	L9-V99 HydrophobicContact CB-CG1 4.27Å; L9-V99 HydrophobicContact CD1-CB 4.26Å; L9-V99 HydrophobicContact CD1-CG1 3.63Å; L9-V99 HydrophobicContact CD1-CG2 3.79Å; L9-V99 HydrophobicContact CG-CG1 4.47Å; I96-V99 HydrophobicContact CG2-CG2 4.24Å; V99-C124 HydrophobicContact CG2-CB 4.35Å; V99-M127 HydrophobicContact CB-CG 4.25Å; V99-M127 HydrophobicContact CG1-CG 4.13Å; V99-M127 HydrophobicContact CG1-SD 4.4Å; V99-M127 CarbonylContact O-C 3.59Å; V99-M127 VanDerWaalsContact O-CA 3.28Å; V99-M127 WeakPolarHBondContact O-CA 3.24Å; V99-M127 WeakPolarHBondContact O-CG 3.36Å; V99-L128 PolarHBondContact O-N 3.1Å
100	V	95.6	Very high	90.2	Very high	6 Å²	6	19 Å²	19	4%	0.036	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.6	162.4	173.3	0	0	0	0	108	V6 G7 L9 L19 V102 L128 V130 L200	V6-V100 HydrophobicContact CG1-CB 4.21Å; V6-V100 HydrophobicContact CG1-CG2 3.42Å; V6-V100 VanDerWaalsContact CG1-CG2 3.42Å; G7-V100 PolarHBondContact O-N 3.41Å; L9-V100 PolarHBondContact N-O 2.89Å; L19-V100 HydrophobicContact CD2-CG1 4.06Å; V100-V102 HydrophobicContact CG1-CG2 4.13Å; V100-L128 CarbonylContact C-O 3.48Å; V100-L128 VanDerWaalsContact CA-O 3.31Å; V100-L128 WeakPolarHBondContact CA-O 3.24Å; V100-L128 HydrophobicContact CG2-CB 4.31Å; V100-L128 HydrophobicContact CG2-CD2 4.29Å; V100-V130 HydrophobicContact CG1-CB 4.3Å; V100-V130 HydrophobicContact CG1-CG2 3.52Å; V100-L200 HydrophobicContact CG2-CD1 3.89Å
101	L	95.6	Very high	90	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.3	177.7	-176.1	65.7	0	0	0	110.1	I103 F109 T113 C116 M127 L128 V130	L101-I103 HydrophobicContact CD2-CD1 4.18Å; L101-I103 HydrophobicContact CG-CD1 4.41Å; L101-I103 HydrophobicContact CG-CG1 4.21Å; L101-F109 HydrophobicContact CD2-CZ 4.38Å; L101-T113 HydrophobicContact CD1-CG2 3.93Å; L101-T113 HydrophobicContact CD2-CG2 3.99Å; L101-T113 HydrophobicContact CG-CG2 4.16Å; L101-C116 HydrophobicContact CD1-CB 3.77Å; L101-M127 HydrophobicContact CB-CG 4.25Å; L101-M127 HydrophobicContact CB-SD 3.69Å; L101-M127 HydrophobicContact CD2-CE 4.24Å; L101-M127 HydrophobicContact CD2-SD 3.89Å; L101-M127 HydrophobicContact CG-SD 4.39Å; L101-L128 PolarHBondContact N-O 3.43Å; L101-V130 PolarHBondContact O-N 3.37Å
102	V	95.8	Very high	90.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.4	-179.2	-169.8	0	0	0	0	110.3	V8 L9 S14 K16 L19 V100 N132	V8-V102 HydrophobicContact CG1-CG2 3.63Å; L9-V102 PolarHBondContact O-N 3.3Å; S14-V102 WeakPolarHBondContact CB-O 3.46Å; S14-V102 WeakPolarHBondContact O-CG1 3.16Å; S14-V102 PolarHBondContact OG-O 3.49Å; K16-V102 HydrophobicContact CG-CB 4.15Å; K16-V102 HydrophobicContact CG-CG2 4.17Å; L19-V102 HydrophobicContact CD2-CG1 4.49Å; L19-V102 HydrophobicContact CD2-CG2 3.48Å; L19-V102 VanDerWaalsContact CD2-CG2 3.48Å; V100-V102 HydrophobicContact CG1-CG2 4.13Å; V102-N132 HydrophobicContact CG1-CB 3.9Å
103	I	95.7	Very high	90.4	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.7	-179	-60.7	-179	0	0	0	108.8	L101 V105 F109 T113 V129 V130 L131 N132 I153	L101-I103 HydrophobicContact CD2-CD1 4.18Å; L101-I103 HydrophobicContact CG-CD1 4.41Å; L101-I103 HydrophobicContact CG-CG1 4.21Å; I103-V105 PolarHBondContact O-N 3.04Å; I103-F109 HydrophobicContact CD1-CD2 4.25Å; I103-F109 HydrophobicContact CD1-CE2 3.91Å; I103-F109 HydrophobicContact CD1-CZ 4.2Å; I103-T113 HydrophobicContact CD1-CG2 4.13Å; I103-T113 HydrophobicContact CG1-CG2 3.96Å; I103-V129 HydrophobicContact CD1-CG1 3.74Å; I103-V129 HydrophobicContact CG1-CG1 4.32Å; I103-V130 PolarHBondContact N-O 2.81Å; I103-L131 HydrophobicContact CB-CD2 4.22Å; I103-L131 HydrophobicContact CG2-CD2 4.21Å; I103-N132 PolarHBondContact O-N 2.86Å; I103-I153 HydrophobicContact CD1-CD1 3.83Å; I103-I153 HydrophobicContact CD1-CG1 4.21Å
104	D	94.6	Very high	90.4	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	114.8	168.3	-175.7	-31	0	0	0	108.6	T106 K107 G108 K133	D104-T106 PolarHBondContact O-N 3.11Å; D104-T106 VanDerWaalsContact O-N 3.14Å; D104-T106 WeakPolarHBondContact OD1-CB 3.44Å; D104-T106 PolarHBondContact OD1-N 3.3Å; D104-T106 PolarHBondContact OD1-OG1 3.35Å; D104-K107 HydrophobicContact CB-CB 4.25Å; D104-K107 HydrophobicContact CB-CG 4.42Å; D104-K107 PolarHBondContact O-N 3.21Å; D104-K107 VanDerWaalsContact O-N 3.09Å; D104-G108 PolarHBondContact O-N 2.96Å; D104-K133 WeakPolarHBondContact OD2-CE 3.48Å; D104-K133 IonicContact OD2-NZ 3.59Å; D104-K133 PolarHBondContact OD2-NZ 2.85Å
105	V	94.7	Very high	90.6	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.03	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.5	-174.8	73.9	0	0	0	0	112.8	I103 L131 N132 K133 L137 I146 M149	I103-V105 PolarHBondContact O-N 3.04Å; V105-L131 HydrophobicContact CB-CB 4.37Å; V105-L131 HydrophobicContact CB-CD2 4.48Å; V105-L131 HydrophobicContact CG2-CB 4.31Å; V105-L131 HydrophobicContact CG2-CD1 4.32Å; V105-L131 HydrophobicContact CG2-CD2 4.28Å; V105-N132 WeakPolarHBondContact CB-O 3.49Å; V105-N132 WeakPolarHBondContact CG1-O 3.4Å; V105-N132 PolarHBondContact N-O 3.08Å; V105-K133 WeakPolarHBondContact CG1-O 3.45Å; V105-L137 HydrophobicContact CG1-CD1 3.77Å; V105-L137 HydrophobicContact CG1-CD2 4.3Å; V105-L137 HydrophobicContact CG1-CG 3.93Å; V105-L137 HydrophobicContact CG2-CD1 3.91Å; V105-I146 HydrophobicContact CG2-CG1 4.23Å; V105-M149 HydrophobicContact CG2-CB 4.44Å; V105-M149 HydrophobicContact CG2-CG 4.41Å; V105-M149 WeakPolarHBondContact O-CE 3.13Å
106	T	92.6	Very high	90.8	Very high	68 Å²	68	24.5 Å²	24.5	42%	0.417	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-27.8	179.3	68.8	0	0	0	0	112.5	D104 L136 L137	D104-T106 PolarHBondContact O-N 3.11Å; D104-T106 VanDerWaalsContact O-N 3.14Å; D104-T106 WeakPolarHBondContact OD1-CB 3.44Å; D104-T106 PolarHBondContact OD1-N 3.3Å; D104-T106 PolarHBondContact OD1-OG1 3.35Å; T106-L136 HydrophobicContact CG2-CB 3.91Å; T106-L136 HydrophobicContact CG2-CD1 4.46Å; T106-L137 HydrophobicContact CG2-CD2 4.11Å
107	K	92	Very high	90.9	Very high	107 Å²	107	24.2 Å²	24.2	47%	0.465	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-29.7	-175.2	-59.3	-177.5	-175.3	177.4	0	113.2	D104 Q110	D104-K107 HydrophobicContact CB-CB 4.25Å; D104-K107 HydrophobicContact CB-CG 4.42Å; D104-K107 PolarHBondContact O-N 3.21Å; D104-K107 VanDerWaalsContact O-N 3.09Å; K107-Q110 HydrophobicContact CB-CG 4.42Å
108	G	91	Very high	90.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.			trans	69.7	-147.8	-176.3	0	0	0	0	0	113.3	D104 Q110	D104-G108 PolarHBondContact O-N 2.96Å; G108-Q110 PolarHBondContact O-N 2.93Å
109	F	87.9	Confident	90.7	Very high	40 Å²	40	21.7 Å²	21.7	18%	0.175	12%	0.119	C	C	.	.	S	Bend	trans	-67.8	124.1	-179.4	-97.4	-90.4	0	0	0	112.1	L101 I103 T113 L117 I153 T156 L157	L101-F109 HydrophobicContact CD2-CZ 4.38Å; I103-F109 HydrophobicContact CD1-CD2 4.25Å; I103-F109 HydrophobicContact CD1-CE2 3.91Å; I103-F109 HydrophobicContact CD1-CZ 4.2Å; F109-T113 HydrophobicContact CD1-CG2 3.6Å; F109-T113 HydrophobicContact CE1-CG2 3.65Å; F109-T113 HydrophobicContact CG-CG2 4.3Å; F109-T113 HydrophobicContact CZ-CG2 4.38Å; F109-L117 HydrophobicContact CE1-CD2 4.26Å; F109-I153 HydrophobicContact CD2-CG1 4.08Å; F109-I153 HydrophobicContact CE2-CB 4.19Å; F109-I153 HydrophobicContact CE2-CG1 3.81Å; F109-I153 HydrophobicContact CE2-CG2 4.08Å; F109-T156 HydrophobicContact CD2-CG2 4.41Å; F109-T156 HydrophobicContact CE1-CG2 4.25Å; F109-T156 HydrophobicContact CE2-CG2 4.12Å; F109-T156 HydrophobicContact CZ-CG2 4.05Å; F109-L157 HydrophobicContact CZ-CD2 4.44Å
110	Q	86.8	Confident	90.6	Very high	49 Å²	49	21.6 Å²	21.6	23%	0.229	12%	0.118	C	C	.	.			trans	-118.9	171.6	176.4	-60.2	-179.8	-86.4	0	0	110.4	H11 K107 G108 Q112 T113 A114	H11-Q110 HydrophobicContact CB-CB 4.22Å; H11-Q110 PolarHBondContact CD2-NE2 3.27Å; H11-Q110 PolarHBondContact CD2-OE1 3.1Å; H11-Q110 VanDerWaalsContact CG-OE1 3.26Å; H11-Q110 PolarHBondContact NE2-NE2 3.21Å; H11-Q110 VanDerWaalsContact NE2-NE2 3.12Å; K107-Q110 HydrophobicContact CB-CG 4.42Å; G108-Q110 PolarHBondContact O-N 2.93Å; Q110-Q112 PolarHBondContact O-N 2.68Å; Q110-T113 PolarHBondContact N-OG1 2.76Å; Q110-T113 WeakPolarHBondContact O-CA 3.39Å; Q110-T113 VanDerWaalsContact O-CB 3.24Å; Q110-T113 WeakPolarHBondContact O-CB 3.31Å; Q110-T113 PolarHBondContact O-N 2.82Å; Q110-A114 PolarHBondContact O-N 2.7Å
111	T	80.5	Confident	90.3	Very high	63 Å²	63	23.4 Å²	23.4	39%	0.387	13%	0.126	S	C	.	.	H	α-helix	trans	-50.8	-54.5	-175.4	-57.4	0	0	0	0	113.2	T113 A114 E115 I413	T111-T113 VanDerWaalsContact C-N 3.25Å; T111-T113 PolarHBondContact O-N 2.81Å; T111-A114 WeakPolarHBondContact O-CB 3.35Å; T111-A114 PolarHBondContact O-N 3.01Å; T111-A114 VanDerWaalsContact O-N 3.11Å; T111-E115 PolarHBondContact O-N 2.72Å; T111-I413 WeakPolarHBondContact CG2-O 3.32Å; T111-I413 PolarHBondContact OG1-O 2.87Å
112	Q	83.7	Confident	90.1	Very high	36 Å²	36	24.2 Å²	24.2	17%	0.168	13%	0.13	C	C	.	.	H	α-helix	trans	-68.9	-25.8	-178.1	-67	87.5	-34.5	0	0	111.9	H11 Q110 A114 E115 C116	H11-Q112 PolarHBondContact CE1-OE1 3.43Å; H11-Q112 PolarHBondContact ND1-OE1 2.71Å; Q110-Q112 PolarHBondContact O-N 2.68Å; Q112-A114 VanDerWaalsContact C-N 3.29Å; Q112-A114 PolarHBondContact O-N 2.78Å; Q112-E115 PolarHBondContact O-N 2.83Å; Q112-C116 WeakPolarHBondContact O-CB 3.33Å; Q112-C116 PolarHBondContact O-N 3.27Å; Q112-C116 PolarHBondContact O-SG 3.49Å
113	T	88.3	Confident	89.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-39.5	172.5	-47.3	0	0	0	0	110.5	L101 I103 F109 Q110 T111 C116 L117	L101-T113 HydrophobicContact CD1-CG2 3.93Å; L101-T113 HydrophobicContact CD2-CG2 3.99Å; L101-T113 HydrophobicContact CG-CG2 4.16Å; I103-T113 HydrophobicContact CD1-CG2 4.13Å; I103-T113 HydrophobicContact CG1-CG2 3.96Å; F109-T113 HydrophobicContact CD1-CG2 3.6Å; F109-T113 HydrophobicContact CE1-CG2 3.65Å; F109-T113 HydrophobicContact CG-CG2 4.3Å; F109-T113 HydrophobicContact CZ-CG2 4.38Å; Q110-T113 PolarHBondContact N-OG1 2.76Å; Q110-T113 WeakPolarHBondContact O-CA 3.39Å; Q110-T113 VanDerWaalsContact O-CB 3.24Å; Q110-T113 WeakPolarHBondContact O-CB 3.31Å; Q110-T113 PolarHBondContact O-N 2.82Å; T111-T113 VanDerWaalsContact C-N 3.25Å; T111-T113 PolarHBondContact O-N 2.81Å; T113-C116 PolarHBondContact O-N 2.71Å; T113-L117 WeakPolarHBondContact O-CB 3.46Å; T113-L117 PolarHBondContact O-N 3.09Å
114	A	86.2	Confident	89.3	Confident	47 Å²	47	25.9 Å²	25.9	39%	0.388	14%	0.143	S	C	.	.	H	α-helix	trans	-67.3	-41.3	176.3	0	0	0	0	0	112.2	Q110 T111 Q112 L117 V118	Q110-A114 PolarHBondContact O-N 2.7Å; T111-A114 WeakPolarHBondContact O-CB 3.35Å; T111-A114 PolarHBondContact O-N 3.01Å; T111-A114 VanDerWaalsContact O-N 3.11Å; Q112-A114 VanDerWaalsContact C-N 3.29Å; Q112-A114 PolarHBondContact O-N 2.78Å; A114-L117 WeakPolarHBondContact O-CB 3.25Å; A114-L117 PolarHBondContact O-N 3Å; A114-V118 WeakPolarHBondContact O-CG2 3.31Å; A114-V118 PolarHBondContact O-N 2.81Å; A114-V118 VanDerWaalsContact O-N 3.13Å
115	E	87	Confident	88.9	Confident	10 Å²	10	31.3 Å²	31.3	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-64.5	-40.9	173.6	-68.4	-172.5	146.3	0	0	111.9	T111 Q112 L117 V118 I119 R417	T111-E115 PolarHBondContact O-N 2.72Å; Q112-E115 PolarHBondContact O-N 2.83Å; E115-L117 VanDerWaalsContact C-N 3.29Å; E115-L117 PolarHBondContact O-N 3.07Å; E115-V118 WeakPolarHBondContact O-CB 3.28Å; E115-V118 PolarHBondContact O-N 2.73Å; E115-I119 WeakPolarHBondContact O-CG1 3.22Å; E115-I119 PolarHBondContact O-N 2.88Å; E115-R417 IonicContact OE1-CZ 3.43Å; E115-R417 PolarHBondContact OE1-N 2.82Å; E115-R417 IonicContact OE1-NE 2.6Å; E115-R417 PolarHBondContact OE1-NE 3.32Å; E115-R417 IonicContact OE1-NH2 2.81Å; E115-R417 PolarHBondContact OE1-NH2 3.3Å; E115-R417 IonicContact OE2-CZ 3.32Å; E115-R417 IonicContact OE2-NE 3.93Å; E115-R417 IonicContact OE2-NH2 3.08Å; E115-R417 PolarHBondContact OE2-NH2 2.95Å
116	C	90	Very high	88.7	Confident	10 Å²	10	35.7 Å²	35.7	7%	0.068	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-37	175.4	-68.9	0	0	0	0	112.3	L9 L101 Q112 T113 I119 G120	L9-C116 HydrophobicContact CB-CB 3.9Å; L9-C116 HydrophobicContact CD2-CB 4.02Å; L101-C116 HydrophobicContact CD1-CB 3.77Å; Q112-C116 WeakPolarHBondContact O-CB 3.33Å; Q112-C116 PolarHBondContact O-N 3.27Å; Q112-C116 PolarHBondContact O-SG 3.49Å; T113-C116 PolarHBondContact O-N 2.71Å; C116-I119 PolarHBondContact O-N 3.33Å; C116-G120 PolarHBondContact O-N 3.37Å
117	L	91.4	Very high	88.8	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-47.8	174	179.1	64.1	0	0	0	110.7	F109 T113 A114 E115 I119 G120 E121 M127 L157 T160 F162	F109-L117 HydrophobicContact CE1-CD2 4.26Å; T113-L117 WeakPolarHBondContact O-CB 3.46Å; T113-L117 PolarHBondContact O-N 3.09Å; A114-L117 WeakPolarHBondContact O-CB 3.25Å; A114-L117 PolarHBondContact O-N 3Å; E115-L117 VanDerWaalsContact C-N 3.29Å; E115-L117 PolarHBondContact O-N 3.07Å; L117-I119 VanDerWaalsContact C-N 3.35Å; L117-I119 PolarHBondContact O-N 3.43Å; L117-G120 WeakPolarHBondContact O-CA 3.15Å; L117-G120 PolarHBondContact O-N 3.35Å; L117-G120 VanDerWaalsContact O-N 3.15Å; L117-E121 WeakPolarHBondContact O-CG 3.46Å; L117-E121 PolarHBondContact O-N 3.45Å; L117-M127 HydrophobicContact CD1-CE 3.68Å; L117-M127 HydrophobicContact CD1-SD 4.01Å; L117-L157 HydrophobicContact CD1-CD2 3.52Å; L117-L157 HydrophobicContact CD2-CD2 3.97Å; L117-L157 HydrophobicContact CG-CD2 4.42Å; L117-T160 HydrophobicContact CD2-CG2 4.36Å; L117-F162 HydrophobicContact CD1-CD2 3.7Å; L117-F162 HydrophobicContact CD1-CE2 4.24Å
118	V	90.6	Very high	88.9	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-59.6	-44.8	175.6	173.4	0	0	0	0	111.4	A114 E115 G120 E121 I122 V321 Y323 I418	A114-V118 WeakPolarHBondContact O-CG2 3.31Å; A114-V118 PolarHBondContact O-N 2.81Å; A114-V118 VanDerWaalsContact O-N 3.13Å; E115-V118 WeakPolarHBondContact O-CB 3.28Å; E115-V118 PolarHBondContact O-N 2.73Å; V118-G120 VanDerWaalsContact C-N 3.27Å; V118-G120 PolarHBondContact O-N 2.89Å; V118-E121 PolarHBondContact O-N 2.94Å; V118-E121 VanDerWaalsContact O-N 3.16Å; V118-I122 HydrophobicContact CG1-CD1 3.78Å; V118-I122 HydrophobicContact CG1-CG1 4.45Å; V118-I122 VanDerWaalsContact O-CG1 3.23Å; V118-I122 WeakPolarHBondContact O-CG1 3.28Å; V118-I122 PolarHBondContact O-N 3.26Å; V118-I122 VanDerWaalsContact O-N 3.09Å; V118-V321 HydrophobicContact CG1-CG1 3.6Å; V118-V321 HydrophobicContact CG1-CG2 4.07Å; V118-V321 HydrophobicContact CG2-CG1 4.21Å; V118-Y323 HydrophobicContact CG2-CD2 3.4Å; V118-Y323 VanDerWaalsContact CG2-CD2 3.4Å; V118-Y323 HydrophobicContact CG2-CE2 3.93Å; V118-Y323 HydrophobicContact CG2-CG 4.21Å; V118-I418 HydrophobicContact CB-CD1 4.38Å; V118-I418 HydrophobicContact CG1-CB 4.32Å; V118-I418 HydrophobicContact CG1-CD1 3.95Å; V118-I418 HydrophobicContact CG1-CG2 4.41Å
119	I	91	Very high	89.2	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-43.3	176.6	-66.7	172.4	0	0	0	110.5	L9 I86 V89 L90 E115 C116 L117 I122 A123 I418	L9-I119 HydrophobicContact CD2-CB 4.37Å; L9-I119 HydrophobicContact CD2-CG2 4.1Å; I86-I119 HydrophobicContact CD1-CD1 3.83Å; V89-I119 HydrophobicContact CB-CD1 4.25Å; V89-I119 HydrophobicContact CG1-CD1 3.61Å; L90-I119 HydrophobicContact CD2-CD1 3.91Å; L90-I119 HydrophobicContact CD2-CG1 3.83Å; L90-I119 HydrophobicContact CG-CD1 4.37Å; E115-I119 WeakPolarHBondContact O-CG1 3.22Å; E115-I119 PolarHBondContact O-N 2.88Å; C116-I119 PolarHBondContact O-N 3.33Å; L117-I119 VanDerWaalsContact C-N 3.35Å; L117-I119 PolarHBondContact O-N 3.43Å; I119-I122 PolarHBondContact O-N 2.97Å; I119-A123 VanDerWaalsContact O-CB 3.29Å; I119-A123 WeakPolarHBondContact O-CB 3.41Å; I119-A123 PolarHBondContact O-N 3.46Å; I119-I418 HydrophobicContact CD1-CD1 4.08Å; I119-I418 HydrophobicContact CG1-CD1 3.42Å; I119-I418 VanDerWaalsContact CG1-CD1 3.42Å
120	G	91.2	Very high	89.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.1	-48	174	0	0	0	0	0	112	C116 L117 V118 I122 A123 C124 F162	C116-G120 PolarHBondContact O-N 3.37Å; L117-G120 WeakPolarHBondContact O-CA 3.15Å; L117-G120 PolarHBondContact O-N 3.35Å; L117-G120 VanDerWaalsContact O-N 3.15Å; V118-G120 VanDerWaalsContact C-N 3.27Å; V118-G120 PolarHBondContact O-N 2.89Å; G120-I122 PolarHBondContact O-N 3.47Å; G120-A123 PolarHBondContact O-N 3.22Å; G120-C124 PolarHBondContact O-N 3.48Å; G120-C124 VanDerWaalsContact O-O 3.13Å; G120-F162 VanDerWaalsContact C-CZ 3.44Å; G120-F162 WeakPolarHBondContact O-CZ 3.09Å
121	E	90.7	Very high	90	Very high	43 Å²	43	23.2 Å²	23.2	20%	0.201	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-32.5	-178.7	-70.2	-178.7	-163.6	0	0	112.6	L117 V118 T160 I161 F162	L117-E121 WeakPolarHBondContact O-CG 3.46Å; L117-E121 PolarHBondContact O-N 3.45Å; V118-E121 PolarHBondContact O-N 2.94Å; V118-E121 VanDerWaalsContact O-N 3.16Å; E121-T160 WeakPolarHBondContact OE1-CB 3.17Å; E121-T160 WeakPolarHBondContact OE1-CG2 3.38Å; E121-I161 HydrophobicContact CB-CD1 4.37Å; E121-I161 HydrophobicContact CB-CG1 4.43Å; E121-I161 HydrophobicContact CG-CG1 4.12Å; E121-F162 HydrophobicContact CB-CE2 4.12Å; E121-F162 HydrophobicContact CG-CD2 3.84Å; E121-F162 HydrophobicContact CG-CE2 3.47Å; E121-F162 VanDerWaalsContact CG-CE2 3.47Å; E121-F162 HydrophobicContact CG-CZ 4.36Å; E121-F162 VanDerWaalsContact N-CE2 3.35Å
122	I	89.6	Confident	90.7	Very high	18 Å²	18	20.4 Å²	20.4	9%	0.092	11%	0.109	C	C	.	.	H	α-helix	trans	-78.9	-41.5	179.9	-63.5	169.8	0	0	0	110.9	V118 I119 G120 V321 L402 I404 I418 Y421	V118-I122 HydrophobicContact CG1-CD1 3.78Å; V118-I122 HydrophobicContact CG1-CG1 4.45Å; V118-I122 VanDerWaalsContact O-CG1 3.23Å; V118-I122 WeakPolarHBondContact O-CG1 3.28Å; V118-I122 PolarHBondContact O-N 3.26Å; V118-I122 VanDerWaalsContact O-N 3.09Å; I119-I122 PolarHBondContact O-N 2.97Å; G120-I122 PolarHBondContact O-N 3.47Å; I122-V321 HydrophobicContact CD1-CG2 4.12Å; I122-L402 HydrophobicContact CG2-CD1 3.78Å; I122-L402 HydrophobicContact CG2-CD2 3.84Å; I122-L402 HydrophobicContact CG2-CG 4.29Å; I122-I404 HydrophobicContact CG2-CD1 4.06Å; I122-I404 HydrophobicContact CG2-CG1 4.13Å; I122-I418 HydrophobicContact CD1-CG2 3.91Å; I122-Y421 HydrophobicContact CB-CG 4.36Å; I122-Y421 HydrophobicContact CD1-CD1 3.67Å; I122-Y421 HydrophobicContact CD1-CE1 4.27Å; I122-Y421 HydrophobicContact CD1-CG 4.06Å; I122-Y421 HydrophobicContact CG1-CD1 3.54Å; I122-Y421 HydrophobicContact CG1-CD2 4.29Å; I122-Y421 HydrophobicContact CG1-CE1 3.77Å; I122-Y421 HydrophobicContact CG1-CE2 4.48Å; I122-Y421 HydrophobicContact CG1-CG 3.81Å; I122-Y421 HydrophobicContact CG2-CD1 4.3Å; I122-Y421 HydrophobicContact CG2-CD2 3.82Å; I122-Y421 HydrophobicContact CG2-CG 3.68Å
123	A	86.6	Confident	91.1	Very high	27 Å²	27	20.8 Å²	20.8	22%	0.223	11%	0.11	C	C	.	.	H	α-helix	trans	-92.5	-31.3	-168.8	0	0	0	0	0	114.2	S93 I119 G120	S93-A123 WeakPolarHBondContact O-CB 3.49Å; I119-A123 VanDerWaalsContact O-CB 3.29Å; I119-A123 WeakPolarHBondContact O-CB 3.41Å; I119-A123 PolarHBondContact O-N 3.46Å; G120-A123 PolarHBondContact O-N 3.22Å
124	C	89.3	Confident	91.2	Very high	8 Å²	8	21 Å²	21	5%	0.054	11%	0.112	C	C	.	.			trans	-134.4	147.7	-166.7	-58	0	0	0	0	112.7	V99 G120	V99-C124 HydrophobicContact CG2-CB 4.35Å; G120-C124 PolarHBondContact O-N 3.48Å; G120-C124 VanDerWaalsContact O-O 3.13Å
125	E	86.6	Confident	91.3	Very high	117 Å²	117	20.9 Å²	20.9	55%	0.547	11%	0.105	S	C	.	.	S	Bend	trans	-83	-23.5	177.9	-63.9	175.1	-163.1	0	0	112.8	H205	E125-H205 IonicContact OE2-CD2 3.65Å; E125-H205 IonicContact OE2-CE1 3.59Å; E125-H205 IonicContact OE2-CG 2.78Å; E125-H205 IonicContact OE2-ND1 3.44Å; E125-H205 IonicContact OE2-NE2 3.58Å
126	K	89.8	Confident	91.5	Very high	97 Å²	97	25.1 Å²	25.1	42%	0.422	13%	0.127	S	C	.	.			trans	-131.5	151.7	-177.5	-66.7	-71.2	-175.1	174.9	0	110.5	I98 S203 H205	I98-K126 HydrophobicContact CD1-CB 4.37Å; K126-S203 VanDerWaalsContact CB-O 3.32Å; K126-S203 WeakPolarHBondContact CB-O 3.46Å; K126-S203 WeakPolarHBondContact CG-O 3.47Å; K126-H205 HydrophobicContact CG-CB 4.31Å
127	M	94	Very high	91.6	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.3	176.5	-179.5	-179.4	67.6	0	0	109.5	V99 L101 L117 V129 L157 F162 S165	V99-M127 HydrophobicContact CB-CG 4.25Å; V99-M127 HydrophobicContact CG1-CG 4.13Å; V99-M127 HydrophobicContact CG1-SD 4.4Å; V99-M127 CarbonylContact O-C 3.59Å; V99-M127 VanDerWaalsContact O-CA 3.28Å; V99-M127 WeakPolarHBondContact O-CA 3.24Å; V99-M127 WeakPolarHBondContact O-CG 3.36Å; L101-M127 HydrophobicContact CB-CG 4.25Å; L101-M127 HydrophobicContact CB-SD 3.69Å; L101-M127 HydrophobicContact CD2-CE 4.24Å; L101-M127 HydrophobicContact CD2-SD 3.89Å; L101-M127 HydrophobicContact CG-SD 4.39Å; L117-M127 HydrophobicContact CD1-CE 3.68Å; L117-M127 HydrophobicContact CD1-SD 4.01Å; M127-V129 HydrophobicContact CE-CG2 3.79Å; M127-L157 HydrophobicContact CE-CD1 4.03Å; M127-L157 HydrophobicContact CE-CD2 3.81Å; M127-F162 HydrophobicContact CB-CD1 3.56Å; M127-F162 HydrophobicContact CB-CD2 4.2Å; M127-F162 HydrophobicContact CB-CE1 3.67Å; M127-F162 HydrophobicContact CB-CE2 4.25Å; M127-F162 HydrophobicContact CB-CG 3.86Å; M127-F162 HydrophobicContact CB-CZ 4.01Å; M127-F162 HydrophobicContact CE-CB 3.74Å; M127-F162 HydrophobicContact CE-CD2 3.75Å; M127-F162 HydrophobicContact CE-CG 3.82Å; M127-F162 HydrophobicContact SD-CD2 4.09Å; M127-F162 HydrophobicContact SD-CE2 4.28Å; M127-F162 HydrophobicContact SD-CG 4.47Å; M127-S165 VanDerWaalsContact O-CB 3.28Å; M127-S165 WeakPolarHBondContact O-CB 3.42Å; M127-S165 PolarHBondContact O-OG 3.47Å
128	L	95.3	Very high	91.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130	167.3	176.6	66.2	0	0	0	108.8	V99 V100 L101 V130 E166 L196 L199 L200	V99-L128 PolarHBondContact O-N 3.1Å; V100-L128 CarbonylContact C-O 3.48Å; V100-L128 VanDerWaalsContact CA-O 3.31Å; V100-L128 WeakPolarHBondContact CA-O 3.24Å; V100-L128 HydrophobicContact CG2-CB 4.31Å; V100-L128 HydrophobicContact CG2-CD2 4.29Å; L101-L128 PolarHBondContact N-O 3.43Å; L128-V130 HydrophobicContact CD2-CG2 4.39Å; L128-V130 HydrophobicContact CG-CG2 4.33Å; L128-E166 HydrophobicContact CD1-CB 3.75Å; L128-L196 HydrophobicContact CD2-CD1 3.69Å; L128-L199 HydrophobicContact CD1-CB 4.1Å; L128-L200 HydrophobicContact CD2-CB 3.91Å; L128-L200 HydrophobicContact CD2-CD1 3.9Å
129	V	96.2	Very high	91.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136	173	-177	0	0	0	0	109.2	I103 M127 I153 L157 E166 I167 A168	I103-V129 HydrophobicContact CD1-CG1 3.74Å; I103-V129 HydrophobicContact CG1-CG1 4.32Å; M127-V129 HydrophobicContact CE-CG2 3.79Å; V129-I153 HydrophobicContact CG1-CD1 4.28Å; V129-I153 HydrophobicContact CG1-CG2 4.21Å; V129-I153 HydrophobicContact CG2-CG2 4.37Å; V129-L157 HydrophobicContact CG2-CD1 4.03Å; V129-E166 PolarHBondContact N-O 2.93Å; V129-I167 HydrophobicContact CB-CG1 4.16Å; V129-I167 HydrophobicContact CB-CG2 4.3Å; V129-I167 HydrophobicContact CG1-CG2 4.25Å; V129-I167 CarbonylContact O-C 3.42Å; V129-I167 WeakPolarHBondContact O-CA 3.48Å; V129-A168 PolarHBondContact O-N 3.39Å
130	V	96.4	Very high	91.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.1	177.3	177.2	0	0	0	0	109.1	L19 V100 L101 I103 L128 N132 A168 I170 L196	L19-V130 HydrophobicContact CD1-CG1 4.33Å; L19-V130 HydrophobicContact CD2-CB 4.38Å; L19-V130 HydrophobicContact CD2-CG1 4.05Å; L19-V130 HydrophobicContact CD2-CG2 4.38Å; V100-V130 HydrophobicContact CG1-CB 4.3Å; V100-V130 HydrophobicContact CG1-CG2 3.52Å; L101-V130 PolarHBondContact O-N 3.37Å; I103-V130 PolarHBondContact N-O 2.81Å; L128-V130 HydrophobicContact CD2-CG2 4.39Å; L128-V130 HydrophobicContact CG-CG2 4.33Å; V130-N132 PolarHBondContact O-N 3.2Å; V130-A168 HydrophobicContact CG2-CB 4.33Å; V130-I170 HydrophobicContact CG1-CG2 3.44Å; V130-I170 VanDerWaalsContact CG1-CG2 3.44Å; V130-L196 HydrophobicContact CG2-CD1 3.61Å
131	L	96	Very high	91.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	107.1	168.5	-68.5	179.5	0	0	0	108.5	I103 V105 C134 I146 M149 K150 I153 I167 A168 I170	I103-L131 HydrophobicContact CB-CD2 4.22Å; I103-L131 HydrophobicContact CG2-CD2 4.21Å; V105-L131 HydrophobicContact CB-CB 4.37Å; V105-L131 HydrophobicContact CB-CD2 4.48Å; V105-L131 HydrophobicContact CG2-CB 4.31Å; V105-L131 HydrophobicContact CG2-CD1 4.32Å; V105-L131 HydrophobicContact CG2-CD2 4.28Å; L131-C134 PolarHBondContact O-SG 3.42Å; L131-I146 HydrophobicContact CD1-CG2 4.19Å; L131-M149 HydrophobicContact CD2-CG 3.92Å; L131-K150 HydrophobicContact CD1-CG 3.79Å; L131-I153 HydrophobicContact CD2-CD1 3.43Å; L131-I153 VanDerWaalsContact CD2-CD1 3.43Å; L131-I153 HydrophobicContact CG-CD1 4.31Å; L131-I167 HydrophobicContact CD1-CG2 3.91Å; L131-I167 HydrophobicContact CG-CG2 3.84Å; L131-A168 PolarHBondContact N-O 2.91Å; L131-I170 PolarHBondContact O-N 2.86Å
132	N	94.5	Very high	91.5	Very high	4 Å²	4	52 Å²	52	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	160.6	179.1	-167.4	26.5	0	0	0	111.5	S14 V102 I103 V105 V130 I170 A172	S14-N132 PolarHBondContact O-ND2 3.25Å; V102-N132 HydrophobicContact CG1-CB 3.9Å; I103-N132 PolarHBondContact O-N 2.86Å; V105-N132 WeakPolarHBondContact CB-O 3.49Å; V105-N132 WeakPolarHBondContact CG1-O 3.4Å; V105-N132 PolarHBondContact N-O 3.08Å; V130-N132 PolarHBondContact O-N 3.2Å; N132-I170 CarbonylContact C-O 3.46Å; N132-I170 VanDerWaalsContact CA-O 3.26Å; N132-I170 WeakPolarHBondContact CA-O 3.23Å; N132-I170 HydrophobicContact CB-CG2 4.34Å; N132-I170 PolarHBondContact OD1-O 3.35Å; N132-A172 WeakPolarHBondContact OD1-CB 2.98Å; N132-A172 PolarHBondContact OD1-N 2.95Å
133	K	92.1	Very high	91.6	Very high	45 Å²	45	57 Å²	57	20%	0.196	29%	0.285	C	S	.	.			trans	68.3	39.5	179.2	-46.5	-175	-170.4	170.2	0	114	D13 D104 V105 D135 L136 I170	D13-K133 WeakPolarHBondContact O-CE 3.29Å; D13-K133 PolarHBondContact O-NZ 3.26Å; D104-K133 WeakPolarHBondContact OD2-CE 3.48Å; D104-K133 IonicContact OD2-NZ 3.59Å; D104-K133 PolarHBondContact OD2-NZ 2.85Å; V105-K133 WeakPolarHBondContact CG1-O 3.45Å; K133-D135 VanDerWaalsContact CA-OD1 3.31Å; K133-D135 WeakPolarHBondContact CA-OD1 3.3Å; K133-D135 PolarHBondContact O-N 2.9Å; K133-L136 HydrophobicContact CB-CD1 3.88Å; K133-L136 HydrophobicContact CB-CG 4.11Å; K133-L136 HydrophobicContact CD-CD1 3.77Å; K133-L136 HydrophobicContact CG-CD1 4.41Å; K133-L136 PolarHBondContact O-N 3.04Å; K133-I170 PolarHBondContact N-O 3.02Å; K133-I170 VanDerWaalsContact N-O 3.12Å
134	C	90.9	Very high	92	Very high	6 Å²	6	62.7 Å²	62.7	4%	0.041	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-64.2	-24.2	178	-59.2	0	0	0	0	112.3	L131 L136 L137 R142 I146 I170 S171	L131-C134 PolarHBondContact O-SG 3.42Å; C134-L136 VanDerWaalsContact C-N 3.26Å; C134-L136 PolarHBondContact O-N 2.87Å; C134-L137 PolarHBondContact O-N 2.75Å; C134-R142 PolarHBondContact O-NE 3.08Å; C134-I146 HydrophobicContact CB-CD1 4.27Å; C134-I170 PolarHBondContact N-O 3.21Å; C134-I170 PolarHBondContact SG-O 3.43Å; C134-S171 WeakPolarHBondContact CB-OG 3.44Å; C134-S171 PolarHBondContact N-OG 2.81Å
135	D	89.2	Confident	92.2	Very high	43 Å²	43	64.4 Å²	64.4	23%	0.23	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-60	-30.6	173.2	65.6	-58.4	0	0	0	113.6	K133 L137 R142 S171 P174 G175	K133-D135 VanDerWaalsContact CA-OD1 3.31Å; K133-D135 WeakPolarHBondContact CA-OD1 3.3Å; K133-D135 PolarHBondContact O-N 2.9Å; D135-L137 PolarHBondContact O-N 3.09Å; D135-R142 PolarHBondContact O-NH2 3.39Å; D135-S171 PolarHBondContact N-OG 3.2Å; D135-P174 HydrophobicContact CB-CB 4.41Å; D135-P174 WeakPolarHBondContact OD2-CA 3.4Å; D135-G175 PolarHBondContact OD2-N 3.23Å
136	L	91.1	Very high	92.5	Very high	100 Å²	100	59 Å²	59	52%	0.524	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-75.6	-10.2	180	-62.1	-176.1	0	0	0	114	T106 K133 C134	T106-L136 HydrophobicContact CG2-CB 3.91Å; T106-L136 HydrophobicContact CG2-CD1 4.46Å; K133-L136 HydrophobicContact CB-CD1 3.88Å; K133-L136 HydrophobicContact CB-CG 4.11Å; K133-L136 HydrophobicContact CD-CD1 3.77Å; K133-L136 HydrophobicContact CG-CD1 4.41Å; K133-L136 PolarHBondContact O-N 3.04Å; C134-L136 VanDerWaalsContact C-N 3.26Å; C134-L136 PolarHBondContact O-N 2.87Å
137	L	91.3	Very high	92.8	Very high	24 Å²	24	59.1 Å²	59.1	13%	0.126	30%	0.296	C	S	.	.	S	Bend	trans	-83	140.9	175.3	-60.8	172.6	0	0	0	110.2	V105 T106 C134 D135 E139 R142 I146	V105-L137 HydrophobicContact CG1-CD1 3.77Å; V105-L137 HydrophobicContact CG1-CD2 4.3Å; V105-L137 HydrophobicContact CG1-CG 3.93Å; V105-L137 HydrophobicContact CG2-CD1 3.91Å; T106-L137 HydrophobicContact CG2-CD2 4.11Å; C134-L137 PolarHBondContact O-N 2.75Å; D135-L137 PolarHBondContact O-N 3.09Å; L137-E139 PolarHBondContact O-N 2.83Å; L137-R142 HydrophobicContact CB-CB 4.24Å; L137-R142 HydrophobicContact CB-CG 4.06Å; L137-R142 HydrophobicContact CD1-CG 4.23Å; L137-R142 PolarHBondContact O-NE 3.16Å; L137-R142 PolarHBondContact O-NH2 2.89Å; L137-I146 HydrophobicContact CD1-CD1 4.22Å; L137-I146 HydrophobicContact CD1-CG1 3.64Å
138	N	91	Very high	92.8	Very high	117 Å²	117	66.9 Å²	66.9	63%	0.626	33%	0.33	S	S	*	.			trans	-53.3	126.4	173.8	-69.7	-17.6	0	0	0	110.3	N140 Q141 R142	N138-N140 VanDerWaalsContact C-N 3.27Å; N138-N140 PolarHBondContact O-N 2.87Å; N138-Q141 CarbonylContact O-C 3.48Å; N138-Q141 PolarHBondContact O-N 2.94Å; N138-R142 WeakPolarHBondContact O-CB 3.4Å; N138-R142 PolarHBondContact O-N 3.31Å
139	E	89.4	Confident	92.7	Very high	151 Å²	151	68 Å²	68	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-51.3	-45.4	-175	-68.3	-177.6	163.6	0	0	112.6	L137 Q141 R142	L137-E139 PolarHBondContact O-N 2.83Å; E139-Q141 PolarHBondContact O-N 2.95Å; E139-R142 PolarHBondContact O-N 3.09Å
140	N	91.2	Very high	92.7	Very high	161 Å²	161	69.8 Å²	69.8	86%	0.861	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-67.2	-19	-178	-61.5	-13.8	0	0	0	114.5	N138	N138-N140 VanDerWaalsContact C-N 3.27Å; N138-N140 PolarHBondContact O-N 2.87Å
141	Q	90.9	Very high	92.6	Very high	107 Å²	107	77 Å²	77	50%	0.5	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-123.7	7.6	-175.8	-66.9	179.7	-9.8	0	0	112.4	N138 E139 S145	N138-Q141 CarbonylContact O-C 3.48Å; N138-Q141 PolarHBondContact O-N 2.94Å; E139-Q141 PolarHBondContact O-N 2.95Å; Q141-S145 VanDerWaalsContact O-CB 3.28Å; Q141-S145 WeakPolarHBondContact O-CB 3.36Å; Q141-S145 PolarHBondContact O-N 3.21Å; Q141-S145 PolarHBondContact O-OG 2.84Å
142	R	90.7	Very high	92.5	Very high	64 Å²	64	83.7 Å²	83.7	24%	0.242	40%	0.4	C	S	.	.	H	α-helix	trans	-60.6	-52.8	-172.6	-179	174.8	-67.9	143.8	2	110.5	C134 D135 L137 N138 E139 E144 S145 I146	C134-R142 PolarHBondContact O-NE 3.08Å; D135-R142 PolarHBondContact O-NH2 3.39Å; L137-R142 HydrophobicContact CB-CB 4.24Å; L137-R142 HydrophobicContact CB-CG 4.06Å; L137-R142 HydrophobicContact CD1-CG 4.23Å; L137-R142 PolarHBondContact O-NE 3.16Å; L137-R142 PolarHBondContact O-NH2 2.89Å; N138-R142 WeakPolarHBondContact O-CB 3.4Å; N138-R142 PolarHBondContact O-N 3.31Å; E139-R142 PolarHBondContact O-N 3.09Å; R142-E144 PolarHBondContact O-N 2.8Å; R142-S145 PolarHBondContact O-N 2.88Å; R142-I146 HydrophobicContact CG-CD1 3.72Å; R142-I146 HydrophobicContact CG-CG1 4.49Å; R142-I146 WeakPolarHBondContact O-CB 3.49Å; R142-I146 VanDerWaalsContact O-CG1 3.26Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.89Å
143	D	92	Very high	92.4	Very high	123 Å²	123	83.5 Å²	83.5	66%	0.658	40%	0.399	S	S	*	.	H	α-helix	trans	-62	-45.4	-177.6	-64.7	-19.2	0	0	0	112	S145 I146 Q147	D143-S145 VanDerWaalsContact C-N 3.34Å; D143-S145 PolarHBondContact O-N 2.94Å; D143-I146 PolarHBondContact O-N 3.35Å; D143-Q147 WeakPolarHBondContact O-CB 3.39Å; D143-Q147 VanDerWaalsContact O-CG 3.24Å; D143-Q147 WeakPolarHBondContact O-CG 3.47Å; D143-Q147 PolarHBondContact O-N 3.28Å
144	E	93.7	Very high	92.5	Very high	147 Å²	147	84.9 Å²	84.9	69%	0.687	41%	0.408	S	S	*	.	H	α-helix	trans	-61.9	-42.4	177.4	-67.3	-170.7	163.4	0	0	112.1	R142 Q147 K148	R142-E144 PolarHBondContact O-N 2.8Å; E144-Q147 PolarHBondContact O-N 2.91Å; E144-K148 WeakPolarHBondContact O-CB 3.49Å; E144-K148 PolarHBondContact O-N 3Å
145	S	93.4	Very high	92.5	Very high	45 Å²	45	92 Å²	92	32%	0.315	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-43.6	179.4	-62.7	0	0	0	0	111.5	Q141 R142 D143 K148 M149	Q141-S145 VanDerWaalsContact O-CB 3.28Å; Q141-S145 WeakPolarHBondContact O-CB 3.36Å; Q141-S145 PolarHBondContact O-N 3.21Å; Q141-S145 PolarHBondContact O-OG 2.84Å; R142-S145 PolarHBondContact O-N 2.88Å; D143-S145 VanDerWaalsContact C-N 3.34Å; D143-S145 PolarHBondContact O-N 2.94Å; S145-K148 PolarHBondContact O-N 3.08Å; S145-M149 WeakPolarHBondContact O-CB 3.2Å; S145-M149 PolarHBondContact O-N 2.85Å
146	I	94.3	Very high	92.6	Very high	4 Å²	4	92.6 Å²	92.6	2%	0.021	44%	0.443	C	S	.	.	H	α-helix	trans	-61.9	-48.5	175.5	-71.3	172.1	0	0	0	110.2	V105 L131 C134 L137 R142 D143 K148 M149 K150 E169	V105-I146 HydrophobicContact CG2-CG1 4.23Å; L131-I146 HydrophobicContact CD1-CG2 4.19Å; C134-I146 HydrophobicContact CB-CD1 4.27Å; L137-I146 HydrophobicContact CD1-CD1 4.22Å; L137-I146 HydrophobicContact CD1-CG1 3.64Å; R142-I146 HydrophobicContact CG-CD1 3.72Å; R142-I146 HydrophobicContact CG-CG1 4.49Å; R142-I146 WeakPolarHBondContact O-CB 3.49Å; R142-I146 VanDerWaalsContact O-CG1 3.26Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.89Å; D143-I146 PolarHBondContact O-N 3.35Å; I146-K148 VanDerWaalsContact C-N 3.32Å; I146-K148 PolarHBondContact O-N 2.85Å; I146-M149 PolarHBondContact O-N 2.8Å; I146-M149 VanDerWaalsContact O-N 3.12Å; I146-K150 HydrophobicContact CG2-CD 4.24Å; I146-K150 HydrophobicContact CG2-CG 4.41Å; I146-K150 WeakPolarHBondContact O-CG 3.05Å; I146-K150 PolarHBondContact O-N 3.26Å; I146-E169 VanDerWaalsContact CG2-CD 3.41Å; I146-E169 HydrophobicContact CG2-CG 3.93Å; I146-E169 VanDerWaalsContact CG2-OE1 3.26Å; I146-E169 WeakPolarHBondContact CG2-OE1 3.31Å
147	Q	94.5	Very high	92.7	Very high	98 Å²	98	87.8 Å²	87.8	46%	0.458	42%	0.418	S	S	.	.	H	α-helix	trans	-62	-40.2	179.3	-71.6	-60.5	-26.6	0	0	112.2	D143 E144 M149 K150 K151	D143-Q147 WeakPolarHBondContact O-CB 3.39Å; D143-Q147 VanDerWaalsContact O-CG 3.24Å; D143-Q147 WeakPolarHBondContact O-CG 3.47Å; D143-Q147 PolarHBondContact O-N 3.28Å; E144-Q147 PolarHBondContact O-N 2.91Å; Q147-M149 VanDerWaalsContact C-N 3.34Å; Q147-K150 PolarHBondContact O-N 3.47Å; Q147-K151 WeakPolarHBondContact O-CG 3.41Å; Q147-K151 PolarHBondContact O-N 3.31Å
148	K	94.5	Very high	92.7	Very high	166 Å²	166	92.6 Å²	92.6	72%	0.722	44%	0.44	S	S	*	.	H	α-helix	trans	-62.5	-42.2	174	-172.7	177.5	-178.9	178.9	0	111.4	E144 S145 I146 R152	E144-K148 WeakPolarHBondContact O-CB 3.49Å; E144-K148 PolarHBondContact O-N 3Å; S145-K148 PolarHBondContact O-N 3.08Å; I146-K148 VanDerWaalsContact C-N 3.32Å; I146-K148 PolarHBondContact O-N 2.85Å; K148-R152 PolarHBondContact O-N 3.03Å; K148-R152 VanDerWaalsContact O-N 3.12Å
149	M	94.5	Very high	92.4	Very high	23 Å²	23	94.2 Å²	94.2	11%	0.113	45%	0.449	C	S	.	.	H	α-helix	trans	-66.2	-44.7	177	-170.3	58.2	77	0	0	111.7	V105 L131 S145 I146 Q147 K151 R152 I153	V105-M149 HydrophobicContact CG2-CB 4.44Å; V105-M149 HydrophobicContact CG2-CG 4.41Å; V105-M149 WeakPolarHBondContact O-CE 3.13Å; L131-M149 HydrophobicContact CD2-CG 3.92Å; S145-M149 WeakPolarHBondContact O-CB 3.2Å; S145-M149 PolarHBondContact O-N 2.85Å; I146-M149 PolarHBondContact O-N 2.8Å; I146-M149 VanDerWaalsContact O-N 3.12Å; Q147-M149 VanDerWaalsContact C-N 3.34Å; M149-K151 PolarHBondContact O-N 2.69Å; M149-R152 WeakPolarHBondContact O-CB 3.49Å; M149-R152 PolarHBondContact O-N 2.9Å; M149-R152 VanDerWaalsContact O-N 3.12Å; M149-I153 HydrophobicContact CG-CD1 3.95Å; M149-I153 HydrophobicContact CG-CG1 4.47Å; M149-I153 WeakPolarHBondContact O-CG1 2.91Å; M149-I153 PolarHBondContact O-N 3.4Å
150	K	94.9	Very high	92.4	Very high	38 Å²	38	87.6 Å²	87.6	17%	0.165	42%	0.419	C	S	.	.	H	α-helix	trans	-54	-49.9	174.5	-77.3	-175.4	164.8	-175	0	111.8	L131 I146 Q147 R152 I153 L154 I167 E169	L131-K150 HydrophobicContact CD1-CG 3.79Å; I146-K150 HydrophobicContact CG2-CD 4.24Å; I146-K150 HydrophobicContact CG2-CG 4.41Å; I146-K150 WeakPolarHBondContact O-CG 3.05Å; I146-K150 PolarHBondContact O-N 3.26Å; Q147-K150 PolarHBondContact O-N 3.47Å; K150-R152 VanDerWaalsContact C-N 3.32Å; K150-R152 PolarHBondContact O-N 2.86Å; K150-I153 PolarHBondContact O-N 3.11Å; K150-L154 WeakPolarHBondContact O-CG 3.22Å; K150-L154 PolarHBondContact O-N 2.76Å; K150-I167 HydrophobicContact CB-CD1 4.22Å; K150-I167 HydrophobicContact CG-CB 4.42Å; K150-I167 HydrophobicContact CG-CD1 4.15Å; K150-I167 HydrophobicContact CG-CG2 4.05Å; K150-I167 PolarHBondContact NZ-O 3.38Å; K150-E169 WeakPolarHBondContact CE-OE1 3.33Å; K150-E169 IonicContact NZ-OE1 2.58Å; K150-E169 PolarHBondContact NZ-OE1 3.25Å
151	K	94	Very high	92.3	Very high	151 Å²	151	84.8 Å²	84.8	66%	0.657	40%	0.402	S	S	*	.	H	α-helix	trans	-58.4	-42.3	176.5	-73.8	178.5	-178.7	177.9	0	112.3	Q147 M149 L154 K155	Q147-K151 WeakPolarHBondContact O-CG 3.41Å; Q147-K151 PolarHBondContact O-N 3.31Å; M149-K151 PolarHBondContact O-N 2.69Å; K151-L154 PolarHBondContact O-N 3.38Å; K151-K155 WeakPolarHBondContact O-CB 3.38Å; K151-K155 PolarHBondContact O-N 3.41Å
152	R	93.8	Very high	92.4	Very high	141 Å²	141	79.8 Å²	79.8	53%	0.532	38%	0.379	S	S	.	.	H	α-helix	trans	-65	-40.2	178	-174.8	179.2	174.6	-171.7	-2.6	112.1	K148 M149 K150 T156	K148-R152 PolarHBondContact O-N 3.03Å; K148-R152 VanDerWaalsContact O-N 3.12Å; M149-R152 WeakPolarHBondContact O-CB 3.49Å; M149-R152 PolarHBondContact O-N 2.9Å; M149-R152 VanDerWaalsContact O-N 3.12Å; K150-R152 VanDerWaalsContact C-N 3.32Å; K150-R152 PolarHBondContact O-N 2.86Å; R152-T156 PolarHBondContact O-N 3Å; R152-T156 VanDerWaalsContact O-N 3.17Å; R152-T156 PolarHBondContact O-OG1 3.08Å
153	I	93.4	Very high	92.4	Very high	0 Å²	0	82.9 Å²	82.9	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-65.1	-50.8	176.7	-70.3	168.4	0	0	0	109.8	I103 F109 V129 L131 M149 K150 K155 T156 L157 I167	I103-I153 HydrophobicContact CD1-CD1 3.83Å; I103-I153 HydrophobicContact CD1-CG1 4.21Å; F109-I153 HydrophobicContact CD2-CG1 4.08Å; F109-I153 HydrophobicContact CE2-CB 4.19Å; F109-I153 HydrophobicContact CE2-CG1 3.81Å; F109-I153 HydrophobicContact CE2-CG2 4.08Å; V129-I153 HydrophobicContact CG1-CD1 4.28Å; V129-I153 HydrophobicContact CG1-CG2 4.21Å; V129-I153 HydrophobicContact CG2-CG2 4.37Å; L131-I153 HydrophobicContact CD2-CD1 3.43Å; L131-I153 VanDerWaalsContact CD2-CD1 3.43Å; L131-I153 HydrophobicContact CG-CD1 4.31Å; M149-I153 HydrophobicContact CG-CD1 3.95Å; M149-I153 HydrophobicContact CG-CG1 4.47Å; M149-I153 WeakPolarHBondContact O-CG1 2.91Å; M149-I153 PolarHBondContact O-N 3.4Å; K150-I153 PolarHBondContact O-N 3.11Å; I153-K155 VanDerWaalsContact C-N 3.3Å; I153-K155 PolarHBondContact O-N 3.23Å; I153-T156 WeakPolarHBondContact O-CA 2.99Å; I153-T156 VanDerWaalsContact O-CB 3.31Å; I153-T156 WeakPolarHBondContact O-CB 3.35Å; I153-T156 PolarHBondContact O-N 2.78Å; I153-L157 HydrophobicContact CG2-CD1 3.86Å; I153-L157 HydrophobicContact CG2-CG 4.28Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.26Å; I153-I167 HydrophobicContact CB-CD1 4.21Å; I153-I167 HydrophobicContact CG2-CD1 3.87Å
154	L	93.1	Very high	92.2	Very high	73 Å²	73	84.5 Å²	84.5	38%	0.382	40%	0.398	S	S	.	.	H	α-helix	trans	-57.5	-42.9	179.7	-70.6	172.1	0	0	0	111.9	K150 K151 T156 L157 E158 I167	K150-L154 WeakPolarHBondContact O-CG 3.22Å; K150-L154 PolarHBondContact O-N 2.76Å; K151-L154 PolarHBondContact O-N 3.38Å; L154-T156 PolarHBondContact O-N 3.28Å; L154-L157 PolarHBondContact O-N 2.79Å; L154-L157 VanDerWaalsContact O-N 3.13Å; L154-E158 PolarHBondContact O-N 2.89Å; L154-I167 HydrophobicContact CD2-CD1 4.01Å; L154-I167 HydrophobicContact CG-CD1 3.91Å
155	K	92.7	Very high	92.2	Very high	157 Å²	157	78.1 Å²	78.1	68%	0.683	37%	0.369	S	S	*	.	H	α-helix	trans	-60.5	-33.1	173.9	-172	175.2	-176.3	176.7	0	113	K151 I153	K151-K155 WeakPolarHBondContact O-CB 3.38Å; K151-K155 PolarHBondContact O-N 3.41Å; I153-K155 VanDerWaalsContact C-N 3.3Å; I153-K155 PolarHBondContact O-N 3.23Å
156	T	90.9	Very high	92.1	Very high	54 Å²	54	79.4 Å²	79.4	33%	0.331	37%	0.371	S	S	.	.	H	α-helix	trans	-73.8	-35	176.8	-52.1	0	0	0	0	111.3	F109 R152 I153 L154 E158	F109-T156 HydrophobicContact CD2-CG2 4.41Å; F109-T156 HydrophobicContact CE1-CG2 4.25Å; F109-T156 HydrophobicContact CE2-CG2 4.12Å; F109-T156 HydrophobicContact CZ-CG2 4.05Å; R152-T156 PolarHBondContact O-N 3Å; R152-T156 VanDerWaalsContact O-N 3.17Å; R152-T156 PolarHBondContact O-OG1 3.08Å; I153-T156 WeakPolarHBondContact O-CA 2.99Å; I153-T156 VanDerWaalsContact O-CB 3.31Å; I153-T156 WeakPolarHBondContact O-CB 3.35Å; I153-T156 PolarHBondContact O-N 2.78Å; L154-T156 PolarHBondContact O-N 3.28Å; T156-E158 VanDerWaalsContact C-N 3.35Å
157	L	92.6	Very high	92.2	Very high	0 Å²	0	80 Å²	80	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-82.6	-10.1	179.6	-59.6	179	0	0	0	113.6	F109 L117 M127 V129 I153 L154 N159 T160 F162 K163	F109-L157 HydrophobicContact CZ-CD2 4.44Å; L117-L157 HydrophobicContact CD1-CD2 3.52Å; L117-L157 HydrophobicContact CD2-CD2 3.97Å; L117-L157 HydrophobicContact CG-CD2 4.42Å; M127-L157 HydrophobicContact CE-CD1 4.03Å; M127-L157 HydrophobicContact CE-CD2 3.81Å; V129-L157 HydrophobicContact CG2-CD1 4.03Å; I153-L157 HydrophobicContact CG2-CD1 3.86Å; I153-L157 HydrophobicContact CG2-CG 4.28Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.26Å; L154-L157 PolarHBondContact O-N 2.79Å; L154-L157 VanDerWaalsContact O-N 3.13Å; L157-N159 PolarHBondContact O-N 3.22Å; L157-N159 VanDerWaalsContact O-N 3.16Å; L157-T160 PolarHBondContact O-N 3.01Å; L157-T160 PolarHBondContact O-OG1 2.61Å; L157-F162 HydrophobicContact CD2-CB 4.41Å; L157-K163 WeakPolarHBondContact O-CA 3.42Å; L157-K163 PolarHBondContact O-N 2.99Å
158	E	91	Very high	92.2	Very high	125 Å²	125	75.5 Å²	75.5	58%	0.584	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.4	-174.1	-170	170.8	-163.7	0	0	113.3	L154 T156 T160	L154-E158 PolarHBondContact O-N 2.89Å; T156-E158 VanDerWaalsContact C-N 3.35Å; E158-T160 VanDerWaalsContact C-N 3.34Å
159	N	85.8	Confident	92.1	Very high	151 Å²	151	70.4 Å²	70.4	81%	0.807	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	11.3	180	-64	-43.1	0	0	0	113.8	L157	L157-N159 PolarHBondContact O-N 3.22Å; L157-N159 VanDerWaalsContact O-N 3.16Å
160	T	88.8	Confident	92	Very high	12 Å²	12	69.3 Å²	69.3	7%	0.074	33%	0.326	C	S	.	.	S	Bend	trans	-116.1	171.2	-177.7	80.2	0	0	0	0	111.3	L117 E121 L157 E158 F162 K163	L117-T160 HydrophobicContact CD2-CG2 4.36Å; E121-T160 WeakPolarHBondContact OE1-CB 3.17Å; E121-T160 WeakPolarHBondContact OE1-CG2 3.38Å; L157-T160 PolarHBondContact O-N 3.01Å; L157-T160 PolarHBondContact O-OG1 2.61Å; E158-T160 VanDerWaalsContact C-N 3.34Å; T160-F162 PolarHBondContact O-N 2.84Å; T160-F162 VanDerWaalsContact O-N 3.14Å; T160-F162 WeakPolarHBondContact OG1-CB 3.31Å; T160-F162 PolarHBondContact OG1-N 3.05Å; T160-F162 VanDerWaalsContact OG1-N 3.07Å; T160-K163 PolarHBondContact O-N 3.28Å
161	I	89.3	Confident	91.7	Very high	101 Å²	101	67.9 Å²	67.9	52%	0.518	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.1	172.3	65.6	168.7	0	0	0	112.4	E121	E121-I161 HydrophobicContact CB-CD1 4.37Å; E121-I161 HydrophobicContact CB-CG1 4.43Å; E121-I161 HydrophobicContact CG-CG1 4.12Å
162	F	92.3	Very high	91.3	Very high	3 Å²	3	60.8 Å²	60.8	1%	0.013	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	19	-176.4	-57.5	-49.2	0	0	0	114.1	L117 G120 E121 M127 L157 T160 Q164 S165	L117-F162 HydrophobicContact CD1-CD2 3.7Å; L117-F162 HydrophobicContact CD1-CE2 4.24Å; G120-F162 VanDerWaalsContact C-CZ 3.44Å; G120-F162 WeakPolarHBondContact O-CZ 3.09Å; E121-F162 HydrophobicContact CB-CE2 4.12Å; E121-F162 HydrophobicContact CG-CD2 3.84Å; E121-F162 HydrophobicContact CG-CE2 3.47Å; E121-F162 VanDerWaalsContact CG-CE2 3.47Å; E121-F162 HydrophobicContact CG-CZ 4.36Å; E121-F162 VanDerWaalsContact N-CE2 3.35Å; M127-F162 HydrophobicContact CB-CD1 3.56Å; M127-F162 HydrophobicContact CB-CD2 4.2Å; M127-F162 HydrophobicContact CB-CE1 3.67Å; M127-F162 HydrophobicContact CB-CE2 4.25Å; M127-F162 HydrophobicContact CB-CG 3.86Å; M127-F162 HydrophobicContact CB-CZ 4.01Å; M127-F162 HydrophobicContact CE-CB 3.74Å; M127-F162 HydrophobicContact CE-CD2 3.75Å; M127-F162 HydrophobicContact CE-CG 3.82Å; M127-F162 HydrophobicContact SD-CD2 4.09Å; M127-F162 HydrophobicContact SD-CE2 4.28Å; M127-F162 HydrophobicContact SD-CG 4.47Å; L157-F162 HydrophobicContact CD2-CB 4.41Å; T160-F162 PolarHBondContact O-N 2.84Å; T160-F162 VanDerWaalsContact O-N 3.14Å; T160-F162 WeakPolarHBondContact OG1-CB 3.31Å; T160-F162 PolarHBondContact OG1-N 3.05Å; T160-F162 VanDerWaalsContact OG1-N 3.07Å; F162-Q164 PolarHBondContact O-N 3.01Å; F162-S165 WeakPolarHBondContact CB-OG 3.31Å; F162-S165 WeakPolarHBondContact O-CB 3.45Å; F162-S165 PolarHBondContact O-N 2.89Å; F162-S165 PolarHBondContact O-OG 3.12Å
163	K	90.5	Very high	90.7	Very high	128 Å²	128	55.1 Å²	55.1	56%	0.557	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-22.2	177.3	63.2	176	-177.3	-176.1	0	115.3	L157 T160	L157-K163 WeakPolarHBondContact O-CA 3.42Å; L157-K163 PolarHBondContact O-N 2.99Å; T160-K163 PolarHBondContact O-N 3.28Å
164	Q	88.5	Confident	89.9	Confident	157 Å²	157	57.8 Å²	57.8	73%	0.734	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	20.1	179.7	-75.2	175.7	-15.8	0	0	112.8	F162 E166	F162-Q164 PolarHBondContact O-N 3.01Å; Q164-E166 PolarHBondContact O-N 2.86Å
165	S	92.5	Very high	88.9	Confident	13 Å²	13	57.6 Å²	57.6	9%	0.091	31%	0.306	C	S	.	.			trans	-66.6	133.9	177.7	-81.8	0	0	0	0	112.1	M127 F162	M127-S165 VanDerWaalsContact O-CB 3.28Å; M127-S165 WeakPolarHBondContact O-CB 3.42Å; M127-S165 PolarHBondContact O-OG 3.47Å; F162-S165 WeakPolarHBondContact CB-OG 3.31Å; F162-S165 WeakPolarHBondContact O-CB 3.45Å; F162-S165 PolarHBondContact O-N 2.89Å; F162-S165 PolarHBondContact O-OG 3.12Å
166	E	93.2	Very high	87.5	Confident	73 Å²	73	53.1 Å²	53.1	34%	0.341	31%	0.305	S	S	.	.			trans	-67.1	150.6	171.3	-69.2	-75.5	-177	0	0	110.5	L128 V129 Q164 L199 R202	L128-E166 HydrophobicContact CD1-CB 3.75Å; V129-E166 PolarHBondContact N-O 2.93Å; Q164-E166 PolarHBondContact O-N 2.86Å; E166-L199 HydrophobicContact CB-CD2 4.38Å; E166-L199 HydrophobicContact CG-CD2 4.34Å; E166-R202 IonicContact OE1-NH1 4Å
167	I	94.6	Very high	86.1	Confident	17 Å²	17	55.4 Å²	55.4	9%	0.087	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	109.9	178.3	-48.7	-177.4	0	0	0	110	V129 L131 K150 I153 L154	V129-I167 HydrophobicContact CB-CG1 4.16Å; V129-I167 HydrophobicContact CB-CG2 4.3Å; V129-I167 HydrophobicContact CG1-CG2 4.25Å; V129-I167 CarbonylContact O-C 3.42Å; V129-I167 WeakPolarHBondContact O-CA 3.48Å; L131-I167 HydrophobicContact CD1-CG2 3.91Å; L131-I167 HydrophobicContact CG-CG2 3.84Å; K150-I167 HydrophobicContact CB-CD1 4.22Å; K150-I167 HydrophobicContact CG-CB 4.42Å; K150-I167 HydrophobicContact CG-CD1 4.15Å; K150-I167 HydrophobicContact CG-CG2 4.05Å; K150-I167 PolarHBondContact NZ-O 3.38Å; I153-I167 HydrophobicContact CB-CD1 4.21Å; I153-I167 HydrophobicContact CG2-CD1 3.87Å; L154-I167 HydrophobicContact CD2-CD1 4.01Å; L154-I167 HydrophobicContact CG-CD1 3.91Å
168	A	94.3	Very high	84.3	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.017	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	155.7	173.6	0	0	0	0	0	111.6	V129 V130 L131 L196 L199	V129-A168 PolarHBondContact O-N 3.39Å; V130-A168 HydrophobicContact CG2-CB 4.33Å; L131-A168 PolarHBondContact N-O 2.91Å; A168-L196 HydrophobicContact CB-CD1 3.55Å; A168-L199 HydrophobicContact CB-CD1 3.67Å
169	E	93.8	Very high	82.6	Confident	60 Å²	60	58.7 Å²	58.7	28%	0.28	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.4	177.8	-63.6	166.1	-152.5	0	0	108.5	I146 K150	I146-E169 VanDerWaalsContact CG2-CD 3.41Å; I146-E169 HydrophobicContact CG2-CG 3.93Å; I146-E169 VanDerWaalsContact CG2-OE1 3.26Å; I146-E169 WeakPolarHBondContact CG2-OE1 3.31Å; K150-E169 WeakPolarHBondContact CE-OE1 3.33Å; K150-E169 IonicContact NZ-OE1 2.58Å; K150-E169 PolarHBondContact NZ-OE1 3.25Å
170	I	91.3	Very high	81	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	155.5	178	-164.8	161.5	0	0	0	111.9	L19 V130 L131 N132 K133 C134 E192 V193 L196	L19-I170 HydrophobicContact CD1-CD1 3.84Å; L19-I170 HydrophobicContact CD1-CG2 3.89Å; V130-I170 HydrophobicContact CG1-CG2 3.44Å; V130-I170 VanDerWaalsContact CG1-CG2 3.44Å; L131-I170 PolarHBondContact O-N 2.86Å; N132-I170 CarbonylContact C-O 3.46Å; N132-I170 VanDerWaalsContact CA-O 3.26Å; N132-I170 WeakPolarHBondContact CA-O 3.23Å; N132-I170 HydrophobicContact CB-CG2 4.34Å; N132-I170 PolarHBondContact OD1-O 3.35Å; K133-I170 PolarHBondContact N-O 3.02Å; K133-I170 VanDerWaalsContact N-O 3.12Å; C134-I170 PolarHBondContact N-O 3.21Å; C134-I170 PolarHBondContact SG-O 3.43Å; I170-E192 WeakPolarHBondContact CA-OE2 3.39Å; I170-E192 HydrophobicContact CG1-CB 4.2Å; I170-V193 HydrophobicContact CD1-CG2 4.08Å; I170-L196 HydrophobicContact CD1-CD2 3.85Å
171	S	90	Very high	79.4	Confident	7 Å²	7	61.9 Å²	61.9	5%	0.049	34%	0.344	C	S	.	.			trans	-118.4	87	163.9	-54.8	0	0	0	0	109.4	C134 D135 A173 P174 N189 E192	C134-S171 WeakPolarHBondContact CB-OG 3.44Å; C134-S171 PolarHBondContact N-OG 2.81Å; D135-S171 PolarHBondContact N-OG 3.2Å; S171-A173 PolarHBondContact O-N 3.23Å; S171-P174 VanDerWaalsContact O-CD 3.3Å; S171-P174 WeakPolarHBondContact O-CD 3.23Å; S171-P174 WeakPolarHBondContact O-CG 3.26Å; S171-N189 PolarHBondContact O-ND2 3.14Å; S171-E192 PolarHBondContact N-OE2 2.79Å
172	A	83.7	Confident	77.6	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.017	34%	0.339	C	S	.	.	S	Bend	trans	-67.7	-20.4	-170.5	0	0	0	0	0	114.6	L19 V22 N132	L19-A172 HydrophobicContact CB-CB 4.37Å; L19-A172 HydrophobicContact CD1-CB 4.4Å; V22-A172 HydrophobicContact CG2-CB 4.31Å; V22-A172 WeakPolarHBondContact CG2-O 3.45Å; N132-A172 WeakPolarHBondContact OD1-CB 2.98Å; N132-A172 PolarHBondContact OD1-N 2.95Å
173	A	81.8	Confident	75.4	Confident	22 Å²	22	66.1 Å²	66.1	18%	0.182	38%	0.379	C	S	.	.	S	Bend	trans	-147.6	73.4	177	0	0	0	0	0	109.7	S171 G175 G176 V179	S171-A173 PolarHBondContact O-N 3.23Å; A173-G175 PolarHBondContact O-N 3.47Å; A173-G176 PolarHBondContact O-N 2.92Å; A173-G176 VanDerWaalsContact O-N 3.11Å; A173-V179 HydrophobicContact CB-CG2 3.85Å
174	P	77.4	Confident	73.1	Confident	57 Å²	57	67.7 Å²	67.7	37%	0.37	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-57.4	133.3	-174.6	-20.8	32.4	0	0	0	111.2	D135 S171 G176	D135-P174 HydrophobicContact CB-CB 4.41Å; D135-P174 WeakPolarHBondContact OD2-CA 3.4Å; S171-P174 VanDerWaalsContact O-CD 3.3Å; S171-P174 WeakPolarHBondContact O-CD 3.23Å; S171-P174 WeakPolarHBondContact O-CG 3.26Å; P174-G176 PolarHBondContact O-N 3.41Å
175	G	71.5	Confident	71.1	Confident	68 Å²	68	64.4 Å²	64.4	70%	0.701	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	70.3	11.4	179.4	0	0	0	0	0	115.2	D135 A173 V177	D135-G175 PolarHBondContact OD2-N 3.23Å; A173-G175 PolarHBondContact O-N 3.47Å; G175-V177 VanDerWaalsContact C-N 3.29Å; G175-V177 PolarHBondContact O-N 2.82Å
176	G	64.1	Low	69	Low	64 Å²	64	69.4 Å²	69.4	66%	0.66	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	76.2	12.7	177.1	0	0	0	0	0	114.7	A173 P174 Q178	A173-G176 PolarHBondContact O-N 2.92Å; A173-G176 VanDerWaalsContact O-N 3.11Å; P174-G176 PolarHBondContact O-N 3.41Å; G176-Q178 PolarHBondContact O-N 3.47Å
177	V	60.1	Low	66.5	Low	101 Å²	101	71.2 Å²	71.2	61%	0.612	41%	0.406	S	S	*	.			trans	-61.9	123	175.3	-175.5	0	0	0	0	108.7	G175 V179	G175-V177 VanDerWaalsContact C-N 3.29Å; G175-V177 PolarHBondContact O-N 2.82Å; V177-V179 PolarHBondContact O-N 2.84Å
178	Q	56.4	Low	64.2	Low	176 Å²	176	77.6 Å²	77.6	82%	0.822	44%	0.441	S	S	*	.			trans	-65.2	106.6	171.9	-72.4	-164.1	12.1	0	0	108.4	G176 E180	G176-Q178 PolarHBondContact O-N 3.47Å; Q178-E180 PolarHBondContact O-N 3.36Å
179	V	54.3	Low	62.4	Low	18 Å²	18	79.4 Å²	79.4	11%	0.109	45%	0.45	C	S	.	.			trans	-63.9	106	178.4	-172.7	0	0	0	0	108.4	K21 A173 V177	K21-V179 HydrophobicContact CD-CB 4.46Å; K21-V179 WeakPolarHBondContact CD-O 3.42Å; K21-V179 PolarHBondContact NZ-O 2.64Å; A173-V179 HydrophobicContact CB-CG2 3.85Å; V177-V179 PolarHBondContact O-N 2.84Å
180	E	52.9	Low	61.2	Low	148 Å²	148	79.9 Å²	79.9	69%	0.692	46%	0.46	S	S	*	.			trans	-74	134.6	167.7	-74.4	-164.6	154.9	0	0	109.2	Q178 T182 Q185	Q178-E180 PolarHBondContact O-N 3.36Å; E180-T182 PolarHBondContact O-N 2.88Å; E180-Q185 PolarHBondContact O-NE2 3.27Å; E180-Q185 PolarHBondContact O-OE1 3.07Å
181	F	55.1	Low	60.8	Low	83 Å²	83	86.7 Å²	86.7	36%	0.364	49%	0.492	S	S	.	.			trans	-74.5	93	-179.5	-175.1	-96.5	0	0	0	110.1	S24 T25 F32	S24-F181 WeakPolarHBondContact O-CE2 3.38Å; T25-F181 WeakPolarHBondContact O-CZ 3.38Å; F32-F181 HydrophobicContact CD2-CB 4.38Å; F32-F181 HydrophobicContact CD2-CD2 4.21Å; F32-F181 HydrophobicContact CD2-CG 4.28Å; F32-F181 HydrophobicContact CE2-CB 4.34Å; F32-F181 HydrophobicContact CE2-CD1 4.4Å; F32-F181 AromaticContact CE2-CD2 3.39Å; F32-F181 HydrophobicContact CE2-CD2 3.39Å; F32-F181 AromaticContact CE2-CE2 3.65Å; F32-F181 HydrophobicContact CE2-CE2 3.65Å; F32-F181 AromaticContact CE2-CG 3.79Å; F32-F181 HydrophobicContact CE2-CG 3.79Å; F32-F181 HydrophobicContact CE2-CZ 4.25Å; F32-F181 AromaticContact CZ-CD2 3.78Å; F32-F181 HydrophobicContact CZ-CD2 3.78Å; F32-F181 AromaticContact CZ-CE2 3.82Å; F32-F181 HydrophobicContact CZ-CE2 3.82Å
182	T	50.5	Low	60.5	Low	69 Å²	69	89.7 Å²	89.7	42%	0.423	51%	0.505	S	S	.	.			trans	-119.7	140.8	170.8	49.2	0	0	0	0	109.7	E180 E184 Q185	E180-T182 PolarHBondContact O-N 2.88Å; T182-E184 PolarHBondContact O-N 3.43Å; T182-Q185 PolarHBondContact O-N 3.28Å
183	S	46	Very low	60.6	Low	123 Å²	123	90 Å²	90	86%	0.86	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-11.6	-175.4	18.6	0	0	0	0	115
184	E	42.6	Very low	60.9	Low	161 Å²	161	92.4 Å²	92.4	75%	0.752	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-1.9	-169.6	-64.3	176.9	177.4	0	0	113.9	T182 R186 V187	T182-E184 PolarHBondContact O-N 3.43Å; E184-R186 PolarHBondContact O-N 3.01Å; E184-V187 WeakPolarHBondContact O-CG2 3.45Å
185	Q	46.5	Very low	61.6	Low	89 Å²	89	93.3 Å²	93.3	42%	0.416	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-83.2	-3.4	-168.7	-83.7	179.7	-3.4	0	0	117.4	E180 T182 V187	E180-Q185 PolarHBondContact O-NE2 3.27Å; E180-Q185 PolarHBondContact O-OE1 3.07Å; T182-Q185 PolarHBondContact O-N 3.28Å; Q185-V187 PolarHBondContact O-N 3.4Å
186	R	48.5	Very low	62.6	Low	117 Å²	117	90.2 Å²	90.2	44%	0.442	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-58.8	-15.9	174.9	-86.2	-169.3	178.6	-170.9	-1	113.3	E184 S190	E184-R186 PolarHBondContact O-N 3.01Å; R186-S190 WeakPolarHBondContact O-CA 3.42Å; R186-S190 WeakPolarHBondContact O-CB 3.26Å; R186-S190 PolarHBondContact O-N 2.87Å
187	V	41.8	Very low	63.9	Low	111 Å²	111	87.2 Å²	87.2	67%	0.673	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-73.8	-33.8	-167.4	-173.4	0	0	0	0	113.9	E184 Q185	E184-V187 WeakPolarHBondContact O-CG2 3.45Å; Q185-V187 PolarHBondContact O-N 3.4Å
188	N	45.5	Very low	65.5	Low	152 Å²	152	84.1 Å²	84.1	81%	0.813	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-25.3	-170.9	-75.2	-5.9	0	0	0	115.2
189	N	56.2	Low	67.3	Low	40 Å²	40	76.4 Å²	76.4	21%	0.214	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	26.8	179.9	-77	-4.6	0	0	0	112.3	S171 Q191 E192 V193	S171-N189 PolarHBondContact O-ND2 3.14Å; N189-Q191 PolarHBondContact O-N 3.41Å; N189-Q191 VanDerWaalsContact O-N 3.1Å; N189-E192 PolarHBondContact O-N 2.79Å; N189-V193 HydrophobicContact CB-CG2 4.04Å; N189-V193 WeakPolarHBondContact O-CB 3.31Å; N189-V193 VanDerWaalsContact O-CG2 3.28Å; N189-V193 WeakPolarHBondContact O-CG2 3.27Å; N189-V193 PolarHBondContact O-N 2.97Å; N189-V193 VanDerWaalsContact O-N 3.08Å
190	S	68.8	Low	69.2	Low	70 Å²	70	75.7 Å²	75.7	49%	0.49	39%	0.393	S	S	.	.	H	α-helix	trans	-52.5	-41.9	-168	60.3	0	0	0	0	112.6	R186 E194	R186-S190 WeakPolarHBondContact O-CA 3.42Å; R186-S190 WeakPolarHBondContact O-CB 3.26Å; R186-S190 PolarHBondContact O-N 2.87Å; S190-E194 WeakPolarHBondContact O-CB 3.14Å; S190-E194 PolarHBondContact O-N 3.28Å
191	Q	82.4	Confident	71.1	Confident	143 Å²	143	68.7 Å²	68.7	67%	0.668	36%	0.361	S	S	*	.	H	α-helix	trans	-71.3	-43.8	-177	-166.3	61.4	43.4	0	0	114.1	N189 V193 E194 N195	N189-Q191 PolarHBondContact O-N 3.41Å; N189-Q191 VanDerWaalsContact O-N 3.1Å; Q191-V193 VanDerWaalsContact C-N 3.34Å; Q191-E194 PolarHBondContact O-N 3.06Å; Q191-N195 WeakPolarHBondContact O-CB 3.41Å; Q191-N195 PolarHBondContact O-N 3.47Å
192	E	84.9	Confident	72.8	Confident	69 Å²	69	71.3 Å²	71.3	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-42.8	177.8	-65.2	-175.3	170.6	0	0	110.7	I170 S171 N189 N195 L196	I170-E192 WeakPolarHBondContact CA-OE2 3.39Å; I170-E192 HydrophobicContact CG1-CB 4.2Å; S171-E192 PolarHBondContact N-OE2 2.79Å; N189-E192 PolarHBondContact O-N 2.79Å; E192-N195 PolarHBondContact O-N 3.48Å; E192-L196 WeakPolarHBondContact O-CB 3.48Å; E192-L196 PolarHBondContact O-N 3.21Å
193	V	86.3	Confident	74.8	Confident	10 Å²	10	68.6 Å²	68.6	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-65.8	-44.3	178.4	177.1	0	0	0	0	110.7	V22 L23 I170 N189 Q191 N195 L196 I197	V22-V193 HydrophobicContact CG1-CG1 4.47Å; V22-V193 HydrophobicContact CG1-CG2 3.29Å; L23-V193 HydrophobicContact CD2-CG1 4.15Å; I170-V193 HydrophobicContact CD1-CG2 4.08Å; N189-V193 HydrophobicContact CB-CG2 4.04Å; N189-V193 WeakPolarHBondContact O-CB 3.31Å; N189-V193 VanDerWaalsContact O-CG2 3.28Å; N189-V193 WeakPolarHBondContact O-CG2 3.27Å; N189-V193 PolarHBondContact O-N 2.97Å; N189-V193 VanDerWaalsContact O-N 3.08Å; Q191-V193 VanDerWaalsContact C-N 3.34Å; V193-N195 VanDerWaalsContact C-N 3.34Å; V193-N195 PolarHBondContact O-N 3.38Å; V193-L196 WeakPolarHBondContact O-CB 3.4Å; V193-L196 PolarHBondContact O-N 3.13Å; V193-I197 HydrophobicContact CG1-CD1 3.98Å; V193-I197 VanDerWaalsContact O-CG1 3.31Å; V193-I197 WeakPolarHBondContact O-CG1 3.38Å; V193-I197 PolarHBondContact O-N 3.46Å
194	E	87.8	Confident	76.9	Confident	72 Å²	72	63.3 Å²	63.3	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-41.6	178.3	-168.9	63.6	-161.8	0	0	111.8	Y59 S190 Q191 I197 T198	Y59-E194 WeakPolarHBondContact CE1-OE1 2.96Å; Y59-E194 PolarHBondContact OH-OE1 2.89Å; Y59-E194 PolarHBondContact OH-OE2 3.46Å; Y59-E194 VanDerWaalsContact OH-OE2 3.07Å; S190-E194 WeakPolarHBondContact O-CB 3.14Å; S190-E194 PolarHBondContact O-N 3.28Å; Q191-E194 PolarHBondContact O-N 3.06Å; E194-I197 PolarHBondContact O-N 3.28Å; E194-T198 WeakPolarHBondContact O-CB 3.48Å; E194-T198 PolarHBondContact O-N 2.93Å; E194-T198 PolarHBondContact O-OG1 3.14Å
195	N	90.9	Very high	79	Confident	76 Å²	76	60.7 Å²	60.7	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-42.2	174.4	-173.2	36.5	0	0	0	111.5	Q191 E192 V193 T198 L199	Q191-N195 WeakPolarHBondContact O-CB 3.41Å; Q191-N195 PolarHBondContact O-N 3.47Å; E192-N195 PolarHBondContact O-N 3.48Å; V193-N195 VanDerWaalsContact C-N 3.34Å; V193-N195 PolarHBondContact O-N 3.38Å; N195-T198 WeakPolarHBondContact O-CB 3.39Å; N195-T198 PolarHBondContact O-N 2.9Å; N195-L199 WeakPolarHBondContact O-CG 3.42Å; N195-L199 PolarHBondContact O-N 2.92Å
196	L	92.7	Very high	81	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-45.2	175.9	175.7	61.1	0	0	0	112	L19 L23 L128 V130 A168 I170 E192 V193 T198 L199 L200	L19-L196 HydrophobicContact CD1-CD2 3.66Å; L23-L196 HydrophobicContact CD1-CD2 4.05Å; L23-L196 HydrophobicContact CD2-CD2 3.97Å; L23-L196 HydrophobicContact CD2-CG 4.39Å; L23-L196 HydrophobicContact CG-CD2 4.26Å; L128-L196 HydrophobicContact CD2-CD1 3.69Å; V130-L196 HydrophobicContact CG2-CD1 3.61Å; A168-L196 HydrophobicContact CB-CD1 3.55Å; I170-L196 HydrophobicContact CD1-CD2 3.85Å; E192-L196 WeakPolarHBondContact O-CB 3.48Å; E192-L196 PolarHBondContact O-N 3.21Å; V193-L196 WeakPolarHBondContact O-CB 3.4Å; V193-L196 PolarHBondContact O-N 3.13Å; L196-T198 VanDerWaalsContact C-N 3.3Å; L196-T198 PolarHBondContact O-N 3.24Å; L196-L199 PolarHBondContact O-N 2.74Å; L196-L200 VanDerWaalsContact O-CB 3.31Å; L196-L200 WeakPolarHBondContact O-CB 3.46Å; L196-L200 PolarHBondContact O-N 3Å
197	I	91.8	Very high	82.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-41.2	176.4	-66.2	168.6	0	0	0	110.3	L23 F52 V54 Y59 V193 E194 L200 A201	L23-I197 HydrophobicContact CD2-CD1 4.33Å; L23-I197 HydrophobicContact CD2-CG1 3.82Å; F52-I197 HydrophobicContact CE2-CD1 4.27Å; F52-I197 HydrophobicContact CE2-CG1 4.07Å; F52-I197 HydrophobicContact CE2-CG2 4.34Å; F52-I197 HydrophobicContact CZ-CG1 4.43Å; V54-I197 HydrophobicContact CG1-CG2 3.94Å; Y59-I197 HydrophobicContact CD1-CG2 3.91Å; Y59-I197 HydrophobicContact CE1-CB 4.1Å; Y59-I197 HydrophobicContact CE1-CG2 3.43Å; Y59-I197 VanDerWaalsContact CE1-CG2 3.43Å; Y59-I197 HydrophobicContact CE2-CG2 4.31Å; V193-I197 HydrophobicContact CG1-CD1 3.98Å; V193-I197 VanDerWaalsContact O-CG1 3.31Å; V193-I197 WeakPolarHBondContact O-CG1 3.38Å; V193-I197 PolarHBondContact O-N 3.46Å; E194-I197 PolarHBondContact O-N 3.28Å; I197-L200 PolarHBondContact O-N 2.78Å; I197-A201 WeakPolarHBondContact O-CB 3.37Å; I197-A201 PolarHBondContact O-N 3.32Å
198	T	93.6	Very high	85	Confident	35 Å²	35	48.2 Å²	48.2	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-46.4	177.1	-60.5	0	0	0	0	112	P60 E194 N195 L196 A201 R202	P60-T198 HydrophobicContact CG-CG2 3.86Å; P60-T198 WeakPolarHBondContact CG-O 3.35Å; E194-T198 WeakPolarHBondContact O-CB 3.48Å; E194-T198 PolarHBondContact O-N 2.93Å; E194-T198 PolarHBondContact O-OG1 3.14Å; N195-T198 WeakPolarHBondContact O-CB 3.39Å; N195-T198 PolarHBondContact O-N 2.9Å; L196-T198 VanDerWaalsContact C-N 3.3Å; L196-T198 PolarHBondContact O-N 3.24Å; T198-A201 PolarHBondContact O-N 2.98Å; T198-R202 PolarHBondContact O-N 2.89Å
199	L	93.9	Very high	87	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-37.7	177	-71.7	172.7	0	0	0	112	L128 E166 A168 N195 L196 R202 S203	L128-L199 HydrophobicContact CD1-CB 4.1Å; E166-L199 HydrophobicContact CB-CD2 4.38Å; E166-L199 HydrophobicContact CG-CD2 4.34Å; A168-L199 HydrophobicContact CB-CD1 3.67Å; N195-L199 WeakPolarHBondContact O-CG 3.42Å; N195-L199 PolarHBondContact O-N 2.92Å; L196-L199 PolarHBondContact O-N 2.74Å; L199-R202 PolarHBondContact O-N 3.43Å; L199-S203 WeakPolarHBondContact O-CB 3.25Å; L199-S203 PolarHBondContact O-N 3.34Å; L199-S203 PolarHBondContact O-OG 3.12Å
200	L	93.6	Very high	88.4	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-48.2	174.8	-175.8	64.8	0	0	0	111.1	V6 F52 F74 I98 V100 L128 L196 I197 R202 S203 I204	V6-L200 HydrophobicContact CG1-CD1 4.37Å; V6-L200 HydrophobicContact CG2-CD2 4.37Å; F52-L200 HydrophobicContact CZ-CD2 4.17Å; F74-L200 HydrophobicContact CD1-CD2 3.8Å; F74-L200 HydrophobicContact CD1-CG 4.42Å; F74-L200 HydrophobicContact CE1-CD2 3.59Å; F74-L200 HydrophobicContact CE1-CG 3.77Å; F74-L200 HydrophobicContact CG-CD2 4.43Å; F74-L200 HydrophobicContact CZ-CD2 4.14Å; F74-L200 HydrophobicContact CZ-CG 4.26Å; I98-L200 HydrophobicContact CD1-CD1 4.14Å; I98-L200 HydrophobicContact CG2-CD1 4.35Å; V100-L200 HydrophobicContact CG2-CD1 3.89Å; L128-L200 HydrophobicContact CD2-CB 3.91Å; L128-L200 HydrophobicContact CD2-CD1 3.9Å; L196-L200 VanDerWaalsContact O-CB 3.31Å; L196-L200 WeakPolarHBondContact O-CB 3.46Å; L196-L200 PolarHBondContact O-N 3Å; I197-L200 PolarHBondContact O-N 2.78Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 2.96Å; L200-S203 PolarHBondContact O-N 3.5Å; L200-S203 VanDerWaalsContact O-N 3.09Å; L200-I204 WeakPolarHBondContact O-CG1 3.46Å; L200-I204 PolarHBondContact O-N 3.21Å
201	A	93.1	Very high	89.3	Confident	2 Å²	2	49.3 Å²	49.3	2%	0.017	23%	0.233	C	C	.	.	H	α-helix	trans	-57.6	-41	176.8	0	0	0	0	0	112.5	P60 F61 I197 T198 S203	P60-A201 HydrophobicContact CG-CB 4.38Å; F61-A201 HydrophobicContact CD1-CB 3.87Å; F61-A201 HydrophobicContact CD2-CB 4.48Å; F61-A201 HydrophobicContact CE1-CB 3.51Å; F61-A201 HydrophobicContact CE2-CB 4.17Å; F61-A201 HydrophobicContact CG-CB 4.35Å; F61-A201 HydrophobicContact CZ-CB 3.68Å; I197-A201 WeakPolarHBondContact O-CB 3.37Å; I197-A201 PolarHBondContact O-N 3.32Å; T198-A201 PolarHBondContact O-N 2.98Å; A201-S203 VanDerWaalsContact C-N 3.35Å
202	R	92.4	Very high	89.5	Confident	137 Å²	137	46.2 Å²	46.2	52%	0.517	22%	0.221	S	C	.	.	H	α-helix	trans	-67.7	-33	176	-173.7	-177.4	-66.2	163.5	0.9	113.1	P60 E166 T198 L199 L200 I204	P60-R202 HydrophobicContact CG-CB 4.06Å; E166-R202 IonicContact OE1-NH1 4Å; T198-R202 PolarHBondContact O-N 2.89Å; L199-R202 PolarHBondContact O-N 3.43Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 2.96Å; R202-I204 VanDerWaalsContact C-N 3.33Å
203	S	92.2	Very high	89.5	Confident	12 Å²	12	49.3 Å²	49.3	8%	0.084	23%	0.233	C	C	.	.	H	α-helix	trans	-81.5	-12.2	-174.5	-60.2	0	0	0	0	113.6	K126 L199 L200 A201	K126-S203 VanDerWaalsContact CB-O 3.32Å; K126-S203 WeakPolarHBondContact CB-O 3.46Å; K126-S203 WeakPolarHBondContact CG-O 3.47Å; L199-S203 WeakPolarHBondContact O-CB 3.25Å; L199-S203 PolarHBondContact O-N 3.34Å; L199-S203 PolarHBondContact O-OG 3.12Å; L200-S203 PolarHBondContact O-N 3.5Å; L200-S203 VanDerWaalsContact O-N 3.09Å; A201-S203 VanDerWaalsContact C-N 3.35Å
204	I	90.3	Very high	89.4	Confident	12 Å²	12	51 Å²	51	6%	0.062	24%	0.242	C	C	.	.			trans	-69.7	130.3	-179.3	-74.6	161.8	0	0	0	111	I4 F61 I65 F74 I98 L200 R202	I4-I204 HydrophobicContact CD1-CD1 3.53Å; I4-I204 HydrophobicContact CD1-CG1 4.2Å; I4-I204 HydrophobicContact CD1-CG2 3.68Å; I4-I204 HydrophobicContact CG2-CD1 4.41Å; F61-I204 HydrophobicContact CD1-CD1 4.29Å; F61-I204 HydrophobicContact CE1-CD1 3.74Å; I65-I204 HydrophobicContact CD1-CG2 4.18Å; F74-I204 HydrophobicContact CD1-CD1 4.46Å; F74-I204 HydrophobicContact CE1-CD1 3.27Å; F74-I204 HydrophobicContact CE1-CG1 4.39Å; F74-I204 HydrophobicContact CZ-CD1 3.53Å; I98-I204 HydrophobicContact CD1-CG1 4.31Å; L200-I204 WeakPolarHBondContact O-CG1 3.46Å; L200-I204 PolarHBondContact O-N 3.21Å; R202-I204 VanDerWaalsContact C-N 3.33Å
205	H	86.7	Confident	89.3	Confident	106 Å²	106	51.2 Å²	51.2	49%	0.491	24%	0.241	S	C	.	.			trans	-84.4	133.1	160.6	-175.2	-89	0	0	0	109.3	E125 K126 P207	E125-H205 IonicContact OE2-CD2 3.65Å; E125-H205 IonicContact OE2-CE1 3.59Å; E125-H205 IonicContact OE2-CG 2.78Å; E125-H205 IonicContact OE2-ND1 3.44Å; E125-H205 IonicContact OE2-NE2 3.58Å; K126-H205 HydrophobicContact CG-CB 4.31Å; H205-P207 WeakPolarHBondContact O-CD 3.31Å
206	D	87.8	Confident	88.7	Confident	23 Å²	23	54.9 Å²	54.9	12%	0.123	26%	0.261	C	S	.	.			trans	-64	115.5	-178	-173.7	-9.7	0	0	0	111.3	S64 I65 T208	S64-D206 WeakPolarHBondContact CB-OD2 3.41Å; S64-D206 PolarHBondContact OG-OD2 3.46Å; I65-D206 HydrophobicContact CD1-CB 4.13Å; I65-D206 HydrophobicContact CG1-CB 4.21Å; D206-T208 VanDerWaalsContact C-N 3.32Å; D206-T208 WeakPolarHBondContact OD1-CB 3.26Å; D206-T208 PolarHBondContact OD1-N 3.1Å; D206-T208 PolarHBondContact OD1-OG1 3.31Å; D206-T208 PolarHBondContact OD2-OG1 2.99Å; D206-T208 VanDerWaalsContact OD2-OG1 3.09Å
207	P	88.4	Confident	88.1	Confident	9 Å²	9	58.1 Å²	58.1	6%	0.058	28%	0.277	C	S	.	.			trans	-85.4	-3.4	-176.8	36.3	-36	0	0	0	113	L2 H205 E209 K210 R211	L2-P207 HydrophobicContact CD1-CG 4.48Å; H205-P207 WeakPolarHBondContact O-CD 3.31Å; P207-E209 PolarHBondContact O-N 2.95Å; P207-K210 PolarHBondContact O-N 3.28Å; P207-R211 HydrophobicContact CB-CG 4.38Å; P207-R211 WeakPolarHBondContact O-CB 3.12Å; P207-R211 VanDerWaalsContact O-CG 3.27Å; P207-R211 WeakPolarHBondContact O-CG 3.14Å; P207-R211 PolarHBondContact O-N 3.24Å
208	T	86.4	Confident	87.6	Confident	24 Å²	24	59 Å²	59	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-44.2	-170.8	38.1	0	0	0	0	113.9	F69 D206 K210 R211 N212	F69-T208 HydrophobicContact CE2-CG2 3.42Å; F69-T208 VanDerWaalsContact CE2-CG2 3.42Å; F69-T208 HydrophobicContact CZ-CG2 3.6Å; D206-T208 VanDerWaalsContact C-N 3.32Å; D206-T208 WeakPolarHBondContact OD1-CB 3.26Å; D206-T208 PolarHBondContact OD1-N 3.1Å; D206-T208 PolarHBondContact OD1-OG1 3.31Å; D206-T208 PolarHBondContact OD2-OG1 2.99Å; D206-T208 VanDerWaalsContact OD2-OG1 3.09Å; T208-K210 PolarHBondContact O-N 2.73Å; T208-R211 PolarHBondContact O-N 3.28Å; T208-N212 WeakPolarHBondContact O-CB 3.37Å; T208-N212 VanDerWaalsContact O-CG 3.26Å; T208-N212 PolarHBondContact O-N 3.31Å; T208-N212 PolarHBondContact O-ND2 3.09Å
209	E	86.7	Confident	87.4	Confident	128 Å²	128	57.6 Å²	57.6	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-61.9	-48.2	-179	-164.2	-160.6	143.9	0	0	111.1	P207 R211 N212 K213	P207-E209 PolarHBondContact O-N 2.95Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 3.41Å; E209-N212 PolarHBondContact O-N 3.28Å; E209-K213 PolarHBondContact O-N 2.49Å; E209-K213 WeakPolarHBondContact OE1-CE 3.34Å; E209-K213 IonicContact OE1-NZ 2.82Å; E209-K213 PolarHBondContact OE1-NZ 3.09Å
210	K	85.2	Confident	87.2	Confident	137 Å²	137	57.3 Å²	57.3	60%	0.596	28%	0.276	S	S	*	.	H	α-helix	trans	-58.7	-45.7	176.3	-176.1	-178.3	176.7	-179.9	0	110.8	P207 T208 K213 L214	P207-K210 PolarHBondContact O-N 3.28Å; T208-K210 PolarHBondContact O-N 2.73Å; K210-K213 PolarHBondContact O-N 3.15Å; K210-L214 HydrophobicContact CG-CD1 4.39Å; K210-L214 WeakPolarHBondContact O-CG 3.2Å; K210-L214 PolarHBondContact O-N 3.38Å
211	R	88.4	Confident	87.1	Confident	19 Å²	19	57.1 Å²	57.1	7%	0.072	28%	0.275	C	S	.	.	H	α-helix	trans	-69.6	-33.9	-178.7	-72.2	174.8	177.6	-165.8	11.6	113.2	N3 D97 P207 T208 E209 L214 K215 P277	N3-R211 VanDerWaalsContact O-CZ 3.25Å; N3-R211 PolarHBondContact O-NH1 3.43Å; N3-R211 PolarHBondContact O-NH2 3.26Å; D97-R211 IonicContact OD1-CZ 3.82Å; D97-R211 IonicContact OD1-NE 3.16Å; D97-R211 IonicContact OD1-NH2 2.96Å; D97-R211 PolarHBondContact OD1-NH2 3.16Å; D97-R211 IonicContact OD2-CZ 3.94Å; D97-R211 IonicContact OD2-NH2 3.86Å; D97-R211 PolarHBondContact OD2-NH2 3.14Å; P207-R211 HydrophobicContact CB-CG 4.38Å; P207-R211 WeakPolarHBondContact O-CB 3.12Å; P207-R211 VanDerWaalsContact O-CG 3.27Å; P207-R211 WeakPolarHBondContact O-CG 3.14Å; P207-R211 PolarHBondContact O-N 3.24Å; T208-R211 PolarHBondContact O-N 3.28Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 3.41Å; R211-L214 PolarHBondContact O-N 3.16Å; R211-K215 WeakPolarHBondContact O-CG 3.26Å; R211-K215 PolarHBondContact O-N 2.95Å; R211-K215 VanDerWaalsContact O-N 3.1Å; R211-P277 HydrophobicContact CB-CB 4.32Å; R211-P277 WeakPolarHBondContact CD-O 3.08Å; R211-P277 HydrophobicContact CG-CB 4.31Å
212	N	86.1	Confident	86.9	Confident	78 Å²	78	57.2 Å²	57.2	42%	0.417	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-41.9	175.2	-76	-22.2	0	0	0	111	T208 E209 L214 K215	T208-N212 WeakPolarHBondContact O-CB 3.37Å; T208-N212 VanDerWaalsContact O-CG 3.26Å; T208-N212 PolarHBondContact O-N 3.31Å; T208-N212 PolarHBondContact O-ND2 3.09Å; E209-N212 PolarHBondContact O-N 3.28Å; N212-L214 PolarHBondContact O-N 3.25Å; N212-K215 WeakPolarHBondContact O-CB 3.17Å; N212-K215 PolarHBondContact O-N 2.69Å; N212-K215 VanDerWaalsContact O-N 3.12Å; N212-K215 PolarHBondContact OD1-NZ 2.59Å
213	K	85.4	Confident	86.8	Confident	134 Å²	134	50.7 Å²	50.7	58%	0.583	25%	0.251	S	S	*	.	H	α-helix	trans	-60	-31.7	173.1	-66.5	173.6	-172.6	167	0	112.7	E209 K210	E209-K213 PolarHBondContact O-N 2.49Å; E209-K213 WeakPolarHBondContact OE1-CE 3.34Å; E209-K213 IonicContact OE1-NZ 2.82Å; E209-K213 PolarHBondContact OE1-NZ 3.09Å; K210-K213 PolarHBondContact O-N 3.15Å
214	L	84.8	Confident	86.5	Confident	46 Å²	46	50.2 Å²	50.2	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-78.9	-22.1	178.9	-66	168.8	0	0	0	113	K210 R211 N212 D216 M217 G243 P277	K210-L214 HydrophobicContact CG-CD1 4.39Å; K210-L214 WeakPolarHBondContact O-CG 3.2Å; K210-L214 PolarHBondContact O-N 3.38Å; R211-L214 PolarHBondContact O-N 3.16Å; N212-L214 PolarHBondContact O-N 3.25Å; L214-D216 VanDerWaalsContact C-N 3.31Å; L214-D216 PolarHBondContact O-N 3.44Å; L214-M217 HydrophobicContact CD2-SD 3.82Å; L214-M217 WeakPolarHBondContact O-CB 3.13Å; L214-M217 PolarHBondContact O-N 3.37Å; L214-G243 WeakPolarHBondContact O-CA 3.22Å; L214-G243 PolarHBondContact O-N 3.49Å; L214-P277 HydrophobicContact CB-CB 4.12Å; L214-P277 HydrophobicContact CB-CG 3.94Å
215	K	84.6	Confident	86.2	Confident	76 Å²	76	50.8 Å²	50.8	33%	0.33	25%	0.25	S	C	.	.	H	α-helix	trans	-64.5	-35.5	-179.4	-77.6	176	-178.7	165.5	0	112.8	R211 N212 M217 G243 T244 P277	R211-K215 WeakPolarHBondContact O-CG 3.26Å; R211-K215 PolarHBondContact O-N 2.95Å; R211-K215 VanDerWaalsContact O-N 3.1Å; N212-K215 WeakPolarHBondContact O-CB 3.17Å; N212-K215 PolarHBondContact O-N 2.69Å; N212-K215 VanDerWaalsContact O-N 3.12Å; N212-K215 PolarHBondContact OD1-NZ 2.59Å; K215-M217 PolarHBondContact O-N 3.49Å; K215-G243 WeakPolarHBondContact O-CA 3.5Å; K215-T244 HydrophobicContact CB-CG2 4.18Å; K215-T244 HydrophobicContact CG-CG2 3.94Å; K215-P277 HydrophobicContact CG-CG 4.02Å
216	D	79	Confident	86.3	Confident	153 Å²	153	46.7 Å²	46.7	82%	0.818	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.2	-178.6	-58	-33.6	0	0	0	112.8	L214	L214-D216 VanDerWaalsContact C-N 3.31Å; L214-D216 PolarHBondContact O-N 3.44Å
217	M	79.4	Confident	86.2	Confident	71 Å²	71	49.3 Å²	49.3	35%	0.35	24%	0.243	S	C	.	.	S	Bend	trans	-88.4	169.9	174.4	-57.7	-172.2	76.5	0	0	111.2	L214 K215 G243	L214-M217 HydrophobicContact CD2-SD 3.82Å; L214-M217 WeakPolarHBondContact O-CB 3.13Å; L214-M217 PolarHBondContact O-N 3.37Å; K215-M217 PolarHBondContact O-N 3.49Å; M217-G243 WeakPolarHBondContact O-CA 3.26Å
218	G	82.1	Confident	86.2	Confident	19 Å²	19	52.6 Å²	52.6	20%	0.196	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-56.9	143.5	172.1	0	0	0	0	0	112.4	V220 S242 G243	G218-V220 PolarHBondContact O-N 3.39Å; G218-S242 CarbonylContact O-C 3.58Å; G218-S242 PolarHBondContact O-OG 2.9Å; G218-G243 PolarHBondContact O-N 3.12Å
219	F	88.7	Confident	86.2	Confident	7 Å²	7	54.1 Å²	54.1	3%	0.031	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-64.4	125.7	177	178.6	-111.3	0	0	0	110.4	F221 V240 S242 T245 I251 I275 I283 G299 D300	F219-F221 HydrophobicContact CE1-CB 3.83Å; F219-F221 HydrophobicContact CE2-CB 4.43Å; F219-F221 HydrophobicContact CZ-CB 3.62Å; F219-F221 HydrophobicContact CZ-CD2 4.25Å; F219-F221 HydrophobicContact CZ-CG 4.16Å; F219-V240 HydrophobicContact CD2-CG1 4.19Å; F219-V240 HydrophobicContact CE2-CG1 3.8Å; F219-V240 HydrophobicContact CE2-CG2 4.06Å; F219-S242 CarbonylContact C-O 3.49Å; F219-S242 WeakPolarHBondContact CA-O 3.43Å; F219-T245 HydrophobicContact CD1-CG2 4.18Å; F219-T245 HydrophobicContact CD2-CG2 4Å; F219-T245 HydrophobicContact CE1-CG2 3.66Å; F219-T245 HydrophobicContact CE2-CG2 3.43Å; F219-T245 VanDerWaalsContact CE2-CG2 3.43Å; F219-T245 HydrophobicContact CG-CG2 4.34Å; F219-T245 HydrophobicContact CZ-CG2 3.24Å; F219-I251 HydrophobicContact CD1-CG2 4.02Å; F219-I251 HydrophobicContact CE1-CG2 3.83Å; F219-I275 HydrophobicContact CE2-CD1 4.15Å; F219-I275 HydrophobicContact CE2-CG1 4.28Å; F219-I275 HydrophobicContact CZ-CD1 4.02Å; F219-I283 HydrophobicContact CZ-CD1 4.22Å; F219-G299 CarbonylContact O-C 3.43Å; F219-G299 WeakPolarHBondContact O-CA 3.38Å; F219-D300 HydrophobicContact CB-CB 4.01Å; F219-D300 PolarHBondContact O-N 3.4Å; F219-D300 VanDerWaalsContact O-N 3.11Å
220	V	89.5	Confident	86.2	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.4	174.9	-178.1	0	0	0	0	108.9	G218 L241 S242 L297 V298 L307	G218-V220 PolarHBondContact O-N 3.39Å; V220-L241 HydrophobicContact CB-CB 4.33Å; V220-L241 HydrophobicContact CG1-CB 4.23Å; V220-L241 HydrophobicContact CG1-CD1 4.07Å; V220-L241 HydrophobicContact CG1-CG 4.47Å; V220-L241 PolarHBondContact O-N 2.91Å; V220-S242 WeakPolarHBondContact CB-OG 3.31Å; V220-S242 VanDerWaalsContact CG2-OG 3.32Å; V220-S242 WeakPolarHBondContact CG2-OG 3.36Å; V220-S242 PolarHBondContact N-O 3.23Å; V220-S242 PolarHBondContact O-N 3.44Å; V220-L297 HydrophobicContact CG1-CD2 3.93Å; V220-V298 CarbonylContact C-O 3.52Å; V220-V298 WeakPolarHBondContact CA-O 3.48Å; V220-L307 HydrophobicContact CG1-CD2 4.19Å; V220-L307 HydrophobicContact CG2-CD1 4.36Å; V220-L307 HydrophobicContact CG2-CD2 4.13Å; V220-L307 HydrophobicContact CG2-CG 4.48Å
221	F	91.4	Very high	86.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	118.9	-177.3	-172.7	-111.5	0	0	0	110.1	F219 V223 L236 G238 V240 I275 A281 I283 V298	F219-F221 HydrophobicContact CE1-CB 3.83Å; F219-F221 HydrophobicContact CE2-CB 4.43Å; F219-F221 HydrophobicContact CZ-CB 3.62Å; F219-F221 HydrophobicContact CZ-CD2 4.25Å; F219-F221 HydrophobicContact CZ-CG 4.16Å; F221-V223 HydrophobicContact CD1-CG2 3.67Å; F221-V223 HydrophobicContact CE1-CG2 3.96Å; F221-V223 PolarHBondContact O-N 3.07Å; F221-L236 HydrophobicContact CE1-CB 4.36Å; F221-G238 WeakPolarHBondContact CE2-O 3.17Å; F221-G238 VanDerWaalsContact CZ-N 3.31Å; F221-V240 HydrophobicContact CD2-CG2 3.84Å; F221-V240 HydrophobicContact CE2-CG2 4.2Å; F221-I275 HydrophobicContact CE2-CD1 4.48Å; F221-A281 WeakPolarHBondContact CZ-O 3.06Å; F221-I283 HydrophobicContact CD1-CD1 3.93Å; F221-I283 HydrophobicContact CD2-CD1 4.27Å; F221-I283 HydrophobicContact CE1-CD1 3.9Å; F221-I283 HydrophobicContact CE1-CG1 4.27Å; F221-I283 HydrophobicContact CE2-CD1 4.24Å; F221-I283 HydrophobicContact CG-CD1 4.1Å; F221-I283 HydrophobicContact CZ-CD1 4.04Å; F221-I283 HydrophobicContact CZ-CG1 4.19Å; F221-V298 HydrophobicContact CB-CB 4.39Å; F221-V298 PolarHBondContact N-O 2.92Å; F221-V298 PolarHBondContact O-N 2.95Å
222	A	90.3	Very high	86.2	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	102.9	176.9	0	0	0	0	0	110	G238 T239 L241 L297 Q340	A222-G238 CarbonylContact O-C 3.55Å; A222-G238 WeakPolarHBondContact O-CA 3.38Å; A222-T239 PolarHBondContact N-O 3.23Å; A222-T239 PolarHBondContact O-N 2.73Å; A222-L241 HydrophobicContact CB-CD1 4.01Å; A222-L241 HydrophobicContact CB-CD2 4.12Å; A222-L241 HydrophobicContact CB-CG 3.95Å; A222-L297 HydrophobicContact CB-CD2 4.11Å; A222-Q340 HydrophobicContact CB-CG 4.09Å
223	V	89.9	Confident	86.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.4	177.6	-178.6	0	0	0	0	109.3	F221 H225 L236 T237 L293 R295 G296 V298	F221-V223 HydrophobicContact CD1-CG2 3.67Å; F221-V223 HydrophobicContact CE1-CG2 3.96Å; F221-V223 PolarHBondContact O-N 3.07Å; V223-H225 WeakPolarHBondContact CG1-O 3.27Å; V223-L236 HydrophobicContact CG1-CB 4.41Å; V223-L236 HydrophobicContact CG1-CD2 4.26Å; V223-L236 HydrophobicContact CG2-CB 4.26Å; V223-T237 WeakPolarHBondContact CA-O 3.13Å; V223-L293 HydrophobicContact CG1-CD2 4.36Å; V223-L293 HydrophobicContact CG2-CD2 4.39Å; V223-R295 WeakPolarHBondContact O-CA 3.38Å; V223-G296 PolarHBondContact N-O 3.25Å; V223-G296 PolarHBondContact O-N 3.09Å; V223-G296 VanDerWaalsContact O-N 3.16Å; V223-V298 HydrophobicContact CG2-CB 4.31Å; V223-V298 HydrophobicContact CG2-CG2 3.62Å
224	D	85.7	Confident	86.8	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.011	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-29.2	175.9	52.5	43.3	0	0	0	113.4	F49 T237 R280 R295	F49-D224 HydrophobicContact CE2-CB 4.35Å; F49-D224 WeakPolarHBondContact CE2-OD2 3.38Å; F49-D224 HydrophobicContact CZ-CB 4.44Å; F49-D224 WeakPolarHBondContact CZ-OD2 3.5Å; D224-T237 PolarHBondContact N-O 2.97Å; D224-T237 VanDerWaalsContact OD1-C 3.31Å; D224-T237 PolarHBondContact OD1-OG1 3.22Å; D224-R280 IonicContact OD1-NH2 3.75Å; D224-R280 PolarHBondContact OD1-NH2 3.22Å; D224-R280 VanDerWaalsContact OD1-NH2 3.16Å; D224-R280 IonicContact OD2-CZ 3.8Å; D224-R280 VanDerWaalsContact OD2-CZ 3.32Å; D224-R280 IonicContact OD2-NH1 3.73Å; D224-R280 PolarHBondContact OD2-NH1 3.48Å; D224-R280 IonicContact OD2-NH2 2.62Å; D224-R280 PolarHBondContact OD2-NH2 3.49Å; D224-R280 VanDerWaalsContact OD2-NH2 3.08Å; D224-R295 WeakPolarHBondContact O-CG 3.38Å
225	H	84.7	Confident	87.1	Confident	25 Å²	25	46.2 Å²	46.2	12%	0.116	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	145.7	173.9	-52.5	74.7	0	0	0	110.1	T29 S30 D46 V223 T237	T29-H225 HydrophobicContact CG2-CB 4Å; S30-H225 PolarHBondContact OG-NE2 2.8Å; D46-H225 IonicContact OD2-NE2 3.49Å; V223-H225 WeakPolarHBondContact CG1-O 3.27Å; H225-T237 WeakPolarHBondContact CB-OG1 3.1Å; H225-T237 PolarHBondContact N-O 3.41Å; H225-T237 PolarHBondContact O-N 3.48Å
226	C	87.9	Confident	87.5	Confident	19 Å²	19	42.6 Å²	42.6	13%	0.128	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.3	173.1	-177.1	0	0	0	0	108.5	T234 I235 L236 L293	C226-T234 WeakPolarHBondContact SG-CG2 3.36Å; C226-I235 WeakPolarHBondContact CA-O 3.27Å; C226-L236 HydrophobicContact CB-CD2 3.97Å; C226-L236 WeakPolarHBondContact SG-CD2 3.4Å; C226-L293 WeakPolarHBondContact CB-O 3.22Å
227	F	86.7	Confident	88.1	Confident	79 Å²	79	35.8 Å²	35.8	35%	0.346	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.4	176.7	54	-89	0	0	0	110.9	I229 I235 T237	F227-I229 HydrophobicContact CD2-CG1 4.19Å; F227-I229 HydrophobicContact CE2-CD1 4.2Å; F227-I229 HydrophobicContact CE2-CG1 4.17Å; F227-I235 HydrophobicContact CD2-CB 4.27Å; F227-I235 HydrophobicContact CE1-CB 4.48Å; F227-I235 HydrophobicContact CE1-CG2 4.31Å; F227-I235 HydrophobicContact CE2-CB 3.84Å; F227-I235 HydrophobicContact CE2-CD1 4.02Å; F227-I235 HydrophobicContact CE2-CG1 4.3Å; F227-I235 HydrophobicContact CE2-CG2 4.2Å; F227-I235 HydrophobicContact CZ-CB 3.95Å; F227-I235 HydrophobicContact CZ-CD1 4.45Å; F227-I235 HydrophobicContact CZ-CG2 3.81Å; F227-I235 PolarHBondContact N-O 2.8Å; F227-I235 PolarHBondContact O-N 2.78Å; F227-T237 HydrophobicContact CE1-CG2 3.91Å; F227-T237 HydrophobicContact CZ-CG2 4.26Å
228	T	87	Confident	88.7	Confident	77 Å²	77	32.4 Å²	32.4	47%	0.472	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.5	-178.9	-53.5	0	0	0	0	110.3	S290	T228-S290 PolarHBondContact OG1-OG 3.1Å
229	I	87.3	Confident	89.2	Confident	56 Å²	56	31.7 Å²	31.7	29%	0.287	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.3	167.9	-59.5	-164.6	0	0	0	108.4	F227 G231 Q232 G233 I235	F227-I229 HydrophobicContact CD2-CG1 4.19Å; F227-I229 HydrophobicContact CE2-CD1 4.2Å; F227-I229 HydrophobicContact CE2-CG1 4.17Å; I229-G231 PolarHBondContact O-N 3.11Å; I229-Q232 HydrophobicContact CB-CB 4.17Å; I229-Q232 HydrophobicContact CG2-CB 4.01Å; I229-Q232 HydrophobicContact CG2-CG 3.91Å; I229-Q232 PolarHBondContact O-N 3.04Å; I229-Q232 VanDerWaalsContact O-N 3.12Å; I229-G233 PolarHBondContact N-O 2.84Å; I229-G233 PolarHBondContact O-N 2.8Å; I229-G233 VanDerWaalsContact O-N 3.07Å; I229-G233 VanDerWaalsContact O-O 3.06Å; I229-I235 HydrophobicContact CD1-CD1 3.32Å; I229-I235 HydrophobicContact CD1-CG1 4.22Å; I229-I235 HydrophobicContact CG1-CD1 3.9Å; I229-I235 HydrophobicContact CG1-CG1 4.27Å
230	T	85.7	Confident	89.4	Confident	142 Å²	142	31.4 Å²	31.4	87%	0.871	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	128.6	176.2	25.7	0	0	0	0	111.2	Q232	T230-Q232 PolarHBondContact O-N 2.92Å
231	G	86.8	Confident	89.4	Confident	89 Å²	89	33 Å²	33	92%	0.918	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	-27.4	-178.8	0	0	0	0	0	115.8	I229	I229-G231 PolarHBondContact O-N 3.11Å
232	Q	86.9	Confident	89.3	Confident	111 Å²	111	33.7 Å²	33.7	52%	0.519	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-45.9	-178.4	-62.1	-174	2.6	0	0	112.1	I229 T230 K263	I229-Q232 HydrophobicContact CB-CB 4.17Å; I229-Q232 HydrophobicContact CG2-CB 4.01Å; I229-Q232 HydrophobicContact CG2-CG 3.91Å; I229-Q232 PolarHBondContact O-N 3.04Å; I229-Q232 VanDerWaalsContact O-N 3.12Å; T230-Q232 PolarHBondContact O-N 2.92Å; Q232-K263 PolarHBondContact O-NZ 3.48Å
233	G	91	Very high	89.2	Confident	12 Å²	12	33.6 Å²	33.6	12%	0.124	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132	-153.3	-173.6	0	0	0	0	0	111.3	I229	I229-G233 PolarHBondContact N-O 2.84Å; I229-G233 PolarHBondContact O-N 2.8Å; I229-G233 VanDerWaalsContact O-N 3.07Å; I229-G233 VanDerWaalsContact O-O 3.06Å
234	T	92.8	Very high	89.3	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.1	-177.3	-45.7	0	0	0	0	109.3	C226 C284 V285 L288	C226-T234 WeakPolarHBondContact SG-CG2 3.36Å; T234-C284 WeakPolarHBondContact O-CA 3.38Å; T234-V285 PolarHBondContact N-O 3.38Å; T234-V285 WeakPolarHBondContact O-CG2 3.48Å; T234-V285 PolarHBondContact O-N 3.43Å; T234-L288 HydrophobicContact CG2-CB 4.06Å; T234-L288 HydrophobicContact CG2-CD2 4.28Å; T234-L288 HydrophobicContact CG2-CG 4.45Å; T234-L288 WeakPolarHBondContact CG2-O 3.17Å; T234-L288 PolarHBondContact OG1-N 2.96Å; T234-L288 VanDerWaalsContact OG1-N 3.1Å; T234-L288 PolarHBondContact OG1-O 3.41Å
235	I	91.9	Very high	89.6	Confident	22 Å²	22	36.8 Å²	36.8	11%	0.113	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.3	179.2	-60	-169.6	0	0	0	109.1	C226 F227 I229 T237 I283	C226-I235 WeakPolarHBondContact CA-O 3.27Å; F227-I235 HydrophobicContact CD2-CB 4.27Å; F227-I235 HydrophobicContact CE1-CB 4.48Å; F227-I235 HydrophobicContact CE1-CG2 4.31Å; F227-I235 HydrophobicContact CE2-CB 3.84Å; F227-I235 HydrophobicContact CE2-CD1 4.02Å; F227-I235 HydrophobicContact CE2-CG1 4.3Å; F227-I235 HydrophobicContact CE2-CG2 4.2Å; F227-I235 HydrophobicContact CZ-CB 3.95Å; F227-I235 HydrophobicContact CZ-CD1 4.45Å; F227-I235 HydrophobicContact CZ-CG2 3.81Å; F227-I235 PolarHBondContact N-O 2.8Å; F227-I235 PolarHBondContact O-N 2.78Å; I229-I235 HydrophobicContact CD1-CD1 3.32Å; I229-I235 HydrophobicContact CD1-CG1 4.22Å; I229-I235 HydrophobicContact CG1-CD1 3.9Å; I229-I235 HydrophobicContact CG1-CG1 4.27Å; I235-T237 HydrophobicContact CG2-CG2 3.97Å; I235-I283 WeakPolarHBondContact CA-O 3.35Å
236	L	92.6	Very high	90	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.2	171.7	-55.7	175.5	0	0	0	107.8	F221 V223 C226 I251 G282 I283 V285 L288 L293 V298	F221-L236 HydrophobicContact CE1-CB 4.36Å; V223-L236 HydrophobicContact CG1-CB 4.41Å; V223-L236 HydrophobicContact CG1-CD2 4.26Å; V223-L236 HydrophobicContact CG2-CB 4.26Å; C226-L236 HydrophobicContact CB-CD2 3.97Å; C226-L236 WeakPolarHBondContact SG-CD2 3.4Å; L236-I251 HydrophobicContact CD1-CD1 4.21Å; L236-G282 CarbonylContact O-C 3.53Å; L236-G282 WeakPolarHBondContact O-CA 3.45Å; L236-I283 HydrophobicContact CB-CB 4.49Å; L236-I283 PolarHBondContact N-O 2.98Å; L236-I283 PolarHBondContact O-N 3.45Å; L236-V285 HydrophobicContact CD1-CG1 4.48Å; L236-V285 HydrophobicContact CD1-CG2 4.25Å; L236-V285 HydrophobicContact CG-CG2 4.4Å; L236-L288 HydrophobicContact CD2-CD2 3.94Å; L236-L293 HydrophobicContact CD2-CD2 3.83Å; L236-V298 HydrophobicContact CD1-CG2 4.39Å
237	T	91.9	Very high	90.4	Very high	10 Å²	10	39 Å²	39	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	142.7	170.9	66	0	0	0	0	110.6	T29 V223 D224 H225 F227 I235 A281	T29-T237 PolarHBondContact OG1-OG1 2.93Å; V223-T237 WeakPolarHBondContact CA-O 3.13Å; D224-T237 PolarHBondContact N-O 2.97Å; D224-T237 VanDerWaalsContact OD1-C 3.31Å; D224-T237 PolarHBondContact OD1-OG1 3.22Å; H225-T237 WeakPolarHBondContact CB-OG1 3.1Å; H225-T237 PolarHBondContact N-O 3.41Å; H225-T237 PolarHBondContact O-N 3.48Å; F227-T237 HydrophobicContact CE1-CG2 3.91Å; F227-T237 HydrophobicContact CZ-CG2 4.26Å; I235-T237 HydrophobicContact CG2-CG2 3.97Å; T237-A281 WeakPolarHBondContact CA-O 3.35Å
238	G	92.1	Very high	90.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.7	-171.7	-173.4	0	0	0	0	0	113.7	F221 A222 R280 A281	F221-G238 WeakPolarHBondContact CE2-O 3.17Å; F221-G238 VanDerWaalsContact CZ-N 3.31Å; A222-G238 CarbonylContact O-C 3.55Å; A222-G238 WeakPolarHBondContact O-CA 3.38Å; G238-R280 WeakPolarHBondContact O-CA 3.06Å; G238-A281 PolarHBondContact N-O 3.13Å; G238-A281 PolarHBondContact O-N 2.97Å
239	T	92.5	Very high	90.9	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.7	-179.3	-51.3	0	0	0	0	110.4	N5 I95 A222 L241 D279	N5-T239 WeakPolarHBondContact ND2-CG2 3.4Å; I95-T239 HydrophobicContact CB-CG2 4.22Å; I95-T239 HydrophobicContact CG2-CG2 4.28Å; A222-T239 PolarHBondContact N-O 3.23Å; A222-T239 PolarHBondContact O-N 2.73Å; T239-L241 PolarHBondContact O-N 2.99Å; T239-D279 WeakPolarHBondContact CA-O 3.35Å
240	V	92.7	Very high	91.1	Very high	2 Å²	2	37 Å²	37	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120.9	175	-174	0	0	0	0	109.5	F219 F221 S242 I275 V276 G278 D279	F219-V240 HydrophobicContact CD2-CG1 4.19Å; F219-V240 HydrophobicContact CE2-CG1 3.8Å; F219-V240 HydrophobicContact CE2-CG2 4.06Å; F221-V240 HydrophobicContact CD2-CG2 3.84Å; F221-V240 HydrophobicContact CE2-CG2 4.2Å; V240-S242 WeakPolarHBondContact CG1-O 3.42Å; V240-I275 HydrophobicContact CG2-CB 3.97Å; V240-I275 HydrophobicContact CG2-CD1 3.65Å; V240-I275 HydrophobicContact CG2-CG1 3.86Å; V240-V276 WeakPolarHBondContact CB-O 3.32Å; V240-G278 PolarHBondContact O-N 3.05Å; V240-D279 HydrophobicContact CG2-CB 4.49Å; V240-D279 PolarHBondContact N-O 3.47Å
241	L	89.2	Confident	91.3	Very high	40 Å²	40	30.3 Å²	30.3	21%	0.209	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-43.2	176.7	-59.6	-174.2	0	0	0	111.6	I95 V220 A222 T239 L297	I95-L241 HydrophobicContact CG2-CD2 4.04Å; V220-L241 HydrophobicContact CB-CB 4.33Å; V220-L241 HydrophobicContact CG1-CB 4.23Å; V220-L241 HydrophobicContact CG1-CD1 4.07Å; V220-L241 HydrophobicContact CG1-CG 4.47Å; V220-L241 PolarHBondContact O-N 2.91Å; A222-L241 HydrophobicContact CB-CD1 4.01Å; A222-L241 HydrophobicContact CB-CD2 4.12Å; A222-L241 HydrophobicContact CB-CG 3.95Å; T239-L241 PolarHBondContact O-N 2.99Å; L241-L297 HydrophobicContact CD1-CD2 3.86Å
242	S	89	Confident	91.3	Very high	15 Å²	15	26.3 Å²	26.3	11%	0.105	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.6	179.9	65.4	0	0	0	0	111.6	G218 F219 V220 V240	G218-S242 CarbonylContact O-C 3.58Å; G218-S242 PolarHBondContact O-OG 2.9Å; F219-S242 CarbonylContact C-O 3.49Å; F219-S242 WeakPolarHBondContact CA-O 3.43Å; V220-S242 WeakPolarHBondContact CB-OG 3.31Å; V220-S242 VanDerWaalsContact CG2-OG 3.32Å; V220-S242 WeakPolarHBondContact CG2-OG 3.36Å; V220-S242 PolarHBondContact N-O 3.23Å; V220-S242 PolarHBondContact O-N 3.44Å; V240-S242 WeakPolarHBondContact CG1-O 3.42Å
243	G	88.7	Confident	91.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	64	-172.3	-178.3	0	0	0	0	0	113.8	L214 K215 M217 G218 P277	L214-G243 WeakPolarHBondContact O-CA 3.22Å; L214-G243 PolarHBondContact O-N 3.49Å; K215-G243 WeakPolarHBondContact O-CA 3.5Å; M217-G243 WeakPolarHBondContact O-CA 3.26Å; G218-G243 PolarHBondContact O-N 3.12Å; G243-P277 WeakPolarHBondContact O-CD 3.32Å; G243-P277 WeakPolarHBondContact O-CG 3.49Å
244	T	91.3	Very high	90.8	Very high	67 Å²	67	21.6 Å²	21.6	41%	0.411	13%	0.134	S	C	.	.			trans	-133.4	148.6	177.7	61.5	0	0	0	0	109.9	K215 I275 V276	K215-T244 HydrophobicContact CB-CG2 4.18Å; K215-T244 HydrophobicContact CG-CG2 3.94Å; T244-I275 WeakPolarHBondContact CA-O 3.17Å; T244-V276 HydrophobicContact CG2-CB 4.28Å; T244-V276 HydrophobicContact CG2-CG1 3.86Å
245	T	92.4	Very high	90.3	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	160.8	168.6	-163	0	0	0	0	111.6	F219 Q249 I262 I265 S274 I275	F219-T245 HydrophobicContact CD1-CG2 4.18Å; F219-T245 HydrophobicContact CD2-CG2 4Å; F219-T245 HydrophobicContact CE1-CG2 3.66Å; F219-T245 HydrophobicContact CE2-CG2 3.43Å; F219-T245 VanDerWaalsContact CE2-CG2 3.43Å; F219-T245 HydrophobicContact CG-CG2 4.34Å; F219-T245 HydrophobicContact CZ-CG2 3.24Å; T245-Q249 PolarHBondContact OG1-OE1 3.33Å; T245-I262 HydrophobicContact CG2-CD1 3.74Å; T245-I262 WeakPolarHBondContact OG1-CD1 3.26Å; T245-I265 HydrophobicContact CG2-CD1 4.44Å; T245-S274 VanDerWaalsContact O-CA 3.26Å; T245-S274 WeakPolarHBondContact O-CA 3.5Å; T245-S274 WeakPolarHBondContact O-CB 3.41Å; T245-I275 HydrophobicContact CG2-CD1 3.7Å; T245-I275 HydrophobicContact CG2-CG1 3.59Å; T245-I275 PolarHBondContact N-O 3.26Å; T245-I275 PolarHBondContact O-N 2.79Å
246	S	94.6	Very high	89.8	Confident	42 Å²	42	26.8 Å²	26.8	29%	0.294	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	157.6	-177.4	-60.6	0	0	0	0	111.5	G248 Q249 Q273 S274	S246-G248 PolarHBondContact O-N 3.02Å; S246-Q249 WeakPolarHBondContact O-CB 3.35Å; S246-Q249 PolarHBondContact O-N 2.75Å; S246-Q249 VanDerWaalsContact O-N 3.08Å; S246-Q273 CarbonylContact C-O 3.57Å; S246-Q273 VanDerWaalsContact CA-O 3.23Å; S246-Q273 WeakPolarHBondContact CA-O 3.37Å; S246-S274 WeakPolarHBondContact OG-CB 3.04Å
247	V	95.5	Very high	89.1	Confident	47 Å²	47	37.9 Å²	37.9	29%	0.285	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	134.9	171.7	177.4	0	0	0	0	109.6	K263 I265 Q273	V247-K263 WeakPolarHBondContact CG1-O 3.41Å; V247-I265 HydrophobicContact CG2-CB 4.23Å; V247-I265 HydrophobicContact CG2-CD1 4.05Å; V247-I265 HydrophobicContact CG2-CG1 3.85Å; V247-Q273 PolarHBondContact N-O 2.97Å
248	G	93.3	Very high	88.8	Confident	32 Å²	32	40.3 Å²	40.3	33%	0.33	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	-12.2	-177	0	0	0	0	0	115	S246 K261 I262	S246-G248 PolarHBondContact O-N 3.02Å; G248-K261 WeakPolarHBondContact O-CE 3.16Å; G248-K261 WeakPolarHBondContact O-CG 3.49Å; G248-I262 WeakPolarHBondContact CA-O 3.13Å; G248-I262 PolarHBondContact N-O 2.96Å
249	Q	91.5	Very high	88.5	Confident	91 Å²	91	45.6 Å²	45.6	43%	0.425	23%	0.232	S	C	.	.			trans	-76.1	163.1	172.1	-68.6	-172.7	-30.4	0	0	112	T245 S246 I262	T245-Q249 PolarHBondContact OG1-OE1 3.33Å; S246-Q249 WeakPolarHBondContact O-CB 3.35Å; S246-Q249 PolarHBondContact O-N 2.75Å; S246-Q249 VanDerWaalsContact O-N 3.08Å; Q249-I262 WeakPolarHBondContact O-CG1 3.19Å; Q249-I262 PolarHBondContact O-N 2.62Å
250	T	90.1	Very high	88.4	Confident	49 Å²	49	47.4 Å²	47.4	30%	0.301	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.4	179.5	-52.8	0	0	0	0	110.4	Q259 K260 I301	T250-Q259 HydrophobicContact CG2-CB 3.81Å; T250-K260 WeakPolarHBondContact CA-O 3.06Å; T250-I301 HydrophobicContact CG2-CD1 3.59Å; T250-I301 HydrophobicContact CG2-CG1 4.48Å
251	I	90.9	Very high	88.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.3	175.8	50.2	164.4	0	0	0	110.2	F219 L236 Q259 K260 I262 I283 V285 V298 G299	F219-I251 HydrophobicContact CD1-CG2 4.02Å; F219-I251 HydrophobicContact CE1-CG2 3.83Å; L236-I251 HydrophobicContact CD1-CD1 4.21Å; I251-Q259 CarbonylContact O-C 3.56Å; I251-Q259 WeakPolarHBondContact O-CA 3.41Å; I251-K260 VanDerWaalsContact CG1-O 3.28Å; I251-K260 WeakPolarHBondContact CG1-O 3.13Å; I251-K260 PolarHBondContact N-O 3.02Å; I251-K260 PolarHBondContact O-N 3.4Å; I251-I262 HydrophobicContact CD1-CG1 4.25Å; I251-I262 HydrophobicContact CG1-CG1 4.07Å; I251-I262 HydrophobicContact CG2-CD1 3.8Å; I251-I262 HydrophobicContact CG2-CG1 4.17Å; I251-I283 HydrophobicContact CD1-CG2 4.11Å; I251-V285 HydrophobicContact CD1-CG1 3.81Å; I251-V285 HydrophobicContact CG1-CG1 4.38Å; I251-V298 HydrophobicContact CB-CG1 3.8Å; I251-V298 HydrophobicContact CD1-CG1 3.6Å; I251-V298 HydrophobicContact CG1-CG1 4.16Å; I251-V298 HydrophobicContact CG2-CG1 4.45Å; I251-G299 CarbonylContact C-O 3.48Å
252	G	87.2	Confident	88.7	Confident	6 Å²	6	51.7 Å²	51.7	6%	0.062	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	137.6	175.2	0	0	0	0	0	111.9	P254 V298 G299	G252-P254 WeakPolarHBondContact O-CD 3.27Å; G252-V298 WeakPolarHBondContact O-CG1 3.37Å; G252-G299 PolarHBondContact N-O 3.17Å; G252-G299 PolarHBondContact O-N 3.28Å
253	L	87	Confident	89	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	101.6	169.6	-74.1	87.2	0	0	0	108	Y255 Q256 R257 I258 K260 L288 L293 V298	L253-Y255 PolarHBondContact O-N 2.83Å; L253-Q256 HydrophobicContact CB-CB 4.34Å; L253-Q256 PolarHBondContact O-N 2.96Å; L253-R257 WeakPolarHBondContact O-CA 3.13Å; L253-R257 PolarHBondContact O-N 3.14Å; L253-I258 HydrophobicContact CB-CG1 3.84Å; L253-I258 HydrophobicContact CD1-CG1 4.21Å; L253-I258 HydrophobicContact CD2-CD1 4.37Å; L253-I258 HydrophobicContact CD2-CG1 4.49Å; L253-I258 HydrophobicContact CG-CG1 4.41Å; L253-I258 PolarHBondContact N-O 3.02Å; L253-I258 PolarHBondContact O-N 3.29Å; L253-K260 HydrophobicContact CD1-CB 4.38Å; L253-K260 HydrophobicContact CD1-CG 4.09Å; L253-L288 HydrophobicContact CD2-CD1 3.63Å; L253-L288 HydrophobicContact CD2-CD2 3.63Å; L253-L288 HydrophobicContact CD2-CG 4.29Å; L253-L293 HydrophobicContact CD2-CD2 3.97Å; L253-V298 HydrophobicContact CG-CG2 4.37Å
254	P	80.7	Confident	89.3	Confident	22 Å²	22	58.5 Å²	58.5	14%	0.143	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-41.2	-163.8	20.2	-31.7	0	0	0	114.3	G252 R257 L297 L307 I396	G252-P254 WeakPolarHBondContact O-CD 3.27Å; P254-R257 PolarHBondContact O-N 3.04Å; P254-L297 WeakPolarHBondContact CD-O 3.35Å; P254-L297 VanDerWaalsContact CG-O 3.3Å; P254-L297 WeakPolarHBondContact CG-O 3.27Å; P254-L307 HydrophobicContact CB-CB 4.29Å; P254-L307 VanDerWaalsContact CB-O 3.23Å; P254-L307 WeakPolarHBondContact CB-O 3.22Å; P254-L307 HydrophobicContact CG-CB 4.42Å; P254-I396 HydrophobicContact CB-CD1 3.5Å; P254-I396 HydrophobicContact CG-CD1 3.14Å
255	Y	81.4	Confident	89.5	Confident	86 Å²	86	55.4 Å²	55.4	34%	0.337	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-40.8	178.9	-73.7	-71.3	0	0	0	113	L253 R257 P309 E341 I396	L253-Y255 PolarHBondContact O-N 2.83Å; Y255-R257 VanDerWaalsContact C-N 3.27Å; Y255-P309 HydrophobicContact CD1-CG 4.11Å; Y255-P309 HydrophobicContact CE1-CB 4.11Å; Y255-P309 HydrophobicContact CE1-CG 3.87Å; Y255-E341 WeakPolarHBondContact CE2-OE1 3.47Å; Y255-E341 VanDerWaalsContact CZ-OE1 3.24Å; Y255-E341 PolarHBondContact OH-OE1 2.79Å; Y255-E341 PolarHBondContact OH-OE2 2.63Å; Y255-I396 HydrophobicContact CD2-CD1 3.94Å; Y255-I396 HydrophobicContact CE2-CD1 3.41Å; Y255-I396 VanDerWaalsContact CE2-CD1 3.41Å; Y255-I396 HydrophobicContact CE2-CG1 3.94Å; Y255-I396 PolarHBondContact OH-N 3.06Å
256	Q	80.5	Confident	89.5	Confident	45 Å²	45	59.6 Å²	59.6	21%	0.21	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.2	-178.6	-60.7	83.2	-6	0	0	111.4	L253 I258 L292	L253-Q256 HydrophobicContact CB-CB 4.34Å; L253-Q256 PolarHBondContact O-N 2.96Å; Q256-I258 HydrophobicContact CB-CD1 3.91Å; Q256-I258 HydrophobicContact CB-CG1 3.77Å; Q256-I258 HydrophobicContact CB-CG2 4.42Å; Q256-I258 WeakPolarHBondContact O-CG2 3.27Å; Q256-I258 PolarHBondContact O-N 3.08Å; Q256-L292 HydrophobicContact CG-CB 4.47Å; Q256-L292 PolarHBondContact NE2-O 2.99Å
257	R	79.6	Confident	89.2	Confident	233 Å²	233	59.1 Å²	59.1	88%	0.879	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	33.9	-174.5	-56.7	-177.4	-179.1	-180	0.2	112.8	L253 P254 Y255	L253-R257 WeakPolarHBondContact O-CA 3.13Å; L253-R257 PolarHBondContact O-N 3.14Å; P254-R257 PolarHBondContact O-N 3.04Å; Y255-R257 VanDerWaalsContact C-N 3.27Å
258	I	83.7	Confident	88.5	Confident	61 Å²	61	57.8 Å²	57.8	31%	0.313	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	158.4	176.8	64.2	-177.4	0	0	0	110.4	L253 Q256 L288	L253-I258 HydrophobicContact CB-CG1 3.84Å; L253-I258 HydrophobicContact CD1-CG1 4.21Å; L253-I258 HydrophobicContact CD2-CD1 4.37Å; L253-I258 HydrophobicContact CD2-CG1 4.49Å; L253-I258 HydrophobicContact CG-CG1 4.41Å; L253-I258 PolarHBondContact N-O 3.02Å; L253-I258 PolarHBondContact O-N 3.29Å; Q256-I258 HydrophobicContact CB-CD1 3.91Å; Q256-I258 HydrophobicContact CB-CG1 3.77Å; Q256-I258 HydrophobicContact CB-CG2 4.42Å; Q256-I258 WeakPolarHBondContact O-CG2 3.27Å; Q256-I258 PolarHBondContact O-N 3.08Å; I258-L288 HydrophobicContact CD1-CD1 3.58Å
259	Q	87.5	Confident	87.8	Confident	111 Å²	111	65.1 Å²	65.1	52%	0.519	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.3	176.5	-64.1	176.8	3.4	0	0	109.4	T250 I251 I301	T250-Q259 HydrophobicContact CG2-CB 3.81Å; I251-Q259 CarbonylContact O-C 3.56Å; I251-Q259 WeakPolarHBondContact O-CA 3.41Å; Q259-I301 VanDerWaalsContact CD-CD1 3.45Å; Q259-I301 HydrophobicContact CG-CD1 4.17Å; Q259-I301 HydrophobicContact CG-CG1 4.04Å
260	K	90.4	Very high	87.5	Confident	41 Å²	41	66.2 Å²	66.2	18%	0.178	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	134.1	-178.6	-66.8	-66	-174.2	165.3	0	110.6	T250 I251 L253 V285 P286 Q287	T250-K260 WeakPolarHBondContact CA-O 3.06Å; I251-K260 VanDerWaalsContact CG1-O 3.28Å; I251-K260 WeakPolarHBondContact CG1-O 3.13Å; I251-K260 PolarHBondContact N-O 3.02Å; I251-K260 PolarHBondContact O-N 3.4Å; L253-K260 HydrophobicContact CD1-CB 4.38Å; L253-K260 HydrophobicContact CD1-CG 4.09Å; K260-V285 HydrophobicContact CB-CB 4.02Å; K260-V285 HydrophobicContact CB-CG1 4.02Å; K260-P286 HydrophobicContact CD-CG 4.38Å; K260-P286 WeakPolarHBondContact CD-O 3.47Å; K260-P286 WeakPolarHBondContact CE-O 3.45Å; K260-P286 PolarHBondContact NZ-O 2.78Å; K260-Q287 PolarHBondContact NZ-O 3.13Å
261	K	92.3	Very high	87.7	Confident	130 Å²	130	69.1 Å²	69.1	57%	0.565	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.4	174.5	-163.8	174.6	-171.3	173.7	0	110.4	G248 K263 P286	G248-K261 WeakPolarHBondContact O-CE 3.16Å; G248-K261 WeakPolarHBondContact O-CG 3.49Å; K261-K263 PolarHBondContact O-N 2.7Å; K261-P286 WeakPolarHBondContact O-CD 3.47Å
262	I	94.9	Very high	87.8	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.015	32%	0.323	C	S	.	.			trans	-71.7	117.4	176.5	-62	174	0	0	0	109	T245 G248 Q249 I251 I265 I283	T245-I262 HydrophobicContact CG2-CD1 3.74Å; T245-I262 WeakPolarHBondContact OG1-CD1 3.26Å; G248-I262 WeakPolarHBondContact CA-O 3.13Å; G248-I262 PolarHBondContact N-O 2.96Å; Q249-I262 WeakPolarHBondContact O-CG1 3.19Å; Q249-I262 PolarHBondContact O-N 2.62Å; I251-I262 HydrophobicContact CD1-CG1 4.25Å; I251-I262 HydrophobicContact CG1-CG1 4.07Å; I251-I262 HydrophobicContact CG2-CD1 3.8Å; I251-I262 HydrophobicContact CG2-CG1 4.17Å; I262-I265 HydrophobicContact CG2-CD1 4.08Å; I262-I265 HydrophobicContact CG2-CG1 3.61Å; I262-I283 HydrophobicContact CB-CG2 4.36Å; I262-I283 HydrophobicContact CD1-CG2 4.22Å; I262-I283 HydrophobicContact CG1-CG2 3.81Å; I262-I283 HydrophobicContact CG2-CG2 3.89Å
263	K	95	Very high	88.2	Confident	112 Å²	112	77.1 Å²	77.1	49%	0.487	35%	0.352	S	S	.	.			trans	-80	-45.6	175.5	-78.5	-174.9	173.4	-176.8	0	112.5	Q232 V247 K261 C284	Q232-K263 PolarHBondContact O-NZ 3.48Å; V247-K263 WeakPolarHBondContact CG1-O 3.41Å; K261-K263 PolarHBondContact O-N 2.7Å; K263-C284 HydrophobicContact CB-CB 4.48Å; K263-C284 PolarHBondContact N-O 2.78Å
264	S	95.5	Very high	88.6	Confident	45 Å²	45	80 Å²	80	32%	0.315	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	154.9	-178.6	61.8	0	0	0	0	110.1	C284	S264-C284 PolarHBondContact O-N 2.96Å; S264-C284 VanDerWaalsContact OG-CB 3.3Å; S264-C284 WeakPolarHBondContact OG-CB 3.5Å
265	I	96.1	Very high	89.2	Confident	2 Å²	2	78.9 Å²	78.9	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.9	173.8	-54	172.1	0	0	0	107.7	T245 V247 I262 I272 I275 A281 G282	T245-I265 HydrophobicContact CG2-CD1 4.44Å; V247-I265 HydrophobicContact CG2-CB 4.23Å; V247-I265 HydrophobicContact CG2-CD1 4.05Å; V247-I265 HydrophobicContact CG2-CG1 3.85Å; I262-I265 HydrophobicContact CG2-CD1 4.08Å; I262-I265 HydrophobicContact CG2-CG1 3.61Å; I265-I272 HydrophobicContact CB-CG1 4.09Å; I265-I272 HydrophobicContact CG2-CD1 3.92Å; I265-I272 HydrophobicContact CG2-CG1 3.73Å; I265-I272 PolarHBondContact O-N 2.78Å; I265-I275 HydrophobicContact CD1-CD1 4.43Å; I265-I275 HydrophobicContact CD1-CG1 4.34Å; I265-I275 HydrophobicContact CG2-CD1 4.42Å; I265-I275 HydrophobicContact CG2-CG2 3.64Å; I265-A281 HydrophobicContact CG2-CB 3.94Å; I265-G282 WeakPolarHBondContact CA-O 3.45Å
266	Q	92.1	Very high	89.8	Confident	92 Å²	92	77.1 Å²	77.1	43%	0.43	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.6	174.6	-67	-173.1	-3.8	0	0	110.7	Q270 A281 G282	Q266-Q270 CarbonylContact C-O 3.49Å; Q266-Q270 VanDerWaalsContact CA-O 3.31Å; Q266-Q270 WeakPolarHBondContact CA-O 3.43Å; Q266-A281 CarbonylContact O-C 3.26Å; Q266-A281 WeakPolarHBondContact O-CA 2.99Å; Q266-G282 PolarHBondContact N-O 2.96Å; Q266-G282 PolarHBondContact O-N 3.39Å
267	R	89	Confident	90.4	Very high	32 Å²	32	75 Å²	75	12%	0.121	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	120.1	169.6	176.5	174	77	-168.1	-4.1	108.2	R269 Q270 I272 D279 R280	R267-R269 VanDerWaalsContact C-N 3.29Å; R267-R269 PolarHBondContact O-N 2.91Å; R267-Q270 PolarHBondContact N-O 2.93Å; R267-Q270 WeakPolarHBondContact O-CB 3.37Å; R267-Q270 PolarHBondContact O-N 3Å; R267-I272 HydrophobicContact CB-CD1 3.62Å; R267-I272 HydrophobicContact CB-CG1 4.35Å; R267-I272 HydrophobicContact CB-CG2 4.49Å; R267-D279 IonicContact NH1-OD1 3.58Å; R267-D279 PolarHBondContact NH1-OD1 3.3Å; R267-D279 IonicContact NH1-OD2 2.74Å; R267-R280 WeakPolarHBondContact CG-O 3.38Å
268	F	79.6	Confident	91	Very high	19 Å²	19	64.3 Å²	64.3	8%	0.083	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	50.1	-179.8	-63.9	-74.8	0	0	0	114.2	I26 S51 T75 Q270 R280	I26-F268 HydrophobicContact CG2-CB 4.26Å; I26-F268 HydrophobicContact CG2-CD1 4.23Å; S51-F268 VanDerWaalsContact CB-CE1 3.42Å; S51-F268 WeakPolarHBondContact OG-CD1 3.41Å; S51-F268 VanDerWaalsContact OG-CE1 3.23Å; S51-F268 WeakPolarHBondContact OG-CE1 3.44Å; T75-F268 HydrophobicContact CG2-CZ 3.89Å; T75-F268 WeakPolarHBondContact OG1-CE2 3.42Å; T75-F268 VanDerWaalsContact OG1-CZ 3.22Å; T75-F268 WeakPolarHBondContact OG1-CZ 3.26Å; F268-Q270 PolarHBondContact O-N 2.96Å; F268-R280 HydrophobicContact CE2-CB 4.36Å; F268-R280 HydrophobicContact CZ-CB 4.39Å; F268-R280 HydrophobicContact CZ-CG 4.41Å
269	R	78.1	Confident	91.4	Very high	186 Å²	186	61.8 Å²	61.8	70%	0.702	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	6.2	-179.1	-48.1	179.7	-175.5	178.8	2	115.9	R267	R267-R269 VanDerWaalsContact C-N 3.29Å; R267-R269 PolarHBondContact O-N 2.91Å
270	Q	86.6	Confident	91.6	Very high	114 Å²	114	56.8 Å²	56.8	53%	0.533	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.3	172.5	-63.8	-177.3	-13.9	0	0	110	Q266 R267 F268	Q266-Q270 CarbonylContact C-O 3.49Å; Q266-Q270 VanDerWaalsContact CA-O 3.31Å; Q266-Q270 WeakPolarHBondContact CA-O 3.43Å; R267-Q270 PolarHBondContact N-O 2.93Å; R267-Q270 WeakPolarHBondContact O-CB 3.37Å; R267-Q270 PolarHBondContact O-N 3Å; F268-Q270 PolarHBondContact O-N 2.96Å
271	P	92.9	Very high	91.8	Very high	109 Å²	109	55 Å²	55	71%	0.708	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.8	173.5	29.1	-33	0	0	0	110.4
272	I	94.6	Very high	91.9	Very high	30 Å²	30	49.4 Å²	49.4	15%	0.154	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	156.3	178.6	57.8	172	0	0	0	110.5	I265 R267 I275	I265-I272 HydrophobicContact CB-CG1 4.09Å; I265-I272 HydrophobicContact CG2-CD1 3.92Å; I265-I272 HydrophobicContact CG2-CG1 3.73Å; I265-I272 PolarHBondContact O-N 2.78Å; R267-I272 HydrophobicContact CB-CD1 3.62Å; R267-I272 HydrophobicContact CB-CG1 4.35Å; R267-I272 HydrophobicContact CB-CG2 4.49Å; I272-I275 HydrophobicContact CD1-CG2 3.38Å; I272-I275 HydrophobicContact CG1-CG2 4.39Å
273	Q	94.8	Very high	91.9	Very high	144 Å²	144	49.3 Å²	49.3	67%	0.673	25%	0.251	S	S	*	.	S	Bend	trans	-90.9	-30.1	-176.4	-68.4	-62.2	-21.4	0	0	113.6	S246 V247	S246-Q273 CarbonylContact C-O 3.57Å; S246-Q273 VanDerWaalsContact CA-O 3.23Å; S246-Q273 WeakPolarHBondContact CA-O 3.37Å; V247-Q273 PolarHBondContact N-O 2.97Å
274	S	94.3	Very high	91.9	Very high	62 Å²	62	44.4 Å²	44.4	43%	0.434	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.3	-178.7	64.5	0	0	0	0	111.8	T245 S246	T245-S274 VanDerWaalsContact O-CA 3.26Å; T245-S274 WeakPolarHBondContact O-CA 3.5Å; T245-S274 WeakPolarHBondContact O-CB 3.41Å; S246-S274 WeakPolarHBondContact OG-CB 3.04Å
275	I	94.8	Very high	91.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.5	177.9	54.1	-179	0	0	0	110.5	F219 F221 V240 T244 T245 I265 I272 D279 A281 I283	F219-I275 HydrophobicContact CE2-CD1 4.15Å; F219-I275 HydrophobicContact CE2-CG1 4.28Å; F219-I275 HydrophobicContact CZ-CD1 4.02Å; F221-I275 HydrophobicContact CE2-CD1 4.48Å; V240-I275 HydrophobicContact CG2-CB 3.97Å; V240-I275 HydrophobicContact CG2-CD1 3.65Å; V240-I275 HydrophobicContact CG2-CG1 3.86Å; T244-I275 WeakPolarHBondContact CA-O 3.17Å; T245-I275 HydrophobicContact CG2-CD1 3.7Å; T245-I275 HydrophobicContact CG2-CG1 3.59Å; T245-I275 PolarHBondContact N-O 3.26Å; T245-I275 PolarHBondContact O-N 2.79Å; I265-I275 HydrophobicContact CD1-CD1 4.43Å; I265-I275 HydrophobicContact CD1-CG1 4.34Å; I265-I275 HydrophobicContact CG2-CD1 4.42Å; I265-I275 HydrophobicContact CG2-CG2 3.64Å; I272-I275 HydrophobicContact CD1-CG2 3.38Å; I272-I275 HydrophobicContact CG1-CG2 4.39Å; I275-D279 HydrophobicContact CB-CB 4.39Å; I275-D279 HydrophobicContact CG2-CB 4.5Å; I275-A281 HydrophobicContact CD1-CB 4.3Å; I275-A281 HydrophobicContact CG2-CB 3.77Å; I275-I283 HydrophobicContact CD1-CD1 3.84Å; I275-I283 HydrophobicContact CD1-CG1 4.19Å
276	V	93.8	Very high	91.6	Very high	48 Å²	48	43.9 Å²	43.9	29%	0.291	23%	0.226	S	C	.	.			trans	-126.4	168.6	-176	-57.5	0	0	0	0	111	V240 T244 G278 D279	V240-V276 WeakPolarHBondContact CB-O 3.32Å; T244-V276 HydrophobicContact CG2-CB 4.28Å; T244-V276 HydrophobicContact CG2-CG1 3.86Å; V276-G278 PolarHBondContact O-N 3.14Å; V276-D279 WeakPolarHBondContact CG2-OD2 3.47Å; V276-D279 PolarHBondContact N-OD2 2.9Å; V276-D279 WeakPolarHBondContact O-CB 3.14Å; V276-D279 PolarHBondContact O-N 3.45Å
277	P	92.4	Very high	91.1	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.013	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	132.9	-178.4	-28	37.9	0	0	0	113	R211 L214 K215 G243	R211-P277 HydrophobicContact CB-CB 4.32Å; R211-P277 WeakPolarHBondContact CD-O 3.08Å; R211-P277 HydrophobicContact CG-CB 4.31Å; L214-P277 HydrophobicContact CB-CB 4.12Å; L214-P277 HydrophobicContact CB-CG 3.94Å; K215-P277 HydrophobicContact CG-CG 4.02Å; G243-P277 WeakPolarHBondContact O-CD 3.32Å; G243-P277 WeakPolarHBondContact O-CG 3.49Å
278	G	91.7	Very high	91	Very high	8 Å²	8	46.5 Å²	46.5	8%	0.082	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-10.7	-176.5	0	0	0	0	0	115.4	N3 N5 V240 V276	N3-G278 PolarHBondContact ND2-O 3.36Å; N5-G278 PolarHBondContact ND2-O 3.04Å; V240-G278 PolarHBondContact O-N 3.05Å; V276-G278 PolarHBondContact O-N 3.14Å
279	D	93.2	Very high	91.2	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.043	26%	0.257	C	S	.	.			trans	-69.5	133.6	172.4	-81.4	-39.2	0	0	0	111.3	T239 V240 R267 I275 V276	T239-D279 WeakPolarHBondContact CA-O 3.35Å; V240-D279 HydrophobicContact CG2-CB 4.49Å; V240-D279 PolarHBondContact N-O 3.47Å; R267-D279 IonicContact NH1-OD1 3.58Å; R267-D279 PolarHBondContact NH1-OD1 3.3Å; R267-D279 IonicContact NH1-OD2 2.74Å; I275-D279 HydrophobicContact CB-CB 4.39Å; I275-D279 HydrophobicContact CG2-CB 4.5Å; V276-D279 WeakPolarHBondContact CG2-OD2 3.47Å; V276-D279 PolarHBondContact N-OD2 2.9Å; V276-D279 WeakPolarHBondContact O-CB 3.14Å; V276-D279 PolarHBondContact O-N 3.45Å
280	R	92.4	Very high	91.2	Very high	5 Å²	5	41.9 Å²	41.9	2%	0.019	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.5	161	178	174.1	-170.9	72.2	4.7	109.4	F49 T75 D224 G238 R267 F268	F49-R280 VanDerWaalsContact CD2-CZ 3.46Å; T75-R280 HydrophobicContact CG2-CB 4.23Å; D224-R280 IonicContact OD1-NH2 3.75Å; D224-R280 PolarHBondContact OD1-NH2 3.22Å; D224-R280 VanDerWaalsContact OD1-NH2 3.16Å; D224-R280 IonicContact OD2-CZ 3.8Å; D224-R280 VanDerWaalsContact OD2-CZ 3.32Å; D224-R280 IonicContact OD2-NH1 3.73Å; D224-R280 PolarHBondContact OD2-NH1 3.48Å; D224-R280 IonicContact OD2-NH2 2.62Å; D224-R280 PolarHBondContact OD2-NH2 3.49Å; D224-R280 VanDerWaalsContact OD2-NH2 3.08Å; G238-R280 WeakPolarHBondContact O-CA 3.06Å; R267-R280 WeakPolarHBondContact CG-O 3.38Å; F268-R280 HydrophobicContact CE2-CB 4.36Å; F268-R280 HydrophobicContact CZ-CB 4.39Å; F268-R280 HydrophobicContact CZ-CG 4.41Å
281	A	93.7	Very high	90.9	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.033	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	163.9	-179.9	0	0	0	0	0	112.6	F221 T237 G238 I265 Q266 I275	F221-A281 WeakPolarHBondContact CZ-O 3.06Å; T237-A281 WeakPolarHBondContact CA-O 3.35Å; G238-A281 PolarHBondContact N-O 3.13Å; G238-A281 PolarHBondContact O-N 2.97Å; I265-A281 HydrophobicContact CG2-CB 3.94Å; Q266-A281 CarbonylContact O-C 3.26Å; Q266-A281 WeakPolarHBondContact O-CA 2.99Å; I275-A281 HydrophobicContact CD1-CB 4.3Å; I275-A281 HydrophobicContact CG2-CB 3.77Å
282	G	93.9	Very high	90.1	Very high	13 Å²	13	42.3 Å²	42.3	13%	0.134	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.3	164.1	0	0	0	0	0	109.6	L236 I265 Q266	L236-G282 CarbonylContact O-C 3.53Å; L236-G282 WeakPolarHBondContact O-CA 3.45Å; I265-G282 WeakPolarHBondContact CA-O 3.45Å; Q266-G282 PolarHBondContact N-O 2.96Å; Q266-G282 PolarHBondContact O-N 3.39Å
283	I	95.1	Very high	89.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.7	176.9	-58	178.9	0	0	0	108.2	F219 F221 I235 L236 I251 I262 I275 V285	F219-I283 HydrophobicContact CZ-CD1 4.22Å; F221-I283 HydrophobicContact CD1-CD1 3.93Å; F221-I283 HydrophobicContact CD2-CD1 4.27Å; F221-I283 HydrophobicContact CE1-CD1 3.9Å; F221-I283 HydrophobicContact CE1-CG1 4.27Å; F221-I283 HydrophobicContact CE2-CD1 4.24Å; F221-I283 HydrophobicContact CG-CD1 4.1Å; F221-I283 HydrophobicContact CZ-CD1 4.04Å; F221-I283 HydrophobicContact CZ-CG1 4.19Å; I235-I283 WeakPolarHBondContact CA-O 3.35Å; L236-I283 HydrophobicContact CB-CB 4.49Å; L236-I283 PolarHBondContact N-O 2.98Å; L236-I283 PolarHBondContact O-N 3.45Å; I251-I283 HydrophobicContact CD1-CG2 4.11Å; I262-I283 HydrophobicContact CB-CG2 4.36Å; I262-I283 HydrophobicContact CD1-CG2 4.22Å; I262-I283 HydrophobicContact CG1-CG2 3.81Å; I262-I283 HydrophobicContact CG2-CG2 3.89Å; I275-I283 HydrophobicContact CD1-CD1 3.84Å; I275-I283 HydrophobicContact CD1-CG1 4.19Å; I283-V285 HydrophobicContact CG2-CG1 4.21Å
284	C	94.8	Very high	88.5	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.9	175.3	-175.4	0	0	0	0	110.8	T234 K263 S264	T234-C284 WeakPolarHBondContact O-CA 3.38Å; K263-C284 HydrophobicContact CB-CB 4.48Å; K263-C284 PolarHBondContact N-O 2.78Å; S264-C284 PolarHBondContact O-N 2.96Å; S264-C284 VanDerWaalsContact OG-CB 3.3Å; S264-C284 WeakPolarHBondContact OG-CB 3.5Å
285	V	94.1	Very high	87.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.6	178.5	-66.9	0	0	0	0	112	T234 L236 I251 K260 I283 L288	T234-V285 PolarHBondContact N-O 3.38Å; T234-V285 WeakPolarHBondContact O-CG2 3.48Å; T234-V285 PolarHBondContact O-N 3.43Å; L236-V285 HydrophobicContact CD1-CG1 4.48Å; L236-V285 HydrophobicContact CD1-CG2 4.25Å; L236-V285 HydrophobicContact CG-CG2 4.4Å; I251-V285 HydrophobicContact CD1-CG1 3.81Å; I251-V285 HydrophobicContact CG1-CG1 4.38Å; K260-V285 HydrophobicContact CB-CB 4.02Å; K260-V285 HydrophobicContact CB-CG1 4.02Å; I283-V285 HydrophobicContact CG2-CG1 4.21Å; V285-L288 HydrophobicContact CG2-CB 4.16Å; V285-L288 HydrophobicContact CG2-CD2 4.26Å
286	P	91.8	Very high	87.4	Confident	36 Å²	36	42.3 Å²	42.3	23%	0.234	22%	0.221	C	C	.	.	S	Bend	trans	-72.8	128.9	177.4	23.8	-27.9	0	0	0	112.4	K260 K261 L288	K260-P286 HydrophobicContact CD-CG 4.38Å; K260-P286 WeakPolarHBondContact CD-O 3.47Å; K260-P286 WeakPolarHBondContact CE-O 3.45Å; K260-P286 PolarHBondContact NZ-O 2.78Å; K261-P286 WeakPolarHBondContact O-CD 3.47Å; P286-L288 PolarHBondContact O-N 2.97Å
287	Q	82.1	Confident	87.2	Confident	173 Å²	173	40.1 Å²	40.1	81%	0.808	21%	0.207	S	C	*	.	S	Bend	trans	47.5	66.5	161	-63.9	173.6	-9.7	0	0	113.3	K260	K260-Q287 PolarHBondContact NZ-O 3.13Å
288	L	85.7	Confident	87	Confident	7 Å²	7	40 Å²	40	4%	0.037	21%	0.207	C	C	.	.			trans	-113.7	129.6	170.2	177.3	72.7	0	0	0	108.4	T234 L236 L253 I258 V285 P286 S290	T234-L288 HydrophobicContact CG2-CB 4.06Å; T234-L288 HydrophobicContact CG2-CD2 4.28Å; T234-L288 HydrophobicContact CG2-CG 4.45Å; T234-L288 WeakPolarHBondContact CG2-O 3.17Å; T234-L288 PolarHBondContact OG1-N 2.96Å; T234-L288 VanDerWaalsContact OG1-N 3.1Å; T234-L288 PolarHBondContact OG1-O 3.41Å; L236-L288 HydrophobicContact CD2-CD2 3.94Å; L253-L288 HydrophobicContact CD2-CD1 3.63Å; L253-L288 HydrophobicContact CD2-CD2 3.63Å; L253-L288 HydrophobicContact CD2-CG 4.29Å; I258-L288 HydrophobicContact CD1-CD1 3.58Å; V285-L288 HydrophobicContact CG2-CB 4.16Å; V285-L288 HydrophobicContact CG2-CD2 4.26Å; P286-L288 PolarHBondContact O-N 2.97Å; L288-S290 PolarHBondContact O-N 2.95Å
289	D	83.6	Confident	86.8	Confident	82 Å²	82	39.7 Å²	39.7	44%	0.439	20%	0.203	S	C	.	.			trans	-67.9	115.6	171.8	-176.3	-0.7	0	0	0	109.2	N291 L292	D289-N291 PolarHBondContact O-N 2.89Å; D289-N291 WeakPolarHBondContact OD1-CB 3.48Å; D289-N291 PolarHBondContact OD1-N 2.62Å; D289-L292 HydrophobicContact CB-CD1 3.88Å; D289-L292 HydrophobicContact CB-CG 3.98Å; D289-L292 PolarHBondContact O-N 3.46Å
290	S	79.5	Confident	86.1	Confident	25 Å²	25	41.4 Å²	41.4	18%	0.175	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.5	-23.4	-178.3	46.8	0	0	0	0	113	T228 L288 L292 L293	T228-S290 PolarHBondContact OG1-OG 3.1Å; L288-S290 PolarHBondContact O-N 2.95Å; S290-L292 PolarHBondContact O-N 3.02Å; S290-L293 CarbonylContact O-C 3.47Å; S290-L293 PolarHBondContact O-N 3.1Å
291	N	79.2	Confident	84.7	Confident	127 Å²	127	43.7 Å²	43.7	68%	0.679	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-71.7	-20.9	179.3	-61.2	-25	0	0	0	112.6	D289 L293	D289-N291 PolarHBondContact O-N 2.89Å; D289-N291 WeakPolarHBondContact OD1-CB 3.48Å; D289-N291 PolarHBondContact OD1-N 2.62Å; N291-L293 VanDerWaalsContact C-N 3.32Å
292	L	77.7	Confident	82.6	Confident	105 Å²	105	46.6 Å²	46.6	55%	0.55	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-80.6	-13.4	179.8	-63.1	177.4	0	0	0	113	Q256 D289 S290	Q256-L292 HydrophobicContact CG-CB 4.47Å; Q256-L292 PolarHBondContact NE2-O 2.99Å; D289-L292 HydrophobicContact CB-CD1 3.88Å; D289-L292 HydrophobicContact CB-CG 3.98Å; D289-L292 PolarHBondContact O-N 3.46Å; S290-L292 PolarHBondContact O-N 3.02Å
293	L	79.7	Confident	80.5	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.037	24%	0.239	C	C	.	.			trans	-147	83.4	-177.9	-175.2	74.8	0	0	0	109.8	V223 C226 L236 L253 S290 N291 V298	V223-L293 HydrophobicContact CG1-CD2 4.36Å; V223-L293 HydrophobicContact CG2-CD2 4.39Å; C226-L293 WeakPolarHBondContact CB-O 3.22Å; L236-L293 HydrophobicContact CD2-CD2 3.83Å; L253-L293 HydrophobicContact CD2-CD2 3.97Å; S290-L293 CarbonylContact O-C 3.47Å; S290-L293 PolarHBondContact O-N 3.1Å; N291-L293 VanDerWaalsContact C-N 3.32Å; L293-V298 HydrophobicContact CD2-CG2 4.16Å
294	E	74.8	Confident	78.3	Confident	148 Å²	148	49 Å²	49	69%	0.692	26%	0.255	S	S	*	.	S	Bend	trans	-73.5	-44.6	170.9	-69.1	-171.4	161.2	0	0	111.3
295	R	81.3	Confident	76.2	Confident	80 Å²	80	50.6 Å²	50.6	30%	0.302	26%	0.263	S	S	.	.	S	Bend	trans	-145.4	151.3	175.6	-60.4	-172.9	-168.2	-159.1	4.4	110.1	D46 V223 D224 Q340	D46-R295 IonicContact OD1-CZ 2.89Å; D46-R295 IonicContact OD1-NH1 3.85Å; D46-R295 IonicContact OD1-NH2 3.41Å; D46-R295 PolarHBondContact OD1-NH2 2.69Å; D46-R295 IonicContact OD2-CZ 3.68Å; D46-R295 IonicContact OD2-NH2 3.95Å; D46-R295 PolarHBondContact OD2-NH2 3.11Å; V223-R295 WeakPolarHBondContact O-CA 3.38Å; D224-R295 WeakPolarHBondContact O-CG 3.38Å; R295-Q340 HydrophobicContact CB-CB 4.42Å
296	G	85.6	Confident	74.5	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164	-167.5	175.5	0	0	0	0	0	113.2	V223	V223-G296 PolarHBondContact N-O 3.25Å; V223-G296 PolarHBondContact O-N 3.09Å; V223-G296 VanDerWaalsContact O-N 3.16Å
297	L	88	Confident	73.5	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.3	177.4	-65.6	171.7	0	0	0	110.2	V220 A222 L241 P254 L307 I396 P398	V220-L297 HydrophobicContact CG1-CD2 3.93Å; A222-L297 HydrophobicContact CB-CD2 4.11Å; L241-L297 HydrophobicContact CD1-CD2 3.86Å; P254-L297 WeakPolarHBondContact CD-O 3.35Å; P254-L297 VanDerWaalsContact CG-O 3.3Å; P254-L297 WeakPolarHBondContact CG-O 3.27Å; L297-L307 HydrophobicContact CB-CD2 4.26Å; L297-L307 HydrophobicContact CD1-CD2 4.39Å; L297-I396 HydrophobicContact CB-CG2 4.45Å; L297-I396 HydrophobicContact CD1-CB 4.1Å; L297-I396 HydrophobicContact CD1-CG2 3.63Å; L297-P398 HydrophobicContact CD1-CG 4.05Å
298	V	89.1	Confident	73.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	146.7	173.3	172.9	0	0	0	0	107.4	V220 F221 V223 L236 I251 G252 L253 L293	V220-V298 CarbonylContact C-O 3.52Å; V220-V298 WeakPolarHBondContact CA-O 3.48Å; F221-V298 HydrophobicContact CB-CB 4.39Å; F221-V298 PolarHBondContact N-O 2.92Å; F221-V298 PolarHBondContact O-N 2.95Å; V223-V298 HydrophobicContact CG2-CB 4.31Å; V223-V298 HydrophobicContact CG2-CG2 3.62Å; L236-V298 HydrophobicContact CD1-CG2 4.39Å; I251-V298 HydrophobicContact CB-CG1 3.8Å; I251-V298 HydrophobicContact CD1-CG1 3.6Å; I251-V298 HydrophobicContact CG1-CG1 4.16Å; I251-V298 HydrophobicContact CG2-CG1 4.45Å; G252-V298 WeakPolarHBondContact O-CG1 3.37Å; L253-V298 HydrophobicContact CG-CG2 4.37Å; L293-V298 HydrophobicContact CD2-CG2 4.16Å
299	G	87.3	Confident	72.8	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	-171.7	177.9	0	0	0	0	0	115	F219 I251 G252 L307	F219-G299 CarbonylContact O-C 3.43Å; F219-G299 WeakPolarHBondContact O-CA 3.38Å; I251-G299 CarbonylContact C-O 3.48Å; G252-G299 PolarHBondContact N-O 3.17Å; G252-G299 PolarHBondContact O-N 3.28Å; G299-L307 VanDerWaalsContact CA-CD1 3.46Å
300	D	78.7	Confident	72.6	Confident	45 Å²	45	47.6 Å²	47.6	24%	0.241	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	146.7	-178.1	179.8	23.2	0	0	0	112	F219 T302 S303 T304	F219-D300 HydrophobicContact CB-CB 4.01Å; F219-D300 PolarHBondContact O-N 3.4Å; F219-D300 VanDerWaalsContact O-N 3.11Å; D300-T302 VanDerWaalsContact C-N 3.28Å; D300-T302 PolarHBondContact O-N 3.21Å; D300-T302 PolarHBondContact OD1-N 3.12Å; D300-T302 WeakPolarHBondContact OD2-CB 3.46Å; D300-T302 PolarHBondContact OD2-OG1 3.43Å; D300-S303 PolarHBondContact N-OG 3Å; D300-S303 CarbonylContact O-C 3.53Å; D300-S303 PolarHBondContact O-N 2.87Å; D300-S303 VanDerWaalsContact O-N 3.15Å; D300-S303 PolarHBondContact O-OG 2.92Å; D300-T304 PolarHBondContact O-N 3.13Å
301	I	62.5	Low	72.8	Confident	52 Å²	52	53.8 Å²	53.8	27%	0.267	27%	0.274	S	S	.	.	S	Bend	trans	-53.6	-44.2	171.9	-59.1	167.8	0	0	0	110.7	T250 Q259 S303 T304	T250-I301 HydrophobicContact CG2-CD1 3.59Å; T250-I301 HydrophobicContact CG2-CG1 4.48Å; Q259-I301 VanDerWaalsContact CD-CD1 3.45Å; Q259-I301 HydrophobicContact CG-CD1 4.17Å; Q259-I301 HydrophobicContact CG-CG1 4.04Å; I301-S303 PolarHBondContact O-N 2.82Å; I301-T304 WeakPolarHBondContact O-CB 3.48Å; I301-T304 WeakPolarHBondContact O-CG2 3.33Å; I301-T304 PolarHBondContact O-N 3.43Å; I301-T304 PolarHBondContact O-OG1 2.96Å
302	T	49.6	Very low	73.1	Confident	65 Å²	65	49.9 Å²	49.9	40%	0.399	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.1	-177.8	75.1	0	0	0	0	112.2	D300 I480 R482	D300-T302 VanDerWaalsContact C-N 3.28Å; D300-T302 PolarHBondContact O-N 3.21Å; D300-T302 PolarHBondContact OD1-N 3.12Å; D300-T302 WeakPolarHBondContact OD2-CB 3.46Å; D300-T302 PolarHBondContact OD2-OG1 3.43Å; T302-I480 HydrophobicContact CG2-CD1 4.31Å; T302-R482 PolarHBondContact O-NH2 3.35Å
303	S	51	Low	73.5	Confident	9 Å²	9	45.5 Å²	45.5	6%	0.063	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	10	176.6	65.7	0	0	0	0	113.9	D300 I301 D305 N306	D300-S303 PolarHBondContact N-OG 3Å; D300-S303 CarbonylContact O-C 3.53Å; D300-S303 PolarHBondContact O-N 2.87Å; D300-S303 VanDerWaalsContact O-N 3.15Å; D300-S303 PolarHBondContact O-OG 2.92Å; I301-S303 PolarHBondContact O-N 2.82Å; S303-D305 PolarHBondContact O-N 3.1Å; S303-N306 WeakPolarHBondContact O-CB 3.36Å; S303-N306 PolarHBondContact O-N 3.29Å
304	T	48.2	Very low	73.8	Confident	56 Å²	56	46.6 Å²	46.6	34%	0.344	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-55.9	-25.2	-176.7	38.8	0	0	0	0	113.4	D300 I301 N306 L307 I308	D300-T304 PolarHBondContact O-N 3.13Å; I301-T304 WeakPolarHBondContact O-CB 3.48Å; I301-T304 WeakPolarHBondContact O-CG2 3.33Å; I301-T304 PolarHBondContact O-N 3.43Å; I301-T304 PolarHBondContact O-OG1 2.96Å; T304-N306 PolarHBondContact O-N 2.69Å; T304-L307 CarbonylContact O-C 3.58Å; T304-L307 PolarHBondContact O-N 2.8Å; T304-I308 WeakPolarHBondContact O-CG1 3.42Å; T304-I308 PolarHBondContact O-N 2.95Å
305	D	51.1	Low	74.5	Confident	42 Å²	42	39.5 Å²	39.5	23%	0.225	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-59.8	-29.3	173.1	-57.6	-45.8	0	0	0	113.1	S303 R482	S303-D305 PolarHBondContact O-N 3.1Å; D305-R482 IonicContact OD1-NH1 3.91Å; D305-R482 IonicContact OD2-CZ 2.83Å; D305-R482 IonicContact OD2-NH1 3.26Å; D305-R482 PolarHBondContact OD2-NH1 2.73Å; D305-R482 IonicContact OD2-NH2 3Å
306	N	57.7	Low	74.8	Confident	64 Å²	64	35.7 Å²	35.7	34%	0.342	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-87	-11.2	175.8	-71.5	-25.8	0	0	0	114.1	S303 T304	S303-N306 WeakPolarHBondContact O-CB 3.36Å; S303-N306 PolarHBondContact O-N 3.29Å; T304-N306 PolarHBondContact O-N 2.69Å
307	L	70.3	Confident	74.9	Confident	6 Å²	6	37.2 Å²	37.2	3%	0.031	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-115.4	20.4	-179.8	-64.5	176.3	0	0	0	112.5	V220 P254 L297 G299 T304 P309 I396	V220-L307 HydrophobicContact CG1-CD2 4.19Å; V220-L307 HydrophobicContact CG2-CD1 4.36Å; V220-L307 HydrophobicContact CG2-CD2 4.13Å; V220-L307 HydrophobicContact CG2-CG 4.48Å; P254-L307 HydrophobicContact CB-CB 4.29Å; P254-L307 VanDerWaalsContact CB-O 3.23Å; P254-L307 WeakPolarHBondContact CB-O 3.22Å; P254-L307 HydrophobicContact CG-CB 4.42Å; L297-L307 HydrophobicContact CB-CD2 4.26Å; L297-L307 HydrophobicContact CD1-CD2 4.39Å; G299-L307 VanDerWaalsContact CA-CD1 3.46Å; T304-L307 CarbonylContact O-C 3.58Å; T304-L307 PolarHBondContact O-N 2.8Å; L307-P309 WeakPolarHBondContact O-CD 3.2Å; L307-I396 HydrophobicContact CB-CG2 4.22Å; L307-I396 HydrophobicContact CD2-CG2 3.53Å; L307-I396 HydrophobicContact CG-CG2 4.48Å
308	I	73.8	Confident	75	Confident	98 Å²	98	37.3 Å²	37.3	50%	0.503	20%	0.204	S	C	.	.			trans	-73.8	125.5	172.9	-51.9	-174	0	0	0	108.6	T304 C310	T304-I308 WeakPolarHBondContact O-CG1 3.42Å; T304-I308 PolarHBondContact O-N 2.95Å; I308-C310 PolarHBondContact O-N 3.41Å
309	P	79.6	Confident	75	Confident	40 Å²	40	40.5 Å²	40.5	26%	0.26	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	127.2	170.7	-23.4	33.7	0	0	0	110.4	Y255 L307 P394 I396	Y255-P309 HydrophobicContact CD1-CG 4.11Å; Y255-P309 HydrophobicContact CE1-CB 4.11Å; Y255-P309 HydrophobicContact CE1-CG 3.87Å; L307-P309 WeakPolarHBondContact O-CD 3.2Å; P309-P394 HydrophobicContact CB-CB 3.82Å; P309-I396 HydrophobicContact CB-CG1 4.31Å; P309-I396 HydrophobicContact CG-CD1 4.34Å; P309-I396 HydrophobicContact CG-CG1 3.93Å
310	C	80.5	Confident	75.2	Confident	26 Å²	26	42.1 Å²	42.1	18%	0.176	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146.1	-177.6	66.8	0	0	0	0	110.7	I308 F391 P394 V395	I308-C310 PolarHBondContact O-N 3.41Å; C310-F391 WeakPolarHBondContact O-CD2 3.32Å; C310-P394 WeakPolarHBondContact O-CA 3.37Å; C310-V395 PolarHBondContact N-O 2.86Å; C310-V395 PolarHBondContact O-N 3.39Å; C310-V395 PolarHBondContact SG-O 2.98Å
311	Y	82.9	Confident	75.8	Confident	155 Å²	155	40.3 Å²	40.3	61%	0.608	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	-11.1	175.9	-72.2	-86	0	0	0	113	F391 P394	Y311-F391 PolarHBondContact O-N 3.03Å; Y311-P394 HydrophobicContact CD1-CB 4.27Å; Y311-P394 HydrophobicContact CD2-CB 4.26Å; Y311-P394 HydrophobicContact CE1-CB 4.02Å; Y311-P394 HydrophobicContact CE1-CG 4.04Å; Y311-P394 HydrophobicContact CE2-CB 3.99Å; Y311-P394 HydrophobicContact CE2-CG 4.4Å; Y311-P394 HydrophobicContact CG-CB 4.39Å
312	A	85.1	Confident	76.8	Confident	46 Å²	46	41.8 Å²	41.8	38%	0.38	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	146.8	177.2	0	0	0	0	0	110.9	L388 L389 E390	A312-L388 HydrophobicContact CB-CD1 4.31Å; A312-L389 CarbonylContact C-O 3.5Å; A312-L389 WeakPolarHBondContact CA-O 3.5Å; A312-L389 VanDerWaalsContact CB-O 3.27Å; A312-L389 WeakPolarHBondContact CB-O 3.32Å; A312-E390 HydrophobicContact CB-CG 4.43Å
313	C	86.1	Confident	78.5	Confident	13 Å²	13	43.2 Å²	43.2	9%	0.088	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	161.3	171.4	86.6	0	0	0	0	110.7	L389 F391 C397	C313-L389 PolarHBondContact N-O 2.87Å; C313-L389 PolarHBondContact O-N 3.34Å; C313-F391 HydrophobicContact CB-CE2 4.01Å; C313-F391 HydrophobicContact CB-CZ 4.1Å; C313-F391 WeakPolarHBondContact SG-CZ 3.5Å; C313-C397 HydrophobicContact CB-CB 4.41Å
314	I	87.5	Confident	80.3	Confident	29 Å²	29	43.4 Å²	43.4	15%	0.149	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133	173.8	-60.7	169.6	0	0	0	107.4	F350 F365 Y386 V387 L388 C425 I537	I314-F350 HydrophobicContact CG2-CZ 3.81Å; I314-F365 HydrophobicContact CD1-CD1 3.75Å; I314-F365 HydrophobicContact CD1-CE1 3.39Å; I314-F365 HydrophobicContact CD1-CE2 4.4Å; I314-F365 HydrophobicContact CD1-CG 4.37Å; I314-F365 HydrophobicContact CD1-CZ 3.78Å; I314-F365 HydrophobicContact CG2-CD2 4.46Å; I314-Y386 HydrophobicContact CG2-CD1 4.23Å; I314-V387 CarbonylContact C-O 3.54Å; I314-V387 VanDerWaalsContact CA-O 3.31Å; I314-V387 WeakPolarHBondContact CA-O 3.42Å; I314-L388 HydrophobicContact CG1-CD1 3.98Å; I314-C425 HydrophobicContact CB-CB 4.19Å; I314-C425 HydrophobicContact CG2-CB 4.28Å; I314-C425 VanDerWaalsContact O-CB 3.27Å; I314-C425 WeakPolarHBondContact O-CB 3.25Å; I314-C425 PolarHBondContact O-N 2.7Å; I314-I537 HydrophobicContact CD1-CD1 3.74Å; I314-I537 HydrophobicContact CG1-CD1 4.22Å
315	L	89.6	Confident	82.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	144.1	166.5	-42.6	178.2	0	0	0	110.8	V318 Y386 V387 L389 A403 H423 V424 C425	L315-V318 HydrophobicContact CB-CG2 3.77Å; L315-Y386 VanDerWaalsContact O-CA 3.24Å; L315-Y386 WeakPolarHBondContact O-CA 3.4Å; L315-Y386 WeakPolarHBondContact O-CB 3.37Å; L315-V387 HydrophobicContact CB-CG1 3.8Å; L315-V387 HydrophobicContact CD1-CG1 3.79Å; L315-V387 HydrophobicContact CG-CG1 3.82Å; L315-V387 PolarHBondContact N-O 2.8Å; L315-V387 PolarHBondContact O-N 2.84Å; L315-V387 VanDerWaalsContact O-N 3.09Å; L315-L389 HydrophobicContact CD1-CD1 3.6Å; L315-L389 HydrophobicContact CD1-CG 4.25Å; L315-L389 HydrophobicContact CD2-CD1 3.98Å; L315-L389 HydrophobicContact CG-CD1 3.69Å; L315-L389 HydrophobicContact CG-CG 4.13Å; L315-A403 HydrophobicContact CD1-CB 3.54Å; L315-A403 HydrophobicContact CD2-CB 3.49Å; L315-A403 VanDerWaalsContact CD2-CB 3.49Å; L315-A403 HydrophobicContact CG-CB 4.16Å; L315-H423 CarbonylContact C-O 3.49Å; L315-H423 VanDerWaalsContact CA-O 3.23Å; L315-H423 WeakPolarHBondContact CA-O 2.85Å; L315-V424 HydrophobicContact CD2-CB 4.43Å; L315-V424 HydrophobicContact CD2-CG2 3.84Å; L315-C425 VanDerWaalsContact C-SG 3.52Å
316	S	87.2	Confident	83.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	165.8	169.8	50.8	0	0	0	0	110.1	V318 H423 C425	S316-V318 PolarHBondContact O-N 2.8Å; S316-H423 PolarHBondContact N-O 2.76Å; S316-H423 PolarHBondContact O-N 2.82Å; S316-H423 PolarHBondContact OG-O 2.7Å; S316-C425 WeakPolarHBondContact CB-SG 3.47Å; S316-C425 PolarHBondContact N-SG 2.86Å; S316-C425 PolarHBondContact OG-SG 3.15Å
317	N	86.2	Confident	85.4	Confident	32 Å²	32	50.5 Å²	50.5	17%	0.171	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	53	40.7	176.2	-156.7	23.7	0	0	0	111	K319	N317-K319 PolarHBondContact O-N 2.9Å
318	V	90.2	Very high	86.4	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.03	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	125.7	-174.3	-178.9	0	0	0	0	108.5	L315 S316 F349 I377 V385 V387 L420 Y421	L315-V318 HydrophobicContact CB-CG2 3.77Å; S316-V318 PolarHBondContact O-N 2.8Å; V318-F349 HydrophobicContact CG1-CE1 4.32Å; V318-I377 HydrophobicContact CG1-CD1 3.89Å; V318-V385 HydrophobicContact CB-CG1 4.37Å; V318-V385 PolarHBondContact N-O 3.22Å; V318-V387 HydrophobicContact CG1-CG1 4.39Å; V318-V387 HydrophobicContact CG2-CB 4.12Å; V318-V387 HydrophobicContact CG2-CG1 3.75Å; V318-L420 HydrophobicContact CG1-CD1 4.4Å; V318-Y421 WeakPolarHBondContact CA-O 3.06Å
319	K	90.2	Very high	87.1	Confident	67 Å²	67	50.2 Å²	50.2	29%	0.291	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.9	179.9	-68.1	178.1	-178.1	-179.3	0	109.9	N317 L420 Y421	N317-K319 PolarHBondContact O-N 2.9Å; K319-L420 CarbonylContact O-C 3.59Å; K319-L420 WeakPolarHBondContact O-CA 3.23Å; K319-L420 WeakPolarHBondContact O-CB 3.09Å; K319-Y421 HydrophobicContact CB-CD1 4.4Å; K319-Y421 HydrophobicContact CB-CE1 3.82Å; K319-Y421 HydrophobicContact CB-CE2 4.03Å; K319-Y421 HydrophobicContact CD-CE2 4.01Å; K319-Y421 WeakPolarHBondContact CD-OH 3.41Å; K319-Y421 HydrophobicContact CG-CE2 4.48Å; K319-Y421 PolarHBondContact N-O 2.97Å; K319-Y421 PolarHBondContact O-N 3.29Å
320	K	91.6	Very high	87.4	Confident	35 Å²	35	48.8 Å²	48.8	15%	0.152	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.8	168.4	-179.9	170.7	166.1	-158.1	0	109.3	S322 I328 I377 N379	K320-S322 PolarHBondContact O-N 2.8Å; K320-I328 HydrophobicContact CD-CD1 4.19Å; K320-I328 HydrophobicContact CG-CD1 4.1Å; K320-I377 HydrophobicContact CB-CD1 4.35Å; K320-I377 HydrophobicContact CB-CG2 4.24Å; K320-I377 HydrophobicContact CD-CG2 3.94Å; K320-N379 WeakPolarHBondContact CD-OD1 3.26Å; K320-N379 WeakPolarHBondContact CE-OD1 3.37Å; K320-N379 PolarHBondContact NZ-OD1 2.85Å
321	V	90	Very high	87.6	Confident	7 Å²	7	53.3 Å²	53.3	4%	0.042	27%	0.265	C	S	.	.			trans	-71.1	124.3	174.2	173	0	0	0	0	108.9	V118 I122 Y323 Y324 I418 A419 Y421	V118-V321 HydrophobicContact CG1-CG1 3.6Å; V118-V321 HydrophobicContact CG1-CG2 4.07Å; V118-V321 HydrophobicContact CG2-CG1 4.21Å; I122-V321 HydrophobicContact CD1-CG2 4.12Å; V321-Y323 HydrophobicContact CG1-CD2 4.34Å; V321-Y323 PolarHBondContact O-N 3.35Å; V321-Y324 VanDerWaalsContact O-CB 3.29Å; V321-Y324 WeakPolarHBondContact O-CB 3.29Å; V321-Y324 PolarHBondContact O-N 2.61Å; V321-I418 WeakPolarHBondContact CB-O 3.5Å; V321-I418 HydrophobicContact CG2-CB 4.43Å; V321-I418 HydrophobicContact CG2-CG2 3.86Å; V321-A419 PolarHBondContact N-O 3.28Å; V321-Y421 HydrophobicContact CG2-CD1 3.93Å; V321-Y421 HydrophobicContact CG2-CE1 4.21Å
322	S	85	Confident	88.1	Confident	83 Å²	83	47.7 Å²	47.7	58%	0.58	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.9	-177.4	53.3	0	0	0	0	113.4	K320 Y324	K320-S322 PolarHBondContact O-N 2.8Å; S322-Y324 VanDerWaalsContact C-N 3.28Å; S322-Y324 PolarHBondContact O-N 2.86Å
323	Y	85.7	Confident	88.5	Confident	95 Å²	95	51.3 Å²	51.3	37%	0.373	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.3	178.3	-56.1	-78.4	0	0	0	114	V118 V321 K325 C416	V118-Y323 HydrophobicContact CG2-CD2 3.4Å; V118-Y323 VanDerWaalsContact CG2-CD2 3.4Å; V118-Y323 HydrophobicContact CG2-CE2 3.93Å; V118-Y323 HydrophobicContact CG2-CG 4.21Å; V321-Y323 HydrophobicContact CG1-CD2 4.34Å; V321-Y323 PolarHBondContact O-N 3.35Å; Y323-K325 PolarHBondContact O-N 3.38Å; Y323-C416 WeakPolarHBondContact O-CB 3.49Å
324	Y	88.3	Confident	88.9	Confident	12 Å²	12	51 Å²	51	5%	0.047	25%	0.25	C	C	.	.			trans	-83	111	175.6	-168.2	-104.2	0	0	0	110.7	V321 S322 L326 I328 K407 C416 I418 A419	V321-Y324 VanDerWaalsContact O-CB 3.29Å; V321-Y324 WeakPolarHBondContact O-CB 3.29Å; V321-Y324 PolarHBondContact O-N 2.61Å; S322-Y324 VanDerWaalsContact C-N 3.28Å; S322-Y324 PolarHBondContact O-N 2.86Å; Y324-L326 HydrophobicContact CD1-CB 4.32Å; Y324-L326 VanDerWaalsContact CD1-O 3.23Å; Y324-L326 WeakPolarHBondContact CD1-O 3.45Å; Y324-L326 HydrophobicContact CE1-CB 3.59Å; Y324-L326 HydrophobicContact CE1-CG 4.5Å; Y324-L326 VanDerWaalsContact CE1-O 3.32Å; Y324-L326 WeakPolarHBondContact CE1-O 3.44Å; Y324-I328 HydrophobicContact CD1-CD1 3.92Å; Y324-I328 HydrophobicContact CD1-CG1 3.96Å; Y324-I328 HydrophobicContact CE1-CD1 3.98Å; Y324-I328 HydrophobicContact CE1-CG1 3.64Å; Y324-K407 HydrophobicContact CE2-CB 4.46Å; Y324-C416 WeakPolarHBondContact CD2-O 3.44Å; Y324-I418 WeakPolarHBondContact CB-O 3.49Å; Y324-I418 WeakPolarHBondContact CD2-O 3.41Å; Y324-A419 HydrophobicContact CD1-CB 3.93Å; Y324-A419 HydrophobicContact CD2-CB 3.89Å; Y324-A419 HydrophobicContact CE1-CB 3.77Å; Y324-A419 HydrophobicContact CE2-CB 3.76Å; Y324-A419 HydrophobicContact CG-CB 3.98Å
325	K	86.2	Confident	89.2	Confident	165 Å²	165	51.5 Å²	51.5	72%	0.717	25%	0.251	S	S	*	.			trans	-78.9	-24.7	-171.2	-66.4	-177	177.8	176.5	0	114.3	Y323	Y323-K325 PolarHBondContact O-N 3.38Å
326	L	87.8	Confident	89.4	Confident	84 Å²	84	51.5 Å²	51.5	44%	0.44	25%	0.251	S	S	.	.	S	Bend	trans	-81.6	148	-174.6	-56.5	174.5	0	0	0	110.9	Y324	Y324-L326 HydrophobicContact CD1-CB 4.32Å; Y324-L326 VanDerWaalsContact CD1-O 3.23Å; Y324-L326 WeakPolarHBondContact CD1-O 3.45Å; Y324-L326 HydrophobicContact CE1-CB 3.59Å; Y324-L326 HydrophobicContact CE1-CG 4.5Å; Y324-L326 VanDerWaalsContact CE1-O 3.32Å; Y324-L326 WeakPolarHBondContact CE1-O 3.44Å
327	S	88.8	Confident	89.6	Confident	63 Å²	63	51.5 Å²	51.5	44%	0.441	25%	0.251	S	S	.	.			trans	-64.1	139.1	167.9	52.9	0	0	0	0	110.2	E376	S327-E376 WeakPolarHBondContact CB-OE1 3.37Å
328	I	91.6	Very high	89.6	Confident	4 Å²	4	50 Å²	50	2%	0.021	24%	0.244	C	C	.	.			trans	-116.1	104.7	174.6	-46.5	167.8	0	0	0	107.6	K320 Y324 L334 F349 I377 A419 L420	K320-I328 HydrophobicContact CD-CD1 4.19Å; K320-I328 HydrophobicContact CG-CD1 4.1Å; Y324-I328 HydrophobicContact CD1-CD1 3.92Å; Y324-I328 HydrophobicContact CD1-CG1 3.96Å; Y324-I328 HydrophobicContact CE1-CD1 3.98Å; Y324-I328 HydrophobicContact CE1-CG1 3.64Å; I328-L334 HydrophobicContact CG2-CD1 4.15Å; I328-F349 HydrophobicContact CG2-CE2 3.89Å; I328-F349 HydrophobicContact CG2-CZ 3.75Å; I328-I377 HydrophobicContact CB-CG2 3.81Å; I328-I377 HydrophobicContact CD1-CG2 4.26Å; I328-I377 HydrophobicContact CG1-CG2 4.43Å; I328-I377 PolarHBondContact O-N 3.34Å; I328-I377 VanDerWaalsContact O-N 3.15Å; I328-A419 HydrophobicContact CD1-CB 3.64Å; I328-A419 WeakPolarHBondContact CD1-O 3.28Å; I328-A419 HydrophobicContact CG1-CB 4.43Å; I328-L420 HydrophobicContact CD1-CB 4.37Å; I328-L420 HydrophobicContact CD1-CD2 4.12Å; I328-L420 HydrophobicContact CG2-CD2 4.24Å
329	K	89.1	Confident	89.2	Confident	93 Å²	93	49.9 Å²	49.9	40%	0.404	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-94	155	-179.8	-58.9	-170.8	178.2	-167.7	0	111	S332 D375 E376	K329-S332 PolarHBondContact N-OG 2.81Å; K329-S332 WeakPolarHBondContact O-CB 3.2Å; K329-S332 PolarHBondContact O-N 3.41Å; K329-S332 VanDerWaalsContact O-N 3.1Å; K329-S332 PolarHBondContact O-OG 2.98Å; K329-D375 CarbonylContact C-O 3.58Å; K329-D375 WeakPolarHBondContact CA-O 3.48Å; K329-E376 WeakPolarHBondContact CE-OE2 3.33Å; K329-E376 HydrophobicContact CG-CB 4.27Å; K329-E376 HydrophobicContact CG-CG 4.22Å
330	S	85.8	Confident	88.7	Confident	10 Å²	10	47.2 Å²	47.2	7%	0.07	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	149.1	161.4	-80.2	0	0	0	0	109.9	S332 L347 F349 Y373 I374 D375	S330-S332 PolarHBondContact O-N 2.82Å; S330-L347 CarbonylContact C-O 3.58Å; S330-L347 WeakPolarHBondContact CA-O 3.36Å; S330-F349 WeakPolarHBondContact OG-CD2 3.4Å; S330-F349 PolarHBondContact OG-N 3.21Å; S330-Y373 WeakPolarHBondContact CB-OH 3.47Å; S330-I374 PolarHBondContact OG-O 3.26Å; S330-D375 PolarHBondContact N-O 2.79Å
331	Q	85.9	Confident	88.3	Confident	121 Å²	121	47 Å²	47	57%	0.565	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	0.8	-169	-53.9	-62.1	-34	0	0	115.8	L347 T348	Q331-L347 PolarHBondContact N-O 3.31Å; Q331-T348 PolarHBondContact NE2-OG1 2.94Å
332	S	92.3	Very high	88.3	Confident	37 Å²	37	48.1 Å²	48.1	26%	0.259	24%	0.238	S	C	.	.			trans	-64.1	153.8	169.1	-60.6	0	0	0	0	110.6	K329 S330 S346 L347	K329-S332 PolarHBondContact N-OG 2.81Å; K329-S332 WeakPolarHBondContact O-CB 3.2Å; K329-S332 PolarHBondContact O-N 3.41Å; K329-S332 VanDerWaalsContact O-N 3.1Å; K329-S332 PolarHBondContact O-OG 2.98Å; S330-S332 PolarHBondContact O-N 2.82Å; S332-S346 WeakPolarHBondContact O-CA 3.35Å; S332-L347 WeakPolarHBondContact O-CD1 3.49Å; S332-L347 PolarHBondContact O-N 3.26Å
333	R	93.9	Very high	88.6	Confident	122 Å²	122	44.7 Å²	44.7	46%	0.46	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.6	172.7	-57.4	-175.6	81.1	-163.3	-0.2	110.6	L344 S345 E392	R333-L344 HydrophobicContact CB-CD1 4.15Å; R333-L344 HydrophobicContact CB-CG 4.44Å; R333-L344 VanDerWaalsContact NH2-CD2 3.32Å; R333-S345 VanDerWaalsContact CA-O 3.26Å; R333-S345 WeakPolarHBondContact CA-O 3.21Å; R333-E392 IonicContact CZ-OE2 3.55Å; R333-E392 IonicContact NH2-OE2 3.43Å; R333-E392 PolarHBondContact NH2-OE2 2.72Å
334	L	93.9	Very high	89	Confident	6 Å²	6	42 Å²	42	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.4	174.3	-64	174.1	0	0	0	110.6	I328 I336 S345 L347 K407 A419 L420	I328-L334 HydrophobicContact CG2-CD1 4.15Å; L334-I336 HydrophobicContact CB-CD1 4.02Å; L334-I336 PolarHBondContact O-N 3.07Å; L334-S345 PolarHBondContact N-O 3.37Å; L334-S345 PolarHBondContact O-N 3.42Å; L334-L347 HydrophobicContact CB-CD1 3.86Å; L334-L347 HydrophobicContact CD1-CD1 4.02Å; L334-L347 HydrophobicContact CD1-CD2 3.89Å; L334-L347 HydrophobicContact CG-CD1 3.82Å; L334-K407 HydrophobicContact CD2-CB 3.9Å; L334-K407 HydrophobicContact CD2-CD 4.42Å; L334-K407 HydrophobicContact CD2-CG 4.44Å; L334-A419 HydrophobicContact CD1-CB 3.89Å; L334-A419 HydrophobicContact CD2-CB 4.3Å; L334-L420 HydrophobicContact CD1-CD2 4.02Å; L334-L420 HydrophobicContact CD1-CG 4.28Å
335	H	93.9	Very high	89.2	Confident	40 Å²	40	41.5 Å²	41.5	19%	0.185	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	114.2	167.3	-68.1	80.9	0	0	0	107.8	F337 T342 G405 A406 L408 D409	H335-F337 HydrophobicContact CB-CE2 4.17Å; H335-T342 HydrophobicContact CB-CG2 4.18Å; H335-G405 WeakPolarHBondContact O-CA 3.37Å; H335-A406 WeakPolarHBondContact CB-O 3.43Å; H335-A406 PolarHBondContact N-O 2.93Å; H335-A406 PolarHBondContact O-N 3.16Å; H335-L408 HydrophobicContact CB-CD1 3.79Å; H335-L408 HydrophobicContact CB-CG 4.05Å; H335-D409 IonicContact CE1-OD1 3.67Å; H335-D409 PolarHBondContact CE1-OD1 2.86Å; H335-D409 IonicContact CE1-OD2 2.71Å
336	I	93.3	Very high	89.4	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.3	177.6	-50.3	-57.6	0	0	0	108.9	L334 I338 T342 V343 L347 L389 A403 I404	L334-I336 HydrophobicContact CB-CD1 4.02Å; L334-I336 PolarHBondContact O-N 3.07Å; I336-I338 HydrophobicContact CG2-CD1 3.9Å; I336-I338 HydrophobicContact CG2-CG1 3.69Å; I336-T342 VanDerWaalsContact O-CA 3.32Å; I336-T342 WeakPolarHBondContact O-CA 3.24Å; I336-V343 PolarHBondContact N-O 2.91Å; I336-V343 PolarHBondContact O-N 2.83Å; I336-L347 HydrophobicContact CD1-CD2 4.46Å; I336-L389 HydrophobicContact CB-CD1 4.45Å; I336-L389 HydrophobicContact CD1-CD1 4.4Å; I336-L389 HydrophobicContact CD1-CD2 4.05Å; I336-L389 HydrophobicContact CG1-CD1 4.08Å; I336-L389 HydrophobicContact CG1-CD2 4.19Å; I336-L389 HydrophobicContact CG2-CD1 3.71Å; I336-A403 HydrophobicContact CG2-CB 4.34Å; I336-I404 CarbonylContact C-O 3.56Å; I336-I404 WeakPolarHBondContact CA-O 3.47Å
337	F	91.5	Very high	89.7	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.4	175	-65.9	-97.2	0	0	0	109.1	K87 L90 H335 E341 T342 A403 I404 A406 L408	K87-F337 HydrophobicContact CB-CE1 3.73Å; K87-F337 HydrophobicContact CB-CZ 4.07Å; K87-F337 HydrophobicContact CD-CE1 4.25Å; K87-F337 HydrophobicContact CG-CE1 3.76Å; K87-F337 HydrophobicContact CG-CZ 4.47Å; L90-F337 HydrophobicContact CB-CD1 3.83Å; L90-F337 HydrophobicContact CB-CE1 4.11Å; L90-F337 HydrophobicContact CB-CG 4.1Å; L90-F337 HydrophobicContact CD1-CD1 4.15Å; L90-F337 HydrophobicContact CD1-CD2 3.7Å; L90-F337 HydrophobicContact CD1-CE1 3.95Å; L90-F337 HydrophobicContact CD1-CE2 3.49Å; L90-F337 VanDerWaalsContact CD1-CE2 3.49Å; L90-F337 HydrophobicContact CD1-CG 4.02Å; L90-F337 HydrophobicContact CD1-CZ 3.6Å; H335-F337 HydrophobicContact CB-CE2 4.17Å; F337-E341 WeakPolarHBondContact CA-O 3.33Å; F337-T342 HydrophobicContact CD1-CG2 3.88Å; F337-T342 WeakPolarHBondContact CD1-OG1 3.33Å; F337-T342 HydrophobicContact CD2-CG2 4.22Å; F337-T342 HydrophobicContact CE1-CG2 3.53Å; F337-T342 WeakPolarHBondContact CE1-OG1 2.98Å; F337-T342 HydrophobicContact CE2-CG2 3.91Å; F337-T342 HydrophobicContact CG-CG2 4.22Å; F337-T342 HydrophobicContact CZ-CG2 3.57Å; F337-A403 VanDerWaalsContact O-CA 3.27Å; F337-A403 WeakPolarHBondContact O-CA 3.43Å; F337-I404 HydrophobicContact CB-CB 4.31Å; F337-I404 WeakPolarHBondContact CD2-O 3.44Å; F337-I404 PolarHBondContact N-O 2.88Å; F337-I404 PolarHBondContact O-N 3.41Å; F337-A406 HydrophobicContact CE2-CB 4.03Å; F337-L408 HydrophobicContact CE2-CD1 4.17Å; F337-L408 HydrophobicContact CZ-CD1 3.79Å; F337-L408 HydrophobicContact CZ-CD2 4.47Å
338	I	87.6	Confident	89.6	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	120.7	177.3	-53.2	-175.3	0	0	0	107.7	I336 Q340 E341 F391 V395 C397 A403 V424	I336-I338 HydrophobicContact CG2-CD1 3.9Å; I336-I338 HydrophobicContact CG2-CG1 3.69Å; I338-Q340 PolarHBondContact O-N 2.94Å; I338-E341 PolarHBondContact N-O 2.9Å; I338-E341 VanDerWaalsContact N-O 3.14Å; I338-E341 PolarHBondContact O-N 2.72Å; I338-F391 HydrophobicContact CD1-CE1 3.99Å; I338-F391 HydrophobicContact CD1-CZ 3.58Å; I338-V395 HydrophobicContact CB-CG1 4.41Å; I338-C397 VanDerWaalsContact CD1-SG 3.59Å; I338-C397 HydrophobicContact CG2-CB 4.41Å; I338-A403 HydrophobicContact CD1-CB 4.15Å; I338-A403 HydrophobicContact CG1-CB 3.83Å; I338-V424 HydrophobicContact CG2-CG2 4.31Å
339	G	80.9	Confident	89.4	Confident	2 Å²	2	28.1 Å²	28.1	2%	0.021	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	-124.2	-173.4	0	0	0	0	0	111.7	Q94	Q94-G339 PolarHBondContact OE1-O 3.29Å
340	Q	79.9	Confident	89.2	Confident	12 Å²	12	23.8 Å²	23.8	6%	0.056	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	4.8	175.7	-67.5	-66.7	-21.8	0	0	112.7	A222 R295 I338	A222-Q340 HydrophobicContact CB-CG 4.09Å; R295-Q340 HydrophobicContact CB-CB 4.42Å; I338-Q340 PolarHBondContact O-N 2.94Å
341	E	84	Confident	89.1	Confident	29 Å²	29	24.4 Å²	24.4	14%	0.136	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	156.6	-171.7	-65.7	-179.2	-172.4	0	0	112.4	Y255 F337 I338 V395 I396	Y255-E341 WeakPolarHBondContact CE2-OE1 3.47Å; Y255-E341 VanDerWaalsContact CZ-OE1 3.24Å; Y255-E341 PolarHBondContact OH-OE1 2.79Å; Y255-E341 PolarHBondContact OH-OE2 2.63Å; F337-E341 WeakPolarHBondContact CA-O 3.33Å; I338-E341 PolarHBondContact N-O 2.9Å; I338-E341 VanDerWaalsContact N-O 3.14Å; I338-E341 PolarHBondContact O-N 2.72Å; E341-V395 HydrophobicContact CB-CG1 4.3Å; E341-V395 VanDerWaalsContact OE2-CG1 3.28Å; E341-V395 WeakPolarHBondContact OE2-CG1 3.42Å; E341-I396 PolarHBondContact OE2-N 3Å
342	T	88.5	Confident	88.6	Confident	31 Å²	31	20.4 Å²	20.4	19%	0.19	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	126.4	174.9	-46.3	0	0	0	0	109	K87 H335 I336 F337	K87-T342 HydrophobicContact CD-CG2 4.38Å; K87-T342 WeakPolarHBondContact CE-OG1 3.45Å; H335-T342 HydrophobicContact CB-CG2 4.18Å; I336-T342 VanDerWaalsContact O-CA 3.32Å; I336-T342 WeakPolarHBondContact O-CA 3.24Å; F337-T342 HydrophobicContact CD1-CG2 3.88Å; F337-T342 WeakPolarHBondContact CD1-OG1 3.33Å; F337-T342 HydrophobicContact CD2-CG2 4.22Å; F337-T342 HydrophobicContact CE1-CG2 3.53Å; F337-T342 WeakPolarHBondContact CE1-OG1 2.98Å; F337-T342 HydrophobicContact CE2-CG2 3.91Å; F337-T342 HydrophobicContact CG-CG2 4.22Å; F337-T342 HydrophobicContact CZ-CG2 3.57Å
343	V	91.4	Very high	87.4	Confident	12 Å²	12	21.4 Å²	21.4	7%	0.073	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	146.1	-179.4	67	0	0	0	0	110.4	I336 F391 H393 V395	I336-V343 PolarHBondContact N-O 2.91Å; I336-V343 PolarHBondContact O-N 2.83Å; V343-F391 HydrophobicContact CG1-CB 4.17Å; V343-F391 HydrophobicContact CG1-CD1 3.37Å; V343-F391 HydrophobicContact CG1-CE1 3.92Å; V343-F391 HydrophobicContact CG1-CG 3.96Å; V343-F391 HydrophobicContact CG2-CB 4.09Å; V343-H393 HydrophobicContact CG2-CB 4.34Å; V343-V395 HydrophobicContact CB-CG2 3.63Å; V343-V395 HydrophobicContact CG1-CB 4.41Å; V343-V395 HydrophobicContact CG1-CG2 3.59Å; V343-V395 HydrophobicContact CG2-CG2 4.05Å
344	L	93.9	Very high	85.7	Confident	39 Å²	39	23.4 Å²	23.4	20%	0.204	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130.7	170.6	-168.7	61.1	0	0	0	108.8	R333 E392	R333-L344 HydrophobicContact CB-CD1 4.15Å; R333-L344 HydrophobicContact CB-CG 4.44Å; R333-L344 VanDerWaalsContact NH2-CD2 3.32Å; L344-E392 WeakPolarHBondContact O-CB 3.43Å; L344-E392 PolarHBondContact O-N 2.93Å
345	S	92.8	Very high	83.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.6	-177	-169.2	0	0	0	0	112	R333 L334 L347 L389 E390	R333-S345 VanDerWaalsContact CA-O 3.26Å; R333-S345 WeakPolarHBondContact CA-O 3.21Å; L334-S345 PolarHBondContact N-O 3.37Å; L334-S345 PolarHBondContact O-N 3.42Å; S345-L347 WeakPolarHBondContact O-CD1 3.32Å; S345-L389 WeakPolarHBondContact OG-CB 3.31Å; S345-E390 CarbonylContact C-O 3.59Å; S345-E390 WeakPolarHBondContact CA-O 3.39Å; S345-E390 WeakPolarHBondContact CB-O 3.1Å; S345-E390 VanDerWaalsContact OG-C 3.23Å; S345-E390 PolarHBondContact OG-N 3.38Å; S345-E390 VanDerWaalsContact OG-N 3.14Å; S345-E390 PolarHBondContact OG-O 3.24Å
346	S	91.7	Very high	81.1	Confident	30 Å²	30	33 Å²	33	21%	0.21	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	137.9	165.8	-60.9	0	0	0	0	109.7	S332 E390	S332-S346 WeakPolarHBondContact O-CA 3.35Å; S346-E390 PolarHBondContact N-O 2.89Å; S346-E390 PolarHBondContact O-N 2.97Å
347	L	92.3	Very high	78.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.6	-174.1	-63	93.1	0	0	0	111	S330 Q331 S332 L334 I336 S345 F349 V387 L388 L389 L420	S330-L347 CarbonylContact C-O 3.58Å; S330-L347 WeakPolarHBondContact CA-O 3.36Å; Q331-L347 PolarHBondContact N-O 3.31Å; S332-L347 WeakPolarHBondContact O-CD1 3.49Å; S332-L347 PolarHBondContact O-N 3.26Å; L334-L347 HydrophobicContact CB-CD1 3.86Å; L334-L347 HydrophobicContact CD1-CD1 4.02Å; L334-L347 HydrophobicContact CD1-CD2 3.89Å; L334-L347 HydrophobicContact CG-CD1 3.82Å; I336-L347 HydrophobicContact CD1-CD2 4.46Å; S345-L347 WeakPolarHBondContact O-CD1 3.32Å; L347-F349 HydrophobicContact CB-CE2 4.19Å; L347-F349 HydrophobicContact CB-CZ 4.24Å; L347-F349 HydrophobicContact CD2-CZ 3.93Å; L347-V387 HydrophobicContact CB-CG2 3.83Å; L347-V387 HydrophobicContact CD2-CG2 4.08Å; L347-V387 HydrophobicContact CG-CG2 4.32Å; L347-L388 WeakPolarHBondContact CA-O 3.29Å; L347-L389 HydrophobicContact CD2-CD2 3.92Å; L347-L389 HydrophobicContact CG-CD2 3.76Å; L347-L420 HydrophobicContact CD2-CD1 4.5Å; L347-L420 HydrophobicContact CD2-CD2 3.62Å
348	T	87	Confident	76.2	Confident	6 Å²	6	47.7 Å²	47.7	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114.4	168.6	-62	0	0	0	0	109.8	Q331 F350 Y373 V387 L388 F538	Q331-T348 PolarHBondContact NE2-OG1 2.94Å; T348-F350 WeakPolarHBondContact O-CD1 3.42Å; T348-Y373 HydrophobicContact CG2-CD2 4.18Å; T348-Y373 HydrophobicContact CG2-CE2 4.08Å; T348-V387 CarbonylContact O-C 3.57Å; T348-V387 WeakPolarHBondContact O-CA 3.44Å; T348-L388 PolarHBondContact N-O 3.38Å; T348-L388 PolarHBondContact O-N 3.08Å; T348-F538 HydrophobicContact CG2-CE2 3.75Å; T348-F538 HydrophobicContact CG2-CZ 3.78Å
349	F	87.4	Confident	74.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143.6	-178	-61.2	-78	0	0	0	112	V318 I328 S330 L347 I374 I377 V385 V387 L420	V318-F349 HydrophobicContact CG1-CE1 4.32Å; I328-F349 HydrophobicContact CG2-CE2 3.89Å; I328-F349 HydrophobicContact CG2-CZ 3.75Å; S330-F349 WeakPolarHBondContact OG-CD2 3.4Å; S330-F349 PolarHBondContact OG-N 3.21Å; L347-F349 HydrophobicContact CB-CE2 4.19Å; L347-F349 HydrophobicContact CB-CZ 4.24Å; L347-F349 HydrophobicContact CD2-CZ 3.93Å; F349-I374 HydrophobicContact CB-CB 3.91Å; F349-I374 HydrophobicContact CB-CG2 4.2Å; F349-I374 PolarHBondContact O-N 3.33Å; F349-I377 HydrophobicContact CD1-CB 4.33Å; F349-I377 HydrophobicContact CD1-CD1 4.23Å; F349-I377 HydrophobicContact CE1-CB 4.22Å; F349-I377 HydrophobicContact CE1-CD1 3.91Å; F349-I377 HydrophobicContact CZ-CB 4.36Å; F349-I377 HydrophobicContact CZ-CG2 4.36Å; F349-V385 HydrophobicContact CD1-CG1 4.42Å; F349-V387 HydrophobicContact CD1-CB 3.8Å; F349-V387 HydrophobicContact CD1-CG2 3.57Å; F349-V387 HydrophobicContact CE1-CB 3.91Å; F349-V387 HydrophobicContact CE1-CG2 3.53Å; F349-V387 HydrophobicContact CG-CG2 4.17Å; F349-V387 HydrophobicContact CZ-CG2 4.1Å; F349-L420 HydrophobicContact CE1-CD2 3.96Å; F349-L420 HydrophobicContact CZ-CD2 3.75Å
350	F	85.4	Confident	72.4	Confident	2 Å²	2	60 Å²	60	1%	0.009	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155.2	174.1	54.6	-87.1	0	0	0	110.9	I314 T348 F365 Y371 Q372 Y386 L388 I537	I314-F350 HydrophobicContact CG2-CZ 3.81Å; T348-F350 WeakPolarHBondContact O-CD1 3.42Å; F350-F365 HydrophobicContact CE2-CD2 4.4Å; F350-F365 AromaticContact CE2-CE2 3.65Å; F350-F365 HydrophobicContact CE2-CE2 3.65Å; F350-F365 HydrophobicContact CE2-CZ 4.31Å; F350-F365 HydrophobicContact CZ-CE2 4.23Å; F350-Y371 AromaticContact CD2-CD1 3.63Å; F350-Y371 HydrophobicContact CD2-CD1 3.63Å; F350-Y371 HydrophobicContact CD2-CE1 4.45Å; F350-Y371 AromaticContact CD2-CG 3.82Å; F350-Y371 HydrophobicContact CD2-CG 3.82Å; F350-Y371 HydrophobicContact CE2-CD1 4.01Å; F350-Y371 HydrophobicContact CE2-CE1 4.43Å; F350-Y371 HydrophobicContact CE2-CG 4.25Å; F350-Q372 CarbonylContact C-O 3.49Å; F350-Q372 WeakPolarHBondContact CA-O 3.12Å; F350-Q372 WeakPolarHBondContact CB-O 3.44Å; F350-Y386 HydrophobicContact CD2-CD2 4.41Å; F350-Y386 HydrophobicContact CD2-CG 4.32Å; F350-Y386 HydrophobicContact CE2-CD2 4.24Å; F350-Y386 AromaticContact CE2-CG 3.8Å; F350-Y386 HydrophobicContact CE2-CG 3.8Å; F350-Y386 HydrophobicContact CZ-CG 4.41Å; F350-Y386 PolarHBondContact N-O 2.86Å; F350-Y386 PolarHBondContact O-N 2.74Å; F350-Y386 VanDerWaalsContact O-O 3.13Å; F350-L388 HydrophobicContact CE1-CB 3.86Å; F350-I537 HydrophobicContact CE1-CD1 3.92Å; F350-I537 HydrophobicContact CZ-CD1 3.82Å
351	T	83.3	Confident	71.1	Confident	22 Å²	22	64.9 Å²	64.9	14%	0.135	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.9	178.9	-175.1	0	0	0	0	111.5	I353 Y371 Q372 I374 N384	T351-I353 PolarHBondContact O-N 2.69Å; T351-Y371 CarbonylContact O-C 3.44Å; T351-Y371 VanDerWaalsContact O-CA 3.22Å; T351-Y371 WeakPolarHBondContact O-CA 3.08Å; T351-Y371 WeakPolarHBondContact O-CB 2.88Å; T351-Q372 HydrophobicContact CG2-CB 4.18Å; T351-Q372 PolarHBondContact N-O 2.96Å; T351-Q372 PolarHBondContact O-N 2.92Å; T351-I374 VanDerWaalsContact CB-CD1 3.48Å; T351-I374 HydrophobicContact CG2-CD1 3.62Å; T351-I374 HydrophobicContact CG2-CG1 4.01Å; T351-N384 WeakPolarHBondContact CA-O 3.44Å; T351-N384 PolarHBondContact OG1-O 3.43Å
352	K	74.8	Confident	69.5	Low	37 Å²	37	66.2 Å²	66.2	16%	0.161	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.9	175.5	-173.5	179.1	173.9	-179.1	0	109.4	K354 I369 Y371 N384 Y386	K352-K354 PolarHBondContact O-N 2.81Å; K352-I369 HydrophobicContact CD-CD1 4.49Å; K352-I369 HydrophobicContact CG-CG2 4.04Å; K352-Y371 HydrophobicContact CB-CD1 4.05Å; K352-Y371 HydrophobicContact CB-CE1 3.76Å; K352-Y371 HydrophobicContact CG-CE1 4.17Å; K352-N384 HydrophobicContact CB-CB 4.46Å; K352-N384 PolarHBondContact N-O 2.94Å; K352-Y386 HydrophobicContact CB-CE2 4.3Å
353	I	66.9	Low	67.8	Low	59 Å²	59	67 Å²	67	30%	0.303	35%	0.351	S	S	.	.			trans	-66.9	118.8	171.8	-59.8	175.5	0	0	0	107	T351 L355 M370 Q372	T351-I353 PolarHBondContact O-N 2.69Å; I353-L355 VanDerWaalsContact C-N 3.26Å; I353-L355 HydrophobicContact CB-CD1 4.35Å; I353-L355 HydrophobicContact CG2-CD1 3.85Å; I353-L355 HydrophobicContact CG2-CG 4.19Å; I353-L355 PolarHBondContact O-N 2.6Å; I353-M370 HydrophobicContact CD1-CB 3.95Å; I353-M370 PolarHBondContact N-O 2.77Å; I353-Q372 HydrophobicContact CD1-CB 4.2Å; I353-Q372 HydrophobicContact CG1-CB 3.83Å
354	K	60.1	Low	66.4	Low	163 Å²	163	70.9 Å²	70.9	71%	0.709	37%	0.369	S	S	*	.			trans	-64	83.9	-180	-72.8	180	-179.7	171.7	0	109.8	K352	K352-K354 PolarHBondContact O-N 2.81Å
355	L	47.7	Very low	65	Low	118 Å²	118	69.5 Å²	69.5	62%	0.618	36%	0.361	S	S	*	.			trans	-100.4	-17.8	179.1	-96	150.7	0	0	0	113.8	I353	I353-L355 VanDerWaalsContact C-N 3.26Å; I353-L355 HydrophobicContact CB-CD1 4.35Å; I353-L355 HydrophobicContact CG2-CD1 3.85Å; I353-L355 HydrophobicContact CG2-CG 4.19Å; I353-L355 PolarHBondContact O-N 2.6Å
356	D	42.1	Very low	63.8	Low	129 Å²	129	70.5 Å²	70.5	69%	0.69	37%	0.366	S	S	*	.			trans	-163.1	141.1	167.6	-87	-45	0	0	0	112	H358	D356-H358 PolarHBondContact O-N 3.4Å
357	N	41	Very low	62.4	Low	167 Å²	167	70 Å²	70	89%	0.893	36%	0.36	S	S	*	.			trans	-70.1	21.7	-178.6	-88.5	-17.4	0	0	0	114.8	L359	N357-L359 PolarHBondContact O-N 2.9Å
358	H	42.1	Very low	60.7	Low	143 Å²	143	74.3 Å²	74.3	66%	0.662	39%	0.387	S	S	*	.			trans	-71.3	123.5	177.5	-72.9	-58.9	0	0	0	110.5	D356 N360	D356-H358 PolarHBondContact O-N 3.4Å; H358-N360 PolarHBondContact O-N 3.13Å
359	L	43.1	Very low	59.8	Low	182 Å²	182	76 Å²	76	95%	0.953	40%	0.395	S	S	*	.			trans	-54.3	68.1	175.3	-75.3	126.1	0	0	0	112.4	N357	N357-L359 PolarHBondContact O-N 2.9Å
360	N	45	Very low	58.4	Low	80 Å²	80	81.9 Å²	81.9	43%	0.428	42%	0.424	S	S	.	.			trans	-82.6	134.3	168.6	-76.1	1.2	0	0	0	108.4	H358	H358-N360 PolarHBondContact O-N 3.13Å
361	N	52.3	Low	58	Low	114 Å²	114	83.5 Å²	83.5	61%	0.61	43%	0.431	S	S	*	.			trans	-50.2	129.1	174.5	-97.2	-30.3	0	0	0	109.9	C363 E364	N361-C363 PolarHBondContact O-N 3.11Å; N361-E364 HydrophobicContact CB-CG 4.4Å; N361-E364 PolarHBondContact O-N 3.19Å
362	P	51.6	Low	57.4	Low	56 Å²	56	88 Å²	88	36%	0.364	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20	-176.1	21.5	-31.7	0	0	0	113.3
363	C	52.1	Low	57.4	Low	47 Å²	47	90.9 Å²	90.9	32%	0.318	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.1	178.7	-59.4	0	0	0	0	114.5	N361	N361-C363 PolarHBondContact O-N 3.11Å
364	E	60.9	Low	58.1	Low	95 Å²	95	89.8 Å²	89.8	44%	0.444	46%	0.455	S	S	.	.			trans	-99.3	114	-179.6	-73.1	-164.1	153.2	0	0	111.9	N361	N361-E364 HydrophobicContact CB-CG 4.4Å; N361-E364 PolarHBondContact O-N 3.19Å
365	F	66	Low	58.8	Low	10 Å²	10	86.4 Å²	86.4	4%	0.044	44%	0.444	C	S	.	.			trans	-79.3	122.9	172.3	179.3	-114.1	0	0	0	110.5	I314 F350 K367 Y371 Y386 C425	I314-F365 HydrophobicContact CD1-CD1 3.75Å; I314-F365 HydrophobicContact CD1-CE1 3.39Å; I314-F365 HydrophobicContact CD1-CE2 4.4Å; I314-F365 HydrophobicContact CD1-CG 4.37Å; I314-F365 HydrophobicContact CD1-CZ 3.78Å; I314-F365 HydrophobicContact CG2-CD2 4.46Å; F350-F365 HydrophobicContact CE2-CD2 4.4Å; F350-F365 AromaticContact CE2-CE2 3.65Å; F350-F365 HydrophobicContact CE2-CE2 3.65Å; F350-F365 HydrophobicContact CE2-CZ 4.31Å; F350-F365 HydrophobicContact CZ-CE2 4.23Å; F365-K367 HydrophobicContact CD1-CG 3.82Å; F365-K367 HydrophobicContact CE1-CD 4.49Å; F365-K367 HydrophobicContact CE1-CG 3.57Å; F365-Y371 HydrophobicContact CD2-CE1 4.11Å; F365-Y371 HydrophobicContact CD2-CE2 4.14Å; F365-Y371 AromaticContact CD2-CZ 3.62Å; F365-Y371 VanDerWaalsContact CD2-OH 3.31Å; F365-Y371 WeakPolarHBondContact CD2-OH 3.48Å; F365-Y371 HydrophobicContact CE2-CD1 4.36Å; F365-Y371 AromaticContact CE2-CD2 4Å; F365-Y371 HydrophobicContact CE2-CD2 4Å; F365-Y371 AromaticContact CE2-CE1 3.81Å; F365-Y371 HydrophobicContact CE2-CE1 3.81Å; F365-Y371 AromaticContact CE2-CE2 3.39Å; F365-Y371 HydrophobicContact CE2-CE2 3.39Å; F365-Y371 HydrophobicContact CE2-CG 4.45Å; F365-Y371 AromaticContact CE2-CZ 3.29Å; F365-Y371 WeakPolarHBondContact CE2-OH 3.45Å; F365-Y371 HydrophobicContact CZ-CD2 4.43Å; F365-Y371 AromaticContact CZ-CE2 3.96Å; F365-Y371 HydrophobicContact CZ-CE2 3.96Å; F365-Y386 HydrophobicContact CB-CE1 4.23Å; F365-Y386 AromaticContact CD2-CD1 3.95Å; F365-Y386 HydrophobicContact CD2-CD1 3.95Å; F365-Y386 AromaticContact CD2-CE1 3.91Å; F365-Y386 HydrophobicContact CD2-CE1 3.91Å; F365-Y386 HydrophobicContact CD2-CG 4.49Å; F365-C425 HydrophobicContact CB-CB 3.97Å
366	D	66.7	Low	60.6	Low	20 Å²	20	84.6 Å²	84.6	11%	0.107	43%	0.433	C	S	.	.			trans	-105.6	100.3	-179.3	-163.1	-10.3	0	0	0	112.8	T368 I369 Y371 K428	D366-T368 PolarHBondContact O-N 2.95Å; D366-T368 PolarHBondContact OD1-N 3.3Å; D366-T368 VanDerWaalsContact OD1-N 3.09Å; D366-T368 PolarHBondContact OD1-OG1 3.5Å; D366-I369 HydrophobicContact CB-CD1 3.64Å; D366-I369 HydrophobicContact CB-CG1 3.85Å; D366-I369 PolarHBondContact O-N 3.45Å; D366-Y371 PolarHBondContact N-OH 3.5Å; D366-Y371 VanDerWaalsContact N-OH 3.12Å; D366-Y371 WeakPolarHBondContact O-CE2 3.26Å; D366-Y371 PolarHBondContact O-OH 2.93Å; D366-K428 IonicContact OD1-NZ 2.78Å; D366-K428 PolarHBondContact OD1-NZ 2.87Å; D366-K428 IonicContact OD2-NZ 3.5Å; D366-K428 PolarHBondContact OD2-NZ 2.78Å
367	K	62.7	Low	62.7	Low	20 Å²	20	78.8 Å²	78.8	9%	0.087	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.8	179.6	-59.4	-179.8	-170.7	-176.9	0	114.4	F365 S427 F533 K535	F365-K367 HydrophobicContact CD1-CG 3.82Å; F365-K367 HydrophobicContact CE1-CD 4.49Å; F365-K367 HydrophobicContact CE1-CG 3.57Å; K367-S427 PolarHBondContact NZ-OG 3.11Å; K367-F533 HydrophobicContact CD-CD2 4.47Å; K367-F533 HydrophobicContact CD-CE2 4.03Å; K367-F533 PolarHBondContact NZ-O 2.96Å; K367-K535 HydrophobicContact CB-CB 4.23Å; K367-K535 HydrophobicContact CB-CD 4.43Å; K367-K535 HydrophobicContact CD-CB 4.24Å; K367-K535 WeakPolarHBondContact O-CD 3.37Å; K367-K535 PolarHBondContact O-NZ 3Å
368	T	56.3	Low	64.5	Low	90 Å²	90	73.7 Å²	73.7	55%	0.552	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.1	176.2	65.2	0	0	0	0	113.2	D366	D366-T368 PolarHBondContact O-N 2.95Å; D366-T368 PolarHBondContact OD1-N 3.3Å; D366-T368 VanDerWaalsContact OD1-N 3.09Å; D366-T368 PolarHBondContact OD1-OG1 3.5Å
369	I	67.5	Low	65.8	Low	42 Å²	42	72 Å²	72	22%	0.215	38%	0.375	C	S	.	.	S	Bend	trans	-95.1	150.8	-175.8	-54.4	-178.5	0	0	0	109.9	K352 D366 Y371	K352-I369 HydrophobicContact CD-CD1 4.49Å; K352-I369 HydrophobicContact CG-CG2 4.04Å; D366-I369 HydrophobicContact CB-CD1 3.64Å; D366-I369 HydrophobicContact CB-CG1 3.85Å; D366-I369 PolarHBondContact O-N 3.45Å; I369-Y371 HydrophobicContact CB-CE2 4.23Å; I369-Y371 VanDerWaalsContact O-CD2 3.31Å; I369-Y371 WeakPolarHBondContact O-CD2 3.3Å; I369-Y371 WeakPolarHBondContact O-CE2 3.36Å
370	M	59.5	Low	66.8	Low	123 Å²	123	71 Å²	71	61%	0.606	37%	0.365	S	S	*	.			trans	-81.3	135.5	171.9	-69.1	-64.4	-66.2	0	0	110.4	I353	I353-M370 HydrophobicContact CD1-CB 3.95Å; I353-M370 PolarHBondContact N-O 2.77Å
371	Y	76.7	Confident	67.5	Low	37 Å²	37	73.9 Å²	73.9	15%	0.145	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	147.1	175.8	-67	-95.7	0	0	0	109.2	F350 T351 K352 F365 D366 I369 Y386	F350-Y371 AromaticContact CD2-CD1 3.63Å; F350-Y371 HydrophobicContact CD2-CD1 3.63Å; F350-Y371 HydrophobicContact CD2-CE1 4.45Å; F350-Y371 AromaticContact CD2-CG 3.82Å; F350-Y371 HydrophobicContact CD2-CG 3.82Å; F350-Y371 HydrophobicContact CE2-CD1 4.01Å; F350-Y371 HydrophobicContact CE2-CE1 4.43Å; F350-Y371 HydrophobicContact CE2-CG 4.25Å; T351-Y371 CarbonylContact O-C 3.44Å; T351-Y371 VanDerWaalsContact O-CA 3.22Å; T351-Y371 WeakPolarHBondContact O-CA 3.08Å; T351-Y371 WeakPolarHBondContact O-CB 2.88Å; K352-Y371 HydrophobicContact CB-CD1 4.05Å; K352-Y371 HydrophobicContact CB-CE1 3.76Å; K352-Y371 HydrophobicContact CG-CE1 4.17Å; F365-Y371 HydrophobicContact CD2-CE1 4.11Å; F365-Y371 HydrophobicContact CD2-CE2 4.14Å; F365-Y371 AromaticContact CD2-CZ 3.62Å; F365-Y371 VanDerWaalsContact CD2-OH 3.31Å; F365-Y371 WeakPolarHBondContact CD2-OH 3.48Å; F365-Y371 HydrophobicContact CE2-CD1 4.36Å; F365-Y371 AromaticContact CE2-CD2 4Å; F365-Y371 HydrophobicContact CE2-CD2 4Å; F365-Y371 AromaticContact CE2-CE1 3.81Å; F365-Y371 HydrophobicContact CE2-CE1 3.81Å; F365-Y371 AromaticContact CE2-CE2 3.39Å; F365-Y371 HydrophobicContact CE2-CE2 3.39Å; F365-Y371 HydrophobicContact CE2-CG 4.45Å; F365-Y371 AromaticContact CE2-CZ 3.29Å; F365-Y371 WeakPolarHBondContact CE2-OH 3.45Å; F365-Y371 HydrophobicContact CZ-CD2 4.43Å; F365-Y371 AromaticContact CZ-CE2 3.96Å; F365-Y371 HydrophobicContact CZ-CE2 3.96Å; D366-Y371 PolarHBondContact N-OH 3.5Å; D366-Y371 VanDerWaalsContact N-OH 3.12Å; D366-Y371 WeakPolarHBondContact O-CE2 3.26Å; D366-Y371 PolarHBondContact O-OH 2.93Å; I369-Y371 HydrophobicContact CB-CE2 4.23Å; I369-Y371 VanDerWaalsContact O-CD2 3.31Å; I369-Y371 WeakPolarHBondContact O-CD2 3.3Å; I369-Y371 WeakPolarHBondContact O-CE2 3.36Å; Y371-Y386 HydrophobicContact CD1-CD2 4.13Å; Y371-Y386 HydrophobicContact CD1-CE2 4.31Å; Y371-Y386 AromaticContact CE1-CD2 3.75Å; Y371-Y386 HydrophobicContact CE1-CD2 3.75Å; Y371-Y386 AromaticContact CE1-CE2 3.56Å; Y371-Y386 HydrophobicContact CE1-CE2 3.56Å
372	Q	71	Confident	68	Low	117 Å²	117	71.7 Å²	71.7	55%	0.547	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.5	175.9	-179.7	174.5	-1.4	0	0	109	F350 T351 I353	F350-Q372 CarbonylContact C-O 3.49Å; F350-Q372 WeakPolarHBondContact CA-O 3.12Å; F350-Q372 WeakPolarHBondContact CB-O 3.44Å; T351-Q372 HydrophobicContact CG2-CB 4.18Å; T351-Q372 PolarHBondContact N-O 2.96Å; T351-Q372 PolarHBondContact O-N 2.92Å; I353-Q372 HydrophobicContact CD1-CB 4.2Å; I353-Q372 HydrophobicContact CG1-CB 3.83Å
373	Y	74.5	Confident	68.7	Low	97 Å²	97	72.5 Å²	72.5	38%	0.38	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	139.7	172.8	171.6	-94.4	0	0	0	110.9	S330 T348 D375 F538	S330-Y373 WeakPolarHBondContact CB-OH 3.47Å; T348-Y373 HydrophobicContact CG2-CD2 4.18Å; T348-Y373 HydrophobicContact CG2-CE2 4.08Å; Y373-D375 HydrophobicContact CE1-CB 3.92Å; Y373-D375 PolarHBondContact OH-OD1 3.45Å; Y373-F538 HydrophobicContact CD2-CE1 4.49Å; Y373-F538 HydrophobicContact CD2-CZ 4.32Å
374	I	80.6	Confident	69.9	Low	36 Å²	36	72.5 Å²	72.5	19%	0.185	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.9	173.6	-67.2	173	0	0	0	108.2	S330 F349 T351 E376 V385	S330-I374 PolarHBondContact OG-O 3.26Å; F349-I374 HydrophobicContact CB-CB 3.91Å; F349-I374 HydrophobicContact CB-CG2 4.2Å; F349-I374 PolarHBondContact O-N 3.33Å; T351-I374 VanDerWaalsContact CB-CD1 3.48Å; T351-I374 HydrophobicContact CG2-CD1 3.62Å; T351-I374 HydrophobicContact CG2-CG1 4.01Å; I374-E376 WeakPolarHBondContact CG2-O 3.2Å; I374-V385 HydrophobicContact CD1-CG1 4.46Å; I374-V385 HydrophobicContact CD1-CG2 4.27Å
375	D	76.1	Confident	71.1	Confident	91 Å²	91	68.3 Å²	68.3	49%	0.487	35%	0.347	S	S	.	.	S	Bend	trans	-79.1	-38.6	178.3	-163.7	53.4	0	0	0	112.7	K329 S330 Y373	K329-D375 CarbonylContact C-O 3.58Å; K329-D375 WeakPolarHBondContact CA-O 3.48Å; S330-D375 PolarHBondContact N-O 2.79Å; Y373-D375 HydrophobicContact CE1-CB 3.92Å; Y373-D375 PolarHBondContact OH-OD1 3.45Å
376	E	85.5	Confident	72.1	Confident	81 Å²	81	68.2 Å²	68.2	38%	0.379	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-139.1	135.1	179.7	-174.1	173.7	160.1	0	0	110.9	S327 K329 I374 S378	S327-E376 WeakPolarHBondContact CB-OE1 3.37Å; K329-E376 WeakPolarHBondContact CE-OE2 3.33Å; K329-E376 HydrophobicContact CG-CB 4.27Å; K329-E376 HydrophobicContact CG-CG 4.22Å; I374-E376 WeakPolarHBondContact CG2-O 3.2Å; E376-S378 PolarHBondContact O-N 3.05Å
377	I	84.9	Confident	73.3	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	34%	0.341	C	S	.	.			trans	-73.6	124.9	176.8	-165	172.1	0	0	0	110.6	V318 K320 I328 F349 V385	V318-I377 HydrophobicContact CG1-CD1 3.89Å; K320-I377 HydrophobicContact CB-CD1 4.35Å; K320-I377 HydrophobicContact CB-CG2 4.24Å; K320-I377 HydrophobicContact CD-CG2 3.94Å; I328-I377 HydrophobicContact CB-CG2 3.81Å; I328-I377 HydrophobicContact CD1-CG2 4.26Å; I328-I377 HydrophobicContact CG1-CG2 4.43Å; I328-I377 PolarHBondContact O-N 3.34Å; I328-I377 VanDerWaalsContact O-N 3.15Å; F349-I377 HydrophobicContact CD1-CB 4.33Å; F349-I377 HydrophobicContact CD1-CD1 4.23Å; F349-I377 HydrophobicContact CE1-CB 4.22Å; F349-I377 HydrophobicContact CE1-CD1 3.91Å; F349-I377 HydrophobicContact CZ-CB 4.36Å; F349-I377 HydrophobicContact CZ-CG2 4.36Å; I377-V385 HydrophobicContact CD1-CG1 4.22Å; I377-V385 HydrophobicContact CG1-CG1 4.41Å
378	S	78.9	Confident	74.5	Confident	60 Å²	60	67.6 Å²	67.6	42%	0.42	34%	0.344	S	S	.	.			trans	-76.5	158.5	174.3	51.8	0	0	0	0	111.8	E376 E380	E376-S378 PolarHBondContact O-N 3.05Å; S378-E380 PolarHBondContact O-N 3.18Å
379	N	70.8	Confident	76.2	Confident	108 Å²	108	63.3 Å²	63.3	58%	0.578	32%	0.317	S	S	*	.	S	Bend	trans	-75.3	-12.8	170.6	-73	-5	0	0	0	112.7	K320	K320-N379 WeakPolarHBondContact CD-OD1 3.26Å; K320-N379 WeakPolarHBondContact CE-OD1 3.37Å; K320-N379 PolarHBondContact NZ-OD1 2.85Å
380	E	63.5	Low	77.1	Confident	160 Å²	160	65.5 Å²	65.5	75%	0.748	33%	0.327	S	S	*	.	S	Bend	trans	-67.6	139.1	-179.6	-65.3	-172.5	174.8	0	0	111.1	S378 D382	S378-E380 PolarHBondContact O-N 3.18Å; E380-D382 PolarHBondContact O-N 2.96Å
381	I	59.1	Low	78.6	Confident	141 Å²	141	60.3 Å²	60.3	72%	0.723	30%	0.301	S	S	*	.			trans	-76.5	73.2	-175.9	-50.5	170.4	0	0	0	108.5
382	D	63.2	Low	79.2	Confident	68 Å²	68	63.2 Å²	63.2	36%	0.364	32%	0.316	S	S	.	.			trans	-95.8	101.1	171.5	-137.4	-3.9	0	0	0	108.1	E380 N384 V385	E380-D382 PolarHBondContact O-N 2.96Å; D382-N384 PolarHBondContact O-N 3.26Å; D382-V385 HydrophobicContact CB-CG2 4.28Å; D382-V385 PolarHBondContact O-N 3.46Å
383	N	66.4	Low	79.9	Confident	74 Å²	74	63.4 Å²	63.4	40%	0.396	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	0.8	-176	-71.3	-22.1	0	0	0	113.8
384	N	77.7	Confident	80.4	Confident	47 Å²	47	60.7 Å²	60.7	25%	0.251	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	10.3	-175.9	-64.9	-36.1	0	0	0	113.6	T351 K352 D382 Y386	T351-N384 WeakPolarHBondContact CA-O 3.44Å; T351-N384 PolarHBondContact OG1-O 3.43Å; K352-N384 HydrophobicContact CB-CB 4.46Å; K352-N384 PolarHBondContact N-O 2.94Å; D382-N384 PolarHBondContact O-N 3.26Å; N384-Y386 WeakPolarHBondContact O-CD2 3.48Å; N384-Y386 VanDerWaalsContact O-CE2 3.25Å; N384-Y386 WeakPolarHBondContact O-CE2 3.45Å
385	V	85.4	Confident	80.6	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	131.1	174.5	-177.4	0	0	0	0	110.1	V318 F349 I374 I377 D382	V318-V385 HydrophobicContact CB-CG1 4.37Å; V318-V385 PolarHBondContact N-O 3.22Å; F349-V385 HydrophobicContact CD1-CG1 4.42Å; I374-V385 HydrophobicContact CD1-CG1 4.46Å; I374-V385 HydrophobicContact CD1-CG2 4.27Å; I377-V385 HydrophobicContact CD1-CG1 4.22Å; I377-V385 HydrophobicContact CG1-CG1 4.41Å; D382-V385 HydrophobicContact CB-CG2 4.28Å; D382-V385 PolarHBondContact O-N 3.46Å
386	Y	87.9	Confident	81	Confident	7 Å²	7	55 Å²	55	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	158.3	174.1	-61.1	-96.6	0	0	0	109.3	I314 L315 F350 K352 F365 Y371 N384	I314-Y386 HydrophobicContact CG2-CD1 4.23Å; L315-Y386 VanDerWaalsContact O-CA 3.24Å; L315-Y386 WeakPolarHBondContact O-CA 3.4Å; L315-Y386 WeakPolarHBondContact O-CB 3.37Å; F350-Y386 HydrophobicContact CD2-CD2 4.41Å; F350-Y386 HydrophobicContact CD2-CG 4.32Å; F350-Y386 HydrophobicContact CE2-CD2 4.24Å; F350-Y386 AromaticContact CE2-CG 3.8Å; F350-Y386 HydrophobicContact CE2-CG 3.8Å; F350-Y386 HydrophobicContact CZ-CG 4.41Å; F350-Y386 PolarHBondContact N-O 2.86Å; F350-Y386 PolarHBondContact O-N 2.74Å; F350-Y386 VanDerWaalsContact O-O 3.13Å; K352-Y386 HydrophobicContact CB-CE2 4.3Å; F365-Y386 HydrophobicContact CB-CE1 4.23Å; F365-Y386 AromaticContact CD2-CD1 3.95Å; F365-Y386 HydrophobicContact CD2-CD1 3.95Å; F365-Y386 AromaticContact CD2-CE1 3.91Å; F365-Y386 HydrophobicContact CD2-CE1 3.91Å; F365-Y386 HydrophobicContact CD2-CG 4.49Å; Y371-Y386 HydrophobicContact CD1-CD2 4.13Å; Y371-Y386 HydrophobicContact CD1-CE2 4.31Å; Y371-Y386 AromaticContact CE1-CD2 3.75Å; Y371-Y386 HydrophobicContact CE1-CD2 3.75Å; Y371-Y386 AromaticContact CE1-CE2 3.56Å; Y371-Y386 HydrophobicContact CE1-CE2 3.56Å; N384-Y386 WeakPolarHBondContact O-CD2 3.48Å; N384-Y386 VanDerWaalsContact O-CE2 3.25Å; N384-Y386 WeakPolarHBondContact O-CE2 3.45Å
387	V	90.1	Very high	80.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.7	171.2	74.9	0	0	0	0	109.8	I314 L315 V318 L347 T348 F349 L389	I314-V387 CarbonylContact C-O 3.54Å; I314-V387 VanDerWaalsContact CA-O 3.31Å; I314-V387 WeakPolarHBondContact CA-O 3.42Å; L315-V387 HydrophobicContact CB-CG1 3.8Å; L315-V387 HydrophobicContact CD1-CG1 3.79Å; L315-V387 HydrophobicContact CG-CG1 3.82Å; L315-V387 PolarHBondContact N-O 2.8Å; L315-V387 PolarHBondContact O-N 2.84Å; L315-V387 VanDerWaalsContact O-N 3.09Å; V318-V387 HydrophobicContact CG1-CG1 4.39Å; V318-V387 HydrophobicContact CG2-CB 4.12Å; V318-V387 HydrophobicContact CG2-CG1 3.75Å; L347-V387 HydrophobicContact CB-CG2 3.83Å; L347-V387 HydrophobicContact CD2-CG2 4.08Å; L347-V387 HydrophobicContact CG-CG2 4.32Å; T348-V387 CarbonylContact O-C 3.57Å; T348-V387 WeakPolarHBondContact O-CA 3.44Å; F349-V387 HydrophobicContact CD1-CB 3.8Å; F349-V387 HydrophobicContact CD1-CG2 3.57Å; F349-V387 HydrophobicContact CE1-CB 3.91Å; F349-V387 HydrophobicContact CE1-CG2 3.53Å; F349-V387 HydrophobicContact CG-CG2 4.17Å; F349-V387 HydrophobicContact CZ-CG2 4.1Å; V387-L389 HydrophobicContact CG1-CD2 3.9Å; V387-L389 HydrophobicContact CG1-CG 4.11Å; V387-L389 HydrophobicContact CG2-CD2 4.21Å
388	L	89.3	Confident	80.6	Confident	27 Å²	27	51.9 Å²	51.9	14%	0.141	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.2	165	174.2	69.3	0	0	0	106.9	A312 I314 L347 T348 F350 E390 I537	A312-L388 HydrophobicContact CB-CD1 4.31Å; I314-L388 HydrophobicContact CG1-CD1 3.98Å; L347-L388 WeakPolarHBondContact CA-O 3.29Å; T348-L388 PolarHBondContact N-O 3.38Å; T348-L388 PolarHBondContact O-N 3.08Å; F350-L388 HydrophobicContact CE1-CB 3.86Å; L388-E390 HydrophobicContact CD2-CG 4.25Å; L388-E390 HydrophobicContact CG-CG 4.2Å; L388-I537 HydrophobicContact CB-CD1 4.32Å; L388-I537 HydrophobicContact CD1-CD1 4.29Å; L388-I537 HydrophobicContact CD2-CD1 4.32Å
389	L	91.2	Very high	80.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.5	171.8	-62.4	-175.2	0	0	0	108.4	A312 C313 L315 I336 S345 L347 V387 F391	A312-L389 CarbonylContact C-O 3.5Å; A312-L389 WeakPolarHBondContact CA-O 3.5Å; A312-L389 VanDerWaalsContact CB-O 3.27Å; A312-L389 WeakPolarHBondContact CB-O 3.32Å; C313-L389 PolarHBondContact N-O 2.87Å; C313-L389 PolarHBondContact O-N 3.34Å; L315-L389 HydrophobicContact CD1-CD1 3.6Å; L315-L389 HydrophobicContact CD1-CG 4.25Å; L315-L389 HydrophobicContact CD2-CD1 3.98Å; L315-L389 HydrophobicContact CG-CD1 3.69Å; L315-L389 HydrophobicContact CG-CG 4.13Å; I336-L389 HydrophobicContact CB-CD1 4.45Å; I336-L389 HydrophobicContact CD1-CD1 4.4Å; I336-L389 HydrophobicContact CD1-CD2 4.05Å; I336-L389 HydrophobicContact CG1-CD1 4.08Å; I336-L389 HydrophobicContact CG1-CD2 4.19Å; I336-L389 HydrophobicContact CG2-CD1 3.71Å; S345-L389 WeakPolarHBondContact OG-CB 3.31Å; L347-L389 HydrophobicContact CD2-CD2 3.92Å; L347-L389 HydrophobicContact CG-CD2 3.76Å; V387-L389 HydrophobicContact CG1-CD2 3.9Å; V387-L389 HydrophobicContact CG1-CG 4.11Å; V387-L389 HydrophobicContact CG2-CD2 4.21Å; L389-F391 HydrophobicContact CB-CD1 4.4Å; L389-F391 HydrophobicContact CB-CE1 3.73Å; L389-F391 HydrophobicContact CB-CZ 3.99Å; L389-F391 HydrophobicContact CD1-CE1 3.99Å; L389-F391 HydrophobicContact CD1-CZ 4.27Å
390	E	87.7	Confident	80.7	Confident	89 Å²	89	50.7 Å²	50.7	42%	0.416	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.8	171	-63.7	177.7	109.2	0	0	107.9	A312 S345 S346 L388	A312-E390 HydrophobicContact CB-CG 4.43Å; S345-E390 CarbonylContact C-O 3.59Å; S345-E390 WeakPolarHBondContact CA-O 3.39Å; S345-E390 WeakPolarHBondContact CB-O 3.1Å; S345-E390 VanDerWaalsContact OG-C 3.23Å; S345-E390 PolarHBondContact OG-N 3.38Å; S345-E390 VanDerWaalsContact OG-N 3.14Å; S345-E390 PolarHBondContact OG-O 3.24Å; S346-E390 PolarHBondContact N-O 2.89Å; S346-E390 PolarHBondContact O-N 2.97Å; L388-E390 HydrophobicContact CD2-CG 4.25Å; L388-E390 HydrophobicContact CG-CG 4.2Å
391	F	89.7	Confident	81.6	Confident	13 Å²	13	43.7 Å²	43.7	6%	0.057	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	141	-172.4	-53.4	-55.2	0	0	0	111.4	C310 Y311 C313 I338 V343 L389 H393 V395	C310-F391 WeakPolarHBondContact O-CD2 3.32Å; Y311-F391 PolarHBondContact O-N 3.03Å; C313-F391 HydrophobicContact CB-CE2 4.01Å; C313-F391 HydrophobicContact CB-CZ 4.1Å; C313-F391 WeakPolarHBondContact SG-CZ 3.5Å; I338-F391 HydrophobicContact CD1-CE1 3.99Å; I338-F391 HydrophobicContact CD1-CZ 3.58Å; V343-F391 HydrophobicContact CG1-CB 4.17Å; V343-F391 HydrophobicContact CG1-CD1 3.37Å; V343-F391 HydrophobicContact CG1-CE1 3.92Å; V343-F391 HydrophobicContact CG1-CG 3.96Å; V343-F391 HydrophobicContact CG2-CB 4.09Å; L389-F391 HydrophobicContact CB-CD1 4.4Å; L389-F391 HydrophobicContact CB-CE1 3.73Å; L389-F391 HydrophobicContact CB-CZ 3.99Å; L389-F391 HydrophobicContact CD1-CE1 3.99Å; L389-F391 HydrophobicContact CD1-CZ 4.27Å; F391-H393 VanDerWaalsContact C-N 3.27Å; F391-H393 WeakPolarHBondContact CB-O 3.43Å; F391-H393 PolarHBondContact O-N 3.25Å; F391-V395 HydrophobicContact CD2-CB 4.37Å
392	E	88.9	Confident	82.9	Confident	98 Å²	98	37.9 Å²	37.9	46%	0.458	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-32.4	174.7	-173.1	168.1	172.1	0	0	112.5	R333 L344	R333-E392 IonicContact CZ-OE2 3.55Å; R333-E392 IonicContact NH2-OE2 3.43Å; R333-E392 PolarHBondContact NH2-OE2 2.72Å; L344-E392 WeakPolarHBondContact O-CB 3.43Å; L344-E392 PolarHBondContact O-N 2.93Å
393	H	86.6	Confident	84.3	Confident	121 Å²	121	34.7 Å²	34.7	56%	0.56	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	151.6	175.9	-61.9	-31.9	0	0	0	109.7	V343 F391 V395	V343-H393 HydrophobicContact CG2-CB 4.34Å; F391-H393 VanDerWaalsContact C-N 3.27Å; F391-H393 WeakPolarHBondContact CB-O 3.43Å; F391-H393 PolarHBondContact O-N 3.25Å; H393-V395 PolarHBondContact O-N 2.75Å
394	P	83.8	Confident	85.6	Confident	41 Å²	41	31.1 Å²	31.1	27%	0.266	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.4	-177.9	29.5	-33.5	0	0	0	110.4	P309 C310 Y311	P309-P394 HydrophobicContact CB-CB 3.82Å; C310-P394 WeakPolarHBondContact O-CA 3.37Å; Y311-P394 HydrophobicContact CD1-CB 4.27Å; Y311-P394 HydrophobicContact CD2-CB 4.26Å; Y311-P394 HydrophobicContact CE1-CB 4.02Å; Y311-P394 HydrophobicContact CE1-CG 4.04Å; Y311-P394 HydrophobicContact CE2-CB 3.99Å; Y311-P394 HydrophobicContact CE2-CG 4.4Å; Y311-P394 HydrophobicContact CG-CB 4.39Å
395	V	85.6	Confident	86.4	Confident	8 Å²	8	29 Å²	29	5%	0.048	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.5	-175.4	164	0	0	0	0	109.7	C310 I338 E341 V343 F391 H393	C310-V395 PolarHBondContact N-O 2.86Å; C310-V395 PolarHBondContact O-N 3.39Å; C310-V395 PolarHBondContact SG-O 2.98Å; I338-V395 HydrophobicContact CB-CG1 4.41Å; E341-V395 HydrophobicContact CB-CG1 4.3Å; E341-V395 VanDerWaalsContact OE2-CG1 3.28Å; E341-V395 WeakPolarHBondContact OE2-CG1 3.42Å; V343-V395 HydrophobicContact CB-CG2 3.63Å; V343-V395 HydrophobicContact CG1-CB 4.41Å; V343-V395 HydrophobicContact CG1-CG2 3.59Å; V343-V395 HydrophobicContact CG2-CG2 4.05Å; F391-V395 HydrophobicContact CD2-CB 4.37Å; H393-V395 PolarHBondContact O-N 2.75Å
396	I	84.9	Confident	86.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.9	175.6	-63.4	173.1	0	0	0	109.4	P254 Y255 L297 L307 P309 E341 P398	P254-I396 HydrophobicContact CB-CD1 3.5Å; P254-I396 HydrophobicContact CG-CD1 3.14Å; Y255-I396 HydrophobicContact CD2-CD1 3.94Å; Y255-I396 HydrophobicContact CE2-CD1 3.41Å; Y255-I396 VanDerWaalsContact CE2-CD1 3.41Å; Y255-I396 HydrophobicContact CE2-CG1 3.94Å; Y255-I396 PolarHBondContact OH-N 3.06Å; L297-I396 HydrophobicContact CB-CG2 4.45Å; L297-I396 HydrophobicContact CD1-CB 4.1Å; L297-I396 HydrophobicContact CD1-CG2 3.63Å; L307-I396 HydrophobicContact CB-CG2 4.22Å; L307-I396 HydrophobicContact CD2-CG2 3.53Å; L307-I396 HydrophobicContact CG-CG2 4.48Å; P309-I396 HydrophobicContact CB-CG1 4.31Å; P309-I396 HydrophobicContact CG-CD1 4.34Å; P309-I396 HydrophobicContact CG-CG1 3.93Å; E341-I396 PolarHBondContact OE2-N 3Å; I396-P398 VanDerWaalsContact O-CD 3.29Å; I396-P398 WeakPolarHBondContact O-CD 3.39Å
397	C	82.8	Confident	86.8	Confident	6 Å²	6	31.9 Å²	31.9	4%	0.041	16%	0.162	C	C	.	.			trans	-109.6	93.6	-178.5	-65.6	0	0	0	0	110.1	C313 I338 M399 V424	C313-C397 HydrophobicContact CB-CB 4.41Å; I338-C397 VanDerWaalsContact CD1-SG 3.59Å; I338-C397 HydrophobicContact CG2-CB 4.41Å; C397-M399 PolarHBondContact O-N 2.82Å; C397-V424 HydrophobicContact CB-CG1 4Å; C397-V424 HydrophobicContact CB-CG2 4.28Å
398	P	78.3	Confident	86.6	Confident	15 Å²	15	33.5 Å²	33.5	10%	0.097	17%	0.17	C	C	.	.			trans	-60.1	135.2	175.9	25.4	-32	0	0	0	109.7	L297 I396 N400 G401	L297-P398 HydrophobicContact CD1-CG 4.05Å; I396-P398 VanDerWaalsContact O-CD 3.29Å; I396-P398 WeakPolarHBondContact O-CD 3.39Å; P398-N400 PolarHBondContact O-N 2.91Å; P398-G401 WeakPolarHBondContact O-CA 2.97Å; P398-G401 PolarHBondContact O-N 3.16Å
399	M	74.7	Confident	86	Confident	56 Å²	56	37.9 Å²	37.9	28%	0.276	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	137.6	-179.1	-69.9	-67	120.8	0	0	111.1	C397 G401 V424	C397-M399 PolarHBondContact O-N 2.82Å; M399-G401 PolarHBondContact O-N 2.8Å; M399-V424 HydrophobicContact CE-CG1 4.41Å
400	N	77.3	Confident	84.8	Confident	86 Å²	86	40.8 Å²	40.8	46%	0.46	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	8.7	-173.2	-60.2	-23.2	0	0	0	114.8	P398 H423 V424	P398-N400 PolarHBondContact O-N 2.91Å; N400-H423 PolarHBondContact O-ND1 2.74Å; N400-V424 WeakPolarHBondContact CA-O 3.13Å; N400-V424 PolarHBondContact N-O 2.85Å; N400-V424 VanDerWaalsContact N-O 3.11Å
401	G	82.2	Confident	83.4	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	22%	0.222	C	C	.	.			trans	-58.9	142.9	174.4	0	0	0	0	0	111	P398 M399 H423 V424	P398-G401 WeakPolarHBondContact O-CA 2.97Å; P398-G401 PolarHBondContact O-N 3.16Å; M399-G401 PolarHBondContact O-N 2.8Å; G401-H423 WeakPolarHBondContact O-CA 3.43Å; G401-V424 WeakPolarHBondContact O-CG2 3.47Å; G401-V424 PolarHBondContact O-N 3.02Å
402	L	88.1	Confident	81.9	Confident	20 Å²	20	44.9 Å²	44.9	11%	0.105	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.6	171.7	176.1	65	0	0	0	109.3	Q94 I122 I404	Q94-L402 PolarHBondContact NE2-O 3.44Å; I122-L402 HydrophobicContact CG2-CD1 3.78Å; I122-L402 HydrophobicContact CG2-CD2 3.84Å; I122-L402 HydrophobicContact CG2-CG 4.29Å; L402-I404 HydrophobicContact CD1-CG1 4.47Å; L402-I404 HydrophobicContact CD2-CD1 4.09Å; L402-I404 HydrophobicContact CD2-CG1 4.26Å; L402-I404 HydrophobicContact CG-CD1 4.43Å; L402-I404 HydrophobicContact CG-CG1 4.06Å
403	A	91.9	Very high	80.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.4	172	0	0	0	0	0	109.6	L315 I336 F337 I338 Y421 G422	L315-A403 HydrophobicContact CD1-CB 3.54Å; L315-A403 HydrophobicContact CD2-CB 3.49Å; L315-A403 VanDerWaalsContact CD2-CB 3.49Å; L315-A403 HydrophobicContact CG-CB 4.16Å; I336-A403 HydrophobicContact CG2-CB 4.34Å; F337-A403 VanDerWaalsContact O-CA 3.27Å; F337-A403 WeakPolarHBondContact O-CA 3.43Å; I338-A403 HydrophobicContact CD1-CB 4.15Å; I338-A403 HydrophobicContact CG1-CB 3.83Å; A403-Y421 CarbonylContact O-C 3.56Å; A403-Y421 VanDerWaalsContact O-CA 3.24Å; A403-Y421 WeakPolarHBondContact O-CA 3.42Å; A403-G422 PolarHBondContact N-O 2.84Å; A403-G422 PolarHBondContact O-N 2.76Å
404	I	93.8	Very high	79.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.7	-179.7	-53.4	175.5	0	0	0	108.7	L90 I122 I336 F337 L402 I418	L90-I404 HydrophobicContact CD2-CD1 3.77Å; L90-I404 HydrophobicContact CD2-CG2 4.06Å; I122-I404 HydrophobicContact CG2-CD1 4.06Å; I122-I404 HydrophobicContact CG2-CG1 4.13Å; I336-I404 CarbonylContact C-O 3.56Å; I336-I404 WeakPolarHBondContact CA-O 3.47Å; F337-I404 HydrophobicContact CB-CB 4.31Å; F337-I404 WeakPolarHBondContact CD2-O 3.44Å; F337-I404 PolarHBondContact N-O 2.88Å; F337-I404 PolarHBondContact O-N 3.41Å; L402-I404 HydrophobicContact CD1-CG1 4.47Å; L402-I404 HydrophobicContact CD2-CD1 4.09Å; L402-I404 HydrophobicContact CD2-CG1 4.26Å; L402-I404 HydrophobicContact CG-CD1 4.43Å; L402-I404 HydrophobicContact CG-CG1 4.06Å; I404-I418 HydrophobicContact CG2-CG2 3.58Å
405	G	93.8	Very high	79.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.5	173.9	0	0	0	0	0	111.2	H335 A419 L420	H335-G405 WeakPolarHBondContact O-CA 3.37Å; G405-A419 WeakPolarHBondContact O-CB 3.24Å; G405-A419 PolarHBondContact O-N 2.9Å; G405-L420 PolarHBondContact N-O 3.26Å; G405-L420 PolarHBondContact O-N 2.96Å; G405-L420 VanDerWaalsContact O-N 3.16Å
406	A	92.4	Very high	79.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.4	177.7	0	0	0	0	0	112.1	L90 H335 F337 L408 R417	L90-A406 HydrophobicContact CD1-CB 4.48Å; H335-A406 WeakPolarHBondContact CB-O 3.43Å; H335-A406 PolarHBondContact N-O 2.93Å; H335-A406 PolarHBondContact O-N 3.16Å; F337-A406 HydrophobicContact CE2-CB 4.03Å; A406-L408 HydrophobicContact CB-CD2 4.04Å; A406-R417 CarbonylContact C-O 3.47Å; A406-R417 VanDerWaalsContact CA-O 3.3Å; A406-R417 WeakPolarHBondContact CA-O 3.21Å; A406-R417 WeakPolarHBondContact CB-O 3.3Å
407	K	90.1	Very high	79.4	Confident	76 Å²	76	47.5 Å²	47.5	33%	0.33	25%	0.253	S	S	.	.			trans	-105.5	101.5	173.6	-165.6	158.2	-173	165.9	0	109.4	Y324 L334 R417	Y324-K407 HydrophobicContact CE2-CB 4.46Å; L334-K407 HydrophobicContact CD2-CB 3.9Å; L334-K407 HydrophobicContact CD2-CD 4.42Å; L334-K407 HydrophobicContact CD2-CG 4.44Å; K407-R417 PolarHBondContact N-O 3.17Å
408	L	84.9	Confident	79.8	Confident	33 Å²	33	47.2 Å²	47.2	17%	0.173	25%	0.251	C	S	.	.			trans	-91.2	-20.5	-171.7	-56.4	178.7	0	0	0	113.5	I86 H335 F337 A406 T410	I86-L408 HydrophobicContact CG2-CD2 3.67Å; H335-L408 HydrophobicContact CB-CD1 3.79Å; H335-L408 HydrophobicContact CB-CG 4.05Å; F337-L408 HydrophobicContact CE2-CD1 4.17Å; F337-L408 HydrophobicContact CZ-CD1 3.79Å; F337-L408 HydrophobicContact CZ-CD2 4.47Å; A406-L408 HydrophobicContact CB-CD2 4.04Å; L408-T410 PolarHBondContact O-N 2.62Å
409	D	77.9	Confident	80.5	Confident	119 Å²	119	46.5 Å²	46.5	64%	0.636	25%	0.246	S	C	*	.	S	Bend	trans	-69.7	-23	-176.2	-46.1	-43.4	0	0	0	112.3	H335 Y411	H335-D409 IonicContact CE1-OD1 3.67Å; H335-D409 PolarHBondContact CE1-OD1 2.86Å; H335-D409 IonicContact CE1-OD2 2.71Å; D409-Y411 PolarHBondContact O-N 2.79Å
410	T	66	Low	81.4	Confident	61 Å²	61	43.8 Å²	43.8	37%	0.374	23%	0.233	S	C	.	.			trans	-90.6	93.5	-179.5	-36.9	0	0	0	0	109	L408 S412	L408-T410 PolarHBondContact O-N 2.62Å; T410-S412 PolarHBondContact O-N 3Å
411	Y	58.3	Low	82.1	Confident	160 Å²	160	42 Å²	42	63%	0.627	22%	0.22	S	C	*	.			trans	-72.2	70	167.1	-106.6	-90.8	0	0	0	110	S84 D409	S84-Y411 WeakPolarHBondContact CA-OH 3.24Å; S84-Y411 WeakPolarHBondContact CB-OH 3.23Å; D409-Y411 PolarHBondContact O-N 2.79Å
412	S	57.4	Low	82.6	Confident	28 Å²	28	41.4 Å²	41.4	20%	0.196	21%	0.214	C	C	.	.			trans	-99.4	117	169.6	135.5	0	0	0	0	108.2	T410 T414 S415	T410-S412 PolarHBondContact O-N 3Å; S412-T414 PolarHBondContact O-N 2.91Å; S412-T414 PolarHBondContact OG-N 2.99Å; S412-S415 PolarHBondContact OG-N 2.84Å; S412-S415 VanDerWaalsContact OG-N 3.1Å; S412-S415 PolarHBondContact OG-OG 2.84Å
413	I	60.1	Low	82.6	Confident	129 Å²	129	43.2 Å²	43.2	66%	0.662	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-14.1	175	-60.5	165.5	0	0	0	111.5	T111	T111-I413 WeakPolarHBondContact CG2-O 3.32Å; T111-I413 PolarHBondContact OG1-O 2.87Å
414	T	67.3	Low	82.3	Confident	123 Å²	123	43.4 Å²	43.4	76%	0.755	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-1.9	-166.6	57.2	0	0	0	0	114.9	S412	S412-T414 PolarHBondContact O-N 2.91Å; S412-T414 PolarHBondContact OG-N 2.99Å
415	S	77.9	Confident	81.5	Confident	35 Å²	35	43.9 Å²	43.9	25%	0.245	23%	0.226	C	C	.	.	S	Bend	trans	-136.1	145.1	-179.6	66.9	0	0	0	0	111.6	S412 R417	S412-S415 PolarHBondContact OG-N 2.84Å; S412-S415 VanDerWaalsContact OG-N 3.1Å; S412-S415 PolarHBondContact OG-OG 2.84Å; S415-R417 PolarHBondContact O-N 2.91Å
416	C	85.2	Confident	79.7	Confident	16 Å²	16	48.6 Å²	48.6	11%	0.108	25%	0.246	C	C	.	.			trans	-63.1	134.4	177.9	-173.4	0	0	0	0	109.7	Y323 Y324	Y323-C416 WeakPolarHBondContact O-CB 3.49Å; Y324-C416 WeakPolarHBondContact CD2-O 3.44Å
417	R	88.1	Confident	77.8	Confident	20 Å²	20	50.7 Å²	50.7	8%	0.075	26%	0.261	C	S	.	.			trans	-87.3	-19.2	178.5	-66.8	172.9	-69.7	169.1	0.1	113.4	G83 E115 A406 K407 S415 A419	G83-R417 PolarHBondContact O-NH1 2.99Å; G83-R417 PolarHBondContact O-NH2 2.8Å; E115-R417 IonicContact OE1-CZ 3.43Å; E115-R417 PolarHBondContact OE1-N 2.82Å; E115-R417 IonicContact OE1-NE 2.6Å; E115-R417 PolarHBondContact OE1-NE 3.32Å; E115-R417 IonicContact OE1-NH2 2.81Å; E115-R417 PolarHBondContact OE1-NH2 3.3Å; E115-R417 IonicContact OE2-CZ 3.32Å; E115-R417 IonicContact OE2-NE 3.93Å; E115-R417 IonicContact OE2-NH2 3.08Å; E115-R417 PolarHBondContact OE2-NH2 2.95Å; A406-R417 CarbonylContact C-O 3.47Å; A406-R417 VanDerWaalsContact CA-O 3.3Å; A406-R417 WeakPolarHBondContact CA-O 3.21Å; A406-R417 WeakPolarHBondContact CB-O 3.3Å; K407-R417 PolarHBondContact N-O 3.17Å; S415-R417 PolarHBondContact O-N 2.91Å; R417-A419 PolarHBondContact O-N 2.84Å
418	I	90.3	Very high	75.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	120.8	-179.3	-51.5	172.7	0	0	0	107.7	L90 V118 I119 I122 V321 Y324 I404	L90-I418 HydrophobicContact CD2-CD1 4.1Å; V118-I418 HydrophobicContact CB-CD1 4.38Å; V118-I418 HydrophobicContact CG1-CB 4.32Å; V118-I418 HydrophobicContact CG1-CD1 3.95Å; V118-I418 HydrophobicContact CG1-CG2 4.41Å; I119-I418 HydrophobicContact CD1-CD1 4.08Å; I119-I418 HydrophobicContact CG1-CD1 3.42Å; I119-I418 VanDerWaalsContact CG1-CD1 3.42Å; I122-I418 HydrophobicContact CD1-CG2 3.91Å; V321-I418 WeakPolarHBondContact CB-O 3.5Å; V321-I418 HydrophobicContact CG2-CB 4.43Å; V321-I418 HydrophobicContact CG2-CG2 3.86Å; Y324-I418 WeakPolarHBondContact CB-O 3.49Å; Y324-I418 WeakPolarHBondContact CD2-O 3.41Å; I404-I418 HydrophobicContact CG2-CG2 3.58Å
419	A	92.2	Very high	74.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-46.4	-168.7	0	0	0	0	0	112	V321 Y324 I328 L334 G405 R417	V321-A419 PolarHBondContact N-O 3.28Å; Y324-A419 HydrophobicContact CD1-CB 3.93Å; Y324-A419 HydrophobicContact CD2-CB 3.89Å; Y324-A419 HydrophobicContact CE1-CB 3.77Å; Y324-A419 HydrophobicContact CE2-CB 3.76Å; Y324-A419 HydrophobicContact CG-CB 3.98Å; I328-A419 HydrophobicContact CD1-CB 3.64Å; I328-A419 WeakPolarHBondContact CD1-O 3.28Å; I328-A419 HydrophobicContact CG1-CB 4.43Å; L334-A419 HydrophobicContact CD1-CB 3.89Å; L334-A419 HydrophobicContact CD2-CB 4.3Å; G405-A419 WeakPolarHBondContact O-CB 3.24Å; G405-A419 PolarHBondContact O-N 2.9Å; R417-A419 PolarHBondContact O-N 2.84Å
420	L	93.7	Very high	73.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	167.3	-178.1	60.8	83.1	0	0	0	111.8	V318 K319 I328 L334 L347 F349 G405	V318-L420 HydrophobicContact CG1-CD1 4.4Å; K319-L420 CarbonylContact O-C 3.59Å; K319-L420 WeakPolarHBondContact O-CA 3.23Å; K319-L420 WeakPolarHBondContact O-CB 3.09Å; I328-L420 HydrophobicContact CD1-CB 4.37Å; I328-L420 HydrophobicContact CD1-CD2 4.12Å; I328-L420 HydrophobicContact CG2-CD2 4.24Å; L334-L420 HydrophobicContact CD1-CD2 4.02Å; L334-L420 HydrophobicContact CD1-CG 4.28Å; L347-L420 HydrophobicContact CD2-CD1 4.5Å; L347-L420 HydrophobicContact CD2-CD2 3.62Å; F349-L420 HydrophobicContact CE1-CD2 3.96Å; F349-L420 HydrophobicContact CZ-CD2 3.75Å; G405-L420 PolarHBondContact N-O 3.26Å; G405-L420 PolarHBondContact O-N 2.96Å; G405-L420 VanDerWaalsContact O-N 3.16Å
421	Y	93.2	Very high	74.1	Confident	48 Å²	48	51.8 Å²	51.8	19%	0.188	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.9	171.3	61.5	-83	0	0	0	110.5	I122 V318 K319 V321 A403	I122-Y421 HydrophobicContact CB-CG 4.36Å; I122-Y421 HydrophobicContact CD1-CD1 3.67Å; I122-Y421 HydrophobicContact CD1-CE1 4.27Å; I122-Y421 HydrophobicContact CD1-CG 4.06Å; I122-Y421 HydrophobicContact CG1-CD1 3.54Å; I122-Y421 HydrophobicContact CG1-CD2 4.29Å; I122-Y421 HydrophobicContact CG1-CE1 3.77Å; I122-Y421 HydrophobicContact CG1-CE2 4.48Å; I122-Y421 HydrophobicContact CG1-CG 3.81Å; I122-Y421 HydrophobicContact CG2-CD1 4.3Å; I122-Y421 HydrophobicContact CG2-CD2 3.82Å; I122-Y421 HydrophobicContact CG2-CG 3.68Å; V318-Y421 WeakPolarHBondContact CA-O 3.06Å; K319-Y421 HydrophobicContact CB-CD1 4.4Å; K319-Y421 HydrophobicContact CB-CE1 3.82Å; K319-Y421 HydrophobicContact CB-CE2 4.03Å; K319-Y421 HydrophobicContact CD-CE2 4.01Å; K319-Y421 WeakPolarHBondContact CD-OH 3.41Å; K319-Y421 HydrophobicContact CG-CE2 4.48Å; K319-Y421 PolarHBondContact N-O 2.97Å; K319-Y421 PolarHBondContact O-N 3.29Å; V321-Y421 HydrophobicContact CG2-CD1 3.93Å; V321-Y421 HydrophobicContact CG2-CE1 4.21Å; A403-Y421 CarbonylContact O-C 3.56Å; A403-Y421 VanDerWaalsContact O-CA 3.24Å; A403-Y421 WeakPolarHBondContact O-CA 3.42Å
422	G	91.4	Very high	75.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	-179	177.6	0	0	0	0	0	111.4	A403	A403-G422 PolarHBondContact N-O 2.84Å; A403-G422 PolarHBondContact O-N 2.76Å
423	H	89	Confident	76.6	Confident	59 Å²	59	48.2 Å²	48.2	27%	0.273	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.6	-178.2	-66.9	-84.7	0	0	0	111.7	L315 S316 N400 G401 C425	L315-H423 CarbonylContact C-O 3.49Å; L315-H423 VanDerWaalsContact CA-O 3.23Å; L315-H423 WeakPolarHBondContact CA-O 2.85Å; S316-H423 PolarHBondContact N-O 2.76Å; S316-H423 PolarHBondContact O-N 2.82Å; S316-H423 PolarHBondContact OG-O 2.7Å; N400-H423 PolarHBondContact O-ND1 2.74Å; G401-H423 WeakPolarHBondContact O-CA 3.43Å; H423-C425 PolarHBondContact O-N 2.94Å; H423-C425 VanDerWaalsContact O-N 3.14Å
424	V	85.8	Confident	77.9	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	118.5	176.3	177.3	0	0	0	0	109.7	L315 I338 C397 M399 N400 G401	L315-V424 HydrophobicContact CD2-CB 4.43Å; L315-V424 HydrophobicContact CD2-CG2 3.84Å; I338-V424 HydrophobicContact CG2-CG2 4.31Å; C397-V424 HydrophobicContact CB-CG1 4Å; C397-V424 HydrophobicContact CB-CG2 4.28Å; M399-V424 HydrophobicContact CE-CG1 4.41Å; N400-V424 WeakPolarHBondContact CA-O 3.13Å; N400-V424 PolarHBondContact N-O 2.85Å; N400-V424 VanDerWaalsContact N-O 3.11Å; G401-V424 WeakPolarHBondContact O-CG2 3.47Å; G401-V424 PolarHBondContact O-N 3.02Å
425	C	76.4	Confident	78.7	Confident	11 Å²	11	40.3 Å²	40.3	7%	0.074	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-71.1	144.8	179.5	-72.3	0	0	0	0	111.8	I314 L315 S316 F365 H423 S427	I314-C425 HydrophobicContact CB-CB 4.19Å; I314-C425 HydrophobicContact CG2-CB 4.28Å; I314-C425 VanDerWaalsContact O-CB 3.27Å; I314-C425 WeakPolarHBondContact O-CB 3.25Å; I314-C425 PolarHBondContact O-N 2.7Å; L315-C425 VanDerWaalsContact C-SG 3.52Å; S316-C425 WeakPolarHBondContact CB-SG 3.47Å; S316-C425 PolarHBondContact N-SG 2.86Å; S316-C425 PolarHBondContact OG-SG 3.15Å; F365-C425 HydrophobicContact CB-CB 3.97Å; H423-C425 PolarHBondContact O-N 2.94Å; H423-C425 VanDerWaalsContact O-N 3.14Å; C425-S427 PolarHBondContact O-N 3.35Å
426	K	56.6	Low	79.1	Confident	99 Å²	99	43.8 Å²	43.8	43%	0.43	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-68.1	126.9	167.4	-166.5	173.2	178.8	-177	0	110.6	K428	K426-K428 PolarHBondContact O-N 3.36Å
427	S	51.5	Low	79.1	Confident	45 Å²	45	44 Å²	44	32%	0.315	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-69.4	126.3	159.5	-173.5	0	0	0	0	108.1	K367 C425 T429 F533	K367-S427 PolarHBondContact NZ-OG 3.11Å; C425-S427 PolarHBondContact O-N 3.35Å; S427-T429 PolarHBondContact O-N 2.89Å; S427-F533 PolarHBondContact OG-O 3.36Å
428	K	47	Very low	79	Confident	64 Å²	64	46.2 Å²	46.2	28%	0.278	21%	0.214	S	C	.	.			trans	-61.7	106.6	176.8	-79.2	-169.2	174.2	-174.4	0	110	D366 K426	D366-K428 IonicContact OD1-NZ 2.78Å; D366-K428 PolarHBondContact OD1-NZ 2.87Å; D366-K428 IonicContact OD2-NZ 3.5Å; D366-K428 PolarHBondContact OD2-NZ 2.78Å; K426-K428 PolarHBondContact O-N 3.36Å
429	T	51.8	Low	78.8	Confident	48 Å²	48	49.3 Å²	49.3	29%	0.294	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130	158.5	7.2	0	0	0	0	107.8	S427 I530 L531 E532	S427-T429 PolarHBondContact O-N 2.89Å; T429-I530 HydrophobicContact CG2-CG2 3.39Å; T429-L531 WeakPolarHBondContact CA-O 3.41Å; T429-E532 HydrophobicContact CG2-CG 3.35Å
430	R	67.8	Low	78.6	Confident	47 Å²	47	52 Å²	52	18%	0.177	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.4	165	-62.5	-158.3	-174.2	-164.9	0.5	108.3	L448 I530 L531 F533	R430-L448 HydrophobicContact CB-CD2 3.8Å; R430-L448 WeakPolarHBondContact CD-O 2.93Å; R430-L448 PolarHBondContact NH1-O 3.21Å; R430-L448 VanDerWaalsContact O-CD2 3.26Å; R430-L448 WeakPolarHBondContact O-CD2 3.31Å; R430-I530 WeakPolarHBondContact O-CA 3.29Å; R430-L531 HydrophobicContact CB-CB 4.46Å; R430-L531 PolarHBondContact N-O 3.32Å; R430-L531 PolarHBondContact O-N 2.9Å; R430-F533 HydrophobicContact CG-CE1 4.22Å
431	R	74.9	Confident	78.4	Confident	152 Å²	152	58.3 Å²	58.3	57%	0.574	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.5	177.3	-71.8	164	173.4	-130.7	10.2	107.8	E528 V529 I530	R431-E528 WeakPolarHBondContact CD-OE1 3.43Å; R431-E528 VanDerWaalsContact CG-OE1 3.3Å; R431-E528 WeakPolarHBondContact CG-OE1 3.01Å; R431-E528 IonicContact CZ-OE1 2.73Å; R431-E528 IonicContact NE-OE1 3.8Å; R431-E528 PolarHBondContact NE-OE1 3.19Å; R431-E528 IonicContact NH1-OE1 2.73Å; R431-E528 PolarHBondContact NH1-OE1 2.62Å; R431-E528 IonicContact NH1-OE2 2.69Å; R431-V529 CarbonylContact C-O 3.56Å; R431-V529 WeakPolarHBondContact CA-O 3.46Å; R431-I530 HydrophobicContact CG-CG1 4.37Å
432	G	83.1	Confident	78.2	Confident	5 Å²	5	57.7 Å²	57.7	5%	0.052	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	178.8	171.2	0	0	0	0	0	110.3	N446 V529	G432-N446 CarbonylContact C-O 3.5Å; G432-N446 WeakPolarHBondContact CA-O 3.31Å; G432-V529 PolarHBondContact N-O 3.22Å; G432-V529 PolarHBondContact O-N 2.76Å
433	Q	85.3	Confident	78.2	Confident	109 Å²	109	57.7 Å²	57.7	51%	0.509	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.5	173.3	-76	179.1	-34.9	0	0	109.5	E435 V445 N446 D526	Q433-E435 PolarHBondContact O-N 2.72Å; Q433-V445 WeakPolarHBondContact O-CA 3.34Å; Q433-V445 WeakPolarHBondContact O-CG1 3.5Å; Q433-N446 PolarHBondContact N-O 3.38Å; Q433-N446 PolarHBondContact O-N 2.83Å; Q433-D526 PolarHBondContact NE2-OD1 3.22Å
434	L	86.9	Confident	78.2	Confident	9 Å²	9	55 Å²	55	5%	0.047	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	119.2	168.3	-168.9	68.9	0	0	0	109.1	I437 C443 L465 Y513 I527	L434-I437 HydrophobicContact CD2-CD1 4.27Å; L434-I437 HydrophobicContact CD2-CG1 4.13Å; L434-C443 HydrophobicContact CD1-CB 3.37Å; L434-C443 VanDerWaalsContact CD1-SG 3.54Å; L434-L465 HydrophobicContact CD1-CD2 3.75Å; L434-L465 HydrophobicContact CD2-CD2 4.31Å; L434-L465 HydrophobicContact CG-CD2 4.43Å; L434-Y513 HydrophobicContact CD2-CE1 4.3Å; L434-Y513 HydrophobicContact CD2-CE2 4.1Å; L434-Y513 HydrophobicContact CG-CE1 4.46Å; L434-I527 HydrophobicContact CB-CB 3.91Å; L434-I527 HydrophobicContact CB-CG2 4.06Å; L434-I527 HydrophobicContact CD2-CB 4.19Å; L434-I527 HydrophobicContact CD2-CD1 3.68Å; L434-I527 HydrophobicContact CD2-CG2 4.17Å; L434-I527 PolarHBondContact N-O 3.22Å; L434-I527 VanDerWaalsContact N-O 3.08Å
435	E	85.4	Confident	78.4	Confident	77 Å²	77	54.9 Å²	54.9	36%	0.36	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-43	179.5	-170.7	-176.5	159.2	0	0	111.7	Q433 I444 N446 K496	Q433-E435 PolarHBondContact O-N 2.72Å; E435-I444 PolarHBondContact N-O 3.18Å; E435-N446 HydrophobicContact CB-CB 4.29Å; E435-N446 WeakPolarHBondContact OE2-CB 3.35Å; E435-K496 IonicContact OE1-NZ 3.79Å; E435-K496 PolarHBondContact OE1-NZ 2.85Å; E435-K496 WeakPolarHBondContact OE2-CD 3.18Å; E435-K496 WeakPolarHBondContact OE2-CE 3.48Å; E435-K496 IonicContact OE2-NZ 2.97Å; E435-K496 PolarHBondContact OE2-NZ 3.2Å
436	R	84.8	Confident	78.9	Confident	107 Å²	107	57.4 Å²	57.4	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	142.8	-175.3	175.6	176.1	170.7	-163.5	-7.3	111.4	C443 I444 K516	R436-C443 CarbonylContact O-C 3.55Å; R436-C443 WeakPolarHBondContact O-CA 3.48Å; R436-I444 HydrophobicContact CB-CB 4.22Å; R436-I444 HydrophobicContact CB-CG1 4.46Å; R436-I444 PolarHBondContact N-O 2.82Å; R436-I444 PolarHBondContact O-N 3.38Å; R436-K516 VanDerWaalsContact NH2-NZ 3.14Å
437	I	86.1	Confident	80.2	Confident	20 Å²	20	55.1 Å²	55.1	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.3	168.4	-58.4	178.4	0	0	0	109.5	L434 N439 L505 I509 L510 Y513	L434-I437 HydrophobicContact CD2-CD1 4.27Å; L434-I437 HydrophobicContact CD2-CG1 4.13Å; I437-N439 WeakPolarHBondContact CG2-O 3.39Å; I437-L505 HydrophobicContact CD1-CD1 3.62Å; I437-L505 HydrophobicContact CG1-CD1 4.05Å; I437-L505 HydrophobicContact CG2-CD1 4.19Å; I437-I509 HydrophobicContact CD1-CG2 3.78Å; I437-L510 HydrophobicContact CD1-CD2 4.37Å; I437-L510 HydrophobicContact CG2-CD2 3.79Å; I437-Y513 HydrophobicContact CD1-CD2 3.84Å; I437-Y513 HydrophobicContact CD1-CG 3.8Å; I437-Y513 HydrophobicContact CG1-CD1 4.27Å; I437-Y513 HydrophobicContact CG1-CD2 4.4Å; I437-Y513 HydrophobicContact CG1-CG 3.95Å
438	V	85.7	Confident	81.4	Confident	67 Å²	67	53 Å²	53	41%	0.406	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-48.2	175.7	-178.7	0	0	0	0	109.5	M442 I444	V438-M442 HydrophobicContact CB-CB 4.22Å; V438-M442 HydrophobicContact CB-CG 4.23Å; V438-M442 WeakPolarHBondContact CB-O 3.48Å; V438-M442 HydrophobicContact CB-SD 4.38Å; V438-M442 HydrophobicContact CG1-SD 4.28Å; V438-M442 HydrophobicContact CG2-CG 4.44Å; V438-M442 PolarHBondContact N-O 2.77Å; V438-I444 HydrophobicContact CG2-CD1 4.05Å; V438-I444 HydrophobicContact CG2-CG1 3.64Å
439	N	87.3	Confident	83	Confident	66 Å²	66	50.5 Å²	50.5	35%	0.353	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	175.4	175.6	67	41.6	0	0	0	109.1	I437 R441 M442	I437-N439 WeakPolarHBondContact CG2-O 3.39Å; N439-R441 PolarHBondContact O-N 2.85Å; N439-R441 VanDerWaalsContact OD1-C 3.31Å; N439-R441 WeakPolarHBondContact OD1-CA 3.42Å; N439-R441 PolarHBondContact OD1-N 2.9Å; N439-M442 PolarHBondContact N-O 3.43Å; N439-M442 PolarHBondContact O-N 3.05Å; N439-M442 VanDerWaalsContact OD1-CB 3.24Å; N439-M442 WeakPolarHBondContact OD1-CB 3.26Å; N439-M442 PolarHBondContact OD1-N 3.4Å
440	P	86.4	Confident	84.3	Confident	55 Å²	55	55.7 Å²	55.7	36%	0.357	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.2	-178	-30	37.7	0	0	0	115.7	D504 L505 L510	P440-D504 HydrophobicContact CB-CB 4.15Å; P440-D504 WeakPolarHBondContact CB-OD1 3.45Å; P440-L505 PolarHBondContact O-N 3.46Å; P440-L510 HydrophobicContact CB-CD1 4.03Å; P440-L510 HydrophobicContact CB-CD2 4.42Å; P440-L510 HydrophobicContact CG-CD1 4.01Å; P440-L510 HydrophobicContact CG-CD2 4.3Å
441	R	89.3	Confident	84.6	Confident	133 Å²	133	61.3 Å²	61.3	50%	0.502	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	10.9	180	-59.9	-162.1	-180	-174.2	-3.9	114.5	N439 A500 L501 D504	N439-R441 PolarHBondContact O-N 2.85Å; N439-R441 VanDerWaalsContact OD1-C 3.31Å; N439-R441 WeakPolarHBondContact OD1-CA 3.42Å; N439-R441 PolarHBondContact OD1-N 2.9Å; R441-A500 CarbonylContact O-C 3.59Å; R441-A500 WeakPolarHBondContact O-CA 3.44Å; R441-L501 PolarHBondContact O-N 2.94Å; R441-D504 WeakPolarHBondContact CD-OD1 3.46Å; R441-D504 WeakPolarHBondContact CG-OD1 3.41Å; R441-D504 IonicContact CZ-OD1 3.8Å; R441-D504 IonicContact CZ-OD2 3.77Å; R441-D504 IonicContact NE-OD1 2.84Å; R441-D504 PolarHBondContact NE-OD1 2.96Å; R441-D504 IonicContact NE-OD2 3.51Å; R441-D504 IonicContact NH2-OD1 3.87Å; R441-D504 IonicContact NH2-OD2 3.1Å; R441-D504 PolarHBondContact NH2-OD2 3.18Å; R441-D504 VanDerWaalsContact NH2-OD2 3.1Å
442	M	90	Very high	84.6	Confident	35 Å²	35	62.6 Å²	62.6	17%	0.172	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	126.8	-175.6	-169.6	-178.3	-69.6	0	0	111	V438 N439 E488 L499	V438-M442 HydrophobicContact CB-CB 4.22Å; V438-M442 HydrophobicContact CB-CG 4.23Å; V438-M442 WeakPolarHBondContact CB-O 3.48Å; V438-M442 HydrophobicContact CB-SD 4.38Å; V438-M442 HydrophobicContact CG1-SD 4.28Å; V438-M442 HydrophobicContact CG2-CG 4.44Å; V438-M442 PolarHBondContact N-O 2.77Å; N439-M442 PolarHBondContact N-O 3.43Å; N439-M442 PolarHBondContact O-N 3.05Å; N439-M442 VanDerWaalsContact OD1-CB 3.24Å; N439-M442 WeakPolarHBondContact OD1-CB 3.26Å; N439-M442 PolarHBondContact OD1-N 3.4Å; M442-E488 VanDerWaalsContact CE-OE2 3.24Å; M442-E488 WeakPolarHBondContact CE-OE2 3.23Å; M442-L499 WeakPolarHBondContact CA-O 3.44Å
443	C	90.8	Very high	84.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	161.5	179.9	65.6	0	0	0	0	112.4	L434 R436 R498 L499	L434-C443 HydrophobicContact CD1-CB 3.37Å; L434-C443 VanDerWaalsContact CD1-SG 3.54Å; R436-C443 CarbonylContact O-C 3.55Å; R436-C443 WeakPolarHBondContact O-CA 3.48Å; C443-R498 WeakPolarHBondContact O-CA 3.38Å; C443-L499 PolarHBondContact N-O 3.2Å; C443-L499 PolarHBondContact O-N 2.89Å
444	I	90.1	Very high	83.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.015	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.4	-178.5	-54.2	-117.7	0	0	0	106.7	E435 R436 V438 F491 K496 C497 R498	E435-I444 PolarHBondContact N-O 3.18Å; R436-I444 HydrophobicContact CB-CB 4.22Å; R436-I444 HydrophobicContact CB-CG1 4.46Å; R436-I444 PolarHBondContact N-O 2.82Å; R436-I444 PolarHBondContact O-N 3.38Å; V438-I444 HydrophobicContact CG2-CD1 4.05Å; V438-I444 HydrophobicContact CG2-CG1 3.64Å; I444-F491 HydrophobicContact CD1-CB 4.05Å; I444-F491 HydrophobicContact CD1-CD1 3.49Å; I444-F491 VanDerWaalsContact CD1-CD1 3.49Å; I444-F491 HydrophobicContact CD1-CD2 3.24Å; I444-F491 HydrophobicContact CD1-CE1 3.65Å; I444-F491 HydrophobicContact CD1-CE2 3.41Å; I444-F491 VanDerWaalsContact CD1-CE2 3.41Å; I444-F491 HydrophobicContact CD1-CG 3.29Å; I444-F491 HydrophobicContact CD1-CZ 3.61Å; I444-F491 HydrophobicContact CG2-CB 4.46Å; I444-F491 HydrophobicContact CG2-CD1 3.83Å; I444-F491 HydrophobicContact CG2-CE1 4.38Å; I444-F491 HydrophobicContact CG2-CG 4.22Å; I444-K496 HydrophobicContact CG2-CB 4.2Å; I444-K496 HydrophobicContact CG2-CD 4.46Å; I444-C497 WeakPolarHBondContact CA-O 3.28Å; I444-R498 HydrophobicContact CD1-CG 4.36Å
445	V	88.7	Confident	83.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.9	-175.4	-172.8	0	0	0	0	108.9	Q433 L448 K496 C497 L499 V529	Q433-V445 WeakPolarHBondContact O-CA 3.34Å; Q433-V445 WeakPolarHBondContact O-CG1 3.5Å; V445-L448 HydrophobicContact CB-CD1 4.12Å; V445-L448 HydrophobicContact CG1-CD1 3.56Å; V445-L448 HydrophobicContact CG1-CG 3.8Å; V445-K496 VanDerWaalsContact O-CA 3.29Å; V445-K496 WeakPolarHBondContact O-CA 3.36Å; V445-C497 PolarHBondContact N-O 2.8Å; V445-C497 PolarHBondContact O-N 2.86Å; V445-L499 HydrophobicContact CG2-CB 3.91Å; V445-L499 HydrophobicContact CG2-CD2 4.27Å; V445-V529 HydrophobicContact CB-CG2 4.43Å; V445-V529 HydrophobicContact CG1-CB 3.62Å; V445-V529 HydrophobicContact CG1-CG1 3.92Å; V445-V529 HydrophobicContact CG1-CG2 3.67Å; V445-V529 HydrophobicContact CG2-CB 4.39Å; V445-V529 HydrophobicContact CG2-CG1 4.17Å; V445-V529 HydrophobicContact CG2-CG2 3.86Å
446	N	88.2	Confident	82.4	Confident	64 Å²	64	65.6 Å²	65.6	34%	0.342	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	157.4	175.1	-167.7	19.2	0	0	0	110.8	G432 Q433 E435 L448 K496	G432-N446 CarbonylContact C-O 3.5Å; G432-N446 WeakPolarHBondContact CA-O 3.31Å; Q433-N446 PolarHBondContact N-O 3.38Å; Q433-N446 PolarHBondContact O-N 2.83Å; E435-N446 HydrophobicContact CB-CB 4.29Å; E435-N446 WeakPolarHBondContact OE2-CB 3.35Å; N446-L448 VanDerWaalsContact C-N 3.28Å; N446-L448 PolarHBondContact O-N 3.37Å; N446-K496 HydrophobicContact CB-CG 4.15Å
447	G	82.4	Confident	81.8	Confident	51 Å²	51	61.9 Å²	61.9	53%	0.526	31%	0.309	S	S	.	.	S	Bend	trans	84.3	-14.5	175.4	0	0	0	0	0	115.7	F449	G447-F449 PolarHBondContact O-N 3.04Å
448	L	77.1	Confident	81.3	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	31%	0.307	C	S	.	.	S	Bend	trans	-66.9	-35.3	174.3	-74.7	176.8	0	0	0	112.6	R430 V445 N446 V529 L531	R430-L448 HydrophobicContact CB-CD2 3.8Å; R430-L448 WeakPolarHBondContact CD-O 2.93Å; R430-L448 PolarHBondContact NH1-O 3.21Å; R430-L448 VanDerWaalsContact O-CD2 3.26Å; R430-L448 WeakPolarHBondContact O-CD2 3.31Å; V445-L448 HydrophobicContact CB-CD1 4.12Å; V445-L448 HydrophobicContact CG1-CD1 3.56Å; V445-L448 HydrophobicContact CG1-CG 3.8Å; N446-L448 VanDerWaalsContact C-N 3.28Å; N446-L448 PolarHBondContact O-N 3.37Å; L448-V529 HydrophobicContact CD1-CG1 4.04Å; L448-L531 HydrophobicContact CD2-CB 3.99Å
449	F	81.8	Confident	81.2	Confident	10 Å²	10	62 Å²	62	4%	0.044	31%	0.307	C	S	.	.	S	Bend	trans	-135.4	149.2	-172.7	-55.7	-78.7	0	0	0	112.2	G447 T453 W455 F458 I487 G495 C497 L531	G447-F449 PolarHBondContact O-N 3.04Å; F449-T453 HydrophobicContact CD1-CG2 3.93Å; F449-W455 HydrophobicContact CB-CH2 3.61Å; F449-W455 HydrophobicContact CB-CZ2 4.08Å; F449-W455 HydrophobicContact CB-CZ3 4.05Å; F449-W455 HydrophobicContact CD2-CE3 4.27Å; F449-W455 AromaticContact CD2-CH2 3.49Å; F449-W455 HydrophobicContact CD2-CH2 3.49Å; F449-W455 VanDerWaalsContact CD2-CH2 3.49Å; F449-W455 AromaticContact CD2-CZ3 3.23Å; F449-W455 HydrophobicContact CD2-CZ3 3.23Å; F449-W455 HydrophobicContact CE2-CH2 4.39Å; F449-W455 AromaticContact CE2-CZ3 3.71Å; F449-W455 HydrophobicContact CE2-CZ3 3.71Å; F449-W455 AromaticContact CG-CH2 3.79Å; F449-W455 HydrophobicContact CG-CH2 3.79Å; F449-W455 AromaticContact CG-CZ3 3.7Å; F449-W455 HydrophobicContact CG-CZ3 3.7Å; F449-F458 HydrophobicContact CD1-CD2 4.38Å; F449-F458 HydrophobicContact CE1-CB 4.04Å; F449-F458 AromaticContact CE1-CD1 3.76Å; F449-F458 HydrophobicContact CE1-CD1 3.76Å; F449-F458 AromaticContact CE1-CD2 3.8Å; F449-F458 HydrophobicContact CE1-CD2 3.8Å; F449-F458 HydrophobicContact CE1-CE1 4.17Å; F449-F458 HydrophobicContact CE1-CE2 4.21Å; F449-F458 AromaticContact CE1-CG 3.56Å; F449-F458 HydrophobicContact CE1-CG 3.56Å; F449-F458 HydrophobicContact CE1-CZ 4.38Å; F449-F458 HydrophobicContact CZ-CB 3.85Å; F449-F458 HydrophobicContact CZ-CD1 4.17Å; F449-F458 HydrophobicContact CZ-CD2 4.46Å; F449-F458 AromaticContact CZ-CG 3.9Å; F449-F458 HydrophobicContact CZ-CG 3.9Å; F449-I487 HydrophobicContact CE2-CD1 3.76Å; F449-I487 HydrophobicContact CZ-CD1 3.61Å; F449-G495 WeakPolarHBondContact O-CA 3.5Å; F449-C497 HydrophobicContact CD2-CB 4.32Å; F449-C497 HydrophobicContact CE2-CB 4.36Å; F449-L531 HydrophobicContact CE1-CD2 3.96Å; F449-L531 HydrophobicContact CE2-CD2 4.32Å; F449-L531 HydrophobicContact CZ-CD2 3.41Å; F449-L531 VanDerWaalsContact CZ-CD2 3.41Å
450	K	78.9	Confident	80.7	Confident	157 Å²	157	61.2 Å²	61.2	68%	0.683	31%	0.313	S	S	*	.			trans	-83.1	157.4	168.8	-65	-174.5	179	-176.1	0	109.3	E452 T453	K450-E452 PolarHBondContact O-N 3.35Å; K450-E452 VanDerWaalsContact O-N 3.1Å; K450-T453 PolarHBondContact N-OG1 3.08Å; K450-T453 VanDerWaalsContact N-OG1 3.11Å; K450-T453 WeakPolarHBondContact O-CB 3.49Å; K450-T453 PolarHBondContact O-N 3.29Å; K450-T453 PolarHBondContact O-OG1 3.26Å
451	R	74	Confident	80.2	Confident	165 Å²	165	59.1 Å²	59.1	62%	0.623	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-33.7	178.7	-179.6	167.3	-167.4	-176.7	4.7	113.9	T453 Q493	R451-T453 VanDerWaalsContact C-N 3.3Å; R451-T453 PolarHBondContact O-N 2.87Å; R451-Q493 WeakPolarHBondContact CD-O 3.08Å; R451-Q493 WeakPolarHBondContact CG-O 3.44Å; R451-Q493 PolarHBondContact NE-O 3.27Å
452	E	75.2	Confident	79.7	Confident	179 Å²	179	56.9 Å²	56.9	84%	0.836	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.5	-176.5	-56.5	157.6	-126.6	0	0	113.8	K450 N454	K450-E452 PolarHBondContact O-N 3.35Å; K450-E452 VanDerWaalsContact O-N 3.1Å; E452-N454 PolarHBondContact O-N 3.29Å
453	T	72.7	Confident	79.3	Confident	23 Å²	23	55.2 Å²	55.2	14%	0.141	28%	0.283	C	S	.	.			trans	-71.7	131	-172.7	-45	0	0	0	0	110.8	F449 K450 R451 W455 F458	F449-T453 HydrophobicContact CD1-CG2 3.93Å; K450-T453 PolarHBondContact N-OG1 3.08Å; K450-T453 VanDerWaalsContact N-OG1 3.11Å; K450-T453 WeakPolarHBondContact O-CB 3.49Å; K450-T453 PolarHBondContact O-N 3.29Å; K450-T453 PolarHBondContact O-OG1 3.26Å; R451-T453 VanDerWaalsContact C-N 3.3Å; R451-T453 PolarHBondContact O-N 2.87Å; T453-W455 PolarHBondContact O-N 3.39Å; T453-W455 VanDerWaalsContact O-N 3.13Å; T453-W455 PolarHBondContact O-NE1 2.73Å; T453-F458 HydrophobicContact CG2-CD2 4.09Å; T453-F458 HydrophobicContact CG2-CE2 3.54Å; T453-F458 HydrophobicContact CG2-CZ 4.39Å
454	N	75.5	Confident	79	Confident	76 Å²	76	56 Å²	56	41%	0.406	29%	0.286	S	S	.	.			trans	-69.2	108.2	170.1	-175.7	-14.1	0	0	0	109.9	E452 D456 I457 F458	E452-N454 PolarHBondContact O-N 3.29Å; N454-D456 PolarHBondContact OD1-N 2.83Å; N454-I457 HydrophobicContact CB-CD1 3.94Å; N454-I457 HydrophobicContact CB-CG1 4.43Å; N454-F458 VanDerWaalsContact O-CD2 3.27Å; N454-F458 WeakPolarHBondContact O-CD2 3.39Å; N454-F458 WeakPolarHBondContact O-CE2 3.4Å
455	W	74	Confident	78.7	Confident	35 Å²	35	55.9 Å²	55.9	13%	0.133	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-72.9	-33.6	-172	-70.6	100.4	0	0	0	114.3	F449 T453 I457 F458 I459 S490 G495 K496 C497	F449-W455 HydrophobicContact CB-CH2 3.61Å; F449-W455 HydrophobicContact CB-CZ2 4.08Å; F449-W455 HydrophobicContact CB-CZ3 4.05Å; F449-W455 HydrophobicContact CD2-CE3 4.27Å; F449-W455 AromaticContact CD2-CH2 3.49Å; F449-W455 HydrophobicContact CD2-CH2 3.49Å; F449-W455 VanDerWaalsContact CD2-CH2 3.49Å; F449-W455 AromaticContact CD2-CZ3 3.23Å; F449-W455 HydrophobicContact CD2-CZ3 3.23Å; F449-W455 HydrophobicContact CE2-CH2 4.39Å; F449-W455 AromaticContact CE2-CZ3 3.71Å; F449-W455 HydrophobicContact CE2-CZ3 3.71Å; F449-W455 AromaticContact CG-CH2 3.79Å; F449-W455 HydrophobicContact CG-CH2 3.79Å; F449-W455 AromaticContact CG-CZ3 3.7Å; F449-W455 HydrophobicContact CG-CZ3 3.7Å; T453-W455 PolarHBondContact O-N 3.39Å; T453-W455 VanDerWaalsContact O-N 3.13Å; T453-W455 PolarHBondContact O-NE1 2.73Å; W455-I457 PolarHBondContact O-N 2.81Å; W455-F458 PolarHBondContact O-N 3.07Å; W455-I459 PolarHBondContact O-N 2.95Å; W455-S490 VanDerWaalsContact CD2-CB 3.47Å; W455-S490 VanDerWaalsContact CE2-CB 3.41Å; W455-G495 WeakPolarHBondContact CH2-O 3.38Å; W455-K496 VanDerWaalsContact CH2-O 3.25Å; W455-K496 WeakPolarHBondContact CH2-O 3.41Å; W455-C497 HydrophobicContact CH2-CB 3.77Å; W455-C497 HydrophobicContact CZ3-CB 3.47Å; W455-C497 VanDerWaalsContact CZ3-CB 3.47Å
456	D	71.7	Confident	78.3	Confident	130 Å²	130	56.8 Å²	56.8	70%	0.695	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-58.5	-24.6	-173.7	-58.5	-31.3	0	0	0	112.1	N454	N454-D456 PolarHBondContact OD1-N 2.83Å
457	I	72.9	Confident	77.8	Confident	29 Å²	29	54.3 Å²	54.3	15%	0.149	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-73.6	-27.5	179.4	-56.2	177.3	0	0	0	112.1	N454 W455 V544	N454-I457 HydrophobicContact CB-CD1 3.94Å; N454-I457 HydrophobicContact CB-CG1 4.43Å; W455-I457 PolarHBondContact O-N 2.81Å; I457-V544 HydrophobicContact CG2-CB 3.97Å; I457-V544 HydrophobicContact CG2-CG2 3.15Å
458	F	75.1	Confident	77	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.057	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-11.8	-171.1	-58.3	-79.5	0	0	0	114.1	F449 T453 N454 W455 G460 L461 I487 L531 F533	F449-F458 HydrophobicContact CD1-CD2 4.38Å; F449-F458 HydrophobicContact CE1-CB 4.04Å; F449-F458 AromaticContact CE1-CD1 3.76Å; F449-F458 HydrophobicContact CE1-CD1 3.76Å; F449-F458 AromaticContact CE1-CD2 3.8Å; F449-F458 HydrophobicContact CE1-CD2 3.8Å; F449-F458 HydrophobicContact CE1-CE1 4.17Å; F449-F458 HydrophobicContact CE1-CE2 4.21Å; F449-F458 AromaticContact CE1-CG 3.56Å; F449-F458 HydrophobicContact CE1-CG 3.56Å; F449-F458 HydrophobicContact CE1-CZ 4.38Å; F449-F458 HydrophobicContact CZ-CB 3.85Å; F449-F458 HydrophobicContact CZ-CD1 4.17Å; F449-F458 HydrophobicContact CZ-CD2 4.46Å; F449-F458 AromaticContact CZ-CG 3.9Å; F449-F458 HydrophobicContact CZ-CG 3.9Å; T453-F458 HydrophobicContact CG2-CD2 4.09Å; T453-F458 HydrophobicContact CG2-CE2 3.54Å; T453-F458 HydrophobicContact CG2-CZ 4.39Å; N454-F458 VanDerWaalsContact O-CD2 3.27Å; N454-F458 WeakPolarHBondContact O-CD2 3.39Å; N454-F458 WeakPolarHBondContact O-CE2 3.4Å; W455-F458 PolarHBondContact O-N 3.07Å; F458-G460 PolarHBondContact O-N 2.81Å; F458-L461 HydrophobicContact CB-CD1 4.09Å; F458-L461 HydrophobicContact CD1-CD1 3.71Å; F458-L461 HydrophobicContact CG-CD1 4.35Å; F458-L461 WeakPolarHBondContact O-CB 3.5Å; F458-L461 WeakPolarHBondContact O-CG 3.34Å; F458-L461 PolarHBondContact O-N 2.82Å; F458-I487 WeakPolarHBondContact O-CB 3.44Å; F458-L531 HydrophobicContact CD1-CD2 4.43Å; F458-F533 HydrophobicContact CD1-CE1 4.46Å; F458-F533 HydrophobicContact CD1-CE2 4.49Å; F458-F533 HydrophobicContact CD1-CZ 4.43Å; F458-F533 HydrophobicContact CE1-CD1 4.39Å; F458-F533 HydrophobicContact CE1-CD2 4.03Å; F458-F533 AromaticContact CE1-CE1 3.95Å; F458-F533 HydrophobicContact CE1-CE1 3.95Å; F458-F533 AromaticContact CE1-CE2 3.58Å; F458-F533 HydrophobicContact CE1-CE2 3.58Å; F458-F533 HydrophobicContact CE1-CG 4.42Å; F458-F533 AromaticContact CE1-CZ 3.52Å; F458-F533 HydrophobicContact CE1-CZ 3.52Å; F458-F533 HydrophobicContact CZ-CE2 4.38Å; F458-F533 HydrophobicContact CZ-CZ 4.29Å
459	I	82.8	Confident	76	Confident	77 Å²	77	60.2 Å²	60.2	40%	0.395	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	133.9	174.7	-67.1	170.7	0	0	0	109	W455 L461 I487 E488	W455-I459 PolarHBondContact O-N 2.95Å; I459-L461 VanDerWaalsContact C-N 3.34Å; I459-I487 CarbonylContact C-O 3.27Å; I459-I487 WeakPolarHBondContact CA-O 3.48Å; I459-E488 WeakPolarHBondContact CG2-O 3.44Å
460	G	77.8	Confident	74.3	Confident	48 Å²	48	67.3 Å²	67.3	50%	0.495	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-6.8	-177.7	0	0	0	0	0	114.8	F458 Y486 I487	F458-G460 PolarHBondContact O-N 2.81Å; G460-Y486 WeakPolarHBondContact O-CD1 3.39Å; G460-I487 PolarHBondContact N-O 2.87Å
461	L	74.4	Confident	72.5	Confident	11 Å²	11	67.1 Å²	67.1	6%	0.058	33%	0.334	C	S	.	.			trans	-75.4	136	176	-61.4	174.6	0	0	0	111	F458 I459 Y486 I487 L531 F533 V544 Q546	F458-L461 HydrophobicContact CB-CD1 4.09Å; F458-L461 HydrophobicContact CD1-CD1 3.71Å; F458-L461 HydrophobicContact CG-CD1 4.35Å; F458-L461 WeakPolarHBondContact O-CB 3.5Å; F458-L461 WeakPolarHBondContact O-CG 3.34Å; F458-L461 PolarHBondContact O-N 2.82Å; I459-L461 VanDerWaalsContact C-N 3.34Å; L461-Y486 CarbonylContact O-C 3.58Å; L461-Y486 WeakPolarHBondContact O-CA 3.29Å; L461-I487 PolarHBondContact O-N 2.86Å; L461-L531 HydrophobicContact CB-CD1 3.91Å; L461-F533 HydrophobicContact CD1-CB 3.77Å; L461-F533 HydrophobicContact CD1-CG 4.19Å; L461-V544 HydrophobicContact CD1-CB 4.17Å; L461-V544 HydrophobicContact CD1-CG1 3.52Å; L461-V544 HydrophobicContact CD2-CB 4.44Å; L461-V544 HydrophobicContact CD2-CG1 3.82Å; L461-V544 HydrophobicContact CG-CG1 4.29Å; L461-Q546 HydrophobicContact CD2-CB 4.2Å
462	R	80	Confident	70.6	Confident	87 Å²	87	65.3 Å²	65.3	33%	0.328	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	133.5	176	-152.4	177.5	-170.4	-162.7	-1.9	110.2	Y484 G485 Y486 E502 L531 Q546	R462-Y484 HydrophobicContact CG-CD1 4.47Å; R462-G485 CarbonylContact C-O 3.54Å; R462-G485 WeakPolarHBondContact CA-O 3.45Å; R462-G485 VanDerWaalsContact CG-O 3.25Å; R462-G485 WeakPolarHBondContact CG-O 3.47Å; R462-Y486 HydrophobicContact CB-CD1 3.99Å; R462-Y486 HydrophobicContact CB-CE1 3.88Å; R462-Y486 HydrophobicContact CG-CD1 4.12Å; R462-Y486 HydrophobicContact CG-CE1 3.77Å; R462-E502 IonicContact CZ-OE1 3.77Å; R462-E502 VanDerWaalsContact CZ-OE1 3.26Å; R462-E502 IonicContact CZ-OE2 2.73Å; R462-E502 IonicContact NE-OE1 3.93Å; R462-E502 PolarHBondContact NE-OE1 2.9Å; R462-E502 IonicContact NE-OE2 3.99Å; R462-E502 VanDerWaalsContact NH2-CD 3.31Å; R462-E502 IonicContact NH2-OE1 2.78Å; R462-E502 PolarHBondContact NH2-OE1 3.19Å; R462-E502 IonicContact NH2-OE2 2.63Å; R462-E502 PolarHBondContact NH2-OE2 2.71Å; R462-L531 VanDerWaalsContact O-CD1 3.29Å; R462-L531 WeakPolarHBondContact O-CD1 3.47Å; R462-Q546 PolarHBondContact O-NE2 2.88Å
463	A	81.8	Confident	68.8	Low	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	166	166.5	0	0	0	0	0	108.1	Y484 G485 L499 V529 I530 L531	A463-Y484 CarbonylContact O-C 3.57Å; A463-G485 PolarHBondContact N-O 2.85Å; A463-G485 PolarHBondContact O-N 2.78Å; A463-L499 HydrophobicContact CB-CD1 3.58Å; A463-L499 HydrophobicContact CB-CD2 4.28Å; A463-V529 HydrophobicContact CB-CG1 4.29Å; A463-I530 CarbonylContact C-O 3.55Å; A463-I530 VanDerWaalsContact CA-O 3.31Å; A463-I530 WeakPolarHBondContact CA-O 3.38Å; A463-I530 WeakPolarHBondContact CB-O 2.85Å; A463-L531 HydrophobicContact CB-CB 4.27Å; A463-L531 HydrophobicContact CB-CD1 4.1Å
464	Y	83	Confident	67.1	Low	17 Å²	17	67.4 Å²	67.4	7%	0.067	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.6	173.8	59.9	-89.1	0	0	0	111.6	I466 R482 I483 Y484 I530 E532	Y464-I466 HydrophobicContact CD2-CG1 3.99Å; Y464-I466 HydrophobicContact CE2-CD1 3.99Å; Y464-I466 HydrophobicContact CE2-CG1 3.85Å; Y464-R482 HydrophobicContact CD2-CG 4.35Å; Y464-I483 CarbonylContact C-O 3.6Å; Y464-I483 WeakPolarHBondContact CA-O 3.44Å; Y464-Y484 HydrophobicContact CD1-CD1 4.45Å; Y464-Y484 HydrophobicContact CD1-CE1 4.07Å; Y464-Y484 HydrophobicContact CG-CD1 4.4Å; Y464-Y484 HydrophobicContact CG-CE1 4.13Å; Y464-I530 HydrophobicContact CD2-CB 4.31Å; Y464-I530 HydrophobicContact CE1-CB 4.02Å; Y464-I530 HydrophobicContact CE1-CG2 3.98Å; Y464-I530 HydrophobicContact CE2-CB 3.8Å; Y464-I530 HydrophobicContact CE2-CD1 3.99Å; Y464-I530 HydrophobicContact CE2-CG1 4.16Å; Y464-I530 HydrophobicContact CE2-CG2 4.36Å; Y464-I530 PolarHBondContact N-O 3.15Å; Y464-I530 PolarHBondContact O-N 3.26Å; Y464-I530 WeakPolarHBondContact OH-CG2 3.42Å; Y464-E532 PolarHBondContact OH-OE1 3.42Å
465	L	85.6	Confident	65.3	Low	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.1	170	-58	107.7	0	0	0	109.2	L434 R482 I483 L499 L501 I527 E528 V529	L434-L465 HydrophobicContact CD1-CD2 3.75Å; L434-L465 HydrophobicContact CD2-CD2 4.31Å; L434-L465 HydrophobicContact CG-CD2 4.43Å; L465-R482 VanDerWaalsContact O-CA 3.29Å; L465-R482 WeakPolarHBondContact O-CA 3.47Å; L465-I483 HydrophobicContact CD1-CB 4.17Å; L465-I483 HydrophobicContact CD1-CG2 4.23Å; L465-I483 PolarHBondContact N-O 2.82Å; L465-I483 PolarHBondContact O-N 2.86Å; L465-I483 VanDerWaalsContact O-N 3.07Å; L465-L499 HydrophobicContact CD1-CD2 4.05Å; L465-L499 HydrophobicContact CG-CD2 4.38Å; L465-L501 HydrophobicContact CD1-CD1 4.02Å; L465-L501 HydrophobicContact CD1-CD2 3.35Å; L465-L501 HydrophobicContact CD1-CG 4.34Å; L465-I527 HydrophobicContact CB-CG2 3.95Å; L465-I527 HydrophobicContact CD2-CG2 3.59Å; L465-I527 HydrophobicContact CG-CG2 4.36Å; L465-E528 WeakPolarHBondContact CA-O 2.88Å; L465-V529 HydrophobicContact CD2-CG2 3.82Å; L465-V529 HydrophobicContact CG-CG2 4.04Å
466	I	79.7	Confident	63.7	Low	18 Å²	18	74.2 Å²	74.2	9%	0.092	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116	167.7	-67	-175.7	0	0	0	107.2	Y464 K468 I480 E528 I530	Y464-I466 HydrophobicContact CD2-CG1 3.99Å; Y464-I466 HydrophobicContact CE2-CD1 3.99Å; Y464-I466 HydrophobicContact CE2-CG1 3.85Å; I466-K468 HydrophobicContact CG2-CG 4.19Å; I466-I480 HydrophobicContact CG2-CG2 3.81Å; I466-E528 PolarHBondContact N-O 3.27Å; I466-E528 PolarHBondContact O-N 3.44Å; I466-I530 HydrophobicContact CD1-CD1 3.49Å; I466-I530 VanDerWaalsContact CD1-CD1 3.49Å; I466-I530 HydrophobicContact CD1-CG1 4.23Å; I466-I530 HydrophobicContact CG1-CD1 4.37Å
467	I	76.9	Confident	62	Low	13 Å²	13	74.4 Å²	74.4	7%	0.067	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.2	171.3	-60.5	155.9	0	0	0	106.9	Q481 I483 P506 I509 I527	I467-Q481 HydrophobicContact CB-CB 4.4Å; I467-Q481 PolarHBondContact N-O 2.83Å; I467-Q481 PolarHBondContact O-N 2.99Å; I467-I483 HydrophobicContact CD1-CD1 3.43Å; I467-I483 VanDerWaalsContact CD1-CD1 3.43Å; I467-I483 HydrophobicContact CD1-CG1 4.14Å; I467-P506 HydrophobicContact CD1-CG 4.45Å; I467-I509 HydrophobicContact CB-CD1 4.36Å; I467-I509 HydrophobicContact CD1-CD1 3.27Å; I467-I509 HydrophobicContact CG1-CD1 3.64Å; I467-I509 HydrophobicContact CG2-CD1 3.79Å; I467-I527 HydrophobicContact CG1-CD1 4.46Å; I467-I527 HydrophobicContact CG1-CG1 4.35Å; I467-I527 HydrophobicContact CG1-CG2 4.3Å
468	K	66.3	Low	60.7	Low	124 Å²	124	79.6 Å²	79.6	54%	0.539	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	108.6	169.2	-64.3	177.2	-176.6	171	0	106.9	I466	I466-K468 HydrophobicContact CG2-CG 4.19Å
469	S	56.3	Low	59.4	Low	53 Å²	53	86 Å²	86	37%	0.371	48%	0.476	S	S	.	.			trans	-72.7	126.8	170.2	49.2	0	0	0	0	108.8	E471	S469-E471 VanDerWaalsContact C-N 3.3Å; S469-E471 PolarHBondContact O-N 2.59Å
470	N	46.4	Very low	58.3	Low	158 Å²	158	85.5 Å²	85.5	85%	0.845	47%	0.473	S	S	*	.			trans	-90.6	72.5	165.2	-78.1	-16.2	0	0	0	107.2
471	E	40.3	Very low	58	Low	154 Å²	154	88.2 Å²	88.2	72%	0.72	47%	0.473	S	S	*	.			trans	-117.4	115.1	166.6	-71.1	-163.8	157.8	0	0	109.1	S469	S469-E471 VanDerWaalsContact C-N 3.3Å; S469-E471 PolarHBondContact O-N 2.59Å
472	D	34.7	Very low	58.3	Low	126 Å²	126	90.7 Å²	90.7	67%	0.674	48%	0.482	S	S	*	.			trans	48.6	108.8	170.3	-63.6	-18	0	0	0	119.5	S474	D472-S474 PolarHBondContact O-N 3.33Å
473	S	36.5	Very low	58.4	Low	140 Å²	140	86.9 Å²	86.9	98%	0.979	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	30	167.8	45.1	0	0	0	0	115.3
474	S	37.9	Very low	58.5	Low	107 Å²	107	90.2 Å²	90.2	75%	0.748	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-3.9	180	60.8	0	0	0	0	114.4	D472	D472-S474 PolarHBondContact O-N 3.33Å
475	S	36.2	Very low	58.7	Low	77 Å²	77	89.4 Å²	89.4	54%	0.538	48%	0.478	S	S	.	.	S	Bend	trans	-131.5	120.6	167.8	46.4	0	0	0	0	110.8	D477	S475-D477 PolarHBondContact O-N 3.42Å
476	N	40.4	Very low	58.8	Low	177 Å²	177	94.1 Å²	94.1	95%	0.947	50%	0.496	S	S	*	.	S	Bend	trans	-64.3	16	-176.1	-96.9	-14.6	0	0	0	116.1
477	D	37.8	Very low	59.1	Low	133 Å²	133	93.3 Å²	93.3	71%	0.711	49%	0.492	S	S	*	.			trans	-104.5	86.4	176.3	-80.4	-24.5	0	0	0	109.5	S475 H479	S475-D477 PolarHBondContact O-N 3.42Å; D477-H479 VanDerWaalsContact C-N 3.3Å; D477-H479 PolarHBondContact O-N 3.08Å
478	N	44.8	Very low	59.7	Low	138 Å²	138	96.9 Å²	96.9	74%	0.738	51%	0.508	S	S	*	.			trans	-62.7	95	163	-83.4	-20.8	0	0	0	108.1	I480	N478-I480 PolarHBondContact O-N 3.38Å
479	H	48.5	Very low	60.7	Low	149 Å²	149	92.4 Å²	92.4	69%	0.69	49%	0.493	S	S	*	.			trans	-68.2	92.9	176.2	-108.5	-63	0	0	0	109.6	D477 Q481	D477-H479 VanDerWaalsContact C-N 3.3Å; D477-H479 PolarHBondContact O-N 3.08Å; H479-Q481 PolarHBondContact O-N 2.6Å
480	I	59.7	Low	62.2	Low	65 Å²	65	92.1 Å²	92.1	33%	0.333	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	108.7	174	-65.7	166.4	0	0	0	108.4	T302 I466 N478 R482	T302-I480 HydrophobicContact CG2-CD1 4.31Å; I466-I480 HydrophobicContact CG2-CG2 3.81Å; N478-I480 PolarHBondContact O-N 3.38Å; I480-R482 HydrophobicContact CG2-CG 4.44Å
481	Q	71	Confident	63.9	Low	105 Å²	105	87.7 Å²	87.7	49%	0.491	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.9	174.5	-163.4	176.7	9.1	0	0	110	I467 H479	I467-Q481 HydrophobicContact CB-CB 4.4Å; I467-Q481 PolarHBondContact N-O 2.83Å; I467-Q481 PolarHBondContact O-N 2.99Å; H479-Q481 PolarHBondContact O-N 2.6Å
482	R	80.5	Confident	65.8	Low	64 Å²	64	83.1 Å²	83.1	24%	0.242	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.2	177.3	-65.7	-178	-176.1	-176.1	-3.8	110.9	T302 D305 Y464 L465 I480 Y484	T302-R482 PolarHBondContact O-NH2 3.35Å; D305-R482 IonicContact OD1-NH1 3.91Å; D305-R482 IonicContact OD2-CZ 2.83Å; D305-R482 IonicContact OD2-NH1 3.26Å; D305-R482 PolarHBondContact OD2-NH1 2.73Å; D305-R482 IonicContact OD2-NH2 3Å; Y464-R482 HydrophobicContact CD2-CG 4.35Å; L465-R482 VanDerWaalsContact O-CA 3.29Å; L465-R482 WeakPolarHBondContact O-CA 3.47Å; I480-R482 HydrophobicContact CG2-CG 4.44Å; R482-Y484 HydrophobicContact CB-CE2 4.34Å
483	I	81.6	Confident	67.6	Low	7 Å²	7	83.9 Å²	83.9	4%	0.036	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.3	176.2	-61	176	0	0	0	108.4	Y464 L465 I467 L501 L505 P506	Y464-I483 CarbonylContact C-O 3.6Å; Y464-I483 WeakPolarHBondContact CA-O 3.44Å; L465-I483 HydrophobicContact CD1-CB 4.17Å; L465-I483 HydrophobicContact CD1-CG2 4.23Å; L465-I483 PolarHBondContact N-O 2.82Å; L465-I483 PolarHBondContact O-N 2.86Å; L465-I483 VanDerWaalsContact O-N 3.07Å; I467-I483 HydrophobicContact CD1-CD1 3.43Å; I467-I483 VanDerWaalsContact CD1-CD1 3.43Å; I467-I483 HydrophobicContact CD1-CG1 4.14Å; I483-L501 HydrophobicContact CG2-CB 4.39Å; I483-L501 HydrophobicContact CG2-CD1 4.35Å; I483-L505 HydrophobicContact CD1-CD2 3.83Å; I483-P506 HydrophobicContact CD1-CG 4.31Å
484	Y	84.2	Confident	69.4	Low	70 Å²	70	80.3 Å²	80.3	28%	0.275	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	151.5	-178.6	-64.9	-87.4	0	0	0	111.3	R462 A463 Y464 R482 E502	R462-Y484 HydrophobicContact CG-CD1 4.47Å; A463-Y484 CarbonylContact O-C 3.57Å; Y464-Y484 HydrophobicContact CD1-CD1 4.45Å; Y464-Y484 HydrophobicContact CD1-CE1 4.07Å; Y464-Y484 HydrophobicContact CG-CD1 4.4Å; Y464-Y484 HydrophobicContact CG-CE1 4.13Å; R482-Y484 HydrophobicContact CB-CE2 4.34Å; Y484-E502 WeakPolarHBondContact CB-OE2 3.47Å; Y484-E502 PolarHBondContact O-N 3Å
485	G	86.7	Confident	71.4	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	-176.5	174.9	0	0	0	0	0	111.4	R462 A463 A500	R462-G485 CarbonylContact C-O 3.54Å; R462-G485 WeakPolarHBondContact CA-O 3.45Å; R462-G485 VanDerWaalsContact CG-O 3.25Å; R462-G485 WeakPolarHBondContact CG-O 3.47Å; A463-G485 PolarHBondContact N-O 2.85Å; A463-G485 PolarHBondContact O-N 2.78Å; G485-A500 CarbonylContact C-O 3.43Å; G485-A500 VanDerWaalsContact C-O 3.26Å; G485-A500 WeakPolarHBondContact CA-O 3.47Å
486	Y	88.2	Confident	73.9	Confident	99 Å²	99	73.5 Å²	73.5	39%	0.388	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143	-178.8	-56.5	-89	0	0	0	110.5	G460 L461 R462 E488 L499 A500 E502	G460-Y486 WeakPolarHBondContact O-CD1 3.39Å; L461-Y486 CarbonylContact O-C 3.58Å; L461-Y486 WeakPolarHBondContact O-CA 3.29Å; R462-Y486 HydrophobicContact CB-CD1 3.99Å; R462-Y486 HydrophobicContact CB-CE1 3.88Å; R462-Y486 HydrophobicContact CG-CD1 4.12Å; R462-Y486 HydrophobicContact CG-CE1 3.77Å; Y486-E488 PolarHBondContact O-N 2.88Å; Y486-L499 VanDerWaalsContact C-CD1 3.5Å; Y486-L499 WeakPolarHBondContact O-CA 3.3Å; Y486-L499 WeakPolarHBondContact O-CD1 3.46Å; Y486-A500 PolarHBondContact N-O 2.84Å; Y486-A500 PolarHBondContact O-N 2.78Å; Y486-E502 HydrophobicContact CD2-CG 4.37Å; Y486-E502 HydrophobicContact CE2-CG 3.6Å; Y486-E502 WeakPolarHBondContact CE2-OE1 3.49Å; Y486-E502 PolarHBondContact OH-OE1 3.03Å
487	I	86.7	Confident	76.2	Confident	1 Å²	1	65 Å²	65	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117.2	174.6	-63.8	177.1	0	0	0	108.1	F449 F458 I459 G460 L461 C497 L499 L531	F449-I487 HydrophobicContact CE2-CD1 3.76Å; F449-I487 HydrophobicContact CZ-CD1 3.61Å; F458-I487 WeakPolarHBondContact O-CB 3.44Å; I459-I487 CarbonylContact C-O 3.27Å; I459-I487 WeakPolarHBondContact CA-O 3.48Å; G460-I487 PolarHBondContact N-O 2.87Å; L461-I487 PolarHBondContact O-N 2.86Å; I487-C497 HydrophobicContact CG2-CB 4.45Å; I487-L499 HydrophobicContact CG1-CD1 3.91Å; I487-L531 HydrophobicContact CD1-CD1 3.6Å; I487-L531 HydrophobicContact CD1-CD2 3.56Å; I487-L531 HydrophobicContact CD1-CG 4.1Å; I487-L531 HydrophobicContact CG1-CD1 4.44Å
488	E	88.7	Confident	78.7	Confident	87 Å²	87	62.4 Å²	62.4	41%	0.407	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-50.7	-175.6	-176.9	-170.7	-158.2	0	0	111.4	M442 I459 Y486 R498 A500	M442-E488 VanDerWaalsContact CE-OE2 3.24Å; M442-E488 WeakPolarHBondContact CE-OE2 3.23Å; I459-E488 WeakPolarHBondContact CG2-O 3.44Å; Y486-E488 PolarHBondContact O-N 2.88Å; E488-R498 HydrophobicContact CB-CB 4.24Å; E488-R498 PolarHBondContact N-O 2.66Å; E488-A500 HydrophobicContact CB-CB 4.44Å
489	S	88	Confident	80.9	Confident	30 Å²	30	55.9 Å²	55.9	21%	0.21	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	165.8	-175.2	55.6	0	0	0	0	112.3	C497 R498	S489-C497 CarbonylContact O-C 3.58Å; S489-C497 WeakPolarHBondContact O-CA 3.24Å; S489-R498 PolarHBondContact O-N 3.19Å; S489-R498 WeakPolarHBondContact OG-CD 2.91Å; S489-R498 PolarHBondContact OG-NH1 3.1Å
490	S	86.5	Confident	82.9	Confident	47 Å²	47	50.1 Å²	50.1	33%	0.329	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	150.6	167.1	64.3	0	0	0	0	111.2	W455 R498	W455-S490 VanDerWaalsContact CD2-CB 3.47Å; W455-S490 VanDerWaalsContact CE2-CB 3.41Å; S490-R498 PolarHBondContact O-NH1 2.8Å
491	F	83.2	Confident	84.3	Confident	65 Å²	65	47.6 Å²	47.6	29%	0.285	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	102.2	176	-173.8	-100.3	0	0	0	110.7	I444 K496 R498	I444-F491 HydrophobicContact CD1-CB 4.05Å; I444-F491 HydrophobicContact CD1-CD1 3.49Å; I444-F491 VanDerWaalsContact CD1-CD1 3.49Å; I444-F491 HydrophobicContact CD1-CD2 3.24Å; I444-F491 HydrophobicContact CD1-CE1 3.65Å; I444-F491 HydrophobicContact CD1-CE2 3.41Å; I444-F491 VanDerWaalsContact CD1-CE2 3.41Å; I444-F491 HydrophobicContact CD1-CG 3.29Å; I444-F491 HydrophobicContact CD1-CZ 3.61Å; I444-F491 HydrophobicContact CG2-CB 4.46Å; I444-F491 HydrophobicContact CG2-CD1 3.83Å; I444-F491 HydrophobicContact CG2-CE1 4.38Å; I444-F491 HydrophobicContact CG2-CG 4.22Å; F491-K496 HydrophobicContact CB-CB 4.11Å; F491-K496 HydrophobicContact CD1-CB 4.26Å; F491-K496 HydrophobicContact CD1-CD 4.25Å; F491-K496 PolarHBondContact N-O 2.89Å; F491-K496 WeakPolarHBondContact O-CB 3.33Å; F491-R498 HydrophobicContact CB-CG 4.3Å; F491-R498 HydrophobicContact CD2-CG 4.37Å
492	G	80.5	Confident	85	Confident	58 Å²	58	45.3 Å²	45.3	60%	0.598	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.3	-160.8	-180	0	0	0	0	0	113.4
493	Q	71.4	Confident	85.2	Confident	143 Å²	143	47.2 Å²	47.2	67%	0.668	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	8	-172.7	-61.8	-171.5	3.2	0	0	114.2	R451	R451-Q493 WeakPolarHBondContact CD-O 3.08Å; R451-Q493 WeakPolarHBondContact CG-O 3.44Å; R451-Q493 PolarHBondContact NE-O 3.27Å
494	S	75.4	Confident	85.3	Confident	64 Å²	64	50.6 Å²	50.6	45%	0.448	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	14.6	-170.6	62.4	0	0	0	0	114.7	K496	S494-K496 VanDerWaalsContact C-N 3.34Å; S494-K496 WeakPolarHBondContact OG-CD 3.11Å; S494-K496 WeakPolarHBondContact OG-CE 3.2Å; S494-K496 WeakPolarHBondContact OG-CG 3.25Å
495	G	78.5	Confident	85.3	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	8.8	-176.4	0	0	0	0	0	114.9	F449 W455	F449-G495 WeakPolarHBondContact O-CA 3.5Å; W455-G495 WeakPolarHBondContact CH2-O 3.38Å
496	K	88.7	Confident	85.1	Confident	39 Å²	39	48.9 Å²	48.9	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	152.3	177.8	-61.3	168.7	-173	-167.1	0	110.6	E435 I444 V445 N446 W455 F491 S494	E435-K496 IonicContact OE1-NZ 3.79Å; E435-K496 PolarHBondContact OE1-NZ 2.85Å; E435-K496 WeakPolarHBondContact OE2-CD 3.18Å; E435-K496 WeakPolarHBondContact OE2-CE 3.48Å; E435-K496 IonicContact OE2-NZ 2.97Å; E435-K496 PolarHBondContact OE2-NZ 3.2Å; I444-K496 HydrophobicContact CG2-CB 4.2Å; I444-K496 HydrophobicContact CG2-CD 4.46Å; V445-K496 VanDerWaalsContact O-CA 3.29Å; V445-K496 WeakPolarHBondContact O-CA 3.36Å; N446-K496 HydrophobicContact CB-CG 4.15Å; W455-K496 VanDerWaalsContact CH2-O 3.25Å; W455-K496 WeakPolarHBondContact CH2-O 3.41Å; F491-K496 HydrophobicContact CB-CB 4.11Å; F491-K496 HydrophobicContact CD1-CB 4.26Å; F491-K496 HydrophobicContact CD1-CD 4.25Å; F491-K496 PolarHBondContact N-O 2.89Å; F491-K496 WeakPolarHBondContact O-CB 3.33Å; S494-K496 VanDerWaalsContact C-N 3.34Å; S494-K496 WeakPolarHBondContact OG-CD 3.11Å; S494-K496 WeakPolarHBondContact OG-CE 3.2Å; S494-K496 WeakPolarHBondContact OG-CG 3.25Å
497	C	89.3	Confident	84.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.1	177.4	68.3	0	0	0	0	112.7	I444 V445 F449 W455 I487 S489	I444-C497 WeakPolarHBondContact CA-O 3.28Å; V445-C497 PolarHBondContact N-O 2.8Å; V445-C497 PolarHBondContact O-N 2.86Å; F449-C497 HydrophobicContact CD2-CB 4.32Å; F449-C497 HydrophobicContact CE2-CB 4.36Å; W455-C497 HydrophobicContact CH2-CB 3.77Å; W455-C497 HydrophobicContact CZ3-CB 3.47Å; W455-C497 VanDerWaalsContact CZ3-CB 3.47Å; I487-C497 HydrophobicContact CG2-CB 4.45Å; S489-C497 CarbonylContact O-C 3.58Å; S489-C497 WeakPolarHBondContact O-CA 3.24Å
498	R	90.9	Very high	84.2	Confident	78 Å²	78	57.2 Å²	57.2	29%	0.294	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.7	167.4	-64.2	-168.8	-177.4	89.2	-4.4	109.3	C443 I444 E488 S489 S490 F491	C443-R498 WeakPolarHBondContact O-CA 3.38Å; I444-R498 HydrophobicContact CD1-CG 4.36Å; E488-R498 HydrophobicContact CB-CB 4.24Å; E488-R498 PolarHBondContact N-O 2.66Å; S489-R498 PolarHBondContact O-N 3.19Å; S489-R498 WeakPolarHBondContact OG-CD 2.91Å; S489-R498 PolarHBondContact OG-NH1 3.1Å; S490-R498 PolarHBondContact O-NH1 2.8Å; F491-R498 HydrophobicContact CB-CG 4.3Å; F491-R498 HydrophobicContact CD2-CG 4.37Å
499	L	90.6	Very high	83.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.4	173.6	-171.9	77.2	0	0	0	108.4	M442 C443 V445 A463 L465 Y486 I487 L501 V529	M442-L499 WeakPolarHBondContact CA-O 3.44Å; C443-L499 PolarHBondContact N-O 3.2Å; C443-L499 PolarHBondContact O-N 2.89Å; V445-L499 HydrophobicContact CG2-CB 3.91Å; V445-L499 HydrophobicContact CG2-CD2 4.27Å; A463-L499 HydrophobicContact CB-CD1 3.58Å; A463-L499 HydrophobicContact CB-CD2 4.28Å; L465-L499 HydrophobicContact CD1-CD2 4.05Å; L465-L499 HydrophobicContact CG-CD2 4.38Å; Y486-L499 VanDerWaalsContact C-CD1 3.5Å; Y486-L499 WeakPolarHBondContact O-CA 3.3Å; Y486-L499 WeakPolarHBondContact O-CD1 3.46Å; I487-L499 HydrophobicContact CG1-CD1 3.91Å; L499-L501 HydrophobicContact CD2-CD2 3.78Å; L499-L501 HydrophobicContact CG-CD2 3.98Å; L499-V529 HydrophobicContact CD2-CG1 3.96Å
500	A	91.2	Very high	83.1	Confident	29 Å²	29	53.6 Å²	53.6	24%	0.24	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.5	176.4	0	0	0	0	0	109.5	R441 G485 Y486 E488	R441-A500 CarbonylContact O-C 3.59Å; R441-A500 WeakPolarHBondContact O-CA 3.44Å; G485-A500 CarbonylContact C-O 3.43Å; G485-A500 VanDerWaalsContact C-O 3.26Å; G485-A500 WeakPolarHBondContact CA-O 3.47Å; Y486-A500 PolarHBondContact N-O 2.84Å; Y486-A500 PolarHBondContact O-N 2.78Å; E488-A500 HydrophobicContact CB-CB 4.44Å
501	L	88.8	Confident	82.4	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.058	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	144.8	-170.5	-50.1	-179.5	0	0	0	111.4	R441 L465 I483 L499 N503 L505	R441-L501 PolarHBondContact O-N 2.94Å; L465-L501 HydrophobicContact CD1-CD1 4.02Å; L465-L501 HydrophobicContact CD1-CD2 3.35Å; L465-L501 HydrophobicContact CD1-CG 4.34Å; I483-L501 HydrophobicContact CG2-CB 4.39Å; I483-L501 HydrophobicContact CG2-CD1 4.35Å; L499-L501 HydrophobicContact CD2-CD2 3.78Å; L499-L501 HydrophobicContact CG-CD2 3.98Å; L501-N503 WeakPolarHBondContact CB-O 3.45Å; L501-L505 HydrophobicContact CD1-CD1 3.61Å; L501-L505 HydrophobicContact CD1-CD2 3.9Å; L501-L505 HydrophobicContact CD1-CG 3.47Å; L501-L505 VanDerWaalsContact CD1-CG 3.47Å
502	E	86.5	Confident	81.9	Confident	58 Å²	58	55.6 Å²	55.6	27%	0.271	31%	0.309	S	S	.	.	S	Bend	trans	-70.3	-38.3	175.8	-71.3	176.6	-174.6	0	0	111.5	R462 Y484 Y486	R462-E502 IonicContact CZ-OE1 3.77Å; R462-E502 VanDerWaalsContact CZ-OE1 3.26Å; R462-E502 IonicContact CZ-OE2 2.73Å; R462-E502 IonicContact NE-OE1 3.93Å; R462-E502 PolarHBondContact NE-OE1 2.9Å; R462-E502 IonicContact NE-OE2 3.99Å; R462-E502 VanDerWaalsContact NH2-CD 3.31Å; R462-E502 IonicContact NH2-OE1 2.78Å; R462-E502 PolarHBondContact NH2-OE1 3.19Å; R462-E502 IonicContact NH2-OE2 2.63Å; R462-E502 PolarHBondContact NH2-OE2 2.71Å; Y484-E502 WeakPolarHBondContact CB-OE2 3.47Å; Y484-E502 PolarHBondContact O-N 3Å; Y486-E502 HydrophobicContact CD2-CG 4.37Å; Y486-E502 HydrophobicContact CE2-CG 3.6Å; Y486-E502 WeakPolarHBondContact CE2-OE1 3.49Å; Y486-E502 PolarHBondContact OH-OE1 3.03Å
503	N	83.8	Confident	81.4	Confident	103 Å²	103	54.6 Å²	54.6	55%	0.551	29%	0.288	S	S	*	.	S	Bend	trans	-119.6	152.4	179.9	-63.6	-35.4	0	0	0	110.1	L501	L501-N503 WeakPolarHBondContact CB-O 3.45Å
504	D	84.1	Confident	81.1	Confident	78 Å²	78	51.9 Å²	51.9	42%	0.417	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-63.8	139.7	174.9	-63.1	-51.7	0	0	0	110.3	P440 R441	P440-D504 HydrophobicContact CB-CB 4.15Å; P440-D504 WeakPolarHBondContact CB-OD1 3.45Å; R441-D504 WeakPolarHBondContact CD-OD1 3.46Å; R441-D504 WeakPolarHBondContact CG-OD1 3.41Å; R441-D504 IonicContact CZ-OD1 3.8Å; R441-D504 IonicContact CZ-OD2 3.77Å; R441-D504 IonicContact NE-OD1 2.84Å; R441-D504 PolarHBondContact NE-OD1 2.96Å; R441-D504 IonicContact NE-OD2 3.51Å; R441-D504 IonicContact NH2-OD1 3.87Å; R441-D504 IonicContact NH2-OD2 3.1Å; R441-D504 PolarHBondContact NH2-OD2 3.18Å; R441-D504 VanDerWaalsContact NH2-OD2 3.1Å
505	L	82.8	Confident	80.1	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-62.6	142.9	171.7	-76.2	160.5	0	0	0	110	I437 P440 I483 L501 D507 L510	I437-L505 HydrophobicContact CD1-CD1 3.62Å; I437-L505 HydrophobicContact CG1-CD1 4.05Å; I437-L505 HydrophobicContact CG2-CD1 4.19Å; P440-L505 PolarHBondContact O-N 3.46Å; I483-L505 HydrophobicContact CD1-CD2 3.83Å; L501-L505 HydrophobicContact CD1-CD1 3.61Å; L501-L505 HydrophobicContact CD1-CD2 3.9Å; L501-L505 HydrophobicContact CD1-CG 3.47Å; L501-L505 VanDerWaalsContact CD1-CG 3.47Å; L505-D507 PolarHBondContact O-N 3.29Å; L505-L510 HydrophobicContact CB-CD1 4.49Å; L505-L510 HydrophobicContact CB-CD2 4.35Å; L505-L510 HydrophobicContact CB-CG 4.12Å; L505-L510 WeakPolarHBondContact O-CD1 3.22Å
506	P	82.8	Confident	78.4	Confident	32 Å²	32	60.8 Å²	60.8	21%	0.208	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-50.7	139.1	172.4	-26.2	31.6	0	0	0	111.8	I467 I483 E508 I509 L510	I467-P506 HydrophobicContact CD1-CG 4.45Å; I483-P506 HydrophobicContact CD1-CG 4.31Å; P506-E508 PolarHBondContact O-N 2.89Å; P506-E508 VanDerWaalsContact O-N 3.13Å; P506-I509 HydrophobicContact CB-CD1 4.47Å; P506-I509 HydrophobicContact CB-CG1 4.47Å; P506-I509 HydrophobicContact CG-CD1 4.19Å; P506-I509 PolarHBondContact O-N 2.89Å; P506-L510 PolarHBondContact O-N 2.96Å; P506-L510 VanDerWaalsContact O-N 3.15Å
507	D	78.1	Confident	75.9	Confident	136 Å²	136	63.2 Å²	63.2	73%	0.727	35%	0.354	S	S	*	.	H	α-helix	trans	-56.6	-32.2	-177	-71.2	-37.9	0	0	0	112.7	L505 I509 L510 A511	L505-D507 PolarHBondContact O-N 3.29Å; D507-I509 VanDerWaalsContact C-N 3.33Å; D507-I509 PolarHBondContact O-N 2.75Å; D507-L510 PolarHBondContact O-N 3.36Å; D507-A511 WeakPolarHBondContact O-CB 3.47Å; D507-A511 PolarHBondContact O-N 2.86Å
508	E	77.6	Confident	73.2	Confident	139 Å²	139	66.9 Å²	66.9	65%	0.65	39%	0.391	S	S	*	.	H	α-helix	trans	-58.1	-43.3	174.9	-68.2	166.8	-166.5	0	0	112.4	P506 Q512	P506-E508 PolarHBondContact O-N 2.89Å; P506-E508 VanDerWaalsContact O-N 3.13Å; E508-Q512 WeakPolarHBondContact O-CG 3.24Å; E508-Q512 PolarHBondContact O-N 3.03Å
509	I	76.8	Confident	70.3	Confident	10 Å²	10	74.5 Å²	74.5	5%	0.051	42%	0.42	C	S	.	.	H	α-helix	trans	-73.8	-38.4	179.2	-60.8	178.9	0	0	0	109.8	I437 I467 P506 D507 A511 Q512 Y513 I527	I437-I509 HydrophobicContact CD1-CG2 3.78Å; I467-I509 HydrophobicContact CB-CD1 4.36Å; I467-I509 HydrophobicContact CD1-CD1 3.27Å; I467-I509 HydrophobicContact CG1-CD1 3.64Å; I467-I509 HydrophobicContact CG2-CD1 3.79Å; P506-I509 HydrophobicContact CB-CD1 4.47Å; P506-I509 HydrophobicContact CB-CG1 4.47Å; P506-I509 HydrophobicContact CG-CD1 4.19Å; P506-I509 PolarHBondContact O-N 2.89Å; D507-I509 VanDerWaalsContact C-N 3.33Å; D507-I509 PolarHBondContact O-N 2.75Å; I509-A511 VanDerWaalsContact C-N 3.34Å; I509-A511 PolarHBondContact O-N 2.81Å; I509-Q512 PolarHBondContact O-N 2.8Å; I509-Y513 HydrophobicContact CG2-CD2 4.04Å; I509-Y513 HydrophobicContact CG2-CE2 4.19Å; I509-Y513 WeakPolarHBondContact O-CD2 3.47Å; I509-Y513 PolarHBondContact O-N 3.45Å; I509-I527 HydrophobicContact CD1-CD1 4.01Å; I509-I527 HydrophobicContact CG1-CD1 4.47Å; I509-I527 HydrophobicContact CG2-CD1 3.67Å
510	L	77.2	Confident	67.5	Low	31 Å²	31	83.3 Å²	83.3	16%	0.162	46%	0.458	C	S	.	.	H	α-helix	trans	-61.3	-42.8	175.8	-72.6	167	0	0	0	111.7	I437 P440 L505 P506 D507 Q512 Y513 S514	I437-L510 HydrophobicContact CD1-CD2 4.37Å; I437-L510 HydrophobicContact CG2-CD2 3.79Å; P440-L510 HydrophobicContact CB-CD1 4.03Å; P440-L510 HydrophobicContact CB-CD2 4.42Å; P440-L510 HydrophobicContact CG-CD1 4.01Å; P440-L510 HydrophobicContact CG-CD2 4.3Å; L505-L510 HydrophobicContact CB-CD1 4.49Å; L505-L510 HydrophobicContact CB-CD2 4.35Å; L505-L510 HydrophobicContact CB-CG 4.12Å; L505-L510 WeakPolarHBondContact O-CD1 3.22Å; P506-L510 PolarHBondContact O-N 2.96Å; P506-L510 VanDerWaalsContact O-N 3.15Å; D507-L510 PolarHBondContact O-N 3.36Å; L510-Q512 VanDerWaalsContact C-N 3.33Å; L510-Q512 PolarHBondContact O-N 2.86Å; L510-Y513 PolarHBondContact O-N 3.07Å; L510-S514 WeakPolarHBondContact O-CB 3.35Å; L510-S514 PolarHBondContact O-N 3.19Å; L510-S514 PolarHBondContact O-OG 3.12Å
511	A	72.9	Confident	64.7	Low	63 Å²	63	91.6 Å²	91.6	52%	0.521	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-39.7	177.2	0	0	0	0	0	112.2	D507 I509 S514	D507-A511 WeakPolarHBondContact O-CB 3.47Å; D507-A511 PolarHBondContact O-N 2.86Å; I509-A511 VanDerWaalsContact C-N 3.34Å; I509-A511 PolarHBondContact O-N 2.81Å; A511-S514 WeakPolarHBondContact CA-OG 3.43Å; A511-S514 PolarHBondContact O-OG 3.32Å
512	Q	72.3	Confident	62.4	Low	91 Å²	91	97.7 Å²	97.7	43%	0.425	52%	0.523	S	S	.	.	H	α-helix	trans	-67	-40.5	180	-72.4	176	6.3	0	0	112.7	E508 I509 L510 S515	E508-Q512 WeakPolarHBondContact O-CG 3.24Å; E508-Q512 PolarHBondContact O-N 3.03Å; I509-Q512 PolarHBondContact O-N 2.8Å; L510-Q512 VanDerWaalsContact C-N 3.33Å; L510-Q512 PolarHBondContact O-N 2.86Å; Q512-S515 PolarHBondContact O-OG 3.42Å; Q512-S515 VanDerWaalsContact O-OG 3.05Å
513	Y	70.6	Confident	60.4	Low	37 Å²	37	99.8 Å²	99.8	15%	0.145	54%	0.544	C	S	.	.	H	α-helix	trans	-90.1	-11.4	-177.2	-78.9	-96.7	0	0	0	114.8	L434 I437 I509 L510 P525 I527	L434-Y513 HydrophobicContact CD2-CE1 4.3Å; L434-Y513 HydrophobicContact CD2-CE2 4.1Å; L434-Y513 HydrophobicContact CG-CE1 4.46Å; I437-Y513 HydrophobicContact CD1-CD2 3.84Å; I437-Y513 HydrophobicContact CD1-CG 3.8Å; I437-Y513 HydrophobicContact CG1-CD1 4.27Å; I437-Y513 HydrophobicContact CG1-CD2 4.4Å; I437-Y513 HydrophobicContact CG1-CG 3.95Å; I509-Y513 HydrophobicContact CG2-CD2 4.04Å; I509-Y513 HydrophobicContact CG2-CE2 4.19Å; I509-Y513 WeakPolarHBondContact O-CD2 3.47Å; I509-Y513 PolarHBondContact O-N 3.45Å; L510-Y513 PolarHBondContact O-N 3.07Å; Y513-P525 HydrophobicContact CE2-CG 4.24Å; Y513-I527 HydrophobicContact CE2-CD1 4.18Å
514	S	63.7	Low	58.9	Low	85 Å²	85	101.5 Å²	101.5	59%	0.594	55%	0.549	S	S	*	.	H	α-helix	trans	-84.8	-8.7	179	51.3	0	0	0	0	114	L510 A511 K516	L510-S514 WeakPolarHBondContact O-CB 3.35Å; L510-S514 PolarHBondContact O-N 3.19Å; L510-S514 PolarHBondContact O-OG 3.12Å; A511-S514 WeakPolarHBondContact CA-OG 3.43Å; A511-S514 PolarHBondContact O-OG 3.32Å; S514-K516 PolarHBondContact O-N 2.93Å
515	S	55.8	Low	57.5	Low	92 Å²	92	99.4 Å²	99.4	64%	0.643	54%	0.539	S	S	*	.			trans	-71.7	66.2	178.5	59.3	0	0	0	0	113.2	Q512 A517	Q512-S515 PolarHBondContact O-OG 3.42Å; Q512-S515 VanDerWaalsContact O-OG 3.05Å; S515-A517 VanDerWaalsContact C-N 3.33Å; S515-A517 PolarHBondContact O-N 3.11Å; S515-A517 VanDerWaalsContact O-N 3.11Å
516	K	42	Very low	56.5	Low	161 Å²	161	105 Å²	105	70%	0.7	57%	0.569	S	S	*	*			trans	-80.5	75.8	167.1	-83.6	-172.6	176.8	-178.9	0	111.1	R436 S514	R436-K516 VanDerWaalsContact NH2-NZ 3.14Å; S514-K516 PolarHBondContact O-N 2.93Å
517	A	35.5	Very low	56.1	Low	91 Å²	91	103.6 Å²	103.6	75%	0.752	56%	0.56	S	S	*	*	S	Bend	trans	-171.4	129	149.8	0	0	0	0	0	107.7	S515 R519	S515-A517 VanDerWaalsContact C-N 3.33Å; S515-A517 PolarHBondContact O-N 3.11Å; S515-A517 VanDerWaalsContact O-N 3.11Å; A517-R519 PolarHBondContact O-N 2.77Å
518	G	33.4	Very low	56.3	Low	77 Å²	77	99 Å²	99	79%	0.794	54%	0.535	S	S	*	.			trans	-55.9	132.1	-159	0	0	0	0	0	115.5
519	R	30.7	Very low	56.5	Low	237 Å²	237	92.4 Å²	92.4	89%	0.894	50%	0.504	S	S	*	.			trans	-176.9	125.2	135.8	-102.8	164.6	-176.9	-176.2	1.9	110.1	A517	A517-R519 PolarHBondContact O-N 2.77Å
520	K	30.9	Very low	56.5	Low	186 Å²	186	92.4 Å²	92.4	81%	0.809	50%	0.503	S	S	*	.			trans	49.9	109.5	150.3	-66.9	-175	172.2	-177.1	0	118.9	I522	K520-I522 PolarHBondContact O-N 3.05Å
521	Q	33.2	Very low	56.3	Low	203 Å²	203	90.9 Å²	90.9	95%	0.949	50%	0.496	S	S	*	.			trans	27.6	63.2	131	-68.8	-179.1	-14.9	0	0	116.3
522	I	39.1	Very low	55.7	Low	139 Å²	139	90.5 Å²	90.5	71%	0.713	48%	0.483	S	S	*	.			trans	-89.4	123.2	148.3	-63.4	169.5	0	0	0	103.6	K520 Q524	K520-I522 PolarHBondContact O-N 3.05Å; I522-Q524 PolarHBondContact O-N 3.01Å
523	S	45.2	Very low	55	Low	101 Å²	101	86.6 Å²	86.6	71%	0.706	47%	0.465	S	S	*	.			trans	-49	107.2	-179.6	51.1	0	0	0	0	108.8
524	Q	51.5	Low	53.8	Low	140 Å²	140	90.5 Å²	90.5	65%	0.654	48%	0.482	S	S	*	.			trans	-54.6	130.2	173.5	-76.4	179.4	-36.3	0	0	106.9	I522 D526	I522-Q524 PolarHBondContact O-N 3.01Å; Q524-D526 PolarHBondContact O-N 3.21Å
525	P	54.5	Low	52.8	Low	33 Å²	33	89.3 Å²	89.3	21%	0.214	47%	0.467	C	S	.	.			trans	-58.4	128.7	171.6	26.1	-34.1	0	0	0	107.1	Y513 I527	Y513-P525 HydrophobicContact CE2-CG 4.24Å; P525-I527 HydrophobicContact CB-CD1 4.38Å; P525-I527 HydrophobicContact CB-CG1 4.08Å; P525-I527 HydrophobicContact CG-CD1 3.9Å; P525-I527 HydrophobicContact CG-CG1 4.1Å; P525-I527 PolarHBondContact O-N 3.42Å
526	D	62.7	Low	52.1	Low	120 Å²	120	88.3 Å²	88.3	64%	0.642	45%	0.454	S	S	*	.			trans	-72	78.1	178.4	-122	-15.4	0	0	0	107.9	Q433 Q524 E528	Q433-D526 PolarHBondContact NE2-OD1 3.22Å; Q524-D526 PolarHBondContact O-N 3.21Å; D526-E528 PolarHBondContact O-N 3.29Å
527	I	75.4	Confident	52.2	Low	3 Å²	3	83 Å²	83	2%	0.015	43%	0.433	C	S	.	.			trans	-82.7	102.5	179.5	-60.8	170.4	0	0	0	107.2	L434 L465 I467 I509 Y513 P525	L434-I527 HydrophobicContact CB-CB 3.91Å; L434-I527 HydrophobicContact CB-CG2 4.06Å; L434-I527 HydrophobicContact CD2-CB 4.19Å; L434-I527 HydrophobicContact CD2-CD1 3.68Å; L434-I527 HydrophobicContact CD2-CG2 4.17Å; L434-I527 PolarHBondContact N-O 3.22Å; L434-I527 VanDerWaalsContact N-O 3.08Å; L465-I527 HydrophobicContact CB-CG2 3.95Å; L465-I527 HydrophobicContact CD2-CG2 3.59Å; L465-I527 HydrophobicContact CG-CG2 4.36Å; I467-I527 HydrophobicContact CG1-CD1 4.46Å; I467-I527 HydrophobicContact CG1-CG1 4.35Å; I467-I527 HydrophobicContact CG1-CG2 4.3Å; I509-I527 HydrophobicContact CD1-CD1 4.01Å; I509-I527 HydrophobicContact CG1-CD1 4.47Å; I509-I527 HydrophobicContact CG2-CD1 3.67Å; Y513-I527 HydrophobicContact CE2-CD1 4.18Å; P525-I527 HydrophobicContact CB-CD1 4.38Å; P525-I527 HydrophobicContact CB-CG1 4.08Å; P525-I527 HydrophobicContact CG-CD1 3.9Å; P525-I527 HydrophobicContact CG-CG1 4.1Å; P525-I527 PolarHBondContact O-N 3.42Å
528	E	81.8	Confident	52.6	Low	41 Å²	41	84.2 Å²	84.2	19%	0.192	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	133	177.9	-164.8	174.9	-166.9	0	0	109.2	R431 L465 I466 D526 I530	R431-E528 WeakPolarHBondContact CD-OE1 3.43Å; R431-E528 VanDerWaalsContact CG-OE1 3.3Å; R431-E528 WeakPolarHBondContact CG-OE1 3.01Å; R431-E528 IonicContact CZ-OE1 2.73Å; R431-E528 IonicContact NE-OE1 3.8Å; R431-E528 PolarHBondContact NE-OE1 3.19Å; R431-E528 IonicContact NH1-OE1 2.73Å; R431-E528 PolarHBondContact NH1-OE1 2.62Å; R431-E528 IonicContact NH1-OE2 2.69Å; L465-E528 WeakPolarHBondContact CA-O 2.88Å; I466-E528 PolarHBondContact N-O 3.27Å; I466-E528 PolarHBondContact O-N 3.44Å; D526-E528 PolarHBondContact O-N 3.29Å; E528-I530 HydrophobicContact CG-CG1 4.44Å
529	V	81.3	Confident	53.2	Low	0 Å²	0	82.3 Å²	82.3	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.9	175.4	-176.6	0	0	0	0	108.7	R431 G432 V445 L448 A463 L465 L499	R431-V529 CarbonylContact C-O 3.56Å; R431-V529 WeakPolarHBondContact CA-O 3.46Å; G432-V529 PolarHBondContact N-O 3.22Å; G432-V529 PolarHBondContact O-N 2.76Å; V445-V529 HydrophobicContact CB-CG2 4.43Å; V445-V529 HydrophobicContact CG1-CB 3.62Å; V445-V529 HydrophobicContact CG1-CG1 3.92Å; V445-V529 HydrophobicContact CG1-CG2 3.67Å; V445-V529 HydrophobicContact CG2-CB 4.39Å; V445-V529 HydrophobicContact CG2-CG1 4.17Å; V445-V529 HydrophobicContact CG2-CG2 3.86Å; L448-V529 HydrophobicContact CD1-CG1 4.04Å; A463-V529 HydrophobicContact CB-CG1 4.29Å; L465-V529 HydrophobicContact CD2-CG2 3.82Å; L465-V529 HydrophobicContact CG-CG2 4.04Å; L499-V529 HydrophobicContact CD2-CG1 3.96Å
530	I	76.5	Confident	54.1	Low	9 Å²	9	77 Å²	77	5%	0.046	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.8	-178.9	-56	-167.8	0	0	0	109.9	T429 R430 R431 A463 Y464 I466 E528 E532	T429-I530 HydrophobicContact CG2-CG2 3.39Å; R430-I530 WeakPolarHBondContact O-CA 3.29Å; R431-I530 HydrophobicContact CG-CG1 4.37Å; A463-I530 CarbonylContact C-O 3.55Å; A463-I530 VanDerWaalsContact CA-O 3.31Å; A463-I530 WeakPolarHBondContact CA-O 3.38Å; A463-I530 WeakPolarHBondContact CB-O 2.85Å; Y464-I530 HydrophobicContact CD2-CB 4.31Å; Y464-I530 HydrophobicContact CE1-CB 4.02Å; Y464-I530 HydrophobicContact CE1-CG2 3.98Å; Y464-I530 HydrophobicContact CE2-CB 3.8Å; Y464-I530 HydrophobicContact CE2-CD1 3.99Å; Y464-I530 HydrophobicContact CE2-CG1 4.16Å; Y464-I530 HydrophobicContact CE2-CG2 4.36Å; Y464-I530 PolarHBondContact N-O 3.15Å; Y464-I530 PolarHBondContact O-N 3.26Å; Y464-I530 WeakPolarHBondContact OH-CG2 3.42Å; I466-I530 HydrophobicContact CD1-CD1 3.49Å; I466-I530 VanDerWaalsContact CD1-CD1 3.49Å; I466-I530 HydrophobicContact CD1-CG1 4.23Å; I466-I530 HydrophobicContact CG1-CD1 4.37Å; E528-I530 HydrophobicContact CG-CG1 4.44Å; I530-E532 HydrophobicContact CG2-CG 4.18Å
531	L	72.9	Confident	55.2	Low	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.4	169.7	175.7	70	0	0	0	109.5	T429 R430 L448 F449 F458 L461 R462 A463 I487 F533	T429-L531 WeakPolarHBondContact CA-O 3.41Å; R430-L531 HydrophobicContact CB-CB 4.46Å; R430-L531 PolarHBondContact N-O 3.32Å; R430-L531 PolarHBondContact O-N 2.9Å; L448-L531 HydrophobicContact CD2-CB 3.99Å; F449-L531 HydrophobicContact CE1-CD2 3.96Å; F449-L531 HydrophobicContact CE2-CD2 4.32Å; F449-L531 HydrophobicContact CZ-CD2 3.41Å; F449-L531 VanDerWaalsContact CZ-CD2 3.41Å; F458-L531 HydrophobicContact CD1-CD2 4.43Å; L461-L531 HydrophobicContact CB-CD1 3.91Å; R462-L531 VanDerWaalsContact O-CD1 3.29Å; R462-L531 WeakPolarHBondContact O-CD1 3.47Å; A463-L531 HydrophobicContact CB-CB 4.27Å; A463-L531 HydrophobicContact CB-CD1 4.1Å; I487-L531 HydrophobicContact CD1-CD1 3.6Å; I487-L531 HydrophobicContact CD1-CD2 3.56Å; I487-L531 HydrophobicContact CD1-CG 4.1Å; I487-L531 HydrophobicContact CG1-CD1 4.44Å; L531-F533 HydrophobicContact CD2-CD1 3.85Å; L531-F533 HydrophobicContact CD2-CE1 4.12Å; L531-F533 HydrophobicContact CG-CD1 3.88Å
532	E	61.6	Low	56.1	Low	55 Å²	55	71.8 Å²	71.8	26%	0.257	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.4	173.7	-74.5	175.8	-156	0	0	109.3	T429 Y464 I530 Q546	T429-E532 HydrophobicContact CG2-CG 3.35Å; Y464-E532 PolarHBondContact OH-OE1 3.42Å; I530-E532 HydrophobicContact CG2-CG 4.18Å; E532-Q546 VanDerWaalsContact O-CD 3.23Å; E532-Q546 VanDerWaalsContact O-CG 3.31Å; E532-Q546 WeakPolarHBondContact O-CG 3.39Å; E532-Q546 PolarHBondContact O-NE2 3.47Å
533	F	56.4	Low	56.3	Low	8 Å²	8	72.3 Å²	72.3	4%	0.035	35%	0.354	C	S	.	.			trans	-151.6	153.8	-178.2	66.1	-87.3	0	0	0	112.6	K367 S427 R430 F458 L461 L531 V544	K367-F533 HydrophobicContact CD-CD2 4.47Å; K367-F533 HydrophobicContact CD-CE2 4.03Å; K367-F533 PolarHBondContact NZ-O 2.96Å; S427-F533 PolarHBondContact OG-O 3.36Å; R430-F533 HydrophobicContact CG-CE1 4.22Å; F458-F533 HydrophobicContact CD1-CE1 4.46Å; F458-F533 HydrophobicContact CD1-CE2 4.49Å; F458-F533 HydrophobicContact CD1-CZ 4.43Å; F458-F533 HydrophobicContact CE1-CD1 4.39Å; F458-F533 HydrophobicContact CE1-CD2 4.03Å; F458-F533 AromaticContact CE1-CE1 3.95Å; F458-F533 HydrophobicContact CE1-CE1 3.95Å; F458-F533 AromaticContact CE1-CE2 3.58Å; F458-F533 HydrophobicContact CE1-CE2 3.58Å; F458-F533 HydrophobicContact CE1-CG 4.42Å; F458-F533 AromaticContact CE1-CZ 3.52Å; F458-F533 HydrophobicContact CE1-CZ 3.52Å; F458-F533 HydrophobicContact CZ-CE2 4.38Å; F458-F533 HydrophobicContact CZ-CZ 4.29Å; L461-F533 HydrophobicContact CD1-CB 3.77Å; L461-F533 HydrophobicContact CD1-CG 4.19Å; L531-F533 HydrophobicContact CD2-CD1 3.85Å; L531-F533 HydrophobicContact CD2-CE1 4.12Å; L531-F533 HydrophobicContact CG-CD1 3.88Å; F533-V544 HydrophobicContact CB-CG1 3.66Å; F533-V544 HydrophobicContact CD2-CG1 3.48Å; F533-V544 VanDerWaalsContact CD2-CG1 3.48Å; F533-V544 HydrophobicContact CD2-CG2 4.31Å; F533-V544 HydrophobicContact CG-CG1 3.94Å
534	K	44.8	Very low	56.4	Low	119 Å²	119	68.4 Å²	68.4	52%	0.517	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	107.5	179.1	-62.5	176.3	-172	155.6	0	110.8	I545 Q546	K534-I545 CarbonylContact C-O 3.56Å; K534-I545 VanDerWaalsContact C-O 3.27Å; K534-I545 VanDerWaalsContact CA-O 3.26Å; K534-I545 WeakPolarHBondContact CA-O 3.2Å; K534-I545 WeakPolarHBondContact CB-O 3.43Å; K534-I545 PolarHBondContact N-O 3.13Å; K534-I545 CarbonylContact O-C 3.49Å; K534-I545 WeakPolarHBondContact O-CA 3.48Å; K534-I545 PolarHBondContact O-N 2.88Å; K534-Q546 WeakPolarHBondContact CD-OXT 3.16Å; K534-Q546 WeakPolarHBondContact CE-OXT 3.39Å; K534-Q546 PolarHBondContact NZ-OXT 2.83Å
535	K	44.7	Very low	55.9	Low	61 Å²	61	65.9 Å²	65.9	27%	0.265	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.3	174.6	-167.7	171.3	177	-169.4	0	110	K367 I537 V544	K367-K535 HydrophobicContact CB-CB 4.23Å; K367-K535 HydrophobicContact CB-CD 4.43Å; K367-K535 HydrophobicContact CD-CB 4.24Å; K367-K535 WeakPolarHBondContact O-CD 3.37Å; K367-K535 PolarHBondContact O-NZ 3Å; K535-I537 PolarHBondContact O-N 2.99Å; K535-V544 HydrophobicContact CB-CG2 3.82Å; K535-V544 HydrophobicContact CD-CG2 4.14Å; K535-V544 HydrophobicContact CG-CG2 3.66Å
536	N	40.4	Very low	55.8	Low	71 Å²	71	69 Å²	69	38%	0.38	33%	0.327	S	S	.	.			trans	-63.1	133.2	173.1	-89.6	-16.1	0	0	0	110.6	F538 D539 I545	N536-F538 VanDerWaalsContact C-N 3.3Å; N536-D539 HydrophobicContact CB-CB 3.9Å; N536-I545 VanDerWaalsContact ND2-CD1 3.27Å; N536-I545 WeakPolarHBondContact ND2-CD1 3.37Å; N536-I545 WeakPolarHBondContact OD1-CD1 3.49Å
537	I	44.7	Very low	55.4	Low	49 Å²	49	66.4 Å²	66.4	25%	0.251	31%	0.312	S	S	.	.	S	Bend	trans	-77.7	-20.2	-179.4	-58.8	176.6	0	0	0	110.9	I314 F350 L388 K535	I314-I537 HydrophobicContact CD1-CD1 3.74Å; I314-I537 HydrophobicContact CG1-CD1 4.22Å; F350-I537 HydrophobicContact CE1-CD1 3.92Å; F350-I537 HydrophobicContact CZ-CD1 3.82Å; L388-I537 HydrophobicContact CB-CD1 4.32Å; L388-I537 HydrophobicContact CD1-CD1 4.29Å; L388-I537 HydrophobicContact CD2-CD1 4.32Å; K535-I537 PolarHBondContact O-N 2.99Å
538	F	42.9	Very low	54.4	Low	117 Å²	117	69.7 Å²	69.7	51%	0.513	33%	0.327	S	S	.	.	S	Bend	trans	-136.2	35.9	-173	-60.2	-74	0	0	0	114.7	T348 Y373 N536	T348-F538 HydrophobicContact CG2-CE2 3.75Å; T348-F538 HydrophobicContact CG2-CZ 3.78Å; Y373-F538 HydrophobicContact CD2-CE1 4.49Å; Y373-F538 HydrophobicContact CD2-CZ 4.32Å; N536-F538 VanDerWaalsContact C-N 3.3Å
539	D	46	Very low	52.8	Low	36 Å²	36	71.3 Å²	71.3	19%	0.193	34%	0.335	C	S	.	.			trans	-99.3	113.6	170.2	-173.9	1.4	0	0	0	110.7	N536 Q541 R542 R543	N536-D539 HydrophobicContact CB-CB 3.9Å; D539-Q541 PolarHBondContact O-N 3.47Å; D539-Q541 WeakPolarHBondContact OD1-CB 3.42Å; D539-Q541 PolarHBondContact OD1-N 3.1Å; D539-R542 PolarHBondContact O-N 2.69Å; D539-R543 WeakPolarHBondContact OD2-CB 3.33Å; D539-R543 WeakPolarHBondContact OD2-CD 2.89Å; D539-R543 WeakPolarHBondContact OD2-CG 3.47Å; D539-R543 PolarHBondContact OD2-N 3.18Å; D539-R543 IonicContact OD2-NE 2.93Å
540	P	49.9	Very low	51.2	Low	126 Å²	126	75.5 Å²	75.5	82%	0.818	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.6	173.1	21.7	-30.6	0	0	0	112.9
541	Q	53.3	Low	49.6	Very low	126 Å²	126	79.7 Å²	79.7	59%	0.589	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	2.7	176.6	-54.3	-171.8	-2.1	0	0	114.2	D539 R543	D539-Q541 PolarHBondContact O-N 3.47Å; D539-Q541 WeakPolarHBondContact OD1-CB 3.42Å; D539-Q541 PolarHBondContact OD1-N 3.1Å; Q541-R543 VanDerWaalsContact C-N 3.26Å; Q541-R543 HydrophobicContact CB-CG 4.27Å; Q541-R543 PolarHBondContact O-N 2.84Å
542	R	52	Low	48	Very low	154 Å²	154	85 Å²	85	58%	0.581	40%	0.399	S	S	*	.			trans	59.3	24.8	174.8	-55.5	177.6	172.7	179.5	-1.8	115.3	D539	D539-R542 PolarHBondContact O-N 2.69Å
543	R	43.6	Very low	47.1	Very low	149 Å²	149	87.1 Å²	87.1	56%	0.562	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66.9	141.5	-179.1	-57.2	176.3	-164.9	-171	6.3	111.3	D539 Q541	D539-R543 WeakPolarHBondContact OD2-CB 3.33Å; D539-R543 WeakPolarHBondContact OD2-CD 2.89Å; D539-R543 WeakPolarHBondContact OD2-CG 3.47Å; D539-R543 PolarHBondContact OD2-N 3.18Å; D539-R543 IonicContact OD2-NE 2.93Å; Q541-R543 VanDerWaalsContact C-N 3.26Å; Q541-R543 HydrophobicContact CB-CG 4.27Å; Q541-R543 PolarHBondContact O-N 2.84Å
544	V	47.2	Very low	46.3	Very low	20 Å²	20	93.2 Å²	93.2	12%	0.121	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.3	170.5	171.2	0	0	0	0	108.6	I457 L461 F533 K535	I457-V544 HydrophobicContact CG2-CB 3.97Å; I457-V544 HydrophobicContact CG2-CG2 3.15Å; L461-V544 HydrophobicContact CD1-CB 4.17Å; L461-V544 HydrophobicContact CD1-CG1 3.52Å; L461-V544 HydrophobicContact CD2-CB 4.44Å; L461-V544 HydrophobicContact CD2-CG1 3.82Å; L461-V544 HydrophobicContact CG-CG1 4.29Å; F533-V544 HydrophobicContact CB-CG1 3.66Å; F533-V544 HydrophobicContact CD2-CG1 3.48Å; F533-V544 VanDerWaalsContact CD2-CG1 3.48Å; F533-V544 HydrophobicContact CD2-CG2 4.31Å; F533-V544 HydrophobicContact CG-CG1 3.94Å; K535-V544 HydrophobicContact CB-CG2 3.82Å; K535-V544 HydrophobicContact CD-CG2 4.14Å; K535-V544 HydrophobicContact CG-CG2 3.66Å
545	I	41.5	Very low	46.5	Very low	87 Å²	87	91.1 Å²	91.1	45%	0.446	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	163.1	172.9	-32.8	-178.5	0	0	0	108.1	K534 N536	K534-I545 CarbonylContact C-O 3.56Å; K534-I545 VanDerWaalsContact C-O 3.27Å; K534-I545 VanDerWaalsContact CA-O 3.26Å; K534-I545 WeakPolarHBondContact CA-O 3.2Å; K534-I545 WeakPolarHBondContact CB-O 3.43Å; K534-I545 PolarHBondContact N-O 3.13Å; K534-I545 CarbonylContact O-C 3.49Å; K534-I545 WeakPolarHBondContact O-CA 3.48Å; K534-I545 PolarHBondContact O-N 2.88Å; N536-I545 VanDerWaalsContact ND2-CD1 3.27Å; N536-I545 WeakPolarHBondContact ND2-CD1 3.37Å; N536-I545 WeakPolarHBondContact OD1-CD1 3.49Å
546	Q	51.5	Low	46.6	Very low	97 Å²	97	93.8 Å²	93.8	45%	0.453	45%	0.446	S	S	.	.			trans	-120.2	0	174.5	-161.5	167.1	4.2	0	0	110.8	L461 R462 E532 K534	L461-Q546 HydrophobicContact CD2-CB 4.2Å; R462-Q546 PolarHBondContact O-NE2 2.88Å; E532-Q546 VanDerWaalsContact O-CD 3.23Å; E532-Q546 VanDerWaalsContact O-CG 3.31Å; E532-Q546 WeakPolarHBondContact O-CG 3.39Å; E532-Q546 PolarHBondContact O-NE2 3.47Å; K534-Q546 WeakPolarHBondContact CD-OXT 3.16Å; K534-Q546 WeakPolarHBondContact CE-OXT 3.39Å; K534-Q546 PolarHBondContact NZ-OXT 2.83Å

Retrieved 546 of 546 residues in 146.3 ms (Link to these results)

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