A0A3Q0KPJ4_SCHMA Loading...

FACT complex subunit SSRP1

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

AlphaFold DB , UniProt , Accession A0A3Q0KPJ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 685 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.7	Low	85.2	Confident	206 Å²	206	68.6 Å²	68.6	100%	1.015	38%	0.376	S	S	*	.				0	63.2	0	-66.8	-160.2	-126.2	0	0	110.6	D3 E26	M1-D3 VanDerWaalsContact C-N 3.34Å; M1-E26 PolarHBondContact N-OE1 2.94Å
2	A	65.3	Low	85.3	Confident	45 Å²	45	67 Å²	67	37%	0.372	36%	0.364	S	S	.	.			trans	-97.7	70.2	166.1	0	0	0	0	0	107.3	I4 F87	A2-I4 PolarHBondContact O-N 3.01Å; A2-F87 VanDerWaalsContact O-CE2 3.28Å; A2-F87 WeakPolarHBondContact O-CE2 3.35Å
3	D	86.2	Confident	85.1	Confident	102 Å²	102	66 Å²	66	55%	0.545	36%	0.361	S	S	.	.			trans	-73.9	125.1	176.6	-68.6	12.9	0	0	0	107.9	M1 L24	M1-D3 VanDerWaalsContact C-N 3.34Å; D3-L24 WeakPolarHBondContact CA-O 2.97Å
4	I	91.7	Very high	84.8	Confident	36 Å²	36	66.8 Å²	66.8	19%	0.185	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.2	176	-52.6	-178.6	0	0	0	107.9	A2 F6 R23 L24 F87	A2-I4 PolarHBondContact O-N 3.01Å; I4-F6 HydrophobicContact CB-CE2 4.46Å; I4-F6 HydrophobicContact CG2-CD2 4.18Å; I4-F6 HydrophobicContact CG2-CE1 4.28Å; I4-F6 HydrophobicContact CG2-CE2 3.36Å; I4-F6 HydrophobicContact CG2-CZ 3.42Å; I4-F6 VanDerWaalsContact CG2-CZ 3.42Å; I4-R23 CarbonylContact O-C 3.51Å; I4-R23 WeakPolarHBondContact O-CA 3.1Å; I4-L24 HydrophobicContact CB-CB 4.31Å; I4-L24 PolarHBondContact N-O 2.93Å; I4-L24 VanDerWaalsContact N-O 3.07Å; I4-L24 PolarHBondContact O-N 3.02Å; I4-F87 HydrophobicContact CD1-CB 3.86Å; I4-F87 HydrophobicContact CD1-CD2 3.49Å; I4-F87 VanDerWaalsContact CD1-CD2 3.49Å; I4-F87 HydrophobicContact CD1-CE2 4.37Å; I4-F87 HydrophobicContact CD1-CG 3.92Å; I4-F87 HydrophobicContact CG1-CD2 3.96Å; I4-F87 HydrophobicContact CG1-CE2 4.37Å
5	A	92.7	Very high	84.6	Confident	62 Å²	62	65 Å²	65	51%	0.512	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.3	178.3	0	0	0	0	0	110.9	L22 R23	A5-L22 CarbonylContact C-O 3.38Å; A5-L22 WeakPolarHBondContact CA-O 3.35Å; A5-R23 HydrophobicContact CB-CG 4.16Å
6	F	93.2	Very high	84.6	Confident	17 Å²	17	62.1 Å²	62.1	8%	0.075	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.7	175.4	-55.3	-84.5	0	0	0	109	I4 I9 K21 L22 F76 E80 V84	I4-F6 HydrophobicContact CB-CE2 4.46Å; I4-F6 HydrophobicContact CG2-CD2 4.18Å; I4-F6 HydrophobicContact CG2-CE1 4.28Å; I4-F6 HydrophobicContact CG2-CE2 3.36Å; I4-F6 HydrophobicContact CG2-CZ 3.42Å; I4-F6 VanDerWaalsContact CG2-CZ 3.42Å; F6-I9 HydrophobicContact CB-CD1 4.11Å; F6-I9 HydrophobicContact CB-CG1 3.51Å; F6-I9 HydrophobicContact CG-CG1 4.28Å; F6-K21 CarbonylContact O-C 3.6Å; F6-K21 WeakPolarHBondContact O-CA 3.28Å; F6-L22 HydrophobicContact CB-CB 4.42Å; F6-L22 HydrophobicContact CD2-CD2 3.73Å; F6-L22 HydrophobicContact CE2-CD2 4.24Å; F6-L22 PolarHBondContact N-O 3.13Å; F6-L22 PolarHBondContact O-N 3.48Å; F6-F76 HydrophobicContact CD2-CE1 4.13Å; F6-F76 HydrophobicContact CE2-CE1 4.12Å; F6-F76 HydrophobicContact CG-CE1 4.44Å; F6-F76 HydrophobicContact CZ-CE1 4.47Å; F6-E80 HydrophobicContact CD1-CB 4.46Å; F6-E80 HydrophobicContact CD1-CG 4.32Å; F6-E80 HydrophobicContact CE1-CB 3.7Å; F6-E80 HydrophobicContact CE1-CG 3.79Å; F6-E80 HydrophobicContact CZ-CB 4.31Å; F6-V84 HydrophobicContact CE2-CG2 3.56Å; F6-V84 HydrophobicContact CZ-CG2 3.58Å
7	D	89.9	Confident	84.8	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-6.8	-175.4	-76.5	-51.4	0	0	0	113.9	K21	D7-K21 WeakPolarHBondContact OD1-CD 3.45Å; D7-K21 WeakPolarHBondContact OD1-CE 3.48Å; D7-K21 IonicContact OD1-NZ 3.53Å; D7-K21 PolarHBondContact OD1-NZ 2.81Å
8	H	88.1	Confident	85	Confident	165 Å²	165	60.8 Å²	60.8	76%	0.764	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	29.4	-170.6	-58.6	-46.7	0	0	0	113.3
9	I	93.1	Very high	85.4	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	133.4	178.5	-60.1	-56.6	0	0	0	109.4	F6 G20 L22 Y31 D74 F76	F6-I9 HydrophobicContact CB-CD1 4.11Å; F6-I9 HydrophobicContact CB-CG1 3.51Å; F6-I9 HydrophobicContact CG-CG1 4.28Å; I9-G20 PolarHBondContact N-O 2.61Å; I9-G20 CarbonylContact O-C 3.49Å; I9-G20 WeakPolarHBondContact O-CA 3.29Å; I9-G20 PolarHBondContact O-N 2.79Å; I9-L22 HydrophobicContact CB-CB 4.2Å; I9-L22 HydrophobicContact CG1-CB 4.05Å; I9-L22 HydrophobicContact CG2-CB 4.46Å; I9-L22 HydrophobicContact CG2-CD1 4.15Å; I9-Y31 HydrophobicContact CB-CE2 4.4Å; I9-Y31 HydrophobicContact CG2-CD2 4.47Å; I9-Y31 HydrophobicContact CG2-CE2 4.13Å; I9-Y31 PolarHBondContact O-OH 2.83Å; I9-D74 WeakPolarHBondContact CG2-O 3.15Å; I9-F76 HydrophobicContact CD1-CD1 3.73Å; I9-F76 HydrophobicContact CD1-CD2 4.1Å; I9-F76 HydrophobicContact CD1-CE1 3.6Å; I9-F76 HydrophobicContact CD1-CE2 3.99Å; I9-F76 HydrophobicContact CD1-CG 3.99Å; I9-F76 HydrophobicContact CD1-CZ 3.76Å; I9-F76 HydrophobicContact CG1-CE1 4.12Å; I9-F76 HydrophobicContact CG1-CZ 4.07Å; I9-F76 HydrophobicContact CG2-CE2 4.15Å; I9-F76 HydrophobicContact CG2-CZ 4.18Å
10	T	92.4	Very high	85.7	Confident	29 Å²	29	57.7 Å²	57.7	18%	0.178	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	156.6	-179.9	62.2	0	0	0	0	111.6	V17 Y18 Y73 D74	T10-V17 VanDerWaalsContact CB-CG1 3.42Å; T10-V17 HydrophobicContact CG2-CG1 3.83Å; T10-Y18 CarbonylContact C-O 3.57Å; T10-Y18 VanDerWaalsContact CA-O 3.22Å; T10-Y18 WeakPolarHBondContact CA-O 3.36Å; T10-Y18 WeakPolarHBondContact CB-O 3.43Å; T10-Y73 CarbonylContact O-C 3.49Å; T10-Y73 WeakPolarHBondContact O-CA 3.32Å; T10-D74 PolarHBondContact N-O 3.11Å; T10-D74 PolarHBondContact O-N 3.38Å; T10-D74 PolarHBondContact OG1-O 2.83Å
11	Q	90.6	Very high	86.1	Confident	13 Å²	13	58.5 Å²	58.5	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.6	171.8	-177.9	179.2	46.3	0	0	108.1	V13 Y18 Y31 D40 Y73	Q11-V13 HydrophobicContact CG-CG2 3.97Å; Q11-Y18 PolarHBondContact N-O 3.42Å; Q11-Y18 PolarHBondContact O-N 3.46Å; Q11-Y31 HydrophobicContact CB-CE1 3.66Å; Q11-Y31 VanDerWaalsContact CB-OH 3.3Å; Q11-Y31 WeakPolarHBondContact CB-OH 3.38Å; Q11-Y31 HydrophobicContact CG-CE1 4.35Å; Q11-Y31 PolarHBondContact N-OH 3Å; Q11-Y31 VanDerWaalsContact OE1-CE1 3.29Å; Q11-D40 PolarHBondContact NE2-OD2 2.84Å; Q11-Y73 HydrophobicContact CB-CD1 4.41Å; Q11-Y73 HydrophobicContact CG-CE1 4.46Å
12	E	86.5	Confident	88	Confident	49 Å²	49	48.8 Å²	48.8	23%	0.229	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	125.3	172.9	-176.9	-86.1	132.5	0	0	109.5	R14 G15 T16 V17	E12-R14 PolarHBondContact OE1-N 3.49Å; E12-R14 VanDerWaalsContact OE1-N 3.09Å; E12-G15 PolarHBondContact OE1-N 3.32Å; E12-T16 WeakPolarHBondContact CA-O 3.42Å; E12-V17 HydrophobicContact CB-CG2 4.46Å; E12-V17 HydrophobicContact CG-CG2 4.49Å
13	V	82.8	Confident	89.4	Confident	54 Å²	54	53.4 Å²	53.4	33%	0.327	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	108.7	176.4	-175.8	0	0	0	0	108.8	Q11 G15 T16 Y18 N152	Q11-V13 HydrophobicContact CG-CG2 3.97Å; V13-G15 VanDerWaalsContact C-N 3.3Å; V13-G15 PolarHBondContact O-N 3.41Å; V13-T16 PolarHBondContact N-O 2.94Å; V13-T16 PolarHBondContact O-N 3.02Å; V13-T16 VanDerWaalsContact O-N 3.16Å; V13-Y18 HydrophobicContact CB-CD2 4.1Å; V13-Y18 HydrophobicContact CB-CE2 3.99Å; V13-Y18 HydrophobicContact CG2-CD2 4.2Å; V13-N152 PolarHBondContact O-ND2 2.99Å
14	R	80.6	Confident	89.7	Confident	77 Å²	77	48.6 Å²	48.6	29%	0.291	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	43.2	175.2	-61.4	178.3	176.8	-176.9	-4.6	112.9	E12 S133 N134 H150 N152 D189	E12-R14 PolarHBondContact OE1-N 3.49Å; E12-R14 VanDerWaalsContact OE1-N 3.09Å; R14-S133 PolarHBondContact NH2-O 2.99Å; R14-N134 WeakPolarHBondContact CG-OD1 3.38Å; R14-H150 PolarHBondContact NH2-CD2 2.83Å; R14-N152 HydrophobicContact CB-CB 4.15Å; R14-N152 WeakPolarHBondContact O-CB 3.5Å; R14-D189 IonicContact NH2-OD2 2.81Å
15	G	81.7	Confident	89.8	Confident	40 Å²	40	50.5 Å²	50.5	41%	0.412	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-13.7	178.7	0	0	0	0	0	115.1	E12 V13	E12-G15 PolarHBondContact OE1-N 3.32Å; V13-G15 VanDerWaalsContact C-N 3.3Å; V13-G15 PolarHBondContact O-N 3.41Å
16	T	85.2	Confident	89.7	Confident	18 Å²	18	51.7 Å²	51.7	11%	0.11	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131	177.9	-56.1	0	0	0	0	110.6	E12 V13 Y18 N152 A155	E12-T16 WeakPolarHBondContact CA-O 3.42Å; V13-T16 PolarHBondContact N-O 2.94Å; V13-T16 PolarHBondContact O-N 3.02Å; V13-T16 VanDerWaalsContact O-N 3.16Å; T16-Y18 HydrophobicContact CG2-CD1 4.31Å; T16-Y18 HydrophobicContact CG2-CD2 4.19Å; T16-Y18 HydrophobicContact CG2-CE1 3.8Å; T16-Y18 HydrophobicContact CG2-CE2 3.65Å; T16-Y18 HydrophobicContact CG2-CG 4.5Å; T16-Y18 VanDerWaalsContact CG2-CZ 3.42Å; T16-N152 PolarHBondContact OG1-ND2 3.39Å; T16-N152 VanDerWaalsContact OG1-ND2 3.08Å; T16-A155 WeakPolarHBondContact OG1-CB 3.28Å
17	V	88.4	Confident	89.6	Confident	85 Å²	85	54.9 Å²	54.9	52%	0.515	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	112	177.4	-178.1	0	0	0	0	109	T10 E12	T10-V17 VanDerWaalsContact CB-CG1 3.42Å; T10-V17 HydrophobicContact CG2-CG1 3.83Å; E12-V17 HydrophobicContact CB-CG2 4.46Å; E12-V17 HydrophobicContact CG-CG2 4.49Å
18	Y	88.6	Confident	89.7	Confident	16 Å²	16	53.8 Å²	53.8	6%	0.063	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.3	179.6	-64.7	-80.6	0	0	0	110.8	T10 Q11 V13 T16 Y31 N33 K35 T36 N152 E154	T10-Y18 CarbonylContact C-O 3.57Å; T10-Y18 VanDerWaalsContact CA-O 3.22Å; T10-Y18 WeakPolarHBondContact CA-O 3.36Å; T10-Y18 WeakPolarHBondContact CB-O 3.43Å; Q11-Y18 PolarHBondContact N-O 3.42Å; Q11-Y18 PolarHBondContact O-N 3.46Å; V13-Y18 HydrophobicContact CB-CD2 4.1Å; V13-Y18 HydrophobicContact CB-CE2 3.99Å; V13-Y18 HydrophobicContact CG2-CD2 4.2Å; T16-Y18 HydrophobicContact CG2-CD1 4.31Å; T16-Y18 HydrophobicContact CG2-CD2 4.19Å; T16-Y18 HydrophobicContact CG2-CE1 3.8Å; T16-Y18 HydrophobicContact CG2-CE2 3.65Å; T16-Y18 HydrophobicContact CG2-CG 4.5Å; T16-Y18 VanDerWaalsContact CG2-CZ 3.42Å; Y18-Y31 PolarHBondContact O-OH 3.46Å; Y18-N33 WeakPolarHBondContact CB-ND2 3.48Å; Y18-K35 HydrophobicContact CD1-CB 3.9Å; Y18-K35 HydrophobicContact CD1-CD 3.79Å; Y18-K35 HydrophobicContact CD1-CG 4.22Å; Y18-K35 HydrophobicContact CE1-CB 4.49Å; Y18-K35 HydrophobicContact CE1-CD 3.73Å; Y18-K35 HydrophobicContact CE1-CG 4.33Å; Y18-T36 HydrophobicContact CD1-CG2 4.43Å; Y18-T36 HydrophobicContact CE1-CG2 4.34Å; Y18-N152 PolarHBondContact OH-ND2 3.25Å; Y18-E154 WeakPolarHBondContact CE1-OE2 3.37Å; Y18-E154 PolarHBondContact OH-OE2 2.84Å
19	P	91.9	Very high	90	Very high	59 Å²	59	45.9 Å²	45.9	38%	0.383	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	149.3	171.4	30.4	-33.6	0	0	0	111	E34	P19-E34 PolarHBondContact O-N 3.47Å
20	G	91.8	Very high	90	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	172	-179.8	0	0	0	0	0	113.5	I9 Y31 K32	I9-G20 PolarHBondContact N-O 2.61Å; I9-G20 CarbonylContact O-C 3.49Å; I9-G20 WeakPolarHBondContact O-CA 3.29Å; I9-G20 PolarHBondContact O-N 2.79Å; G20-Y31 WeakPolarHBondContact CA-OH 3.31Å; G20-Y31 PolarHBondContact N-OH 3.43Å; G20-K32 CarbonylContact C-O 3.58Å; G20-K32 WeakPolarHBondContact CA-O 3.4Å
21	K	93.2	Very high	90	Very high	76 Å²	76	46.3 Å²	46.3	33%	0.33	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.6	178.7	-60.3	-175.1	173.9	-124.5	0	109.5	F6 D7 Y31 K32 E34	F6-K21 CarbonylContact O-C 3.6Å; F6-K21 WeakPolarHBondContact O-CA 3.28Å; D7-K21 WeakPolarHBondContact OD1-CD 3.45Å; D7-K21 WeakPolarHBondContact OD1-CE 3.48Å; D7-K21 IonicContact OD1-NZ 3.53Å; D7-K21 PolarHBondContact OD1-NZ 2.81Å; K21-Y31 CarbonylContact O-C 3.54Å; K21-Y31 WeakPolarHBondContact O-CA 3.37Å; K21-K32 PolarHBondContact N-O 3.12Å; K21-K32 PolarHBondContact O-N 2.95Å; K21-E34 WeakPolarHBondContact CE-OE1 3.4Å; K21-E34 HydrophobicContact CG-CG 4.34Å; K21-E34 IonicContact NZ-OE1 3.66Å
22	L	94.5	Very high	90	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.8	178.1	-169.7	145.8	0	0	0	109.9	A5 F6 I9 L24 F29 M30 Y31 Y73 F76	A5-L22 CarbonylContact C-O 3.38Å; A5-L22 WeakPolarHBondContact CA-O 3.35Å; F6-L22 HydrophobicContact CB-CB 4.42Å; F6-L22 HydrophobicContact CD2-CD2 3.73Å; F6-L22 HydrophobicContact CE2-CD2 4.24Å; F6-L22 PolarHBondContact N-O 3.13Å; F6-L22 PolarHBondContact O-N 3.48Å; I9-L22 HydrophobicContact CB-CB 4.2Å; I9-L22 HydrophobicContact CG1-CB 4.05Å; I9-L22 HydrophobicContact CG2-CB 4.46Å; I9-L22 HydrophobicContact CG2-CD1 4.15Å; L22-L24 HydrophobicContact CD2-CD1 4.24Å; L22-L24 HydrophobicContact CD2-CD2 3.83Å; L22-L24 HydrophobicContact CD2-CG 3.7Å; L22-F29 HydrophobicContact CD1-CE1 4.26Å; L22-F29 HydrophobicContact CD1-CE2 3.87Å; L22-F29 HydrophobicContact CD1-CZ 3.38Å; L22-F29 HydrophobicContact CD2-CE2 4.32Å; L22-F29 HydrophobicContact CG-CE2 4.3Å; L22-F29 HydrophobicContact CG-CZ 4Å; L22-M30 CarbonylContact C-O 3.45Å; L22-M30 WeakPolarHBondContact CA-O 3.36Å; L22-Y31 HydrophobicContact CB-CD2 4.2Å; L22-Y31 HydrophobicContact CD1-CD2 4.47Å; L22-Y73 HydrophobicContact CD1-CD2 4.5Å; L22-Y73 HydrophobicContact CD1-CG 4.19Å; L22-F76 HydrophobicContact CD1-CZ 3.86Å
23	R	94.1	Very high	90	Very high	143 Å²	143	49.1 Å²	49.1	54%	0.54	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131	177.1	-66.2	-174.6	178.6	-174.3	-2	109.7	I4 A5 M30	I4-R23 CarbonylContact O-C 3.51Å; I4-R23 WeakPolarHBondContact O-CA 3.1Å; A5-R23 HydrophobicContact CB-CG 4.16Å; R23-M30 HydrophobicContact CB-CB 4.39Å; R23-M30 HydrophobicContact CB-CE 4.38Å; R23-M30 PolarHBondContact N-O 3Å; R23-M30 PolarHBondContact O-N 3.21Å
24	L	93.8	Very high	90.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.9	175.9	-58.2	178.3	0	0	0	109.1	D3 I4 L22 F29 V84 F87 F88	D3-L24 WeakPolarHBondContact CA-O 2.97Å; I4-L24 HydrophobicContact CB-CB 4.31Å; I4-L24 PolarHBondContact N-O 2.93Å; I4-L24 VanDerWaalsContact N-O 3.07Å; I4-L24 PolarHBondContact O-N 3.02Å; L22-L24 HydrophobicContact CD2-CD1 4.24Å; L22-L24 HydrophobicContact CD2-CD2 3.83Å; L22-L24 HydrophobicContact CD2-CG 3.7Å; L24-F29 HydrophobicContact CD2-CB 4.37Å; L24-F29 HydrophobicContact CD2-CD2 3.17Å; L24-F29 HydrophobicContact CD2-CE2 3.6Å; L24-F29 HydrophobicContact CD2-CG 4Å; L24-V84 HydrophobicContact CD1-CG1 4.29Å; L24-V84 HydrophobicContact CD1-CG2 4.16Å; L24-F87 HydrophobicContact CB-CD1 4.02Å; L24-F87 HydrophobicContact CB-CE1 3.69Å; L24-F87 HydrophobicContact CB-CE2 4.36Å; L24-F87 HydrophobicContact CB-CZ 3.87Å; L24-F87 HydrophobicContact CD1-CD1 3.96Å; L24-F87 HydrophobicContact CD1-CE1 4.45Å; L24-F87 HydrophobicContact CD1-CG 4.26Å; L24-F88 HydrophobicContact CD1-CE2 4.23Å; L24-F88 HydrophobicContact CD2-CE2 4.25Å
25	K	92.7	Very high	90.3	Very high	76 Å²	76	53.5 Å²	53.5	33%	0.33	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	167.3	169.3	-62	-173.5	-162.8	151	0	109.6	D27 E28 M30 F87	K25-D27 PolarHBondContact O-N 3.35Å; K25-E28 HydrophobicContact CB-CB 4.28Å; K25-E28 WeakPolarHBondContact CD-OE2 3.34Å; K25-E28 PolarHBondContact N-O 3.15Å; K25-E28 IonicContact NZ-OE2 2.71Å; K25-E28 PolarHBondContact NZ-OE2 3.47Å; K25-E28 PolarHBondContact O-N 3.19Å; K25-M30 HydrophobicContact CD-CE 4.2Å; K25-M30 HydrophobicContact CG-CE 4.41Å; K25-F87 VanDerWaalsContact C-CZ 3.45Å; K25-F87 VanDerWaalsContact O-CZ 3.31Å; K25-F87 WeakPolarHBondContact O-CZ 3.18Å
26	E	90.7	Very high	90.1	Very high	88 Å²	88	55.3 Å²	55.3	41%	0.411	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.5	-171.1	-60	179.6	-174.2	0	0	113.8	M1 Y91	M1-E26 PolarHBondContact N-OE1 2.94Å; E26-Y91 HydrophobicContact CB-CD1 3.96Å; E26-Y91 HydrophobicContact CB-CE1 4.26Å; E26-Y91 HydrophobicContact CB-CG 4.47Å; E26-Y91 HydrophobicContact CG-CD1 3.9Å; E26-Y91 HydrophobicContact CG-CE1 3.69Å
27	D	90.6	Very high	89.9	Confident	84 Å²	84	56.4 Å²	56.4	45%	0.449	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-0.7	179.2	-161.1	41.4	0	0	0	113.6	K25 S43 R44	K25-D27 PolarHBondContact O-N 3.35Å; D27-S43 CarbonylContact O-C 3.6Å; D27-S43 WeakPolarHBondContact O-CA 3.34Å; D27-R44 PolarHBondContact O-N 2.89Å; D27-R44 WeakPolarHBondContact OD1-CD 3.38Å; D27-R44 WeakPolarHBondContact OD1-CG 3.5Å; D27-R44 IonicContact OD1-NE 3.01Å; D27-R44 PolarHBondContact OD1-NE 3.07Å
28	E	92.4	Very high	89.5	Confident	54 Å²	54	58.2 Å²	58.2	25%	0.252	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.9	-170.3	-52.3	-175.2	128.9	0	0	112.1	K25 H41	K25-E28 HydrophobicContact CB-CB 4.28Å; K25-E28 WeakPolarHBondContact CD-OE2 3.34Å; K25-E28 PolarHBondContact N-O 3.15Å; K25-E28 IonicContact NZ-OE2 2.71Å; K25-E28 PolarHBondContact NZ-OE2 3.47Å; K25-E28 PolarHBondContact O-N 3.19Å; E28-H41 IonicContact OE1-CD2 3.14Å; E28-H41 IonicContact OE1-CE1 3.66Å; E28-H41 IonicContact OE1-NE2 4Å; E28-H41 PolarHBondContact OE1-NE2 3.5Å
29	F	93.8	Very high	89.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.1	162.6	-178.3	-77.3	0	0	0	108.6	L22 L24 H41 F42 I47 L61 I63 Y73 F88	L22-F29 HydrophobicContact CD1-CE1 4.26Å; L22-F29 HydrophobicContact CD1-CE2 3.87Å; L22-F29 HydrophobicContact CD1-CZ 3.38Å; L22-F29 HydrophobicContact CD2-CE2 4.32Å; L22-F29 HydrophobicContact CG-CE2 4.3Å; L22-F29 HydrophobicContact CG-CZ 4Å; L24-F29 HydrophobicContact CD2-CB 4.37Å; L24-F29 HydrophobicContact CD2-CD2 3.17Å; L24-F29 HydrophobicContact CD2-CE2 3.6Å; L24-F29 HydrophobicContact CD2-CG 4Å; F29-H41 WeakPolarHBondContact O-CA 3.42Å; F29-F42 HydrophobicContact CB-CB 4.37Å; F29-F42 HydrophobicContact CB-CD2 4.43Å; F29-F42 AromaticContact CD1-CD2 3.61Å; F29-F42 HydrophobicContact CD1-CD2 3.61Å; F29-F42 HydrophobicContact CD1-CE2 4.05Å; F29-F42 HydrophobicContact CE1-CD2 4.26Å; F29-F42 HydrophobicContact CE1-CE2 4.27Å; F29-F42 HydrophobicContact CG-CD2 4.28Å; F29-F42 PolarHBondContact N-O 2.92Å; F29-F42 PolarHBondContact O-N 3.48Å; F29-I47 HydrophobicContact CB-CD1 4.26Å; F29-L61 HydrophobicContact CE2-CD2 4.1Å; F29-I63 HydrophobicContact CD1-CD1 4.45Å; F29-I63 HydrophobicContact CD2-CD1 3.69Å; F29-I63 HydrophobicContact CE1-CD1 4.11Å; F29-I63 HydrophobicContact CE2-CD1 3.29Å; F29-I63 HydrophobicContact CG-CD1 4.27Å; F29-I63 HydrophobicContact CZ-CD1 3.52Å; F29-Y73 HydrophobicContact CE1-CD2 4.11Å; F29-Y73 AromaticContact CE1-CE2 3.41Å; F29-Y73 HydrophobicContact CE1-CE2 3.41Å; F29-Y73 VanDerWaalsContact CE1-CE2 3.41Å; F29-Y73 AromaticContact CE1-CZ 3.65Å; F29-Y73 AromaticContact CZ-CD2 3.6Å; F29-Y73 HydrophobicContact CZ-CD2 3.6Å; F29-Y73 AromaticContact CZ-CE2 3.38Å; F29-Y73 HydrophobicContact CZ-CE2 3.38Å; F29-Y73 HydrophobicContact CZ-CG 4.35Å; F29-F88 HydrophobicContact CD2-CE2 4.36Å; F29-F88 AromaticContact CD2-CZ 3.99Å; F29-F88 HydrophobicContact CD2-CZ 3.99Å; F29-F88 HydrophobicContact CE2-CZ 4.2Å
30	M	93.1	Very high	89.2	Confident	38 Å²	38	58.8 Å²	58.8	19%	0.187	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.8	177.9	-72.7	-176.9	-75.2	0	0	111.6	L22 R23 K25 D40 H41	L22-M30 CarbonylContact C-O 3.45Å; L22-M30 WeakPolarHBondContact CA-O 3.36Å; R23-M30 HydrophobicContact CB-CB 4.39Å; R23-M30 HydrophobicContact CB-CE 4.38Å; R23-M30 PolarHBondContact N-O 3Å; R23-M30 PolarHBondContact O-N 3.21Å; K25-M30 HydrophobicContact CD-CE 4.2Å; K25-M30 HydrophobicContact CG-CE 4.41Å; M30-D40 CarbonylContact C-O 3.59Å; M30-D40 WeakPolarHBondContact CA-O 3.3Å; M30-H41 HydrophobicContact CG-CB 4.44Å; M30-H41 VanDerWaalsContact CG-CD2 3.48Å; M30-H41 WeakPolarHBondContact CG-CD2 3.5Å
31	Y	92.7	Very high	89.2	Confident	1 Å²	1	63.3 Å²	63.3	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.3	167.4	174.4	-94	0	0	0	109.7	I9 Q11 Y18 G20 K21 L22 N33 V39 D40 Y73	I9-Y31 HydrophobicContact CB-CE2 4.4Å; I9-Y31 HydrophobicContact CG2-CD2 4.47Å; I9-Y31 HydrophobicContact CG2-CE2 4.13Å; I9-Y31 PolarHBondContact O-OH 2.83Å; Q11-Y31 HydrophobicContact CB-CE1 3.66Å; Q11-Y31 VanDerWaalsContact CB-OH 3.3Å; Q11-Y31 WeakPolarHBondContact CB-OH 3.38Å; Q11-Y31 HydrophobicContact CG-CE1 4.35Å; Q11-Y31 PolarHBondContact N-OH 3Å; Q11-Y31 VanDerWaalsContact OE1-CE1 3.29Å; Y18-Y31 PolarHBondContact O-OH 3.46Å; G20-Y31 WeakPolarHBondContact CA-OH 3.31Å; G20-Y31 PolarHBondContact N-OH 3.43Å; K21-Y31 CarbonylContact O-C 3.54Å; K21-Y31 WeakPolarHBondContact O-CA 3.37Å; L22-Y31 HydrophobicContact CB-CD2 4.2Å; L22-Y31 HydrophobicContact CD1-CD2 4.47Å; Y31-N33 HydrophobicContact CE1-CB 4.03Å; Y31-V39 CarbonylContact O-C 3.54Å; Y31-V39 VanDerWaalsContact O-CA 3.3Å; Y31-V39 WeakPolarHBondContact O-CA 3.2Å; Y31-D40 PolarHBondContact N-O 2.99Å; Y31-D40 PolarHBondContact O-N 3.43Å; Y31-Y73 HydrophobicContact CD1-CD1 4.21Å; Y31-Y73 AromaticContact CD1-CE1 3.57Å; Y31-Y73 HydrophobicContact CD1-CE1 3.57Å; Y31-Y73 AromaticContact CD2-CD1 3.67Å; Y31-Y73 HydrophobicContact CD2-CD1 3.67Å; Y31-Y73 AromaticContact CD2-CE1 3.75Å; Y31-Y73 HydrophobicContact CD2-CE1 3.75Å; Y31-Y73 HydrophobicContact CE1-CD1 4.49Å; Y31-Y73 HydrophobicContact CE1-CE1 4.16Å; Y31-Y73 AromaticContact CE2-CD1 4Å; Y31-Y73 HydrophobicContact CE2-CD1 4Å; Y31-Y73 HydrophobicContact CE2-CE1 4.32Å; Y31-Y73 AromaticContact CG-CD1 3.78Å; Y31-Y73 HydrophobicContact CG-CD1 3.78Å; Y31-Y73 AromaticContact CG-CE1 3.32Å; Y31-Y73 HydrophobicContact CG-CE1 3.32Å
32	K	91.5	Very high	89.1	Confident	118 Å²	118	60.6 Å²	60.6	51%	0.513	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.5	174.8	-179.9	173.5	-179	-178.4	0	109.6	G20 K21 E34 V39	G20-K32 CarbonylContact C-O 3.58Å; G20-K32 WeakPolarHBondContact CA-O 3.4Å; K21-K32 PolarHBondContact N-O 3.12Å; K21-K32 PolarHBondContact O-N 2.95Å; K32-E34 PolarHBondContact O-N 2.8Å; K32-V39 HydrophobicContact CB-CG2 4.18Å; K32-V39 HydrophobicContact CD-CG2 4.21Å; K32-V39 HydrophobicContact CG-CG2 3.94Å
33	N	86.2	Confident	89	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	124.6	171.9	-173.8	-48	0	0	0	109.3	Y18 Y31 K35 T36 G37 K38	Y18-N33 WeakPolarHBondContact CB-ND2 3.48Å; Y31-N33 HydrophobicContact CE1-CB 4.03Å; N33-K35 PolarHBondContact OD1-N 2.89Å; N33-T36 VanDerWaalsContact CB-OG1 3.28Å; N33-T36 WeakPolarHBondContact CB-OG1 3.36Å; N33-T36 PolarHBondContact ND2-OG1 3.35Å; N33-T36 PolarHBondContact OD1-N 3.27Å; N33-T36 PolarHBondContact OD1-OG1 2.86Å; N33-G37 VanDerWaalsContact O-CA 3.23Å; N33-G37 WeakPolarHBondContact O-CA 3.34Å; N33-G37 PolarHBondContact O-N 3.04Å; N33-K38 HydrophobicContact CB-CB 4.49Å; N33-K38 PolarHBondContact N-O 3.14Å
34	E	88	Confident	88.8	Confident	101 Å²	101	61.6 Å²	61.6	47%	0.472	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-30.6	-175.7	-75.2	-175.5	154.4	0	0	112.8	P19 K21 K32	P19-E34 PolarHBondContact O-N 3.47Å; K21-E34 WeakPolarHBondContact CE-OE1 3.4Å; K21-E34 HydrophobicContact CG-CG 4.34Å; K21-E34 IonicContact NZ-OE1 3.66Å; K32-E34 PolarHBondContact O-N 2.8Å
35	K	81.9	Confident	88.7	Confident	122 Å²	122	64.8 Å²	64.8	53%	0.53	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-45.1	-177	-173.5	170.7	169.5	-155.7	0	112.1	Y18 N33 E154	Y18-K35 HydrophobicContact CD1-CB 3.9Å; Y18-K35 HydrophobicContact CD1-CD 3.79Å; Y18-K35 HydrophobicContact CD1-CG 4.22Å; Y18-K35 HydrophobicContact CE1-CB 4.49Å; Y18-K35 HydrophobicContact CE1-CD 3.73Å; Y18-K35 HydrophobicContact CE1-CG 4.33Å; N33-K35 PolarHBondContact OD1-N 2.89Å; K35-E154 IonicContact NZ-OE1 3.46Å; K35-E154 PolarHBondContact NZ-OE1 3.34Å; K35-E154 IonicContact NZ-OE2 3.71Å; K35-E154 PolarHBondContact NZ-OE2 2.89Å
36	T	78	Confident	88.7	Confident	79 Å²	79	64.4 Å²	64.4	49%	0.485	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-18	-177.8	66.8	0	0	0	0	113	Y18 N33 K38	Y18-T36 HydrophobicContact CD1-CG2 4.43Å; Y18-T36 HydrophobicContact CE1-CG2 4.34Å; N33-T36 VanDerWaalsContact CB-OG1 3.28Å; N33-T36 WeakPolarHBondContact CB-OG1 3.36Å; N33-T36 PolarHBondContact ND2-OG1 3.35Å; N33-T36 PolarHBondContact OD1-N 3.27Å; N33-T36 PolarHBondContact OD1-OG1 2.86Å; T36-K38 PolarHBondContact O-N 2.89Å; T36-K38 WeakPolarHBondContact OG1-CB 3.43Å; T36-K38 PolarHBondContact OG1-N 3.45Å
37	G	80.1	Confident	88.8	Confident	41 Å²	41	60.5 Å²	60.5	42%	0.423	31%	0.308	S	S	.	.			trans	71.8	-2.3	-172.7	0	0	0	0	0	114.2	N33 V39	N33-G37 VanDerWaalsContact O-CA 3.23Å; N33-G37 WeakPolarHBondContact O-CA 3.34Å; N33-G37 PolarHBondContact O-N 3.04Å; G37-V39 PolarHBondContact O-N 3.46Å
38	K	79.4	Confident	88.9	Confident	122 Å²	122	60.7 Å²	60.7	53%	0.53	31%	0.306	S	S	.	.			trans	-60.9	134.3	177.9	-172.7	-176	174.7	-166.5	0	109.9	N33 T36 D40	N33-K38 HydrophobicContact CB-CB 4.49Å; N33-K38 PolarHBondContact N-O 3.14Å; T36-K38 PolarHBondContact O-N 2.89Å; T36-K38 WeakPolarHBondContact OG1-CB 3.43Å; T36-K38 PolarHBondContact OG1-N 3.45Å; K38-D40 WeakPolarHBondContact CE-OD1 3.45Å; K38-D40 IonicContact NZ-OD1 3.79Å
39	V	87.4	Confident	89	Confident	80 Å²	80	60.4 Å²	60.4	49%	0.485	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.9	175.8	-177.4	0	0	0	0	108.4	Y31 K32 G37	Y31-V39 CarbonylContact O-C 3.54Å; Y31-V39 VanDerWaalsContact O-CA 3.3Å; Y31-V39 WeakPolarHBondContact O-CA 3.2Å; K32-V39 HydrophobicContact CB-CG2 4.18Å; K32-V39 HydrophobicContact CD-CG2 4.21Å; K32-V39 HydrophobicContact CG-CG2 3.94Å; G37-V39 PolarHBondContact O-N 3.46Å
40	D	87.6	Confident	89	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.043	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	123	164.2	-68.4	-12.2	0	0	0	107.1	Q11 M30 Y31 K38 F42 H71 Y73	Q11-D40 PolarHBondContact NE2-OD2 2.84Å; M30-D40 CarbonylContact C-O 3.59Å; M30-D40 WeakPolarHBondContact CA-O 3.3Å; Y31-D40 PolarHBondContact N-O 2.99Å; Y31-D40 PolarHBondContact O-N 3.43Å; K38-D40 WeakPolarHBondContact CE-OD1 3.45Å; K38-D40 IonicContact NZ-OD1 3.79Å; D40-F42 HydrophobicContact CB-CE1 4.43Å; D40-F42 HydrophobicContact CB-CE2 4.02Å; D40-F42 HydrophobicContact CB-CZ 3.67Å; D40-H71 IonicContact OD2-ND1 2.74Å; D40-H71 PolarHBondContact OD2-ND1 2.79Å; D40-Y73 WeakPolarHBondContact CB-OH 3.49Å; D40-Y73 PolarHBondContact OD2-OH 2.94Å
41	H	91.7	Very high	89.1	Confident	94 Å²	94	60 Å²	60	44%	0.435	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.8	177.5	175.7	-79.9	0	0	0	108.5	E28 F29 M30	E28-H41 IonicContact OE1-CD2 3.14Å; E28-H41 IonicContact OE1-CE1 3.66Å; E28-H41 IonicContact OE1-NE2 4Å; E28-H41 PolarHBondContact OE1-NE2 3.5Å; F29-H41 WeakPolarHBondContact O-CA 3.42Å; M30-H41 HydrophobicContact CG-CB 4.44Å; M30-H41 VanDerWaalsContact CG-CD2 3.48Å; M30-H41 WeakPolarHBondContact CG-CD2 3.5Å
42	F	91.1	Very high	89.2	Confident	19 Å²	19	61 Å²	61	8%	0.083	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.8	179.4	-45.1	-53.3	0	0	0	109.3	F29 D40 D46 L65 H71 Y73	F29-F42 HydrophobicContact CB-CB 4.37Å; F29-F42 HydrophobicContact CB-CD2 4.43Å; F29-F42 AromaticContact CD1-CD2 3.61Å; F29-F42 HydrophobicContact CD1-CD2 3.61Å; F29-F42 HydrophobicContact CD1-CE2 4.05Å; F29-F42 HydrophobicContact CE1-CD2 4.26Å; F29-F42 HydrophobicContact CE1-CE2 4.27Å; F29-F42 HydrophobicContact CG-CD2 4.28Å; F29-F42 PolarHBondContact N-O 2.92Å; F29-F42 PolarHBondContact O-N 3.48Å; D40-F42 HydrophobicContact CB-CE1 4.43Å; D40-F42 HydrophobicContact CB-CE2 4.02Å; D40-F42 HydrophobicContact CB-CZ 3.67Å; F42-D46 HydrophobicContact CB-CB 4.36Å; F42-L65 HydrophobicContact CB-CD2 4.17Å; F42-L65 HydrophobicContact CD1-CD1 3.4Å; F42-L65 HydrophobicContact CD1-CD2 4.2Å; F42-L65 HydrophobicContact CD1-CG 4.45Å; F42-L65 HydrophobicContact CD2-CD1 4.35Å; F42-L65 HydrophobicContact CD2-CD2 4.13Å; F42-L65 HydrophobicContact CE1-CD1 3.37Å; F42-L65 HydrophobicContact CE2-CD1 4.3Å; F42-L65 HydrophobicContact CG-CD1 3.94Å; F42-L65 HydrophobicContact CG-CD2 3.89Å; F42-L65 HydrophobicContact CZ-CD1 3.85Å; F42-H71 HydrophobicContact CE2-CB 4.37Å; F42-H71 AromaticContact CE2-CG 4Å; F42-H71 AromaticContact CZ-CD2 3.8Å; F42-H71 AromaticContact CZ-CE1 3.5Å; F42-H71 VanDerWaalsContact CZ-CE1 3.5Å; F42-H71 WeakPolarHBondContact CZ-CE1 3.49Å; F42-H71 AromaticContact CZ-CG 3.7Å; F42-H71 AromaticContact CZ-ND1 3.51Å; F42-H71 AromaticContact CZ-NE2 3.7Å; F42-Y73 WeakPolarHBondContact CE2-OH 3.46Å
43	S	91.8	Very high	89.2	Confident	25 Å²	25	55.6 Å²	55.6	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	160.5	167.9	70.2	0	0	0	0	110.3	D27 S45 D46	D27-S43 CarbonylContact O-C 3.6Å; D27-S43 WeakPolarHBondContact O-CA 3.34Å; S43-S45 PolarHBondContact O-N 2.81Å; S43-S45 VanDerWaalsContact O-N 3.13Å; S43-S45 PolarHBondContact OG-N 2.88Å; S43-S45 PolarHBondContact OG-OG 3.5Å; S43-D46 WeakPolarHBondContact CB-OD2 3.46Å; S43-D46 PolarHBondContact N-OD2 2.95Å; S43-D46 WeakPolarHBondContact O-CB 3.34Å; S43-D46 PolarHBondContact O-N 2.88Å; S43-D46 PolarHBondContact OG-N 3.41Å; S43-D46 PolarHBondContact OG-OD1 3.01Å; S43-D46 PolarHBondContact OG-OD2 2.84Å
44	R	91.2	Very high	89.4	Confident	140 Å²	140	59.1 Å²	59.1	53%	0.528	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.2	173.3	78.3	-176	172.6	142.3	8.2	112.8	D27 D46 I47 F92	D27-R44 PolarHBondContact O-N 2.89Å; D27-R44 WeakPolarHBondContact OD1-CD 3.38Å; D27-R44 WeakPolarHBondContact OD1-CG 3.5Å; D27-R44 IonicContact OD1-NE 3.01Å; D27-R44 PolarHBondContact OD1-NE 3.07Å; R44-D46 VanDerWaalsContact C-N 3.27Å; R44-D46 PolarHBondContact O-N 2.93Å; R44-I47 PolarHBondContact O-N 2.89Å; R44-F92 HydrophobicContact CB-CD1 3.41Å; R44-F92 VanDerWaalsContact CB-CD1 3.41Å; R44-F92 HydrophobicContact CB-CE1 3.85Å; R44-F92 HydrophobicContact CB-CG 4.27Å
45	S	92	Very high	89.3	Confident	67 Å²	67	57.5 Å²	57.5	47%	0.469	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-20.4	178.8	36.6	0	0	0	0	113.5	S43 R66	S43-S45 PolarHBondContact O-N 2.81Å; S43-S45 VanDerWaalsContact O-N 3.13Å; S43-S45 PolarHBondContact OG-N 2.88Å; S43-S45 PolarHBondContact OG-OG 3.5Å; S45-R66 WeakPolarHBondContact O-CD 3.11Å; S45-R66 PolarHBondContact O-NE 2.71Å
46	D	92	Very high	89.3	Confident	69 Å²	69	57.2 Å²	57.2	37%	0.369	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-24	179.5	-58.4	-42.1	0	0	0	111.8	F42 S43 R44 L65 R66	F42-D46 HydrophobicContact CB-CB 4.36Å; S43-D46 WeakPolarHBondContact CB-OD2 3.46Å; S43-D46 PolarHBondContact N-OD2 2.95Å; S43-D46 WeakPolarHBondContact O-CB 3.34Å; S43-D46 PolarHBondContact O-N 2.88Å; S43-D46 PolarHBondContact OG-N 3.41Å; S43-D46 PolarHBondContact OG-OD1 3.01Å; S43-D46 PolarHBondContact OG-OD2 2.84Å; R44-D46 VanDerWaalsContact C-N 3.27Å; R44-D46 PolarHBondContact O-N 2.93Å; D46-L65 HydrophobicContact CB-CD2 4.29Å; D46-L65 CarbonylContact O-C 3.59Å; D46-L65 WeakPolarHBondContact O-CA 3.45Å; D46-R66 PolarHBondContact O-N 2.86Å
47	I	92.8	Very high	89.5	Confident	5 Å²	5	58 Å²	58	3%	0.026	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.3	-177.7	-58.6	174.3	0	0	0	109.5	F29 R44 I63 L65 F88 F92 V94	F29-I47 HydrophobicContact CB-CD1 4.26Å; R44-I47 PolarHBondContact O-N 2.89Å; I47-I63 HydrophobicContact CD1-CG2 4.49Å; I47-I63 HydrophobicContact CG1-CG2 4.1Å; I47-I63 HydrophobicContact CG2-CG2 3.87Å; I47-L65 HydrophobicContact CG1-CD2 3.95Å; I47-F88 HydrophobicContact CD1-CE1 4.38Å; I47-F92 HydrophobicContact CD1-CD2 3.98Å; I47-F92 HydrophobicContact CD1-CE2 4.03Å; I47-V94 HydrophobicContact CG2-CG2 4.3Å
48	E	92.7	Very high	89.8	Confident	88 Å²	88	57.3 Å²	57.3	41%	0.411	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-50.5	176.6	-176.4	-171.9	146.7	0	0	110.9	K64 R66	E48-K64 PolarHBondContact N-O 2.95Å; E48-K64 IonicContact OE1-NZ 2.69Å; E48-K64 PolarHBondContact OE1-NZ 2.88Å; E48-K64 WeakPolarHBondContact OE2-CE 3.3Å; E48-K64 IonicContact OE2-NZ 3.47Å; E48-R66 HydrophobicContact CB-CG 3.98Å
49	S	93.4	Very high	90.5	Very high	48 Å²	48	52.9 Å²	52.9	34%	0.336	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	160.2	-179.3	67.2	0	0	0	0	111.1	K64	S49-K64 PolarHBondContact N-O 2.88Å; S49-K64 PolarHBondContact O-N 3.47Å
50	A	94.7	Very high	90.8	Very high	6 Å²	6	49.1 Å²	49.1	5%	0.05	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.9	176.6	0	0	0	0	0	110.2	L61 S62 F88 V94 I96 V97	A50-L61 HydrophobicContact CB-CD1 4.29Å; A50-S62 CarbonylContact C-O 3.58Å; A50-S62 VanDerWaalsContact CA-O 3.3Å; A50-S62 WeakPolarHBondContact CA-O 3.4Å; A50-F88 HydrophobicContact CB-CD1 4.06Å; A50-F88 HydrophobicContact CB-CE1 3.89Å; A50-V94 HydrophobicContact CB-CG1 4.11Å; A50-I96 HydrophobicContact CB-CB 4.5Å; A50-I96 HydrophobicContact CB-CG1 4.06Å; A50-I96 HydrophobicContact CB-CG2 4.11Å; A50-I96 WeakPolarHBondContact O-CA 3.22Å; A50-V97 PolarHBondContact O-N 3.22Å
51	Q	94.3	Very high	91.1	Very high	23 Å²	23	48.8 Å²	48.8	11%	0.107	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.4	179.4	62	-175.2	-7.1	0	0	112.6	I53 S62 V97	Q51-I53 HydrophobicContact CG-CD1 4.43Å; Q51-I53 HydrophobicContact CG-CG1 4.4Å; Q51-S62 PolarHBondContact N-O 2.85Å; Q51-S62 PolarHBondContact O-N 3.22Å; Q51-V97 CarbonylContact C-O 3.58Å; Q51-V97 WeakPolarHBondContact CA-O 3.44Å; Q51-V97 VanDerWaalsContact CB-O 3.3Å; Q51-V97 WeakPolarHBondContact CB-O 3.46Å
52	W	95.1	Very high	91.2	Very high	22 Å²	22	44.4 Å²	44.4	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.9	171.3	-70.6	120.2	0	0	0	110.2	L59 G60 L61 F76 A81 V84 I96 V97 K98 R99	W52-L59 HydrophobicContact CE3-CB 3.88Å; W52-L59 HydrophobicContact CZ3-CB 4.21Å; W52-G60 WeakPolarHBondContact CA-O 3.37Å; W52-L61 HydrophobicContact CD2-CD1 4.49Å; W52-L61 HydrophobicContact CE3-CB 4.14Å; W52-L61 HydrophobicContact CE3-CD1 4.31Å; W52-L61 HydrophobicContact CH2-CB 3.98Å; W52-L61 HydrophobicContact CH2-CD1 4Å; W52-L61 HydrophobicContact CH2-CG 4.4Å; W52-L61 HydrophobicContact CZ2-CD1 4.18Å; W52-L61 HydrophobicContact CZ3-CB 3.54Å; W52-L61 HydrophobicContact CZ3-CD1 4.08Å; W52-L61 HydrophobicContact CZ3-CG 4.34Å; W52-F76 HydrophobicContact CH2-CB 4.31Å; W52-F76 HydrophobicContact CH2-CD1 4.32Å; W52-F76 HydrophobicContact CH2-CD2 4.16Å; W52-F76 HydrophobicContact CH2-CG 4.01Å; W52-F76 HydrophobicContact CZ3-CB 4.03Å; W52-F76 AromaticContact CZ3-CD2 3.73Å; W52-F76 HydrophobicContact CZ3-CD2 3.73Å; W52-F76 HydrophobicContact CZ3-CE2 4.33Å; W52-F76 AromaticContact CZ3-CG 3.89Å; W52-F76 HydrophobicContact CZ3-CG 3.89Å; W52-A81 HydrophobicContact CD2-CB 4.38Å; W52-A81 HydrophobicContact CH2-CB 3.85Å; W52-A81 HydrophobicContact CZ2-CB 3.69Å; W52-A81 WeakPolarHBondContact CZ2-O 3.35Å; W52-A81 HydrophobicContact CZ3-CB 4.24Å; W52-V84 HydrophobicContact CH2-CB 4.09Å; W52-V84 HydrophobicContact CH2-CG1 3.97Å; W52-V84 HydrophobicContact CZ2-CB 3.94Å; W52-V84 HydrophobicContact CZ2-CG1 3.86Å; W52-I96 HydrophobicContact CD2-CG2 4Å; W52-I96 HydrophobicContact CG-CG2 3.73Å; W52-I96 HydrophobicContact CZ2-CD1 3.87Å; W52-I96 VanDerWaalsContact NE1-CG2 3.31Å; W52-V97 PolarHBondContact N-O 3.18Å; W52-K98 HydrophobicContact CB-CB 4.5Å; W52-K98 HydrophobicContact CB-CG 4.49Å; W52-R99 PolarHBondContact O-N 3.27Å
53	I	92.1	Very high	91.3	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.4	175.7	-60.6	166.7	0	0	0	108.1	Q51 R55 G60 R99 L101 M126	Q51-I53 HydrophobicContact CG-CD1 4.43Å; Q51-I53 HydrophobicContact CG-CG1 4.4Å; I53-R55 HydrophobicContact CG2-CG 4.29Å; I53-G60 PolarHBondContact N-O 2.81Å; I53-G60 PolarHBondContact O-N 2.9Å; I53-R99 HydrophobicContact CG1-CB 4.29Å; I53-L101 HydrophobicContact CG2-CD1 3.84Å; I53-L101 HydrophobicContact CG2-CD2 4.05Å; I53-L101 HydrophobicContact CG2-CG 4.25Å; I53-M126 HydrophobicContact CD1-CE 3.87Å; I53-M126 HydrophobicContact CG1-CE 4.2Å; I53-M126 HydrophobicContact CG2-CE 4.27Å
54	V	90.2	Very high	91.3	Very high	76 Å²	76	43.4 Å²	43.4	46%	0.461	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.7	175.7	-177.9	0	0	0	0	109.4	L59 L101	V54-L59 HydrophobicContact CG2-CD2 4.03Å; V54-L101 HydrophobicContact CB-CD1 4.5Å; V54-L101 WeakPolarHBondContact O-CD1 3.44Å
55	R	86	Confident	91.3	Very high	68 Å²	68	36.9 Å²	36.9	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	170.7	-179.5	-70	-178.2	172.5	-128.6	-8.6	110.7	I53 T57 G58 D74 E129	I53-R55 HydrophobicContact CG2-CG 4.29Å; R55-T57 PolarHBondContact O-N 3.43Å; R55-G58 CarbonylContact C-O 3.59Å; R55-G58 WeakPolarHBondContact CA-O 3.4Å; R55-G58 PolarHBondContact N-O 3.39Å; R55-G58 PolarHBondContact O-N 3.03Å; R55-D74 WeakPolarHBondContact CD-OD1 3.47Å; R55-D74 VanDerWaalsContact CD-OD2 3.3Å; R55-D74 WeakPolarHBondContact CD-OD2 3.38Å; R55-D74 IonicContact CZ-OD1 2.77Å; R55-D74 IonicContact CZ-OD2 3.43Å; R55-D74 IonicContact NE-OD1 2.63Å; R55-D74 PolarHBondContact NE-OD1 2.84Å; R55-D74 IonicContact NE-OD2 3.82Å; R55-D74 IonicContact NH1-OD1 3.65Å; R55-D74 IonicContact NH1-OD2 3.88Å; R55-D74 PolarHBondContact NH1-OD2 2.9Å; R55-E129 IonicContact NH2-OE1 3.75Å
56	A	82.4	Confident	91.2	Very high	116 Å²	116	41.9 Å²	41.9	96%	0.959	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.4	-177.8	0	0	0	0	0	113.4
57	T	81.3	Confident	90.8	Very high	94 Å²	94	43.4 Å²	43.4	58%	0.577	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	3.4	-179.6	51.9	0	0	0	0	114	R55	R55-T57 PolarHBondContact O-N 3.43Å
58	G	87.4	Confident	90.4	Very high	28 Å²	28	46 Å²	46	29%	0.289	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	126.6	-142	-176	0	0	0	0	0	112.2	R55	R55-G58 CarbonylContact C-O 3.59Å; R55-G58 WeakPolarHBondContact CA-O 3.4Å; R55-G58 PolarHBondContact N-O 3.39Å; R55-G58 PolarHBondContact O-N 3.03Å
59	L	92.8	Very high	89.9	Confident	28 Å²	28	43.2 Å²	43.2	15%	0.147	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.5	174.4	-67.4	163.8	0	0	0	109.8	W52 V54 F76 A81	W52-L59 HydrophobicContact CE3-CB 3.88Å; W52-L59 HydrophobicContact CZ3-CB 4.21Å; V54-L59 HydrophobicContact CG2-CD2 4.03Å; L59-F76 HydrophobicContact CB-CB 4.29Å; L59-F76 PolarHBondContact N-O 2.87Å; L59-F76 WeakPolarHBondContact O-CB 3.44Å; L59-F76 WeakPolarHBondContact O-CD2 3.32Å; L59-F76 PolarHBondContact O-N 2.8Å; L59-A81 HydrophobicContact CD1-CB 3.52Å
60	G	93.5	Very high	89.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.9	170.4	0	0	0	0	0	110.2	W52 I53 Y73 D74	W52-G60 WeakPolarHBondContact CA-O 3.37Å; I53-G60 PolarHBondContact N-O 2.81Å; I53-G60 PolarHBondContact O-N 2.9Å; G60-Y73 CarbonylContact C-O 3.54Å; G60-Y73 WeakPolarHBondContact CA-O 3.4Å; G60-D74 WeakPolarHBondContact CA-OD1 3.32Å
61	L	94.9	Very high	89.3	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.2	170.8	-178.1	62	0	0	0	108.7	F29 A50 W52 I63 R72 Y73 F76 V84 F88 I96	F29-L61 HydrophobicContact CE2-CD2 4.1Å; A50-L61 HydrophobicContact CB-CD1 4.29Å; W52-L61 HydrophobicContact CD2-CD1 4.49Å; W52-L61 HydrophobicContact CE3-CB 4.14Å; W52-L61 HydrophobicContact CE3-CD1 4.31Å; W52-L61 HydrophobicContact CH2-CB 3.98Å; W52-L61 HydrophobicContact CH2-CD1 4Å; W52-L61 HydrophobicContact CH2-CG 4.4Å; W52-L61 HydrophobicContact CZ2-CD1 4.18Å; W52-L61 HydrophobicContact CZ3-CB 3.54Å; W52-L61 HydrophobicContact CZ3-CD1 4.08Å; W52-L61 HydrophobicContact CZ3-CG 4.34Å; L61-I63 HydrophobicContact CD1-CG1 4.39Å; L61-I63 HydrophobicContact CD2-CD1 3.85Å; L61-I63 HydrophobicContact CD2-CG1 4.08Å; L61-I63 HydrophobicContact CG-CD1 4.2Å; L61-I63 HydrophobicContact CG-CG1 3.85Å; L61-R72 WeakPolarHBondContact O-CA 3.48Å; L61-Y73 PolarHBondContact N-O 2.88Å; L61-Y73 PolarHBondContact O-N 3.42Å; L61-F76 HydrophobicContact CB-CD2 4.13Å; L61-F76 HydrophobicContact CB-CE2 3.61Å; L61-F76 HydrophobicContact CB-CZ 4.28Å; L61-F76 HydrophobicContact CD2-CE2 4.45Å; L61-F76 HydrophobicContact CD2-CZ 4.31Å; L61-V84 HydrophobicContact CD2-CG1 4.1Å; L61-F88 HydrophobicContact CD2-CE2 4.42Å; L61-F88 HydrophobicContact CD2-CZ 4.14Å; L61-I96 HydrophobicContact CD1-CD1 3.92Å; L61-I96 HydrophobicContact CD1-CG2 4.04Å
62	S	93.1	Very high	89.2	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119	173.3	-167.7	0	0	0	0	109	A50 Q51 L70 H71	A50-S62 CarbonylContact C-O 3.58Å; A50-S62 VanDerWaalsContact CA-O 3.3Å; A50-S62 WeakPolarHBondContact CA-O 3.4Å; Q51-S62 PolarHBondContact N-O 2.85Å; Q51-S62 PolarHBondContact O-N 3.22Å; S62-L70 WeakPolarHBondContact OG-CD1 3.35Å; S62-H71 CarbonylContact C-O 3.57Å; S62-H71 WeakPolarHBondContact CA-O 3.41Å
63	I	93.1	Very high	89.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.9	-177.1	-55.2	-179.1	0	0	0	108.3	F29 I47 L61 L65 L70 H71 Y73 F88	F29-I63 HydrophobicContact CD1-CD1 4.45Å; F29-I63 HydrophobicContact CD2-CD1 3.69Å; F29-I63 HydrophobicContact CE1-CD1 4.11Å; F29-I63 HydrophobicContact CE2-CD1 3.29Å; F29-I63 HydrophobicContact CG-CD1 4.27Å; F29-I63 HydrophobicContact CZ-CD1 3.52Å; I47-I63 HydrophobicContact CD1-CG2 4.49Å; I47-I63 HydrophobicContact CG1-CG2 4.1Å; I47-I63 HydrophobicContact CG2-CG2 3.87Å; L61-I63 HydrophobicContact CD1-CG1 4.39Å; L61-I63 HydrophobicContact CD2-CD1 3.85Å; L61-I63 HydrophobicContact CD2-CG1 4.08Å; L61-I63 HydrophobicContact CG-CD1 4.2Å; L61-I63 HydrophobicContact CG-CG1 3.85Å; I63-L65 HydrophobicContact CG2-CD2 4Å; I63-L70 WeakPolarHBondContact O-CA 3.3Å; I63-H71 PolarHBondContact N-O 3.18Å; I63-H71 PolarHBondContact O-N 3.26Å; I63-Y73 HydrophobicContact CD1-CD2 4.32Å; I63-Y73 HydrophobicContact CD1-CE2 4.16Å; I63-F88 HydrophobicContact CD1-CE1 4.33Å; I63-F88 HydrophobicContact CD1-CZ 3.89Å
64	K	92	Very high	89.2	Confident	23 Å²	23	42.7 Å²	42.7	10%	0.1	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.7	170.6	-174	-175.4	172.9	-166.5	0	108.9	E48 S49 L70 D114	E48-K64 PolarHBondContact N-O 2.95Å; E48-K64 IonicContact OE1-NZ 2.69Å; E48-K64 PolarHBondContact OE1-NZ 2.88Å; E48-K64 WeakPolarHBondContact OE2-CE 3.3Å; E48-K64 IonicContact OE2-NZ 3.47Å; S49-K64 PolarHBondContact N-O 2.88Å; S49-K64 PolarHBondContact O-N 3.47Å; K64-L70 HydrophobicContact CB-CD1 4.12Å; K64-D114 WeakPolarHBondContact CE-OD1 3.21Å; K64-D114 IonicContact NZ-OD1 2.74Å; K64-D114 PolarHBondContact NZ-OD1 2.76Å
65	L	90.7	Very high	89.3	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	157.3	175.4	-59.2	-178.3	0	0	0	110.6	F42 D46 I47 I63 N67 N68 S69	F42-L65 HydrophobicContact CB-CD2 4.17Å; F42-L65 HydrophobicContact CD1-CD1 3.4Å; F42-L65 HydrophobicContact CD1-CD2 4.2Å; F42-L65 HydrophobicContact CD1-CG 4.45Å; F42-L65 HydrophobicContact CD2-CD1 4.35Å; F42-L65 HydrophobicContact CD2-CD2 4.13Å; F42-L65 HydrophobicContact CE1-CD1 3.37Å; F42-L65 HydrophobicContact CE2-CD1 4.3Å; F42-L65 HydrophobicContact CG-CD1 3.94Å; F42-L65 HydrophobicContact CG-CD2 3.89Å; F42-L65 HydrophobicContact CZ-CD1 3.85Å; D46-L65 HydrophobicContact CB-CD2 4.29Å; D46-L65 CarbonylContact O-C 3.59Å; D46-L65 WeakPolarHBondContact O-CA 3.45Å; I47-L65 HydrophobicContact CG1-CD2 3.95Å; I63-L65 HydrophobicContact CG2-CD2 4Å; L65-N67 WeakPolarHBondContact CB-OD1 3.5Å; L65-N67 PolarHBondContact O-N 2.83Å; L65-N67 VanDerWaalsContact O-N 3.12Å; L65-N68 WeakPolarHBondContact O-CA 3.36Å; L65-N68 PolarHBondContact O-N 2.74Å; L65-S69 PolarHBondContact N-O 3.05Å
66	R	90.1	Very high	89.6	Confident	171 Å²	171	37 Å²	37	65%	0.645	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.1	179.2	-66.8	-174.3	-176.8	-157.3	0.7	114.2	S45 D46 E48 N68	S45-R66 WeakPolarHBondContact O-CD 3.11Å; S45-R66 PolarHBondContact O-NE 2.71Å; D46-R66 PolarHBondContact O-N 2.86Å; E48-R66 HydrophobicContact CB-CG 3.98Å; R66-N68 PolarHBondContact O-N 2.78Å
67	N	84.7	Confident	90.1	Very high	101 Å²	101	33 Å²	33	54%	0.54	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	5.4	171.4	69.6	-4.5	0	0	0	112.7	L65 S69	L65-N67 WeakPolarHBondContact CB-OD1 3.5Å; L65-N67 PolarHBondContact O-N 2.83Å; L65-N67 VanDerWaalsContact O-N 3.12Å; N67-S69 VanDerWaalsContact C-N 3.32Å; N67-S69 PolarHBondContact ND2-OG 3.28Å; N67-S69 PolarHBondContact O-N 2.85Å; N67-S69 WeakPolarHBondContact OD1-CB 3.46Å; N67-S69 PolarHBondContact OD1-N 2.76Å; N67-S69 PolarHBondContact OD1-OG 2.98Å
68	N	83.7	Confident	90.5	Very high	61 Å²	61	36 Å²	36	33%	0.326	19%	0.193	S	C	.	.	S	Bend	trans	73.9	5	-176.3	-59	-61.1	0	0	0	116.6	L65 R66 D116	L65-N68 WeakPolarHBondContact O-CA 3.36Å; L65-N68 PolarHBondContact O-N 2.74Å; R66-N68 PolarHBondContact O-N 2.78Å; N68-D116 PolarHBondContact O-N 3.2Å
69	S	82.1	Confident	90.7	Very high	28 Å²	28	40.4 Å²	40.4	20%	0.196	21%	0.208	C	C	.	.			trans	-79.4	144.9	174.7	73.9	0	0	0	0	111.7	L65 N67 H71	L65-S69 PolarHBondContact N-O 3.05Å; N67-S69 VanDerWaalsContact C-N 3.32Å; N67-S69 PolarHBondContact ND2-OG 3.28Å; N67-S69 PolarHBondContact O-N 2.85Å; N67-S69 WeakPolarHBondContact OD1-CB 3.46Å; N67-S69 PolarHBondContact OD1-N 2.76Å; N67-S69 PolarHBondContact OD1-OG 2.98Å; S69-H71 PolarHBondContact OG-NE2 2.8Å
70	L	87.2	Confident	90.7	Very high	30 Å²	30	42.4 Å²	42.4	16%	0.157	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.9	177.8	-169.9	80.6	0	0	0	110	S62 I63 K64 R72 V117 E129	S62-L70 WeakPolarHBondContact OG-CD1 3.35Å; I63-L70 WeakPolarHBondContact O-CA 3.3Å; K64-L70 HydrophobicContact CB-CD1 4.12Å; L70-R72 HydrophobicContact CD2-CG 4.28Å; L70-V117 HydrophobicContact CB-CG2 3.5Å; L70-V117 HydrophobicContact CD2-CG1 4.35Å; L70-V117 HydrophobicContact CD2-CG2 3.81Å; L70-V117 HydrophobicContact CG-CG2 4.21Å; L70-E129 WeakPolarHBondContact CD2-OE2 3.26Å
71	H	89	Confident	90.6	Very high	30 Å²	30	42.7 Å²	42.7	14%	0.139	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128	178.5	-66.5	-99.8	0	0	0	110	D40 F42 S62 I63 S69 Y73	D40-H71 IonicContact OD2-ND1 2.74Å; D40-H71 PolarHBondContact OD2-ND1 2.79Å; F42-H71 HydrophobicContact CE2-CB 4.37Å; F42-H71 AromaticContact CE2-CG 4Å; F42-H71 AromaticContact CZ-CD2 3.8Å; F42-H71 AromaticContact CZ-CE1 3.5Å; F42-H71 VanDerWaalsContact CZ-CE1 3.5Å; F42-H71 WeakPolarHBondContact CZ-CE1 3.49Å; F42-H71 AromaticContact CZ-CG 3.7Å; F42-H71 AromaticContact CZ-ND1 3.51Å; F42-H71 AromaticContact CZ-NE2 3.7Å; S62-H71 CarbonylContact C-O 3.57Å; S62-H71 WeakPolarHBondContact CA-O 3.41Å; I63-H71 PolarHBondContact N-O 3.18Å; I63-H71 PolarHBondContact O-N 3.26Å; S69-H71 PolarHBondContact OG-NE2 2.8Å; H71-Y73 HydrophobicContact CB-CE2 3.77Å
72	R	91.3	Very high	90.5	Very high	24 Å²	24	49.3 Å²	49.3	9%	0.091	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.9	-175.5	-61	170.1	-179.2	165.2	6.2	110.1	L61 L70 E129	L61-R72 WeakPolarHBondContact O-CA 3.48Å; L70-R72 HydrophobicContact CD2-CG 4.28Å; R72-E129 IonicContact CZ-OE1 3.82Å; R72-E129 IonicContact CZ-OE2 2.89Å; R72-E129 IonicContact NE-OE1 2.79Å; R72-E129 PolarHBondContact NE-OE1 3.46Å; R72-E129 IonicContact NE-OE2 3.46Å; R72-E129 PolarHBondContact NH1-O 3.13Å; R72-E129 IonicContact NH1-OE1 2.8Å; R72-E129 PolarHBondContact NH2-O 3.28Å; R72-E129 IonicContact NH2-OE1 2.98Å; R72-E129 PolarHBondContact NH2-OE1 3.05Å; R72-E129 VanDerWaalsContact NH2-OE1 3.08Å; R72-E129 IonicContact NH2-OE2 2.71Å; R72-E129 PolarHBondContact NH2-OE2 2.79Å
73	Y	94.4	Very high	90.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.1	179.7	-57.1	-71	0	0	0	109.4	T10 Q11 L22 F29 Y31 D40 F42 G60 L61 I63 H71 F76	T10-Y73 CarbonylContact O-C 3.49Å; T10-Y73 WeakPolarHBondContact O-CA 3.32Å; Q11-Y73 HydrophobicContact CB-CD1 4.41Å; Q11-Y73 HydrophobicContact CG-CE1 4.46Å; L22-Y73 HydrophobicContact CD1-CD2 4.5Å; L22-Y73 HydrophobicContact CD1-CG 4.19Å; F29-Y73 HydrophobicContact CE1-CD2 4.11Å; F29-Y73 AromaticContact CE1-CE2 3.41Å; F29-Y73 HydrophobicContact CE1-CE2 3.41Å; F29-Y73 VanDerWaalsContact CE1-CE2 3.41Å; F29-Y73 AromaticContact CE1-CZ 3.65Å; F29-Y73 AromaticContact CZ-CD2 3.6Å; F29-Y73 HydrophobicContact CZ-CD2 3.6Å; F29-Y73 AromaticContact CZ-CE2 3.38Å; F29-Y73 HydrophobicContact CZ-CE2 3.38Å; F29-Y73 HydrophobicContact CZ-CG 4.35Å; Y31-Y73 HydrophobicContact CD1-CD1 4.21Å; Y31-Y73 AromaticContact CD1-CE1 3.57Å; Y31-Y73 HydrophobicContact CD1-CE1 3.57Å; Y31-Y73 AromaticContact CD2-CD1 3.67Å; Y31-Y73 HydrophobicContact CD2-CD1 3.67Å; Y31-Y73 AromaticContact CD2-CE1 3.75Å; Y31-Y73 HydrophobicContact CD2-CE1 3.75Å; Y31-Y73 HydrophobicContact CE1-CD1 4.49Å; Y31-Y73 HydrophobicContact CE1-CE1 4.16Å; Y31-Y73 AromaticContact CE2-CD1 4Å; Y31-Y73 HydrophobicContact CE2-CD1 4Å; Y31-Y73 HydrophobicContact CE2-CE1 4.32Å; Y31-Y73 AromaticContact CG-CD1 3.78Å; Y31-Y73 HydrophobicContact CG-CD1 3.78Å; Y31-Y73 AromaticContact CG-CE1 3.32Å; Y31-Y73 HydrophobicContact CG-CE1 3.32Å; D40-Y73 WeakPolarHBondContact CB-OH 3.49Å; D40-Y73 PolarHBondContact OD2-OH 2.94Å; F42-Y73 WeakPolarHBondContact CE2-OH 3.46Å; G60-Y73 CarbonylContact C-O 3.54Å; G60-Y73 WeakPolarHBondContact CA-O 3.4Å; L61-Y73 PolarHBondContact N-O 2.88Å; L61-Y73 PolarHBondContact O-N 3.42Å; I63-Y73 HydrophobicContact CD1-CD2 4.32Å; I63-Y73 HydrophobicContact CD1-CE2 4.16Å; H71-Y73 HydrophobicContact CB-CE2 3.77Å; Y73-F76 WeakPolarHBondContact O-CE2 3.42Å
74	D	93.2	Very high	90.5	Very high	11 Å²	11	54.8 Å²	54.8	6%	0.059	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	158.2	-170.7	-65.6	-21.1	0	0	0	111.6	I9 T10 R55 G60	I9-D74 WeakPolarHBondContact CG2-O 3.15Å; T10-D74 PolarHBondContact N-O 3.11Å; T10-D74 PolarHBondContact O-N 3.38Å; T10-D74 PolarHBondContact OG1-O 2.83Å; R55-D74 WeakPolarHBondContact CD-OD1 3.47Å; R55-D74 VanDerWaalsContact CD-OD2 3.3Å; R55-D74 WeakPolarHBondContact CD-OD2 3.38Å; R55-D74 IonicContact CZ-OD1 2.77Å; R55-D74 IonicContact CZ-OD2 3.43Å; R55-D74 IonicContact NE-OD1 2.63Å; R55-D74 PolarHBondContact NE-OD1 2.84Å; R55-D74 IonicContact NE-OD2 3.82Å; R55-D74 IonicContact NH1-OD1 3.65Å; R55-D74 IonicContact NH1-OD2 3.88Å; R55-D74 PolarHBondContact NH1-OD2 2.9Å; G60-D74 WeakPolarHBondContact CA-OD1 3.32Å
75	G	91.5	Very high	90.6	Very high	22 Å²	22	54.7 Å²	54.7	23%	0.227	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	104.3	15.2	174.4	0	0	0	0	0	115.5
76	F	93.6	Very high	90.7	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.5	175.4	-63.2	-86.8	0	0	0	111.3	F6 I9 L22 W52 L59 L61 Y73 E80 V84	F6-F76 HydrophobicContact CD2-CE1 4.13Å; F6-F76 HydrophobicContact CE2-CE1 4.12Å; F6-F76 HydrophobicContact CG-CE1 4.44Å; F6-F76 HydrophobicContact CZ-CE1 4.47Å; I9-F76 HydrophobicContact CD1-CD1 3.73Å; I9-F76 HydrophobicContact CD1-CD2 4.1Å; I9-F76 HydrophobicContact CD1-CE1 3.6Å; I9-F76 HydrophobicContact CD1-CE2 3.99Å; I9-F76 HydrophobicContact CD1-CG 3.99Å; I9-F76 HydrophobicContact CD1-CZ 3.76Å; I9-F76 HydrophobicContact CG1-CE1 4.12Å; I9-F76 HydrophobicContact CG1-CZ 4.07Å; I9-F76 HydrophobicContact CG2-CE2 4.15Å; I9-F76 HydrophobicContact CG2-CZ 4.18Å; L22-F76 HydrophobicContact CD1-CZ 3.86Å; W52-F76 HydrophobicContact CH2-CB 4.31Å; W52-F76 HydrophobicContact CH2-CD1 4.32Å; W52-F76 HydrophobicContact CH2-CD2 4.16Å; W52-F76 HydrophobicContact CH2-CG 4.01Å; W52-F76 HydrophobicContact CZ3-CB 4.03Å; W52-F76 AromaticContact CZ3-CD2 3.73Å; W52-F76 HydrophobicContact CZ3-CD2 3.73Å; W52-F76 HydrophobicContact CZ3-CE2 4.33Å; W52-F76 AromaticContact CZ3-CG 3.89Å; W52-F76 HydrophobicContact CZ3-CG 3.89Å; L59-F76 HydrophobicContact CB-CB 4.29Å; L59-F76 PolarHBondContact N-O 2.87Å; L59-F76 WeakPolarHBondContact O-CB 3.44Å; L59-F76 WeakPolarHBondContact O-CD2 3.32Å; L59-F76 PolarHBondContact O-N 2.8Å; L61-F76 HydrophobicContact CB-CD2 4.13Å; L61-F76 HydrophobicContact CB-CE2 3.61Å; L61-F76 HydrophobicContact CB-CZ 4.28Å; L61-F76 HydrophobicContact CD2-CE2 4.45Å; L61-F76 HydrophobicContact CD2-CZ 4.31Å; Y73-F76 WeakPolarHBondContact O-CE2 3.42Å; F76-E80 HydrophobicContact CD1-CB 4.3Å; F76-V84 HydrophobicContact CD1-CG2 4.21Å; F76-V84 HydrophobicContact CE1-CG2 3.89Å
77	G	91.8	Very high	90.9	Very high	33 Å²	33	50.6 Å²	50.6	34%	0.34	28%	0.276	S	S	.	.			trans	-72.7	169	165	0	0	0	0	0	112.3	I79 E80 A81	G77-I79 PolarHBondContact O-N 3.29Å; G77-E80 PolarHBondContact N-OE2 2.89Å; G77-E80 PolarHBondContact O-N 3.02Å; G77-A81 WeakPolarHBondContact O-CB 3.41Å; G77-A81 PolarHBondContact O-N 3.19Å
78	E	90.6	Very high	91.3	Very high	158 Å²	158	45.8 Å²	45.8	74%	0.738	25%	0.25	S	S	*	.	H	α-helix	trans	-58.8	-45.9	179.9	-64.8	-175.9	163.3	0	0	112.6	E80 A81 E82	E78-E80 VanDerWaalsContact C-N 3.29Å; E78-E80 PolarHBondContact O-N 3.44Å; E78-A81 PolarHBondContact O-N 3.39Å; E78-E82 PolarHBondContact O-N 3.5Å
79	I	91.9	Very high	91.8	Very high	120 Å²	120	48.9 Å²	48.9	62%	0.615	26%	0.261	S	S	*	.	H	α-helix	trans	-62.9	-37.5	178.6	-60.8	172	0	0	0	111.3	G77 K83	G77-I79 PolarHBondContact O-N 3.29Å; I79-K83 WeakPolarHBondContact O-CG 3.49Å; I79-K83 PolarHBondContact O-N 2.95Å
80	E	91.5	Very high	92.2	Very high	70 Å²	70	54.6 Å²	54.6	33%	0.327	28%	0.282	S	S	.	.	H	α-helix	trans	-72.2	-41.8	179.6	-61.6	178.9	149.7	0	0	110.7	F6 F76 G77 E78 E82 K83 V84	F6-E80 HydrophobicContact CD1-CB 4.46Å; F6-E80 HydrophobicContact CD1-CG 4.32Å; F6-E80 HydrophobicContact CE1-CB 3.7Å; F6-E80 HydrophobicContact CE1-CG 3.79Å; F6-E80 HydrophobicContact CZ-CB 4.31Å; F76-E80 HydrophobicContact CD1-CB 4.3Å; G77-E80 PolarHBondContact N-OE2 2.89Å; G77-E80 PolarHBondContact O-N 3.02Å; E78-E80 VanDerWaalsContact C-N 3.29Å; E78-E80 PolarHBondContact O-N 3.44Å; E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.77Å; E80-K83 WeakPolarHBondContact O-CB 3.39Å; E80-K83 PolarHBondContact O-N 3.36Å; E80-V84 WeakPolarHBondContact O-CG2 3.38Å; E80-V84 PolarHBondContact O-N 3.35Å
81	A	91.9	Very high	92.5	Very high	7 Å²	7	55.4 Å²	55.4	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-39.2	175.6	0	0	0	0	0	112.2	W52 L59 G77 E78 V84 G85	W52-A81 HydrophobicContact CD2-CB 4.38Å; W52-A81 HydrophobicContact CH2-CB 3.85Å; W52-A81 HydrophobicContact CZ2-CB 3.69Å; W52-A81 WeakPolarHBondContact CZ2-O 3.35Å; W52-A81 HydrophobicContact CZ3-CB 4.24Å; L59-A81 HydrophobicContact CD1-CB 3.52Å; G77-A81 WeakPolarHBondContact O-CB 3.41Å; G77-A81 PolarHBondContact O-N 3.19Å; E78-A81 PolarHBondContact O-N 3.39Å; A81-V84 PolarHBondContact O-N 2.86Å; A81-G85 PolarHBondContact O-N 2.87Å
82	E	92.8	Very high	92.6	Very high	140 Å²	140	54.6 Å²	54.6	65%	0.654	28%	0.28	S	S	*	.	H	α-helix	trans	-63.5	-41.7	173.7	-74	-178	176.3	0	0	112.6	E78 E80 G85 S86	E78-E82 PolarHBondContact O-N 3.5Å; E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.77Å; E82-G85 PolarHBondContact O-N 2.85Å; E82-S86 WeakPolarHBondContact O-CB 3.28Å; E82-S86 PolarHBondContact O-N 2.84Å; E82-S86 PolarHBondContact O-OG 3.3Å
83	K	92.7	Very high	92.6	Very high	117 Å²	117	60.8 Å²	60.8	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.2	-71.9	173	-176.8	175.8	0	111.2	I79 E80 S86 F87	I79-K83 WeakPolarHBondContact O-CG 3.49Å; I79-K83 PolarHBondContact O-N 2.95Å; E80-K83 WeakPolarHBondContact O-CB 3.39Å; E80-K83 PolarHBondContact O-N 3.36Å; K83-S86 PolarHBondContact O-N 2.89Å; K83-F87 WeakPolarHBondContact O-CB 3.11Å; K83-F87 PolarHBondContact O-N 3.2Å
84	V	93.8	Very high	92.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-44.4	177.7	173.8	0	0	0	0	111	F6 L24 W52 L61 F76 E80 A81 S86 F87 F88 I96	F6-V84 HydrophobicContact CE2-CG2 3.56Å; F6-V84 HydrophobicContact CZ-CG2 3.58Å; L24-V84 HydrophobicContact CD1-CG1 4.29Å; L24-V84 HydrophobicContact CD1-CG2 4.16Å; W52-V84 HydrophobicContact CH2-CB 4.09Å; W52-V84 HydrophobicContact CH2-CG1 3.97Å; W52-V84 HydrophobicContact CZ2-CB 3.94Å; W52-V84 HydrophobicContact CZ2-CG1 3.86Å; L61-V84 HydrophobicContact CD2-CG1 4.1Å; F76-V84 HydrophobicContact CD1-CG2 4.21Å; F76-V84 HydrophobicContact CE1-CG2 3.89Å; E80-V84 WeakPolarHBondContact O-CG2 3.38Å; E80-V84 PolarHBondContact O-N 3.35Å; A81-V84 PolarHBondContact O-N 2.86Å; V84-S86 PolarHBondContact O-N 3.48Å; V84-F87 WeakPolarHBondContact O-CB 3.21Å; V84-F87 PolarHBondContact O-N 2.93Å; V84-F87 VanDerWaalsContact O-N 3.14Å; V84-F88 HydrophobicContact CG1-CD2 3.8Å; V84-F88 HydrophobicContact CG1-CE2 3.76Å; V84-F88 WeakPolarHBondContact O-CD2 3.36Å; V84-F88 PolarHBondContact O-N 3Å; V84-I96 HydrophobicContact CG1-CD1 3.94Å
85	G	93.9	Very high	92.4	Very high	20 Å²	20	67.5 Å²	67.5	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-43.7	176.7	0	0	0	0	0	112.8	A81 E82 F87 F88 K89	A81-G85 PolarHBondContact O-N 2.87Å; E82-G85 PolarHBondContact O-N 2.85Å; G85-F87 VanDerWaalsContact C-N 3.29Å; G85-F87 PolarHBondContact O-N 3.37Å; G85-F88 PolarHBondContact O-N 3.04Å; G85-K89 WeakPolarHBondContact O-CB 3.39Å; G85-K89 PolarHBondContact O-N 3.19Å
86	S	93.2	Very high	92.6	Very high	82 Å²	82	67.4 Å²	67.4	57%	0.573	34%	0.341	S	S	*	.	H	α-helix	trans	-63.5	-36.5	174.8	-59	0	0	0	0	112.1	E82 K83 V84 K90	E82-S86 WeakPolarHBondContact O-CB 3.28Å; E82-S86 PolarHBondContact O-N 2.84Å; E82-S86 PolarHBondContact O-OG 3.3Å; K83-S86 PolarHBondContact O-N 2.89Å; V84-S86 PolarHBondContact O-N 3.48Å; S86-K90 VanDerWaalsContact O-CB 3.29Å; S86-K90 WeakPolarHBondContact O-CB 3.23Å; S86-K90 PolarHBondContact O-N 3.29Å; S86-K90 VanDerWaalsContact O-N 3.15Å
87	F	93.7	Very high	92.5	Very high	7 Å²	7	71.6 Å²	71.6	3%	0.031	37%	0.366	C	S	.	.	H	α-helix	trans	-66.8	-49.9	177	-171.5	-84.8	0	0	0	112	A2 I4 L24 K25 K83 V84 G85 K89 K90 Y91 F92	A2-F87 VanDerWaalsContact O-CE2 3.28Å; A2-F87 WeakPolarHBondContact O-CE2 3.35Å; I4-F87 HydrophobicContact CD1-CB 3.86Å; I4-F87 HydrophobicContact CD1-CD2 3.49Å; I4-F87 VanDerWaalsContact CD1-CD2 3.49Å; I4-F87 HydrophobicContact CD1-CE2 4.37Å; I4-F87 HydrophobicContact CD1-CG 3.92Å; I4-F87 HydrophobicContact CG1-CD2 3.96Å; I4-F87 HydrophobicContact CG1-CE2 4.37Å; L24-F87 HydrophobicContact CB-CD1 4.02Å; L24-F87 HydrophobicContact CB-CE1 3.69Å; L24-F87 HydrophobicContact CB-CE2 4.36Å; L24-F87 HydrophobicContact CB-CZ 3.87Å; L24-F87 HydrophobicContact CD1-CD1 3.96Å; L24-F87 HydrophobicContact CD1-CE1 4.45Å; L24-F87 HydrophobicContact CD1-CG 4.26Å; K25-F87 VanDerWaalsContact C-CZ 3.45Å; K25-F87 VanDerWaalsContact O-CZ 3.31Å; K25-F87 WeakPolarHBondContact O-CZ 3.18Å; K83-F87 WeakPolarHBondContact O-CB 3.11Å; K83-F87 PolarHBondContact O-N 3.2Å; V84-F87 WeakPolarHBondContact O-CB 3.21Å; V84-F87 PolarHBondContact O-N 2.93Å; V84-F87 VanDerWaalsContact O-N 3.14Å; G85-F87 VanDerWaalsContact C-N 3.29Å; G85-F87 PolarHBondContact O-N 3.37Å; F87-K89 PolarHBondContact O-N 3.41Å; F87-K90 PolarHBondContact O-N 2.89Å; F87-Y91 HydrophobicContact CD1-CD2 4.16Å; F87-Y91 AromaticContact CD2-CD2 3.56Å; F87-Y91 HydrophobicContact CD2-CD2 3.56Å; F87-Y91 AromaticContact CD2-CE2 3.69Å; F87-Y91 HydrophobicContact CD2-CE2 3.69Å; F87-Y91 AromaticContact CE1-CD2 3.98Å; F87-Y91 HydrophobicContact CE1-CD2 3.98Å; F87-Y91 AromaticContact CE2-CD2 3.37Å; F87-Y91 HydrophobicContact CE2-CD2 3.37Å; F87-Y91 AromaticContact CE2-CE2 3.5Å; F87-Y91 HydrophobicContact CE2-CE2 3.5Å; F87-Y91 VanDerWaalsContact CE2-CE2 3.5Å; F87-Y91 HydrophobicContact CE2-CG 4.38Å; F87-Y91 AromaticContact CG-CD2 3.95Å; F87-Y91 HydrophobicContact CG-CD2 3.95Å; F87-Y91 HydrophobicContact CG-CE2 4.47Å; F87-Y91 AromaticContact CZ-CD2 3.59Å; F87-Y91 HydrophobicContact CZ-CD2 3.59Å; F87-Y91 HydrophobicContact CZ-CE2 4.14Å; F87-Y91 HydrophobicContact CZ-CG 4.22Å; F87-Y91 PolarHBondContact O-N 3.45Å; F87-F92 HydrophobicContact CD1-CE2 4.23Å; F87-F92 HydrophobicContact CD1-CZ 4.45Å; F87-F92 HydrophobicContact CE1-CE1 4.22Å; F87-F92 AromaticContact CE1-CE2 3.98Å; F87-F92 HydrophobicContact CE1-CE2 3.98Å; F87-F92 AromaticContact CE1-CZ 3.75Å; F87-F92 HydrophobicContact CE1-CZ 3.75Å
88	F	93.7	Very high	92.6	Very high	0 Å²	0	77 Å²	77	0%	0	38%	0.38	C	S	.	.	I	π-helix	trans	-59.8	-45.6	178.7	-90.3	-120.6	0	0	0	111.4	L24 F29 I47 A50 L61 I63 V84 G85 K90 F92 D93 V94 I96	L24-F88 HydrophobicContact CD1-CE2 4.23Å; L24-F88 HydrophobicContact CD2-CE2 4.25Å; F29-F88 HydrophobicContact CD2-CE2 4.36Å; F29-F88 AromaticContact CD2-CZ 3.99Å; F29-F88 HydrophobicContact CD2-CZ 3.99Å; F29-F88 HydrophobicContact CE2-CZ 4.2Å; I47-F88 HydrophobicContact CD1-CE1 4.38Å; A50-F88 HydrophobicContact CB-CD1 4.06Å; A50-F88 HydrophobicContact CB-CE1 3.89Å; L61-F88 HydrophobicContact CD2-CE2 4.42Å; L61-F88 HydrophobicContact CD2-CZ 4.14Å; I63-F88 HydrophobicContact CD1-CE1 4.33Å; I63-F88 HydrophobicContact CD1-CZ 3.89Å; V84-F88 HydrophobicContact CG1-CD2 3.8Å; V84-F88 HydrophobicContact CG1-CE2 3.76Å; V84-F88 WeakPolarHBondContact O-CD2 3.36Å; V84-F88 PolarHBondContact O-N 3Å; G85-F88 PolarHBondContact O-N 3.04Å; F88-K90 VanDerWaalsContact C-N 3.29Å; F88-K90 PolarHBondContact O-N 2.88Å; F88-F92 HydrophobicContact CB-CD2 4.43Å; F88-F92 AromaticContact CD1-CD2 3.8Å; F88-F92 HydrophobicContact CD1-CD2 3.8Å; F88-F92 AromaticContact CD2-CD2 3.84Å; F88-F92 HydrophobicContact CD2-CD2 3.84Å; F88-F92 HydrophobicContact CD2-CE2 4.06Å; F88-F92 AromaticContact CE1-CD2 3.91Å; F88-F92 HydrophobicContact CE1-CD2 3.91Å; F88-F92 HydrophobicContact CE1-CE2 4.36Å; F88-F92 AromaticContact CE2-CD2 3.95Å; F88-F92 HydrophobicContact CE2-CD2 3.95Å; F88-F92 AromaticContact CE2-CE2 3.82Å; F88-F92 HydrophobicContact CE2-CE2 3.82Å; F88-F92 AromaticContact CG-CD2 3.76Å; F88-F92 HydrophobicContact CG-CD2 3.76Å; F88-F92 HydrophobicContact CG-CE2 4.44Å; F88-F92 AromaticContact CZ-CD2 3.98Å; F88-F92 HydrophobicContact CZ-CD2 3.98Å; F88-F92 AromaticContact CZ-CE2 3.97Å; F88-F92 HydrophobicContact CZ-CE2 3.97Å; F88-F92 CarbonylContact O-C 3.52Å; F88-F92 WeakPolarHBondContact O-CA 2.82Å; F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 3.3Å; F88-D93 PolarHBondContact O-N 2.8Å; F88-V94 CarbonylContact C-O 3.45Å; F88-V94 WeakPolarHBondContact CB-O 3.43Å; F88-V94 HydrophobicContact CD1-CB 4.37Å; F88-V94 HydrophobicContact CD1-CG1 4.43Å; F88-V94 PolarHBondContact O-N 3.24Å; F88-I96 HydrophobicContact CB-CD1 3.92Å; F88-I96 HydrophobicContact CB-CG1 3.93Å; F88-I96 HydrophobicContact CD1-CD1 3.96Å; F88-I96 HydrophobicContact CD1-CG1 4.02Å; F88-I96 HydrophobicContact CD2-CD1 4.04Å; F88-I96 HydrophobicContact CG-CD1 3.7Å; F88-I96 HydrophobicContact CG-CG1 4.03Å
89	K	93	Very high	92.5	Very high	127 Å²	127	73.4 Å²	73.4	55%	0.552	36%	0.36	S	S	*	.	I	π-helix	trans	-61.8	-37	177.1	-173.1	168.3	-172.7	157.8	0	112.7	G85 F87 V94 E95	G85-K89 WeakPolarHBondContact O-CB 3.39Å; G85-K89 PolarHBondContact O-N 3.19Å; F87-K89 PolarHBondContact O-N 3.41Å; K89-V94 PolarHBondContact N-O 2.95Å; K89-E95 IonicContact NZ-OE1 3.15Å
90	K	92.4	Very high	92.4	Very high	148 Å²	148	74.5 Å²	74.5	64%	0.643	36%	0.362	S	S	*	.	I	π-helix	trans	-79.6	-42.8	-176.3	-174.7	179.1	178.6	-164.6	0	113.4	S86 F87 F88	S86-K90 VanDerWaalsContact O-CB 3.29Å; S86-K90 WeakPolarHBondContact O-CB 3.23Å; S86-K90 PolarHBondContact O-N 3.29Å; S86-K90 VanDerWaalsContact O-N 3.15Å; F87-K90 PolarHBondContact O-N 2.89Å; F88-K90 VanDerWaalsContact C-N 3.29Å; F88-K90 PolarHBondContact O-N 2.88Å
91	Y	92.1	Very high	92.3	Very high	46 Å²	46	73.6 Å²	73.6	18%	0.18	36%	0.36	C	S	.	.	I	π-helix	trans	-109	-31.3	-169	-64	-68.7	0	0	0	113.7	E26 F87	E26-Y91 HydrophobicContact CB-CD1 3.96Å; E26-Y91 HydrophobicContact CB-CE1 4.26Å; E26-Y91 HydrophobicContact CB-CG 4.47Å; E26-Y91 HydrophobicContact CG-CD1 3.9Å; E26-Y91 HydrophobicContact CG-CE1 3.69Å; F87-Y91 HydrophobicContact CD1-CD2 4.16Å; F87-Y91 AromaticContact CD2-CD2 3.56Å; F87-Y91 HydrophobicContact CD2-CD2 3.56Å; F87-Y91 AromaticContact CD2-CE2 3.69Å; F87-Y91 HydrophobicContact CD2-CE2 3.69Å; F87-Y91 AromaticContact CE1-CD2 3.98Å; F87-Y91 HydrophobicContact CE1-CD2 3.98Å; F87-Y91 AromaticContact CE2-CD2 3.37Å; F87-Y91 HydrophobicContact CE2-CD2 3.37Å; F87-Y91 AromaticContact CE2-CE2 3.5Å; F87-Y91 HydrophobicContact CE2-CE2 3.5Å; F87-Y91 VanDerWaalsContact CE2-CE2 3.5Å; F87-Y91 HydrophobicContact CE2-CG 4.38Å; F87-Y91 AromaticContact CG-CD2 3.95Å; F87-Y91 HydrophobicContact CG-CD2 3.95Å; F87-Y91 HydrophobicContact CG-CE2 4.47Å; F87-Y91 AromaticContact CZ-CD2 3.59Å; F87-Y91 HydrophobicContact CZ-CD2 3.59Å; F87-Y91 HydrophobicContact CZ-CE2 4.14Å; F87-Y91 HydrophobicContact CZ-CG 4.22Å; F87-Y91 PolarHBondContact O-N 3.45Å
92	F	91	Very high	92.2	Very high	14 Å²	14	74.4 Å²	74.4	6%	0.061	36%	0.364	C	S	.	.	I	π-helix	trans	-101	-10.1	-178.8	-57.9	-25.2	0	0	0	113.4	R44 I47 F87 F88 V94	R44-F92 HydrophobicContact CB-CD1 3.41Å; R44-F92 VanDerWaalsContact CB-CD1 3.41Å; R44-F92 HydrophobicContact CB-CE1 3.85Å; R44-F92 HydrophobicContact CB-CG 4.27Å; I47-F92 HydrophobicContact CD1-CD2 3.98Å; I47-F92 HydrophobicContact CD1-CE2 4.03Å; F87-F92 HydrophobicContact CD1-CE2 4.23Å; F87-F92 HydrophobicContact CD1-CZ 4.45Å; F87-F92 HydrophobicContact CE1-CE1 4.22Å; F87-F92 AromaticContact CE1-CE2 3.98Å; F87-F92 HydrophobicContact CE1-CE2 3.98Å; F87-F92 AromaticContact CE1-CZ 3.75Å; F87-F92 HydrophobicContact CE1-CZ 3.75Å; F88-F92 HydrophobicContact CB-CD2 4.43Å; F88-F92 AromaticContact CD1-CD2 3.8Å; F88-F92 HydrophobicContact CD1-CD2 3.8Å; F88-F92 AromaticContact CD2-CD2 3.84Å; F88-F92 HydrophobicContact CD2-CD2 3.84Å; F88-F92 HydrophobicContact CD2-CE2 4.06Å; F88-F92 AromaticContact CE1-CD2 3.91Å; F88-F92 HydrophobicContact CE1-CD2 3.91Å; F88-F92 HydrophobicContact CE1-CE2 4.36Å; F88-F92 AromaticContact CE2-CD2 3.95Å; F88-F92 HydrophobicContact CE2-CD2 3.95Å; F88-F92 AromaticContact CE2-CE2 3.82Å; F88-F92 HydrophobicContact CE2-CE2 3.82Å; F88-F92 AromaticContact CG-CD2 3.76Å; F88-F92 HydrophobicContact CG-CD2 3.76Å; F88-F92 HydrophobicContact CG-CE2 4.44Å; F88-F92 AromaticContact CZ-CD2 3.98Å; F88-F92 HydrophobicContact CZ-CD2 3.98Å; F88-F92 AromaticContact CZ-CE2 3.97Å; F88-F92 HydrophobicContact CZ-CE2 3.97Å; F88-F92 CarbonylContact O-C 3.52Å; F88-F92 WeakPolarHBondContact O-CA 2.82Å; F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 3.3Å; F92-V94 HydrophobicContact CB-CG2 4.44Å; F92-V94 PolarHBondContact O-N 3.01Å
93	D	91.2	Very high	91.9	Very high	154 Å²	154	77.4 Å²	77.4	82%	0.824	37%	0.371	S	S	*	.			trans	56.8	33.5	-175.5	-159.9	32.3	0	0	0	112.7	F88	F88-D93 PolarHBondContact O-N 2.8Å
94	V	91.7	Very high	91.7	Very high	18 Å²	18	77.4 Å²	77.4	11%	0.109	37%	0.371	C	S	.	.			trans	-119.7	124.8	179.2	175.8	0	0	0	0	109.2	I47 A50 F88 K89 F92	I47-V94 HydrophobicContact CG2-CG2 4.3Å; A50-V94 HydrophobicContact CB-CG1 4.11Å; F88-V94 CarbonylContact C-O 3.45Å; F88-V94 WeakPolarHBondContact CB-O 3.43Å; F88-V94 HydrophobicContact CD1-CB 4.37Å; F88-V94 HydrophobicContact CD1-CG1 4.43Å; F88-V94 PolarHBondContact O-N 3.24Å; K89-V94 PolarHBondContact N-O 2.95Å; F92-V94 HydrophobicContact CB-CG2 4.44Å; F92-V94 PolarHBondContact O-N 3.01Å
95	E	93.4	Very high	91.4	Very high	133 Å²	133	80.3 Å²	80.3	62%	0.621	40%	0.401	S	S	*	.			trans	-87.1	123.7	170.8	-175.4	160.3	-134.2	0	0	110	K89 V97	K89-E95 IonicContact NZ-OE1 3.15Å; E95-V97 PolarHBondContact O-N 3.46Å
96	I	93.8	Very high	91.2	Very high	20 Å²	20	83.6 Å²	83.6	10%	0.103	41%	0.408	C	S	.	.			trans	-83	109	-179.4	-45.7	-177.4	0	0	0	109.3	A50 W52 L61 V84 F88	A50-I96 HydrophobicContact CB-CB 4.5Å; A50-I96 HydrophobicContact CB-CG1 4.06Å; A50-I96 HydrophobicContact CB-CG2 4.11Å; A50-I96 WeakPolarHBondContact O-CA 3.22Å; W52-I96 HydrophobicContact CD2-CG2 4Å; W52-I96 HydrophobicContact CG-CG2 3.73Å; W52-I96 HydrophobicContact CZ2-CD1 3.87Å; W52-I96 VanDerWaalsContact NE1-CG2 3.31Å; L61-I96 HydrophobicContact CD1-CD1 3.92Å; L61-I96 HydrophobicContact CD1-CG2 4.04Å; V84-I96 HydrophobicContact CG1-CD1 3.94Å; F88-I96 HydrophobicContact CB-CD1 3.92Å; F88-I96 HydrophobicContact CB-CG1 3.93Å; F88-I96 HydrophobicContact CD1-CD1 3.96Å; F88-I96 HydrophobicContact CD1-CG1 4.02Å; F88-I96 HydrophobicContact CD2-CD1 4.04Å; F88-I96 HydrophobicContact CG-CD1 3.7Å; F88-I96 HydrophobicContact CG-CG1 4.03Å
97	V	93.3	Very high	91	Very high	90 Å²	90	86.7 Å²	86.7	55%	0.545	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.2	-177	-177.1	0	0	0	0	110.4	A50 Q51 W52 E95 R99	A50-V97 PolarHBondContact O-N 3.22Å; Q51-V97 CarbonylContact C-O 3.58Å; Q51-V97 WeakPolarHBondContact CA-O 3.44Å; Q51-V97 VanDerWaalsContact CB-O 3.3Å; Q51-V97 WeakPolarHBondContact CB-O 3.46Å; W52-V97 PolarHBondContact N-O 3.18Å; E95-V97 PolarHBondContact O-N 3.46Å; V97-R99 PolarHBondContact O-N 2.95Å
98	K	92.3	Very high	90.8	Very high	146 Å²	146	94.2 Å²	94.2	64%	0.635	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	118.7	171.7	-171	175.3	-178.3	175.6	0	109.8	W52	W52-K98 HydrophobicContact CB-CB 4.5Å; W52-K98 HydrophobicContact CB-CG 4.49Å
99	R	90.3	Very high	90.7	Very high	83 Å²	83	95.9 Å²	95.9	31%	0.313	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-84.6	132.6	178.9	-163.9	71.2	172.3	-144.3	2.1	110	W52 I53 V97 E119 M126	W52-R99 PolarHBondContact O-N 3.27Å; I53-R99 HydrophobicContact CG1-CB 4.29Å; V97-R99 PolarHBondContact O-N 2.95Å; R99-E119 IonicContact CZ-OE1 2.95Å; R99-E119 IonicContact CZ-OE2 3.59Å; R99-E119 VanDerWaalsContact NH2-CD 3.3Å; R99-E119 IonicContact NH2-OE1 2.88Å; R99-E119 PolarHBondContact NH2-OE1 2.91Å; R99-E119 IonicContact NH2-OE2 3.78Å; R99-E119 PolarHBondContact NH2-OE2 3.44Å; R99-M126 HydrophobicContact CG-CB 4.41Å; R99-M126 HydrophobicContact CG-CE 4.43Å
100	E	89.3	Confident	90.6	Very high	142 Å²	142	93.9 Å²	93.9	66%	0.664	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-79.8	132.8	175.4	-170.4	175.8	-178.6	0	0	110.7	A125 M126	E100-A125 HydrophobicContact CG-CB 4.28Å; E100-M126 PolarHBondContact O-N 2.8Å
101	L	89.6	Confident	90.5	Very high	52 Å²	52	87.9 Å²	87.9	27%	0.272	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-103.9	140.2	178.9	-69.4	177	0	0	0	111.6	I53 V54 Y103 M126	I53-L101 HydrophobicContact CG2-CD1 3.84Å; I53-L101 HydrophobicContact CG2-CD2 4.05Å; I53-L101 HydrophobicContact CG2-CG 4.25Å; V54-L101 HydrophobicContact CB-CD1 4.5Å; V54-L101 WeakPolarHBondContact O-CD1 3.44Å; L101-Y103 WeakPolarHBondContact O-CD1 3.47Å; L101-Y103 PolarHBondContact O-N 3.2Å; L101-M126 CarbonylContact C-O 3.57Å; L101-M126 VanDerWaalsContact CA-O 3.27Å; L101-M126 WeakPolarHBondContact CA-O 3.07Å; L101-M126 HydrophobicContact CD2-CB 4.33Å; L101-M126 HydrophobicContact CD2-CE 3.32Å; L101-M126 WeakPolarHBondContact CD2-O 3.31Å
102	C	89	Confident	90.5	Very high	23 Å²	23	89.9 Å²	89.9	16%	0.155	45%	0.449	C	S	.	.			trans	-87.2	107.7	171.1	-174.4	0	0	0	0	110.9	V122 A125 M126 A127	C102-V122 HydrophobicContact CB-CB 4.1Å; C102-A125 HydrophobicContact CB-CB 3.92Å; C102-M126 PolarHBondContact N-O 3.32Å; C102-A127 HydrophobicContact CB-CB 4.22Å
103	Y	86.9	Confident	90.4	Very high	204 Å²	204	91.4 Å²	91.4	80%	0.8	46%	0.456	S	S	*	.			trans	-96.6	11.6	175.9	50.8	-92.9	0	0	0	113.6	L101 G105	L101-Y103 WeakPolarHBondContact O-CD1 3.47Å; L101-Y103 PolarHBondContact O-N 3.2Å; Y103-G105 VanDerWaalsContact C-N 3.32Å; Y103-G105 PolarHBondContact O-N 3.08Å
104	K	88.8	Confident	90.2	Very high	117 Å²	117	87 Å²	87	51%	0.509	43%	0.432	S	S	.	.	S	Bend	trans	-77	-15.6	-174.8	-65.7	-178.1	-179.8	170.9	0	114.2	Y106	K104-Y106 VanDerWaalsContact C-N 3.27Å; K104-Y106 HydrophobicContact CB-CD1 4.15Å; K104-Y106 HydrophobicContact CB-CD2 4.14Å; K104-Y106 HydrophobicContact CB-CE1 4.21Å; K104-Y106 HydrophobicContact CB-CE2 4.2Å; K104-Y106 HydrophobicContact CB-CG 4.12Å; K104-Y106 HydrophobicContact CD-CD2 4.28Å; K104-Y106 HydrophobicContact CD-CE2 3.8Å; K104-Y106 PolarHBondContact O-N 3.4Å
105	G	86.3	Confident	89.7	Confident	61 Å²	61	86.7 Å²	86.7	63%	0.629	43%	0.432	S	S	*	.			trans	67.9	25.4	-176.2	0	0	0	0	0	113.8	Y103	Y103-G105 VanDerWaalsContact C-N 3.32Å; Y103-G105 PolarHBondContact O-N 3.08Å
106	Y	90	Very high	89.4	Confident	88 Å²	88	82.8 Å²	82.8	35%	0.345	42%	0.415	S	S	.	.			trans	-78	133.3	173.8	-65.8	-14.6	0	0	0	110.3	K104 W108 V122	K104-Y106 VanDerWaalsContact C-N 3.27Å; K104-Y106 HydrophobicContact CB-CD1 4.15Å; K104-Y106 HydrophobicContact CB-CD2 4.14Å; K104-Y106 HydrophobicContact CB-CE1 4.21Å; K104-Y106 HydrophobicContact CB-CE2 4.2Å; K104-Y106 HydrophobicContact CB-CG 4.12Å; K104-Y106 HydrophobicContact CD-CD2 4.28Å; K104-Y106 HydrophobicContact CD-CE2 3.8Å; K104-Y106 PolarHBondContact O-N 3.4Å; Y106-W108 AromaticContact CD1-CH2 3.58Å; Y106-W108 HydrophobicContact CD1-CH2 3.58Å; Y106-W108 AromaticContact CD1-CZ2 3.65Å; Y106-W108 HydrophobicContact CD1-CZ2 3.65Å; Y106-W108 HydrophobicContact CD1-CZ3 4.34Å; Y106-W108 AromaticContact CD2-CE2 3.89Å; Y106-W108 HydrophobicContact CD2-CH2 4.37Å; Y106-W108 AromaticContact CD2-CZ2 3.58Å; Y106-W108 HydrophobicContact CD2-CZ2 3.58Å; Y106-W108 AromaticContact CE1-CH2 3.95Å; Y106-W108 HydrophobicContact CE1-CH2 3.95Å; Y106-W108 AromaticContact CE1-CZ2 3.95Å; Y106-W108 HydrophobicContact CE1-CZ2 3.95Å; Y106-W108 AromaticContact CE2-CZ2 3.89Å; Y106-W108 HydrophobicContact CE2-CZ2 3.89Å; Y106-W108 AromaticContact CG-CE2 3.84Å; Y106-W108 AromaticContact CG-CH2 3.83Å; Y106-W108 HydrophobicContact CG-CH2 3.83Å; Y106-W108 AromaticContact CG-CZ2 3.46Å; Y106-W108 HydrophobicContact CG-CZ2 3.46Å; Y106-W108 VanDerWaalsContact CG-CZ2 3.46Å; Y106-W108 HydrophobicContact CG-CZ3 4.49Å; Y106-V122 HydrophobicContact CD2-CG1 3.94Å
107	N	89.3	Confident	89.2	Confident	147 Å²	147	82.2 Å²	82.2	79%	0.786	41%	0.413	S	S	*	.			trans	-97.1	9.6	-179.2	-59.9	-32.2	0	0	0	112.7
108	W	89.4	Confident	89.2	Confident	165 Å²	165	78 Å²	78	63%	0.625	39%	0.388	S	S	*	.			trans	-116.2	139.2	174.1	60.2	84.2	0	0	0	109.5	Y106 V122	Y106-W108 AromaticContact CD1-CH2 3.58Å; Y106-W108 HydrophobicContact CD1-CH2 3.58Å; Y106-W108 AromaticContact CD1-CZ2 3.65Å; Y106-W108 HydrophobicContact CD1-CZ2 3.65Å; Y106-W108 HydrophobicContact CD1-CZ3 4.34Å; Y106-W108 AromaticContact CD2-CE2 3.89Å; Y106-W108 HydrophobicContact CD2-CH2 4.37Å; Y106-W108 AromaticContact CD2-CZ2 3.58Å; Y106-W108 HydrophobicContact CD2-CZ2 3.58Å; Y106-W108 AromaticContact CE1-CH2 3.95Å; Y106-W108 HydrophobicContact CE1-CH2 3.95Å; Y106-W108 AromaticContact CE1-CZ2 3.95Å; Y106-W108 HydrophobicContact CE1-CZ2 3.95Å; Y106-W108 AromaticContact CE2-CZ2 3.89Å; Y106-W108 HydrophobicContact CE2-CZ2 3.89Å; Y106-W108 AromaticContact CG-CE2 3.84Å; Y106-W108 AromaticContact CG-CH2 3.83Å; Y106-W108 HydrophobicContact CG-CH2 3.83Å; Y106-W108 AromaticContact CG-CZ2 3.46Å; Y106-W108 HydrophobicContact CG-CZ2 3.46Å; Y106-W108 VanDerWaalsContact CG-CZ2 3.46Å; Y106-W108 HydrophobicContact CG-CZ3 4.49Å; W108-V122 WeakPolarHBondContact O-CG2 3.16Å
109	G	91.7	Very high	89.3	Confident	36 Å²	36	71.9 Å²	71.9	37%	0.371	36%	0.361	S	S	.	.			trans	175.6	-177.1	-170.8	0	0	0	0	0	111	S121	G109-S121 CarbonylContact C-O 3.54Å; G109-S121 WeakPolarHBondContact CA-O 3.5Å
110	D	90.7	Very high	89.4	Confident	84 Å²	84	68.7 Å²	68.7	45%	0.449	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139.3	178.2	-67.6	-69.7	0	0	0	109.8	F120 S121	D110-F120 WeakPolarHBondContact O-CA 3.49Å; D110-S121 PolarHBondContact N-O 3.44Å; D110-S121 PolarHBondContact O-N 3.18Å
111	V	91.3	Very high	89.6	Confident	22 Å²	22	62.3 Å²	62.3	13%	0.133	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.4	173.1	178.6	0	0	0	0	107.7	F113 L118 E119 F120 L164 I180	V111-F113 HydrophobicContact CG1-CE2 4.48Å; V111-L118 HydrophobicContact CG1-CD1 3.96Å; V111-L118 HydrophobicContact CG1-CD2 4.02Å; V111-L118 HydrophobicContact CG1-CG 3.78Å; V111-E119 WeakPolarHBondContact CA-O 3.46Å; V111-F120 HydrophobicContact CG2-CD2 3.83Å; V111-F120 HydrophobicContact CG2-CE2 4.35Å; V111-L164 HydrophobicContact CG2-CD1 3.87Å; V111-I180 HydrophobicContact CB-CD1 3.88Å; V111-I180 HydrophobicContact CG1-CD1 3.95Å; V111-I180 HydrophobicContact CG1-CG1 4.34Å; V111-I180 HydrophobicContact CG1-CG2 4.28Å; V111-I180 HydrophobicContact CG2-CD1 4.27Å
112	D	90.8	Very high	89.7	Confident	89 Å²	89	60 Å²	60	48%	0.476	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	164.4	176	-70.7	-48	0	0	0	110.5	E119	D112-E119 PolarHBondContact N-O 3.47Å; D112-E119 PolarHBondContact O-N 2.91Å
113	F	89.3	Confident	89.7	Confident	46 Å²	46	66.7 Å²	66.7	20%	0.202	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.1	176.9	-69.8	-94.5	0	0	0	108.7	V111 V117 L118 L132 I180 K183 V184	V111-F113 HydrophobicContact CG1-CE2 4.48Å; F113-V117 WeakPolarHBondContact CA-O 3.47Å; F113-L118 HydrophobicContact CD1-CB 4.47Å; F113-L118 HydrophobicContact CE1-CB 4.26Å; F113-L118 HydrophobicContact CE1-CD1 4.26Å; F113-L118 HydrophobicContact CE1-CG 4.46Å; F113-L118 HydrophobicContact CZ-CD1 4.22Å; F113-L132 HydrophobicContact CD1-CD1 4.25Å; F113-L132 HydrophobicContact CE1-CD1 4.28Å; F113-L132 HydrophobicContact CE1-CD2 4.42Å; F113-I180 HydrophobicContact CE2-CB 4.32Å; F113-I180 HydrophobicContact CE2-CG1 4.2Å; F113-I180 HydrophobicContact CE2-CG2 4.09Å; F113-I180 HydrophobicContact CZ-CB 4.34Å; F113-I180 HydrophobicContact CZ-CG2 3.76Å; F113-K183 HydrophobicContact CD1-CB 4.45Å; F113-K183 HydrophobicContact CD2-CB 4.48Å; F113-K183 HydrophobicContact CD2-CD 3.57Å; F113-K183 HydrophobicContact CE1-CB 3.95Å; F113-K183 HydrophobicContact CE2-CB 4Å; F113-K183 HydrophobicContact CE2-CD 3.62Å; F113-K183 HydrophobicContact CE2-CG 4.46Å; F113-K183 HydrophobicContact CG-CD 4.1Å; F113-K183 HydrophobicContact CZ-CB 3.69Å; F113-K183 HydrophobicContact CZ-CD 4.2Å; F113-V184 HydrophobicContact CE1-CG2 3.67Å; F113-V184 HydrophobicContact CZ-CG2 3.78Å
114	D	86.7	Confident	89.5	Confident	61 Å²	61	64.1 Å²	64.1	33%	0.326	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	104.6	169.6	-174.1	16.2	0	0	0	108.5	K64 D116 V117	K64-D114 WeakPolarHBondContact CE-OD1 3.21Å; K64-D114 IonicContact NZ-OD1 2.74Å; K64-D114 PolarHBondContact NZ-OD1 2.76Å; D114-D116 PolarHBondContact O-N 2.86Å; D114-V117 PolarHBondContact N-O 2.85Å; D114-V117 WeakPolarHBondContact O-CB 3.32Å; D114-V117 PolarHBondContact O-N 3.04Å; D114-V117 VanDerWaalsContact O-N 3.13Å
115	G	82.6	Confident	89.6	Confident	11 Å²	11	59 Å²	59	11%	0.113	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	-124.4	-173.6	0	0	0	0	0	112.4	V117 K187	G115-V117 VanDerWaalsContact C-N 3.33Å; G115-K187 PolarHBondContact O-NZ 3.25Å
116	D	86.3	Confident	89.9	Confident	51 Å²	51	56.2 Å²	56.2	27%	0.273	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	33.4	177.6	-62.6	-21.3	0	0	0	112.3	N68 D114 L132 K187	N68-D116 PolarHBondContact O-N 3.2Å; D114-D116 PolarHBondContact O-N 2.86Å; D116-L132 VanDerWaalsContact O-CB 3.32Å; D116-L132 WeakPolarHBondContact O-CB 3.41Å; D116-L132 VanDerWaalsContact O-CG 3.25Å; D116-L132 WeakPolarHBondContact O-CG 3.41Å; D116-L132 PolarHBondContact O-N 3.48Å; D116-K187 IonicContact OD1-NZ 2.83Å; D116-K187 PolarHBondContact OD1-NZ 3.4Å
117	V	90.6	Very high	89.9	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.048	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.5	178.8	-174.6	0	0	0	0	109.5	L70 F113 D114 G115 E129 V130	L70-V117 HydrophobicContact CB-CG2 3.5Å; L70-V117 HydrophobicContact CD2-CG1 4.35Å; L70-V117 HydrophobicContact CD2-CG2 3.81Å; L70-V117 HydrophobicContact CG-CG2 4.21Å; F113-V117 WeakPolarHBondContact CA-O 3.47Å; D114-V117 PolarHBondContact N-O 2.85Å; D114-V117 WeakPolarHBondContact O-CB 3.32Å; D114-V117 PolarHBondContact O-N 3.04Å; D114-V117 VanDerWaalsContact O-N 3.13Å; G115-V117 VanDerWaalsContact C-N 3.33Å; V117-E129 HydrophobicContact CG1-CB 3.8Å; V117-V130 WeakPolarHBondContact CA-O 3.41Å
118	L	92.6	Very high	90	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.2	168	-178.7	155.7	0	0	0	108.3	V111 F113 F128 E129 V130 L132 F147 L164 I180 V184	V111-L118 HydrophobicContact CG1-CD1 3.96Å; V111-L118 HydrophobicContact CG1-CD2 4.02Å; V111-L118 HydrophobicContact CG1-CG 3.78Å; F113-L118 HydrophobicContact CD1-CB 4.47Å; F113-L118 HydrophobicContact CE1-CB 4.26Å; F113-L118 HydrophobicContact CE1-CD1 4.26Å; F113-L118 HydrophobicContact CE1-CG 4.46Å; F113-L118 HydrophobicContact CZ-CD1 4.22Å; L118-F128 HydrophobicContact CD2-CE2 4.28Å; L118-E129 CarbonylContact O-C 3.52Å; L118-E129 VanDerWaalsContact O-CA 3.31Å; L118-E129 WeakPolarHBondContact O-CA 3.25Å; L118-V130 HydrophobicContact CB-CB 4.44Å; L118-V130 PolarHBondContact N-O 2.65Å; L118-V130 PolarHBondContact O-N 3.25Å; L118-L132 HydrophobicContact CB-CD2 4.05Å; L118-F147 HydrophobicContact CD1-CE2 4.08Å; L118-F147 HydrophobicContact CD1-CZ 3.82Å; L118-L164 HydrophobicContact CD2-CD1 4.47Å; L118-I180 HydrophobicContact CD1-CG2 4.3Å; L118-V184 HydrophobicContact CD1-CG2 4.15Å
119	E	93.2	Very high	90.1	Very high	17 Å²	17	43.2 Å²	43.2	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.1	175.8	-172.7	176.2	138.8	0	0	109.6	R99 V111 D112 M126	R99-E119 IonicContact CZ-OE1 2.95Å; R99-E119 IonicContact CZ-OE2 3.59Å; R99-E119 VanDerWaalsContact NH2-CD 3.3Å; R99-E119 IonicContact NH2-OE1 2.88Å; R99-E119 PolarHBondContact NH2-OE1 2.91Å; R99-E119 IonicContact NH2-OE2 3.78Å; R99-E119 PolarHBondContact NH2-OE2 3.44Å; V111-E119 WeakPolarHBondContact CA-O 3.46Å; D112-E119 PolarHBondContact N-O 3.47Å; D112-E119 PolarHBondContact O-N 2.91Å; E119-M126 HydrophobicContact CG-CG 3.91Å; E119-M126 HydrophobicContact CG-SD 4.36Å
120	F	93.8	Very high	90	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.066	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117	168	-174.9	-106.7	0	0	0	109.1	D110 V111 V122 A127 F128	D110-F120 WeakPolarHBondContact O-CA 3.49Å; V111-F120 HydrophobicContact CG2-CD2 3.83Å; V111-F120 HydrophobicContact CG2-CE2 4.35Å; F120-V122 HydrophobicContact CD1-CG2 4.37Å; F120-V122 HydrophobicContact CE1-CG2 3.87Å; F120-A127 HydrophobicContact CD1-CB 3.83Å; F120-A127 HydrophobicContact CE1-CB 4.45Å; F120-A127 WeakPolarHBondContact O-CB 3.2Å; F120-A127 PolarHBondContact O-N 2.76Å; F120-F128 HydrophobicContact CB-CD1 3.82Å; F120-F128 HydrophobicContact CB-CD2 4.05Å; F120-F128 HydrophobicContact CB-CE1 3.42Å; F120-F128 VanDerWaalsContact CB-CE1 3.42Å; F120-F128 HydrophobicContact CB-CE2 3.66Å; F120-F128 HydrophobicContact CB-CG 4.13Å; F120-F128 HydrophobicContact CB-CZ 3.33Å; F120-F128 AromaticContact CD1-CD1 3.8Å; F120-F128 HydrophobicContact CD1-CD1 3.8Å; F120-F128 AromaticContact CD1-CE1 3.29Å; F120-F128 HydrophobicContact CD1-CE1 3.29Å; F120-F128 AromaticContact CD1-CZ 3.98Å; F120-F128 HydrophobicContact CD1-CZ 3.98Å; F120-F128 HydrophobicContact CD2-CE1 4.44Å; F120-F128 HydrophobicContact CD2-CZ 4.37Å; F120-F128 HydrophobicContact CE1-CE1 4.15Å; F120-F128 HydrophobicContact CG-CD1 4.16Å; F120-F128 AromaticContact CG-CE1 3.47Å; F120-F128 HydrophobicContact CG-CE1 3.47Å; F120-F128 VanDerWaalsContact CG-CE1 3.47Å; F120-F128 HydrophobicContact CG-CE2 4.47Å; F120-F128 AromaticContact CG-CZ 3.66Å; F120-F128 HydrophobicContact CG-CZ 3.66Å; F120-F128 PolarHBondContact N-O 2.57Å; F120-F128 PolarHBondContact O-N 2.82Å
121	S	93.1	Very high	90	Very high	8 Å²	8	39 Å²	39	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.3	-176	75.3	0	0	0	0	111.7	G109 D110 A125	G109-S121 CarbonylContact C-O 3.54Å; G109-S121 WeakPolarHBondContact CA-O 3.5Å; D110-S121 PolarHBondContact N-O 3.44Å; D110-S121 PolarHBondContact O-N 3.18Å; S121-A125 CarbonylContact C-O 3.58Å; S121-A125 WeakPolarHBondContact CA-O 3.32Å
122	V	92.4	Very high	89.8	Confident	5 Å²	5	38 Å²	38	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	108.1	177.6	-179.5	0	0	0	0	107.9	C102 Y106 W108 F120 N124 A125 A127	C102-V122 HydrophobicContact CB-CB 4.1Å; Y106-V122 HydrophobicContact CD2-CG1 3.94Å; W108-V122 WeakPolarHBondContact O-CG2 3.16Å; F120-V122 HydrophobicContact CD1-CG2 4.37Å; F120-V122 HydrophobicContact CE1-CG2 3.87Å; V122-N124 VanDerWaalsContact C-N 3.34Å; V122-N124 PolarHBondContact O-N 2.97Å; V122-A125 PolarHBondContact N-O 3.33Å; V122-A125 PolarHBondContact O-N 2.85Å; V122-A127 HydrophobicContact CG2-CB 3.98Å
123	K	87.3	Confident	89.4	Confident	162 Å²	162	36.9 Å²	36.9	70%	0.704	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	48	-176.1	-57.9	-175.6	175.7	-171.6	0	112.5	A125	K123-A125 PolarHBondContact O-N 2.91Å
124	N	84.2	Confident	89.2	Confident	151 Å²	151	36 Å²	36	81%	0.807	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.5	2	-178.3	-53.9	-13.2	0	0	0	116.1	V122	V122-N124 VanDerWaalsContact C-N 3.34Å; V122-N124 PolarHBondContact O-N 2.97Å
125	A	90.6	Very high	89.2	Confident	9 Å²	9	33.1 Å²	33.1	7%	0.074	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.1	170.3	0	0	0	0	0	109.8	E100 C102 S121 V122 K123 A127	E100-A125 HydrophobicContact CG-CB 4.28Å; C102-A125 HydrophobicContact CB-CB 3.92Å; S121-A125 CarbonylContact C-O 3.58Å; S121-A125 WeakPolarHBondContact CA-O 3.32Å; V122-A125 PolarHBondContact N-O 3.33Å; V122-A125 PolarHBondContact O-N 2.85Å; K123-A125 PolarHBondContact O-N 2.91Å; A125-A127 PolarHBondContact O-N 2.88Å
126	M	91.5	Very high	89	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.015	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.4	-179.2	-177.9	-179.5	73.8	0	0	109.6	I53 R99 E100 L101 C102 E119 E129	I53-M126 HydrophobicContact CD1-CE 3.87Å; I53-M126 HydrophobicContact CG1-CE 4.2Å; I53-M126 HydrophobicContact CG2-CE 4.27Å; R99-M126 HydrophobicContact CG-CB 4.41Å; R99-M126 HydrophobicContact CG-CE 4.43Å; E100-M126 PolarHBondContact O-N 2.8Å; L101-M126 CarbonylContact C-O 3.57Å; L101-M126 VanDerWaalsContact CA-O 3.27Å; L101-M126 WeakPolarHBondContact CA-O 3.07Å; L101-M126 HydrophobicContact CD2-CB 4.33Å; L101-M126 HydrophobicContact CD2-CE 3.32Å; L101-M126 WeakPolarHBondContact CD2-O 3.31Å; C102-M126 PolarHBondContact N-O 3.32Å; E119-M126 HydrophobicContact CG-CG 3.91Å; E119-M126 HydrophobicContact CG-SD 4.36Å; M126-E129 HydrophobicContact CE-CG 4.11Å; M126-E129 HydrophobicContact SD-CB 4.05Å; M126-E129 HydrophobicContact SD-CG 3.7Å
127	A	91.8	Very high	88.7	Confident	36 Å²	36	32.2 Å²	32.2	30%	0.298	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-49	174.7	0	0	0	0	0	110.9	C102 F120 V122 A125	C102-A127 HydrophobicContact CB-CB 4.22Å; F120-A127 HydrophobicContact CD1-CB 3.83Å; F120-A127 HydrophobicContact CE1-CB 4.45Å; F120-A127 WeakPolarHBondContact O-CB 3.2Å; F120-A127 PolarHBondContact O-N 2.76Å; V122-A127 HydrophobicContact CG2-CB 3.98Å; A125-A127 PolarHBondContact O-N 2.88Å
128	F	91	Very high	88.4	Confident	70 Å²	70	32 Å²	32	31%	0.307	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	162.1	172.2	65.2	-95.8	0	0	0	111.2	L118 F120 V130 M162 L164	L118-F128 HydrophobicContact CD2-CE2 4.28Å; F120-F128 HydrophobicContact CB-CD1 3.82Å; F120-F128 HydrophobicContact CB-CD2 4.05Å; F120-F128 HydrophobicContact CB-CE1 3.42Å; F120-F128 VanDerWaalsContact CB-CE1 3.42Å; F120-F128 HydrophobicContact CB-CE2 3.66Å; F120-F128 HydrophobicContact CB-CG 4.13Å; F120-F128 HydrophobicContact CB-CZ 3.33Å; F120-F128 AromaticContact CD1-CD1 3.8Å; F120-F128 HydrophobicContact CD1-CD1 3.8Å; F120-F128 AromaticContact CD1-CE1 3.29Å; F120-F128 HydrophobicContact CD1-CE1 3.29Å; F120-F128 AromaticContact CD1-CZ 3.98Å; F120-F128 HydrophobicContact CD1-CZ 3.98Å; F120-F128 HydrophobicContact CD2-CE1 4.44Å; F120-F128 HydrophobicContact CD2-CZ 4.37Å; F120-F128 HydrophobicContact CE1-CE1 4.15Å; F120-F128 HydrophobicContact CG-CD1 4.16Å; F120-F128 AromaticContact CG-CE1 3.47Å; F120-F128 HydrophobicContact CG-CE1 3.47Å; F120-F128 VanDerWaalsContact CG-CE1 3.47Å; F120-F128 HydrophobicContact CG-CE2 4.47Å; F120-F128 AromaticContact CG-CZ 3.66Å; F120-F128 HydrophobicContact CG-CZ 3.66Å; F120-F128 PolarHBondContact N-O 2.57Å; F120-F128 PolarHBondContact O-N 2.82Å; F128-V130 HydrophobicContact CD2-CG2 3.91Å; F128-V130 HydrophobicContact CE2-CG2 4.05Å; F128-M162 HydrophobicContact CE2-CE 4.06Å; F128-M162 HydrophobicContact CE2-SD 3.84Å; F128-M162 HydrophobicContact CZ-SD 4.02Å; F128-L164 HydrophobicContact CZ-CD2 4.33Å
129	E	91.1	Very high	88	Confident	20 Å²	20	33 Å²	33	9%	0.093	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.1	178.4	42.1	157.1	-164.1	0	0	110.6	R55 L70 R72 V117 L118 M126	R55-E129 IonicContact NH2-OE1 3.75Å; L70-E129 WeakPolarHBondContact CD2-OE2 3.26Å; R72-E129 IonicContact CZ-OE1 3.82Å; R72-E129 IonicContact CZ-OE2 2.89Å; R72-E129 IonicContact NE-OE1 2.79Å; R72-E129 PolarHBondContact NE-OE1 3.46Å; R72-E129 IonicContact NE-OE2 3.46Å; R72-E129 PolarHBondContact NH1-O 3.13Å; R72-E129 IonicContact NH1-OE1 2.8Å; R72-E129 PolarHBondContact NH2-O 3.28Å; R72-E129 IonicContact NH2-OE1 2.98Å; R72-E129 PolarHBondContact NH2-OE1 3.05Å; R72-E129 VanDerWaalsContact NH2-OE1 3.08Å; R72-E129 IonicContact NH2-OE2 2.71Å; R72-E129 PolarHBondContact NH2-OE2 2.79Å; V117-E129 HydrophobicContact CG1-CB 3.8Å; L118-E129 CarbonylContact O-C 3.52Å; L118-E129 VanDerWaalsContact O-CA 3.31Å; L118-E129 WeakPolarHBondContact O-CA 3.25Å; M126-E129 HydrophobicContact CE-CG 4.11Å; M126-E129 HydrophobicContact SD-CB 4.05Å; M126-E129 HydrophobicContact SD-CG 3.7Å
130	V	90.4	Very high	87.6	Confident	14 Å²	14	35.1 Å²	35.1	9%	0.085	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112	-176.7	177.6	0	0	0	0	109.8	V117 L118 F128 L132 V135 F149 M162	V117-V130 WeakPolarHBondContact CA-O 3.41Å; L118-V130 HydrophobicContact CB-CB 4.44Å; L118-V130 PolarHBondContact N-O 2.65Å; L118-V130 PolarHBondContact O-N 3.25Å; F128-V130 HydrophobicContact CD2-CG2 3.91Å; F128-V130 HydrophobicContact CE2-CG2 4.05Å; V130-L132 PolarHBondContact O-N 3.31Å; V130-V135 HydrophobicContact CG1-CG2 4.06Å; V130-F149 HydrophobicContact CG1-CE1 3.38Å; V130-F149 HydrophobicContact CG1-CZ 3.75Å; V130-M162 HydrophobicContact CG2-CE 3.96Å; V130-M162 HydrophobicContact CG2-SD 4.49Å
131	P	88.7	Confident	87.2	Confident	17 Å²	17	38.1 Å²	38.1	11%	0.11	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	127.1	169.9	-20.4	33.3	0	0	0	109.8	S133 N134	P131-S133 PolarHBondContact O-N 3.01Å; P131-N134 WeakPolarHBondContact O-CB 2.98Å; P131-N134 PolarHBondContact O-N 3.22Å
132	L	88.1	Confident	86.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-65.7	-22.9	-177.9	-62.2	-178.9	0	0	0	112	F113 D116 L118 V130 N134 V135 V184 K187 A188 D189	F113-L132 HydrophobicContact CD1-CD1 4.25Å; F113-L132 HydrophobicContact CE1-CD1 4.28Å; F113-L132 HydrophobicContact CE1-CD2 4.42Å; D116-L132 VanDerWaalsContact O-CB 3.32Å; D116-L132 WeakPolarHBondContact O-CB 3.41Å; D116-L132 VanDerWaalsContact O-CG 3.25Å; D116-L132 WeakPolarHBondContact O-CG 3.41Å; D116-L132 PolarHBondContact O-N 3.48Å; L118-L132 HydrophobicContact CB-CD2 4.05Å; V130-L132 PolarHBondContact O-N 3.31Å; L132-N134 PolarHBondContact O-N 3.07Å; L132-V135 WeakPolarHBondContact O-CB 3.01Å; L132-V135 PolarHBondContact O-N 3.19Å; L132-V184 HydrophobicContact CD2-CG1 4.26Å; L132-V184 HydrophobicContact CD2-CG2 3.92Å; L132-K187 HydrophobicContact CD1-CB 3.51Å; L132-K187 HydrophobicContact CD1-CD 3.96Å; L132-K187 HydrophobicContact CD1-CG 4.41Å; L132-A188 HydrophobicContact CB-CB 4.2Å; L132-A188 WeakPolarHBondContact O-CA 3.48Å; L132-A188 VanDerWaalsContact O-CB 3.32Å; L132-A188 WeakPolarHBondContact O-CB 3.43Å; L132-D189 PolarHBondContact O-N 3.33Å
133	S	82.8	Confident	86.7	Confident	66 Å²	66	47.4 Å²	47.4	46%	0.462	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-64.8	-12.2	171.2	57.9	0	0	0	0	114.9	R14 P131	R14-S133 PolarHBondContact NH2-O 2.99Å; P131-S133 PolarHBondContact O-N 3.01Å
134	N	85.4	Confident	86.8	Confident	27 Å²	27	43 Å²	43	14%	0.144	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-91.4	-19.1	173.2	-68.3	-13.6	0	0	0	112.4	R14 P131 L132 A136 F149 H150	R14-N134 WeakPolarHBondContact CG-OD1 3.38Å; P131-N134 WeakPolarHBondContact O-CB 2.98Å; P131-N134 PolarHBondContact O-N 3.22Å; L132-N134 PolarHBondContact O-N 3.07Å; N134-A136 PolarHBondContact O-N 3.08Å; N134-F149 HydrophobicContact CB-CD1 4.1Å; N134-F149 WeakPolarHBondContact O-CA 3.3Å; N134-F149 WeakPolarHBondContact O-CD1 3.18Å; N134-H150 PolarHBondContact O-N 2.98Å
135	V	86.1	Confident	87.1	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	117.1	-179.6	-179.3	0	0	0	0	108.6	V130 L132 N137 F147 E148 F149 V184 A188 D189 I190	V130-V135 HydrophobicContact CG1-CG2 4.06Å; L132-V135 WeakPolarHBondContact O-CB 3.01Å; L132-V135 PolarHBondContact O-N 3.19Å; V135-N137 VanDerWaalsContact CG1-O 3.25Å; V135-N137 WeakPolarHBondContact CG1-O 3.36Å; V135-F147 HydrophobicContact CG1-CB 4.39Å; V135-F147 HydrophobicContact CG1-CD1 4.34Å; V135-E148 CarbonylContact C-O 3.52Å; V135-F149 HydrophobicContact CG2-CD1 4.19Å; V135-F149 HydrophobicContact CG2-CE1 3.64Å; V135-F149 HydrophobicContact CG2-CZ 4.25Å; V135-V184 HydrophobicContact CG1-CG1 4.06Å; V135-A188 HydrophobicContact CB-CB 3.82Å; V135-A188 HydrophobicContact CG1-CB 4.07Å; V135-D189 CarbonylContact O-C 3.55Å; V135-D189 PolarHBondContact O-N 3.06Å; V135-I190 PolarHBondContact O-N 2.86Å
136	A	78.1	Confident	87.1	Confident	23 Å²	23	36.3 Å²	36.3	19%	0.19	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-30.7	179.5	0	0	0	0	0	112.6	N134 E148 I190	N134-A136 PolarHBondContact O-N 3.08Å; A136-E148 PolarHBondContact N-O 2.9Å; A136-I190 WeakPolarHBondContact O-CA 3.44Å
137	N	79.3	Confident	87	Confident	21 Å²	21	36.3 Å²	36.3	11%	0.112	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	158.3	179.4	-168.2	19.4	0	0	0	110.2	V135 E148	V135-N137 VanDerWaalsContact CG1-O 3.25Å; V135-N137 WeakPolarHBondContact CG1-O 3.36Å; N137-E148 HydrophobicContact CB-CB 4.15Å; N137-E148 WeakPolarHBondContact CB-OE2 3.48Å; N137-E148 PolarHBondContact N-O 3.45Å; N137-E148 VanDerWaalsContact N-O 3.14Å; N137-E148 PolarHBondContact ND2-OE2 2.79Å; N137-E148 PolarHBondContact O-N 2.86Å
138	A	84.9	Confident	86.7	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.017	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	143.4	170.5	0	0	0	0	0	109.1	I146 F147 Y181 V184 I190	A138-I146 CarbonylContact C-O 3.57Å; A138-I146 VanDerWaalsContact CA-O 3.26Å; A138-I146 WeakPolarHBondContact CA-O 3.49Å; A138-F147 HydrophobicContact CB-CD1 4.03Å; A138-F147 HydrophobicContact CB-CE1 4.36Å; A138-Y181 HydrophobicContact CB-CD2 4.04Å; A138-Y181 HydrophobicContact CB-CE2 3.98Å; A138-Y181 WeakPolarHBondContact O-CE2 3.4Å; A138-V184 HydrophobicContact CB-CG1 4.1Å; A138-I190 HydrophobicContact CB-CD1 4.11Å
139	V	84	Confident	86.5	Confident	24 Å²	24	34 Å²	34	15%	0.145	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.3	176.2	-176.8	0	0	0	0	109.2	I146	V139-I146 HydrophobicContact CB-CB 4.33Å; V139-I146 PolarHBondContact N-O 3.36Å; V139-I146 PolarHBondContact O-N 2.79Å
140	L	85.7	Confident	85.9	Confident	62 Å²	62	35 Å²	35	33%	0.325	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.6	175.9	179.9	66.6	0	0	0	110.1	I145 A177 P178 Y181	L140-I145 HydrophobicContact CD1-CG1 4.26Å; L140-A177 HydrophobicContact CD1-CB 3.7Å; L140-P178 HydrophobicContact CD2-CB 4.22Å; L140-P178 HydrophobicContact CD2-CG 4.26Å; L140-Y181 HydrophobicContact CB-CD1 4.17Å; L140-Y181 HydrophobicContact CB-CD2 3.83Å; L140-Y181 HydrophobicContact CB-CE1 4.48Å; L140-Y181 HydrophobicContact CB-CE2 4.16Å; L140-Y181 HydrophobicContact CB-CG 3.84Å; L140-Y181 HydrophobicContact CD2-CD1 4.28Å; L140-Y181 HydrophobicContact CD2-CG 4.43Å
141	N	85.6	Confident	85.3	Confident	79 Å²	79	37.7 Å²	37.7	42%	0.422	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	86.2	174.3	-179.1	31.5	0	0	0	110.2	N143 E144	N141-N143 PolarHBondContact O-N 2.88Å; N141-E144 HydrophobicContact CB-CB 4.36Å; N141-E144 PolarHBondContact N-O 3.06Å; N141-E144 PolarHBondContact ND2-OE2 2.82Å; N141-E144 WeakPolarHBondContact O-CB 3.5Å; N141-E144 PolarHBondContact O-N 3.19Å
142	K	85.3	Confident	84.7	Confident	175 Å²	175	38.2 Å²	38.2	76%	0.761	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-103.1	-174.6	-58.5	176.2	-179	174.2	0	111.7
143	N	88.5	Confident	84.1	Confident	32 Å²	32	45.5 Å²	45.5	17%	0.171	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	2.3	-177.5	-70.5	4.8	0	0	0	112	N141 Y165 T166 R173 E174	N141-N143 PolarHBondContact O-N 2.88Å; N143-Y165 HydrophobicContact CB-CD2 4.04Å; N143-Y165 HydrophobicContact CB-CE2 3.6Å; N143-Y165 CarbonylContact O-C 3.56Å; N143-Y165 WeakPolarHBondContact O-CA 3.42Å; N143-T166 VanDerWaalsContact CB-O 3.3Å; N143-T166 WeakPolarHBondContact CB-O 3.45Å; N143-T166 PolarHBondContact O-N 3.34Å; N143-T166 PolarHBondContact O-OG1 2.93Å; N143-R173 PolarHBondContact OD1-O 3.19Å; N143-E174 WeakPolarHBondContact OD1-CA 3.09Å; N143-E174 PolarHBondContact OD1-O 2.9Å
144	E	90.2	Very high	83.8	Confident	69 Å²	69	47.5 Å²	47.5	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	140.2	179.2	-62.8	176.6	159	0	0	110.5	N141 L164 Y165	N141-E144 HydrophobicContact CB-CB 4.36Å; N141-E144 PolarHBondContact N-O 3.06Å; N141-E144 PolarHBondContact ND2-OE2 2.82Å; N141-E144 WeakPolarHBondContact O-CB 3.5Å; N141-E144 PolarHBondContact O-N 3.19Å; E144-L164 CarbonylContact C-O 3.56Å; E144-L164 VanDerWaalsContact CA-O 3.29Å; E144-L164 WeakPolarHBondContact CA-O 3.39Å; E144-Y165 HydrophobicContact CG-CD2 3.91Å
145	I	90.9	Very high	83.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	171	-44.6	169.3	0	0	0	107.4	L140 F147 R163 L164 A177 I180 Y181	L140-I145 HydrophobicContact CD1-CG1 4.26Å; I145-F147 HydrophobicContact CB-CE1 4.44Å; I145-F147 HydrophobicContact CB-CE2 4.45Å; I145-F147 HydrophobicContact CB-CZ 4.08Å; I145-F147 HydrophobicContact CD1-CZ 4.32Å; I145-F147 HydrophobicContact CG2-CD1 4.1Å; I145-F147 HydrophobicContact CG2-CE1 3.44Å; I145-F147 VanDerWaalsContact CG2-CE1 3.44Å; I145-F147 HydrophobicContact CG2-CE2 4.24Å; I145-F147 HydrophobicContact CG2-CZ 3.55Å; I145-R163 CarbonylContact O-C 3.37Å; I145-R163 VanDerWaalsContact O-CA 3.29Å; I145-R163 WeakPolarHBondContact O-CA 3.44Å; I145-L164 PolarHBondContact N-O 2.92Å; I145-L164 PolarHBondContact O-N 2.89Å; I145-A177 HydrophobicContact CD1-CB 4.16Å; I145-A177 WeakPolarHBondContact CD1-O 3.46Å; I145-A177 HydrophobicContact CG1-CB 3.77Å; I145-I180 HydrophobicContact CD1-CB 3.42Å; I145-I180 VanDerWaalsContact CD1-CB 3.42Å; I145-I180 HydrophobicContact CD1-CD1 4.22Å; I145-I180 HydrophobicContact CD1-CG1 4.42Å; I145-I180 HydrophobicContact CD1-CG2 3.31Å; I145-Y181 HydrophobicContact CG2-CD2 4.43Å
146	I	89.9	Confident	83.4	Confident	21 Å²	21	56.6 Å²	56.6	11%	0.108	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.5	177.6	-50.9	179.2	0	0	0	107	A138 V139 E161 R163	A138-I146 CarbonylContact C-O 3.57Å; A138-I146 VanDerWaalsContact CA-O 3.26Å; A138-I146 WeakPolarHBondContact CA-O 3.49Å; V139-I146 HydrophobicContact CB-CB 4.33Å; V139-I146 PolarHBondContact N-O 3.36Å; V139-I146 PolarHBondContact O-N 2.79Å; I146-E161 HydrophobicContact CG2-CG 3.56Å; I146-E161 WeakPolarHBondContact CG2-OE1 3.48Å; I146-R163 HydrophobicContact CB-CG 4.39Å; I146-R163 HydrophobicContact CG1-CG 4Å; I146-R163 HydrophobicContact CG2-CG 4.15Å
147	F	89.5	Confident	83.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.6	171.5	-55.1	-62.8	0	0	0	109.2	L118 V135 A138 I145 F149 E161 M162 L164 I180 V184	L118-F147 HydrophobicContact CD1-CE2 4.08Å; L118-F147 HydrophobicContact CD1-CZ 3.82Å; V135-F147 HydrophobicContact CG1-CB 4.39Å; V135-F147 HydrophobicContact CG1-CD1 4.34Å; A138-F147 HydrophobicContact CB-CD1 4.03Å; A138-F147 HydrophobicContact CB-CE1 4.36Å; I145-F147 HydrophobicContact CB-CE1 4.44Å; I145-F147 HydrophobicContact CB-CE2 4.45Å; I145-F147 HydrophobicContact CB-CZ 4.08Å; I145-F147 HydrophobicContact CD1-CZ 4.32Å; I145-F147 HydrophobicContact CG2-CD1 4.1Å; I145-F147 HydrophobicContact CG2-CE1 3.44Å; I145-F147 VanDerWaalsContact CG2-CE1 3.44Å; I145-F147 HydrophobicContact CG2-CE2 4.24Å; I145-F147 HydrophobicContact CG2-CZ 3.55Å; F147-F149 HydrophobicContact CB-CE2 4.02Å; F147-F149 HydrophobicContact CB-CZ 4.14Å; F147-E161 CarbonylContact O-C 3.54Å; F147-E161 VanDerWaalsContact O-CA 3.24Å; F147-E161 WeakPolarHBondContact O-CA 3.3Å; F147-M162 HydrophobicContact CD2-CE 3.49Å; F147-M162 VanDerWaalsContact CD2-CE 3.49Å; F147-M162 HydrophobicContact CE2-CE 3.96Å; F147-M162 HydrophobicContact CG-CE 4.44Å; F147-M162 PolarHBondContact N-O 3.24Å; F147-M162 PolarHBondContact O-N 3.24Å; F147-L164 HydrophobicContact CE2-CB 4.48Å; F147-L164 HydrophobicContact CE2-CD1 3.67Å; F147-L164 HydrophobicContact CE2-CG 3.88Å; F147-L164 HydrophobicContact CZ-CD1 4.44Å; F147-I180 HydrophobicContact CZ-CG2 4.17Å; F147-V184 HydrophobicContact CD1-CG1 3.99Å; F147-V184 HydrophobicContact CE1-CB 4Å; F147-V184 HydrophobicContact CE1-CG1 3.8Å; F147-V184 HydrophobicContact CE1-CG2 3.64Å; F147-V184 HydrophobicContact CZ-CG2 4.11Å
148	E	85.4	Confident	83.8	Confident	40 Å²	40	63.3 Å²	63.3	19%	0.187	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.8	171.7	-59.1	179	153.9	0	0	108.3	V135 A136 N137	V135-E148 CarbonylContact C-O 3.52Å; A136-E148 PolarHBondContact N-O 2.9Å; N137-E148 HydrophobicContact CB-CB 4.15Å; N137-E148 WeakPolarHBondContact CB-OE2 3.48Å; N137-E148 PolarHBondContact N-O 3.45Å; N137-E148 VanDerWaalsContact N-O 3.14Å; N137-E148 PolarHBondContact ND2-OE2 2.79Å; N137-E148 PolarHBondContact O-N 2.86Å
149	F	86.2	Confident	83.9	Confident	19 Å²	19	67.7 Å²	67.7	8%	0.083	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	151.9	-174.4	-68.8	-84.7	0	0	0	112	V130 N134 V135 F147 L151 L159 S160 M162	V130-F149 HydrophobicContact CG1-CE1 3.38Å; V130-F149 HydrophobicContact CG1-CZ 3.75Å; N134-F149 HydrophobicContact CB-CD1 4.1Å; N134-F149 WeakPolarHBondContact O-CA 3.3Å; N134-F149 WeakPolarHBondContact O-CD1 3.18Å; V135-F149 HydrophobicContact CG2-CD1 4.19Å; V135-F149 HydrophobicContact CG2-CE1 3.64Å; V135-F149 HydrophobicContact CG2-CZ 4.25Å; F147-F149 HydrophobicContact CB-CE2 4.02Å; F147-F149 HydrophobicContact CB-CZ 4.14Å; F149-L151 PolarHBondContact O-N 2.89Å; F149-L159 VanDerWaalsContact CB-O 3.24Å; F149-L159 WeakPolarHBondContact CB-O 3.32Å; F149-L159 HydrophobicContact CD2-CD2 3.86Å; F149-L159 HydrophobicContact CD2-CG 3.72Å; F149-L159 HydrophobicContact CE1-CD2 4.33Å; F149-L159 HydrophobicContact CE2-CD2 3.52Å; F149-L159 HydrophobicContact CE2-CG 3.84Å; F149-L159 HydrophobicContact CG-CD2 4.38Å; F149-L159 HydrophobicContact CG-CG 4.33Å; F149-L159 HydrophobicContact CZ-CD2 3.78Å; F149-S160 PolarHBondContact N-O 3.44Å; F149-M162 HydrophobicContact CE2-CB 3.66Å; F149-M162 HydrophobicContact CZ-CB 4.29Å; F149-M162 HydrophobicContact CZ-CE 4.25Å
150	H	79.8	Confident	84	Confident	40 Å²	40	70 Å²	70	19%	0.185	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.9	120.7	167.6	-71.6	-69	0	0	0	109.9	R14 N134 D189	R14-H150 PolarHBondContact NH2-CD2 2.83Å; N134-H150 PolarHBondContact O-N 2.98Å; H150-D189 PolarHBondContact NE2-O 3.46Å; H150-D189 IonicContact NE2-OD2 2.8Å
151	L	77	Confident	84.1	Confident	71 Å²	71	69.4 Å²	69.4	37%	0.372	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-74.8	138.4	175.5	-57.7	176.3	0	0	0	110.3	F149 K263	F149-L151 PolarHBondContact O-N 2.89Å; L151-K263 HydrophobicContact CD1-CD 3.83Å
152	N	76.1	Confident	84.4	Confident	28 Å²	28	67.1 Å²	67.1	15%	0.15	34%	0.34	C	S	.	.			trans	-109.3	108.5	169.3	-169.9	-13.3	0	0	0	108.5	V13 R14 T16 Y18 E154 A155 C158	V13-N152 PolarHBondContact O-ND2 2.99Å; R14-N152 HydrophobicContact CB-CB 4.15Å; R14-N152 WeakPolarHBondContact O-CB 3.5Å; T16-N152 PolarHBondContact OG1-ND2 3.39Å; T16-N152 VanDerWaalsContact OG1-ND2 3.08Å; Y18-N152 PolarHBondContact OH-ND2 3.25Å; N152-E154 PolarHBondContact O-N 3.33Å; N152-E154 WeakPolarHBondContact OD1-CB 3.39Å; N152-E154 PolarHBondContact OD1-N 3.49Å; N152-E154 VanDerWaalsContact OD1-N 3.15Å; N152-A155 HydrophobicContact CB-CB 4.22Å; N152-A155 WeakPolarHBondContact O-CB 3.22Å; N152-A155 PolarHBondContact O-N 2.97Å; N152-C158 PolarHBondContact N-SG 3.3Å
153	D	75.2	Confident	84.8	Confident	153 Å²	153	66 Å²	66	82%	0.818	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.5	-178.2	-67.7	-30.8	0	0	0	112.7
154	E	77.4	Confident	85	Confident	108 Å²	108	65.4 Å²	65.4	51%	0.505	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-14.7	172	-58	-164.5	137.6	0	0	113.5	Y18 K35 N152	Y18-E154 WeakPolarHBondContact CE1-OE2 3.37Å; Y18-E154 PolarHBondContact OH-OE2 2.84Å; K35-E154 IonicContact NZ-OE1 3.46Å; K35-E154 PolarHBondContact NZ-OE1 3.34Å; K35-E154 IonicContact NZ-OE2 3.71Å; K35-E154 PolarHBondContact NZ-OE2 2.89Å; N152-E154 PolarHBondContact O-N 3.33Å; N152-E154 WeakPolarHBondContact OD1-CB 3.39Å; N152-E154 PolarHBondContact OD1-N 3.49Å; N152-E154 VanDerWaalsContact OD1-N 3.15Å
155	A	81	Confident	85.1	Confident	18 Å²	18	69 Å²	69	15%	0.149	34%	0.34	C	S	.	.			trans	-84.5	130.2	-178.2	0	0	0	0	0	110.6	T16 N152 I157 C158	T16-A155 WeakPolarHBondContact OG1-CB 3.28Å; N152-A155 HydrophobicContact CB-CB 4.22Å; N152-A155 WeakPolarHBondContact O-CB 3.22Å; N152-A155 PolarHBondContact O-N 2.97Å; A155-I157 VanDerWaalsContact C-N 3.3Å; A155-I157 PolarHBondContact O-N 3.24Å; A155-C158 HydrophobicContact CB-CB 4.2Å
156	E	80.9	Confident	85.1	Confident	201 Å²	201	69.6 Å²	69.6	94%	0.939	34%	0.343	S	S	*	.	S	Bend	trans	-63.8	-38.5	173.4	-64.8	-177	175	0	0	111.7
157	I	84.6	Confident	84.9	Confident	149 Å²	149	72.8 Å²	72.8	76%	0.764	37%	0.366	S	S	*	.	S	Bend	trans	-128.1	119.6	177.8	-56.9	176.1	0	0	0	107.5	A155	A155-I157 VanDerWaalsContact C-N 3.3Å; A155-I157 PolarHBondContact O-N 3.24Å
158	C	81.8	Confident	84.6	Confident	37 Å²	37	74.1 Å²	74.1	25%	0.25	38%	0.38	C	S	.	.			trans	-126.6	127.7	-179.2	-166.4	0	0	0	0	110.1	N152 A155 S160	N152-C158 PolarHBondContact N-SG 3.3Å; A155-C158 HydrophobicContact CB-CB 4.2Å; C158-S160 PolarHBondContact O-N 3.1Å
159	L	86.8	Confident	84.3	Confident	94 Å²	94	76.4 Å²	76.4	49%	0.492	40%	0.397	S	S	.	.			trans	-65.8	117.4	170.5	-179.3	64.2	0	0	0	107.8	F149	F149-L159 VanDerWaalsContact CB-O 3.24Å; F149-L159 WeakPolarHBondContact CB-O 3.32Å; F149-L159 HydrophobicContact CD2-CD2 3.86Å; F149-L159 HydrophobicContact CD2-CG 3.72Å; F149-L159 HydrophobicContact CE1-CD2 4.33Å; F149-L159 HydrophobicContact CE2-CD2 3.52Å; F149-L159 HydrophobicContact CE2-CG 3.84Å; F149-L159 HydrophobicContact CG-CD2 4.38Å; F149-L159 HydrophobicContact CG-CG 4.33Å; F149-L159 HydrophobicContact CZ-CD2 3.78Å
160	S	85.3	Confident	83.8	Confident	71 Å²	71	85 Å²	85	50%	0.497	44%	0.437	S	S	.	.			trans	-100.1	-42.9	-177.3	49.7	0	0	0	0	112.2	F149 C158	F149-S160 PolarHBondContact N-O 3.44Å; C158-S160 PolarHBondContact O-N 3.1Å
161	E	89.6	Confident	83.6	Confident	51 Å²	51	88 Å²	88	24%	0.238	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.6	-176.1	-167.2	-176.2	123.3	0	0	109.9	I146 F147 R163	I146-E161 HydrophobicContact CG2-CG 3.56Å; I146-E161 WeakPolarHBondContact CG2-OE1 3.48Å; F147-E161 CarbonylContact O-C 3.54Å; F147-E161 VanDerWaalsContact O-CA 3.24Å; F147-E161 WeakPolarHBondContact O-CA 3.3Å; E161-R163 IonicContact OE1-CZ 3.72Å; E161-R163 IonicContact OE1-NE 2.97Å; E161-R163 PolarHBondContact OE1-NE 3.19Å; E161-R163 IonicContact OE1-NH2 3.08Å; E161-R163 PolarHBondContact OE1-NH2 3.32Å
162	M	91.6	Very high	83.6	Confident	30 Å²	30	88.3 Å²	88.3	15%	0.148	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.6	172	-178.2	175.8	72.1	0	0	109.4	F128 V130 F147 F149 L164	F128-M162 HydrophobicContact CE2-CE 4.06Å; F128-M162 HydrophobicContact CE2-SD 3.84Å; F128-M162 HydrophobicContact CZ-SD 4.02Å; V130-M162 HydrophobicContact CG2-CE 3.96Å; V130-M162 HydrophobicContact CG2-SD 4.49Å; F147-M162 HydrophobicContact CD2-CE 3.49Å; F147-M162 VanDerWaalsContact CD2-CE 3.49Å; F147-M162 HydrophobicContact CE2-CE 3.96Å; F147-M162 HydrophobicContact CG-CE 4.44Å; F147-M162 PolarHBondContact N-O 3.24Å; F147-M162 PolarHBondContact O-N 3.24Å; F149-M162 HydrophobicContact CE2-CB 3.66Å; F149-M162 HydrophobicContact CZ-CB 4.29Å; F149-M162 HydrophobicContact CZ-CE 4.25Å; M162-L164 HydrophobicContact CE-CG 4.48Å
163	R	92.7	Very high	83.4	Confident	151 Å²	151	97.1 Å²	97.1	57%	0.57	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.6	176.2	-56.8	-170.2	-175.6	177.9	1.9	110.5	I145 I146 E161	I145-R163 CarbonylContact O-C 3.37Å; I145-R163 VanDerWaalsContact O-CA 3.29Å; I145-R163 WeakPolarHBondContact O-CA 3.44Å; I146-R163 HydrophobicContact CB-CG 4.39Å; I146-R163 HydrophobicContact CG1-CG 4Å; I146-R163 HydrophobicContact CG2-CG 4.15Å; E161-R163 IonicContact OE1-CZ 3.72Å; E161-R163 IonicContact OE1-NE 2.97Å; E161-R163 PolarHBondContact OE1-NE 3.19Å; E161-R163 IonicContact OE1-NH2 3.08Å; E161-R163 PolarHBondContact OE1-NH2 3.32Å
164	L	92.5	Very high	83	Confident	21 Å²	21	95.6 Å²	95.6	11%	0.11	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134	170.6	-62.3	-174.1	0	0	0	109.7	V111 L118 F128 E144 I145 F147 M162	V111-L164 HydrophobicContact CG2-CD1 3.87Å; L118-L164 HydrophobicContact CD2-CD1 4.47Å; F128-L164 HydrophobicContact CZ-CD2 4.33Å; E144-L164 CarbonylContact C-O 3.56Å; E144-L164 VanDerWaalsContact CA-O 3.29Å; E144-L164 WeakPolarHBondContact CA-O 3.39Å; I145-L164 PolarHBondContact N-O 2.92Å; I145-L164 PolarHBondContact O-N 2.89Å; F147-L164 HydrophobicContact CE2-CB 4.48Å; F147-L164 HydrophobicContact CE2-CD1 3.67Å; F147-L164 HydrophobicContact CE2-CG 3.88Å; F147-L164 HydrophobicContact CZ-CD1 4.44Å; M162-L164 HydrophobicContact CE-CG 4.48Å
165	Y	92.2	Very high	83.1	Confident	143 Å²	143	90.8 Å²	90.8	56%	0.561	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.8	171.2	175.2	-103.1	0	0	0	109.5	N143 E144 P167	N143-Y165 HydrophobicContact CB-CD2 4.04Å; N143-Y165 HydrophobicContact CB-CE2 3.6Å; N143-Y165 CarbonylContact O-C 3.56Å; N143-Y165 WeakPolarHBondContact O-CA 3.42Å; E144-Y165 HydrophobicContact CG-CD2 3.91Å; Y165-P167 HydrophobicContact CE1-CB 3.83Å; Y165-P167 HydrophobicContact CE1-CG 4.41Å
166	T	90.6	Very high	83.4	Confident	13 Å²	13	95.8 Å²	95.8	8%	0.08	49%	0.488	C	S	.	.			trans	-111	109.6	171.4	68.3	0	0	0	0	109.3	N143 G168 K176 A177 I180	N143-T166 VanDerWaalsContact CB-O 3.3Å; N143-T166 WeakPolarHBondContact CB-O 3.45Å; N143-T166 PolarHBondContact O-N 3.34Å; N143-T166 PolarHBondContact O-OG1 2.93Å; T166-G168 PolarHBondContact O-N 3Å; T166-K176 HydrophobicContact CG2-CB 4.33Å; T166-A177 HydrophobicContact CG2-CB 4.28Å; T166-A177 WeakPolarHBondContact OG1-CA 2.92Å; T166-A177 WeakPolarHBondContact OG1-CB 3.35Å; T166-A177 PolarHBondContact OG1-N 3.38Å; T166-I180 HydrophobicContact CG2-CD1 3.78Å
167	P	86.4	Confident	83.7	Confident	89 Å²	89	86.2 Å²	86.2	58%	0.578	44%	0.444	S	S	*	.			trans	-60.8	134.3	177	24.1	-31.7	0	0	0	110.5	Y165	Y165-P167 HydrophobicContact CE1-CB 3.83Å; Y165-P167 HydrophobicContact CE1-CG 4.41Å
168	G	83	Confident	83.9	Confident	30 Å²	30	80.9 Å²	80.9	31%	0.309	42%	0.419	S	S	.	.			trans	-70.2	158.1	167.4	0	0	0	0	0	111.5	T166 D172	T166-G168 PolarHBondContact O-N 3Å; G168-D172 CarbonylContact C-O 3.49Å; G168-D172 VanDerWaalsContact CA-O 3.3Å; G168-D172 WeakPolarHBondContact CA-O 3.46Å
169	T	80.2	Confident	84.2	Confident	87 Å²	87	82 Å²	82	53%	0.534	43%	0.431	S	S	.	.			trans	-108.5	169.1	168.9	63.4	0	0	0	0	109.9	A171 D172 R173	T169-A171 PolarHBondContact O-N 2.87Å; T169-D172 PolarHBondContact N-O 2.82Å; T169-D172 CarbonylContact O-C 3.46Å; T169-D172 PolarHBondContact O-N 3.35Å; T169-D172 PolarHBondContact OG1-N 2.9Å; T169-D172 VanDerWaalsContact OG1-N 3.1Å; T169-R173 PolarHBondContact O-N 2.89Å
170	E	76	Confident	84.3	Confident	199 Å²	199	77.9 Å²	77.9	93%	0.93	41%	0.409	S	S	*	.	S	Bend	trans	-58.8	-31.8	174.7	-69.7	-172.1	162.7	0	0	112.7
171	A	75.7	Confident	84.5	Confident	104 Å²	104	78 Å²	78	86%	0.86	40%	0.399	S	S	*	.	S	Bend	trans	-81.5	-32.3	178.2	0	0	0	0	0	113.1	T169	T169-A171 PolarHBondContact O-N 2.87Å
172	D	76.1	Confident	84.3	Confident	78 Å²	78	78.1 Å²	78.1	42%	0.417	41%	0.405	S	S	.	.			trans	-133.4	88.5	-178.6	-175.4	8.3	0	0	0	110.1	G168 T169 E174 G175	G168-D172 CarbonylContact C-O 3.49Å; G168-D172 VanDerWaalsContact CA-O 3.3Å; G168-D172 WeakPolarHBondContact CA-O 3.46Å; T169-D172 PolarHBondContact N-O 2.82Å; T169-D172 CarbonylContact O-C 3.46Å; T169-D172 PolarHBondContact O-N 3.35Å; T169-D172 PolarHBondContact OG1-N 2.9Å; T169-D172 VanDerWaalsContact OG1-N 3.1Å; D172-E174 PolarHBondContact O-N 3.04Å; D172-G175 PolarHBondContact O-N 2.84Å; D172-G175 VanDerWaalsContact O-N 3.08Å
173	R	71.4	Confident	84.1	Confident	213 Å²	213	81.8 Å²	81.8	80%	0.804	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-28	-173.1	-70.3	-173.5	178.9	-178.1	-1.2	113.4	N143 T169 G175	N143-R173 PolarHBondContact OD1-O 3.19Å; T169-R173 PolarHBondContact O-N 2.89Å; R173-G175 VanDerWaalsContact C-N 3.32Å
174	E	66.8	Low	83.8	Confident	120 Å²	120	74.6 Å²	74.6	56%	0.561	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-11.4	179.7	-62.6	-178.2	177.8	0	0	111.9	N143 D172 P178	N143-E174 WeakPolarHBondContact OD1-CA 3.09Å; N143-E174 PolarHBondContact OD1-O 2.9Å; D172-E174 PolarHBondContact O-N 3.04Å; E174-P178 HydrophobicContact CB-CG 3.85Å
175	G	79.5	Confident	83.3	Confident	8 Å²	8	75.6 Å²	75.6	8%	0.082	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-157.3	-179.7	0	0	0	0	0	112.6	D172 R173 A177	D172-G175 PolarHBondContact O-N 2.84Å; D172-G175 VanDerWaalsContact O-N 3.08Å; R173-G175 VanDerWaalsContact C-N 3.32Å; G175-A177 PolarHBondContact O-N 2.84Å
176	K	86.9	Confident	82.6	Confident	122 Å²	122	74.9 Å²	74.9	53%	0.53	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.9	-178.8	-64.8	-177.7	-179.9	177.4	0	113.5	T166 A179 I180	T166-K176 HydrophobicContact CG2-CB 4.33Å; K176-A179 PolarHBondContact O-N 3.14Å; K176-I180 HydrophobicContact CB-CD1 4.06Å; K176-I180 HydrophobicContact CB-CG1 4.43Å; K176-I180 WeakPolarHBondContact O-CG1 2.88Å; K176-I180 PolarHBondContact O-N 3.37Å
177	A	88.3	Confident	81.9	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-58.1	-48.6	-172.1	0	0	0	0	0	113.8	L140 I145 T166 G175 A179 I180 Y181	L140-A177 HydrophobicContact CD1-CB 3.7Å; I145-A177 HydrophobicContact CD1-CB 4.16Å; I145-A177 WeakPolarHBondContact CD1-O 3.46Å; I145-A177 HydrophobicContact CG1-CB 3.77Å; T166-A177 HydrophobicContact CG2-CB 4.28Å; T166-A177 WeakPolarHBondContact OG1-CA 2.92Å; T166-A177 WeakPolarHBondContact OG1-CB 3.35Å; T166-A177 PolarHBondContact OG1-N 3.38Å; G175-A177 PolarHBondContact O-N 2.84Å; A177-A179 VanDerWaalsContact C-N 3.29Å; A177-A179 PolarHBondContact O-N 2.85Å; A177-I180 PolarHBondContact O-N 3.48Å; A177-Y181 VanDerWaalsContact O-CB 3.28Å; A177-Y181 WeakPolarHBondContact O-CB 3.41Å; A177-Y181 PolarHBondContact O-N 2.87Å
178	P	88.1	Confident	81.1	Confident	38 Å²	38	74.3 Å²	74.3	25%	0.247	39%	0.391	C	S	.	.	H	α-helix	trans	-60.7	-36.8	177.6	-23.5	33.3	0	0	0	113.3	L140 E174 S182	L140-P178 HydrophobicContact CD2-CB 4.22Å; L140-P178 HydrophobicContact CD2-CG 4.26Å; E174-P178 HydrophobicContact CB-CG 3.85Å; P178-S182 WeakPolarHBondContact O-CB 3.25Å; P178-S182 PolarHBondContact O-N 2.83Å
179	A	88.3	Confident	79.9	Confident	60 Å²	60	76.7 Å²	76.7	50%	0.496	40%	0.397	S	S	.	.	H	α-helix	trans	-70.1	-43	179.8	0	0	0	0	0	112.2	K176 A177 K183	K176-A179 PolarHBondContact O-N 3.14Å; A177-A179 VanDerWaalsContact C-N 3.29Å; A177-A179 PolarHBondContact O-N 2.85Å; A179-K183 WeakPolarHBondContact O-CG 3.46Å; A179-K183 PolarHBondContact O-N 3.45Å
180	I	90.3	Very high	78.9	Confident	8 Å²	8	73.9 Å²	73.9	4%	0.041	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-45.7	175.2	-63.8	168.7	0	0	0	109.6	V111 F113 L118 I145 F147 T166 K176 A177 S182 K183 V184	V111-I180 HydrophobicContact CB-CD1 3.88Å; V111-I180 HydrophobicContact CG1-CD1 3.95Å; V111-I180 HydrophobicContact CG1-CG1 4.34Å; V111-I180 HydrophobicContact CG1-CG2 4.28Å; V111-I180 HydrophobicContact CG2-CD1 4.27Å; F113-I180 HydrophobicContact CE2-CB 4.32Å; F113-I180 HydrophobicContact CE2-CG1 4.2Å; F113-I180 HydrophobicContact CE2-CG2 4.09Å; F113-I180 HydrophobicContact CZ-CB 4.34Å; F113-I180 HydrophobicContact CZ-CG2 3.76Å; L118-I180 HydrophobicContact CD1-CG2 4.3Å; I145-I180 HydrophobicContact CD1-CB 3.42Å; I145-I180 VanDerWaalsContact CD1-CB 3.42Å; I145-I180 HydrophobicContact CD1-CD1 4.22Å; I145-I180 HydrophobicContact CD1-CG1 4.42Å; I145-I180 HydrophobicContact CD1-CG2 3.31Å; F147-I180 HydrophobicContact CZ-CG2 4.17Å; T166-I180 HydrophobicContact CG2-CD1 3.78Å; K176-I180 HydrophobicContact CB-CD1 4.06Å; K176-I180 HydrophobicContact CB-CG1 4.43Å; K176-I180 WeakPolarHBondContact O-CG1 2.88Å; K176-I180 PolarHBondContact O-N 3.37Å; A177-I180 PolarHBondContact O-N 3.48Å; I180-S182 PolarHBondContact O-N 2.82Å; I180-K183 PolarHBondContact O-N 3.21Å; I180-V184 HydrophobicContact CG2-CG2 4.46Å; I180-V184 WeakPolarHBondContact O-CG2 3.39Å; I180-V184 PolarHBondContact O-N 2.9Å
181	Y	88.4	Confident	77.8	Confident	73 Å²	73	67 Å²	67	29%	0.286	35%	0.348	S	S	.	.	H	α-helix	trans	-54.8	-52.7	176.3	173	-101.7	0	0	0	111.4	A138 L140 I145 A177 K183 V184 T185	A138-Y181 HydrophobicContact CB-CD2 4.04Å; A138-Y181 HydrophobicContact CB-CE2 3.98Å; A138-Y181 WeakPolarHBondContact O-CE2 3.4Å; L140-Y181 HydrophobicContact CB-CD1 4.17Å; L140-Y181 HydrophobicContact CB-CD2 3.83Å; L140-Y181 HydrophobicContact CB-CE1 4.48Å; L140-Y181 HydrophobicContact CB-CE2 4.16Å; L140-Y181 HydrophobicContact CB-CG 3.84Å; L140-Y181 HydrophobicContact CD2-CD1 4.28Å; L140-Y181 HydrophobicContact CD2-CG 4.43Å; I145-Y181 HydrophobicContact CG2-CD2 4.43Å; A177-Y181 VanDerWaalsContact O-CB 3.28Å; A177-Y181 WeakPolarHBondContact O-CB 3.41Å; A177-Y181 PolarHBondContact O-N 2.87Å; Y181-K183 VanDerWaalsContact C-N 3.28Å; Y181-K183 PolarHBondContact O-N 3.46Å; Y181-V184 PolarHBondContact O-N 2.96Å; Y181-T185 WeakPolarHBondContact O-CB 3.46Å; Y181-T185 PolarHBondContact O-N 3.18Å; Y181-T185 PolarHBondContact O-OG1 2.9Å; Y181-T185 VanDerWaalsContact O-OG1 3.04Å
182	S	86.2	Confident	76.6	Confident	53 Å²	53	67.7 Å²	67.7	37%	0.371	33%	0.333	S	S	.	.	H	α-helix	trans	-59.2	-38	179.6	-176.5	0	0	0	0	112.7	P178 I180 Q186	P178-S182 WeakPolarHBondContact O-CB 3.25Å; P178-S182 PolarHBondContact O-N 2.83Å; I180-S182 PolarHBondContact O-N 2.82Å; S182-Q186 WeakPolarHBondContact O-CG 3.5Å; S182-Q186 PolarHBondContact O-N 3.09Å; S182-Q186 PolarHBondContact OG-NE2 2.75Å
183	K	86.4	Confident	75.5	Confident	107 Å²	107	66 Å²	66	47%	0.465	33%	0.325	S	S	.	.	H	α-helix	trans	-68.8	-43.8	177.7	-77.2	-177.7	177.9	-175.6	0	111.9	F113 A179 I180 Y181 Q186 K187	F113-K183 HydrophobicContact CD1-CB 4.45Å; F113-K183 HydrophobicContact CD2-CB 4.48Å; F113-K183 HydrophobicContact CD2-CD 3.57Å; F113-K183 HydrophobicContact CE1-CB 3.95Å; F113-K183 HydrophobicContact CE2-CB 4Å; F113-K183 HydrophobicContact CE2-CD 3.62Å; F113-K183 HydrophobicContact CE2-CG 4.46Å; F113-K183 HydrophobicContact CG-CD 4.1Å; F113-K183 HydrophobicContact CZ-CB 3.69Å; F113-K183 HydrophobicContact CZ-CD 4.2Å; A179-K183 WeakPolarHBondContact O-CG 3.46Å; A179-K183 PolarHBondContact O-N 3.45Å; I180-K183 PolarHBondContact O-N 3.21Å; Y181-K183 VanDerWaalsContact C-N 3.28Å; Y181-K183 PolarHBondContact O-N 3.46Å; K183-Q186 PolarHBondContact O-N 3.15Å; K183-K187 PolarHBondContact O-N 3.09Å
184	V	86.9	Confident	74.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-48.2	176.5	173.5	0	0	0	0	109.8	F113 L118 L132 V135 A138 F147 I180 Y181 Q186 K187 A188	F113-V184 HydrophobicContact CE1-CG2 3.67Å; F113-V184 HydrophobicContact CZ-CG2 3.78Å; L118-V184 HydrophobicContact CD1-CG2 4.15Å; L132-V184 HydrophobicContact CD2-CG1 4.26Å; L132-V184 HydrophobicContact CD2-CG2 3.92Å; V135-V184 HydrophobicContact CG1-CG1 4.06Å; A138-V184 HydrophobicContact CB-CG1 4.1Å; F147-V184 HydrophobicContact CD1-CG1 3.99Å; F147-V184 HydrophobicContact CE1-CB 4Å; F147-V184 HydrophobicContact CE1-CG1 3.8Å; F147-V184 HydrophobicContact CE1-CG2 3.64Å; F147-V184 HydrophobicContact CZ-CG2 4.11Å; I180-V184 HydrophobicContact CG2-CG2 4.46Å; I180-V184 WeakPolarHBondContact O-CG2 3.39Å; I180-V184 PolarHBondContact O-N 2.9Å; Y181-V184 PolarHBondContact O-N 2.96Å; V184-Q186 PolarHBondContact O-N 3.32Å; V184-K187 PolarHBondContact O-N 3.18Å; V184-K187 VanDerWaalsContact O-N 3.08Å; V184-A188 HydrophobicContact CG1-CB 3.87Å; V184-A188 WeakPolarHBondContact O-CB 3.27Å; V184-A188 PolarHBondContact O-N 3.12Å
185	T	80.8	Confident	74.1	Confident	43 Å²	43	58 Å²	58	26%	0.264	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-29.5	-177.8	-57.9	0	0	0	0	113.9	Y181 I190	Y181-T185 WeakPolarHBondContact O-CB 3.46Å; Y181-T185 PolarHBondContact O-N 3.18Å; Y181-T185 PolarHBondContact O-OG1 2.9Å; Y181-T185 VanDerWaalsContact O-OG1 3.04Å; T185-I190 HydrophobicContact CG2-CD1 4.08Å
186	Q	78.6	Confident	73.8	Confident	127 Å²	127	64.8 Å²	64.8	59%	0.593	35%	0.353	S	S	*	.	H	α-helix	trans	-75.8	-29.1	177	-74.5	171.3	16.2	0	0	113.7	S182 K183 V184 Q192	S182-Q186 WeakPolarHBondContact O-CG 3.5Å; S182-Q186 PolarHBondContact O-N 3.09Å; S182-Q186 PolarHBondContact OG-NE2 2.75Å; K183-Q186 PolarHBondContact O-N 3.15Å; V184-Q186 PolarHBondContact O-N 3.32Å; Q186-Q192 PolarHBondContact O-NE2 3.16Å
187	K	75.4	Confident	73.8	Confident	83 Å²	83	62.2 Å²	62.2	36%	0.361	34%	0.342	S	S	.	.	H	α-helix	trans	-116.4	-24.3	-167.5	-75	170.5	161.7	-105.1	0	114.8	G115 D116 L132 K183 V184	G115-K187 PolarHBondContact O-NZ 3.25Å; D116-K187 IonicContact OD1-NZ 2.83Å; D116-K187 PolarHBondContact OD1-NZ 3.4Å; L132-K187 HydrophobicContact CD1-CB 3.51Å; L132-K187 HydrophobicContact CD1-CD 3.96Å; L132-K187 HydrophobicContact CD1-CG 4.41Å; K183-K187 PolarHBondContact O-N 3.09Å; V184-K187 PolarHBondContact O-N 3.18Å; V184-K187 VanDerWaalsContact O-N 3.08Å
188	A	69.4	Low	73.8	Confident	8 Å²	8	62.8 Å²	62.8	7%	0.066	35%	0.345	C	S	.	.	S	Bend	trans	-67.8	156.5	178.1	0	0	0	0	0	110.6	L132 V135 V184 I190	L132-A188 HydrophobicContact CB-CB 4.2Å; L132-A188 WeakPolarHBondContact O-CA 3.48Å; L132-A188 VanDerWaalsContact O-CB 3.32Å; L132-A188 WeakPolarHBondContact O-CB 3.43Å; V135-A188 HydrophobicContact CB-CB 3.82Å; V135-A188 HydrophobicContact CG1-CB 4.07Å; V184-A188 HydrophobicContact CG1-CB 3.87Å; V184-A188 WeakPolarHBondContact O-CB 3.27Å; V184-A188 PolarHBondContact O-N 3.12Å; A188-I190 HydrophobicContact CB-CD1 4.39Å; A188-I190 HydrophobicContact CB-CG1 3.74Å; A188-I190 PolarHBondContact O-N 3.46Å
189	D	59.2	Low	73.9	Confident	80 Å²	80	61 Å²	61	43%	0.428	33%	0.334	S	S	.	.			trans	-72.9	35	167.8	-163.6	22.3	0	0	0	110.5	R14 L132 V135 H150 I191	R14-D189 IonicContact NH2-OD2 2.81Å; L132-D189 PolarHBondContact O-N 3.33Å; V135-D189 CarbonylContact O-C 3.55Å; V135-D189 PolarHBondContact O-N 3.06Å; H150-D189 PolarHBondContact NE2-O 3.46Å; H150-D189 IonicContact NE2-OD2 2.8Å; D189-I191 PolarHBondContact O-N 3.08Å; D189-I191 VanDerWaalsContact O-N 3.09Å
190	I	58.4	Low	74.2	Confident	27 Å²	27	60.2 Å²	60.2	14%	0.138	32%	0.32	C	S	.	.			trans	-55.8	120.5	153.4	-53	-169.4	0	0	0	102.9	V135 A136 A138 T185 A188 Q192	V135-I190 PolarHBondContact O-N 2.86Å; A136-I190 WeakPolarHBondContact O-CA 3.44Å; A138-I190 HydrophobicContact CB-CD1 4.11Å; T185-I190 HydrophobicContact CG2-CD1 4.08Å; A188-I190 HydrophobicContact CB-CD1 4.39Å; A188-I190 HydrophobicContact CB-CG1 3.74Å; A188-I190 PolarHBondContact O-N 3.46Å; I190-Q192 PolarHBondContact O-N 3.4Å
191	I	51.7	Low	74.3	Confident	56 Å²	56	59.8 Å²	59.8	29%	0.287	32%	0.318	S	S	.	.			trans	-55.8	92.9	174.8	-62.6	117	0	0	0	106.1	D189 V193 K232	D189-I191 PolarHBondContact O-N 3.08Å; D189-I191 VanDerWaalsContact O-N 3.09Å; I191-V193 VanDerWaalsContact C-N 3.26Å; I191-V193 HydrophobicContact CG2-CG2 4.32Å; I191-V193 WeakPolarHBondContact O-CG2 3.41Å; I191-V193 PolarHBondContact O-N 2.86Å; I191-K232 HydrophobicContact CB-CD 4.1Å; I191-K232 HydrophobicContact CD1-CB 4.31Å; I191-K232 HydrophobicContact CD1-CD 3.51Å; I191-K232 HydrophobicContact CG1-CD 3.77Å; I191-K232 HydrophobicContact CG2-CD 3.81Å
192	Q	50.7	Low	74.5	Confident	117 Å²	117	63 Å²	63	55%	0.547	33%	0.333	S	S	.	.			trans	-58.3	110	155.7	-74.3	-168.9	3.9	0	0	101.4	Q186 I190 T194	Q186-Q192 PolarHBondContact O-NE2 3.16Å; I190-Q192 PolarHBondContact O-N 3.4Å; Q192-T194 HydrophobicContact CB-CG2 4.1Å; Q192-T194 PolarHBondContact O-N 2.75Å; Q192-T194 PolarHBondContact O-OG1 2.65Å; Q192-T194 VanDerWaalsContact O-OG1 3.11Å
193	V	53.5	Low	74.8	Confident	42 Å²	42	64.2 Å²	64.2	26%	0.255	33%	0.333	S	S	.	.			trans	-66.8	86.2	-179	-171.8	0	0	0	0	105.4	I191 Y218 F221	I191-V193 VanDerWaalsContact C-N 3.26Å; I191-V193 HydrophobicContact CG2-CG2 4.32Å; I191-V193 WeakPolarHBondContact O-CG2 3.41Å; I191-V193 PolarHBondContact O-N 2.86Å; V193-Y218 HydrophobicContact CG1-CD2 4.26Å; V193-Y218 HydrophobicContact CG1-CE1 3.71Å; V193-Y218 HydrophobicContact CG1-CE2 3.36Å; V193-Y218 WeakPolarHBondContact CG1-OH 3.42Å; V193-F221 HydrophobicContact CG1-CE2 4.03Å; V193-F221 HydrophobicContact CG1-CZ 3.95Å
194	T	47.8	Very low	75.2	Confident	114 Å²	114	59.5 Å²	59.5	70%	0.699	31%	0.313	S	S	*	.			trans	-91.5	126.7	-176.1	37.8	0	0	0	0	106.3	Q192	Q192-T194 HydrophobicContact CB-CG2 4.1Å; Q192-T194 PolarHBondContact O-N 2.75Å; Q192-T194 PolarHBondContact O-OG1 2.65Å; Q192-T194 VanDerWaalsContact O-OG1 3.11Å
195	G	60.9	Low	75.6	Confident	53 Å²	53	63.5 Å²	63.5	55%	0.546	33%	0.331	S	S	.	.	S	Bend	trans	112.4	157.8	-170.9	0	0	0	0	0	111.9	Y218	G195-Y218 WeakPolarHBondContact O-CE1 3.46Å
196	D	72.8	Confident	76.2	Confident	150 Å²	150	61.6 Å²	61.6	80%	0.802	32%	0.32	S	S	*	.			trans	-83.5	131.7	177.2	-61.2	-41.7	0	0	0	109.4
197	F	86.7	Confident	76.9	Confident	67 Å²	67	57.1 Å²	57.1	29%	0.294	30%	0.3	S	S	.	.			trans	-68.1	145.4	169.7	56.8	-90.1	0	0	0	109.1	E200 K216 L217 Y218 A287	F197-E200 HydrophobicContact CD2-CB 3.89Å; F197-E200 HydrophobicContact CE2-CB 3.62Å; F197-E200 HydrophobicContact CZ-CB 4.26Å; F197-K216 HydrophobicContact CB-CB 4.13Å; F197-K216 HydrophobicContact CD1-CD 4.3Å; F197-K216 HydrophobicContact CG-CB 4.48Å; F197-L217 CarbonylContact C-O 3.58Å; F197-L217 WeakPolarHBondContact CA-O 3.18Å; F197-Y218 HydrophobicContact CB-CD1 4.49Å; F197-Y218 HydrophobicContact CB-CE1 3.9Å; F197-Y218 HydrophobicContact CB-CE2 3.97Å; F197-A287 WeakPolarHBondContact O-CB 3.48Å
198	L	89	Confident	77.7	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.063	29%	0.288	C	S	.	.	S	Bend	trans	-76.9	-34.7	175.4	-67	176.1	0	0	0	112.1	L217 P219 M286 A287 A288 W292 L320	L198-L217 PolarHBondContact N-O 2.85Å; L198-P219 HydrophobicContact CD1-CG 3.92Å; L198-P219 HydrophobicContact CG-CG 4.29Å; L198-M286 HydrophobicContact CB-CE 4.16Å; L198-M286 CarbonylContact O-C 3.6Å; L198-M286 VanDerWaalsContact O-CA 3.26Å; L198-M286 WeakPolarHBondContact O-CA 3.48Å; L198-A287 PolarHBondContact O-N 3.22Å; L198-A288 HydrophobicContact CD2-CB 3.77Å; L198-W292 HydrophobicContact CD1-CH2 4.09Å; L198-W292 HydrophobicContact CD1-CZ3 4.13Å; L198-W292 HydrophobicContact CD2-CE3 4.39Å; L198-W292 HydrophobicContact CD2-CH2 3.78Å; L198-W292 HydrophobicContact CD2-CZ3 3.52Å; L198-W292 HydrophobicContact CG-CZ3 4.49Å; L198-L320 HydrophobicContact CD1-CD1 3.44Å; L198-L320 VanDerWaalsContact CD1-CD1 3.44Å; L198-L320 HydrophobicContact CD1-CD2 4.33Å
199	A	91.2	Very high	78.8	Confident	1 Å²	1	54 Å²	54	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	151.1	-178.7	0	0	0	0	0	110.4	L217 L284	A199-L217 HydrophobicContact CB-CB 4.41Å; A199-L217 HydrophobicContact CB-CD1 4.24Å; A199-L217 PolarHBondContact O-N 2.83Å; A199-L284 HydrophobicContact CB-CD1 4.11Å; A199-L284 HydrophobicContact CB-CD2 3.99Å; A199-L284 HydrophobicContact CB-CG 4.42Å
200	E	93.1	Very high	80.3	Confident	43 Å²	43	59.4 Å²	59.4	20%	0.201	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.7	176.8	178.1	-179	-135	0	0	109.8	F197 K202 V215 K216	F197-E200 HydrophobicContact CD2-CB 3.89Å; F197-E200 HydrophobicContact CE2-CB 3.62Å; F197-E200 HydrophobicContact CZ-CB 4.26Å; E200-K202 HydrophobicContact CG-CG 4.07Å; E200-K202 WeakPolarHBondContact OE2-CE 3.28Å; E200-K202 IonicContact OE2-NZ 3.5Å; E200-V215 WeakPolarHBondContact CA-O 3.09Å; E200-K216 HydrophobicContact CB-CG 4.32Å; E200-K216 HydrophobicContact CG-CG 3.95Å; E200-K216 WeakPolarHBondContact OE1-CE 3.15Å; E200-K216 IonicContact OE1-NZ 3.35Å
201	F	93.9	Very high	81.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.8	169.9	-60.9	-81.6	0	0	0	109.2	L204 D214 V215 L217 I282 L284 V312 V313 F317	F201-L204 HydrophobicContact CB-CD1 3.56Å; F201-L204 HydrophobicContact CB-CD2 4.06Å; F201-L204 HydrophobicContact CB-CG 3.7Å; F201-L204 HydrophobicContact CG-CD1 4.2Å; F201-D214 CarbonylContact O-C 3.58Å; F201-D214 WeakPolarHBondContact O-CA 3.45Å; F201-V215 HydrophobicContact CB-CB 4.35Å; F201-V215 PolarHBondContact N-O 3.14Å; F201-V215 PolarHBondContact O-N 2.77Å; F201-L217 HydrophobicContact CD2-CD1 4.4Å; F201-L217 HydrophobicContact CE2-CD1 3.74Å; F201-L217 HydrophobicContact CE2-CG 4.34Å; F201-I282 HydrophobicContact CD1-CD1 3.74Å; F201-I282 HydrophobicContact CE1-CD1 4.07Å; F201-L284 HydrophobicContact CE1-CD1 4.27Å; F201-L284 HydrophobicContact CE1-CD2 4.04Å; F201-L284 HydrophobicContact CZ-CD1 4.48Å; F201-L284 HydrophobicContact CZ-CD2 3.72Å; F201-V312 HydrophobicContact CE1-CG1 4.31Å; F201-V313 HydrophobicContact CD1-CG2 3.65Å; F201-V313 HydrophobicContact CD2-CG2 4.38Å; F201-V313 HydrophobicContact CE1-CB 4.48Å; F201-V313 HydrophobicContact CE1-CG2 3.41Å; F201-V313 VanDerWaalsContact CE1-CG2 3.41Å; F201-V313 HydrophobicContact CE2-CG2 4.16Å; F201-V313 HydrophobicContact CG-CG2 4.14Å; F201-V313 HydrophobicContact CZ-CB 4.36Å; F201-V313 HydrophobicContact CZ-CG2 3.68Å; F201-F317 HydrophobicContact CE2-CE2 4.19Å
202	K	92.5	Very high	84	Confident	139 Å²	139	63.9 Å²	63.9	60%	0.604	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.1	-173.9	-64.7	-178.1	179.3	177	0	111.3	E200 L204 D214	E200-K202 HydrophobicContact CG-CG 4.07Å; E200-K202 WeakPolarHBondContact OE2-CE 3.28Å; E200-K202 IonicContact OE2-NZ 3.5Å; K202-L204 VanDerWaalsContact C-N 3.27Å; K202-L204 PolarHBondContact O-N 3.28Å; K202-D214 WeakPolarHBondContact CA-OD1 3.49Å
203	Q	92.4	Very high	86.1	Confident	80 Å²	80	58.9 Å²	58.9	37%	0.374	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	36.1	171.4	-62.7	-63.6	-63.1	0	0	114.8	Q205 Y213 D214	Q203-Q205 PolarHBondContact O-N 3.08Å; Q203-Y213 PolarHBondContact N-O 3.39Å; Q203-D214 PolarHBondContact N-OD1 2.91Å; Q203-D214 PolarHBondContact NE2-OD1 3.38Å
204	L	93.7	Very high	88	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	129.3	173.7	-70.1	-169.8	0	0	0	110.3	F201 K202 C206 R212 Y213 V215 F276 E309	F201-L204 HydrophobicContact CB-CD1 3.56Å; F201-L204 HydrophobicContact CB-CD2 4.06Å; F201-L204 HydrophobicContact CB-CG 3.7Å; F201-L204 HydrophobicContact CG-CD1 4.2Å; K202-L204 VanDerWaalsContact C-N 3.27Å; K202-L204 PolarHBondContact O-N 3.28Å; L204-C206 PolarHBondContact O-N 2.83Å; L204-R212 WeakPolarHBondContact O-CA 3.3Å; L204-Y213 PolarHBondContact N-O 3.27Å; L204-Y213 PolarHBondContact O-N 2.76Å; L204-V215 HydrophobicContact CB-CG2 4.27Å; L204-V215 HydrophobicContact CD1-CB 4.02Å; L204-V215 HydrophobicContact CD1-CG2 3.72Å; L204-V215 HydrophobicContact CG-CG2 4.29Å; L204-F276 HydrophobicContact CD1-CZ 4.18Å; L204-F276 HydrophobicContact CD2-CE1 3.46Å; L204-F276 VanDerWaalsContact CD2-CE1 3.46Å; L204-F276 HydrophobicContact CD2-CZ 3.82Å; L204-E309 WeakPolarHBondContact CD2-OE1 3.37Å
205	Q	95.1	Very high	90.2	Very high	84 Å²	84	53.2 Å²	53.2	39%	0.393	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	106.1	177.5	179.5	174.1	-19	0	0	109.8	Q203 S274 L275	Q203-Q205 PolarHBondContact O-N 3.08Å; Q205-S274 CarbonylContact O-C 3.53Å; Q205-S274 WeakPolarHBondContact O-CA 3.36Å; Q205-L275 PolarHBondContact O-N 3Å
206	C	94.5	Very high	91.7	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.02	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.4	173	-59	0	0	0	0	110.4	L204 P209 R210 G211 Y213 V273 S274	L204-C206 PolarHBondContact O-N 2.83Å; C206-P209 CarbonylContact C-O 3.54Å; C206-P209 WeakPolarHBondContact CB-O 3.37Å; C206-R210 WeakPolarHBondContact O-CA 3.36Å; C206-G211 PolarHBondContact N-O 2.85Å; C206-G211 PolarHBondContact O-N 2.77Å; C206-G211 VanDerWaalsContact O-O 3.13Å; C206-Y213 HydrophobicContact CB-CD2 3.81Å; C206-Y213 HydrophobicContact CB-CE2 4.09Å; C206-V273 CarbonylContact C-O 3.37Å; C206-V273 WeakPolarHBondContact CA-O 3.24Å; C206-S274 PolarHBondContact SG-OG 3.35Å
207	L	93.8	Very high	92.7	Very high	33 Å²	33	46 Å²	46	17%	0.173	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-29	171.6	-59.7	-178	0	0	0	111.5	F253 V273 L275 P362	L207-F253 HydrophobicContact CD1-CD1 3.83Å; L207-F253 HydrophobicContact CD1-CE1 3.5Å; L207-F253 VanDerWaalsContact CD1-CE1 3.5Å; L207-V273 HydrophobicContact CB-CG1 4.46Å; L207-V273 HydrophobicContact CD1-CG1 4.48Å; L207-V273 PolarHBondContact N-O 3.18Å; L207-L275 HydrophobicContact CD1-CB 4.19Å; L207-L275 HydrophobicContact CD2-CB 4.43Å; L207-L275 HydrophobicContact CD2-CD2 4.38Å; L207-L275 HydrophobicContact CG-CB 4.14Å; L207-P362 HydrophobicContact CB-CB 4.46Å; L207-P362 HydrophobicContact CD1-CB 3.76Å
208	Q	91.5	Very high	92.8	Very high	22 Å²	22	43.3 Å²	43.3	10%	0.103	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	122.6	175.5	-173.5	164.4	-46.4	0	0	110.2	Y269 V272 V273 P365	Q208-Y269 HydrophobicContact CG-CD1 3.35Å; Q208-Y269 HydrophobicContact CG-CE1 3.84Å; Q208-Y269 HydrophobicContact CG-CG 4.19Å; Q208-V272 CarbonylContact O-C 3.57Å; Q208-V272 WeakPolarHBondContact O-CA 3.4Å; Q208-V273 HydrophobicContact CB-CB 4.36Å; Q208-V273 HydrophobicContact CB-CG2 4.41Å; Q208-V273 PolarHBondContact N-O 3.44Å; Q208-V273 PolarHBondContact O-N 3.26Å; Q208-P365 VanDerWaalsContact CD-CD 3.48Å; Q208-P365 VanDerWaalsContact NE2-CG 3.31Å
209	P	91.6	Very high	92.7	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.019	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	cis	-51	144.3	-20.2	-18.1	29.7	0	0	0	110.7	C206 G211 Y213 F231 I262 Y269	C206-P209 CarbonylContact C-O 3.54Å; C206-P209 WeakPolarHBondContact CB-O 3.37Å; P209-G211 PolarHBondContact O-N 2.81Å; P209-Y213 HydrophobicContact CB-CE2 4.44Å; P209-F231 HydrophobicContact CB-CE2 4.14Å; P209-F231 HydrophobicContact CG-CD2 4.33Å; P209-F231 HydrophobicContact CG-CE2 3.79Å; P209-F231 HydrophobicContact CG-CZ 4.23Å; P209-I262 HydrophobicContact CG-CD1 3.74Å; P209-Y269 HydrophobicContact CB-CD2 4.12Å; P209-Y269 HydrophobicContact CB-CE2 3.75Å; P209-Y269 HydrophobicContact CG-CD2 3.6Å; P209-Y269 HydrophobicContact CG-CE2 3.76Å; P209-Y269 HydrophobicContact CG-CG 4.02Å
210	R	92.7	Very high	92.3	Very high	194 Å²	194	48.7 Å²	48.7	73%	0.732	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	118.2	-175.7	-177.1	-178.3	178.1	103.1	-5.9	109.4	C206	C206-R210 WeakPolarHBondContact O-CA 3.36Å
211	G	92	Very high	92.1	Very high	28 Å²	28	47.4 Å²	47.4	29%	0.289	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	168.6	-178.5	177.9	0	0	0	0	0	113	C206 P209	C206-G211 PolarHBondContact N-O 2.85Å; C206-G211 PolarHBondContact O-N 2.77Å; C206-G211 VanDerWaalsContact O-O 3.13Å; P209-G211 PolarHBondContact O-N 2.81Å
212	R	94.5	Very high	92	Very high	149 Å²	149	47.7 Å²	47.7	56%	0.562	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.1	164.7	-68.4	-170.3	179.3	-147.6	-3.1	108.2	L204	L204-R212 WeakPolarHBondContact O-CA 3.3Å
213	Y	94.3	Very high	91.9	Very high	12 Å²	12	42.1 Å²	42.1	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.1	-176.3	-66.1	-92.6	0	0	0	110.3	Q203 L204 C206 P209 L224 H225 Y229 F231	Q203-Y213 PolarHBondContact N-O 3.39Å; L204-Y213 PolarHBondContact N-O 3.27Å; L204-Y213 PolarHBondContact O-N 2.76Å; C206-Y213 HydrophobicContact CB-CD2 3.81Å; C206-Y213 HydrophobicContact CB-CE2 4.09Å; P209-Y213 HydrophobicContact CB-CE2 4.44Å; Y213-L224 HydrophobicContact CD1-CB 4.07Å; Y213-L224 HydrophobicContact CG-CB 4.49Å; Y213-H225 CarbonylContact C-O 3.51Å; Y213-H225 VanDerWaalsContact CA-O 3.25Å; Y213-H225 WeakPolarHBondContact CA-O 3.47Å; Y213-Y229 WeakPolarHBondContact CE1-O 3.25Å; Y213-F231 HydrophobicContact CE1-CD2 4.05Å; Y213-F231 AromaticContact CE1-CE2 3.92Å; Y213-F231 HydrophobicContact CE1-CE2 3.92Å
214	D	93.9	Very high	91.8	Very high	34 Å²	34	38.8 Å²	38.8	18%	0.182	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113	163.6	-62.1	-21	0	0	0	107.3	F201 K202 Q203 H225	F201-D214 CarbonylContact O-C 3.58Å; F201-D214 WeakPolarHBondContact O-CA 3.45Å; K202-D214 WeakPolarHBondContact CA-OD1 3.49Å; Q203-D214 PolarHBondContact N-OD1 2.91Å; Q203-D214 PolarHBondContact NE2-OD1 3.38Å; D214-H225 HydrophobicContact CB-CB 4.35Å; D214-H225 PolarHBondContact N-O 2.6Å; D214-H225 WeakPolarHBondContact O-CB 3.29Å; D214-H225 PolarHBondContact O-N 3.45Å
215	V	94.1	Very high	91.5	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	105.7	-173.3	-179.7	0	0	0	0	109.4	E200 F201 L204 L217 I222 H223 L224 F317	E200-V215 WeakPolarHBondContact CA-O 3.09Å; F201-V215 HydrophobicContact CB-CB 4.35Å; F201-V215 PolarHBondContact N-O 3.14Å; F201-V215 PolarHBondContact O-N 2.77Å; L204-V215 HydrophobicContact CB-CG2 4.27Å; L204-V215 HydrophobicContact CD1-CB 4.02Å; L204-V215 HydrophobicContact CD1-CG2 3.72Å; L204-V215 HydrophobicContact CG-CG2 4.29Å; V215-L217 HydrophobicContact CG1-CD2 3.92Å; V215-I222 HydrophobicContact CG1-CG2 3.63Å; V215-H223 WeakPolarHBondContact CA-O 3.44Å; V215-L224 HydrophobicContact CB-CD2 4.18Å; V215-L224 HydrophobicContact CG1-CD2 3.82Å; V215-L224 HydrophobicContact CG2-CD2 3.47Å; V215-L224 VanDerWaalsContact CG2-CD2 3.47Å; V215-F317 HydrophobicContact CG1-CZ 4.14Å
216	K	92.5	Very high	91.1	Very high	51 Å²	51	38.2 Å²	38.2	22%	0.222	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.5	177.5	-65.4	175.1	179.3	175.6	0	110	F197 E200 Y218 H223	F197-K216 HydrophobicContact CB-CB 4.13Å; F197-K216 HydrophobicContact CD1-CD 4.3Å; F197-K216 HydrophobicContact CG-CB 4.48Å; E200-K216 HydrophobicContact CB-CG 4.32Å; E200-K216 HydrophobicContact CG-CG 3.95Å; E200-K216 WeakPolarHBondContact OE1-CE 3.15Å; E200-K216 IonicContact OE1-NZ 3.35Å; K216-Y218 HydrophobicContact CB-CE2 3.84Å; K216-H223 HydrophobicContact CB-CB 4.29Å; K216-H223 PolarHBondContact N-O 3.42Å; K216-H223 PolarHBondContact O-N 3.04Å
217	L	93.1	Very high	90.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126	-176.2	-58	-170.5	0	0	0	111.3	F197 L198 A199 F201 V215 I222 V316 F317 L320 Y321	F197-L217 CarbonylContact C-O 3.58Å; F197-L217 WeakPolarHBondContact CA-O 3.18Å; L198-L217 PolarHBondContact N-O 2.85Å; A199-L217 HydrophobicContact CB-CB 4.41Å; A199-L217 HydrophobicContact CB-CD1 4.24Å; A199-L217 PolarHBondContact O-N 2.83Å; F201-L217 HydrophobicContact CD2-CD1 4.4Å; F201-L217 HydrophobicContact CE2-CD1 3.74Å; F201-L217 HydrophobicContact CE2-CG 4.34Å; V215-L217 HydrophobicContact CG1-CD2 3.92Å; L217-I222 HydrophobicContact CD2-CB 4.39Å; L217-I222 HydrophobicContact CD2-CG1 3.93Å; L217-I222 HydrophobicContact CD2-CG2 3.93Å; L217-V316 HydrophobicContact CD1-CB 4.49Å; L217-V316 HydrophobicContact CD1-CG1 3.44Å; L217-V316 VanDerWaalsContact CD1-CG1 3.44Å; L217-F317 HydrophobicContact CD1-CD2 3.99Å; L217-F317 HydrophobicContact CD1-CE2 3.77Å; L217-F317 HydrophobicContact CD2-CD2 4.38Å; L217-F317 HydrophobicContact CD2-CE2 3.61Å; L217-F317 HydrophobicContact CD2-CZ 3.71Å; L217-F317 HydrophobicContact CG-CE2 4.28Å; L217-L320 HydrophobicContact CB-CD2 3.72Å; L217-L320 HydrophobicContact CD1-CD2 4.09Å; L217-L320 HydrophobicContact CG-CD2 4.48Å; L217-Y321 HydrophobicContact CD2-CE2 4.29Å
218	Y	90.4	Very high	89.7	Confident	12 Å²	12	49.3 Å²	49.3	5%	0.047	24%	0.243	C	C	.	.			trans	-115.3	159.3	173.2	-64.1	-93.5	0	0	0	110.3	V193 G195 F197 K216 S220 F221 H223 Y321	V193-Y218 HydrophobicContact CG1-CD2 4.26Å; V193-Y218 HydrophobicContact CG1-CE1 3.71Å; V193-Y218 HydrophobicContact CG1-CE2 3.36Å; V193-Y218 WeakPolarHBondContact CG1-OH 3.42Å; G195-Y218 WeakPolarHBondContact O-CE1 3.46Å; F197-Y218 HydrophobicContact CB-CD1 4.49Å; F197-Y218 HydrophobicContact CB-CE1 3.9Å; F197-Y218 HydrophobicContact CB-CE2 3.97Å; K216-Y218 HydrophobicContact CB-CE2 3.84Å; Y218-S220 PolarHBondContact O-N 2.71Å; Y218-S220 VanDerWaalsContact O-N 3.15Å; Y218-F221 CarbonylContact C-O 3.59Å; Y218-F221 WeakPolarHBondContact CA-O 3.07Å; Y218-F221 VanDerWaalsContact CB-O 3.28Å; Y218-F221 WeakPolarHBondContact CB-O 3.3Å; Y218-F221 HydrophobicContact CD1-CE1 4.43Å; Y218-F221 HydrophobicContact CD1-CE2 4.48Å; Y218-F221 AromaticContact CD1-CZ 3.96Å; Y218-F221 HydrophobicContact CD1-CZ 3.96Å; Y218-F221 AromaticContact CD2-CD2 3.81Å; Y218-F221 HydrophobicContact CD2-CD2 3.81Å; Y218-F221 HydrophobicContact CD2-CE1 4.38Å; Y218-F221 AromaticContact CD2-CE2 3.24Å; Y218-F221 HydrophobicContact CD2-CE2 3.24Å; Y218-F221 AromaticContact CD2-CZ 3.57Å; Y218-F221 HydrophobicContact CD2-CZ 3.57Å; Y218-F221 HydrophobicContact CE1-CZ 4.43Å; Y218-F221 AromaticContact CE2-CE2 3.77Å; Y218-F221 HydrophobicContact CE2-CE2 3.77Å; Y218-F221 HydrophobicContact CE2-CZ 4.11Å; Y218-F221 HydrophobicContact CG-CD2 4.25Å; Y218-F221 AromaticContact CG-CE1 3.97Å; Y218-F221 HydrophobicContact CG-CE1 3.97Å; Y218-F221 AromaticContact CG-CE2 3.68Å; Y218-F221 HydrophobicContact CG-CE2 3.68Å; Y218-F221 AromaticContact CG-CZ 3.51Å; Y218-F221 HydrophobicContact CG-CZ 3.51Å; Y218-F221 PolarHBondContact N-O 2.82Å; Y218-H223 HydrophobicContact CD2-CB 4.46Å; Y218-H223 HydrophobicContact CE2-CB 4.12Å; Y218-Y321 WeakPolarHBondContact O-CE1 3.44Å; Y218-Y321 PolarHBondContact O-OH 3.43Å
219	P	85.9	Confident	89	Confident	59 Å²	59	52.2 Å²	52.2	38%	0.383	25%	0.254	S	S	.	.	S	Bend	trans	-57	-28.1	176.5	-23.7	31.2	0	0	0	114.7	L198 W292	L198-P219 HydrophobicContact CD1-CG 3.92Å; L198-P219 HydrophobicContact CG-CG 4.29Å; P219-W292 HydrophobicContact CG-CH2 4.45Å
220	S	83.3	Confident	88.5	Confident	66 Å²	66	54.6 Å²	54.6	46%	0.462	27%	0.267	S	S	.	.	S	Bend	trans	-112.8	-14.5	-174.4	54.3	0	0	0	0	114.6	Y218 K235	Y218-S220 PolarHBondContact O-N 2.71Å; Y218-S220 VanDerWaalsContact O-N 3.15Å; S220-K235 WeakPolarHBondContact O-CB 3.35Å; S220-K235 WeakPolarHBondContact O-CG 3.47Å; S220-K235 PolarHBondContact O-N 2.84Å
221	F	89.2	Confident	88.2	Confident	17 Å²	17	46.2 Å²	46.2	8%	0.075	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	165.7	-178.9	62.6	-88.8	0	0	0	112	V193 Y218 H223 K232 V233 Y321	V193-F221 HydrophobicContact CG1-CE2 4.03Å; V193-F221 HydrophobicContact CG1-CZ 3.95Å; Y218-F221 CarbonylContact C-O 3.59Å; Y218-F221 WeakPolarHBondContact CA-O 3.07Å; Y218-F221 VanDerWaalsContact CB-O 3.28Å; Y218-F221 WeakPolarHBondContact CB-O 3.3Å; Y218-F221 HydrophobicContact CD1-CE1 4.43Å; Y218-F221 HydrophobicContact CD1-CE2 4.48Å; Y218-F221 AromaticContact CD1-CZ 3.96Å; Y218-F221 HydrophobicContact CD1-CZ 3.96Å; Y218-F221 AromaticContact CD2-CD2 3.81Å; Y218-F221 HydrophobicContact CD2-CD2 3.81Å; Y218-F221 HydrophobicContact CD2-CE1 4.38Å; Y218-F221 AromaticContact CD2-CE2 3.24Å; Y218-F221 HydrophobicContact CD2-CE2 3.24Å; Y218-F221 AromaticContact CD2-CZ 3.57Å; Y218-F221 HydrophobicContact CD2-CZ 3.57Å; Y218-F221 HydrophobicContact CE1-CZ 4.43Å; Y218-F221 AromaticContact CE2-CE2 3.77Å; Y218-F221 HydrophobicContact CE2-CE2 3.77Å; Y218-F221 HydrophobicContact CE2-CZ 4.11Å; Y218-F221 HydrophobicContact CG-CD2 4.25Å; Y218-F221 AromaticContact CG-CE1 3.97Å; Y218-F221 HydrophobicContact CG-CE1 3.97Å; Y218-F221 AromaticContact CG-CE2 3.68Å; Y218-F221 HydrophobicContact CG-CE2 3.68Å; Y218-F221 AromaticContact CG-CZ 3.51Å; Y218-F221 HydrophobicContact CG-CZ 3.51Å; Y218-F221 PolarHBondContact N-O 2.82Å; F221-H223 HydrophobicContact CD2-CB 4.4Å; F221-H223 HydrophobicContact CE2-CB 4.18Å; F221-K232 HydrophobicContact CB-CG 4.11Å; F221-K232 HydrophobicContact CD2-CD 3.97Å; F221-K232 HydrophobicContact CD2-CG 3.5Å; F221-K232 VanDerWaalsContact CD2-CG 3.5Å; F221-K232 VanDerWaalsContact CE1-CE 3.43Å; F221-K232 HydrophobicContact CE2-CD 4.18Å; F221-K232 VanDerWaalsContact CE2-CE 3.49Å; F221-K232 HydrophobicContact CE2-CG 4.08Å; F221-K232 HydrophobicContact CG-CD 4.18Å; F221-K232 HydrophobicContact CG-CG 3.89Å; F221-V233 CarbonylContact C-O 3.49Å; F221-V233 VanDerWaalsContact CA-O 3.24Å; F221-V233 WeakPolarHBondContact CA-O 3.37Å; F221-V233 WeakPolarHBondContact CB-O 3.3Å; F221-Y321 PolarHBondContact O-OH 2.9Å; F221-Y321 VanDerWaalsContact O-OH 3.12Å
222	I	90.9	Very high	87.8	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.3	166.1	-57.6	163	0	0	0	107.5	V215 L217 L224 K232 V233 I238 F317 Y321	V215-I222 HydrophobicContact CG1-CG2 3.63Å; L217-I222 HydrophobicContact CD2-CB 4.39Å; L217-I222 HydrophobicContact CD2-CG1 3.93Å; L217-I222 HydrophobicContact CD2-CG2 3.93Å; I222-L224 HydrophobicContact CG2-CD2 3.91Å; I222-L224 HydrophobicContact CG2-CG 4.33Å; I222-K232 CarbonylContact O-C 3.37Å; I222-K232 WeakPolarHBondContact O-CA 3.4Å; I222-V233 HydrophobicContact CB-CB 4.21Å; I222-V233 PolarHBondContact N-O 2.78Å; I222-V233 PolarHBondContact O-N 2.89Å; I222-I238 HydrophobicContact CD1-CD1 3.48Å; I222-I238 VanDerWaalsContact CD1-CD1 3.48Å; I222-I238 HydrophobicContact CD1-CG1 4.49Å; I222-I238 HydrophobicContact CG1-CD1 4.33Å; I222-F317 HydrophobicContact CD1-CD1 4.09Å; I222-F317 HydrophobicContact CD1-CE1 3.47Å; I222-F317 VanDerWaalsContact CD1-CE1 3.47Å; I222-F317 HydrophobicContact CD1-CZ 4.11Å; I222-F317 HydrophobicContact CG1-CE1 4.42Å; I222-Y321 HydrophobicContact CD1-CD2 4.23Å; I222-Y321 HydrophobicContact CD1-CE2 3.59Å; I222-Y321 HydrophobicContact CG1-CD2 4.43Å; I222-Y321 HydrophobicContact CG1-CE1 4.27Å; I222-Y321 HydrophobicContact CG1-CE2 3.41Å; I222-Y321 VanDerWaalsContact CG1-CE2 3.41Å; I222-Y321 WeakPolarHBondContact CG1-OH 3.31Å
223	H	89.7	Confident	87.5	Confident	23 Å²	23	41.7 Å²	41.7	11%	0.106	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.1	170	-177	-142.2	0	0	0	109.5	V215 K216 Y218 F221 F231	V215-H223 WeakPolarHBondContact CA-O 3.44Å; K216-H223 HydrophobicContact CB-CB 4.29Å; K216-H223 PolarHBondContact N-O 3.42Å; K216-H223 PolarHBondContact O-N 3.04Å; Y218-H223 HydrophobicContact CD2-CB 4.46Å; Y218-H223 HydrophobicContact CE2-CB 4.12Å; F221-H223 HydrophobicContact CD2-CB 4.4Å; F221-H223 HydrophobicContact CE2-CB 4.18Å; H223-F231 WeakPolarHBondContact CA-O 3.47Å
224	L	91.3	Very high	87.2	Confident	9 Å²	9	43.8 Å²	43.8	5%	0.047	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	98.1	173.8	-55.9	176.3	0	0	0	108	Y213 V215 I222 D230 F231 V233 I262 V272	Y213-L224 HydrophobicContact CD1-CB 4.07Å; Y213-L224 HydrophobicContact CG-CB 4.49Å; V215-L224 HydrophobicContact CB-CD2 4.18Å; V215-L224 HydrophobicContact CG1-CD2 3.82Å; V215-L224 HydrophobicContact CG2-CD2 3.47Å; V215-L224 VanDerWaalsContact CG2-CD2 3.47Å; I222-L224 HydrophobicContact CG2-CD2 3.91Å; I222-L224 HydrophobicContact CG2-CG 4.33Å; L224-D230 CarbonylContact O-C 3.57Å; L224-D230 WeakPolarHBondContact O-CA 3.2Å; L224-F231 HydrophobicContact CB-CB 4.18Å; L224-F231 HydrophobicContact CB-CD2 4.39Å; L224-F231 HydrophobicContact CD1-CB 4.27Å; L224-F231 HydrophobicContact CD1-CD2 4.49Å; L224-F231 PolarHBondContact N-O 3.43Å; L224-F231 PolarHBondContact O-N 3.21Å; L224-V233 HydrophobicContact CD1-CG2 4.14Å; L224-V233 HydrophobicContact CG-CG2 4.49Å; L224-I262 HydrophobicContact CD1-CD1 4.45Å; L224-V272 HydrophobicContact CD1-CG1 4.17Å; L224-V272 HydrophobicContact CD1-CG2 3.93Å
225	H	88.4	Confident	86.9	Confident	70 Å²	70	47.3 Å²	47.3	32%	0.324	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.5	-178.1	-177.7	60	0	0	0	111.1	Y213 D214 D230	Y213-H225 CarbonylContact C-O 3.51Å; Y213-H225 VanDerWaalsContact CA-O 3.25Å; Y213-H225 WeakPolarHBondContact CA-O 3.47Å; D214-H225 HydrophobicContact CB-CB 4.35Å; D214-H225 PolarHBondContact N-O 2.6Å; D214-H225 WeakPolarHBondContact O-CB 3.29Å; D214-H225 PolarHBondContact O-N 3.45Å; H225-D230 WeakPolarHBondContact CA-OD1 3.44Å; H225-D230 IonicContact CE1-OD1 3.96Å; H225-D230 IonicContact CE1-OD2 3.69Å; H225-D230 IonicContact CG-OD1 3.7Å; H225-D230 IonicContact ND1-OD1 3.25Å; H225-D230 PolarHBondContact ND1-OD1 3.26Å; H225-D230 IonicContact ND1-OD2 3.02Å; H225-D230 PolarHBondContact ND1-OD2 2.91Å; H225-D230 VanDerWaalsContact ND1-OD2 3.14Å
226	G	86.5	Confident	86.6	Confident	10 Å²	10	53.4 Å²	53.4	10%	0.103	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	169.6	-178.4	0	0	0	0	0	112.2	S228 Y229 D230	G226-S228 VanDerWaalsContact C-N 3.29Å; G226-S228 PolarHBondContact O-N 2.83Å; G226-Y229 WeakPolarHBondContact CA-O 3.48Å; G226-Y229 PolarHBondContact N-O 2.86Å; G226-D230 PolarHBondContact N-OD1 2.77Å
227	K	80.8	Confident	86.4	Confident	195 Å²	195	51.6 Å²	51.6	85%	0.848	27%	0.267	S	S	*	.	S	Bend	trans	-66	-32.4	175.5	-70.1	-173.3	178.8	-177	0	113.5
228	S	76.3	Confident	86.4	Confident	74 Å²	74	51.8 Å²	51.8	52%	0.517	27%	0.267	S	S	.	.	S	Bend	trans	-113.9	-29.4	-173.9	-56.8	0	0	0	0	112.7	G226	G226-S228 VanDerWaalsContact C-N 3.29Å; G226-S228 PolarHBondContact O-N 2.83Å
229	Y	77	Confident	86.4	Confident	83 Å²	83	54 Å²	54	33%	0.325	28%	0.283	S	S	.	.			trans	-144	141	-171.6	-53.5	-65.2	0	0	0	109.9	Y213 G226 H264	Y213-Y229 WeakPolarHBondContact CE1-O 3.25Å; G226-Y229 WeakPolarHBondContact CA-O 3.48Å; G226-Y229 PolarHBondContact N-O 2.86Å; Y229-H264 AromaticContact CD1-CE1 3.49Å; Y229-H264 VanDerWaalsContact CD1-CE1 3.49Å; Y229-H264 WeakPolarHBondContact CD1-CE1 3.26Å; Y229-H264 AromaticContact CD1-ND1 3.64Å; Y229-H264 AromaticContact CE1-CE1 3.06Å; Y229-H264 WeakPolarHBondContact CE1-CE1 3.29Å; Y229-H264 AromaticContact CE1-ND1 3.7Å; Y229-H264 AromaticContact CE1-NE2 3.98Å; Y229-H264 AromaticContact CE2-CE1 3.61Å; Y229-H264 AromaticContact CE2-NE2 3.77Å; Y229-H264 AromaticContact CG-CE1 3.96Å; Y229-H264 AromaticContact CG-ND1 3.97Å; Y229-H264 AromaticContact CZ-CE1 3.1Å; Y229-H264 AromaticContact CZ-NE2 3.55Å; Y229-H264 PolarHBondContact OH-CE1 2.85Å
230	D	82.3	Confident	86.6	Confident	53 Å²	53	53.7 Å²	53.7	28%	0.283	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.1	176.7	-68.3	-31.2	0	0	0	109.2	L224 H225 G226	L224-D230 CarbonylContact O-C 3.57Å; L224-D230 WeakPolarHBondContact O-CA 3.2Å; H225-D230 WeakPolarHBondContact CA-OD1 3.44Å; H225-D230 IonicContact CE1-OD1 3.96Å; H225-D230 IonicContact CE1-OD2 3.69Å; H225-D230 IonicContact CG-OD1 3.7Å; H225-D230 IonicContact ND1-OD1 3.25Å; H225-D230 PolarHBondContact ND1-OD1 3.26Å; H225-D230 IonicContact ND1-OD2 3.02Å; H225-D230 PolarHBondContact ND1-OD2 2.91Å; H225-D230 VanDerWaalsContact ND1-OD2 3.14Å; G226-D230 PolarHBondContact N-OD1 2.77Å
231	F	85.1	Confident	87.2	Confident	17 Å²	17	50.6 Å²	50.6	8%	0.075	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.7	177.6	-53.4	-76.4	0	0	0	110.6	P209 Y213 H223 L224 I262 K263 H264	P209-F231 HydrophobicContact CB-CE2 4.14Å; P209-F231 HydrophobicContact CG-CD2 4.33Å; P209-F231 HydrophobicContact CG-CE2 3.79Å; P209-F231 HydrophobicContact CG-CZ 4.23Å; Y213-F231 HydrophobicContact CE1-CD2 4.05Å; Y213-F231 AromaticContact CE1-CE2 3.92Å; Y213-F231 HydrophobicContact CE1-CE2 3.92Å; H223-F231 WeakPolarHBondContact CA-O 3.47Å; L224-F231 HydrophobicContact CB-CB 4.18Å; L224-F231 HydrophobicContact CB-CD2 4.39Å; L224-F231 HydrophobicContact CD1-CB 4.27Å; L224-F231 HydrophobicContact CD1-CD2 4.49Å; L224-F231 PolarHBondContact N-O 3.43Å; L224-F231 PolarHBondContact O-N 3.21Å; F231-I262 HydrophobicContact CB-CD1 4.38Å; F231-I262 HydrophobicContact CD1-CB 4.32Å; F231-I262 HydrophobicContact CD1-CD1 4.31Å; F231-I262 HydrophobicContact CD2-CD1 4.29Å; F231-I262 HydrophobicContact CG-CD1 4.07Å; F231-K263 WeakPolarHBondContact CE1-O 3.49Å; F231-H264 HydrophobicContact CE1-CB 4.13Å; F231-H264 HydrophobicContact CZ-CB 4.12Å
232	K	84.5	Confident	87.4	Confident	80 Å²	80	49.8 Å²	49.8	35%	0.348	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.1	166.7	-168.6	179.1	-174	179.4	0	108.9	I191 F221 I222 P234	I191-K232 HydrophobicContact CB-CD 4.1Å; I191-K232 HydrophobicContact CD1-CB 4.31Å; I191-K232 HydrophobicContact CD1-CD 3.51Å; I191-K232 HydrophobicContact CG1-CD 3.77Å; I191-K232 HydrophobicContact CG2-CD 3.81Å; F221-K232 HydrophobicContact CB-CG 4.11Å; F221-K232 HydrophobicContact CD2-CD 3.97Å; F221-K232 HydrophobicContact CD2-CG 3.5Å; F221-K232 VanDerWaalsContact CD2-CG 3.5Å; F221-K232 VanDerWaalsContact CE1-CE 3.43Å; F221-K232 HydrophobicContact CE2-CD 4.18Å; F221-K232 VanDerWaalsContact CE2-CE 3.49Å; F221-K232 HydrophobicContact CE2-CG 4.08Å; F221-K232 HydrophobicContact CG-CD 4.18Å; F221-K232 HydrophobicContact CG-CG 3.89Å; I222-K232 CarbonylContact O-C 3.37Å; I222-K232 WeakPolarHBondContact O-CA 3.4Å; K232-P234 WeakPolarHBondContact O-CD 3.14Å
233	V	88.5	Confident	87.7	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	101.6	-179.9	-176.9	0	0	0	0	108.6	F221 I222 L224 T237 I238 L258 I262	F221-V233 CarbonylContact C-O 3.49Å; F221-V233 VanDerWaalsContact CA-O 3.24Å; F221-V233 WeakPolarHBondContact CA-O 3.37Å; F221-V233 WeakPolarHBondContact CB-O 3.3Å; I222-V233 HydrophobicContact CB-CB 4.21Å; I222-V233 PolarHBondContact N-O 2.78Å; I222-V233 PolarHBondContact O-N 2.89Å; L224-V233 HydrophobicContact CD1-CG2 4.14Å; L224-V233 HydrophobicContact CG-CG2 4.49Å; V233-T237 VanDerWaalsContact CG1-OG1 3.31Å; V233-T237 WeakPolarHBondContact CG1-OG1 3.44Å; V233-I238 HydrophobicContact CG1-CG1 4.24Å; V233-L258 HydrophobicContact CG1-CD1 4.01Å; V233-L258 HydrophobicContact CG1-CD2 3.51Å; V233-L258 HydrophobicContact CG1-CG 4.42Å; V233-L258 HydrophobicContact CG2-CD1 4.28Å; V233-I262 HydrophobicContact CG2-CG2 3.74Å
234	P	86.8	Confident	88	Confident	55 Å²	55	49.1 Å²	49.1	36%	0.357	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	144.7	178.3	-20.8	33.7	0	0	0	111.7	K232 N236 T237	K232-P234 WeakPolarHBondContact O-CD 3.14Å; P234-N236 WeakPolarHBondContact CB-OD1 3.24Å; P234-N236 PolarHBondContact O-N 2.86Å; P234-N236 VanDerWaalsContact O-N 3.15Å; P234-T237 HydrophobicContact CB-CG2 4.08Å; P234-T237 HydrophobicContact CG-CG2 4.18Å; P234-T237 WeakPolarHBondContact O-CB 3.45Å; P234-T237 PolarHBondContact O-N 2.8Å; P234-T237 PolarHBondContact O-OG1 2.78Å
235	K	89.3	Confident	88.1	Confident	108 Å²	108	50.8 Å²	50.8	47%	0.47	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-58.1	-33.9	-173.7	71.3	173.8	179.1	-177	0	113.8	S220 T237 I238 Y321	S220-K235 WeakPolarHBondContact O-CB 3.35Å; S220-K235 WeakPolarHBondContact O-CG 3.47Å; S220-K235 PolarHBondContact O-N 2.84Å; K235-T237 PolarHBondContact O-N 2.87Å; K235-I238 PolarHBondContact O-N 2.76Å; K235-Y321 HydrophobicContact CB-CD1 3.54Å; K235-Y321 HydrophobicContact CB-CE1 4.02Å; K235-Y321 HydrophobicContact CB-CG 4.49Å
236	N	86.9	Confident	88.4	Confident	132 Å²	132	49.6 Å²	49.6	71%	0.706	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-70.3	-16	-179.3	61.1	-20.6	0	0	0	112.9	P234 I238	P234-N236 WeakPolarHBondContact CB-OD1 3.24Å; P234-N236 PolarHBondContact O-N 2.86Å; P234-N236 VanDerWaalsContact O-N 3.15Å; N236-I238 VanDerWaalsContact C-N 3.34Å
237	T	89	Confident	88.5	Confident	13 Å²	13	51.6 Å²	51.6	8%	0.08	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-80.8	-17.5	175.6	69.4	0	0	0	0	112.8	V233 P234 K235 T239 L258 D259 P260	V233-T237 VanDerWaalsContact CG1-OG1 3.31Å; V233-T237 WeakPolarHBondContact CG1-OG1 3.44Å; P234-T237 HydrophobicContact CB-CG2 4.08Å; P234-T237 HydrophobicContact CG-CG2 4.18Å; P234-T237 WeakPolarHBondContact O-CB 3.45Å; P234-T237 PolarHBondContact O-N 2.8Å; P234-T237 PolarHBondContact O-OG1 2.78Å; K235-T237 PolarHBondContact O-N 2.87Å; T237-T239 PolarHBondContact O-N 2.89Å; T237-L258 CarbonylContact O-C 3.35Å; T237-L258 VanDerWaalsContact O-CA 3.32Å; T237-L258 WeakPolarHBondContact O-CA 3.32Å; T237-D259 VanDerWaalsContact CA-O 3.24Å; T237-D259 WeakPolarHBondContact CA-O 3.36Å; T237-D259 PolarHBondContact O-N 2.67Å; T237-P260 HydrophobicContact CG2-CG 4.29Å
238	I	92.1	Very high	88.9	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.015	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.9	-178.5	-55.2	169.9	0	0	0	108.2	I222 V233 K235 N236 L241 V256 L258 Y321 Q323	I222-I238 HydrophobicContact CD1-CD1 3.48Å; I222-I238 VanDerWaalsContact CD1-CD1 3.48Å; I222-I238 HydrophobicContact CD1-CG1 4.49Å; I222-I238 HydrophobicContact CG1-CD1 4.33Å; V233-I238 HydrophobicContact CG1-CG1 4.24Å; K235-I238 PolarHBondContact O-N 2.76Å; N236-I238 VanDerWaalsContact C-N 3.34Å; I238-L241 HydrophobicContact CG2-CD2 3.86Å; I238-L241 HydrophobicContact CG2-CG 4.45Å; I238-V256 HydrophobicContact CG1-CG1 4.3Å; I238-V256 HydrophobicContact CG2-CG1 3.79Å; I238-L258 HydrophobicContact CG1-CD2 4.02Å; I238-Y321 HydrophobicContact CD1-CD1 4.32Å; I238-Y321 HydrophobicContact CD1-CD2 3.77Å; I238-Y321 HydrophobicContact CD1-CE2 4.25Å; I238-Y321 HydrophobicContact CD1-CG 3.82Å; I238-Q323 HydrophobicContact CG2-CG 4.04Å; I238-Q323 PolarHBondContact O-NE2 3.21Å
239	T	90.2	Very high	89.4	Confident	60 Å²	60	47.1 Å²	47.1	37%	0.368	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-31.2	-177.2	53.5	0	0	0	0	113.1	T237 Q257 D259 Q323	T237-T239 PolarHBondContact O-N 2.89Å; T239-Q257 PolarHBondContact N-O 3.24Å; T239-Q257 WeakPolarHBondContact OG1-CB 3.31Å; T239-Q257 VanDerWaalsContact OG1-CG 3.32Å; T239-Q257 WeakPolarHBondContact OG1-CG 3.33Å; T239-Q257 PolarHBondContact OG1-O 3.32Å; T239-D259 HydrophobicContact CG2-CB 3.7Å; T239-Q323 PolarHBondContact O-OE1 3.46Å
240	R	90.8	Very high	90.1	Very high	52 Å²	52	51.7 Å²	51.7	20%	0.196	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	142.2	-179.2	-168.2	173.8	-71.6	-152.6	1.5	111.8	M242 Q257	R240-M242 HydrophobicContact CG-CG 4.07Å; R240-Q257 HydrophobicContact CB-CB 4.03Å; R240-Q257 PolarHBondContact O-N 3.33Å
241	L	95	Very high	90.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.7	169.1	-57.2	176.5	0	0	0	109	I238 F254 V256 F317 Q323 V325 T326	I238-L241 HydrophobicContact CG2-CD2 3.86Å; I238-L241 HydrophobicContact CG2-CG 4.45Å; L241-F254 HydrophobicContact CB-CE2 4.47Å; L241-F254 HydrophobicContact CB-CZ 4.5Å; L241-F254 HydrophobicContact CD2-CZ 4.09Å; L241-V256 HydrophobicContact CD2-CB 4.31Å; L241-V256 HydrophobicContact CD2-CG1 3.91Å; L241-V256 HydrophobicContact CD2-CG2 3.91Å; L241-F317 HydrophobicContact CD1-CB 3.77Å; L241-F317 HydrophobicContact CD2-CB 4.49Å; L241-F317 HydrophobicContact CD2-CD1 4.18Å; L241-Q323 HydrophobicContact CD1-CB 3.73Å; L241-Q323 HydrophobicContact CG-CB 3.89Å; L241-V325 HydrophobicContact CB-CG2 4.15Å; L241-V325 HydrophobicContact CD1-CG2 4.2Å; L241-T326 PolarHBondContact O-N 2.81Å
242	M	95	Very high	91.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.2	-179.3	-61.9	177.3	-78.6	0	0	110.7	R240 L244 F254 A255 F271 T326 L354 T359	R240-M242 HydrophobicContact CG-CG 4.07Å; M242-L244 HydrophobicContact CB-CD1 4.45Å; M242-L244 HydrophobicContact CB-CD2 4.31Å; M242-L244 HydrophobicContact CB-CG 4.17Å; M242-F254 CarbonylContact O-C 3.52Å; M242-F254 WeakPolarHBondContact O-CA 3.42Å; M242-F254 WeakPolarHBondContact O-CD2 3.2Å; M242-A255 HydrophobicContact CB-CB 4.29Å; M242-A255 HydrophobicContact CE-CB 3.87Å; M242-A255 PolarHBondContact N-O 3.1Å; M242-A255 PolarHBondContact O-N 3.17Å; M242-F271 HydrophobicContact CE-CD1 3.97Å; M242-F271 HydrophobicContact CE-CE1 3.57Å; M242-T326 VanDerWaalsContact CA-O 3.3Å; M242-T326 WeakPolarHBondContact CA-O 3.17Å; M242-L354 HydrophobicContact SD-CD1 4.31Å; M242-T359 HydrophobicContact CE-CG2 4.21Å; M242-T359 HydrophobicContact SD-CG2 3.89Å
243	V	96.4	Very high	91.7	Very high	14 Å²	14	48.8 Å²	48.8	9%	0.085	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.9	170.2	175.3	0	0	0	0	106.8	I252 F254 Y310 A314 V325 T326 V327 P328	V243-I252 HydrophobicContact CG1-CG2 3.66Å; V243-F254 HydrophobicContact CG2-CD2 3.75Å; V243-F254 HydrophobicContact CG2-CE2 4.09Å; V243-Y310 HydrophobicContact CG1-CD2 4.21Å; V243-A314 HydrophobicContact CG2-CB 3.73Å; V243-V325 HydrophobicContact CB-CG1 4.21Å; V243-V325 HydrophobicContact CG2-CG1 3.54Å; V243-T326 PolarHBondContact N-O 3.49Å; V243-V327 HydrophobicContact CB-CG1 4.42Å; V243-P328 WeakPolarHBondContact O-CD 3.5Å
244	L	95.3	Very high	92.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	103.5	-171.3	-55.5	175.9	0	0	0	109.1	M242 F253 Y352 L354 T359 V361	M242-L244 HydrophobicContact CB-CD1 4.45Å; M242-L244 HydrophobicContact CB-CD2 4.31Å; M242-L244 HydrophobicContact CB-CG 4.17Å; L244-F253 HydrophobicContact CB-CB 4.23Å; L244-F253 PolarHBondContact N-O 3.2Å; L244-F253 PolarHBondContact O-N 3.44Å; L244-Y352 HydrophobicContact CB-CD1 4.1Å; L244-Y352 HydrophobicContact CB-CE1 3.7Å; L244-Y352 HydrophobicContact CB-CE2 4.18Å; L244-Y352 HydrophobicContact CB-CG 4.47Å; L244-Y352 HydrophobicContact CD1-CD2 4.09Å; L244-Y352 HydrophobicContact CD1-CE2 4.29Å; L244-Y352 HydrophobicContact CD1-CG 4.35Å; L244-Y352 HydrophobicContact CD2-CD1 4.01Å; L244-Y352 HydrophobicContact CD2-CE1 4.47Å; L244-Y352 HydrophobicContact CD2-CG 4.09Å; L244-L354 HydrophobicContact CD2-CD2 3.97Å; L244-T359 HydrophobicContact CD1-CG2 3.98Å; L244-V361 HydrophobicContact CD1-CG1 4.05Å; L244-V361 HydrophobicContact CD1-CG2 4.05Å
245	P	94.8	Very high	92.5	Very high	45 Å²	45	46.2 Å²	46.2	29%	0.292	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130.2	178.3	-18.5	31.8	0	0	0	111.6	P328 Y352	P245-P328 HydrophobicContact CG-CG 4.3Å; P245-Y352 WeakPolarHBondContact O-CE1 3.09Å; P245-Y352 PolarHBondContact O-OH 2.97Å; P245-Y352 VanDerWaalsContact O-OH 3.04Å
246	H	93.5	Very high	92.8	Very high	44 Å²	44	41.4 Å²	41.4	20%	0.204	21%	0.208	C	C	.	.			trans	-71.8	141.2	174.7	-172.2	-80.5	0	0	0	109.9	D248 N249 Q251 F253 L350	H246-D248 WeakPolarHBondContact CB-OD1 3.24Å; H246-D248 IonicContact CE1-OD1 2.74Å; H246-D248 IonicContact CE1-OD2 3.98Å; H246-D248 IonicContact CG-OD1 2.71Å; H246-D248 VanDerWaalsContact ND1-CB 3.32Å; H246-D248 WeakPolarHBondContact ND1-CB 3.47Å; H246-D248 PolarHBondContact ND1-N 2.97Å; H246-D248 IonicContact ND1-OD1 3.5Å; H246-D248 PolarHBondContact ND1-OD1 3.38Å; H246-D248 IonicContact ND1-OD2 2.64Å; H246-D248 PolarHBondContact ND1-OD2 3.46Å; H246-D248 PolarHBondContact O-N 2.93Å; H246-D248 VanDerWaalsContact O-N 3.08Å; H246-N249 PolarHBondContact O-N 2.9Å; H246-Q251 HydrophobicContact CB-CB 3.92Å; H246-Q251 WeakPolarHBondContact CB-O 3.49Å; H246-Q251 PolarHBondContact N-O 3.46Å; H246-F253 HydrophobicContact CB-CE2 4.06Å; H246-F253 AromaticContact CD2-CE2 3.54Å; H246-F253 AromaticContact CD2-CZ 3.66Å; H246-L350 VanDerWaalsContact CD2-CD1 3.48Å; H246-L350 WeakPolarHBondContact CD2-CD1 3.25Å
247	P	89.9	Confident	93.1	Very high	52 Å²	52	37.3 Å²	37.3	34%	0.338	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.4	-177.8	24.2	-35.5	0	0	0	114.5	N249 L350	P247-N249 PolarHBondContact O-N 3.36Å; P247-L350 VanDerWaalsContact CD-CD1 3.47Å; P247-L350 HydrophobicContact CG-CD1 4.06Å; P247-L350 HydrophobicContact CG-CD2 3.75Å
248	D	87.7	Confident	93.3	Very high	62 Å²	62	36.9 Å²	36.9	33%	0.332	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-5.9	173	76.3	-11.7	0	0	0	114	H246 R250 Q251	H246-D248 WeakPolarHBondContact CB-OD1 3.24Å; H246-D248 IonicContact CE1-OD1 2.74Å; H246-D248 IonicContact CE1-OD2 3.98Å; H246-D248 IonicContact CG-OD1 2.71Å; H246-D248 VanDerWaalsContact ND1-CB 3.32Å; H246-D248 WeakPolarHBondContact ND1-CB 3.47Å; H246-D248 PolarHBondContact ND1-N 2.97Å; H246-D248 IonicContact ND1-OD1 3.5Å; H246-D248 PolarHBondContact ND1-OD1 3.38Å; H246-D248 IonicContact ND1-OD2 2.64Å; H246-D248 PolarHBondContact ND1-OD2 3.46Å; H246-D248 PolarHBondContact O-N 2.93Å; H246-D248 VanDerWaalsContact O-N 3.08Å; D248-R250 PolarHBondContact O-N 3.13Å; D248-R250 VanDerWaalsContact O-N 3.14Å; D248-R250 PolarHBondContact OD1-N 3.42Å; D248-Q251 PolarHBondContact OD1-N 2.78Å
249	N	87.3	Confident	93	Very high	113 Å²	113	41.7 Å²	41.7	60%	0.604	21%	0.208	S	C	*	.	S	Bend	trans	59.4	14.3	-176.5	-73	-50.4	0	0	0	115.6	H246 P247 K278	H246-N249 PolarHBondContact O-N 2.9Å; P247-N249 PolarHBondContact O-N 3.36Å; N249-K278 WeakPolarHBondContact O-CD 3.18Å
250	R	91.9	Very high	92.9	Very high	180 Å²	180	42.8 Å²	42.8	68%	0.679	22%	0.216	S	C	*	.	S	Bend	trans	-110.8	-28	179.7	-64.4	176.4	-176.5	-163.2	-0.9	112.6	D248 K278	D248-R250 PolarHBondContact O-N 3.13Å; D248-R250 VanDerWaalsContact O-N 3.14Å; D248-R250 PolarHBondContact OD1-N 3.42Å; R250-K278 VanDerWaalsContact O-CB 3.27Å; R250-K278 WeakPolarHBondContact O-CB 3.49Å; R250-K278 PolarHBondContact O-N 3.01Å
251	Q	94.2	Very high	92.7	Very high	72 Å²	72	41.1 Å²	41.1	34%	0.336	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.8	-174.9	-62.9	-180	-1.1	0	0	111.8	H246 D248 L275 F276	H246-Q251 HydrophobicContact CB-CB 3.92Å; H246-Q251 WeakPolarHBondContact CB-O 3.49Å; H246-Q251 PolarHBondContact N-O 3.46Å; D248-Q251 PolarHBondContact OD1-N 2.78Å; Q251-L275 HydrophobicContact CB-CD1 3.91Å; Q251-L275 HydrophobicContact CG-CD1 4.46Å; Q251-F276 CarbonylContact C-O 3.57Å; Q251-F276 VanDerWaalsContact CA-O 3.31Å; Q251-F276 WeakPolarHBondContact CA-O 3.25Å
252	I	95.6	Very high	92.4	Very high	8 Å²	8	42 Å²	42	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.8	175.9	-63.1	177.3	0	0	0	108.1	V243 F276 K278 Y310	V243-I252 HydrophobicContact CG1-CG2 3.66Å; I252-F276 PolarHBondContact N-O 3.42Å; I252-F276 PolarHBondContact O-N 2.69Å; I252-K278 HydrophobicContact CD1-CB 4.35Å; I252-K278 HydrophobicContact CD1-CG 4.09Å; I252-Y310 HydrophobicContact CB-CG 4.39Å; I252-Y310 HydrophobicContact CD1-CD1 3.56Å; I252-Y310 HydrophobicContact CD1-CD2 3.61Å; I252-Y310 HydrophobicContact CD1-CE1 3.41Å; I252-Y310 VanDerWaalsContact CD1-CE1 3.41Å; I252-Y310 HydrophobicContact CD1-CE2 3.49Å; I252-Y310 VanDerWaalsContact CD1-CE2 3.49Å; I252-Y310 HydrophobicContact CD1-CG 3.66Å; I252-Y310 VanDerWaalsContact CD1-CZ 3.41Å; I252-Y310 HydrophobicContact CG2-CD2 4.09Å; I252-Y310 HydrophobicContact CG2-CG 4.24Å
253	F	96.1	Very high	91.7	Very high	9 Å²	9	45.1 Å²	45.1	4%	0.039	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.2	169.1	-54.6	-81.5	0	0	0	109.8	L207 L244 H246 V273 S274 L275 L350 V361 P362	L207-F253 HydrophobicContact CD1-CD1 3.83Å; L207-F253 HydrophobicContact CD1-CE1 3.5Å; L207-F253 VanDerWaalsContact CD1-CE1 3.5Å; L244-F253 HydrophobicContact CB-CB 4.23Å; L244-F253 PolarHBondContact N-O 3.2Å; L244-F253 PolarHBondContact O-N 3.44Å; H246-F253 HydrophobicContact CB-CE2 4.06Å; H246-F253 AromaticContact CD2-CE2 3.54Å; H246-F253 AromaticContact CD2-CZ 3.66Å; F253-V273 HydrophobicContact CB-CG1 4.46Å; F253-V273 HydrophobicContact CD1-CG1 4.19Å; F253-S274 CarbonylContact C-O 3.46Å; F253-S274 WeakPolarHBondContact CA-O 3.41Å; F253-L275 HydrophobicContact CD1-CD1 3.67Å; F253-L275 HydrophobicContact CE1-CD1 3.59Å; F253-L275 HydrophobicContact CG-CD1 4.41Å; F253-L275 HydrophobicContact CZ-CD1 4.27Å; F253-L350 HydrophobicContact CE2-CD1 3.82Å; F253-L350 HydrophobicContact CZ-CD1 4.37Å; F253-V361 HydrophobicContact CD2-CG2 4.05Å; F253-V361 HydrophobicContact CE2-CG2 4.32Å; F253-V361 HydrophobicContact CG-CG2 4.31Å; F253-P362 HydrophobicContact CE1-CB 4.42Å
254	F	96.4	Very high	90.8	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.5	165.7	-175.5	-113.2	0	0	0	108.5	L241 M242 V243 V256 S274 F276 V313 A314 F317	L241-F254 HydrophobicContact CB-CE2 4.47Å; L241-F254 HydrophobicContact CB-CZ 4.5Å; L241-F254 HydrophobicContact CD2-CZ 4.09Å; M242-F254 CarbonylContact O-C 3.52Å; M242-F254 WeakPolarHBondContact O-CA 3.42Å; M242-F254 WeakPolarHBondContact O-CD2 3.2Å; V243-F254 HydrophobicContact CG2-CD2 3.75Å; V243-F254 HydrophobicContact CG2-CE2 4.09Å; F254-V256 HydrophobicContact CD1-CG2 4.04Å; F254-V256 HydrophobicContact CE1-CG2 3.56Å; F254-V256 HydrophobicContact CZ-CG2 4.23Å; F254-S274 PolarHBondContact N-O 3.34Å; F254-S274 PolarHBondContact O-N 2.86Å; F254-F276 HydrophobicContact CB-CD2 4Å; F254-F276 HydrophobicContact CB-CE2 3.63Å; F254-F276 HydrophobicContact CG-CE2 4.37Å; F254-V313 HydrophobicContact CD1-CG1 3.88Å; F254-V313 HydrophobicContact CE1-CG1 3.74Å; F254-V313 HydrophobicContact CG-CG1 4.47Å; F254-V313 HydrophobicContact CZ-CG1 4.21Å; F254-A314 HydrophobicContact CD2-CB 4.36Å; F254-A314 HydrophobicContact CE2-CB 3.85Å; F254-F317 AromaticContact CE1-CD1 3.88Å; F254-F317 HydrophobicContact CE1-CD1 3.88Å; F254-F317 HydrophobicContact CE1-CE1 4.06Å; F254-F317 HydrophobicContact CE1-CG 4.18Å; F254-F317 HydrophobicContact CZ-CB 4.11Å; F254-F317 HydrophobicContact CZ-CD1 4.05Å; F254-F317 HydrophobicContact CZ-CG 4.08Å
255	A	95.5	Very high	89.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.7	-177.9	0	0	0	0	0	110.8	M242 V272 V273	M242-A255 HydrophobicContact CB-CB 4.29Å; M242-A255 HydrophobicContact CE-CB 3.87Å; M242-A255 PolarHBondContact N-O 3.1Å; M242-A255 PolarHBondContact O-N 3.17Å; A255-V272 CarbonylContact C-O 3.55Å; A255-V272 WeakPolarHBondContact CA-O 3.44Å; A255-V273 HydrophobicContact CB-CG2 4.14Å
256	V	95.3	Very high	89	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	114.5	175.5	-175.6	0	0	0	0	107.6	I238 L241 F254 L258 F271 V272 F317	I238-V256 HydrophobicContact CG1-CG1 4.3Å; I238-V256 HydrophobicContact CG2-CG1 3.79Å; L241-V256 HydrophobicContact CD2-CB 4.31Å; L241-V256 HydrophobicContact CD2-CG1 3.91Å; L241-V256 HydrophobicContact CD2-CG2 3.91Å; F254-V256 HydrophobicContact CD1-CG2 4.04Å; F254-V256 HydrophobicContact CE1-CG2 3.56Å; F254-V256 HydrophobicContact CZ-CG2 4.23Å; V256-L258 HydrophobicContact CG1-CD2 3.76Å; V256-F271 CarbonylContact O-C 3.54Å; V256-F271 VanDerWaalsContact O-CA 3.25Å; V256-F271 WeakPolarHBondContact O-CA 3.43Å; V256-V272 HydrophobicContact CB-CB 4.29Å; V256-V272 PolarHBondContact N-O 2.91Å; V256-V272 PolarHBondContact O-N 3.25Å; V256-F317 HydrophobicContact CG2-CD1 4.39Å; V256-F317 HydrophobicContact CG2-CE1 4.2Å
257	Q	94.2	Very high	88.5	Confident	47 Å²	47	57 Å²	57	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	131.6	176.5	-170.3	174.1	-1.8	0	0	110.3	T239 R240 F271	T239-Q257 PolarHBondContact N-O 3.24Å; T239-Q257 WeakPolarHBondContact OG1-CB 3.31Å; T239-Q257 VanDerWaalsContact OG1-CG 3.32Å; T239-Q257 WeakPolarHBondContact OG1-CG 3.33Å; T239-Q257 PolarHBondContact OG1-O 3.32Å; R240-Q257 HydrophobicContact CB-CB 4.03Å; R240-Q257 PolarHBondContact O-N 3.33Å; Q257-F271 HydrophobicContact CB-CD1 3.86Å; Q257-F271 HydrophobicContact CB-CE1 3.54Å; Q257-F271 HydrophobicContact CB-CZ 4.31Å; Q257-F271 HydrophobicContact CG-CD1 4.05Å; Q257-F271 HydrophobicContact CG-CE1 3.43Å; Q257-F271 VanDerWaalsContact CG-CE1 3.43Å; Q257-F271 HydrophobicContact CG-CE2 4.47Å; Q257-F271 HydrophobicContact CG-CZ 3.68Å
258	L	92.4	Very high	88.4	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.3	-174.2	-56.6	-177.1	0	0	0	111.5	V233 T237 I238 V256 I262 H270 V272	V233-L258 HydrophobicContact CG1-CD1 4.01Å; V233-L258 HydrophobicContact CG1-CD2 3.51Å; V233-L258 HydrophobicContact CG1-CG 4.42Å; V233-L258 HydrophobicContact CG2-CD1 4.28Å; T237-L258 CarbonylContact O-C 3.35Å; T237-L258 VanDerWaalsContact O-CA 3.32Å; T237-L258 WeakPolarHBondContact O-CA 3.32Å; I238-L258 HydrophobicContact CG1-CD2 4.02Å; V256-L258 HydrophobicContact CG1-CD2 3.76Å; L258-I262 HydrophobicContact CD1-CD1 4.35Å; L258-I262 HydrophobicContact CD1-CG1 4.21Å; L258-I262 HydrophobicContact CD1-CG2 3.88Å; L258-H270 PolarHBondContact N-O 3.34Å; L258-V272 HydrophobicContact CD1-CG2 3.71Å
259	D	86.1	Confident	88.6	Confident	105 Å²	105	60.2 Å²	60.2	56%	0.561	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	112.9	169.6	-171.6	21.8	0	0	0	110	T237 T239	T237-D259 VanDerWaalsContact CA-O 3.24Å; T237-D259 WeakPolarHBondContact CA-O 3.36Å; T237-D259 PolarHBondContact O-N 2.67Å; T239-D259 HydrophobicContact CG2-CB 3.7Å
260	P	86.9	Confident	88.8	Confident	83 Å²	83	59.2 Å²	59.2	54%	0.539	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-66.9	158.6	-1	28.4	-37.1	0	0	0	113.6	T237	T237-P260 HydrophobicContact CG2-CG 4.29Å
261	P	88.5	Confident	88.9	Confident	16 Å²	16	51.1 Å²	51.1	10%	0.104	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	149	175.7	29.3	-36.6	0	0	0	111.9	R268 Y269 H270	P261-R268 HydrophobicContact CB-CB 4.1Å; P261-R268 HydrophobicContact CG-CB 3.99Å; P261-R268 HydrophobicContact CG-CG 4.49Å; P261-Y269 WeakPolarHBondContact CA-O 3.46Å; P261-Y269 VanDerWaalsContact CB-O 3.32Å; P261-Y269 WeakPolarHBondContact CB-O 3.47Å; P261-H270 HydrophobicContact CB-CB 4.46Å
262	I	86.9	Confident	88.9	Confident	18 Å²	18	48 Å²	48	9%	0.092	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	143.4	163.9	58.9	-179	0	0	0	109.6	P209 L224 F231 V233 L258 Y269 V272	P209-I262 HydrophobicContact CG-CD1 3.74Å; L224-I262 HydrophobicContact CD1-CD1 4.45Å; F231-I262 HydrophobicContact CB-CD1 4.38Å; F231-I262 HydrophobicContact CD1-CB 4.32Å; F231-I262 HydrophobicContact CD1-CD1 4.31Å; F231-I262 HydrophobicContact CD2-CD1 4.29Å; F231-I262 HydrophobicContact CG-CD1 4.07Å; V233-I262 HydrophobicContact CG2-CG2 3.74Å; L258-I262 HydrophobicContact CD1-CD1 4.35Å; L258-I262 HydrophobicContact CD1-CG1 4.21Å; L258-I262 HydrophobicContact CD1-CG2 3.88Å; I262-Y269 HydrophobicContact CD1-CD2 4.47Å; I262-Y269 HydrophobicContact CG1-CD2 4.18Å; I262-Y269 HydrophobicContact CG1-CG 4.44Å; I262-Y269 PolarHBondContact N-O 2.99Å; I262-Y269 PolarHBondContact O-N 3.02Å; I262-V272 HydrophobicContact CD1-CG2 3.79Å
263	K	81.1	Confident	89	Confident	67 Å²	67	47.7 Å²	47.7	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.3	-177.9	-58.3	-177.4	-173.6	170.1	0	109.6	L151 F231 T267 R268	L151-K263 HydrophobicContact CD1-CD 3.83Å; F231-K263 WeakPolarHBondContact CE1-O 3.49Å; K263-T267 WeakPolarHBondContact CA-O 3.49Å; K263-R268 HydrophobicContact CG-CG 4.29Å
264	H	78.3	Confident	88.9	Confident	43 Å²	43	47.6 Å²	47.6	20%	0.199	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	102.6	169	175.2	48.2	0	0	0	107.8	Y229 F231 Q266 T267 Y269	Y229-H264 AromaticContact CD1-CE1 3.49Å; Y229-H264 VanDerWaalsContact CD1-CE1 3.49Å; Y229-H264 WeakPolarHBondContact CD1-CE1 3.26Å; Y229-H264 AromaticContact CD1-ND1 3.64Å; Y229-H264 AromaticContact CE1-CE1 3.06Å; Y229-H264 WeakPolarHBondContact CE1-CE1 3.29Å; Y229-H264 AromaticContact CE1-ND1 3.7Å; Y229-H264 AromaticContact CE1-NE2 3.98Å; Y229-H264 AromaticContact CE2-CE1 3.61Å; Y229-H264 AromaticContact CE2-NE2 3.77Å; Y229-H264 AromaticContact CG-CE1 3.96Å; Y229-H264 AromaticContact CG-ND1 3.97Å; Y229-H264 AromaticContact CZ-CE1 3.1Å; Y229-H264 AromaticContact CZ-NE2 3.55Å; Y229-H264 PolarHBondContact OH-CE1 2.85Å; F231-H264 HydrophobicContact CE1-CB 4.13Å; F231-H264 HydrophobicContact CZ-CB 4.12Å; H264-Q266 PolarHBondContact O-N 3.15Å; H264-T267 PolarHBondContact N-O 3.19Å; H264-T267 WeakPolarHBondContact O-CB 3.19Å; H264-T267 PolarHBondContact O-N 3.15Å; H264-Y269 HydrophobicContact CB-CD2 4.37Å; H264-Y269 HydrophobicContact CB-CE2 3.67Å
265	G	75.7	Confident	88.9	Confident	40 Å²	40	48.6 Å²	48.6	41%	0.412	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	-123.4	-165.2	0	0	0	0	0	111.1
266	Q	74.7	Confident	88.9	Confident	198 Å²	198	48.9 Å²	48.9	93%	0.925	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-15.8	176.3	-62.4	-176.9	4.2	0	0	113.9	H264	H264-Q266 PolarHBondContact O-N 3.15Å
267	T	84.5	Confident	88.8	Confident	70 Å²	70	52.9 Å²	52.9	43%	0.429	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132.5	-176.3	-56.5	0	0	0	0	110.6	K263 H264 Y269	K263-T267 WeakPolarHBondContact CA-O 3.49Å; H264-T267 PolarHBondContact N-O 3.19Å; H264-T267 WeakPolarHBondContact O-CB 3.19Å; H264-T267 PolarHBondContact O-N 3.15Å; T267-Y269 HydrophobicContact CG2-CD1 4.2Å; T267-Y269 HydrophobicContact CG2-CE1 3.68Å; T267-Y269 HydrophobicContact CG2-CE2 4.21Å
268	R	86.9	Confident	88.7	Confident	142 Å²	142	54.7 Å²	54.7	54%	0.536	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.2	176.4	-57.3	-170.1	179.2	-141.8	3.7	110.1	P261 K263	P261-R268 HydrophobicContact CB-CB 4.1Å; P261-R268 HydrophobicContact CG-CB 3.99Å; P261-R268 HydrophobicContact CG-CG 4.49Å; K263-R268 HydrophobicContact CG-CG 4.29Å
269	Y	91.9	Very high	88.7	Confident	41 Å²	41	60.6 Å²	60.6	16%	0.161	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	101	175.8	-54.4	-70.7	0	0	0	110	Q208 P209 P261 I262 H264 T267 F271	Q208-Y269 HydrophobicContact CG-CD1 3.35Å; Q208-Y269 HydrophobicContact CG-CE1 3.84Å; Q208-Y269 HydrophobicContact CG-CG 4.19Å; P209-Y269 HydrophobicContact CB-CD2 4.12Å; P209-Y269 HydrophobicContact CB-CE2 3.75Å; P209-Y269 HydrophobicContact CG-CD2 3.6Å; P209-Y269 HydrophobicContact CG-CE2 3.76Å; P209-Y269 HydrophobicContact CG-CG 4.02Å; P261-Y269 WeakPolarHBondContact CA-O 3.46Å; P261-Y269 VanDerWaalsContact CB-O 3.32Å; P261-Y269 WeakPolarHBondContact CB-O 3.47Å; I262-Y269 HydrophobicContact CD1-CD2 4.47Å; I262-Y269 HydrophobicContact CG1-CD2 4.18Å; I262-Y269 HydrophobicContact CG1-CG 4.44Å; I262-Y269 PolarHBondContact N-O 2.99Å; I262-Y269 PolarHBondContact O-N 3.02Å; H264-Y269 HydrophobicContact CB-CD2 4.37Å; H264-Y269 HydrophobicContact CB-CE2 3.67Å; T267-Y269 HydrophobicContact CG2-CD1 4.2Å; T267-Y269 HydrophobicContact CG2-CE1 3.68Å; T267-Y269 HydrophobicContact CG2-CE2 4.21Å; Y269-F271 PolarHBondContact O-N 2.97Å
270	H	92.1	Very high	89.1	Confident	91 Å²	91	57.4 Å²	57.4	42%	0.421	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-10	172.3	-66.6	-87.2	0	0	0	113.2	L258 P261	L258-H270 PolarHBondContact N-O 3.34Å; P261-H270 HydrophobicContact CB-CB 4.46Å
271	F	94.3	Very high	89.3	Confident	10 Å²	10	59.8 Å²	59.8	4%	0.044	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139.9	178.3	-65.5	-93.8	0	0	0	109.9	M242 V256 Q257 Y269 V273 P365	M242-F271 HydrophobicContact CE-CD1 3.97Å; M242-F271 HydrophobicContact CE-CE1 3.57Å; V256-F271 CarbonylContact O-C 3.54Å; V256-F271 VanDerWaalsContact O-CA 3.25Å; V256-F271 WeakPolarHBondContact O-CA 3.43Å; Q257-F271 HydrophobicContact CB-CD1 3.86Å; Q257-F271 HydrophobicContact CB-CE1 3.54Å; Q257-F271 HydrophobicContact CB-CZ 4.31Å; Q257-F271 HydrophobicContact CG-CD1 4.05Å; Q257-F271 HydrophobicContact CG-CE1 3.43Å; Q257-F271 VanDerWaalsContact CG-CE1 3.43Å; Q257-F271 HydrophobicContact CG-CE2 4.47Å; Q257-F271 HydrophobicContact CG-CZ 3.68Å; Y269-F271 PolarHBondContact O-N 2.97Å; F271-V273 HydrophobicContact CB-CG2 4.01Å; F271-P365 HydrophobicContact CB-CB 4.06Å; F271-P365 HydrophobicContact CB-CG 3.7Å; F271-P365 HydrophobicContact CD2-CB 3.87Å; F271-P365 HydrophobicContact CD2-CG 3.78Å; F271-P365 HydrophobicContact CG-CB 3.95Å; F271-P365 HydrophobicContact CG-CG 3.96Å
272	V	94.4	Very high	89.6	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	113.8	160	178.1	0	0	0	0	107.4	Q208 L224 A255 V256 L258 I262	Q208-V272 CarbonylContact O-C 3.57Å; Q208-V272 WeakPolarHBondContact O-CA 3.4Å; L224-V272 HydrophobicContact CD1-CG1 4.17Å; L224-V272 HydrophobicContact CD1-CG2 3.93Å; A255-V272 CarbonylContact C-O 3.55Å; A255-V272 WeakPolarHBondContact CA-O 3.44Å; V256-V272 HydrophobicContact CB-CB 4.29Å; V256-V272 PolarHBondContact N-O 2.91Å; V256-V272 PolarHBondContact O-N 3.25Å; L258-V272 HydrophobicContact CD1-CG2 3.71Å; I262-V272 HydrophobicContact CD1-CG2 3.79Å
273	V	95.9	Very high	89.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	114.4	-177.9	-175.9	0	0	0	0	108.6	C206 L207 Q208 F253 A255 F271 P365	C206-V273 CarbonylContact C-O 3.37Å; C206-V273 WeakPolarHBondContact CA-O 3.24Å; L207-V273 HydrophobicContact CB-CG1 4.46Å; L207-V273 HydrophobicContact CD1-CG1 4.48Å; L207-V273 PolarHBondContact N-O 3.18Å; Q208-V273 HydrophobicContact CB-CB 4.36Å; Q208-V273 HydrophobicContact CB-CG2 4.41Å; Q208-V273 PolarHBondContact N-O 3.44Å; Q208-V273 PolarHBondContact O-N 3.26Å; F253-V273 HydrophobicContact CB-CG1 4.46Å; F253-V273 HydrophobicContact CD1-CG1 4.19Å; A255-V273 HydrophobicContact CB-CG2 4.14Å; F271-V273 HydrophobicContact CB-CG2 4.01Å; V273-P365 HydrophobicContact CG2-CB 4.19Å; V273-P365 HydrophobicContact CG2-CG 4.28Å
274	S	95.4	Very high	90.3	Very high	8 Å²	8	63.4 Å²	63.4	6%	0.056	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	149.6	175	-55.3	0	0	0	0	110.7	Q205 C206 F253 F254	Q205-S274 CarbonylContact O-C 3.53Å; Q205-S274 WeakPolarHBondContact O-CA 3.36Å; C206-S274 PolarHBondContact SG-OG 3.35Å; F253-S274 CarbonylContact C-O 3.46Å; F253-S274 WeakPolarHBondContact CA-O 3.41Å; F254-S274 PolarHBondContact N-O 3.34Å; F254-S274 PolarHBondContact O-N 2.86Å
275	L	95.2	Very high	90.9	Very high	24 Å²	24	66.8 Å²	66.8	13%	0.126	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126	178.5	-174.8	68.4	0	0	0	109.2	Q205 L207 Q251 F253	Q205-L275 PolarHBondContact O-N 3Å; L207-L275 HydrophobicContact CD1-CB 4.19Å; L207-L275 HydrophobicContact CD2-CB 4.43Å; L207-L275 HydrophobicContact CD2-CD2 4.38Å; L207-L275 HydrophobicContact CG-CB 4.14Å; Q251-L275 HydrophobicContact CB-CD1 3.91Å; Q251-L275 HydrophobicContact CG-CD1 4.46Å; F253-L275 HydrophobicContact CD1-CD1 3.67Å; F253-L275 HydrophobicContact CE1-CD1 3.59Å; F253-L275 HydrophobicContact CG-CD1 4.41Å; F253-L275 HydrophobicContact CZ-CD1 4.27Å
276	F	95.6	Very high	91.4	Very high	7 Å²	7	65 Å²	65	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.2	176.9	-66.8	-83.9	0	0	0	110.3	L204 Q251 I252 F254 E309 V313	L204-F276 HydrophobicContact CD1-CZ 4.18Å; L204-F276 HydrophobicContact CD2-CE1 3.46Å; L204-F276 VanDerWaalsContact CD2-CE1 3.46Å; L204-F276 HydrophobicContact CD2-CZ 3.82Å; Q251-F276 CarbonylContact C-O 3.57Å; Q251-F276 VanDerWaalsContact CA-O 3.31Å; Q251-F276 WeakPolarHBondContact CA-O 3.25Å; I252-F276 PolarHBondContact N-O 3.42Å; I252-F276 PolarHBondContact O-N 2.69Å; F254-F276 HydrophobicContact CB-CD2 4Å; F254-F276 HydrophobicContact CB-CE2 3.63Å; F254-F276 HydrophobicContact CG-CE2 4.37Å; F276-E309 HydrophobicContact CD1-CB 4.17Å; F276-E309 HydrophobicContact CD1-CG 3.8Å; F276-E309 HydrophobicContact CE1-CG 3.72Å; F276-V313 HydrophobicContact CE1-CG2 4.02Å; F276-V313 HydrophobicContact CZ-CB 4.22Å; F276-V313 HydrophobicContact CZ-CG1 4.14Å; F276-V313 HydrophobicContact CZ-CG2 3.81Å
277	D	94.8	Very high	92	Very high	90 Å²	90	58.8 Å²	58.8	48%	0.481	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	133	161.9	-168	-19.5	0	0	0	108.2	D279 S280	D277-D279 PolarHBondContact O-N 3.12Å; D277-D279 PolarHBondContact OD1-N 2.83Å; D277-S280 WeakPolarHBondContact O-CB 3.34Å; D277-S280 PolarHBondContact O-N 3.34Å; D277-S280 VanDerWaalsContact O-N 3.16Å
278	K	92.1	Very high	91.9	Very high	85 Å²	85	56.1 Å²	56.1	37%	0.37	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.3	-177.7	-174.9	-179.9	179.5	-177.8	0	111.7	N249 R250 I252 Y310	N249-K278 WeakPolarHBondContact O-CD 3.18Å; R250-K278 VanDerWaalsContact O-CB 3.27Å; R250-K278 WeakPolarHBondContact O-CB 3.49Å; R250-K278 PolarHBondContact O-N 3.01Å; I252-K278 HydrophobicContact CD1-CB 4.35Å; I252-K278 HydrophobicContact CD1-CG 4.09Å; K278-Y310 HydrophobicContact CG-CE1 4.47Å
279	D	92.1	Very high	91.7	Very high	127 Å²	127	53.2 Å²	53.2	68%	0.679	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.4	-179	-64.2	-31.3	0	0	0	112.8	D277 H281	D277-D279 PolarHBondContact O-N 3.12Å; D277-D279 PolarHBondContact OD1-N 2.83Å; D279-H281 PolarHBondContact O-N 3.27Å; D279-H281 PolarHBondContact O-ND1 3.34Å; D279-H281 VanDerWaalsContact O-ND1 3.12Å
280	S	93.1	Very high	91.4	Very high	37 Å²	37	57 Å²	57	26%	0.259	30%	0.302	S	S	.	.			trans	-62.1	128.9	178.9	-171.2	0	0	0	0	110.8	D277 P308 E309	D277-S280 WeakPolarHBondContact O-CB 3.34Å; D277-S280 PolarHBondContact O-N 3.34Å; D277-S280 VanDerWaalsContact O-N 3.16Å; S280-P308 CarbonylContact O-C 3.54Å; S280-P308 WeakPolarHBondContact O-CA 3.2Å; S280-E309 WeakPolarHBondContact CB-OE2 3.37Å; S280-E309 PolarHBondContact O-N 3.47Å; S280-E309 PolarHBondContact OG-OE2 2.61Å
281	H	92.7	Very high	91	Very high	133 Å²	133	59.2 Å²	59.2	62%	0.616	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	139.7	177.2	-87.4	56.3	0	0	0	110.3	D279 G307	D279-H281 PolarHBondContact O-N 3.27Å; D279-H281 PolarHBondContact O-ND1 3.34Å; D279-H281 VanDerWaalsContact O-ND1 3.12Å; H281-G307 WeakPolarHBondContact CA-O 3.17Å
282	I	94.2	Very high	90.6	Very high	34 Å²	34	62.5 Å²	62.5	17%	0.174	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.2	176.1	-161.9	170.9	0	0	0	110.5	F201 S306 G307 E309 V312	F201-I282 HydrophobicContact CD1-CD1 3.74Å; F201-I282 HydrophobicContact CE1-CD1 4.07Å; I282-S306 WeakPolarHBondContact O-CA 3.06Å; I282-G307 PolarHBondContact N-O 2.87Å; I282-G307 PolarHBondContact O-N 3.05Å; I282-E309 HydrophobicContact CB-CB 4.27Å; I282-E309 HydrophobicContact CB-CG 4.1Å; I282-E309 HydrophobicContact CD1-CG 4.36Å; I282-E309 HydrophobicContact CG2-CB 4.19Å; I282-E309 HydrophobicContact CG2-CG 4.1Å; I282-V312 HydrophobicContact CG2-CB 3.71Å; I282-V312 HydrophobicContact CG2-CG1 3.89Å; I282-V312 HydrophobicContact CG2-CG2 3.77Å
283	N	92.3	Very high	90.2	Very high	133 Å²	133	62.2 Å²	62.2	71%	0.711	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	101	166.1	-66.1	-38.4	0	0	0	107.1	S306	N283-S306 WeakPolarHBondContact OD1-CB 3.33Å; N283-S306 PolarHBondContact OD1-OG 2.88Å
284	L	90.8	Very high	89.7	Confident	10 Å²	10	67.5 Å²	67.5	5%	0.052	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	120.2	-179.5	-177.5	70.6	0	0	0	109.6	A199 F201 N304 I305 V312 V316	A199-L284 HydrophobicContact CB-CD1 4.11Å; A199-L284 HydrophobicContact CB-CD2 3.99Å; A199-L284 HydrophobicContact CB-CG 4.42Å; F201-L284 HydrophobicContact CE1-CD1 4.27Å; F201-L284 HydrophobicContact CE1-CD2 4.04Å; F201-L284 HydrophobicContact CZ-CD1 4.48Å; F201-L284 HydrophobicContact CZ-CD2 3.72Å; L284-N304 WeakPolarHBondContact O-CA 3.24Å; L284-I305 PolarHBondContact N-O 3.37Å; L284-I305 PolarHBondContact O-N 3.16Å; L284-V312 HydrophobicContact CB-CG1 4.04Å; L284-V312 HydrophobicContact CD2-CG1 3.96Å; L284-V316 HydrophobicContact CD2-CG2 3.8Å
285	E	90.2	Very high	89.3	Confident	115 Å²	115	74 Å²	74	54%	0.537	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.7	165.7	-178.1	174.2	-173	0	0	108.8	R303 N304	E285-R303 CarbonylContact C-O 3.48Å; E285-R303 WeakPolarHBondContact CA-O 3.49Å; E285-R303 HydrophobicContact CG-CG 4.46Å; E285-R303 IonicContact OE1-CZ 3.9Å; E285-R303 IonicContact OE1-NE 3.21Å; E285-R303 PolarHBondContact OE1-NE 2.96Å; E285-R303 IonicContact OE1-NH2 2.71Å; E285-R303 PolarHBondContact OE1-NH2 2.74Å; E285-N304 WeakPolarHBondContact CG-OD1 3.32Å
286	M	86.3	Confident	88.8	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.005	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-76.2	139.5	172.9	-60.6	-165.4	70.9	0	0	110	L198 A288 L293 L301 R303 I305	L198-M286 HydrophobicContact CB-CE 4.16Å; L198-M286 CarbonylContact O-C 3.6Å; L198-M286 VanDerWaalsContact O-CA 3.26Å; L198-M286 WeakPolarHBondContact O-CA 3.48Å; M286-A288 VanDerWaalsContact C-N 3.26Å; M286-A288 PolarHBondContact O-N 2.94Å; M286-L293 HydrophobicContact CB-CD1 4.17Å; M286-L293 HydrophobicContact CE-CD2 3.63Å; M286-L293 HydrophobicContact SD-CD1 3.83Å; M286-L293 HydrophobicContact SD-CD2 3.85Å; M286-L301 HydrophobicContact CE-CD1 4.03Å; M286-L301 HydrophobicContact SD-CB 3.94Å; M286-L301 HydrophobicContact SD-CD1 4.27Å; M286-R303 PolarHBondContact N-O 3.49Å; M286-I305 HydrophobicContact SD-CD1 4.25Å
287	A	86.6	Confident	88.3	Confident	69 Å²	69	78.8 Å²	78.8	57%	0.57	40%	0.403	S	S	*	.	S	Bend	trans	-72.1	-19.9	-179.7	0	0	0	0	0	113.4	F197 L198	F197-A287 WeakPolarHBondContact O-CB 3.48Å; L198-A287 PolarHBondContact O-N 3.22Å
288	A	82.2	Confident	87.7	Confident	14 Å²	14	80.4 Å²	80.4	12%	0.116	41%	0.412	C	S	.	.	S	Bend	trans	-79.2	152.9	-179.9	0	0	0	0	0	112.9	L198 M286 W292 L293	L198-A288 HydrophobicContact CD2-CB 3.77Å; M286-A288 VanDerWaalsContact C-N 3.26Å; M286-A288 PolarHBondContact O-N 2.94Å; A288-W292 HydrophobicContact CB-CD2 4.29Å; A288-W292 HydrophobicContact CB-CE3 3.49Å; A288-W292 VanDerWaalsContact CB-CE3 3.49Å; A288-W292 HydrophobicContact CB-CZ3 3.93Å; A288-L293 HydrophobicContact CB-CD2 4.06Å; A288-L293 HydrophobicContact CB-CG 4.04Å
289	T	84.2	Confident	87.1	Confident	81 Å²	81	77.8 Å²	77.8	50%	0.497	41%	0.409	S	S	.	.			trans	-68.4	151.7	173.5	56.9	0	0	0	0	111.1	D291 W292 L293	T289-D291 VanDerWaalsContact C-N 3.29Å; T289-D291 PolarHBondContact O-N 3.23Å; T289-W292 PolarHBondContact O-N 2.85Å; T289-W292 WeakPolarHBondContact OG1-CB 3.45Å; T289-L293 WeakPolarHBondContact O-CG 3.33Å; T289-L293 PolarHBondContact O-N 3.37Å
290	E	84.1	Confident	86.7	Confident	119 Å²	119	78.3 Å²	78.3	56%	0.556	41%	0.405	S	S	*	.	H	α-helix	trans	-62	-38	-179.6	-169	159.7	-153.1	0	0	111.9	W292 L293 Q294	E290-W292 VanDerWaalsContact C-N 3.35Å; E290-W292 PolarHBondContact O-N 3.46Å; E290-L293 PolarHBondContact O-N 2.96Å; E290-Q294 WeakPolarHBondContact O-CB 3.39Å; E290-Q294 PolarHBondContact O-N 2.97Å
291	D	85.6	Confident	86.5	Confident	138 Å²	138	76.7 Å²	76.7	74%	0.738	39%	0.394	S	S	*	.	H	α-helix	trans	-60.3	-42.9	174.8	-62.2	-28.5	0	0	0	112.2	T289 Q294 E295	T289-D291 VanDerWaalsContact C-N 3.29Å; T289-D291 PolarHBondContact O-N 3.23Å; D291-Q294 PolarHBondContact O-N 2.95Å; D291-E295 WeakPolarHBondContact O-CB 3.38Å; D291-E295 PolarHBondContact O-N 3.05Å
292	W	85.9	Confident	86.2	Confident	80 Å²	80	73.4 Å²	73.4	30%	0.303	38%	0.383	S	S	.	.	H	α-helix	trans	-68.8	-40.2	178.6	-174.6	89.2	0	0	0	111.5	L198 P219 A288 T289 E290 Q294 E295 Q296 F297	L198-W292 HydrophobicContact CD1-CH2 4.09Å; L198-W292 HydrophobicContact CD1-CZ3 4.13Å; L198-W292 HydrophobicContact CD2-CE3 4.39Å; L198-W292 HydrophobicContact CD2-CH2 3.78Å; L198-W292 HydrophobicContact CD2-CZ3 3.52Å; L198-W292 HydrophobicContact CG-CZ3 4.49Å; P219-W292 HydrophobicContact CG-CH2 4.45Å; A288-W292 HydrophobicContact CB-CD2 4.29Å; A288-W292 HydrophobicContact CB-CE3 3.49Å; A288-W292 VanDerWaalsContact CB-CE3 3.49Å; A288-W292 HydrophobicContact CB-CZ3 3.93Å; T289-W292 PolarHBondContact O-N 2.85Å; T289-W292 WeakPolarHBondContact OG1-CB 3.45Å; E290-W292 VanDerWaalsContact C-N 3.35Å; E290-W292 PolarHBondContact O-N 3.46Å; W292-Q294 VanDerWaalsContact C-N 3.31Å; W292-Q294 PolarHBondContact O-N 3.15Å; W292-E295 PolarHBondContact O-N 2.82Å; W292-Q296 HydrophobicContact CD2-CG 3.83Å; W292-Q296 HydrophobicContact CE3-CG 4.2Å; W292-Q296 HydrophobicContact CG-CG 4.37Å; W292-Q296 HydrophobicContact CH2-CB 4.5Å; W292-Q296 HydrophobicContact CH2-CG 4.08Å; W292-Q296 HydrophobicContact CZ2-CG 3.68Å; W292-Q296 HydrophobicContact CZ3-CG 4.33Å; W292-Q296 WeakPolarHBondContact O-CB 3.27Å; W292-Q296 VanDerWaalsContact O-CG 3.32Å; W292-Q296 WeakPolarHBondContact O-CG 3.43Å; W292-Q296 PolarHBondContact O-N 3.47Å; W292-F297 HydrophobicContact CH2-CE2 4.18Å; W292-F297 AromaticContact CZ3-CE2 3.72Å; W292-F297 HydrophobicContact CZ3-CE2 3.72Å; W292-F297 HydrophobicContact CZ3-CZ 4.48Å
293	L	84.4	Confident	85.8	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-38.1	174.5	-69.3	172.4	0	0	0	111.8	M286 A288 T289 E290 F297 L301 R303	M286-L293 HydrophobicContact CB-CD1 4.17Å; M286-L293 HydrophobicContact CE-CD2 3.63Å; M286-L293 HydrophobicContact SD-CD1 3.83Å; M286-L293 HydrophobicContact SD-CD2 3.85Å; A288-L293 HydrophobicContact CB-CD2 4.06Å; A288-L293 HydrophobicContact CB-CG 4.04Å; T289-L293 WeakPolarHBondContact O-CG 3.33Å; T289-L293 PolarHBondContact O-N 3.37Å; E290-L293 PolarHBondContact O-N 2.96Å; L293-F297 HydrophobicContact CD2-CD2 3.87Å; L293-F297 HydrophobicContact CD2-CE2 3.99Å; L293-F297 WeakPolarHBondContact O-CA 3.48Å; L293-F297 WeakPolarHBondContact O-CB 3.25Å; L293-F297 PolarHBondContact O-N 3.18Å; L293-L301 HydrophobicContact CD2-CB 4.44Å; L293-R303 HydrophobicContact CD1-CB 4.38Å
294	Q	85.8	Confident	85.7	Confident	111 Å²	111	75.6 Å²	75.6	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-65.4	-44.1	176.1	-172.3	66.4	15.4	0	0	111.5	E290 D291 W292 N298	E290-Q294 WeakPolarHBondContact O-CB 3.39Å; E290-Q294 PolarHBondContact O-N 2.97Å; D291-Q294 PolarHBondContact O-N 2.95Å; W292-Q294 VanDerWaalsContact C-N 3.31Å; W292-Q294 PolarHBondContact O-N 3.15Å; Q294-N298 WeakPolarHBondContact O-CA 3.39Å; Q294-N298 PolarHBondContact O-N 3.3Å
295	E	87	Confident	85.7	Confident	146 Å²	146	75.6 Å²	75.6	68%	0.682	39%	0.388	S	S	*	.	H	α-helix	trans	-66.5	-45.1	178.6	-171.9	-180	-172.5	0	0	112.1	D291 W292	D291-E295 WeakPolarHBondContact O-CB 3.38Å; D291-E295 PolarHBondContact O-N 3.05Å; W292-E295 PolarHBondContact O-N 2.82Å
296	Q	84.3	Confident	85.8	Confident	101 Å²	101	73.9 Å²	73.9	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-82.6	-35	-174.1	-65.8	-61.5	-47.8	0	0	114	W292	W292-Q296 HydrophobicContact CD2-CG 3.83Å; W292-Q296 HydrophobicContact CE3-CG 4.2Å; W292-Q296 HydrophobicContact CG-CG 4.37Å; W292-Q296 HydrophobicContact CH2-CB 4.5Å; W292-Q296 HydrophobicContact CH2-CG 4.08Å; W292-Q296 HydrophobicContact CZ2-CG 3.68Å; W292-Q296 HydrophobicContact CZ3-CG 4.33Å; W292-Q296 WeakPolarHBondContact O-CB 3.27Å; W292-Q296 VanDerWaalsContact O-CG 3.32Å; W292-Q296 WeakPolarHBondContact O-CG 3.43Å; W292-Q296 PolarHBondContact O-N 3.47Å
297	F	85.2	Confident	86.2	Confident	29 Å²	29	74.4 Å²	74.4	13%	0.127	39%	0.394	C	S	.	.	H	α-helix	trans	-120.9	10.1	-172.3	-55.3	-69	0	0	0	113.9	W292 L293 G299 K300 L301 V319 L320	W292-F297 HydrophobicContact CH2-CE2 4.18Å; W292-F297 AromaticContact CZ3-CE2 3.72Å; W292-F297 HydrophobicContact CZ3-CE2 3.72Å; W292-F297 HydrophobicContact CZ3-CZ 4.48Å; L293-F297 HydrophobicContact CD2-CD2 3.87Å; L293-F297 HydrophobicContact CD2-CE2 3.99Å; L293-F297 WeakPolarHBondContact O-CA 3.48Å; L293-F297 WeakPolarHBondContact O-CB 3.25Å; L293-F297 PolarHBondContact O-N 3.18Å; F297-G299 PolarHBondContact O-N 3.41Å; F297-K300 VanDerWaalsContact O-CB 3.3Å; F297-K300 WeakPolarHBondContact O-CB 3.5Å; F297-K300 VanDerWaalsContact O-CG 3.32Å; F297-K300 WeakPolarHBondContact O-CG 3.16Å; F297-K300 PolarHBondContact O-N 3.25Å; F297-L301 HydrophobicContact CD2-CD1 4.08Å; F297-L301 HydrophobicContact CE2-CD1 4.33Å; F297-L301 HydrophobicContact CG-CD1 4.22Å; F297-V319 HydrophobicContact CB-CG1 3.89Å; F297-V319 HydrophobicContact CD1-CG1 3.71Å; F297-V319 HydrophobicContact CG-CG1 3.98Å; F297-L320 HydrophobicContact CE1-CD1 4.02Å; F297-L320 HydrophobicContact CE2-CD1 4.41Å; F297-L320 HydrophobicContact CZ-CD1 3.5Å; F297-L320 VanDerWaalsContact CZ-CD1 3.5Å
298	N	83.5	Confident	86.5	Confident	125 Å²	125	72.4 Å²	72.4	67%	0.668	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	35.9	178.3	-57.1	93.2	0	0	0	113.4	Q294 K300	Q294-N298 WeakPolarHBondContact O-CA 3.39Å; Q294-N298 PolarHBondContact O-N 3.3Å; N298-K300 VanDerWaalsContact C-N 3.27Å; N298-K300 PolarHBondContact O-N 2.97Å
299	G	77.8	Confident	87.1	Confident	30 Å²	30	73.2 Å²	73.2	31%	0.309	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	9.6	179.7	0	0	0	0	0	115.3	F297 L301	F297-G299 PolarHBondContact O-N 3.41Å; G299-L301 PolarHBondContact O-N 2.88Å
300	K	85.6	Confident	87.6	Confident	137 Å²	137	71 Å²	71	60%	0.596	36%	0.359	S	S	*	.	S	Bend	trans	-68.6	-22	173.3	-68.6	175	-177.4	169.4	0	112.9	F297 N298 V319	F297-K300 VanDerWaalsContact O-CB 3.3Å; F297-K300 WeakPolarHBondContact O-CB 3.5Å; F297-K300 VanDerWaalsContact O-CG 3.32Å; F297-K300 WeakPolarHBondContact O-CG 3.16Å; F297-K300 PolarHBondContact O-N 3.25Å; N298-K300 VanDerWaalsContact C-N 3.27Å; N298-K300 PolarHBondContact O-N 2.97Å; K300-V319 HydrophobicContact CB-CG1 3.77Å; K300-V319 HydrophobicContact CB-CG2 3.93Å; K300-V319 HydrophobicContact CD-CG1 4.25Å; K300-V319 HydrophobicContact CD-CG2 4.47Å
301	L	87.4	Confident	88.1	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	35%	0.35	C	S	.	.	S	Bend	trans	-121.4	134.2	172.8	-67.1	174	0	0	0	109	M286 L293 F297 G299 I305 V316 V319	M286-L301 HydrophobicContact CE-CD1 4.03Å; M286-L301 HydrophobicContact SD-CB 3.94Å; M286-L301 HydrophobicContact SD-CD1 4.27Å; L293-L301 HydrophobicContact CD2-CB 4.44Å; F297-L301 HydrophobicContact CD2-CD1 4.08Å; F297-L301 HydrophobicContact CE2-CD1 4.33Å; F297-L301 HydrophobicContact CG-CD1 4.22Å; G299-L301 PolarHBondContact O-N 2.88Å; L301-I305 HydrophobicContact CD2-CD1 3.7Å; L301-V316 HydrophobicContact CD2-CG2 4.23Å; L301-V319 HydrophobicContact CD1-CB 3.91Å; L301-V319 HydrophobicContact CD1-CG1 3.73Å; L301-V319 HydrophobicContact CD2-CB 4.1Å; L301-V319 HydrophobicContact CD2-CG1 4.45Å; L301-V319 HydrophobicContact CD2-CG2 4.24Å; L301-V319 HydrophobicContact CG-CB 3.85Å; L301-V319 HydrophobicContact CG-CG1 3.68Å; L301-V319 HydrophobicContact CG-CG2 4.31Å
302	T	86.1	Confident	88.5	Confident	64 Å²	64	62.7 Å²	62.7	39%	0.393	32%	0.316	S	S	.	.			trans	-105.9	158.8	173.4	51.4	0	0	0	0	109.2	N304 I305	T302-N304 VanDerWaalsContact C-N 3.27Å; T302-N304 PolarHBondContact O-N 3.26Å; T302-N304 PolarHBondContact OG1-O 3.31Å; T302-I305 WeakPolarHBondContact O-CG1 3.34Å
303	R	87.5	Confident	88.9	Confident	106 Å²	106	59 Å²	59	40%	0.4	30%	0.302	S	S	.	.	S	Bend	trans	-58.3	-41	179.2	-179.8	174.7	170.8	165.9	1.1	112.4	E285 M286 L293	E285-R303 CarbonylContact C-O 3.48Å; E285-R303 WeakPolarHBondContact CA-O 3.49Å; E285-R303 HydrophobicContact CG-CG 4.46Å; E285-R303 IonicContact OE1-CZ 3.9Å; E285-R303 IonicContact OE1-NE 3.21Å; E285-R303 PolarHBondContact OE1-NE 2.96Å; E285-R303 IonicContact OE1-NH2 2.71Å; E285-R303 PolarHBondContact OE1-NH2 2.74Å; M286-R303 PolarHBondContact N-O 3.49Å; L293-R303 HydrophobicContact CD1-CB 4.38Å
304	N	90.1	Very high	89.4	Confident	107 Å²	107	59.4 Å²	59.4	57%	0.572	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	124.7	176.3	-66	-43.7	0	0	0	109.5	L284 E285 T302	L284-N304 WeakPolarHBondContact O-CA 3.24Å; E285-N304 WeakPolarHBondContact CG-OD1 3.32Å; T302-N304 VanDerWaalsContact C-N 3.27Å; T302-N304 PolarHBondContact O-N 3.26Å; T302-N304 PolarHBondContact OG1-O 3.31Å
305	I	90.7	Very high	89.7	Confident	10 Å²	10	60.2 Å²	60.2	5%	0.051	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.3	177	-53.5	175.2	0	0	0	107.5	L284 M286 L301 T302 V312 V316	L284-I305 PolarHBondContact N-O 3.37Å; L284-I305 PolarHBondContact O-N 3.16Å; M286-I305 HydrophobicContact SD-CD1 4.25Å; L301-I305 HydrophobicContact CD2-CD1 3.7Å; T302-I305 WeakPolarHBondContact O-CG1 3.34Å; I305-V312 HydrophobicContact CB-CG1 4.39Å; I305-V312 HydrophobicContact CG2-CG1 3.97Å; I305-V312 HydrophobicContact CG2-CG2 4.12Å; I305-V316 HydrophobicContact CD1-CG2 4.01Å
306	S	92.3	Very high	90	Very high	79 Å²	79	53.2 Å²	53.2	55%	0.552	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.2	178.2	-178.4	0	0	0	0	110	I282 N283	I282-S306 WeakPolarHBondContact O-CA 3.06Å; N283-S306 WeakPolarHBondContact OD1-CB 3.33Å; N283-S306 PolarHBondContact OD1-OG 2.88Å
307	G	93.4	Very high	90.5	Very high	12 Å²	12	48.9 Å²	48.9	12%	0.124	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.4	-169.7	175.1	0	0	0	0	0	112.5	H281 I282 E309	H281-G307 WeakPolarHBondContact CA-O 3.17Å; I282-G307 PolarHBondContact N-O 2.87Å; I282-G307 PolarHBondContact O-N 3.05Å; G307-E309 PolarHBondContact O-N 2.75Å
308	P	94.5	Very high	90.9	Very high	27 Å²	27	52.7 Å²	52.7	18%	0.175	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	133.8	171.7	-21.3	32.4	0	0	0	110.5	S280 Y310 E311 V312	S280-P308 CarbonylContact O-C 3.54Å; S280-P308 WeakPolarHBondContact O-CA 3.2Å; P308-Y310 VanDerWaalsContact C-N 3.29Å; P308-Y310 HydrophobicContact CB-CD1 3.82Å; P308-Y310 HydrophobicContact CB-CE1 3.4Å; P308-Y310 HydrophobicContact CG-CE1 4.35Å; P308-Y310 PolarHBondContact O-N 2.81Å; P308-E311 HydrophobicContact CB-CB 4.48Å; P308-E311 HydrophobicContact CB-CG 4.17Å; P308-E311 HydrophobicContact CG-CG 4.38Å; P308-E311 PolarHBondContact O-N 2.84Å; P308-V312 PolarHBondContact O-N 2.86Å
309	E	94.4	Very high	91.3	Very high	30 Å²	30	48 Å²	48	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-56.5	-43.2	-169	-171.6	179.9	-174.1	0	0	112.4	L204 F276 S280 I282 G307 E311 V312 V313	L204-E309 WeakPolarHBondContact CD2-OE1 3.37Å; F276-E309 HydrophobicContact CD1-CB 4.17Å; F276-E309 HydrophobicContact CD1-CG 3.8Å; F276-E309 HydrophobicContact CE1-CG 3.72Å; S280-E309 WeakPolarHBondContact CB-OE2 3.37Å; S280-E309 PolarHBondContact O-N 3.47Å; S280-E309 PolarHBondContact OG-OE2 2.61Å; I282-E309 HydrophobicContact CB-CB 4.27Å; I282-E309 HydrophobicContact CB-CG 4.1Å; I282-E309 HydrophobicContact CD1-CG 4.36Å; I282-E309 HydrophobicContact CG2-CB 4.19Å; I282-E309 HydrophobicContact CG2-CG 4.1Å; G307-E309 PolarHBondContact O-N 2.75Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 2.92Å; E309-V312 PolarHBondContact O-N 2.89Å; E309-V313 WeakPolarHBondContact O-CB 3.41Å; E309-V313 VanDerWaalsContact O-CG2 3.27Å; E309-V313 WeakPolarHBondContact O-CG2 3.35Å; E309-V313 PolarHBondContact O-N 2.86Å
310	Y	94.1	Very high	91.9	Very high	34 Å²	34	47.1 Å²	47.1	13%	0.133	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-34.8	177.8	74	-88	0	0	0	112.9	V243 I252 K278 P308 A314	V243-Y310 HydrophobicContact CG1-CD2 4.21Å; I252-Y310 HydrophobicContact CB-CG 4.39Å; I252-Y310 HydrophobicContact CD1-CD1 3.56Å; I252-Y310 HydrophobicContact CD1-CD2 3.61Å; I252-Y310 HydrophobicContact CD1-CE1 3.41Å; I252-Y310 VanDerWaalsContact CD1-CE1 3.41Å; I252-Y310 HydrophobicContact CD1-CE2 3.49Å; I252-Y310 VanDerWaalsContact CD1-CE2 3.49Å; I252-Y310 HydrophobicContact CD1-CG 3.66Å; I252-Y310 VanDerWaalsContact CD1-CZ 3.41Å; I252-Y310 HydrophobicContact CG2-CD2 4.09Å; I252-Y310 HydrophobicContact CG2-CG 4.24Å; K278-Y310 HydrophobicContact CG-CE1 4.47Å; P308-Y310 VanDerWaalsContact C-N 3.29Å; P308-Y310 HydrophobicContact CB-CD1 3.82Å; P308-Y310 HydrophobicContact CB-CE1 3.4Å; P308-Y310 HydrophobicContact CG-CE1 4.35Å; P308-Y310 PolarHBondContact O-N 2.81Å; Y310-A314 VanDerWaalsContact O-CB 3.25Å; Y310-A314 WeakPolarHBondContact O-CB 3.2Å; Y310-A314 PolarHBondContact O-N 2.85Å
311	E	94.1	Very high	92.1	Very high	80 Å²	80	41.1 Å²	41.1	37%	0.374	21%	0.205	S	C	.	.	H	α-helix	trans	-74	-40.9	178.4	-64.5	-167.8	171.7	0	0	111.6	P308 E309 A314 R315	P308-E311 HydrophobicContact CB-CB 4.48Å; P308-E311 HydrophobicContact CB-CG 4.17Å; P308-E311 HydrophobicContact CG-CG 4.38Å; P308-E311 PolarHBondContact O-N 2.84Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 2.92Å; E311-A314 PolarHBondContact O-N 3.24Å; E311-R315 WeakPolarHBondContact O-CB 3.25Å; E311-R315 PolarHBondContact O-N 2.98Å
312	V	94.6	Very high	92.2	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-48.6	176.1	177.7	0	0	0	0	109.4	F201 I282 L284 I305 P308 E309 A314 R315 V316	F201-V312 HydrophobicContact CE1-CG1 4.31Å; I282-V312 HydrophobicContact CG2-CB 3.71Å; I282-V312 HydrophobicContact CG2-CG1 3.89Å; I282-V312 HydrophobicContact CG2-CG2 3.77Å; L284-V312 HydrophobicContact CB-CG1 4.04Å; L284-V312 HydrophobicContact CD2-CG1 3.96Å; I305-V312 HydrophobicContact CB-CG1 4.39Å; I305-V312 HydrophobicContact CG2-CG1 3.97Å; I305-V312 HydrophobicContact CG2-CG2 4.12Å; P308-V312 PolarHBondContact O-N 2.86Å; E309-V312 PolarHBondContact O-N 2.89Å; V312-A314 PolarHBondContact O-N 2.82Å; V312-R315 PolarHBondContact O-N 2.87Å; V312-V316 HydrophobicContact CG1-CG2 4.33Å; V312-V316 WeakPolarHBondContact O-CB 3.45Å; V312-V316 VanDerWaalsContact O-CG2 3.25Å; V312-V316 WeakPolarHBondContact O-CG2 3.44Å; V312-V316 PolarHBondContact O-N 3.4Å
313	V	94.3	Very high	92.3	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-57.4	-51.9	175.9	171	0	0	0	0	110.9	F201 F254 F276 E309 R315 V316 F317	F201-V313 HydrophobicContact CD1-CG2 3.65Å; F201-V313 HydrophobicContact CD2-CG2 4.38Å; F201-V313 HydrophobicContact CE1-CB 4.48Å; F201-V313 HydrophobicContact CE1-CG2 3.41Å; F201-V313 VanDerWaalsContact CE1-CG2 3.41Å; F201-V313 HydrophobicContact CE2-CG2 4.16Å; F201-V313 HydrophobicContact CG-CG2 4.14Å; F201-V313 HydrophobicContact CZ-CB 4.36Å; F201-V313 HydrophobicContact CZ-CG2 3.68Å; F254-V313 HydrophobicContact CD1-CG1 3.88Å; F254-V313 HydrophobicContact CE1-CG1 3.74Å; F254-V313 HydrophobicContact CG-CG1 4.47Å; F254-V313 HydrophobicContact CZ-CG1 4.21Å; F276-V313 HydrophobicContact CE1-CG2 4.02Å; F276-V313 HydrophobicContact CZ-CB 4.22Å; F276-V313 HydrophobicContact CZ-CG1 4.14Å; F276-V313 HydrophobicContact CZ-CG2 3.81Å; E309-V313 WeakPolarHBondContact O-CB 3.41Å; E309-V313 VanDerWaalsContact O-CG2 3.27Å; E309-V313 WeakPolarHBondContact O-CG2 3.35Å; E309-V313 PolarHBondContact O-N 2.86Å; V313-R315 VanDerWaalsContact C-N 3.33Å; V313-R315 PolarHBondContact O-N 2.79Å; V313-V316 PolarHBondContact O-N 2.81Å; V313-F317 HydrophobicContact CG1-CD2 3.99Å; V313-F317 HydrophobicContact CG1-CE2 3.91Å; V313-F317 WeakPolarHBondContact O-CB 3.42Å; V313-F317 WeakPolarHBondContact O-CD2 3.3Å; V313-F317 PolarHBondContact O-N 2.87Å
314	A	94.4	Very high	92.4	Very high	10 Å²	10	50.5 Å²	50.5	8%	0.083	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-40.3	-179.3	0	0	0	0	0	112.5	V243 F254 Y310 E311 V312 K318 V325	V243-A314 HydrophobicContact CG2-CB 3.73Å; F254-A314 HydrophobicContact CD2-CB 4.36Å; F254-A314 HydrophobicContact CE2-CB 3.85Å; Y310-A314 VanDerWaalsContact O-CB 3.25Å; Y310-A314 WeakPolarHBondContact O-CB 3.2Å; Y310-A314 PolarHBondContact O-N 2.85Å; E311-A314 PolarHBondContact O-N 3.24Å; V312-A314 PolarHBondContact O-N 2.82Å; A314-K318 WeakPolarHBondContact O-CB 3.42Å; A314-K318 PolarHBondContact O-N 2.84Å; A314-V325 HydrophobicContact CB-CG2 4.5Å
315	R	93.2	Very high	92.6	Very high	128 Å²	128	47.1 Å²	47.1	48%	0.483	23%	0.234	S	C	.	.	H	α-helix	trans	-66.1	-47	178.3	-174.7	-177.6	-60.4	-176.5	3.5	111.7	E311 V312 V313 K318 V319	E311-R315 WeakPolarHBondContact O-CB 3.25Å; E311-R315 PolarHBondContact O-N 2.98Å; V312-R315 PolarHBondContact O-N 2.87Å; V313-R315 VanDerWaalsContact C-N 3.33Å; V313-R315 PolarHBondContact O-N 2.79Å; R315-K318 PolarHBondContact O-N 2.79Å; R315-V319 WeakPolarHBondContact O-CG2 3.32Å; R315-V319 PolarHBondContact O-N 2.87Å; R315-V319 VanDerWaalsContact O-N 3.13Å
316	V	93.2	Very high	92.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-46.6	-179.9	176.1	0	0	0	0	110.3	L217 L284 L301 I305 V312 V313 K318 V319 L320	L217-V316 HydrophobicContact CD1-CB 4.49Å; L217-V316 HydrophobicContact CD1-CG1 3.44Å; L217-V316 VanDerWaalsContact CD1-CG1 3.44Å; L284-V316 HydrophobicContact CD2-CG2 3.8Å; L301-V316 HydrophobicContact CD2-CG2 4.23Å; I305-V316 HydrophobicContact CD1-CG2 4.01Å; V312-V316 HydrophobicContact CG1-CG2 4.33Å; V312-V316 WeakPolarHBondContact O-CB 3.45Å; V312-V316 VanDerWaalsContact O-CG2 3.25Å; V312-V316 WeakPolarHBondContact O-CG2 3.44Å; V312-V316 PolarHBondContact O-N 3.4Å; V313-V316 PolarHBondContact O-N 2.81Å; V316-K318 PolarHBondContact O-N 3.21Å; V316-V319 PolarHBondContact O-N 2.89Å; V316-L320 WeakPolarHBondContact O-CB 3.31Å; V316-L320 PolarHBondContact O-N 3.4Å
317	F	93.8	Very high	92.8	Very high	9 Å²	9	48.4 Å²	48.4	4%	0.039	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-42.7	177.8	-84.8	-124.5	0	0	0	112.3	F201 V215 L217 I222 L241 F254 V256 V313 V319 Y321	F201-F317 HydrophobicContact CE2-CE2 4.19Å; V215-F317 HydrophobicContact CG1-CZ 4.14Å; L217-F317 HydrophobicContact CD1-CD2 3.99Å; L217-F317 HydrophobicContact CD1-CE2 3.77Å; L217-F317 HydrophobicContact CD2-CD2 4.38Å; L217-F317 HydrophobicContact CD2-CE2 3.61Å; L217-F317 HydrophobicContact CD2-CZ 3.71Å; L217-F317 HydrophobicContact CG-CE2 4.28Å; I222-F317 HydrophobicContact CD1-CD1 4.09Å; I222-F317 HydrophobicContact CD1-CE1 3.47Å; I222-F317 VanDerWaalsContact CD1-CE1 3.47Å; I222-F317 HydrophobicContact CD1-CZ 4.11Å; I222-F317 HydrophobicContact CG1-CE1 4.42Å; L241-F317 HydrophobicContact CD1-CB 3.77Å; L241-F317 HydrophobicContact CD2-CB 4.49Å; L241-F317 HydrophobicContact CD2-CD1 4.18Å; F254-F317 AromaticContact CE1-CD1 3.88Å; F254-F317 HydrophobicContact CE1-CD1 3.88Å; F254-F317 HydrophobicContact CE1-CE1 4.06Å; F254-F317 HydrophobicContact CE1-CG 4.18Å; F254-F317 HydrophobicContact CZ-CB 4.11Å; F254-F317 HydrophobicContact CZ-CD1 4.05Å; F254-F317 HydrophobicContact CZ-CG 4.08Å; V256-F317 HydrophobicContact CG2-CD1 4.39Å; V256-F317 HydrophobicContact CG2-CE1 4.2Å; V313-F317 HydrophobicContact CG1-CD2 3.99Å; V313-F317 HydrophobicContact CG1-CE2 3.91Å; V313-F317 WeakPolarHBondContact O-CB 3.42Å; V313-F317 WeakPolarHBondContact O-CD2 3.3Å; V313-F317 PolarHBondContact O-N 2.87Å; F317-V319 VanDerWaalsContact C-N 3.35Å; F317-V319 PolarHBondContact O-N 2.89Å; F317-Y321 HydrophobicContact CB-CD2 4.39Å; F317-Y321 HydrophobicContact CD1-CD2 4.22Å; F317-Y321 HydrophobicContact CD1-CE2 4.2Å; F317-Y321 HydrophobicContact CG-CD2 4.36Å; F317-Y321 HydrophobicContact CG-CE2 4.35Å; F317-Y321 WeakPolarHBondContact O-CB 3.13Å; F317-Y321 PolarHBondContact O-N 3.5Å; F317-Y321 VanDerWaalsContact O-N 3.1Å
318	K	93.7	Very high	92.8	Very high	110 Å²	110	49 Å²	49	48%	0.478	24%	0.241	S	C	.	.	H	α-helix	trans	-55	-49.7	177.2	175.5	178.1	-177.2	-178	0	111.8	A314 R315 V316 D322 Q323 V325	A314-K318 WeakPolarHBondContact O-CB 3.42Å; A314-K318 PolarHBondContact O-N 2.84Å; R315-K318 PolarHBondContact O-N 2.79Å; V316-K318 PolarHBondContact O-N 3.21Å; K318-D322 WeakPolarHBondContact O-CA 3.47Å; K318-D322 PolarHBondContact O-N 2.84Å; K318-Q323 WeakPolarHBondContact CA-O 3.32Å; K318-Q323 WeakPolarHBondContact CG-O 3.27Å; K318-Q323 PolarHBondContact O-N 2.83Å; K318-V325 HydrophobicContact CB-CG2 3.79Å; K318-V325 HydrophobicContact CD-CG2 4.14Å; K318-V325 HydrophobicContact CG-CG2 4.21Å
319	V	92.4	Very high	92.4	Very high	25 Å²	25	49.2 Å²	49.2	15%	0.152	25%	0.247	C	C	.	.	H	α-helix	trans	-78.4	-42.4	-174.5	-180	0	0	0	0	111.3	F297 K300 L301 R315 V316 F317 Y321	F297-V319 HydrophobicContact CB-CG1 3.89Å; F297-V319 HydrophobicContact CD1-CG1 3.71Å; F297-V319 HydrophobicContact CG-CG1 3.98Å; K300-V319 HydrophobicContact CB-CG1 3.77Å; K300-V319 HydrophobicContact CB-CG2 3.93Å; K300-V319 HydrophobicContact CD-CG1 4.25Å; K300-V319 HydrophobicContact CD-CG2 4.47Å; L301-V319 HydrophobicContact CD1-CB 3.91Å; L301-V319 HydrophobicContact CD1-CG1 3.73Å; L301-V319 HydrophobicContact CD2-CB 4.1Å; L301-V319 HydrophobicContact CD2-CG1 4.45Å; L301-V319 HydrophobicContact CD2-CG2 4.24Å; L301-V319 HydrophobicContact CG-CB 3.85Å; L301-V319 HydrophobicContact CG-CG1 3.68Å; L301-V319 HydrophobicContact CG-CG2 4.31Å; R315-V319 WeakPolarHBondContact O-CG2 3.32Å; R315-V319 PolarHBondContact O-N 2.87Å; R315-V319 VanDerWaalsContact O-N 3.13Å; V316-V319 PolarHBondContact O-N 2.89Å; F317-V319 VanDerWaalsContact C-N 3.35Å; F317-V319 PolarHBondContact O-N 2.89Å; V319-Y321 PolarHBondContact O-N 2.71Å
320	L	90.1	Very high	92.1	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-68	-35.8	-175.5	-175	59.5	0	0	0	112.9	L198 L217 F297 V316	L198-L320 HydrophobicContact CD1-CD1 3.44Å; L198-L320 VanDerWaalsContact CD1-CD1 3.44Å; L198-L320 HydrophobicContact CD1-CD2 4.33Å; L217-L320 HydrophobicContact CB-CD2 3.72Å; L217-L320 HydrophobicContact CD1-CD2 4.09Å; L217-L320 HydrophobicContact CG-CD2 4.48Å; F297-L320 HydrophobicContact CE1-CD1 4.02Å; F297-L320 HydrophobicContact CE2-CD1 4.41Å; F297-L320 HydrophobicContact CZ-CD1 3.5Å; F297-L320 VanDerWaalsContact CZ-CD1 3.5Å; V316-L320 WeakPolarHBondContact O-CB 3.31Å; V316-L320 PolarHBondContact O-N 3.4Å
321	Y	90.2	Very high	92	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.047	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	5.2	-176	-55.8	-54.4	0	0	0	114	L217 Y218 F221 I222 K235 I238 F317 V319 Q323	L217-Y321 HydrophobicContact CD2-CE2 4.29Å; Y218-Y321 WeakPolarHBondContact O-CE1 3.44Å; Y218-Y321 PolarHBondContact O-OH 3.43Å; F221-Y321 PolarHBondContact O-OH 2.9Å; F221-Y321 VanDerWaalsContact O-OH 3.12Å; I222-Y321 HydrophobicContact CD1-CD2 4.23Å; I222-Y321 HydrophobicContact CD1-CE2 3.59Å; I222-Y321 HydrophobicContact CG1-CD2 4.43Å; I222-Y321 HydrophobicContact CG1-CE1 4.27Å; I222-Y321 HydrophobicContact CG1-CE2 3.41Å; I222-Y321 VanDerWaalsContact CG1-CE2 3.41Å; I222-Y321 WeakPolarHBondContact CG1-OH 3.31Å; K235-Y321 HydrophobicContact CB-CD1 3.54Å; K235-Y321 HydrophobicContact CB-CE1 4.02Å; K235-Y321 HydrophobicContact CB-CG 4.49Å; I238-Y321 HydrophobicContact CD1-CD1 4.32Å; I238-Y321 HydrophobicContact CD1-CD2 3.77Å; I238-Y321 HydrophobicContact CD1-CE2 4.25Å; I238-Y321 HydrophobicContact CD1-CG 3.82Å; F317-Y321 HydrophobicContact CB-CD2 4.39Å; F317-Y321 HydrophobicContact CD1-CD2 4.22Å; F317-Y321 HydrophobicContact CD1-CE2 4.2Å; F317-Y321 HydrophobicContact CG-CD2 4.36Å; F317-Y321 HydrophobicContact CG-CE2 4.35Å; F317-Y321 WeakPolarHBondContact O-CB 3.13Å; F317-Y321 PolarHBondContact O-N 3.5Å; F317-Y321 VanDerWaalsContact O-N 3.1Å; V319-Y321 PolarHBondContact O-N 2.71Å; Y321-Q323 VanDerWaalsContact C-N 3.29Å; Y321-Q323 WeakPolarHBondContact O-CG 2.92Å; Y321-Q323 PolarHBondContact O-N 3.14Å
322	D	88.7	Confident	91.7	Very high	140 Å²	140	50.3 Å²	50.3	75%	0.749	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	43.9	-179.7	-163.1	34.6	0	0	0	113.6	K318	K318-D322 WeakPolarHBondContact O-CA 3.47Å; K318-D322 PolarHBondContact O-N 2.84Å
323	Q	88.7	Confident	91.5	Very high	53 Å²	53	50.3 Å²	50.3	25%	0.248	27%	0.271	C	S	.	.			trans	-113.8	140.2	-177.7	-71.7	-61	-23.3	0	0	111.9	I238 T239 L241 K318 Y321	I238-Q323 HydrophobicContact CG2-CG 4.04Å; I238-Q323 PolarHBondContact O-NE2 3.21Å; T239-Q323 PolarHBondContact O-OE1 3.46Å; L241-Q323 HydrophobicContact CD1-CB 3.73Å; L241-Q323 HydrophobicContact CG-CB 3.89Å; K318-Q323 WeakPolarHBondContact CA-O 3.32Å; K318-Q323 WeakPolarHBondContact CG-O 3.27Å; K318-Q323 PolarHBondContact O-N 2.83Å; Y321-Q323 VanDerWaalsContact C-N 3.29Å; Y321-Q323 WeakPolarHBondContact O-CG 2.92Å; Y321-Q323 PolarHBondContact O-N 3.14Å
324	K	90.5	Very high	90.9	Very high	177 Å²	177	55.4 Å²	55.4	77%	0.77	29%	0.293	S	S	*	.			trans	-73.9	136.9	174	-66.6	-176.2	-178.3	-179.7	0	110.5
325	V	94.1	Very high	90.2	Very high	37 Å²	37	58.6 Å²	58.6	22%	0.224	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	115.8	172.1	-177.8	0	0	0	0	108.2	L241 V243 A314 K318	L241-V325 HydrophobicContact CB-CG2 4.15Å; L241-V325 HydrophobicContact CD1-CG2 4.2Å; V243-V325 HydrophobicContact CB-CG1 4.21Å; V243-V325 HydrophobicContact CG2-CG1 3.54Å; A314-V325 HydrophobicContact CB-CG2 4.5Å; K318-V325 HydrophobicContact CB-CG2 3.79Å; K318-V325 HydrophobicContact CD-CG2 4.14Å; K318-V325 HydrophobicContact CG-CG2 4.21Å
326	T	93.6	Very high	89.6	Confident	31 Å²	31	55.1 Å²	55.1	19%	0.19	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.1	175.2	-50.6	0	0	0	0	108.6	L241 M242 V243 L354	L241-T326 PolarHBondContact O-N 2.81Å; M242-T326 VanDerWaalsContact CA-O 3.3Å; M242-T326 WeakPolarHBondContact CA-O 3.17Å; V243-T326 PolarHBondContact N-O 3.49Å; T326-L354 HydrophobicContact CG2-CD1 3.97Å
327	V	93.6	Very high	89.3	Confident	85 Å²	85	56 Å²	56	52%	0.515	34%	0.341	S	S	.	.			trans	-114.8	164	174.1	-65.7	0	0	0	0	108.5	V243	V243-V327 HydrophobicContact CB-CG1 4.42Å
328	P	91.8	Very high	89.2	Confident	25 Å²	25	57.5 Å²	57.5	16%	0.162	35%	0.351	C	S	.	.			trans	-55.6	145.6	173.5	-21.3	31.5	0	0	0	112	V243 P245 C338 Y352	V243-P328 WeakPolarHBondContact O-CD 3.5Å; P245-P328 HydrophobicContact CG-CG 4.3Å; P328-C338 HydrophobicContact CB-CB 3.52Å; P328-C338 HydrophobicContact CG-CB 3.78Å; P328-Y352 HydrophobicContact CG-CD1 4.48Å
329	G	87.3	Confident	89.2	Confident	30 Å²	30	52.5 Å²	52.5	31%	0.309	33%	0.33	S	S	.	.			trans	-88.8	-144.1	-178.3	0	0	0	0	0	112.5	F331	G329-F331 PolarHBondContact O-N 3.02Å
330	S	87.3	Confident	89.2	Confident	94 Å²	94	51.3 Å²	51.3	66%	0.657	32%	0.323	S	S	*	.	S	Bend	trans	-76.4	5.1	-179.2	61.9	0	0	0	0	115.1
331	F	91.5	Very high	89.4	Confident	11 Å²	11	53.7 Å²	53.7	5%	0.048	35%	0.345	C	S	.	.			trans	-75.8	131.3	-177.5	179.1	-101.3	0	0	0	111.4	G329 A333 V340 P353 H412 L413 F416	G329-F331 PolarHBondContact O-N 3.02Å; F331-A333 HydrophobicContact CE1-CB 3.95Å; F331-A333 HydrophobicContact CZ-CB 4.36Å; F331-V340 HydrophobicContact CE1-CG2 3.7Å; F331-V340 HydrophobicContact CZ-CG2 3.49Å; F331-V340 VanDerWaalsContact CZ-CG2 3.49Å; F331-P353 HydrophobicContact CB-CB 3.99Å; F331-P353 HydrophobicContact CB-CG 4.45Å; F331-P353 HydrophobicContact CD1-CB 4.15Å; F331-P353 HydrophobicContact CD1-CG 3.68Å; F331-P353 HydrophobicContact CD2-CB 4Å; F331-P353 HydrophobicContact CD2-CG 3.88Å; F331-P353 HydrophobicContact CE1-CG 3.82Å; F331-P353 HydrophobicContact CE2-CG 4.01Å; F331-P353 HydrophobicContact CG-CB 3.76Å; F331-P353 HydrophobicContact CG-CG 3.71Å; F331-P353 HydrophobicContact CZ-CG 3.99Å; F331-H412 HydrophobicContact CE2-CB 4.12Å; F331-H412 HydrophobicContact CZ-CB 4.32Å; F331-L413 HydrophobicContact CE2-CD1 4.45Å; F331-F416 HydrophobicContact CB-CD2 3.77Å; F331-F416 HydrophobicContact CB-CE2 3.84Å; F331-F416 HydrophobicContact CB-CG 4.49Å; F331-F416 HydrophobicContact CD2-CB 3.77Å; F331-F416 AromaticContact CD2-CD2 3.84Å; F331-F416 HydrophobicContact CD2-CD2 3.84Å; F331-F416 AromaticContact CD2-CG 3.78Å; F331-F416 HydrophobicContact CD2-CG 3.78Å; F331-F416 HydrophobicContact CE2-CB 4.25Å; F331-F416 HydrophobicContact CG-CD2 4.27Å
332	S	89.7	Confident	89.5	Confident	63 Å²	63	53.3 Å²	53.3	44%	0.441	34%	0.344	S	S	.	.			trans	-124	120.6	171.2	-178	0	0	0	0	109.3	H412	S332-H412 PolarHBondContact O-CD2 3.47Å
333	A	89	Confident	89.7	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.033	31%	0.312	C	S	.	.			trans	-73.4	172.9	170.7	0	0	0	0	0	110.9	F331 G335 G336 G337 E409	F331-A333 HydrophobicContact CE1-CB 3.95Å; F331-A333 HydrophobicContact CZ-CB 4.36Å; A333-G335 PolarHBondContact O-N 3.05Å; A333-G336 PolarHBondContact O-N 3.04Å; A333-G337 VanDerWaalsContact CB-O 3.28Å; A333-G337 WeakPolarHBondContact CB-O 3.39Å; A333-G337 PolarHBondContact N-O 3.07Å; A333-E409 WeakPolarHBondContact CA-OE2 3.5Å; A333-E409 WeakPolarHBondContact CB-OE2 3.48Å
334	K	83	Confident	90	Very high	108 Å²	108	45.5 Å²	45.5	47%	0.47	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-37.7	179.5	-179	-166.4	179	176.5	0	114.3	D408 E409	K334-D408 HydrophobicContact CD-CB 3.62Å; K334-D408 VanDerWaalsContact CE-OD2 3.29Å; K334-D408 WeakPolarHBondContact CE-OD2 3.38Å; K334-D408 HydrophobicContact CG-CB 4.32Å; K334-D408 IonicContact NZ-OD2 3.72Å; K334-D408 PolarHBondContact NZ-OD2 3.08Å; K334-E409 VanDerWaalsContact CB-OE1 3.26Å; K334-E409 WeakPolarHBondContact CB-OE1 3.19Å; K334-E409 PolarHBondContact N-OE1 2.95Å; K334-E409 PolarHBondContact N-OE2 3.34Å
335	G	78.5	Confident	90	Very high	76 Å²	76	44.2 Å²	44.2	78%	0.784	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	11.3	-178.1	0	0	0	0	0	115.4	A333 G337	A333-G335 PolarHBondContact O-N 3.05Å; G335-G337 PolarHBondContact O-N 2.81Å
336	G	81.6	Confident	89.7	Confident	56 Å²	56	47.1 Å²	47.1	58%	0.577	33%	0.326	S	S	*	.	S	Bend	trans	75	6.1	-171.2	0	0	0	0	0	114.2	A333	A333-G336 PolarHBondContact O-N 3.04Å
337	G	85.9	Confident	89.6	Confident	19 Å²	19	47.5 Å²	47.5	20%	0.196	33%	0.33	C	S	.	.			trans	-76.6	163.7	173.6	0	0	0	0	0	112.1	A333 G335	A333-G337 VanDerWaalsContact CB-O 3.28Å; A333-G337 WeakPolarHBondContact CB-O 3.39Å; A333-G337 PolarHBondContact N-O 3.07Å; G335-G337 PolarHBondContact O-N 2.81Å
338	C	91.9	Very high	89.6	Confident	39 Å²	39	48.7 Å²	48.7	26%	0.264	34%	0.337	S	S	.	.	S	Bend	trans	-95.1	9.3	-179.9	-52.9	0	0	0	0	113.9	P328	P328-C338 HydrophobicContact CB-CB 3.52Å; P328-C338 HydrophobicContact CG-CB 3.78Å
339	A	93.6	Very high	89.7	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.041	33%	0.333	C	S	.	.			trans	-143.5	150.3	-172.1	0	0	0	0	0	112	L350 L351 Y352	A339-L350 HydrophobicContact CB-CB 4.2Å; A339-L350 HydrophobicContact CB-CD2 4.46Å; A339-L351 CarbonylContact C-O 3.59Å; A339-L351 VanDerWaalsContact CA-O 3.28Å; A339-L351 WeakPolarHBondContact CA-O 3.02Å; A339-Y352 HydrophobicContact CB-CD1 3.73Å; A339-Y352 HydrophobicContact CB-CD2 4.18Å; A339-Y352 HydrophobicContact CB-CE1 3.53Å; A339-Y352 HydrophobicContact CB-CE2 3.97Å; A339-Y352 HydrophobicContact CB-CG 4.06Å
340	V	93.6	Very high	90.1	Very high	0 Å²	0	47 Å²	47	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.5	176.8	-179.8	0	0	0	0	108.8	F331 C342 L350 L351 I405 E409	F331-V340 HydrophobicContact CE1-CG2 3.7Å; F331-V340 HydrophobicContact CZ-CG2 3.49Å; F331-V340 VanDerWaalsContact CZ-CG2 3.49Å; V340-C342 PolarHBondContact O-N 3.46Å; V340-L350 WeakPolarHBondContact O-CA 3.41Å; V340-L351 PolarHBondContact N-O 3.06Å; V340-L351 PolarHBondContact O-N 2.81Å; V340-I405 HydrophobicContact CG1-CB 4.47Å; V340-I405 HydrophobicContact CG1-CG1 4.28Å; V340-I405 HydrophobicContact CG1-CG2 3.46Å; V340-I405 VanDerWaalsContact CG1-CG2 3.46Å; V340-E409 HydrophobicContact CG1-CB 4.09Å; V340-E409 HydrophobicContact CG1-CG 4.1Å
341	A	93.2	Very high	90.5	Very high	63 Å²	63	42.6 Å²	42.6	52%	0.521	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126.1	173.5	0	0	0	0	0	110.2	L350	A341-L350 HydrophobicContact CB-CD2 4.21Å
342	C	93	Very high	90.7	Very high	3 Å²	3	42 Å²	42	2%	0.02	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	168.4	-179.9	73.3	0	0	0	0	111.7	V340 G349 F360 F402 I405	V340-C342 PolarHBondContact O-N 3.46Å; C342-G349 PolarHBondContact N-O 3.23Å; C342-G349 CarbonylContact O-C 3.47Å; C342-G349 PolarHBondContact O-N 2.82Å; C342-F360 VanDerWaalsContact SG-CE2 3.55Å; C342-F402 HydrophobicContact CB-CB 4.38Å; C342-I405 HydrophobicContact CB-CD1 4.19Å; C342-I405 HydrophobicContact CB-CG1 3.51Å
343	S	93.4	Very high	91	Very high	13 Å²	13	39 Å²	39	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.8	169.9	-63.9	0	0	0	0	109.6	S347 F402 T403	S343-S347 WeakPolarHBondContact CA-O 3.19Å; S343-F402 CarbonylContact O-C 3.56Å; S343-F402 WeakPolarHBondContact O-CA 3.34Å; S343-T403 WeakPolarHBondContact CB-OG1 3.47Å; S343-T403 PolarHBondContact N-O 3.26Å; S343-T403 PolarHBondContact O-N 3.4Å; S343-T403 PolarHBondContact O-OG1 2.74Å
344	Y	93.6	Very high	91.2	Very high	16 Å²	16	38.9 Å²	38.9	6%	0.063	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.6	169.3	-176.4	-116.7	0	0	0	108.5	A346 S347 F360 P364 I366 H400 T401 F402	Y344-A346 PolarHBondContact O-N 2.93Å; Y344-S347 PolarHBondContact N-O 2.83Å; Y344-S347 PolarHBondContact O-N 3.23Å; Y344-S347 VanDerWaalsContact O-N 3.16Å; Y344-F360 VanDerWaalsContact CB-CZ 3.46Å; Y344-F360 HydrophobicContact CD1-CD1 4.18Å; Y344-F360 HydrophobicContact CD1-CE1 4.28Å; Y344-F360 HydrophobicContact CG-CD1 4.38Å; Y344-F360 HydrophobicContact CG-CE1 4.38Å; Y344-P364 HydrophobicContact CD1-CG 3.95Å; Y344-P364 HydrophobicContact CE1-CG 3.98Å; Y344-I366 HydrophobicContact CD1-CG2 4.24Å; Y344-I366 HydrophobicContact CE1-CD1 4.48Å; Y344-I366 HydrophobicContact CE1-CG2 4.1Å; Y344-H400 HydrophobicContact CE2-CB 3.99Å; Y344-H400 AromaticContact CZ-ND1 3.65Å; Y344-H400 PolarHBondContact OH-ND1 3.21Å; Y344-T401 WeakPolarHBondContact CD2-O 3.32Å; Y344-F402 AromaticContact CD2-CD1 3.69Å; Y344-F402 HydrophobicContact CD2-CD1 3.69Å; Y344-F402 AromaticContact CD2-CE1 3.58Å; Y344-F402 HydrophobicContact CD2-CE1 3.58Å; Y344-F402 HydrophobicContact CD2-CG 4.38Å; Y344-F402 HydrophobicContact CD2-CZ 4.22Å; Y344-F402 HydrophobicContact CE2-CE1 4.29Å; Y344-F402 HydrophobicContact CG-CD1 4.03Å; Y344-F402 AromaticContact CG-CE1 3.82Å; Y344-F402 HydrophobicContact CG-CE1 3.82Å
345	K	90.1	Very high	91.6	Very high	151 Å²	151	38.4 Å²	38.4	66%	0.657	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-122.6	-167.1	-55.6	-178.8	179.3	179	0	110.3	P364	K345-P364 HydrophobicContact CD-CG 4.18Å
346	A	89	Confident	92.2	Very high	98 Å²	98	43 Å²	43	81%	0.81	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	15.6	-179	0	0	0	0	0	113	Y344	Y344-A346 PolarHBondContact O-N 2.93Å
347	S	92.3	Very high	92.7	Very high	38 Å²	38	40.4 Å²	40.4	27%	0.266	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.6	-173.9	-66.6	0	0	0	0	111.3	S343 Y344 R363	S343-S347 WeakPolarHBondContact CA-O 3.19Å; Y344-S347 PolarHBondContact N-O 2.83Å; Y344-S347 PolarHBondContact O-N 3.23Å; Y344-S347 VanDerWaalsContact O-N 3.16Å; S347-R363 WeakPolarHBondContact CB-O 3.12Å
348	V	92.9	Very high	93.2	Very high	110 Å²	110	39.6 Å²	39.6	67%	0.667	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	137.4	173.8	-175.8	0	0	0	0	108.8
349	G	93.8	Very high	93.3	Very high	8 Å²	8	37.8 Å²	37.8	8%	0.082	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	-157.7	177.2	0	0	0	0	0	111.6	C342 F360 V361	C342-G349 PolarHBondContact N-O 3.23Å; C342-G349 CarbonylContact O-C 3.47Å; C342-G349 PolarHBondContact O-N 2.82Å; G349-F360 VanDerWaalsContact CA-CZ 3.49Å; G349-V361 CarbonylContact C-O 3.53Å; G349-V361 WeakPolarHBondContact CA-O 3.38Å
350	L	95.2	Very high	93.4	Very high	13 Å²	13	37.5 Å²	37.5	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.9	-173.3	-65.9	169.4	0	0	0	108.5	H246 P247 F253 A339 V340 A341 Y352 F360 V361	H246-L350 VanDerWaalsContact CD2-CD1 3.48Å; H246-L350 WeakPolarHBondContact CD2-CD1 3.25Å; P247-L350 VanDerWaalsContact CD-CD1 3.47Å; P247-L350 HydrophobicContact CG-CD1 4.06Å; P247-L350 HydrophobicContact CG-CD2 3.75Å; F253-L350 HydrophobicContact CE2-CD1 3.82Å; F253-L350 HydrophobicContact CZ-CD1 4.37Å; A339-L350 HydrophobicContact CB-CB 4.2Å; A339-L350 HydrophobicContact CB-CD2 4.46Å; V340-L350 WeakPolarHBondContact O-CA 3.41Å; A341-L350 HydrophobicContact CB-CD2 4.21Å; L350-Y352 HydrophobicContact CB-CD2 4.3Å; L350-Y352 HydrophobicContact CB-CE2 3.57Å; L350-Y352 HydrophobicContact CD1-CE2 4.42Å; L350-F360 VanDerWaalsContact O-CA 3.32Å; L350-F360 WeakPolarHBondContact O-CA 3.45Å; L350-V361 PolarHBondContact N-O 3.28Å; L350-V361 PolarHBondContact O-N 3.09Å; L350-V361 VanDerWaalsContact O-N 3.07Å
351	L	95.9	Very high	93.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	124.4	171.4	-177.3	66.3	0	0	0	109	A339 V340 P353 F358 F360 F390 F402	A339-L351 CarbonylContact C-O 3.59Å; A339-L351 VanDerWaalsContact CA-O 3.28Å; A339-L351 WeakPolarHBondContact CA-O 3.02Å; V340-L351 PolarHBondContact N-O 3.06Å; V340-L351 PolarHBondContact O-N 2.81Å; L351-P353 WeakPolarHBondContact O-CD 3.49Å; L351-F358 HydrophobicContact CD1-CB 4.01Å; L351-F358 HydrophobicContact CD1-CD1 4.45Å; L351-F360 HydrophobicContact CB-CD2 4.45Å; L351-F360 HydrophobicContact CD1-CB 4.17Å; L351-F390 HydrophobicContact CD2-CD1 3.93Å; L351-F390 HydrophobicContact CD2-CE1 4.23Å; L351-F402 HydrophobicContact CD1-CD1 4.2Å; L351-F402 HydrophobicContact CD1-CE1 3.81Å; L351-F402 HydrophobicContact CD1-CE2 4.12Å; L351-F402 HydrophobicContact CD1-CZ 3.76Å; L351-F402 HydrophobicContact CD2-CD2 4.24Å; L351-F402 HydrophobicContact CD2-CG 4.22Å
352	Y	95.8	Very high	93.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.6	176	-67.4	-99.4	0	0	0	109	L244 P245 P328 A339 L350 L354 F358 T359 V361	L244-Y352 HydrophobicContact CB-CD1 4.1Å; L244-Y352 HydrophobicContact CB-CE1 3.7Å; L244-Y352 HydrophobicContact CB-CE2 4.18Å; L244-Y352 HydrophobicContact CB-CG 4.47Å; L244-Y352 HydrophobicContact CD1-CD2 4.09Å; L244-Y352 HydrophobicContact CD1-CE2 4.29Å; L244-Y352 HydrophobicContact CD1-CG 4.35Å; L244-Y352 HydrophobicContact CD2-CD1 4.01Å; L244-Y352 HydrophobicContact CD2-CE1 4.47Å; L244-Y352 HydrophobicContact CD2-CG 4.09Å; P245-Y352 WeakPolarHBondContact O-CE1 3.09Å; P245-Y352 PolarHBondContact O-OH 2.97Å; P245-Y352 VanDerWaalsContact O-OH 3.04Å; P328-Y352 HydrophobicContact CG-CD1 4.48Å; A339-Y352 HydrophobicContact CB-CD1 3.73Å; A339-Y352 HydrophobicContact CB-CD2 4.18Å; A339-Y352 HydrophobicContact CB-CE1 3.53Å; A339-Y352 HydrophobicContact CB-CE2 3.97Å; A339-Y352 HydrophobicContact CB-CG 4.06Å; L350-Y352 HydrophobicContact CB-CD2 4.3Å; L350-Y352 HydrophobicContact CB-CE2 3.57Å; L350-Y352 HydrophobicContact CD1-CE2 4.42Å; Y352-L354 PolarHBondContact O-N 2.8Å; Y352-F358 WeakPolarHBondContact O-CA 3.11Å; Y352-T359 WeakPolarHBondContact CB-O 3.36Å; Y352-T359 PolarHBondContact N-O 3.02Å; Y352-T359 PolarHBondContact O-N 3.27Å; Y352-V361 HydrophobicContact CD2-CG2 3.93Å; Y352-V361 HydrophobicContact CE2-CG2 3.4Å
353	P	95.2	Very high	92.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	106.3	164.3	-18.2	34	0	0	0	109.6	F331 L351 F358 L413 F416	F331-P353 HydrophobicContact CB-CB 3.99Å; F331-P353 HydrophobicContact CB-CG 4.45Å; F331-P353 HydrophobicContact CD1-CB 4.15Å; F331-P353 HydrophobicContact CD1-CG 3.68Å; F331-P353 HydrophobicContact CD2-CB 4Å; F331-P353 HydrophobicContact CD2-CG 3.88Å; F331-P353 HydrophobicContact CE1-CG 3.82Å; F331-P353 HydrophobicContact CE2-CG 4.01Å; F331-P353 HydrophobicContact CG-CB 3.76Å; F331-P353 HydrophobicContact CG-CG 3.71Å; F331-P353 HydrophobicContact CZ-CG 3.99Å; L351-P353 WeakPolarHBondContact O-CD 3.49Å; P353-F358 HydrophobicContact CB-CD1 4.04Å; P353-F358 HydrophobicContact CB-CE1 3.81Å; P353-F358 HydrophobicContact CG-CD1 4.26Å; P353-F358 HydrophobicContact CG-CE1 4.12Å; P353-L413 HydrophobicContact CG-CD1 4.01Å; P353-F416 HydrophobicContact CB-CD1 3.75Å; P353-F416 HydrophobicContact CB-CE1 3.43Å; P353-F416 VanDerWaalsContact CB-CE1 3.43Å; P353-F416 HydrophobicContact CB-CE2 4.23Å; P353-F416 HydrophobicContact CB-CG 4.28Å; P353-F416 HydrophobicContact CB-CZ 3.69Å
354	L	94.2	Very high	92.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	169.9	178.9	-53.1	179.2	0	0	0	110.3	M242 L244 T326 Y352 R356 G357 T359 F370 F416	M242-L354 HydrophobicContact SD-CD1 4.31Å; L244-L354 HydrophobicContact CD2-CD2 3.97Å; T326-L354 HydrophobicContact CG2-CD1 3.97Å; Y352-L354 PolarHBondContact O-N 2.8Å; L354-R356 PolarHBondContact O-N 2.73Å; L354-R356 VanDerWaalsContact O-N 3.09Å; L354-G357 CarbonylContact C-O 3.57Å; L354-G357 WeakPolarHBondContact CA-O 3.45Å; L354-G357 VanDerWaalsContact CB-O 3.3Å; L354-G357 WeakPolarHBondContact CB-O 3.19Å; L354-G357 PolarHBondContact N-O 2.93Å; L354-T359 VanDerWaalsContact CD1-OG1 3.31Å; L354-T359 WeakPolarHBondContact CD1-OG1 3.48Å; L354-F370 WeakPolarHBondContact O-CZ 3.3Å; L354-F416 WeakPolarHBondContact O-CZ 3.35Å
355	E	91.9	Very high	92.7	Very high	98 Å²	98	43.1 Å²	43.1	46%	0.458	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.3	-177.7	-171	53.3	-144.5	0	0	114.6	F370 K420	E355-F370 VanDerWaalsContact O-CE2 3.27Å; E355-F370 WeakPolarHBondContact O-CE2 2.99Å; E355-K420 IonicContact OE1-NZ 2.86Å; E355-K420 PolarHBondContact OE1-NZ 2.97Å; E355-K420 IonicContact OE2-NZ 2.72Å; E355-K420 PolarHBondContact OE2-NZ 2.77Å
356	R	89.9	Confident	92.8	Very high	172 Å²	172	37.2 Å²	37.2	65%	0.649	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-132.3	18.8	-175.5	-63.1	-172.9	64.5	-179.7	0.2	114	L354 R369 F370	L354-R356 PolarHBondContact O-N 2.73Å; L354-R356 VanDerWaalsContact O-N 3.09Å; R356-R369 WeakPolarHBondContact O-CA 3.27Å; R356-F370 PolarHBondContact O-N 2.63Å
357	G	93.4	Very high	93	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	173.8	-175.9	0	0	0	0	0	113.7	L354 I368 F370	L354-G357 CarbonylContact C-O 3.57Å; L354-G357 WeakPolarHBondContact CA-O 3.45Å; L354-G357 VanDerWaalsContact CB-O 3.3Å; L354-G357 WeakPolarHBondContact CB-O 3.19Å; L354-G357 PolarHBondContact N-O 2.93Å; G357-I368 CarbonylContact C-O 3.5Å; G357-I368 WeakPolarHBondContact CA-O 3.2Å; G357-F370 VanDerWaalsContact C-CE1 3.42Å; G357-F370 VanDerWaalsContact CA-CD1 3.42Å; G357-F370 VanDerWaalsContact N-CE1 3.33Å; G357-F370 VanDerWaalsContact N-CZ 3.33Å
358	F	95	Very high	93	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.009	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.7	168.2	-65.6	-74.1	0	0	0	109.4	L351 Y352 P353 S367 I368 F370 I373 F390 V392 L413 F416 V417 L422	L351-F358 HydrophobicContact CD1-CB 4.01Å; L351-F358 HydrophobicContact CD1-CD1 4.45Å; Y352-F358 WeakPolarHBondContact O-CA 3.11Å; P353-F358 HydrophobicContact CB-CD1 4.04Å; P353-F358 HydrophobicContact CB-CE1 3.81Å; P353-F358 HydrophobicContact CG-CD1 4.26Å; P353-F358 HydrophobicContact CG-CE1 4.12Å; F358-S367 CarbonylContact O-C 3.51Å; F358-S367 WeakPolarHBondContact O-CA 3.28Å; F358-I368 PolarHBondContact N-O 3.07Å; F358-I368 PolarHBondContact O-N 3.13Å; F358-F370 HydrophobicContact CD2-CD1 4.34Å; F358-F370 AromaticContact CD2-CE1 3.81Å; F358-F370 HydrophobicContact CD2-CE1 3.81Å; F358-F370 HydrophobicContact CE2-CD1 4.2Å; F358-F370 AromaticContact CE2-CE1 3.6Å; F358-F370 HydrophobicContact CE2-CE1 3.6Å; F358-F370 HydrophobicContact CG-CE1 4.38Å; F358-F370 AromaticContact CZ-CE1 3.99Å; F358-F370 HydrophobicContact CZ-CE1 3.99Å; F358-I373 HydrophobicContact CD2-CD1 3.79Å; F358-I373 HydrophobicContact CE2-CD1 3.8Å; F358-F390 HydrophobicContact CD1-CE1 4.48Å; F358-F390 HydrophobicContact CE1-CE1 4.19Å; F358-F390 HydrophobicContact CE1-CZ 4.3Å; F358-F390 HydrophobicContact CE2-CE1 4.25Å; F358-F390 HydrophobicContact CE2-CZ 4.08Å; F358-F390 HydrophobicContact CZ-CE1 4.08Å; F358-F390 AromaticContact CZ-CZ 3.82Å; F358-F390 HydrophobicContact CZ-CZ 3.82Å; F358-V392 HydrophobicContact CD2-CG2 4.49Å; F358-L413 HydrophobicContact CE1-CD1 4.21Å; F358-F416 HydrophobicContact CE1-CD1 4.34Å; F358-F416 HydrophobicContact CE1-CE1 4.09Å; F358-F416 HydrophobicContact CZ-CD1 4.48Å; F358-F416 HydrophobicContact CZ-CE1 4.28Å; F358-V417 HydrophobicContact CZ-CG2 4.13Å; F358-L422 HydrophobicContact CE2-CD1 3.87Å; F358-L422 HydrophobicContact CZ-CD1 4.12Å
359	T	95.1	Very high	93	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.3	172.6	-63.8	0	0	0	0	110	M242 L244 Y352 L354 V361 I366	M242-T359 HydrophobicContact CE-CG2 4.21Å; M242-T359 HydrophobicContact SD-CG2 3.89Å; L244-T359 HydrophobicContact CD1-CG2 3.98Å; Y352-T359 WeakPolarHBondContact CB-O 3.36Å; Y352-T359 PolarHBondContact N-O 3.02Å; Y352-T359 PolarHBondContact O-N 3.27Å; L354-T359 VanDerWaalsContact CD1-OG1 3.31Å; L354-T359 WeakPolarHBondContact CD1-OG1 3.48Å; T359-V361 HydrophobicContact CG2-CG1 4.26Å; T359-I366 CarbonylContact C-O 3.48Å; T359-I366 VanDerWaalsContact CA-O 3.25Å; T359-I366 WeakPolarHBondContact CA-O 3.27Å
360	F	96.2	Very high	92.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.5	174.1	172.7	-85.6	0	0	0	109.9	C342 Y344 G349 L350 L351 R363 P364 P365 I366 F402	C342-F360 VanDerWaalsContact SG-CE2 3.55Å; Y344-F360 VanDerWaalsContact CB-CZ 3.46Å; Y344-F360 HydrophobicContact CD1-CD1 4.18Å; Y344-F360 HydrophobicContact CD1-CE1 4.28Å; Y344-F360 HydrophobicContact CG-CD1 4.38Å; Y344-F360 HydrophobicContact CG-CE1 4.38Å; G349-F360 VanDerWaalsContact CA-CZ 3.49Å; L350-F360 VanDerWaalsContact O-CA 3.32Å; L350-F360 WeakPolarHBondContact O-CA 3.45Å; L351-F360 HydrophobicContact CB-CD2 4.45Å; L351-F360 HydrophobicContact CD1-CB 4.17Å; F360-R363 WeakPolarHBondContact CE1-O 3.47Å; F360-P364 WeakPolarHBondContact CD1-O 3.43Å; F360-P365 WeakPolarHBondContact O-CA 3.32Å; F360-I366 HydrophobicContact CB-CG2 3.66Å; F360-I366 HydrophobicContact CD1-CG2 4.36Å; F360-I366 HydrophobicContact CG-CG2 4.41Å; F360-I366 PolarHBondContact N-O 2.78Å; F360-I366 PolarHBondContact O-N 2.74Å; F360-F402 HydrophobicContact CB-CE1 3.77Å; F360-F402 HydrophobicContact CB-CZ 4.47Å; F360-F402 HydrophobicContact CD2-CD1 4.09Å; F360-F402 AromaticContact CD2-CE1 4Å; F360-F402 HydrophobicContact CD2-CE1 4Å; F360-F402 AromaticContact CG-CE1 3.99Å; F360-F402 HydrophobicContact CG-CE1 3.99Å
361	V	93.7	Very high	92.8	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	154.6	177.3	-70.2	0	0	0	0	108.8	L244 F253 G349 L350 Y352 T359 P365	L244-V361 HydrophobicContact CD1-CG1 4.05Å; L244-V361 HydrophobicContact CD1-CG2 4.05Å; F253-V361 HydrophobicContact CD2-CG2 4.05Å; F253-V361 HydrophobicContact CE2-CG2 4.32Å; F253-V361 HydrophobicContact CG-CG2 4.31Å; G349-V361 CarbonylContact C-O 3.53Å; G349-V361 WeakPolarHBondContact CA-O 3.38Å; L350-V361 PolarHBondContact N-O 3.28Å; L350-V361 PolarHBondContact O-N 3.09Å; L350-V361 VanDerWaalsContact O-N 3.07Å; Y352-V361 HydrophobicContact CD2-CG2 3.93Å; Y352-V361 HydrophobicContact CE2-CG2 3.4Å; T359-V361 HydrophobicContact CG2-CG1 4.26Å; V361-P365 HydrophobicContact CG1-CB 4.38Å
362	P	86.9	Confident	92.6	Very high	34 Å²	34	38.8 Å²	38.8	22%	0.221	18%	0.177	C	C	.	.	S	Bend	cis	-97.8	-20.1	7.9	35.6	-34.2	0	0	0	115.4	L207 F253 P365	L207-P362 HydrophobicContact CB-CB 4.46Å; L207-P362 HydrophobicContact CD1-CB 3.76Å; F253-P362 HydrophobicContact CE1-CB 4.42Å; P362-P365 WeakPolarHBondContact O-CD 3.41Å
363	R	87.3	Confident	92.5	Very high	122 Å²	122	39.4 Å²	39.4	46%	0.46	18%	0.18	S	C	.	.	S	Bend	trans	-149.6	129.3	-169.9	-175.7	-177.5	-68.4	-167.5	-4.5	113.8	S347 F360	S347-R363 WeakPolarHBondContact CB-O 3.12Å; F360-R363 WeakPolarHBondContact CE1-O 3.47Å
364	P	89.8	Confident	92.4	Very high	41 Å²	41	42 Å²	42	27%	0.266	20%	0.196	S	C	.	.	S	Bend	cis	-68.4	134.9	-21.9	29.9	-32.1	0	0	0	109.1	Y344 K345 F360 I366	Y344-P364 HydrophobicContact CD1-CG 3.95Å; Y344-P364 HydrophobicContact CE1-CG 3.98Å; K345-P364 HydrophobicContact CD-CG 4.18Å; F360-P364 WeakPolarHBondContact CD1-O 3.43Å; P364-I366 PolarHBondContact O-N 3.14Å
365	P	92.6	Very high	92.3	Very high	14 Å²	14	42 Å²	42	9%	0.091	20%	0.196	C	C	.	.			trans	-67.4	135.5	177.2	28.4	-32	0	0	0	109.4	Q208 F271 V273 F360 V361 P362	Q208-P365 VanDerWaalsContact CD-CD 3.48Å; Q208-P365 VanDerWaalsContact NE2-CG 3.31Å; F271-P365 HydrophobicContact CB-CB 4.06Å; F271-P365 HydrophobicContact CB-CG 3.7Å; F271-P365 HydrophobicContact CD2-CB 3.87Å; F271-P365 HydrophobicContact CD2-CG 3.78Å; F271-P365 HydrophobicContact CG-CB 3.95Å; F271-P365 HydrophobicContact CG-CG 3.96Å; V273-P365 HydrophobicContact CG2-CB 4.19Å; V273-P365 HydrophobicContact CG2-CG 4.28Å; F360-P365 WeakPolarHBondContact O-CA 3.32Å; V361-P365 HydrophobicContact CG1-CB 4.38Å; P362-P365 WeakPolarHBondContact O-CD 3.41Å
366	I	92.9	Very high	92.5	Very high	27 Å²	27	37.4 Å²	37.4	14%	0.138	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	139.7	178.9	-177.7	170.3	0	0	0	109.2	Y344 T359 F360 P364 I368 H400	Y344-I366 HydrophobicContact CD1-CG2 4.24Å; Y344-I366 HydrophobicContact CE1-CD1 4.48Å; Y344-I366 HydrophobicContact CE1-CG2 4.1Å; T359-I366 CarbonylContact C-O 3.48Å; T359-I366 VanDerWaalsContact CA-O 3.25Å; T359-I366 WeakPolarHBondContact CA-O 3.27Å; F360-I366 HydrophobicContact CB-CG2 3.66Å; F360-I366 HydrophobicContact CD1-CG2 4.36Å; F360-I366 HydrophobicContact CG-CG2 4.41Å; F360-I366 PolarHBondContact N-O 2.78Å; F360-I366 PolarHBondContact O-N 2.74Å; P364-I366 PolarHBondContact O-N 3.14Å; I366-I368 HydrophobicContact CD1-CD1 4.12Å; I366-I368 HydrophobicContact CD1-CG1 3.93Å; I366-I368 HydrophobicContact CG1-CG1 3.97Å; I366-H400 WeakPolarHBondContact CD1-CE1 3.28Å; I366-H400 WeakPolarHBondContact CD1-ND1 3.39Å
367	S	92.4	Very high	92.6	Very high	19 Å²	19	31.9 Å²	31.9	13%	0.133	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.1	170.8	174.9	0	0	0	0	108.2	F358	F358-S367 CarbonylContact O-C 3.51Å; F358-S367 WeakPolarHBondContact O-CA 3.28Å
368	I	93.4	Very high	92.5	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.7	177.6	-53.1	170.2	0	0	0	106.9	G357 F358 I366 I373 V392 T394 H400 F402	G357-I368 CarbonylContact C-O 3.5Å; G357-I368 WeakPolarHBondContact CA-O 3.2Å; F358-I368 PolarHBondContact N-O 3.07Å; F358-I368 PolarHBondContact O-N 3.13Å; I366-I368 HydrophobicContact CD1-CD1 4.12Å; I366-I368 HydrophobicContact CD1-CG1 3.93Å; I366-I368 HydrophobicContact CG1-CG1 3.97Å; I368-I373 HydrophobicContact CG2-CD1 4.15Å; I368-I373 HydrophobicContact CG2-CG1 3.8Å; I368-V392 HydrophobicContact CD1-CB 4.33Å; I368-V392 HydrophobicContact CD1-CG1 4.23Å; I368-V392 HydrophobicContact CG2-CG1 4.17Å; I368-T394 HydrophobicContact CG2-CG2 3.73Å; I368-H400 HydrophobicContact CD1-CB 3.73Å; I368-H400 VanDerWaalsContact CD1-CD2 3.49Å; I368-H400 WeakPolarHBondContact CD1-CD2 3.39Å; I368-F402 HydrophobicContact CD1-CE2 4.39Å; I368-F402 HydrophobicContact CD1-CZ 4.32Å
369	R	91.9	Very high	92.2	Very high	104 Å²	104	33.2 Å²	33.2	39%	0.392	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	149.6	178.6	-55.4	179.9	-73.4	166.6	-5.7	110.6	R356 D371 E372	R356-R369 WeakPolarHBondContact O-CA 3.27Å; R369-D371 VanDerWaalsContact C-N 3.26Å; R369-D371 WeakPolarHBondContact CB-OD1 3.45Å; R369-D371 IonicContact CZ-OD2 2.65Å; R369-D371 IonicContact NE-OD1 3.05Å; R369-D371 IonicContact NH1-OD2 3.14Å; R369-D371 PolarHBondContact O-N 2.9Å; R369-E372 HydrophobicContact CB-CG 4.29Å; R369-E372 IonicContact CZ-OE1 3.08Å; R369-E372 PolarHBondContact N-OE2 3.06Å; R369-E372 IonicContact NE-OE1 4Å; R369-E372 PolarHBondContact NE-OE1 2.86Å; R369-E372 IonicContact NE-OE2 3.07Å; R369-E372 IonicContact NH2-OE1 2.75Å; R369-E372 PolarHBondContact NH2-OE1 2.84Å; R369-E372 WeakPolarHBondContact O-CB 3.5Å; R369-E372 PolarHBondContact O-N 3.27Å
370	F	93	Very high	91.6	Very high	33 Å²	33	40 Å²	40	15%	0.145	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-63	-30.6	-178.5	-66.1	-19.7	0	0	0	113.7	L354 E355 R356 G357 F358 E372 I373 F416 K420 L422	L354-F370 WeakPolarHBondContact O-CZ 3.3Å; E355-F370 VanDerWaalsContact O-CE2 3.27Å; E355-F370 WeakPolarHBondContact O-CE2 2.99Å; R356-F370 PolarHBondContact O-N 2.63Å; G357-F370 VanDerWaalsContact C-CE1 3.42Å; G357-F370 VanDerWaalsContact CA-CD1 3.42Å; G357-F370 VanDerWaalsContact N-CE1 3.33Å; G357-F370 VanDerWaalsContact N-CZ 3.33Å; F358-F370 HydrophobicContact CD2-CD1 4.34Å; F358-F370 AromaticContact CD2-CE1 3.81Å; F358-F370 HydrophobicContact CD2-CE1 3.81Å; F358-F370 HydrophobicContact CE2-CD1 4.2Å; F358-F370 AromaticContact CE2-CE1 3.6Å; F358-F370 HydrophobicContact CE2-CE1 3.6Å; F358-F370 HydrophobicContact CG-CE1 4.38Å; F358-F370 AromaticContact CZ-CE1 3.99Å; F358-F370 HydrophobicContact CZ-CE1 3.99Å; F370-E372 PolarHBondContact O-N 3.37Å; F370-I373 HydrophobicContact CD1-CD1 3.82Å; F370-I373 PolarHBondContact O-N 2.85Å; F370-I373 VanDerWaalsContact O-N 3.13Å; F370-F416 AromaticContact CZ-CE1 3.82Å; F370-F416 HydrophobicContact CZ-CE1 3.82Å; F370-F416 HydrophobicContact CZ-CZ 4.06Å; F370-K420 HydrophobicContact CE2-CB 4.1Å; F370-K420 HydrophobicContact CE2-CD 4Å; F370-K420 HydrophobicContact CE2-CG 3.74Å; F370-K420 HydrophobicContact CZ-CG 4.17Å; F370-L422 HydrophobicContact CB-CD2 4.17Å; F370-L422 HydrophobicContact CD1-CD1 4.08Å; F370-L422 HydrophobicContact CD1-CD2 4.33Å; F370-L422 HydrophobicContact CE1-CD1 4.09Å; F370-L422 HydrophobicContact CG-CD2 4.23Å
371	D	91.8	Very high	90.4	Very high	79 Å²	79	40.4 Å²	40.4	42%	0.422	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-64	-23.3	174.6	54.2	-47.4	0	0	0	112.8	R369 R395	R369-D371 VanDerWaalsContact C-N 3.26Å; R369-D371 WeakPolarHBondContact CB-OD1 3.45Å; R369-D371 IonicContact CZ-OD2 2.65Å; R369-D371 IonicContact NE-OD1 3.05Å; R369-D371 IonicContact NH1-OD2 3.14Å; R369-D371 PolarHBondContact O-N 2.9Å; D371-R395 WeakPolarHBondContact O-CD 3.32Å; D371-R395 PolarHBondContact O-NE 3.16Å
372	E	91.4	Very high	89.2	Confident	61 Å²	61	46.4 Å²	46.4	29%	0.285	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-86.2	-13.1	177.6	-61.1	165.7	164.7	0	0	112.5	R369 F370 T394 R395	R369-E372 HydrophobicContact CB-CG 4.29Å; R369-E372 IonicContact CZ-OE1 3.08Å; R369-E372 PolarHBondContact N-OE2 3.06Å; R369-E372 IonicContact NE-OE1 4Å; R369-E372 PolarHBondContact NE-OE1 2.86Å; R369-E372 IonicContact NE-OE2 3.07Å; R369-E372 IonicContact NH2-OE1 2.75Å; R369-E372 PolarHBondContact NH2-OE1 2.84Å; R369-E372 WeakPolarHBondContact O-CB 3.5Å; R369-E372 PolarHBondContact O-N 3.27Å; F370-E372 PolarHBondContact O-N 3.37Å; E372-T394 CarbonylContact O-C 3.47Å; E372-T394 WeakPolarHBondContact O-CA 3.33Å; E372-T394 WeakPolarHBondContact O-CB 3.49Å; E372-R395 WeakPolarHBondContact O-CG 3.41Å; E372-R395 PolarHBondContact O-N 2.8Å
373	I	93.9	Very high	88	Confident	14 Å²	14	46.8 Å²	46.8	7%	0.072	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.6	-175.1	-59.2	176.6	0	0	0	110.3	F358 I368 F370 V376 V392 L422	F358-I373 HydrophobicContact CD2-CD1 3.79Å; F358-I373 HydrophobicContact CE2-CD1 3.8Å; I368-I373 HydrophobicContact CG2-CD1 4.15Å; I368-I373 HydrophobicContact CG2-CG1 3.8Å; F370-I373 HydrophobicContact CD1-CD1 3.82Å; F370-I373 PolarHBondContact O-N 2.85Å; F370-I373 VanDerWaalsContact O-N 3.13Å; I373-V376 HydrophobicContact CG2-CG1 4Å; I373-V392 HydrophobicContact CB-CG1 4.42Å; I373-V392 HydrophobicContact CD1-CG1 3.67Å; I373-V392 HydrophobicContact CG1-CG1 3.65Å; I373-V392 HydrophobicContact CG2-CG1 3.99Å; I373-L422 HydrophobicContact CD1-CD1 4.36Å
374	V	93.4	Very high	86.5	Confident	54 Å²	54	44.8 Å²	44.8	33%	0.327	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-41.7	174.3	171.4	0	0	0	0	110.9	E393 R395 R423	V374-E393 HydrophobicContact CB-CG 4.35Å; V374-E393 PolarHBondContact N-O 3.29Å; V374-R395 HydrophobicContact CG2-CB 4.14Å; V374-R395 HydrophobicContact CG2-CG 3.54Å; V374-R423 PolarHBondContact O-NE 2.91Å; V374-R423 PolarHBondContact O-NH2 3.46Å
375	A	93.2	Very high	85.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	163.1	172.5	0	0	0	0	0	111.3	E393 R423 K425	A375-E393 PolarHBondContact O-N 2.88Å; A375-R423 CarbonylContact C-O 3.54Å; A375-R423 WeakPolarHBondContact CA-O 3.36Å; A375-R423 HydrophobicContact CB-CB 4.37Å; A375-R423 HydrophobicContact CB-CG 4.49Å; A375-R423 WeakPolarHBondContact CB-O 3.45Å; A375-K425 HydrophobicContact CB-CD 4.2Å; A375-K425 HydrophobicContact CB-CG 3.81Å
376	V	94.8	Very high	84.3	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154	165.9	-54.2	0	0	0	0	110.5	I373 F378 F390 E391 V392 V417 R423 V424 K425	I373-V376 HydrophobicContact CG2-CG1 4Å; V376-F378 HydrophobicContact CG2-CE2 4.13Å; V376-F390 HydrophobicContact CB-CE2 3.76Å; V376-F390 HydrophobicContact CB-CZ 4.1Å; V376-F390 HydrophobicContact CG1-CE2 4.12Å; V376-F390 HydrophobicContact CG1-CZ 3.92Å; V376-F390 HydrophobicContact CG2-CE2 4.09Å; V376-E391 CarbonylContact C-O 3.53Å; V376-E391 WeakPolarHBondContact CA-O 3.37Å; V376-V392 HydrophobicContact CG1-CG1 4.42Å; V376-V392 HydrophobicContact CG1-CG2 4.15Å; V376-V417 HydrophobicContact CG2-CG1 3.41Å; V376-V417 VanDerWaalsContact CG2-CG1 3.41Å; V376-V417 HydrophobicContact CG2-CG2 4.36Å; V376-R423 PolarHBondContact N-O 2.83Å; V376-V424 HydrophobicContact CG2-CG2 3.92Å; V376-V424 WeakPolarHBondContact O-CA 3.33Å; V376-K425 PolarHBondContact O-N 2.84Å
377	Q	93	Very high	84.1	Confident	56 Å²	56	56 Å²	56	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	137.1	-178.5	170.6	167.3	-9.9	0	0	109.3	E391 K425	Q377-E391 HydrophobicContact CB-CB 4.08Å; Q377-E391 PolarHBondContact N-O 3.44Å; Q377-E391 PolarHBondContact O-N 3Å; Q377-K425 HydrophobicContact CB-CB 4.42Å
378	F	91.7	Very high	84	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	99.3	178.1	-65.7	-94.8	0	0	0	109.2	V376 F388 D389 F390 Y410 L413 Y414 V417 V424 N426	V376-F378 HydrophobicContact CG2-CE2 4.13Å; F378-F388 AromaticContact CD1-CD2 3.94Å; F378-F388 HydrophobicContact CD1-CD2 3.94Å; F378-F388 AromaticContact CD1-CE2 3.61Å; F378-F388 HydrophobicContact CD1-CE2 3.61Å; F378-F388 AromaticContact CE1-CE2 3.99Å; F378-F388 HydrophobicContact CE1-CE2 3.99Å; F378-D389 WeakPolarHBondContact CA-O 3.27Å; F378-F390 AromaticContact CD1-CD2 3.92Å; F378-F390 HydrophobicContact CD1-CD2 3.92Å; F378-F390 AromaticContact CE1-CD2 3.58Å; F378-F390 HydrophobicContact CE1-CD2 3.58Å; F378-F390 AromaticContact CE1-CE2 3.91Å; F378-F390 HydrophobicContact CE1-CE2 3.91Å; F378-F390 HydrophobicContact CE2-CD2 4.42Å; F378-F390 HydrophobicContact CE2-CE2 4.2Å; F378-F390 HydrophobicContact CG-CD2 4.48Å; F378-F390 AromaticContact CZ-CD2 3.86Å; F378-F390 HydrophobicContact CZ-CD2 3.86Å; F378-F390 AromaticContact CZ-CE2 3.7Å; F378-F390 HydrophobicContact CZ-CE2 3.7Å; F378-Y410 HydrophobicContact CB-CE2 3.76Å; F378-Y410 AromaticContact CD1-CD2 3.91Å; F378-Y410 HydrophobicContact CD1-CD2 3.91Å; F378-Y410 AromaticContact CD1-CE2 3.64Å; F378-Y410 HydrophobicContact CD1-CE2 3.64Å; F378-Y410 HydrophobicContact CE1-CD2 4.45Å; F378-Y410 HydrophobicContact CE1-CE2 4.35Å; F378-Y410 HydrophobicContact CG-CD2 4.49Å; F378-Y410 AromaticContact CG-CE2 3.78Å; F378-Y410 HydrophobicContact CG-CE2 3.78Å; F378-L413 HydrophobicContact CE1-CB 4.33Å; F378-L413 HydrophobicContact CE1-CD2 3.95Å; F378-L413 HydrophobicContact CE1-CG 4.04Å; F378-L413 HydrophobicContact CZ-CG 4.33Å; F378-Y414 HydrophobicContact CD2-CD2 4.45Å; F378-Y414 HydrophobicContact CE2-CD2 4.02Å; F378-Y414 HydrophobicContact CZ-CD2 4.38Å; F378-V417 HydrophobicContact CZ-CG2 4.22Å; F378-V424 HydrophobicContact CD2-CG1 3.95Å; F378-V424 HydrophobicContact CE2-CG1 4.14Å; F378-V424 HydrophobicContact CE2-CG2 4.43Å; F378-N426 VanDerWaalsContact C-ND2 3.34Å; F378-N426 PolarHBondContact N-ND2 2.84Å; F378-N426 PolarHBondContact O-ND2 2.91Å
379	S	88.2	Confident	84	Confident	24 Å²	24	55.9 Å²	55.9	17%	0.168	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	151.5	-179.4	42	0	0	0	0	110.8	G381 F388 D389 E391	S379-G381 PolarHBondContact O-N 2.97Å; S379-F388 WeakPolarHBondContact O-CA 3.35Å; S379-F388 WeakPolarHBondContact O-CB 3.5Å; S379-D389 PolarHBondContact N-O 3.5Å; S379-D389 PolarHBondContact O-N 2.81Å; S379-D389 WeakPolarHBondContact OG-CB 3.43Å; S379-E391 PolarHBondContact OG-OE1 2.84Å
380	R	82.3	Confident	84.1	Confident	145 Å²	145	51 Å²	51	55%	0.547	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	129.1	172.5	-176.1	-174.4	-177.3	140.1	13	108.2	D449	R380-D449 IonicContact CZ-OD2 3.54Å; R380-D449 IonicContact NH1-OD2 3.55Å; R380-D449 PolarHBondContact NH1-OD2 2.75Å; R380-D449 IonicContact NH2-OD2 3.87Å; R380-D449 PolarHBondContact NH2-OD2 2.92Å
381	G	71.6	Confident	84.2	Confident	8 Å²	8	51.6 Å²	51.6	8%	0.082	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-63.1	143.7	-179.7	0	0	0	0	0	111.3	S379 G383 S387	S379-G381 PolarHBondContact O-N 2.97Å; G381-G383 PolarHBondContact O-N 3.37Å; G381-G383 VanDerWaalsContact O-N 3.1Å; G381-S387 WeakPolarHBondContact CA-O 3.22Å; G381-S387 PolarHBondContact N-O 3.46Å; G381-S387 VanDerWaalsContact N-O 3.09Å
382	T	67	Low	84.3	Confident	127 Å²	127	47.8 Å²	47.8	78%	0.779	25%	0.254	S	S	*	.	S	Bend	trans	-77.1	12.8	-177.6	51	0	0	0	0	114.2
383	G	62.1	Low	84.5	Confident	41 Å²	41	47.4 Å²	47.4	42%	0.423	25%	0.252	S	S	.	.	S	Bend	trans	-112.2	157.1	-174.4	0	0	0	0	0	114.2	G381 Q385	G381-G383 PolarHBondContact O-N 3.37Å; G381-G383 VanDerWaalsContact O-N 3.1Å; G383-Q385 PolarHBondContact O-N 3.29Å; G383-Q385 VanDerWaalsContact O-N 3.12Å
384	A	55.2	Low	84.4	Confident	81 Å²	81	47 Å²	47	67%	0.669	25%	0.251	S	S	*	.	S	Bend	trans	-69.2	-4.2	179.6	0	0	0	0	0	114.4	K584	A384-K584 HydrophobicContact CB-CD 3.62Å; A384-K584 PolarHBondContact O-NZ 3.03Å
385	Q	62.1	Low	84.3	Confident	93 Å²	93	53.5 Å²	53.5	44%	0.435	27%	0.269	S	S	.	.	S	Bend	trans	-92.1	154.2	174.1	-66.8	-175.1	-73.6	0	0	110	G383 S387 S583 K584	G383-Q385 PolarHBondContact O-N 3.29Å; G383-Q385 VanDerWaalsContact O-N 3.12Å; Q385-S387 PolarHBondContact O-N 3.41Å; Q385-S583 PolarHBondContact NE2-O 3.05Å; Q385-K584 HydrophobicContact CB-CD 4.44Å; Q385-K584 HydrophobicContact CG-CB 3.64Å; Q385-K584 HydrophobicContact CG-CD 3.3Å; Q385-K584 HydrophobicContact CG-CG 3.36Å
386	R	75	Confident	84	Confident	199 Å²	199	59 Å²	59	75%	0.751	30%	0.298	S	S	*	.	S	Bend	trans	-68.5	72.5	176.1	-63.6	176.6	-177.8	176.5	-0.4	109.7	R407	R386-R407 HydrophobicContact CB-CB 4.33Å; R386-R407 WeakPolarHBondContact O-CB 3.39Å; R386-R407 PolarHBondContact O-N 2.95Å
387	S	88.3	Confident	83.6	Confident	24 Å²	24	61.8 Å²	61.8	17%	0.168	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	155.7	180	59.8	0	0	0	0	112.2	G381 Q385 I405	G381-S387 WeakPolarHBondContact CA-O 3.22Å; G381-S387 PolarHBondContact N-O 3.46Å; G381-S387 VanDerWaalsContact N-O 3.09Å; Q385-S387 PolarHBondContact O-N 3.41Å; S387-I405 CarbonylContact C-O 3.48Å; S387-I405 WeakPolarHBondContact CA-O 3.42Å; S387-I405 WeakPolarHBondContact CB-O 3.43Å
388	F	90.6	Very high	83.5	Confident	7 Å²	7	63.8 Å²	63.8	3%	0.031	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	162.2	172	73	-87.2	0	0	0	110.5	F378 S379 F390 I405 E406 Y410 L413	F378-F388 AromaticContact CD1-CD2 3.94Å; F378-F388 HydrophobicContact CD1-CD2 3.94Å; F378-F388 AromaticContact CD1-CE2 3.61Å; F378-F388 HydrophobicContact CD1-CE2 3.61Å; F378-F388 AromaticContact CE1-CE2 3.99Å; F378-F388 HydrophobicContact CE1-CE2 3.99Å; S379-F388 WeakPolarHBondContact O-CA 3.35Å; S379-F388 WeakPolarHBondContact O-CB 3.5Å; F388-F390 HydrophobicContact CE2-CB 4.23Å; F388-I405 HydrophobicContact CD1-CB 4.17Å; F388-I405 HydrophobicContact CD1-CG2 4.15Å; F388-I405 HydrophobicContact CD2-CB 4.49Å; F388-I405 HydrophobicContact CE1-CB 3.86Å; F388-I405 HydrophobicContact CE1-CG2 3.37Å; F388-I405 HydrophobicContact CE2-CB 4.18Å; F388-I405 HydrophobicContact CE2-CD1 3.99Å; F388-I405 HydrophobicContact CE2-CG2 4.15Å; F388-I405 HydrophobicContact CG-CB 4.49Å; F388-I405 HydrophobicContact CZ-CB 3.86Å; F388-I405 HydrophobicContact CZ-CD1 4.23Å; F388-I405 HydrophobicContact CZ-CG2 3.37Å; F388-I405 PolarHBondContact N-O 3.43Å; F388-I405 PolarHBondContact O-N 2.99Å; F388-I405 VanDerWaalsContact O-N 3.12Å; F388-E406 WeakPolarHBondContact CE1-O 3.34Å; F388-Y410 HydrophobicContact CD1-CD2 4.23Å; F388-Y410 HydrophobicContact CD2-CD2 4.24Å; F388-Y410 HydrophobicContact CE1-CD2 4.21Å; F388-Y410 HydrophobicContact CE1-CG 4.48Å; F388-Y410 HydrophobicContact CE2-CD2 4.25Å; F388-Y410 HydrophobicContact CG-CD2 4.23Å; F388-Y410 HydrophobicContact CZ-CD2 4.22Å; F388-L413 HydrophobicContact CE2-CD2 4.2Å; F388-L413 HydrophobicContact CZ-CD2 4.23Å
389	D	92.5	Very high	83.6	Confident	15 Å²	15	66.9 Å²	66.9	8%	0.08	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	135.7	175.7	-63.1	-16	0	0	0	108.4	F378 S379 T401 F402 T403 S404	F378-D389 WeakPolarHBondContact CA-O 3.27Å; S379-D389 PolarHBondContact N-O 3.5Å; S379-D389 PolarHBondContact O-N 2.81Å; S379-D389 WeakPolarHBondContact OG-CB 3.43Å; D389-T401 HydrophobicContact CB-CG2 4.37Å; D389-F402 CarbonylContact C-O 3.18Å; D389-F402 WeakPolarHBondContact CA-O 3.2Å; D389-T403 HydrophobicContact CB-CG2 4.39Å; D389-T403 WeakPolarHBondContact OD1-CA 3.26Å; D389-T403 VanDerWaalsContact OD1-CB 3.25Å; D389-T403 WeakPolarHBondContact OD1-CB 3.48Å; D389-S404 PolarHBondContact OD1-N 3.23Å
390	F	94.5	Very high	83.9	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	113.4	177.9	178.9	-117.9	0	0	0	109.3	L351 F358 V376 F378 F388 V392 F402 I405 L413 V417	L351-F390 HydrophobicContact CD2-CD1 3.93Å; L351-F390 HydrophobicContact CD2-CE1 4.23Å; F358-F390 HydrophobicContact CD1-CE1 4.48Å; F358-F390 HydrophobicContact CE1-CE1 4.19Å; F358-F390 HydrophobicContact CE1-CZ 4.3Å; F358-F390 HydrophobicContact CE2-CE1 4.25Å; F358-F390 HydrophobicContact CE2-CZ 4.08Å; F358-F390 HydrophobicContact CZ-CE1 4.08Å; F358-F390 AromaticContact CZ-CZ 3.82Å; F358-F390 HydrophobicContact CZ-CZ 3.82Å; V376-F390 HydrophobicContact CB-CE2 3.76Å; V376-F390 HydrophobicContact CB-CZ 4.1Å; V376-F390 HydrophobicContact CG1-CE2 4.12Å; V376-F390 HydrophobicContact CG1-CZ 3.92Å; V376-F390 HydrophobicContact CG2-CE2 4.09Å; F378-F390 AromaticContact CD1-CD2 3.92Å; F378-F390 HydrophobicContact CD1-CD2 3.92Å; F378-F390 AromaticContact CE1-CD2 3.58Å; F378-F390 HydrophobicContact CE1-CD2 3.58Å; F378-F390 AromaticContact CE1-CE2 3.91Å; F378-F390 HydrophobicContact CE1-CE2 3.91Å; F378-F390 HydrophobicContact CE2-CD2 4.42Å; F378-F390 HydrophobicContact CE2-CE2 4.2Å; F378-F390 HydrophobicContact CG-CD2 4.48Å; F378-F390 AromaticContact CZ-CD2 3.86Å; F378-F390 HydrophobicContact CZ-CD2 3.86Å; F378-F390 AromaticContact CZ-CE2 3.7Å; F378-F390 HydrophobicContact CZ-CE2 3.7Å; F388-F390 HydrophobicContact CE2-CB 4.23Å; F390-V392 HydrophobicContact CD1-CG2 3.96Å; F390-V392 HydrophobicContact CE1-CG2 3.38Å; F390-V392 HydrophobicContact CZ-CG2 3.77Å; F390-F402 HydrophobicContact CB-CB 4.35Å; F390-F402 AromaticContact CD1-CD2 3.8Å; F390-F402 HydrophobicContact CD1-CD2 3.8Å; F390-F402 HydrophobicContact CD1-CE2 4.47Å; F390-F402 PolarHBondContact N-O 2.93Å; F390-F402 WeakPolarHBondContact O-CD2 3.48Å; F390-F402 PolarHBondContact O-N 3.38Å; F390-I405 HydrophobicContact CB-CD1 3.57Å; F390-L413 HydrophobicContact CB-CD2 4.18Å; F390-L413 HydrophobicContact CD1-CD2 4.03Å; F390-L413 HydrophobicContact CD2-CD2 3.81Å; F390-L413 HydrophobicContact CE1-CD2 4.34Å; F390-L413 HydrophobicContact CE2-CD2 4.14Å; F390-L413 HydrophobicContact CE2-CG 4.41Å; F390-L413 HydrophobicContact CG-CD2 3.75Å; F390-L413 HydrophobicContact CZ-CD2 4.39Å; F390-V417 HydrophobicContact CE2-CG2 4.14Å; F390-V417 HydrophobicContact CZ-CG2 4.12Å
391	E	94.6	Very high	84.5	Confident	46 Å²	46	62.2 Å²	62.2	22%	0.215	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.1	-177.4	-70.2	173.1	-146.4	0	0	110.2	V376 Q377 S379 T399 H400 T401	V376-E391 CarbonylContact C-O 3.53Å; V376-E391 WeakPolarHBondContact CA-O 3.37Å; Q377-E391 HydrophobicContact CB-CB 4.08Å; Q377-E391 PolarHBondContact N-O 3.44Å; Q377-E391 PolarHBondContact O-N 3Å; S379-E391 PolarHBondContact OG-OE1 2.84Å; E391-T399 HydrophobicContact CB-CG2 4.32Å; E391-H400 WeakPolarHBondContact CA-O 3.35Å; E391-T401 HydrophobicContact CG-CG2 3.73Å
392	V	95.3	Very high	85.6	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112	176.5	-177.4	0	0	0	0	109	F358 I368 I373 V376 F390 T394 T399 H400 F402	F358-V392 HydrophobicContact CD2-CG2 4.49Å; I368-V392 HydrophobicContact CD1-CB 4.33Å; I368-V392 HydrophobicContact CD1-CG1 4.23Å; I368-V392 HydrophobicContact CG2-CG1 4.17Å; I373-V392 HydrophobicContact CB-CG1 4.42Å; I373-V392 HydrophobicContact CD1-CG1 3.67Å; I373-V392 HydrophobicContact CG1-CG1 3.65Å; I373-V392 HydrophobicContact CG2-CG1 3.99Å; V376-V392 HydrophobicContact CG1-CG1 4.42Å; V376-V392 HydrophobicContact CG1-CG2 4.15Å; F390-V392 HydrophobicContact CD1-CG2 3.96Å; F390-V392 HydrophobicContact CE1-CG2 3.38Å; F390-V392 HydrophobicContact CZ-CG2 3.77Å; V392-T394 HydrophobicContact CG1-CG2 4.48Å; V392-T399 WeakPolarHBondContact O-CA 3.37Å; V392-H400 HydrophobicContact CB-CB 4.47Å; V392-H400 PolarHBondContact N-O 3.12Å; V392-H400 PolarHBondContact O-N 3.29Å; V392-F402 HydrophobicContact CG2-CE2 4.14Å
393	E	94.1	Very high	86.8	Confident	53 Å²	53	57.7 Å²	57.7	25%	0.248	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.4	175.2	-177.8	-176.7	-137.2	0	0	109.5	V374 A375 K425	V374-E393 HydrophobicContact CB-CG 4.35Å; V374-E393 PolarHBondContact N-O 3.29Å; A375-E393 PolarHBondContact O-N 2.88Å; E393-K425 IonicContact OE1-NZ 3.05Å; E393-K425 PolarHBondContact OE1-NZ 3.26Å; E393-K425 VanDerWaalsContact OE1-NZ 3.14Å; E393-K425 WeakPolarHBondContact OE2-CE 2.8Å; E393-K425 IonicContact OE2-NZ 3.68Å; E393-K425 PolarHBondContact OE2-NZ 3.47Å
394	T	92.7	Very high	88.1	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	159.7	-179	62.3	0	0	0	0	112.2	I368 E372 V392 N396 G397 L398	I368-T394 HydrophobicContact CG2-CG2 3.73Å; E372-T394 CarbonylContact O-C 3.47Å; E372-T394 WeakPolarHBondContact O-CA 3.33Å; E372-T394 WeakPolarHBondContact O-CB 3.49Å; V392-T394 HydrophobicContact CG1-CG2 4.48Å; T394-N396 PolarHBondContact O-N 3.31Å; T394-N396 VanDerWaalsContact O-N 3.14Å; T394-N396 PolarHBondContact OG1-OD1 3.32Å; T394-G397 PolarHBondContact O-N 3.18Å; T394-L398 PolarHBondContact N-O 3.01Å; T394-L398 PolarHBondContact OG1-O 3.13Å
395	R	90.6	Very high	89.9	Confident	190 Å²	190	54.9 Å²	54.9	72%	0.717	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22	-176.1	-72.6	-179.5	-173	-113	-0.3	113.9	D371 E372 V374 G397	D371-R395 WeakPolarHBondContact O-CD 3.32Å; D371-R395 PolarHBondContact O-NE 3.16Å; E372-R395 WeakPolarHBondContact O-CG 3.41Å; E372-R395 PolarHBondContact O-N 2.8Å; V374-R395 HydrophobicContact CG2-CB 4.14Å; V374-R395 HydrophobicContact CG2-CG 3.54Å; R395-G397 VanDerWaalsContact C-N 3.25Å; R395-G397 PolarHBondContact O-N 2.87Å
396	N	88	Confident	91.2	Very high	115 Å²	115	56 Å²	56	62%	0.615	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	3.4	177.1	65.8	19.1	0	0	0	113.1	T394 L398	T394-N396 PolarHBondContact O-N 3.31Å; T394-N396 VanDerWaalsContact O-N 3.14Å; T394-N396 PolarHBondContact OG1-OD1 3.32Å; N396-L398 WeakPolarHBondContact OD1-CB 3.38Å; N396-L398 VanDerWaalsContact OD1-CG 3.27Å; N396-L398 WeakPolarHBondContact OD1-CG 3.39Å; N396-L398 PolarHBondContact OD1-N 3.17Å
397	G	86.9	Confident	91.7	Very high	61 Å²	61	47.9 Å²	47.9	63%	0.629	26%	0.258	S	S	*	.	S	Bend	trans	85.3	2.2	-179.3	0	0	0	0	0	114.7	T394 R395	T394-G397 PolarHBondContact O-N 3.18Å; R395-G397 VanDerWaalsContact C-N 3.25Å; R395-G397 PolarHBondContact O-N 2.87Å
398	L	90.9	Very high	91.7	Very high	97 Å²	97	50.5 Å²	50.5	51%	0.508	27%	0.27	S	S	.	.			trans	-81.9	130.9	173.6	-63.9	170.2	0	0	0	110.6	T394 N396	T394-L398 PolarHBondContact N-O 3.01Å; T394-L398 PolarHBondContact OG1-O 3.13Å; N396-L398 WeakPolarHBondContact OD1-CB 3.38Å; N396-L398 VanDerWaalsContact OD1-CG 3.27Å; N396-L398 WeakPolarHBondContact OD1-CG 3.39Å; N396-L398 PolarHBondContact OD1-N 3.17Å
399	T	93.4	Very high	91.7	Very high	72 Å²	72	51.2 Å²	51.2	44%	0.442	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.5	171.5	-56	0	0	0	0	109.9	E391 V392	E391-T399 HydrophobicContact CB-CG2 4.32Å; V392-T399 WeakPolarHBondContact O-CA 3.37Å
400	H	93.9	Very high	91.5	Very high	23 Å²	23	51.2 Å²	51.2	11%	0.106	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109.9	176.5	-61.6	-79.8	0	0	0	109.9	Y344 I366 I368 E391 V392 F402	Y344-H400 HydrophobicContact CE2-CB 3.99Å; Y344-H400 AromaticContact CZ-ND1 3.65Å; Y344-H400 PolarHBondContact OH-ND1 3.21Å; I366-H400 WeakPolarHBondContact CD1-CE1 3.28Å; I366-H400 WeakPolarHBondContact CD1-ND1 3.39Å; I368-H400 HydrophobicContact CD1-CB 3.73Å; I368-H400 VanDerWaalsContact CD1-CD2 3.49Å; I368-H400 WeakPolarHBondContact CD1-CD2 3.39Å; E391-H400 WeakPolarHBondContact CA-O 3.35Å; V392-H400 HydrophobicContact CB-CB 4.47Å; V392-H400 PolarHBondContact N-O 3.12Å; V392-H400 PolarHBondContact O-N 3.29Å; H400-F402 HydrophobicContact CB-CE2 4.16Å; H400-F402 HydrophobicContact CB-CZ 4.4Å
401	T	94.6	Very high	91.3	Very high	48 Å²	48	53.7 Å²	53.7	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117	179.6	-48.8	0	0	0	0	110.8	Y344 D389 E391 T403	Y344-T401 WeakPolarHBondContact CD2-O 3.32Å; D389-T401 HydrophobicContact CB-CG2 4.37Å; E391-T401 HydrophobicContact CG-CG2 3.73Å; T401-T403 HydrophobicContact CG2-CG2 3.77Å
402	F	94.7	Very high	91.2	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.2	172	-58.1	-80.8	0	0	0	108.6	C342 S343 Y344 L351 F360 I368 D389 F390 V392 H400 I405	C342-F402 HydrophobicContact CB-CB 4.38Å; S343-F402 CarbonylContact O-C 3.56Å; S343-F402 WeakPolarHBondContact O-CA 3.34Å; Y344-F402 AromaticContact CD2-CD1 3.69Å; Y344-F402 HydrophobicContact CD2-CD1 3.69Å; Y344-F402 AromaticContact CD2-CE1 3.58Å; Y344-F402 HydrophobicContact CD2-CE1 3.58Å; Y344-F402 HydrophobicContact CD2-CG 4.38Å; Y344-F402 HydrophobicContact CD2-CZ 4.22Å; Y344-F402 HydrophobicContact CE2-CE1 4.29Å; Y344-F402 HydrophobicContact CG-CD1 4.03Å; Y344-F402 AromaticContact CG-CE1 3.82Å; Y344-F402 HydrophobicContact CG-CE1 3.82Å; L351-F402 HydrophobicContact CD1-CD1 4.2Å; L351-F402 HydrophobicContact CD1-CE1 3.81Å; L351-F402 HydrophobicContact CD1-CE2 4.12Å; L351-F402 HydrophobicContact CD1-CZ 3.76Å; L351-F402 HydrophobicContact CD2-CD2 4.24Å; L351-F402 HydrophobicContact CD2-CG 4.22Å; F360-F402 HydrophobicContact CB-CE1 3.77Å; F360-F402 HydrophobicContact CB-CZ 4.47Å; F360-F402 HydrophobicContact CD2-CD1 4.09Å; F360-F402 AromaticContact CD2-CE1 4Å; F360-F402 HydrophobicContact CD2-CE1 4Å; F360-F402 AromaticContact CG-CE1 3.99Å; F360-F402 HydrophobicContact CG-CE1 3.99Å; I368-F402 HydrophobicContact CD1-CE2 4.39Å; I368-F402 HydrophobicContact CD1-CZ 4.32Å; D389-F402 CarbonylContact C-O 3.18Å; D389-F402 WeakPolarHBondContact CA-O 3.2Å; F390-F402 HydrophobicContact CB-CB 4.35Å; F390-F402 AromaticContact CD1-CD2 3.8Å; F390-F402 HydrophobicContact CD1-CD2 3.8Å; F390-F402 HydrophobicContact CD1-CE2 4.47Å; F390-F402 PolarHBondContact N-O 2.93Å; F390-F402 WeakPolarHBondContact O-CD2 3.48Å; F390-F402 PolarHBondContact O-N 3.38Å; V392-F402 HydrophobicContact CG2-CE2 4.14Å; H400-F402 HydrophobicContact CB-CE2 4.16Å; H400-F402 HydrophobicContact CB-CZ 4.4Å; F402-I405 HydrophobicContact CB-CD1 4.24Å
403	T	93.4	Very high	91.1	Very high	39 Å²	39	54.8 Å²	54.8	24%	0.239	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	168.7	-173.5	65.4	0	0	0	0	112.3	S343 D389 T401 I405	S343-T403 WeakPolarHBondContact CB-OG1 3.47Å; S343-T403 PolarHBondContact N-O 3.26Å; S343-T403 PolarHBondContact O-N 3.4Å; S343-T403 PolarHBondContact O-OG1 2.74Å; D389-T403 HydrophobicContact CB-CG2 4.39Å; D389-T403 WeakPolarHBondContact OD1-CA 3.26Å; D389-T403 VanDerWaalsContact OD1-CB 3.25Å; D389-T403 WeakPolarHBondContact OD1-CB 3.48Å; T401-T403 HydrophobicContact CG2-CG2 3.77Å; T403-I405 VanDerWaalsContact C-N 3.31Å; T403-I405 PolarHBondContact O-N 2.99Å
404	S	89.1	Confident	91	Very high	63 Å²	63	53.5 Å²	53.5	44%	0.441	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.3	33	173.2	-45.2	0	0	0	0	114.2	D389	D389-S404 PolarHBondContact OD1-N 3.23Å
405	I	92.1	Very high	90.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.4	173.9	-59.8	169	0	0	0	108.8	V340 C342 S387 F388 F390 F402 T403 E409 L413	V340-I405 HydrophobicContact CG1-CB 4.47Å; V340-I405 HydrophobicContact CG1-CG1 4.28Å; V340-I405 HydrophobicContact CG1-CG2 3.46Å; V340-I405 VanDerWaalsContact CG1-CG2 3.46Å; C342-I405 HydrophobicContact CB-CD1 4.19Å; C342-I405 HydrophobicContact CB-CG1 3.51Å; S387-I405 CarbonylContact C-O 3.48Å; S387-I405 WeakPolarHBondContact CA-O 3.42Å; S387-I405 WeakPolarHBondContact CB-O 3.43Å; F388-I405 HydrophobicContact CD1-CB 4.17Å; F388-I405 HydrophobicContact CD1-CG2 4.15Å; F388-I405 HydrophobicContact CD2-CB 4.49Å; F388-I405 HydrophobicContact CE1-CB 3.86Å; F388-I405 HydrophobicContact CE1-CG2 3.37Å; F388-I405 HydrophobicContact CE2-CB 4.18Å; F388-I405 HydrophobicContact CE2-CD1 3.99Å; F388-I405 HydrophobicContact CE2-CG2 4.15Å; F388-I405 HydrophobicContact CG-CB 4.49Å; F388-I405 HydrophobicContact CZ-CB 3.86Å; F388-I405 HydrophobicContact CZ-CD1 4.23Å; F388-I405 HydrophobicContact CZ-CG2 3.37Å; F388-I405 PolarHBondContact N-O 3.43Å; F388-I405 PolarHBondContact O-N 2.99Å; F388-I405 VanDerWaalsContact O-N 3.12Å; F390-I405 HydrophobicContact CB-CD1 3.57Å; F402-I405 HydrophobicContact CB-CD1 4.24Å; T403-I405 VanDerWaalsContact C-N 3.31Å; T403-I405 PolarHBondContact O-N 2.99Å; I405-E409 HydrophobicContact CG2-CB 3.83Å; I405-E409 HydrophobicContact CG2-CG 4.46Å; I405-L413 HydrophobicContact CD1-CD2 4.49Å
406	E	90	Very high	91.1	Very high	116 Å²	116	48 Å²	48	54%	0.542	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.2	177.3	-65.8	-171.3	-179.1	0	0	111.9	F388 D408 E409	F388-E406 WeakPolarHBondContact CE1-O 3.34Å; E406-D408 PolarHBondContact O-N 3.46Å; E406-D408 VanDerWaalsContact O-N 3.12Å; E406-E409 HydrophobicContact CB-CG 4.49Å; E406-E409 WeakPolarHBondContact O-CB 3.43Å; E406-E409 PolarHBondContact O-N 3.19Å
407	R	85.5	Confident	91.3	Very high	29 Å²	29	42.6 Å²	42.6	11%	0.109	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-55.5	-32.8	-178	-172.5	175.6	-177	142.8	-3.7	114.2	R386 E409 Y410 Y451	R386-R407 HydrophobicContact CB-CB 4.33Å; R386-R407 WeakPolarHBondContact O-CB 3.39Å; R386-R407 PolarHBondContact O-N 2.95Å; R407-E409 PolarHBondContact O-N 3.39Å; R407-Y410 WeakPolarHBondContact O-CB 3.38Å; R407-Y410 PolarHBondContact O-N 3.23Å; R407-Y451 PolarHBondContact NH2-O 3.19Å
408	D	87.9	Confident	91.5	Very high	79 Å²	79	42.6 Å²	42.6	42%	0.422	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-70.5	-15.5	-177.7	-61	-10.7	0	0	0	112.7	K334 E406 Y410 H412	K334-D408 HydrophobicContact CD-CB 3.62Å; K334-D408 VanDerWaalsContact CE-OD2 3.29Å; K334-D408 WeakPolarHBondContact CE-OD2 3.38Å; K334-D408 HydrophobicContact CG-CB 4.32Å; K334-D408 IonicContact NZ-OD2 3.72Å; K334-D408 PolarHBondContact NZ-OD2 3.08Å; E406-D408 PolarHBondContact O-N 3.46Å; E406-D408 VanDerWaalsContact O-N 3.12Å; D408-Y410 VanDerWaalsContact C-N 3.32Å; D408-H412 PolarHBondContact O-ND1 3.12Å; D408-H412 VanDerWaalsContact O-ND1 3.11Å
409	E	90.5	Very high	91.6	Very high	22 Å²	22	41.8 Å²	41.8	10%	0.103	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-84.4	-7.8	172.9	-61.3	-69.6	178.1	0	0	112.4	A333 K334 V340 I405 E406 R407 L413	A333-E409 WeakPolarHBondContact CA-OE2 3.5Å; A333-E409 WeakPolarHBondContact CB-OE2 3.48Å; K334-E409 VanDerWaalsContact CB-OE1 3.26Å; K334-E409 WeakPolarHBondContact CB-OE1 3.19Å; K334-E409 PolarHBondContact N-OE1 2.95Å; K334-E409 PolarHBondContact N-OE2 3.34Å; V340-E409 HydrophobicContact CG1-CB 4.09Å; V340-E409 HydrophobicContact CG1-CG 4.1Å; I405-E409 HydrophobicContact CG2-CB 3.83Å; I405-E409 HydrophobicContact CG2-CG 4.46Å; E406-E409 HydrophobicContact CB-CG 4.49Å; E406-E409 WeakPolarHBondContact O-CB 3.43Å; E406-E409 PolarHBondContact O-N 3.19Å; R407-E409 PolarHBondContact O-N 3.39Å; E409-L413 WeakPolarHBondContact O-CB 3.19Å; E409-L413 PolarHBondContact O-N 3.13Å
410	Y	89.5	Confident	91.6	Very high	16 Å²	16	40.7 Å²	40.7	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-53.2	-176.1	178.6	-97.5	0	0	0	112.1	F378 F388 R407 D408 L413 Y414 V455	F378-Y410 HydrophobicContact CB-CE2 3.76Å; F378-Y410 AromaticContact CD1-CD2 3.91Å; F378-Y410 HydrophobicContact CD1-CD2 3.91Å; F378-Y410 AromaticContact CD1-CE2 3.64Å; F378-Y410 HydrophobicContact CD1-CE2 3.64Å; F378-Y410 HydrophobicContact CE1-CD2 4.45Å; F378-Y410 HydrophobicContact CE1-CE2 4.35Å; F378-Y410 HydrophobicContact CG-CD2 4.49Å; F378-Y410 AromaticContact CG-CE2 3.78Å; F378-Y410 HydrophobicContact CG-CE2 3.78Å; F388-Y410 HydrophobicContact CD1-CD2 4.23Å; F388-Y410 HydrophobicContact CD2-CD2 4.24Å; F388-Y410 HydrophobicContact CE1-CD2 4.21Å; F388-Y410 HydrophobicContact CE1-CG 4.48Å; F388-Y410 HydrophobicContact CE2-CD2 4.25Å; F388-Y410 HydrophobicContact CG-CD2 4.23Å; F388-Y410 HydrophobicContact CZ-CD2 4.22Å; R407-Y410 WeakPolarHBondContact O-CB 3.38Å; R407-Y410 PolarHBondContact O-N 3.23Å; D408-Y410 VanDerWaalsContact C-N 3.32Å; Y410-L413 PolarHBondContact O-N 3.42Å; Y410-Y414 WeakPolarHBondContact O-CB 3.47Å; Y410-Y414 PolarHBondContact O-N 2.95Å; Y410-V455 HydrophobicContact CD1-CG1 3.9Å; Y410-V455 HydrophobicContact CE1-CG1 4.14Å
411	H	90.4	Very high	91.4	Very high	51 Å²	51	48.7 Å²	48.7	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-47.9	-178.1	-64.8	-73.4	0	0	0	111.3	L413 Y414 D415	H411-L413 VanDerWaalsContact C-N 3.3Å; H411-L413 PolarHBondContact O-N 2.99Å; H411-Y414 PolarHBondContact O-N 3.3Å; H411-D415 WeakPolarHBondContact O-CB 3.39Å; H411-D415 PolarHBondContact O-N 3.05Å
412	H	92.1	Very high	91.3	Very high	70 Å²	70	47.4 Å²	47.4	32%	0.324	25%	0.248	S	C	.	.	H	α-helix	trans	-55.6	-44.4	177.7	-60	92.6	0	0	0	112.5	F331 S332 D408 F416	F331-H412 HydrophobicContact CE2-CB 4.12Å; F331-H412 HydrophobicContact CZ-CB 4.32Å; S332-H412 PolarHBondContact O-CD2 3.47Å; D408-H412 PolarHBondContact O-ND1 3.12Å; D408-H412 VanDerWaalsContact O-ND1 3.11Å; H412-F416 WeakPolarHBondContact O-CB 3.26Å; H412-F416 PolarHBondContact O-N 3.04Å
413	L	92.4	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-73.8	-38.2	179.6	-170	60.6	0	0	0	112.2	F331 P353 F358 F378 F388 F390 I405 E409 Y410 H411 F416 V417	F331-L413 HydrophobicContact CE2-CD1 4.45Å; P353-L413 HydrophobicContact CG-CD1 4.01Å; F358-L413 HydrophobicContact CE1-CD1 4.21Å; F378-L413 HydrophobicContact CE1-CB 4.33Å; F378-L413 HydrophobicContact CE1-CD2 3.95Å; F378-L413 HydrophobicContact CE1-CG 4.04Å; F378-L413 HydrophobicContact CZ-CG 4.33Å; F388-L413 HydrophobicContact CE2-CD2 4.2Å; F388-L413 HydrophobicContact CZ-CD2 4.23Å; F390-L413 HydrophobicContact CB-CD2 4.18Å; F390-L413 HydrophobicContact CD1-CD2 4.03Å; F390-L413 HydrophobicContact CD2-CD2 3.81Å; F390-L413 HydrophobicContact CE1-CD2 4.34Å; F390-L413 HydrophobicContact CE2-CD2 4.14Å; F390-L413 HydrophobicContact CE2-CG 4.41Å; F390-L413 HydrophobicContact CG-CD2 3.75Å; F390-L413 HydrophobicContact CZ-CD2 4.39Å; I405-L413 HydrophobicContact CD1-CD2 4.49Å; E409-L413 WeakPolarHBondContact O-CB 3.19Å; E409-L413 PolarHBondContact O-N 3.13Å; Y410-L413 PolarHBondContact O-N 3.42Å; H411-L413 VanDerWaalsContact C-N 3.3Å; H411-L413 PolarHBondContact O-N 2.99Å; L413-F416 PolarHBondContact O-N 2.82Å; L413-V417 WeakPolarHBondContact O-CB 3.19Å; L413-V417 WeakPolarHBondContact O-CG2 3.02Å; L413-V417 PolarHBondContact O-N 3.02Å
414	Y	92	Very high	90.9	Very high	26 Å²	26	53.1 Å²	53.1	10%	0.102	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-47.3	177.3	-178.2	-90.8	0	0	0	111.9	F378 Y410 H411 F416 V417 T418 I427	F378-Y414 HydrophobicContact CD2-CD2 4.45Å; F378-Y414 HydrophobicContact CE2-CD2 4.02Å; F378-Y414 HydrophobicContact CZ-CD2 4.38Å; Y410-Y414 WeakPolarHBondContact O-CB 3.47Å; Y410-Y414 PolarHBondContact O-N 2.95Å; H411-Y414 PolarHBondContact O-N 3.3Å; Y414-F416 VanDerWaalsContact C-N 3.29Å; Y414-F416 PolarHBondContact O-N 3.37Å; Y414-V417 PolarHBondContact O-N 3.16Å; Y414-T418 WeakPolarHBondContact O-CB 3.43Å; Y414-T418 PolarHBondContact O-N 2.86Å; Y414-T418 PolarHBondContact O-OG1 3.19Å; Y414-I427 HydrophobicContact CE2-CD1 3.85Å; Y414-I427 WeakPolarHBondContact OH-CD1 3.38Å
415	D	92.1	Very high	90.7	Very high	70 Å²	70	53.5 Å²	53.5	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-61.1	-42.4	177.7	-63.8	-12.9	0	0	0	110.1	H411 T418 A419	H411-D415 WeakPolarHBondContact O-CB 3.39Å; H411-D415 PolarHBondContact O-N 3.05Å; D415-T418 PolarHBondContact O-N 3.48Å; D415-A419 VanDerWaalsContact O-CB 3.22Å; D415-A419 WeakPolarHBondContact O-CB 3.27Å; D415-A419 PolarHBondContact O-N 3.41Å
416	F	93.3	Very high	89.6	Confident	11 Å²	11	55.7 Å²	55.7	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-46.7	176.3	-179.7	-93	0	0	0	113	F331 P353 L354 F358 F370 H412 L413 Y414 T418 A419 K420	F331-F416 HydrophobicContact CB-CD2 3.77Å; F331-F416 HydrophobicContact CB-CE2 3.84Å; F331-F416 HydrophobicContact CB-CG 4.49Å; F331-F416 HydrophobicContact CD2-CB 3.77Å; F331-F416 AromaticContact CD2-CD2 3.84Å; F331-F416 HydrophobicContact CD2-CD2 3.84Å; F331-F416 AromaticContact CD2-CG 3.78Å; F331-F416 HydrophobicContact CD2-CG 3.78Å; F331-F416 HydrophobicContact CE2-CB 4.25Å; F331-F416 HydrophobicContact CG-CD2 4.27Å; P353-F416 HydrophobicContact CB-CD1 3.75Å; P353-F416 HydrophobicContact CB-CE1 3.43Å; P353-F416 VanDerWaalsContact CB-CE1 3.43Å; P353-F416 HydrophobicContact CB-CE2 4.23Å; P353-F416 HydrophobicContact CB-CG 4.28Å; P353-F416 HydrophobicContact CB-CZ 3.69Å; L354-F416 WeakPolarHBondContact O-CZ 3.35Å; F358-F416 HydrophobicContact CE1-CD1 4.34Å; F358-F416 HydrophobicContact CE1-CE1 4.09Å; F358-F416 HydrophobicContact CZ-CD1 4.48Å; F358-F416 HydrophobicContact CZ-CE1 4.28Å; F370-F416 AromaticContact CZ-CE1 3.82Å; F370-F416 HydrophobicContact CZ-CE1 3.82Å; F370-F416 HydrophobicContact CZ-CZ 4.06Å; H412-F416 WeakPolarHBondContact O-CB 3.26Å; H412-F416 PolarHBondContact O-N 3.04Å; L413-F416 PolarHBondContact O-N 2.82Å; Y414-F416 VanDerWaalsContact C-N 3.29Å; Y414-F416 PolarHBondContact O-N 3.37Å; F416-T418 VanDerWaalsContact C-N 3.31Å; F416-T418 PolarHBondContact O-N 2.78Å; F416-A419 PolarHBondContact O-N 3.48Å; F416-K420 HydrophobicContact CD1-CG 4.39Å; F416-K420 HydrophobicContact CE1-CG 3.95Å; F416-K420 HydrophobicContact CE2-CG 4.28Å; F416-K420 HydrophobicContact CZ-CG 3.9Å; F416-K420 WeakPolarHBondContact O-CB 3.39Å; F416-K420 WeakPolarHBondContact O-CG 3.4Å; F416-K420 PolarHBondContact O-N 2.82Å
417	V	92.8	Very high	88.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-42.5	177.8	163.2	0	0	0	0	110.8	F358 V376 F378 F390 L413 Y414 K420 K421 L422 V424	F358-V417 HydrophobicContact CZ-CG2 4.13Å; V376-V417 HydrophobicContact CG2-CG1 3.41Å; V376-V417 VanDerWaalsContact CG2-CG1 3.41Å; V376-V417 HydrophobicContact CG2-CG2 4.36Å; F378-V417 HydrophobicContact CZ-CG2 4.22Å; F390-V417 HydrophobicContact CE2-CG2 4.14Å; F390-V417 HydrophobicContact CZ-CG2 4.12Å; L413-V417 WeakPolarHBondContact O-CB 3.19Å; L413-V417 WeakPolarHBondContact O-CG2 3.02Å; L413-V417 PolarHBondContact O-N 3.02Å; Y414-V417 PolarHBondContact O-N 3.16Å; V417-K420 CarbonylContact O-C 3.58Å; V417-K420 PolarHBondContact O-N 2.83Å; V417-K421 PolarHBondContact O-N 2.79Å; V417-L422 HydrophobicContact CG1-CB 3.78Å; V417-L422 HydrophobicContact CG1-CD1 4.43Å; V417-L422 HydrophobicContact CG2-CD1 4.42Å; V417-L422 PolarHBondContact O-N 2.8Å; V417-V424 HydrophobicContact CG1-CG2 3.65Å
418	T	91.6	Very high	86	Confident	62 Å²	62	58.2 Å²	58.2	38%	0.38	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-45.9	178.5	-55.9	0	0	0	0	111	Y414 D415 F416 K420 K421	Y414-T418 WeakPolarHBondContact O-CB 3.43Å; Y414-T418 PolarHBondContact O-N 2.86Å; Y414-T418 PolarHBondContact O-OG1 3.19Å; D415-T418 PolarHBondContact O-N 3.48Å; F416-T418 VanDerWaalsContact C-N 3.31Å; F416-T418 PolarHBondContact O-N 2.78Å; T418-K420 VanDerWaalsContact C-N 3.25Å; T418-K420 PolarHBondContact O-N 3.18Å; T418-K421 WeakPolarHBondContact O-CA 3.26Å; T418-K421 PolarHBondContact O-N 3.3Å
419	A	92.7	Very high	83.7	Confident	79 Å²	79	59.6 Å²	59.6	65%	0.653	32%	0.315	S	S	*	.	H	α-helix	trans	-60	-34.6	175.2	0	0	0	0	0	112.5	D415 F416 K421	D415-A419 VanDerWaalsContact O-CB 3.22Å; D415-A419 WeakPolarHBondContact O-CB 3.27Å; D415-A419 PolarHBondContact O-N 3.41Å; F416-A419 PolarHBondContact O-N 3.48Å; A419-K421 PolarHBondContact O-N 3.28Å
420	K	92.6	Very high	81.1	Confident	49 Å²	49	66.1 Å²	66.1	21%	0.213	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4.3	173.8	-63.8	-54.9	-174.7	-161.2	0	114	E355 F370 F416 V417 T418 L422	E355-K420 IonicContact OE1-NZ 2.86Å; E355-K420 PolarHBondContact OE1-NZ 2.97Å; E355-K420 IonicContact OE2-NZ 2.72Å; E355-K420 PolarHBondContact OE2-NZ 2.77Å; F370-K420 HydrophobicContact CE2-CB 4.1Å; F370-K420 HydrophobicContact CE2-CD 4Å; F370-K420 HydrophobicContact CE2-CG 3.74Å; F370-K420 HydrophobicContact CZ-CG 4.17Å; F416-K420 HydrophobicContact CD1-CG 4.39Å; F416-K420 HydrophobicContact CE1-CG 3.95Å; F416-K420 HydrophobicContact CE2-CG 4.28Å; F416-K420 HydrophobicContact CZ-CG 3.9Å; F416-K420 WeakPolarHBondContact O-CB 3.39Å; F416-K420 WeakPolarHBondContact O-CG 3.4Å; F416-K420 PolarHBondContact O-N 2.82Å; V417-K420 CarbonylContact O-C 3.58Å; V417-K420 PolarHBondContact O-N 2.83Å; T418-K420 VanDerWaalsContact C-N 3.25Å; T418-K420 PolarHBondContact O-N 3.18Å; K420-L422 HydrophobicContact CB-CD1 4.48Å; K420-L422 HydrophobicContact CB-CG 4.18Å; K420-L422 PolarHBondContact O-N 2.84Å
421	K	90.4	Very high	78.4	Confident	192 Å²	192	73.2 Å²	73.2	84%	0.835	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	33.9	178.2	-54	-175.8	179.6	-173.2	0	113.2	V417 T418 A419	V417-K421 PolarHBondContact O-N 2.79Å; T418-K421 WeakPolarHBondContact O-CA 3.26Å; T418-K421 PolarHBondContact O-N 3.3Å; A419-K421 PolarHBondContact O-N 3.28Å
422	L	91.4	Very high	75.7	Confident	21 Å²	21	79.7 Å²	79.7	11%	0.11	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-80.9	136.6	175.1	-63.4	178.2	0	0	0	109.7	F358 F370 I373 V417 K420 V424	F358-L422 HydrophobicContact CE2-CD1 3.87Å; F358-L422 HydrophobicContact CZ-CD1 4.12Å; F370-L422 HydrophobicContact CB-CD2 4.17Å; F370-L422 HydrophobicContact CD1-CD1 4.08Å; F370-L422 HydrophobicContact CD1-CD2 4.33Å; F370-L422 HydrophobicContact CE1-CD1 4.09Å; F370-L422 HydrophobicContact CG-CD2 4.23Å; I373-L422 HydrophobicContact CD1-CD1 4.36Å; V417-L422 HydrophobicContact CG1-CB 3.78Å; V417-L422 HydrophobicContact CG1-CD1 4.43Å; V417-L422 HydrophobicContact CG2-CD1 4.42Å; V417-L422 PolarHBondContact O-N 2.8Å; K420-L422 HydrophobicContact CB-CD1 4.48Å; K420-L422 HydrophobicContact CB-CG 4.18Å; K420-L422 PolarHBondContact O-N 2.84Å; L422-V424 PolarHBondContact O-N 2.83Å
423	R	89.9	Confident	72.7	Confident	138 Å²	138	83.3 Å²	83.3	52%	0.521	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-69.4	124.3	-178.7	-173.6	175.7	70.5	108.3	-3.4	111.1	V374 A375 V376	V374-R423 PolarHBondContact O-NE 2.91Å; V374-R423 PolarHBondContact O-NH2 3.46Å; A375-R423 CarbonylContact C-O 3.54Å; A375-R423 WeakPolarHBondContact CA-O 3.36Å; A375-R423 HydrophobicContact CB-CB 4.37Å; A375-R423 HydrophobicContact CB-CG 4.49Å; A375-R423 WeakPolarHBondContact CB-O 3.45Å; V376-R423 PolarHBondContact N-O 2.83Å
424	V	90.1	Very high	69.7	Low	21 Å²	21	89.1 Å²	89.1	13%	0.127	48%	0.475	C	S	.	.	B	Isolated β-bridge	trans	-102.2	120.9	176.4	-174.5	0	0	0	0	110.1	V376 F378 V417 L422 N426 I427	V376-V424 HydrophobicContact CG2-CG2 3.92Å; V376-V424 WeakPolarHBondContact O-CA 3.33Å; F378-V424 HydrophobicContact CD2-CG1 3.95Å; F378-V424 HydrophobicContact CE2-CG1 4.14Å; F378-V424 HydrophobicContact CE2-CG2 4.43Å; V417-V424 HydrophobicContact CG1-CG2 3.65Å; L422-V424 PolarHBondContact O-N 2.83Å; V424-N426 PolarHBondContact O-N 3.4Å; V424-I427 HydrophobicContact CB-CD1 3.8Å; V424-I427 HydrophobicContact CB-CG1 4.43Å; V424-I427 HydrophobicContact CG1-CD1 3.93Å; V424-I427 HydrophobicContact CG1-CG1 4.16Å; V424-I427 HydrophobicContact CG2-CD1 4.41Å
425	K	85.4	Confident	67	Low	71 Å²	71	95 Å²	95	31%	0.309	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-69.1	-26.6	-177.1	-82.5	-179.8	179.9	177.7	0	114.4	A375 V376 Q377 E393 I427	A375-K425 HydrophobicContact CB-CD 4.2Å; A375-K425 HydrophobicContact CB-CG 3.81Å; V376-K425 PolarHBondContact O-N 2.84Å; Q377-K425 HydrophobicContact CB-CB 4.42Å; E393-K425 IonicContact OE1-NZ 3.05Å; E393-K425 PolarHBondContact OE1-NZ 3.26Å; E393-K425 VanDerWaalsContact OE1-NZ 3.14Å; E393-K425 WeakPolarHBondContact OE2-CE 2.8Å; E393-K425 IonicContact OE2-NZ 3.68Å; E393-K425 PolarHBondContact OE2-NZ 3.47Å; K425-I427 PolarHBondContact O-N 3.23Å
426	N	69.9	Low	64	Low	46 Å²	46	98.2 Å²	98.2	25%	0.246	53%	0.532	C	S	.	.	G	3₁₀ helix	trans	-89.4	9.1	-165.9	-73.1	-0.6	0	0	0	116	F378 V424	F378-N426 VanDerWaalsContact C-ND2 3.34Å; F378-N426 PolarHBondContact N-ND2 2.84Å; F378-N426 PolarHBondContact O-ND2 2.91Å; V424-N426 PolarHBondContact O-N 3.4Å
427	I	58.8	Low	61.4	Low	93 Å²	93	100.9 Å²	100.9	48%	0.477	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-102.4	-15.2	-177.2	-60.9	166.5	0	0	0	111.8	Y414 V424 K425	Y414-I427 HydrophobicContact CE2-CD1 3.85Å; Y414-I427 WeakPolarHBondContact OH-CD1 3.38Å; V424-I427 HydrophobicContact CB-CD1 3.8Å; V424-I427 HydrophobicContact CB-CG1 4.43Å; V424-I427 HydrophobicContact CG1-CD1 3.93Å; V424-I427 HydrophobicContact CG1-CG1 4.16Å; V424-I427 HydrophobicContact CG2-CD1 4.41Å; K425-I427 PolarHBondContact O-N 3.23Å
428	S	40.4	Very low	58.6	Low	106 Å²	106	108.1 Å²	108.1	74%	0.741	60%	0.602	S	S	*	*			trans	-105.5	30.2	-166.9	64.1	0	0	0	0	116
429	S	39.1	Very low	55.9	Low	107 Å²	107	112.4 Å²	112.4	75%	0.748	62%	0.623	S	S	*	*	S	Bend	trans	-106	10.6	-178.5	44.4	0	0	0	0	116.3
430	E	37.4	Very low	53.3	Low	160 Å²	160	115.6 Å²	115.6	75%	0.748	63%	0.634	S	S	*	*	S	Bend	trans	-120.9	5	-179.4	-70.7	-171.4	127.2	0	0	116.4
431	N	31.8	Very low	50.5	Low	165 Å²	165	124.7 Å²	124.7	88%	0.882	67%	0.667	S	S	*	*			trans	-107.9	24	-179.4	-107.1	6.5	0	0	0	115.3
432	K	33.1	Very low	47.7	Very low	186 Å²	186	121.2 Å²	121.2	81%	0.809	67%	0.667	S	S	*	*			trans	-92.6	99.6	163.1	-89.7	-175.8	176.8	178.7	0	109.1	T434	K432-T434 PolarHBondContact O-N 3.06Å
433	T	29.3	Very low	44.9	Very low	146 Å²	146	125.4 Å²	125.4	90%	0.896	70%	0.698	S	S	*	*			trans	-44.3	97.9	157.5	26	0	0	0	0	110.6
434	T	30	Very low	42.4	Very low	122 Å²	122	123.6 Å²	123.6	75%	0.748	71%	0.707	S	S	*	*			trans	-112.3	120.5	169	43.7	0	0	0	0	108.9	K432	K432-T434 PolarHBondContact O-N 3.06Å
435	N	34.3	Very low	39.8	Very low	151 Å²	151	130.6 Å²	130.6	81%	0.807	74%	0.743	S	S	*	*			trans	-49.9	142.4	179.9	-76.3	-27.8	0	0	0	112.3	G437	N435-G437 PolarHBondContact O-N 3.27Å
436	P	30.1	Very low	37.7	Very low	136 Å²	136	136.1 Å²	136.1	88%	0.883	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	96.9	171.9	30.3	-29.2	0	0	0	108.2
437	G	39.2	Very low	36.5	Very low	68 Å²	68	139 Å²	139	70%	0.701	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172.2	-28.5	-179.3	0	0	0	0	0	117.5	N435	N435-G437 PolarHBondContact O-N 3.27Å
438	D	32.8	Very low	36.2	Very low	152 Å²	152	141 Å²	141	81%	0.813	80%	0.8	S	S	*	*			trans	-123	141.4	-170.7	-71.7	-40	0	0	0	112.5
439	D	34.9	Very low	37.1	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	78%	0.777	S	S	*	*			trans	93.2	64	167	-58.4	-29.4	0	0	0	119.4	W441	D439-W441 PolarHBondContact O-N 2.82Å; D439-W441 VanDerWaalsContact O-N 3.12Å
440	V	38.3	Very low	38.3	Very low	147 Å²	147	136.2 Å²	136.2	89%	0.891	77%	0.768	S	S	*	*	S	Bend	trans	-70	69.5	145.8	-175.9	0	0	0	0	109.8
441	W	33.7	Very low	39.4	Very low	240 Å²	240	134 Å²	134	91%	0.909	75%	0.753	S	S	*	*			trans	169.9	98.6	153.6	-121.2	-41.3	0	0	0	110.5	D439	D439-W441 PolarHBondContact O-N 2.82Å; D439-W441 VanDerWaalsContact O-N 3.12Å
442	S	32.6	Very low	40.9	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	72%	0.719	S	S	*	*			trans	-157.8	111.7	149.2	-167.4	0	0	0	0	109.7
443	S	31.7	Very low	42.5	Very low	109 Å²	109	122.7 Å²	122.7	76%	0.762	70%	0.698	S	S	*	*			trans	-91.5	120.4	173.6	65.5	0	0	0	0	109.6
444	S	37	Very low	44.6	Very low	100 Å²	100	121.2 Å²	121.2	70%	0.699	68%	0.679	S	S	*	*			trans	179.6	95.4	144.5	55.7	0	0	0	0	110.9	E446	S444-E446 PolarHBondContact O-N 2.65Å
445	D	36.9	Very low	46.6	Very low	167 Å²	167	115.6 Å²	115.6	89%	0.893	65%	0.645	S	S	*	*				35.3	56.2	129.8	-150.2	28	0	0	0	119.3
446	E	39.8	Very low	48.4	Very low	188 Å²	188	112.5 Å²	112.5	88%	0.879	62%	0.624	S	S	*	*			trans	-104.1	97.1	158.6	-85.6	-172	127.3	0	0	109	S444 H448	S444-E446 PolarHBondContact O-N 2.65Å; E446-H448 PolarHBondContact O-N 3.37Å
447	S	46.4	Very low	50.3	Low	105 Å²	105	109 Å²	109	73%	0.734	60%	0.601	S	S	*	*			trans	-66.7	102.1	173.1	63.9	0	0	0	0	110	D449	S447-D449 PolarHBondContact O-N 3.14Å; S447-D449 VanDerWaalsContact O-N 3.16Å
448	H	52.2	Low	51.8	Low	135 Å²	135	109.8 Å²	109.8	63%	0.625	59%	0.586	S	S	*	*			trans	-53.7	106.7	171.2	-176.7	76.2	0	0	0	110.9	E446 A450 E453	E446-H448 PolarHBondContact O-N 3.37Å; H448-A450 PolarHBondContact O-N 3.34Å; H448-E453 IonicContact CE1-OE1 3.27Å; H448-E453 PolarHBondContact CE1-OE1 3.33Å; H448-E453 IonicContact CE1-OE2 2.87Å; H448-E453 PolarHBondContact CE1-OE2 3.06Å; H448-E453 IonicContact ND1-OE1 2.75Å; H448-E453 PolarHBondContact ND1-OE1 3.03Å; H448-E453 IonicContact ND1-OE2 3.64Å; H448-E453 IonicContact NE2-OE2 2.85Å; H448-E453 PolarHBondContact NE2-OE2 3.43Å
449	D	58.5	Low	53.4	Low	48 Å²	48	102.8 Å²	102.8	26%	0.257	55%	0.549	S	S	.	.			trans	-85.9	90.9	175.5	-172.7	-19	0	0	0	109.6	R380 S447 Y451 M452 E453	R380-D449 IonicContact CZ-OD2 3.54Å; R380-D449 IonicContact NH1-OD2 3.55Å; R380-D449 PolarHBondContact NH1-OD2 2.75Å; R380-D449 IonicContact NH2-OD2 3.87Å; R380-D449 PolarHBondContact NH2-OD2 2.92Å; S447-D449 PolarHBondContact O-N 3.14Å; S447-D449 VanDerWaalsContact O-N 3.16Å; D449-Y451 PolarHBondContact O-N 3.48Å; D449-Y451 VanDerWaalsContact OD1-CB 3.3Å; D449-Y451 WeakPolarHBondContact OD1-CB 3.5Å; D449-Y451 PolarHBondContact OD1-N 3.22Å; D449-M452 HydrophobicContact CB-CB 4.46Å; D449-M452 PolarHBondContact O-N 3.38Å; D449-E453 PolarHBondContact O-N 3.41Å
450	A	64.1	Low	55.2	Low	66 Å²	66	103 Å²	103	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-49.1	-24.8	177.5	0	0	0	0	0	113.6	H448 K454	H448-A450 PolarHBondContact O-N 3.34Å; A450-K454 VanDerWaalsContact O-CB 3.3Å; A450-K454 WeakPolarHBondContact O-CB 3.42Å; A450-K454 PolarHBondContact O-N 3.41Å
451	Y	61.5	Low	56.7	Low	114 Å²	114	101.5 Å²	101.5	45%	0.447	52%	0.522	S	S	.	.	H	α-helix	trans	-78.7	-34.1	178.9	-177.8	-129.8	0	0	0	112.5	R407 D449 K454 V455	R407-Y451 PolarHBondContact NH2-O 3.19Å; D449-Y451 PolarHBondContact O-N 3.48Å; D449-Y451 VanDerWaalsContact OD1-CB 3.3Å; D449-Y451 WeakPolarHBondContact OD1-CB 3.5Å; D449-Y451 PolarHBondContact OD1-N 3.22Å; Y451-K454 PolarHBondContact O-N 3.37Å; Y451-V455 HydrophobicContact CE2-CG2 4.18Å; Y451-V455 WeakPolarHBondContact O-CG2 3.1Å; Y451-V455 PolarHBondContact O-N 3.38Å
452	M	61.6	Low	58.2	Low	34 Å²	34	97.3 Å²	97.3	17%	0.167	51%	0.506	C	S	.	.	H	α-helix	trans	-70.4	-36.9	174.1	-91	-69.7	-62	0	0	111.7	D449 V455 K456	D449-M452 HydrophobicContact CB-CB 4.46Å; D449-M452 PolarHBondContact O-N 3.38Å; M452-V455 PolarHBondContact O-N 3.26Å; M452-K456 WeakPolarHBondContact O-CG 3.42Å; M452-K456 PolarHBondContact O-N 3.05Å
453	E	68.4	Low	59.5	Low	78 Å²	78	94 Å²	94	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-44.1	170.9	-78.4	-176.8	-175	0	0	111.5	H448 D449 V455 K456 T457	H448-E453 IonicContact CE1-OE1 3.27Å; H448-E453 PolarHBondContact CE1-OE1 3.33Å; H448-E453 IonicContact CE1-OE2 2.87Å; H448-E453 PolarHBondContact CE1-OE2 3.06Å; H448-E453 IonicContact ND1-OE1 2.75Å; H448-E453 PolarHBondContact ND1-OE1 3.03Å; H448-E453 IonicContact ND1-OE2 3.64Å; H448-E453 IonicContact NE2-OE2 2.85Å; H448-E453 PolarHBondContact NE2-OE2 3.43Å; D449-E453 PolarHBondContact O-N 3.41Å; E453-V455 PolarHBondContact O-N 3.08Å; E453-K456 CarbonylContact O-C 3.49Å; E453-K456 WeakPolarHBondContact O-CB 3.21Å; E453-K456 PolarHBondContact O-N 3.46Å; E453-T457 WeakPolarHBondContact O-CG2 3.38Å; E453-T457 PolarHBondContact O-N 3.22Å; E453-T457 PolarHBondContact O-OG1 3.18Å; E453-T457 VanDerWaalsContact O-OG1 3.09Å
454	K	73.6	Confident	60.8	Low	115 Å²	115	92.2 Å²	92.2	50%	0.5	47%	0.465	S	S	.	.	H	α-helix	trans	-54.5	-41.4	173.6	-172.5	171.6	177.2	175.6	0	112.8	A450 Y451 T457 E458	A450-K454 VanDerWaalsContact O-CB 3.3Å; A450-K454 WeakPolarHBondContact O-CB 3.42Å; A450-K454 PolarHBondContact O-N 3.41Å; Y451-K454 PolarHBondContact O-N 3.37Å; K454-T457 VanDerWaalsContact CA-OG1 3.28Å; K454-T457 WeakPolarHBondContact CA-OG1 3.43Å; K454-T457 PolarHBondContact O-N 2.89Å; K454-T457 PolarHBondContact O-OG1 3Å; K454-E458 WeakPolarHBondContact CE-OE1 3.38Å; K454-E458 HydrophobicContact CG-CG 4.4Å; K454-E458 VanDerWaalsContact O-CB 3.29Å; K454-E458 WeakPolarHBondContact O-CB 3.44Å; K454-E458 VanDerWaalsContact O-CG 3.23Å; K454-E458 WeakPolarHBondContact O-CG 3.25Å; K454-E458 PolarHBondContact O-N 3.23Å
455	V	71.2	Confident	61.7	Low	5 Å²	5	94.5 Å²	94.5	3%	0.03	47%	0.465	C	S	.	.	H	α-helix	trans	-70.1	-35.7	177.5	163.3	0	0	0	0	112.5	Y410 Y451 M452 E453 A459	Y410-V455 HydrophobicContact CD1-CG1 3.9Å; Y410-V455 HydrophobicContact CE1-CG1 4.14Å; Y451-V455 HydrophobicContact CE2-CG2 4.18Å; Y451-V455 WeakPolarHBondContact O-CG2 3.1Å; Y451-V455 PolarHBondContact O-N 3.38Å; M452-V455 PolarHBondContact O-N 3.26Å; E453-V455 PolarHBondContact O-N 3.08Å; V455-A459 WeakPolarHBondContact O-CB 3.41Å; V455-A459 PolarHBondContact O-N 2.97Å; V455-A459 VanDerWaalsContact O-N 3.11Å
456	K	71.1	Confident	62.3	Low	85 Å²	85	93.3 Å²	93.3	37%	0.37	46%	0.456	S	S	.	.	H	α-helix	trans	-69.6	-40	173.5	-73.5	177.5	-179.8	-178	0	111.9	M452 E453 A459 R460	M452-K456 WeakPolarHBondContact O-CG 3.42Å; M452-K456 PolarHBondContact O-N 3.05Å; E453-K456 CarbonylContact O-C 3.49Å; E453-K456 WeakPolarHBondContact O-CB 3.21Å; E453-K456 PolarHBondContact O-N 3.46Å; K456-A459 PolarHBondContact O-N 3.34Å; K456-R460 WeakPolarHBondContact O-CB 3.18Å; K456-R460 PolarHBondContact O-N 3.01Å
457	T	69.8	Low	62.7	Low	63 Å²	63	91.1 Å²	91.1	39%	0.387	45%	0.45	S	S	.	.	H	α-helix	trans	-69.6	-44.5	178.2	54.7	0	0	0	0	110.5	E453 K454 A459 R460 E461	E453-T457 WeakPolarHBondContact O-CG2 3.38Å; E453-T457 PolarHBondContact O-N 3.22Å; E453-T457 PolarHBondContact O-OG1 3.18Å; E453-T457 VanDerWaalsContact O-OG1 3.09Å; K454-T457 VanDerWaalsContact CA-OG1 3.28Å; K454-T457 WeakPolarHBondContact CA-OG1 3.43Å; K454-T457 PolarHBondContact O-N 2.89Å; K454-T457 PolarHBondContact O-OG1 3Å; T457-A459 VanDerWaalsContact C-N 3.28Å; T457-A459 PolarHBondContact O-N 3.2Å; T457-R460 CarbonylContact O-C 3.57Å; T457-R460 WeakPolarHBondContact O-CA 3.4Å; T457-R460 WeakPolarHBondContact O-CB 3.45Å; T457-R460 PolarHBondContact O-N 3.27Å; T457-E461 WeakPolarHBondContact O-CB 3.37Å; T457-E461 WeakPolarHBondContact O-CG 3.33Å; T457-E461 PolarHBondContact O-N 2.77Å
458	E	72.2	Confident	62.6	Low	84 Å²	84	92 Å²	92	39%	0.393	45%	0.447	S	S	.	.	H	α-helix	trans	-58.6	-40.1	174	-78.2	173.4	-179.3	0	0	111.6	K454 R460 R462	K454-E458 WeakPolarHBondContact CE-OE1 3.38Å; K454-E458 HydrophobicContact CG-CG 4.4Å; K454-E458 VanDerWaalsContact O-CB 3.29Å; K454-E458 WeakPolarHBondContact O-CB 3.44Å; K454-E458 VanDerWaalsContact O-CG 3.23Å; K454-E458 WeakPolarHBondContact O-CG 3.25Å; K454-E458 PolarHBondContact O-N 3.23Å; E458-R460 VanDerWaalsContact C-N 3.31Å; E458-R460 PolarHBondContact O-N 3.01Å; E458-R462 WeakPolarHBondContact O-CB 3.48Å; E458-R462 PolarHBondContact O-N 3.4Å; E458-R462 VanDerWaalsContact O-N 3.11Å
459	A	66.2	Low	62	Low	5 Å²	5	92.7 Å²	92.7	4%	0.041	46%	0.455	C	S	.	.	H	α-helix	trans	-65.2	-34.8	174.6	0	0	0	0	0	112.6	V455 K456 T457 T463	V455-A459 WeakPolarHBondContact O-CB 3.41Å; V455-A459 PolarHBondContact O-N 2.97Å; V455-A459 VanDerWaalsContact O-N 3.11Å; K456-A459 PolarHBondContact O-N 3.34Å; T457-A459 VanDerWaalsContact C-N 3.28Å; T457-A459 PolarHBondContact O-N 3.2Å; A459-T463 PolarHBondContact O-N 3.16Å
460	R	72.4	Confident	60.9	Low	157 Å²	157	97.5 Å²	97.5	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-75.2	-42.4	178.3	-170.3	178.6	-178.2	177.8	-1.4	112	K456 T457 E458 R462 T463 T464	K456-R460 WeakPolarHBondContact O-CB 3.18Å; K456-R460 PolarHBondContact O-N 3.01Å; T457-R460 CarbonylContact O-C 3.57Å; T457-R460 WeakPolarHBondContact O-CA 3.4Å; T457-R460 WeakPolarHBondContact O-CB 3.45Å; T457-R460 PolarHBondContact O-N 3.27Å; E458-R460 VanDerWaalsContact C-N 3.31Å; E458-R460 PolarHBondContact O-N 3.01Å; R460-R462 VanDerWaalsContact C-N 3.28Å; R460-R462 PolarHBondContact O-N 3.07Å; R460-T463 WeakPolarHBondContact CA-OG1 3.29Å; R460-T463 PolarHBondContact O-N 3.23Å; R460-T463 VanDerWaalsContact O-N 3.16Å; R460-T463 PolarHBondContact O-OG1 2.9Å; R460-T464 PolarHBondContact O-N 3.36Å; R460-T464 VanDerWaalsContact O-N 3.15Å; R460-T464 PolarHBondContact O-OG1 3.39Å
461	E	70.6	Confident	59.7	Low	115 Å²	115	101.1 Å²	101.1	54%	0.537	49%	0.491	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.2	-73.9	168.7	-179	0	0	110.5	T457 T463 T464 E465	T457-E461 WeakPolarHBondContact O-CB 3.37Å; T457-E461 WeakPolarHBondContact O-CG 3.33Å; T457-E461 PolarHBondContact O-N 2.77Å; E461-T463 VanDerWaalsContact C-N 3.3Å; E461-T463 PolarHBondContact O-N 2.82Å; E461-T464 PolarHBondContact O-N 3.48Å; E461-T464 VanDerWaalsContact O-N 3.15Å; E461-E465 PolarHBondContact O-N 3.19Å
462	R	64.9	Low	58.6	Low	152 Å²	152	101.9 Å²	101.9	57%	0.574	50%	0.503	S	S	*	.	H	α-helix	trans	-67	-26.9	177.1	-157.9	176.3	-168.8	177.1	2.9	114.2	E458 R460	E458-R462 WeakPolarHBondContact O-CB 3.48Å; E458-R462 PolarHBondContact O-N 3.4Å; E458-R462 VanDerWaalsContact O-N 3.11Å; R460-R462 VanDerWaalsContact C-N 3.28Å; R460-R462 PolarHBondContact O-N 3.07Å
463	T	60	Low	57.4	Low	49 Å²	49	106.8 Å²	106.8	30%	0.301	53%	0.529	S	S	.	.	H	α-helix	trans	-75.8	-34	172.5	48.7	0	0	0	0	112.2	A459 R460 E461 M466 D467	A459-T463 PolarHBondContact O-N 3.16Å; R460-T463 WeakPolarHBondContact CA-OG1 3.29Å; R460-T463 PolarHBondContact O-N 3.23Å; R460-T463 VanDerWaalsContact O-N 3.16Å; R460-T463 PolarHBondContact O-OG1 2.9Å; E461-T463 VanDerWaalsContact C-N 3.3Å; E461-T463 PolarHBondContact O-N 2.82Å; T463-M466 PolarHBondContact O-N 3.4Å; T463-D467 PolarHBondContact O-N 3.46Å
464	T	58.4	Low	56	Low	71 Å²	71	110.9 Å²	110.9	44%	0.436	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-41.3	175.9	-35.3	0	0	0	0	110.8	R460 E461 M466 D467 D468	R460-T464 PolarHBondContact O-N 3.36Å; R460-T464 VanDerWaalsContact O-N 3.15Å; R460-T464 PolarHBondContact O-OG1 3.39Å; E461-T464 PolarHBondContact O-N 3.48Å; E461-T464 VanDerWaalsContact O-N 3.15Å; T464-M466 PolarHBondContact O-N 2.88Å; T464-D467 PolarHBondContact O-N 3.42Å; T464-D468 PolarHBondContact O-N 3.48Å
465	E	55.5	Low	54.4	Low	149 Å²	149	111.7 Å²	111.7	70%	0.696	56%	0.558	S	S	*	*	H	α-helix	trans	-64.6	-18.2	177.4	-71.3	179.4	175	0	0	114.6	E461	E461-E465 PolarHBondContact O-N 3.19Å
466	M	51	Low	53.2	Low	142 Å²	142	117.6 Å²	117.6	70%	0.7	59%	0.59	S	S	*	*	H	α-helix	trans	-94.7	-14.7	177.1	-70.8	-171	-179.1	0	0	113.6	T463 T464	T463-M466 PolarHBondContact O-N 3.4Å; T464-M466 PolarHBondContact O-N 2.88Å
467	D	46.8	Very low	51.6	Low	141 Å²	141	121.4 Å²	121.4	75%	0.754	61%	0.609	S	S	*	*	H	α-helix	trans	-102.8	-4.3	-178.9	-81.1	-24.6	0	0	0	112.5	T463 T464	T463-D467 PolarHBondContact O-N 3.46Å; T464-D467 PolarHBondContact O-N 3.42Å
468	D	43.8	Very low	50.7	Low	124 Å²	124	125.6 Å²	125.6	66%	0.663	63%	0.629	S	S	*	*			trans	-96.8	16.7	-177.4	-78.5	-25.4	0	0	0	114.4	T464	T464-D468 PolarHBondContact O-N 3.48Å
469	D	40.3	Very low	49.4	Very low	150 Å²	150	131.3 Å²	131.3	80%	0.802	65%	0.653	S	S	*	*			trans	-96.2	18.1	-177.9	-107.7	-13.3	0	0	0	114.5
470	D	35	Very low	48.4	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	69%	0.689	S	S	*	*	S	Bend	trans	-130.8	129.4	173.1	-87.4	-36.9	0	0	0	111.3
471	D	38.7	Very low	47.2	Very low	141 Å²	141	138 Å²	138	75%	0.754	70%	0.698	S	S	*	*			trans	93.8	104.9	165.2	-63.9	-25	0	0	0	120.3
472	D	40	Very low	45.9	Very low	131 Å²	131	138.5 Å²	138.5	70%	0.701	71%	0.711	S	S	*	*				86.6	98.4	128.4	-63.4	-15.3	0	0	0	121.5
473	D	35.6	Very low	44.5	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	73%	0.726	S	S	*	*				68.4	124	115.6	-71.5	-20.9	0	0	0	122.5
474	E	38	Very low	43.5	Very low	164 Å²	164	143 Å²	143	77%	0.766	75%	0.746	S	S	*	*			trans	91.5	124.4	138.6	-71.5	178.3	178.2	0	0	121.4
475	D	41.2	Very low	42.4	Very low	132 Å²	132	147.3 Å²	147.3	71%	0.706	77%	0.767	S	S	*	*			trans	94.7	96.7	144.7	-61.6	-13.1	0	0	0	121.9
476	D	45.6	Very low	41.4	Very low	130 Å²	130	143.1 Å²	143.1	70%	0.695	76%	0.763	S	S	*	*				82	101.8	118.4	-79.5	-4.4	0	0	0	122
477	E	37.9	Very low	40.5	Very low	165 Å²	165	141.3 Å²	141.3	77%	0.771	77%	0.765	S	S	*	*				73.8	138.7	121.5	-62	-159	160.2	0	0	122.1
478	D	50.1	Low	39.9	Very low	151 Å²	151	143.2 Å²	143.2	81%	0.807	77%	0.769	S	S	*	*			trans	73	100.1	159.6	-70.2	-20.8	0	0	0	120.1
479	F	46.1	Very low	39.6	Very low	204 Å²	204	146.1 Å²	146.1	90%	0.895	78%	0.784	S	S	*	*				-175	126.1	102.3	-164.5	-111.4	0	0	0	112.4
480	K	45.5	Very low	39.4	Very low	183 Å²	183	143.3 Å²	143.3	80%	0.796	78%	0.782	S	S	*	*			trans	-83.5	146.3	-178.6	-76.5	173.1	177.9	167.9	0	113.1
481	P	46.5	Very low	39.4	Very low	119 Å²	119	144.7 Å²	144.7	77%	0.773	78%	0.783	S	S	*	*			trans	-86.2	169.6	173.7	37.1	-33.3	0	0	0	111.6
482	P	42.2	Very low	39.7	Very low	125 Å²	125	147.3 Å²	147.3	81%	0.812	79%	0.791	S	S	*	*			trans	-136	149.7	138.5	34.4	-20.1	0	0	0	114.6
483	E	36.9	Very low	39.5	Very low	193 Å²	193	151.2 Å²	151.2	90%	0.902	80%	0.797	S	S	*	*			trans	-51.7	152.1	168	-51.7	-177.1	153.7	0	0	113.3
484	S	37.8	Very low	40	Very low	103 Å²	103	152.3 Å²	152.3	72%	0.72	80%	0.803	S	S	*	*				168.5	132.2	123	-171	0	0	0	0	112.2
485	D	35.4	Very low	39.8	Very low	161 Å²	161	148.8 Å²	148.8	86%	0.861	80%	0.796	S	S	*	*			trans	61.7	120.3	147.4	-86.1	-23.8	0	0	0	122
486	G	34.3	Very low	39.5	Very low	61 Å²	61	149 Å²	149	63%	0.629	80%	0.798	S	S	*	*				123.2	112.5	97.2	0	0	0	0	0	117.1
487	S	33.4	Very low	39.2	Very low	105 Å²	105	149.8 Å²	149.8	73%	0.734	81%	0.807	S	S	*	*			trans	71.3	113.8	145.8	76.2	0	0	0	0	117.8
488	E	32.8	Very low	38.9	Very low	181 Å²	181	149.4 Å²	149.4	85%	0.846	81%	0.805	S	S	*	*				92.1	108.6	98	-79.6	-177.2	178.1	0	0	112.1
489	L	37.4	Very low	37.9	Very low	185 Å²	185	148 Å²	148	97%	0.969	80%	0.803	S	S	*	*			trans	-153.8	103.3	144.4	-113.7	144.5	0	0	0	109.6
490	A	36.8	Very low	37.3	Very low	91 Å²	91	145.3 Å²	145.3	75%	0.752	80%	0.803	S	S	*	*			trans	-81.9	162.7	180	0	0	0	0	0	112.1
491	E	34.6	Very low	36.4	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	81%	0.805	S	S	*	*			trans	-53.7	139.6	175.8	-50.9	177.9	166.5	0	0	113.8
492	E	45.3	Very low	35.7	Very low	195 Å²	195	142.4 Å²	142.4	91%	0.911	80%	0.803	S	S	*	*			trans	-139.1	128.2	151.6	-73.2	-164.4	167.6	0	0	112.2
493	Y	35.8	Very low	35.3	Very low	213 Å²	213	144.9 Å²	144.9	84%	0.835	80%	0.803	S	S	*	*			trans	-50.6	149.6	164.9	-90.6	-123.6	0	0	0	113.3
494	D	45.4	Very low	35	Very low	159 Å²	159	143 Å²	143	85%	0.85	80%	0.8	S	S	*	*				-156.4	151.4	121.1	-147.9	-7.7	0	0	0	112.5
495	S	34.6	Very low	34.7	Very low	90 Å²	90	147.6 Å²	147.6	63%	0.629	81%	0.81	S	S	*	*			trans	-108.7	155.7	-167.2	58.2	0	0	0	0	112.6
496	N	34.9	Very low	34.6	Very low	137 Å²	137	145.4 Å²	145.4	73%	0.733	81%	0.807	S	S	*	*			trans	82.5	110.9	150.2	-154.9	37.5	0	0	0	119
497	V	38.5	Very low	34.5	Very low	147 Å²	147	145.5 Å²	145.5	89%	0.891	81%	0.808	S	S	*	*			trans	-147.3	140.3	135.7	138.2	0	0	0	0	109.6
498	Q	32.8	Very low	34.5	Very low	156 Å²	156	148 Å²	148	73%	0.729	81%	0.808	S	S	*	*			trans	-82.4	147.9	-164.5	-67.8	176.3	-44.4	0	0	115.5
499	T	28	Very low	34.5	Very low	123 Å²	123	146.6 Å²	146.6	76%	0.755	81%	0.806	S	S	*	*			trans	26.8	119.4	140.4	62.2	0	0	0	0	120.4
500	T	33.5	Very low	34.4	Very low	147 Å²	147	144.4 Å²	144.4	90%	0.902	80%	0.795	S	S	*	*				-150.1	134.2	129.2	48.4	0	0	0	0	110.9
501	T	27.1	Very low	34.3	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	80%	0.801	S	S	*	*			trans	-80.9	144	179.3	44.2	0	0	0	0	113.2
502	S	33.2	Very low	34.4	Very low	104 Å²	104	146.2 Å²	146.2	73%	0.727	80%	0.798	S	S	*	*			trans	-177.2	117.1	139.2	51.4	0	0	0	0	112.6
503	E	32.2	Very low	33.8	Very low	178 Å²	178	144.4 Å²	144.4	83%	0.832	80%	0.795	S	S	*	*			trans	67.2	102.8	130.4	-59.8	172.5	-172.5	0	0	118.4
504	D	30.9	Very low	33.8	Very low	154 Å²	154	140.8 Å²	140.8	82%	0.824	79%	0.79	S	S	*	*				82.8	101.7	72.9	-82.7	-30	0	0	0	113.6
505	E	32.6	Very low	33.2	Very low	198 Å²	198	138.1 Å²	138.1	93%	0.925	78%	0.784	S	S	*	*			trans	-148	102.4	144	-79.8	-152.9	157.7	0	0	110.6
506	S	33.3	Very low	33.2	Very low	115 Å²	115	141.1 Å²	141.1	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.1	126.2	178	52.9	0	0	0	0	111.9
507	G	30.9	Very low	33.1	Very low	63 Å²	63	143.6 Å²	143.6	65%	0.649	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-88.1	129.8	171.6	0	0	0	0	0	112.6
508	E	33.5	Very low	32.9	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.1	131.9	171.7	-66.4	170.3	153.4	0	0	111.7
509	N	33.8	Very low	33	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	79%	0.794	S	S	*	*			trans	-115.2	115.8	161.9	-79.3	-24.5	0	0	0	107.5
510	D	35.4	Very low	33.4	Very low	138 Å²	138	144.7 Å²	144.7	74%	0.738	80%	0.796	S	S	*	*			trans	-95.9	124	166.5	-72.7	-41.6	0	0	0	108.5
511	D	34.8	Very low	33.4	Very low	162 Å²	162	144.8 Å²	144.8	87%	0.866	79%	0.79	S	S	*	*			trans	-92.6	106.5	165.3	-73.4	-47	0	0	0	107.8
512	D	35.9	Very low	33.9	Very low	145 Å²	145	146 Å²	146	78%	0.775	79%	0.79	S	S	*	*			trans	-97.7	109.8	167.8	-78.5	-39.6	0	0	0	108.7
513	D	32.7	Very low	33.9	Very low	158 Å²	158	145.9 Å²	145.9	85%	0.845	79%	0.79	S	S	*	*			trans	-98.8	95.3	168.9	-167.7	20.2	0	0	0	107.3
514	D	35.2	Very low	33.9	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	78%	0.784	S	S	*	*			trans	-95.7	102.5	176	-94	-35.4	0	0	0	109.8
515	S	33.6	Very low	34.1	Very low	104 Å²	104	145 Å²	145	73%	0.727	79%	0.789	S	S	*	*			trans	-103.9	97.3	158	57.6	0	0	0	0	108.6	E517	S515-E517 PolarHBondContact O-N 2.95Å
516	E	34.9	Very low	34	Very low	152 Å²	152	142.3 Å²	142.3	71%	0.71	78%	0.78	S	S	*	*			trans	-80.9	110.8	172.7	-71.6	-172.8	154.5	0	0	110.1
517	E	32.6	Very low	34	Very low	189 Å²	189	144.1 Å²	144.1	88%	0.883	79%	0.787	S	S	*	*			trans	-92.4	107.8	159.6	-72	-177.5	165.9	0	0	108.2	S515 E519	S515-E517 PolarHBondContact O-N 2.95Å; E517-E519 PolarHBondContact O-N 3.19Å
518	D	34.8	Very low	34	Very low	147 Å²	147	146.5 Å²	146.5	79%	0.786	79%	0.789	S	S	*	*			trans	-86.7	96.7	172.8	-103	-27.4	0	0	0	110.2
519	E	34.3	Very low	34.1	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	79%	0.793	S	S	*	*			trans	-94	104.9	157.3	-77	-154.6	161	0	0	109.7	E517	E517-E519 PolarHBondContact O-N 3.19Å
520	T	36	Very low	34.3	Very low	128 Å²	128	146 Å²	146	79%	0.785	79%	0.791	S	S	*	*			trans	-91.6	102.6	166.5	43.3	0	0	0	0	110.2
521	N	32.9	Very low	34.3	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	80%	0.795	S	S	*	*			trans	-95	108	171.6	-134.3	-22.9	0	0	0	108.9
522	I	37.6	Very low	34.3	Very low	161 Å²	161	149 Å²	149	83%	0.826	79%	0.79	S	S	*	*			trans	-90.7	103.8	170.4	-66.9	175.1	0	0	0	108.3
523	S	35	Very low	34.1	Very low	103 Å²	103	150.3 Å²	150.3	72%	0.72	79%	0.788	S	S	*	*			trans	-83.1	111.1	167.1	68.4	0	0	0	0	111.1
524	S	31.2	Very low	34.4	Very low	102 Å²	102	149.1 Å²	149.1	71%	0.713	78%	0.782	S	S	*	*			trans	3.2	131.1	140.8	47.5	0	0	0	0	119.3
525	K	35.4	Very low	34.4	Very low	212 Å²	212	151.7 Å²	151.7	92%	0.922	79%	0.787	S	S	*	*			trans	-124.6	123	148.7	-120.3	177.2	-174.2	172.8	0	110.7
526	N	29.9	Very low	34.6	Very low	140 Å²	140	155 Å²	155	75%	0.749	79%	0.791	S	S	*	*			trans	-51.8	149.2	178.5	-68.4	-34.3	0	0	0	115.1
527	T	33.6	Very low	34.6	Very low	153 Å²	153	153.9 Å²	153.9	94%	0.939	79%	0.79	S	S	*	*				-144.9	135.6	127.9	32.2	0	0	0	0	111
528	T	30.8	Very low	34.7	Very low	114 Å²	114	152 Å²	152	70%	0.699	79%	0.785	S	S	*	*			trans	-102.3	139.7	-164.2	-35.6	0	0	0	0	110.6
529	T	35.6	Very low	34.8	Very low	135 Å²	135	152 Å²	152	83%	0.828	79%	0.786	S	S	*	*			trans	-167	101.7	146.7	21	0	0	0	0	113.8
530	H	37.6	Very low	35	Very low	165 Å²	165	148.5 Å²	148.5	76%	0.764	78%	0.78	S	S	*	*			trans	48.9	135	131.2	-75.5	-57.4	0	0	0	126.5
531	K	35.5	Very low	35	Very low	190 Å²	190	149.2 Å²	149.2	83%	0.826	78%	0.779	S	S	*	*			trans	82.2	139.5	149	-78	174.9	175.5	175.4	0	116.4
532	K	34.3	Very low	35.4	Very low	172 Å²	172	150.3 Å²	150.3	75%	0.748	78%	0.78	S	S	*	*			cis	162.7	131.9	-12.7	-128.3	-173.3	179.2	177.7	0	104.7
533	K	33.3	Very low	35.5	Very low	172 Å²	172	148.5 Å²	148.5	75%	0.748	77%	0.772	S	S	*	*			trans	61.4	144.1	144.5	-80.1	-172.8	170.6	-159.6	0	119.6
534	D	37.9	Very low	35.8	Very low	133 Å²	133	151.3 Å²	151.3	71%	0.711	77%	0.773	S	S	*	*			cis	-151.8	144.8	18.9	-73.7	-54.7	0	0	0	107.1
535	K	35.6	Very low	36.3	Very low	191 Å²	191	152.2 Å²	152.2	83%	0.83	77%	0.771	S	S	*	*				71.1	135.9	71.9	-135.6	-175	-174.5	-173.5	0	117.2
536	Q	37.6	Very low	36.4	Very low	174 Å²	174	147 Å²	147	81%	0.813	76%	0.761	S	S	*	*			trans	95.1	146.8	171.2	-73.2	-177	-51.9	0	0	117.2
537	D	34.3	Very low	36.8	Very low	128 Å²	128	148.3 Å²	148.3	68%	0.684	77%	0.767	S	S	*	*			cis	162.3	154.2	-26.2	-95.2	-23.1	0	0	0	104.7
538	N	35.4	Very low	37.1	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	76%	0.756	S	S	*	*			trans	83.3	124.2	171.5	-65.7	-7.1	0	0	0	118
539	D	36.5	Very low	37.4	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	76%	0.758	S	S	*	*			cis	100.2	142.7	40.2	-103.8	-17.7	0	0	0	113.8
540	S	38.6	Very low	37.5	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	75%	0.754	S	S	*	*			trans	76.4	146.9	167.2	69.6	0	0	0	0	118.2
541	D	37.2	Very low	37.5	Very low	143 Å²	143	142 Å²	142	77%	0.765	75%	0.753	S	S	*	*			cis	178.8	173.6	-22.7	-95	-40.6	0	0	0	104.4
542	E	40.2	Very low	37.6	Very low	171 Å²	171	137.4 Å²	137.4	80%	0.799	74%	0.744	S	S	*	*			trans	81.9	137.9	159.4	-49.7	-173.9	175.5	0	0	117.3
543	D	41	Very low	37.6	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	75%	0.747	S	S	*	*			cis	-176.7	156.9	-7.7	-101.8	-29.3	0	0	0	108.9
544	E	41	Very low	37.8	Very low	162 Å²	162	132 Å²	132	76%	0.757	75%	0.745	S	S	*	*			trans	61.5	148.7	146.9	-68	-170.5	177.8	0	0	120.2
545	D	40.2	Very low	37.6	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	75%	0.752	S	S	*	*			cis	-176.1	141.8	7	-115.2	-18.3	0	0	0	104.2
546	S	38.9	Very low	37.4	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	75%	0.746	S	S	*	*				158	121.1	77	41.7	0	0	0	0	111.4
547	L	38.7	Very low	37.1	Very low	167 Å²	167	131.7 Å²	131.7	87%	0.874	75%	0.748	S	S	*	*				46	139.4	127.4	-66	162.9	0	0	0	126.6
548	S	38.1	Very low	37	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	75%	0.753	S	S	*	*			trans	113.9	100.8	139.6	76.4	0	0	0	0	116.4
549	S	37.1	Very low	36.6	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	76%	0.757	S	S	*	*				80.9	134.4	81.5	76.3	0	0	0	0	112.7
550	V	38.7	Very low	36.5	Very low	122 Å²	122	136.5 Å²	136.5	74%	0.739	76%	0.764	S	S	*	*				-173.5	137.8	53.5	-179.8	0	0	0	0	110.9
551	S	36.6	Very low	36.1	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	77%	0.771	S	S	*	*			trans	54.6	150.9	145.7	87.2	0	0	0	0	122.1
552	S	38.1	Very low	35.7	Very low	93 Å²	93	143 Å²	143	65%	0.65	77%	0.773	S	S	*	*			cis	-172.2	141.3	29.3	51.7	0	0	0	0	112.3
553	T	35.8	Very low	35.4	Very low	131 Å²	131	142.7 Å²	142.7	80%	0.804	78%	0.776	S	S	*	*			trans	54	145.5	140.5	44.6	0	0	0	0	120.8
554	S	36.3	Very low	34.8	Very low	100 Å²	100	146.2 Å²	146.2	70%	0.699	79%	0.785	S	S	*	*			cis	176.3	138.2	4.9	42.9	0	0	0	0	104.2
555	E	33.4	Very low	34.3	Very low	184 Å²	184	147.9 Å²	147.9	86%	0.86	79%	0.793	S	S	*	*				177.4	157.1	78.6	-81.6	-170.6	135.8	0	0	110.4
556	P	31.3	Very low	33.8	Very low	110 Å²	110	151 Å²	151	71%	0.714	80%	0.804	S	S	*	*			trans	-125.8	168.5	-170.8	41.8	-27.1	0	0	0	117.6
557	K	31.6	Very low	33.6	Very low	196 Å²	196	151.5 Å²	151.5	85%	0.852	81%	0.805	S	S	*	*			trans	79.9	161.1	152.9	-76.8	174.2	-174.9	175.3	0	119.3
558	P	32.1	Very low	33.3	Very low	121 Å²	121	153.7 Å²	153.7	79%	0.786	81%	0.807	S	S	*	*			cis	-137.5	168.1	4.8	26.3	-1.5	0	0	0	118.2
559	K	27.7	Very low	32.8	Very low	201 Å²	201	158.7 Å²	158.7	87%	0.874	82%	0.816	S	S	*	*			trans	-61.7	143.9	166.2	-65.8	167.3	173.7	173.9	0	113.5
560	Q	34.9	Very low	32.7	Very low	204 Å²	204	158.8 Å²	158.8	95%	0.953	82%	0.816	S	S	*	*			trans	-122.1	139.2	146	-82.7	-171.1	-7.2	0	0	111.2
561	K	29.1	Very low	32.3	Very low	193 Å²	193	158.7 Å²	158.7	84%	0.839	82%	0.817	S	S	*	*			trans	-114.7	162.4	-172.6	-124.8	179.8	-177.8	179.9	0	106.7
562	K	29.8	Very low	32.3	Very low	188 Å²	188	161.5 Å²	161.5	82%	0.817	82%	0.821	S	S	*	*			trans	87.2	132.1	163	-72.6	178.4	176	-175	0	114.6
563	L	32.9	Very low	31.8	Very low	164 Å²	164	166.5 Å²	166.5	86%	0.859	83%	0.831	S	S	*	*			cis	-149.2	155.7	21.8	-88.4	122.1	0	0	0	112.6
564	K	28.3	Very low	31.8	Very low	196 Å²	196	165.1 Å²	165.1	85%	0.852	83%	0.827	S	S	*	*			trans	-75	145.9	164.4	-74.6	176.5	167.5	-175.6	0	110.9
565	E	31	Very low	31.6	Very low	197 Å²	197	171.6 Å²	171.6	92%	0.921	84%	0.836	S	S	*	*			trans	-158.5	120.3	142.3	-112.1	176.1	-176.8	0	0	110.3
566	E	29.7	Very low	31.4	Very low	187 Å²	187	170.8 Å²	170.8	87%	0.874	83%	0.83	S	S	*	*			trans	-109	-177.7	160.3	-58.4	-172.3	126.2	0	0	108.6
567	P	34.4	Very low	31.4	Very low	113 Å²	113	170.1 Å²	170.1	73%	0.734	82%	0.82	S	S	*	*				-122	156.2	-91.8	33.6	-14.4	0	0	0	112.3
568	K	32.6	Very low	31.3	Very low	213 Å²	213	168.1 Å²	168.1	93%	0.926	81%	0.814	S	S	*	*			trans	-143.2	129.4	167.6	-72.4	-170.4	-179.3	172.1	0	114.4
569	K	28	Very low	31.3	Very low	209 Å²	209	168.9 Å²	168.9	91%	0.909	82%	0.817	S	S	*	*			trans	-63.9	142.3	168.3	-68.7	171.2	172	175.9	0	112.4
570	S	34.9	Very low	31.4	Very low	107 Å²	107	169.6 Å²	169.6	75%	0.748	82%	0.82	S	S	*	*			trans	-170.5	100.5	144.5	54.2	0	0	0	0	108.9
571	T	29.1	Very low	31.5	Very low	121 Å²	121	169 Å²	169	74%	0.742	82%	0.817	S	S	*	*				54.8	104.9	91.6	-27.5	0	0	0	0	115.2
572	I	36.9	Very low	31.8	Very low	163 Å²	163	165.2 Å²	165.2	84%	0.836	81%	0.813	S	S	*	*			trans	-173.1	108.9	145.7	-81.6	140.4	0	0	0	103
573	K	28.8	Very low	32	Very low	198 Å²	198	160.5 Å²	160.5	86%	0.861	80%	0.803	S	S	*	*				62.5	87.7	50.2	-97.6	-168.1	-177.1	-179.8	0	115.6
574	S	34.4	Very low	32.2	Very low	103 Å²	103	157.8 Å²	157.8	72%	0.72	78%	0.784	S	S	*	*			trans	-171.2	106.2	145.1	45.8	0	0	0	0	109.2
575	R	32.1	Very low	32.3	Very low	235 Å²	235	159 Å²	159	89%	0.887	78%	0.784	S	S	*	*				91.4	107.9	90.6	-84.5	179.8	171.5	175.3	-3	111.5
576	K	29.7	Very low	32.8	Very low	168 Å²	168	157.8 Å²	157.8	73%	0.73	78%	0.778	S	S	*	*				74.6	132.7	96.5	-90.6	-168.2	141.4	-119.1	0	111.1
577	D	30.3	Very low	33.1	Very low	95 Å²	95	154.8 Å²	154.8	51%	0.508	77%	0.773	S	S	.	*			cis	-169.5	155.9	25.6	-104.6	-31.2	0	0	0	110.2
578	E	30.9	Very low	33.1	Very low	155 Å²	155	157.8 Å²	157.8	72%	0.724	77%	0.774	S	S	*	*			trans	59.7	114.1	137.8	-61.7	165.8	-178.8	0	0	119.6
579	T	31.1	Very low	33.4	Very low	137 Å²	137	157.2 Å²	157.2	84%	0.84	77%	0.772	S	S	*	*				-172.7	126.5	64.1	22.1	0	0	0	0	109.6
580	K	30.4	Very low	33.7	Very low	215 Å²	215	156.7 Å²	156.7	94%	0.935	77%	0.772	S	S	*	*			trans	-118.8	112.3	164.6	-86.9	-172.6	175.9	-176.8	0	108.6
581	Q	37.3	Very low	33.9	Very low	191 Å²	191	160.3 Å²	160.3	89%	0.893	78%	0.775	S	S	*	*			trans	-89.9	145.9	161.5	-82.4	-171.2	-8.1	0	0	110.2
582	P	34.9	Very low	34.6	Very low	115 Å²	115	163.8 Å²	163.8	75%	0.747	78%	0.779	S	S	*	*			trans	-101.3	173.2	-167.2	38.9	-32.1	0	0	0	113.9
583	S	33.3	Very low	35.2	Very low	89 Å²	89	162.1 Å²	162.1	62%	0.622	78%	0.779	S	S	*	*			trans	102.2	143.1	163.6	86.7	0	0	0	0	116.8	Q385	Q385-S583 PolarHBondContact NE2-O 3.05Å
584	K	37.5	Very low	36.5	Very low	107 Å²	107	161.5 Å²	161.5	47%	0.465	78%	0.776	S	S	.	*			cis	-140.5	139.7	26.5	-56.6	-171.9	-164.1	176.4	0	116.5	A384 Q385	A384-K584 HydrophobicContact CB-CD 3.62Å; A384-K584 PolarHBondContact O-NZ 3.03Å; Q385-K584 HydrophobicContact CB-CD 4.44Å; Q385-K584 HydrophobicContact CG-CB 3.64Å; Q385-K584 HydrophobicContact CG-CD 3.3Å; Q385-K584 HydrophobicContact CG-CG 3.36Å
585	R	31	Very low	38.2	Very low	221 Å²	221	159.9 Å²	159.9	83%	0.834	76%	0.76	S	S	*	*			trans	1.6	120.1	150.6	-74.1	171.5	157.9	177.7	-6.4	120.4
586	Q	41.4	Very low	40.2	Very low	172 Å²	172	154.7 Å²	154.7	80%	0.804	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-88.8	140.3	159.9	-75.4	-178	-10.5	0	0	111.7
587	T	35.9	Very low	42.4	Very low	124 Å²	124	152.7 Å²	152.7	76%	0.761	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-70.9	127	-178.7	37.9	0	0	0	0	112.1	K589	T587-K589 PolarHBondContact O-N 3.35Å
588	K	35.7	Very low	44.8	Very low	175 Å²	175	150.1 Å²	150.1	76%	0.761	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-61.9	119.4	177.5	-76	178.2	174.7	178.1	0	110.4	Q590	K588-Q590 PolarHBondContact O-N 3.15Å
589	K	37.9	Very low	47.2	Very low	202 Å²	202	144.2 Å²	144.2	88%	0.878	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-56	124.6	162.4	-86.6	-179.5	175.4	175.4	0	108.8	T587 K591	T587-K589 PolarHBondContact O-N 3.35Å; K589-K591 PolarHBondContact O-N 3.03Å
590	Q	34.1	Very low	49.7	Very low	197 Å²	197	143.6 Å²	143.6	92%	0.921	72%	0.717	S	S	*	*			trans	-55.8	113.3	173.2	-72.8	179.7	-12.7	0	0	109.2	K588 K592	K588-Q590 PolarHBondContact O-N 3.15Å; Q590-K592 PolarHBondContact O-N 2.75Å
591	K	38.9	Very low	52.4	Low	184 Å²	184	142.6 Å²	142.6	80%	0.8	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-60.4	129.5	170.3	-69	-178.3	178.1	-179.7	0	106.6	K589	K589-K591 PolarHBondContact O-N 3.03Å
592	K	45.2	Very low	54.8	Low	193 Å²	193	135.4 Å²	135.4	84%	0.839	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-46.8	134.7	169.1	-73.5	-179.5	177.6	-179.8	0	107.9	Q590 K594	Q590-K592 PolarHBondContact O-N 2.75Å; K592-K594 PolarHBondContact O-N 2.9Å
593	P	48.4	Very low	57.2	Low	128 Å²	128	133.8 Å²	133.8	83%	0.831	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-54.1	120.9	179.6	21.1	-30.7	0	0	0	108.1	D595	P593-D595 PolarHBondContact O-N 3.1Å
594	K	56.6	Low	59.9	Low	185 Å²	185	132.1 Å²	132.1	80%	0.804	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.5	131.9	170.9	-76.4	178.6	175.8	179.3	0	106.4	K592 P596	K592-K594 PolarHBondContact O-N 2.9Å; K594-P596 WeakPolarHBondContact O-CD 3.44Å; K594-P596 VanDerWaalsContact O-N 3.08Å
595	D	69.1	Low	62.4	Low	70 Å²	70	127.5 Å²	127.5	37%	0.374	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-54.9	118	173.6	-173.3	-33	0	0	0	107.8	P593 N597 A598 Y667	P593-D595 PolarHBondContact O-N 3.1Å; D595-N597 PolarHBondContact O-N 3.32Å; D595-N597 VanDerWaalsContact O-N 3.09Å; D595-N597 WeakPolarHBondContact OD1-CB 3.33Å; D595-N597 PolarHBondContact OD1-N 2.76Å; D595-A598 HydrophobicContact CB-CB 4.12Å; D595-A598 WeakPolarHBondContact O-CB 3.25Å; D595-A598 PolarHBondContact O-N 3.39Å; D595-Y667 WeakPolarHBondContact CB-OH 3.3Å; D595-Y667 VanDerWaalsContact CG-OH 3.25Å; D595-Y667 PolarHBondContact OD2-OH 2.81Å
596	P	75	Confident	65.2	Low	125 Å²	125	119.4 Å²	119.4	81%	0.812	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-17.1	-177.3	23.5	-32.1	0	0	0	112.8	K594	K594-P596 WeakPolarHBondContact O-CD 3.44Å; K594-P596 VanDerWaalsContact O-N 3.08Å
597	N	76.5	Confident	67.6	Low	127 Å²	127	116 Å²	116	68%	0.679	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-5.5	177.6	-63.6	-37.7	0	0	0	113.6	D595 Y667	D595-N597 PolarHBondContact O-N 3.32Å; D595-N597 VanDerWaalsContact O-N 3.09Å; D595-N597 WeakPolarHBondContact OD1-CB 3.33Å; D595-N597 PolarHBondContact OD1-N 2.76Å; N597-Y667 VanDerWaalsContact C-CE2 3.49Å; N597-Y667 HydrophobicContact CB-CD2 4.29Å; N597-Y667 HydrophobicContact CB-CE2 3.98Å; N597-Y667 WeakPolarHBondContact O-CD2 3.15Å; N597-Y667 WeakPolarHBondContact O-CE2 3.04Å
598	A	80.3	Confident	70.1	Confident	40 Å²	40	111.5 Å²	111.5	33%	0.331	56%	0.556	S	S	.	*	S	Bend	trans	-72.4	126.9	178.7	0	0	0	0	0	110.9	D595 Y667	D595-A598 HydrophobicContact CB-CB 4.12Å; D595-A598 WeakPolarHBondContact O-CB 3.25Å; D595-A598 PolarHBondContact O-N 3.39Å; A598-Y667 HydrophobicContact CB-CE1 4.27Å; A598-Y667 HydrophobicContact CB-CE2 4.18Å
599	P	81.6	Confident	72.9	Confident	31 Å²	31	103.3 Å²	103.3	20%	0.201	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-62.1	142.5	178.7	21	-28.6	0	0	0	111.3	Y660 D663 L664	P599-Y660 HydrophobicContact CB-CD2 4.05Å; P599-Y660 HydrophobicContact CB-CE2 3.99Å; P599-Y660 HydrophobicContact CG-CE2 4.25Å; P599-Y660 WeakPolarHBondContact O-CE2 3.28Å; P599-D663 HydrophobicContact CB-CB 3.89Å; P599-D663 HydrophobicContact CG-CB 4.32Å; P599-L664 HydrophobicContact CG-CB 3.98Å; P599-L664 HydrophobicContact CG-CD1 4.45Å; P599-L664 HydrophobicContact CG-CG 4.41Å
600	T	82.7	Confident	75.4	Confident	125 Å²	125	94.7 Å²	94.7	77%	0.767	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-87.4	138.3	-178.7	52.3	0	0	0	0	111.4	Y660	T600-Y660 WeakPolarHBondContact O-CD2 3.29Å; T600-Y660 WeakPolarHBondContact O-CE2 3.4Å
601	R	86.5	Confident	78.1	Confident	193 Å²	193	89.8 Å²	89.8	73%	0.728	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-64.2	141.5	179.1	-69.7	-178.3	178.5	-163.5	0.6	110.5	Y660	R601-Y660 HydrophobicContact CG-CE1 4.23Å; R601-Y660 HydrophobicContact CG-CE2 4.19Å; R601-Y660 WeakPolarHBondContact CG-OH 3.16Å
602	P	87.6	Confident	80.5	Confident	40 Å²	40	85.4 Å²	85.4	26%	0.26	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-67.3	144.3	178.9	29.4	-35.5	0	0	0	111.4	L656 K657	P602-L656 HydrophobicContact CB-CB 3.75Å; P602-K657 HydrophobicContact CG-CG 3.73Å
603	L	86.7	Confident	82.7	Confident	82 Å²	82	77.9 Å²	77.9	43%	0.429	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-64.8	150.2	175	-69.5	165.9	0	0	0	111.1	F607 L608	L603-F607 HydrophobicContact CB-CB 4.07Å; L603-F607 HydrophobicContact CD2-CB 4.06Å; L603-L608 HydrophobicContact CB-CD2 4.11Å; L603-L608 HydrophobicContact CB-CG 4.15Å; L603-L608 HydrophobicContact CD1-CD2 4.34Å
604	S	88.6	Confident	84.5	Confident	54 Å²	54	77.3 Å²	77.3	38%	0.378	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-67.5	162.6	174.4	83.5	0	0	0	0	111.7	Y606 F607 L608	S604-Y606 PolarHBondContact O-N 3.31Å; S604-F607 PolarHBondContact O-N 3.15Å; S604-F607 WeakPolarHBondContact OG-CD2 3.47Å; S604-F607 PolarHBondContact OG-N 3.26Å; S604-L608 PolarHBondContact O-N 3.06Å
605	A	90.4	Very high	86	Confident	10 Å²	10	75.3 Å²	75.3	8%	0.083	39%	0.389	C	S	.	.	H	α-helix	trans	-56.7	-36.7	180	0	0	0	0	0	112	W609 W638 V653	A605-W609 PolarHBondContact O-N 3.47Å; A605-W609 VanDerWaalsContact O-N 3.16Å; A605-W638 HydrophobicContact CB-CH2 4.04Å; A605-W638 HydrophobicContact CB-CZ2 4.05Å; A605-V653 HydrophobicContact CB-CG2 3.87Å
606	Y	90.4	Very high	86.9	Confident	50 Å²	50	78.1 Å²	78.1	20%	0.196	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-47.7	175.1	171.4	-107.3	0	0	0	112	S604 W609 F610 W638	S604-Y606 PolarHBondContact O-N 3.31Å; Y606-W609 HydrophobicContact CD2-CE3 4.03Å; Y606-W609 HydrophobicContact CD2-CZ3 4.21Å; Y606-W609 HydrophobicContact CE2-CE3 4.1Å; Y606-W609 AromaticContact CE2-CZ3 3.83Å; Y606-W609 HydrophobicContact CE2-CZ3 3.83Å; Y606-W609 PolarHBondContact O-N 2.94Å; Y606-F610 VanDerWaalsContact O-CB 3.26Å; Y606-F610 WeakPolarHBondContact O-CB 3.09Å; Y606-F610 PolarHBondContact O-N 2.88Å; Y606-W638 HydrophobicContact CD2-CB 3.75Å; Y606-W638 AromaticContact CD2-CD1 3.65Å; Y606-W638 AromaticContact CD2-CD2 3.84Å; Y606-W638 HydrophobicContact CD2-CD2 3.84Å; Y606-W638 HydrophobicContact CD2-CE3 4.5Å; Y606-W638 AromaticContact CD2-CG 3.48Å; Y606-W638 HydrophobicContact CD2-CG 3.48Å; Y606-W638 VanDerWaalsContact CD2-CG 3.48Å; Y606-W638 HydrophobicContact CE2-CB 3.82Å; Y606-W638 HydrophobicContact CE2-CG 4.08Å
607	F	91	Very high	87.5	Confident	100 Å²	100	72.5 Å²	72.5	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-69.4	-34.5	-178	-75.4	-66.9	0	0	0	112.9	L603 S604 F610 N611	L603-F607 HydrophobicContact CB-CB 4.07Å; L603-F607 HydrophobicContact CD2-CB 4.06Å; S604-F607 PolarHBondContact O-N 3.15Å; S604-F607 WeakPolarHBondContact OG-CD2 3.47Å; S604-F607 PolarHBondContact OG-N 3.26Å; F607-F610 PolarHBondContact O-N 3.03Å; F607-N611 WeakPolarHBondContact O-CB 3.42Å; F607-N611 VanDerWaalsContact O-CG 3.26Å; F607-N611 PolarHBondContact O-N 3.12Å; F607-N611 PolarHBondContact O-ND2 3.44Å
608	L	89.8	Confident	87.9	Confident	30 Å²	30	67.8 Å²	67.8	16%	0.157	34%	0.339	C	S	.	.	H	α-helix	trans	-60.4	-49.3	171.8	-71.4	175.5	0	0	0	111.2	L603 S604 E612 Y649 R652 V653 L656	L603-L608 HydrophobicContact CB-CD2 4.11Å; L603-L608 HydrophobicContact CB-CG 4.15Å; L603-L608 HydrophobicContact CD1-CD2 4.34Å; S604-L608 PolarHBondContact O-N 3.06Å; L608-E612 WeakPolarHBondContact O-CG 3.21Å; L608-E612 PolarHBondContact O-N 3.29Å; L608-Y649 HydrophobicContact CB-CD1 4.15Å; L608-R652 HydrophobicContact CD1-CB 4.42Å; L608-V653 HydrophobicContact CD1-CG2 3.55Å; L608-L656 HydrophobicContact CD1-CD1 3.95Å; L608-L656 HydrophobicContact CD2-CD1 4.08Å
609	W	93.6	Very high	88.2	Confident	3 Å²	3	73.1 Å²	73.1	1%	0.011	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-43.4	176.4	168.5	75.2	0	0	0	112.4	A605 Y606 N611 E612 N613 I617 A634 I637 W638 M641 Y649	A605-W609 PolarHBondContact O-N 3.47Å; A605-W609 VanDerWaalsContact O-N 3.16Å; Y606-W609 HydrophobicContact CD2-CE3 4.03Å; Y606-W609 HydrophobicContact CD2-CZ3 4.21Å; Y606-W609 HydrophobicContact CE2-CE3 4.1Å; Y606-W609 AromaticContact CE2-CZ3 3.83Å; Y606-W609 HydrophobicContact CE2-CZ3 3.83Å; Y606-W609 PolarHBondContact O-N 2.94Å; W609-N611 VanDerWaalsContact C-N 3.34Å; W609-N611 PolarHBondContact O-N 3.39Å; W609-E612 PolarHBondContact O-N 2.64Å; W609-N613 HydrophobicContact CZ2-CB 4.19Å; W609-N613 PolarHBondContact NE1-ND2 3.11Å; W609-N613 VanDerWaalsContact NE1-ND2 3.15Å; W609-N613 WeakPolarHBondContact O-CB 3.04Å; W609-N613 PolarHBondContact O-N 3.12Å; W609-I617 HydrophobicContact CH2-CD1 3.89Å; W609-I617 HydrophobicContact CZ2-CD1 4.24Å; W609-A634 HydrophobicContact CH2-CB 4.09Å; W609-A634 VanDerWaalsContact CH2-O 3.26Å; W609-A634 WeakPolarHBondContact CH2-O 3.33Å; W609-A634 HydrophobicContact CZ3-CB 3.91Å; W609-A634 VanDerWaalsContact CZ3-O 3.27Å; W609-A634 WeakPolarHBondContact CZ3-O 3.44Å; W609-I637 HydrophobicContact CH2-CB 3.79Å; W609-I637 HydrophobicContact CH2-CG2 3.81Å; W609-I637 HydrophobicContact CZ2-CB 4.01Å; W609-I637 HydrophobicContact CZ2-CG2 3.48Å; W609-I637 VanDerWaalsContact CZ2-CG2 3.48Å; W609-W638 HydrophobicContact CB-CE3 3.95Å; W609-W638 HydrophobicContact CB-CH2 4.29Å; W609-W638 HydrophobicContact CB-CZ3 3.46Å; W609-W638 VanDerWaalsContact CB-CZ3 3.46Å; W609-W638 AromaticContact CD2-CE3 3.52Å; W609-W638 HydrophobicContact CD2-CE3 3.52Å; W609-W638 AromaticContact CD2-CZ3 3.96Å; W609-W638 HydrophobicContact CD2-CZ3 3.96Å; W609-W638 HydrophobicContact CE3-CB 4.11Å; W609-W638 HydrophobicContact CE3-CD2 4.2Å; W609-W638 AromaticContact CE3-CE3 3.55Å; W609-W638 HydrophobicContact CE3-CE3 3.55Å; W609-W638 HydrophobicContact CE3-CG 4.47Å; W609-W638 HydrophobicContact CE3-CZ3 4.29Å; W609-W638 AromaticContact CG-CE3 3.68Å; W609-W638 HydrophobicContact CG-CE3 3.68Å; W609-W638 AromaticContact CG-CZ3 3.57Å; W609-W638 HydrophobicContact CG-CZ3 3.57Å; W609-W638 HydrophobicContact CH2-CB 4.28Å; W609-W638 HydrophobicContact CZ3-CB 3.76Å; W609-W638 HydrophobicContact CZ3-CE3 4.33Å; W609-M641 HydrophobicContact CD2-CE 4.2Å; W609-M641 VanDerWaalsContact CE2-CE 3.44Å; W609-M641 HydrophobicContact CG-CE 4.37Å; W609-M641 HydrophobicContact CZ2-CE 3.83Å; W609-Y649 HydrophobicContact CB-CD1 3.92Å; W609-Y649 HydrophobicContact CB-CD2 4.06Å; W609-Y649 HydrophobicContact CB-CE1 3.76Å; W609-Y649 HydrophobicContact CB-CE2 3.91Å; W609-Y649 HydrophobicContact CB-CG 4.08Å; W609-Y649 AromaticContact CD1-CE2 3.52Å; W609-Y649 AromaticContact CD1-CZ 3.58Å; W609-Y649 HydrophobicContact CG-CD2 4.5Å; W609-Y649 HydrophobicContact CG-CE2 4.05Å
610	F	91.4	Very high	88.4	Confident	22 Å²	22	78.5 Å²	78.5	10%	0.096	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-43.8	-179	179	-122.3	0	0	0	111	Y606 F607 E612 N613 R614 V630 A634	Y606-F610 VanDerWaalsContact O-CB 3.26Å; Y606-F610 WeakPolarHBondContact O-CB 3.09Å; Y606-F610 PolarHBondContact O-N 2.88Å; F607-F610 PolarHBondContact O-N 3.03Å; F610-E612 VanDerWaalsContact C-N 3.34Å; F610-E612 PolarHBondContact O-N 2.92Å; F610-N613 CarbonylContact O-C 3.55Å; F610-N613 PolarHBondContact O-N 3.31Å; F610-R614 HydrophobicContact CZ-CG 4.35Å; F610-R614 WeakPolarHBondContact O-CA 3.45Å; F610-R614 VanDerWaalsContact O-CB 3.28Å; F610-R614 WeakPolarHBondContact O-CB 3.35Å; F610-R614 PolarHBondContact O-N 3.03Å; F610-V630 HydrophobicContact CE2-CG1 4.1Å; F610-V630 HydrophobicContact CZ-CG1 4.3Å; F610-A634 HydrophobicContact CD2-CB 3.27Å; F610-A634 HydrophobicContact CE2-CB 3.33Å; F610-A634 HydrophobicContact CG-CB 4.42Å
611	N	89	Confident	88.2	Confident	93 Å²	93	76 Å²	76	50%	0.497	36%	0.363	S	S	.	.	H	α-helix	trans	-63.1	-38.4	177.7	-74.5	-12.3	0	0	0	112.6	F607 W609 N613	F607-N611 WeakPolarHBondContact O-CB 3.42Å; F607-N611 VanDerWaalsContact O-CG 3.26Å; F607-N611 PolarHBondContact O-N 3.12Å; F607-N611 PolarHBondContact O-ND2 3.44Å; W609-N611 VanDerWaalsContact C-N 3.34Å; W609-N611 PolarHBondContact O-N 3.39Å; N611-N613 VanDerWaalsContact C-N 3.34Å
612	E	90.7	Very high	87.6	Confident	92 Å²	92	69.7 Å²	69.7	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-70.8	-29.2	176.5	-70.8	178.6	-177.1	0	0	113.1	L608 W609 F610 Y649 R652	L608-E612 WeakPolarHBondContact O-CG 3.21Å; L608-E612 PolarHBondContact O-N 3.29Å; W609-E612 PolarHBondContact O-N 2.64Å; F610-E612 VanDerWaalsContact C-N 3.34Å; F610-E612 PolarHBondContact O-N 2.92Å; E612-Y649 VanDerWaalsContact OE2-CE1 3.3Å; E612-Y649 WeakPolarHBondContact OE2-CE1 3.48Å; E612-Y649 PolarHBondContact OE2-OH 3.28Å; E612-R652 IonicContact OE1-CZ 3.36Å; E612-R652 IonicContact OE1-NH1 3.65Å; E612-R652 PolarHBondContact OE1-NH1 3.47Å; E612-R652 IonicContact OE2-NH1 3.65Å
613	N	90.4	Very high	86.6	Confident	35 Å²	35	70.5 Å²	70.5	19%	0.187	37%	0.374	C	S	.	.	H	α-helix	trans	-105.7	-8.7	-173.2	-77.5	36.2	0	0	0	114.1	W609 F610 N611 E615 K616 I617	W609-N613 HydrophobicContact CZ2-CB 4.19Å; W609-N613 PolarHBondContact NE1-ND2 3.11Å; W609-N613 VanDerWaalsContact NE1-ND2 3.15Å; W609-N613 WeakPolarHBondContact O-CB 3.04Å; W609-N613 PolarHBondContact O-N 3.12Å; F610-N613 CarbonylContact O-C 3.55Å; F610-N613 PolarHBondContact O-N 3.31Å; N611-N613 VanDerWaalsContact C-N 3.34Å; N613-E615 VanDerWaalsContact C-N 3.32Å; N613-E615 PolarHBondContact O-N 3.25Å; N613-K616 WeakPolarHBondContact O-CB 3.3Å; N613-K616 PolarHBondContact O-N 2.95Å; N613-I617 HydrophobicContact CB-CD1 4.14Å; N613-I617 HydrophobicContact CB-CG1 4.48Å; N613-I617 WeakPolarHBondContact O-CG1 3.36Å; N613-I617 PolarHBondContact O-N 2.84Å
614	R	87.1	Confident	85.5	Confident	117 Å²	117	75.7 Å²	75.7	44%	0.442	40%	0.397	S	S	.	.	H	α-helix	trans	-51.8	-47.7	-175.5	-175.1	178.9	178	-172.7	0	112.4	F610 K616 I617 A618 V630	F610-R614 HydrophobicContact CZ-CG 4.35Å; F610-R614 WeakPolarHBondContact O-CA 3.45Å; F610-R614 VanDerWaalsContact O-CB 3.28Å; F610-R614 WeakPolarHBondContact O-CB 3.35Å; F610-R614 PolarHBondContact O-N 3.03Å; R614-K616 PolarHBondContact O-N 3.06Å; R614-I617 PolarHBondContact O-N 3.42Å; R614-A618 VanDerWaalsContact O-CB 3.3Å; R614-A618 WeakPolarHBondContact O-CB 3.36Å; R614-A618 PolarHBondContact O-N 2.95Å; R614-V630 HydrophobicContact CG-CG1 4.16Å
615	E	86.9	Confident	84.5	Confident	143 Å²	143	75.6 Å²	75.6	67%	0.668	39%	0.392	S	S	*	.	H	α-helix	trans	-65.5	-36.9	179	-67.5	-171.9	-176.8	0	0	112.9	N613 K619	N613-E615 VanDerWaalsContact C-N 3.32Å; N613-E615 PolarHBondContact O-N 3.25Å; E615-K619 WeakPolarHBondContact O-CB 3.42Å; E615-K619 WeakPolarHBondContact O-CG 3.3Å; E615-K619 PolarHBondContact O-N 3.18Å
616	K	87.8	Confident	83.9	Confident	129 Å²	129	78 Å²	78	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-68.5	-42.2	177.9	-64.6	175.3	-175.8	163.9	0	110.8	N613 R614 K619 N620	N613-K616 WeakPolarHBondContact O-CB 3.3Å; N613-K616 PolarHBondContact O-N 2.95Å; R614-K616 PolarHBondContact O-N 3.06Å; K616-K619 PolarHBondContact O-N 2.85Å; K616-N620 WeakPolarHBondContact O-CB 3.31Å; K616-N620 VanDerWaalsContact O-CG 3.25Å; K616-N620 PolarHBondContact O-N 3.34Å
617	I	87.6	Confident	83.5	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.036	43%	0.426	C	S	.	.	H	α-helix	trans	-66.1	-44.6	177.4	-62.5	169.6	0	0	0	109.8	W609 N613 R614 K619 N620 L621 V630 A633 A634 I637	W609-I617 HydrophobicContact CH2-CD1 3.89Å; W609-I617 HydrophobicContact CZ2-CD1 4.24Å; N613-I617 HydrophobicContact CB-CD1 4.14Å; N613-I617 HydrophobicContact CB-CG1 4.48Å; N613-I617 WeakPolarHBondContact O-CG1 3.36Å; N613-I617 PolarHBondContact O-N 2.84Å; R614-I617 PolarHBondContact O-N 3.42Å; I617-K619 PolarHBondContact O-N 3.44Å; I617-N620 PolarHBondContact O-N 3.18Å; I617-L621 HydrophobicContact CG2-CD1 3.85Å; I617-L621 WeakPolarHBondContact O-CG 3.3Å; I617-L621 PolarHBondContact O-N 3.15Å; I617-V630 HydrophobicContact CB-CG1 4.3Å; I617-V630 HydrophobicContact CG2-CG1 3.96Å; I617-A633 HydrophobicContact CG2-CB 3.83Å; I617-A634 HydrophobicContact CD1-CB 3.75Å; I617-I637 HydrophobicContact CD1-CD1 4.01Å; I617-I637 HydrophobicContact CG1-CD1 3.89Å
618	A	85.9	Confident	83.1	Confident	28 Å²	28	78.2 Å²	78.2	23%	0.231	43%	0.429	C	S	.	.	H	α-helix	trans	-60.3	-42.6	176.3	0	0	0	0	0	112.3	R614 L621 G622 G623 V630	R614-A618 VanDerWaalsContact O-CB 3.3Å; R614-A618 WeakPolarHBondContact O-CB 3.36Å; R614-A618 PolarHBondContact O-N 2.95Å; A618-L621 PolarHBondContact O-N 2.98Å; A618-G622 PolarHBondContact O-N 2.7Å; A618-G623 WeakPolarHBondContact O-CA 3.28Å; A618-G623 PolarHBondContact O-N 3.42Å; A618-V630 HydrophobicContact CB-CG2 4.24Å
619	K	86.8	Confident	82.8	Confident	152 Å²	152	81.4 Å²	81.4	66%	0.661	44%	0.443	S	S	*	.	H	α-helix	trans	-64.1	-45.1	174.9	-77.6	174.1	-179.3	169.3	0	112.4	E615 K616 I617 L621 G622	E615-K619 WeakPolarHBondContact O-CB 3.42Å; E615-K619 WeakPolarHBondContact O-CG 3.3Å; E615-K619 PolarHBondContact O-N 3.18Å; K616-K619 PolarHBondContact O-N 2.85Å; I617-K619 PolarHBondContact O-N 3.44Å; K619-L621 VanDerWaalsContact C-N 3.26Å; K619-L621 PolarHBondContact O-N 3.41Å; K619-G622 PolarHBondContact O-N 3.46Å; K619-G622 VanDerWaalsContact O-N 3.08Å
620	N	84.7	Confident	82.6	Confident	143 Å²	143	81.7 Å²	81.7	77%	0.765	45%	0.445	S	S	*	.	H	α-helix	trans	-64.9	-29.1	-179.9	-74.1	-10.3	0	0	0	113.2	K616 I617 G622	K616-N620 WeakPolarHBondContact O-CB 3.31Å; K616-N620 VanDerWaalsContact O-CG 3.25Å; K616-N620 PolarHBondContact O-N 3.34Å; I617-N620 PolarHBondContact O-N 3.18Å; N620-G622 VanDerWaalsContact C-N 3.32Å
621	L	79.4	Confident	82.4	Confident	72 Å²	72	82.4 Å²	82.4	38%	0.377	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-2.1	176	-68.3	166.5	0	0	0	113.3	I617 A618 K619 N625 V630 A633	I617-L621 HydrophobicContact CG2-CD1 3.85Å; I617-L621 WeakPolarHBondContact O-CG 3.3Å; I617-L621 PolarHBondContact O-N 3.15Å; A618-L621 PolarHBondContact O-N 2.98Å; K619-L621 VanDerWaalsContact C-N 3.26Å; K619-L621 PolarHBondContact O-N 3.41Å; L621-N625 HydrophobicContact CB-CB 4.44Å; L621-N625 WeakPolarHBondContact CB-ND2 3.42Å; L621-N625 PolarHBondContact O-ND2 2.96Å; L621-N625 PolarHBondContact O-OD1 3.35Å; L621-V630 HydrophobicContact CD1-CG2 4.27Å; L621-A633 HydrophobicContact CD1-CB 3.76Å; L621-A633 HydrophobicContact CD2-CB 4.34Å; L621-A633 HydrophobicContact CG-CB 4.46Å
622	G	74.4	Confident	82.4	Confident	62 Å²	62	85.5 Å²	85.5	64%	0.639	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	15.2	177.1	0	0	0	0	0	116.1	A618 K619 N620 Q624	A618-G622 PolarHBondContact O-N 2.7Å; K619-G622 PolarHBondContact O-N 3.46Å; K619-G622 VanDerWaalsContact O-N 3.08Å; N620-G622 VanDerWaalsContact C-N 3.32Å; G622-Q624 PolarHBondContact O-N 3.23Å
623	G	66.8	Low	82.3	Confident	56 Å²	56	82 Å²	82	58%	0.577	45%	0.451	S	S	*	.	S	Bend	trans	76.3	-21.3	167.2	0	0	0	0	0	116.7	A618	A618-G623 WeakPolarHBondContact O-CA 3.28Å; A618-G623 PolarHBondContact O-N 3.42Å
624	Q	62.1	Low	82.3	Confident	192 Å²	192	80.4 Å²	80.4	90%	0.897	44%	0.442	S	S	*	.			trans	-121.2	67.3	177.2	-69.8	-178.5	-28.7	0	0	110.8	G622	G622-Q624 PolarHBondContact O-N 3.23Å
625	N	69.4	Low	82.3	Confident	52 Å²	52	76.2 Å²	76.2	28%	0.278	44%	0.436	S	S	.	.			trans	-118	146.5	178.3	-62.9	-78.9	0	0	0	110.7	L621 E629 V630	L621-N625 HydrophobicContact CB-CB 4.44Å; L621-N625 WeakPolarHBondContact CB-ND2 3.42Å; L621-N625 PolarHBondContact O-ND2 2.96Å; L621-N625 PolarHBondContact O-OD1 3.35Å; N625-E629 HydrophobicContact CB-CB 4.18Å; N625-V630 HydrophobicContact CB-CG2 4.04Å
626	S	77.2	Confident	82.4	Confident	59 Å²	59	76 Å²	76	41%	0.413	43%	0.434	S	S	.	.			trans	-61.3	150.5	173.9	67.2	0	0	0	0	110.5	A628 E629 V630	S626-A628 PolarHBondContact O-N 3Å; S626-A628 VanDerWaalsContact O-N 3.1Å; S626-E629 PolarHBondContact N-OE2 3.12Å; S626-E629 PolarHBondContact O-N 2.71Å; S626-E629 VanDerWaalsContact OG-CD 3.3Å; S626-E629 VanDerWaalsContact OG-CG 3.31Å; S626-E629 WeakPolarHBondContact OG-CG 3.39Å; S626-E629 PolarHBondContact OG-N 3.31Å; S626-E629 PolarHBondContact OG-OE2 3.49Å; S626-V630 PolarHBondContact O-N 3.45Å; S626-V630 VanDerWaalsContact O-N 3.12Å
627	V	80.8	Confident	82.5	Confident	96 Å²	96	73.3 Å²	73.3	58%	0.582	43%	0.426	S	S	*	.	H	α-helix	trans	-52.9	-34.9	174.5	-179.4	0	0	0	0	110.9	V630 A631	V627-V630 PolarHBondContact O-N 2.98Å; V627-A631 VanDerWaalsContact O-CB 3.29Å; V627-A631 WeakPolarHBondContact O-CB 3.29Å; V627-A631 PolarHBondContact O-N 3.19Å
628	A	83.2	Confident	82.7	Confident	60 Å²	60	75.2 Å²	75.2	50%	0.496	43%	0.433	S	S	.	.	H	α-helix	trans	-64.9	-39.5	176.8	0	0	0	0	0	113.5	S626 K632	S626-A628 PolarHBondContact O-N 3Å; S626-A628 VanDerWaalsContact O-N 3.1Å; A628-K632 WeakPolarHBondContact O-CG 3.42Å; A628-K632 PolarHBondContact O-N 2.93Å
629	E	84.5	Confident	82.8	Confident	97 Å²	97	83.8 Å²	83.8	45%	0.453	46%	0.459	S	S	.	.	H	α-helix	trans	-70.4	-41.9	176.9	-75.4	159.9	154.7	0	0	111.7	N625 S626 A631 K632 A633	N625-E629 HydrophobicContact CB-CB 4.18Å; S626-E629 PolarHBondContact N-OE2 3.12Å; S626-E629 PolarHBondContact O-N 2.71Å; S626-E629 VanDerWaalsContact OG-CD 3.3Å; S626-E629 VanDerWaalsContact OG-CG 3.31Å; S626-E629 WeakPolarHBondContact OG-CG 3.39Å; S626-E629 PolarHBondContact OG-N 3.31Å; S626-E629 PolarHBondContact OG-OE2 3.49Å; E629-A631 VanDerWaalsContact C-N 3.3Å; E629-A631 PolarHBondContact O-N 2.98Å; E629-K632 PolarHBondContact O-N 3.43Å; E629-A633 PolarHBondContact O-N 3.5Å
630	V	88.5	Confident	83	Confident	8 Å²	8	82.9 Å²	82.9	5%	0.048	46%	0.461	C	S	.	.	H	α-helix	trans	-62.1	-41.1	175.1	179.9	0	0	0	0	110.5	F610 R614 I617 A618 L621 N625 S626 V627 A634	F610-V630 HydrophobicContact CE2-CG1 4.1Å; F610-V630 HydrophobicContact CZ-CG1 4.3Å; R614-V630 HydrophobicContact CG-CG1 4.16Å; I617-V630 HydrophobicContact CB-CG1 4.3Å; I617-V630 HydrophobicContact CG2-CG1 3.96Å; A618-V630 HydrophobicContact CB-CG2 4.24Å; L621-V630 HydrophobicContact CD1-CG2 4.27Å; N625-V630 HydrophobicContact CB-CG2 4.04Å; S626-V630 PolarHBondContact O-N 3.45Å; S626-V630 VanDerWaalsContact O-N 3.12Å; V627-V630 PolarHBondContact O-N 2.98Å; V630-A634 VanDerWaalsContact O-CB 3.3Å; V630-A634 WeakPolarHBondContact O-CB 3.12Å; V630-A634 PolarHBondContact O-N 3.02Å
631	A	87.5	Confident	83.1	Confident	38 Å²	38	77.9 Å²	77.9	31%	0.314	43%	0.434	S	S	.	.	H	α-helix	trans	-65.8	-41.6	176.4	0	0	0	0	0	112.7	V627 E629 A634 G635	V627-A631 VanDerWaalsContact O-CB 3.29Å; V627-A631 WeakPolarHBondContact O-CB 3.29Å; V627-A631 PolarHBondContact O-N 3.19Å; E629-A631 VanDerWaalsContact C-N 3.3Å; E629-A631 PolarHBondContact O-N 2.98Å; A631-A634 PolarHBondContact O-N 3.09Å; A631-G635 PolarHBondContact O-N 2.85Å
632	K	88.1	Confident	83.4	Confident	158 Å²	158	80.1 Å²	80.1	69%	0.687	45%	0.446	S	S	*	.	H	α-helix	trans	-62	-48	175.2	-79.7	178.4	-178.4	174.5	0	112	A628 E629 A634 G635 E636	A628-K632 WeakPolarHBondContact O-CG 3.42Å; A628-K632 PolarHBondContact O-N 2.93Å; E629-K632 PolarHBondContact O-N 3.43Å; K632-A634 VanDerWaalsContact C-N 3.29Å; K632-A634 PolarHBondContact O-N 2.97Å; K632-G635 PolarHBondContact O-N 3.45Å; K632-E636 PolarHBondContact O-N 3.31Å
633	A	88.3	Confident	83.8	Confident	19 Å²	19	81.8 Å²	81.8	16%	0.157	45%	0.448	C	S	.	.	H	α-helix	trans	-62.4	-38.2	177.3	0	0	0	0	0	111.9	I617 L621 E629 E636 I637	I617-A633 HydrophobicContact CG2-CB 3.83Å; L621-A633 HydrophobicContact CD1-CB 3.76Å; L621-A633 HydrophobicContact CD2-CB 4.34Å; L621-A633 HydrophobicContact CG-CB 4.46Å; E629-A633 PolarHBondContact O-N 3.5Å; A633-E636 PolarHBondContact O-N 2.86Å; A633-I637 VanDerWaalsContact O-CG1 3.3Å; A633-I637 WeakPolarHBondContact O-CG1 3.42Å; A633-I637 PolarHBondContact O-N 3.05Å
634	A	90.5	Very high	84.7	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-63	-42.5	174.7	0	0	0	0	0	112.9	W609 F610 I617 V630 A631 K632 E636 I637 W638	W609-A634 HydrophobicContact CH2-CB 4.09Å; W609-A634 VanDerWaalsContact CH2-O 3.26Å; W609-A634 WeakPolarHBondContact CH2-O 3.33Å; W609-A634 HydrophobicContact CZ3-CB 3.91Å; W609-A634 VanDerWaalsContact CZ3-O 3.27Å; W609-A634 WeakPolarHBondContact CZ3-O 3.44Å; F610-A634 HydrophobicContact CD2-CB 3.27Å; F610-A634 HydrophobicContact CE2-CB 3.33Å; F610-A634 HydrophobicContact CG-CB 4.42Å; I617-A634 HydrophobicContact CD1-CB 3.75Å; V630-A634 VanDerWaalsContact O-CB 3.3Å; V630-A634 WeakPolarHBondContact O-CB 3.12Å; V630-A634 PolarHBondContact O-N 3.02Å; A631-A634 PolarHBondContact O-N 3.09Å; K632-A634 VanDerWaalsContact C-N 3.29Å; K632-A634 PolarHBondContact O-N 2.97Å; A634-E636 VanDerWaalsContact C-N 3.31Å; A634-E636 PolarHBondContact O-N 3.36Å; A634-I637 PolarHBondContact O-N 3.39Å; A634-W638 WeakPolarHBondContact O-CB 3.38Å; A634-W638 PolarHBondContact O-N 3.41Å
635	G	88.5	Confident	85.8	Confident	30 Å²	30	76.9 Å²	76.9	31%	0.309	42%	0.424	S	S	.	.	H	α-helix	trans	-58.6	-41.8	175.7	0	0	0	0	0	112.7	A631 K632 R639	A631-G635 PolarHBondContact O-N 2.85Å; K632-G635 PolarHBondContact O-N 3.45Å; G635-R639 WeakPolarHBondContact O-CB 3.49Å; G635-R639 PolarHBondContact O-N 3.22Å
636	E	88.7	Confident	86.7	Confident	137 Å²	137	77.4 Å²	77.4	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-67.2	-44.4	176.8	-70.9	-175.6	174	0	0	112.7	K632 A633 A634 R639 N640	K632-E636 PolarHBondContact O-N 3.31Å; A633-E636 PolarHBondContact O-N 2.86Å; A634-E636 VanDerWaalsContact C-N 3.31Å; A634-E636 PolarHBondContact O-N 3.36Å; E636-R639 PolarHBondContact O-N 3.28Å; E636-N640 PolarHBondContact O-N 3.12Å; E636-N640 VanDerWaalsContact O-N 3.13Å; E636-N640 PolarHBondContact O-ND2 2.76Å
637	I	90.1	Very high	87.3	Confident	74 Å²	74	77.8 Å²	77.8	38%	0.379	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-43.6	177.7	-63.3	162.2	0	0	0	110.5	W609 I617 A633 A634 R639 N640 M641	W609-I637 HydrophobicContact CH2-CB 3.79Å; W609-I637 HydrophobicContact CH2-CG2 3.81Å; W609-I637 HydrophobicContact CZ2-CB 4.01Å; W609-I637 HydrophobicContact CZ2-CG2 3.48Å; W609-I637 VanDerWaalsContact CZ2-CG2 3.48Å; I617-I637 HydrophobicContact CD1-CD1 4.01Å; I617-I637 HydrophobicContact CG1-CD1 3.89Å; A633-I637 VanDerWaalsContact O-CG1 3.3Å; A633-I637 WeakPolarHBondContact O-CG1 3.42Å; A633-I637 PolarHBondContact O-N 3.05Å; A634-I637 PolarHBondContact O-N 3.39Å; I637-R639 PolarHBondContact O-N 3.04Å; I637-N640 PolarHBondContact O-N 3.07Å; I637-M641 HydrophobicContact CG2-CE 4.33Å; I637-M641 WeakPolarHBondContact O-CB 3.4Å; I637-M641 PolarHBondContact O-N 3.1Å
638	W	90.7	Very high	87.7	Confident	47 Å²	47	76.1 Å²	76.1	18%	0.178	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-42.1	177.1	-176.4	-108.4	0	0	0	111.7	A605 Y606 W609 A634 N640 M641 K646 Y649	A605-W638 HydrophobicContact CB-CH2 4.04Å; A605-W638 HydrophobicContact CB-CZ2 4.05Å; Y606-W638 HydrophobicContact CD2-CB 3.75Å; Y606-W638 AromaticContact CD2-CD1 3.65Å; Y606-W638 AromaticContact CD2-CD2 3.84Å; Y606-W638 HydrophobicContact CD2-CD2 3.84Å; Y606-W638 HydrophobicContact CD2-CE3 4.5Å; Y606-W638 AromaticContact CD2-CG 3.48Å; Y606-W638 HydrophobicContact CD2-CG 3.48Å; Y606-W638 VanDerWaalsContact CD2-CG 3.48Å; Y606-W638 HydrophobicContact CE2-CB 3.82Å; Y606-W638 HydrophobicContact CE2-CG 4.08Å; W609-W638 HydrophobicContact CB-CE3 3.95Å; W609-W638 HydrophobicContact CB-CH2 4.29Å; W609-W638 HydrophobicContact CB-CZ3 3.46Å; W609-W638 VanDerWaalsContact CB-CZ3 3.46Å; W609-W638 AromaticContact CD2-CE3 3.52Å; W609-W638 HydrophobicContact CD2-CE3 3.52Å; W609-W638 AromaticContact CD2-CZ3 3.96Å; W609-W638 HydrophobicContact CD2-CZ3 3.96Å; W609-W638 HydrophobicContact CE3-CB 4.11Å; W609-W638 HydrophobicContact CE3-CD2 4.2Å; W609-W638 AromaticContact CE3-CE3 3.55Å; W609-W638 HydrophobicContact CE3-CE3 3.55Å; W609-W638 HydrophobicContact CE3-CG 4.47Å; W609-W638 HydrophobicContact CE3-CZ3 4.29Å; W609-W638 AromaticContact CG-CE3 3.68Å; W609-W638 HydrophobicContact CG-CE3 3.68Å; W609-W638 AromaticContact CG-CZ3 3.57Å; W609-W638 HydrophobicContact CG-CZ3 3.57Å; W609-W638 HydrophobicContact CH2-CB 4.28Å; W609-W638 HydrophobicContact CZ3-CB 3.76Å; W609-W638 HydrophobicContact CZ3-CE3 4.33Å; A634-W638 WeakPolarHBondContact O-CB 3.38Å; A634-W638 PolarHBondContact O-N 3.41Å; W638-N640 VanDerWaalsContact C-N 3.26Å; W638-N640 PolarHBondContact O-N 3.09Å; W638-M641 HydrophobicContact CE3-CE 4.35Å; W638-M641 HydrophobicContact CE3-SD 4.07Å; W638-M641 HydrophobicContact CZ3-SD 4.05Å; W638-M641 PolarHBondContact O-N 3.42Å; W638-K646 HydrophobicContact CH2-CG 4.11Å; W638-K646 HydrophobicContact CZ2-CG 4.13Å; W638-K646 HydrophobicContact CZ3-CG 4.38Å; W638-K646 WeakPolarHBondContact O-CE 3.38Å; W638-K646 PolarHBondContact O-NZ 3.47Å; W638-Y649 HydrophobicContact CH2-CD2 4.33Å; W638-Y649 HydrophobicContact CH2-CG 4.39Å; W638-Y649 HydrophobicContact CZ3-CD2 4.06Å; W638-Y649 HydrophobicContact CZ3-CG 4.44Å
639	R	89.4	Confident	88.1	Confident	207 Å²	207	74.6 Å²	74.6	78%	0.781	40%	0.401	S	S	*	.	H	α-helix	trans	-59.7	-39.5	178.3	-166.3	173.5	-176.5	171.4	2	111.7	G635 E636 I637 K646	G635-R639 WeakPolarHBondContact O-CB 3.49Å; G635-R639 PolarHBondContact O-N 3.22Å; E636-R639 PolarHBondContact O-N 3.28Å; I637-R639 PolarHBondContact O-N 3.04Å; R639-K646 PolarHBondContact O-NZ 2.99Å
640	N	89.9	Confident	88.3	Confident	134 Å²	134	73.8 Å²	73.8	72%	0.717	40%	0.397	S	S	*	.	H	α-helix	trans	-89.8	-1.8	-177.8	-66.4	-22.5	0	0	0	115.1	E636 I637 W638	E636-N640 PolarHBondContact O-N 3.12Å; E636-N640 VanDerWaalsContact O-N 3.13Å; E636-N640 PolarHBondContact O-ND2 2.76Å; I637-N640 PolarHBondContact O-N 3.07Å; W638-N640 VanDerWaalsContact C-N 3.26Å; W638-N640 PolarHBondContact O-N 3.09Å
641	M	86.8	Confident	88.3	Confident	38 Å²	38	76.3 Å²	76.3	19%	0.187	42%	0.415	C	S	.	.	S	Bend	trans	-72.6	140.6	179.4	-175.4	175.8	-63.3	0	0	112.4	W609 I637 W638 A645 K646	W609-M641 HydrophobicContact CD2-CE 4.2Å; W609-M641 VanDerWaalsContact CE2-CE 3.44Å; W609-M641 HydrophobicContact CG-CE 4.37Å; W609-M641 HydrophobicContact CZ2-CE 3.83Å; I637-M641 HydrophobicContact CG2-CE 4.33Å; I637-M641 WeakPolarHBondContact O-CB 3.4Å; I637-M641 PolarHBondContact O-N 3.1Å; W638-M641 HydrophobicContact CE3-CE 4.35Å; W638-M641 HydrophobicContact CE3-SD 4.07Å; W638-M641 HydrophobicContact CZ3-SD 4.05Å; W638-M641 PolarHBondContact O-N 3.42Å; M641-A645 HydrophobicContact CG-CB 3.68Å; M641-A645 HydrophobicContact SD-CB 3.75Å; M641-K646 HydrophobicContact CB-CG 4.48Å; M641-K646 HydrophobicContact CG-CG 4.41Å; M641-K646 VanDerWaalsContact O-CE 3.27Å; M641-K646 WeakPolarHBondContact O-CE 3.45Å; M641-K646 PolarHBondContact O-NZ 3.05Å
642	D	86.8	Confident	88.5	Confident	119 Å²	119	79.7 Å²	79.7	64%	0.636	42%	0.42	S	S	*	.			trans	-58.2	149	179.3	-69.3	-36.1	0	0	0	113	T644 A645 K646	D642-T644 VanDerWaalsContact C-N 3.25Å; D642-T644 PolarHBondContact O-N 3.11Å; D642-A645 PolarHBondContact O-N 3.2Å; D642-K646 PolarHBondContact O-N 3.11Å; D642-K646 VanDerWaalsContact O-N 3.12Å
643	S	82.7	Confident	88.6	Confident	97 Å²	97	72.4 Å²	72.4	68%	0.678	39%	0.389	S	S	*	.	H	α-helix	trans	-59.9	-33.5	-178.8	59.9	0	0	0	0	113.1	S647	S643-S647 WeakPolarHBondContact O-CB 3.43Å; S643-S647 PolarHBondContact O-N 3.41Å
644	T	85.6	Confident	88.7	Confident	106 Å²	106	74.7 Å²	74.7	65%	0.65	40%	0.398	S	S	*	.	H	α-helix	trans	-65.3	-43.3	177.6	50.1	0	0	0	0	112.1	D642 S647 S648	D642-T644 VanDerWaalsContact C-N 3.25Å; D642-T644 PolarHBondContact O-N 3.11Å; T644-S647 PolarHBondContact O-N 3.33Å; T644-S648 PolarHBondContact O-N 2.69Å
645	A	85.2	Confident	88.7	Confident	39 Å²	39	81.1 Å²	81.1	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-68.2	-42.8	177.4	0	0	0	0	0	111.5	M641 D642 S647 S648 Y649	M641-A645 HydrophobicContact CG-CB 3.68Å; M641-A645 HydrophobicContact SD-CB 3.75Å; D642-A645 PolarHBondContact O-N 3.2Å; A645-S647 VanDerWaalsContact C-N 3.3Å; A645-S647 PolarHBondContact O-N 3.48Å; A645-S648 PolarHBondContact O-N 2.97Å; A645-Y649 WeakPolarHBondContact O-CD2 3.37Å
646	K	88.7	Confident	88.8	Confident	62 Å²	62	83 Å²	83	27%	0.27	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-40.4	173.1	-72.4	177.6	177.4	160.9	0	112.3	W638 R639 M641 D642 S648 Y649 Q650	W638-K646 HydrophobicContact CH2-CG 4.11Å; W638-K646 HydrophobicContact CZ2-CG 4.13Å; W638-K646 HydrophobicContact CZ3-CG 4.38Å; W638-K646 WeakPolarHBondContact O-CE 3.38Å; W638-K646 PolarHBondContact O-NZ 3.47Å; R639-K646 PolarHBondContact O-NZ 2.99Å; M641-K646 HydrophobicContact CB-CG 4.48Å; M641-K646 HydrophobicContact CG-CG 4.41Å; M641-K646 VanDerWaalsContact O-CE 3.27Å; M641-K646 WeakPolarHBondContact O-CE 3.45Å; M641-K646 PolarHBondContact O-NZ 3.05Å; D642-K646 PolarHBondContact O-N 3.11Å; D642-K646 VanDerWaalsContact O-N 3.12Å; K646-S648 VanDerWaalsContact C-N 3.31Å; K646-S648 PolarHBondContact O-N 3.15Å; K646-Y649 PolarHBondContact O-N 3.43Å; K646-Q650 PolarHBondContact O-N 2.96Å
647	S	87.9	Confident	88.9	Confident	67 Å²	67	81.2 Å²	81.2	47%	0.469	42%	0.421	S	S	.	.	H	α-helix	trans	-61.5	-36.7	178.2	-168.5	0	0	0	0	112.5	S643 T644 A645 Y649 Q650 S651	S643-S647 WeakPolarHBondContact O-CB 3.43Å; S643-S647 PolarHBondContact O-N 3.41Å; T644-S647 PolarHBondContact O-N 3.33Å; A645-S647 VanDerWaalsContact C-N 3.3Å; A645-S647 PolarHBondContact O-N 3.48Å; S647-Y649 VanDerWaalsContact C-N 3.31Å; S647-Y649 PolarHBondContact O-N 3.05Å; S647-Q650 PolarHBondContact O-N 3.39Å; S647-S651 PolarHBondContact O-N 3.15Å; S647-S651 PolarHBondContact O-OG 3.34Å
648	S	90.2	Very high	88.9	Confident	61 Å²	61	84.5 Å²	84.5	43%	0.427	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-37.5	176.7	-175.9	0	0	0	0	112.3	T644 A645 K646 R652	T644-S648 PolarHBondContact O-N 2.69Å; A645-S648 PolarHBondContact O-N 2.97Å; K646-S648 VanDerWaalsContact C-N 3.31Å; K646-S648 PolarHBondContact O-N 3.15Å; S648-R652 PolarHBondContact O-N 2.67Å
649	Y	91.3	Very high	88.8	Confident	29 Å²	29	88.6 Å²	88.6	11%	0.114	45%	0.451	C	S	.	.	H	α-helix	trans	-72.3	-37.6	174.9	-74.8	-75.7	0	0	0	111.4	L608 W609 E612 W638 A645 K646 S647 S651 R652 V653	L608-Y649 HydrophobicContact CB-CD1 4.15Å; W609-Y649 HydrophobicContact CB-CD1 3.92Å; W609-Y649 HydrophobicContact CB-CD2 4.06Å; W609-Y649 HydrophobicContact CB-CE1 3.76Å; W609-Y649 HydrophobicContact CB-CE2 3.91Å; W609-Y649 HydrophobicContact CB-CG 4.08Å; W609-Y649 AromaticContact CD1-CE2 3.52Å; W609-Y649 AromaticContact CD1-CZ 3.58Å; W609-Y649 HydrophobicContact CG-CD2 4.5Å; W609-Y649 HydrophobicContact CG-CE2 4.05Å; E612-Y649 VanDerWaalsContact OE2-CE1 3.3Å; E612-Y649 WeakPolarHBondContact OE2-CE1 3.48Å; E612-Y649 PolarHBondContact OE2-OH 3.28Å; W638-Y649 HydrophobicContact CH2-CD2 4.33Å; W638-Y649 HydrophobicContact CH2-CG 4.39Å; W638-Y649 HydrophobicContact CZ3-CD2 4.06Å; W638-Y649 HydrophobicContact CZ3-CG 4.44Å; A645-Y649 WeakPolarHBondContact O-CD2 3.37Å; K646-Y649 PolarHBondContact O-N 3.43Å; S647-Y649 VanDerWaalsContact C-N 3.31Å; S647-Y649 PolarHBondContact O-N 3.05Å; Y649-S651 PolarHBondContact O-N 3.44Å; Y649-R652 PolarHBondContact O-N 3.16Å; Y649-V653 WeakPolarHBondContact O-CG2 3.45Å; Y649-V653 PolarHBondContact O-N 3.38Å
650	Q	88.2	Confident	88.8	Confident	80 Å²	80	81 Å²	81	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-61.1	-42.9	175.4	-168.8	57.9	47.1	0	0	112.1	K646 S647 R652 V653 D654	K646-Q650 PolarHBondContact O-N 2.96Å; S647-Q650 PolarHBondContact O-N 3.39Å; Q650-R652 VanDerWaalsContact C-N 3.33Å; Q650-R652 PolarHBondContact O-N 2.82Å; Q650-V653 WeakPolarHBondContact O-CB 3.44Å; Q650-V653 PolarHBondContact O-N 3.47Å; Q650-V653 VanDerWaalsContact O-N 3.13Å; Q650-D654 PolarHBondContact NE2-OD1 2.88Å; Q650-D654 VanDerWaalsContact O-CG 3.25Å; Q650-D654 PolarHBondContact O-N 3.05Å
651	S	90.2	Very high	88.7	Confident	61 Å²	61	80.9 Å²	80.9	43%	0.427	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-38.4	175.9	-58.9	0	0	0	0	112.8	S647 Y649 D654 E655	S647-S651 PolarHBondContact O-N 3.15Å; S647-S651 PolarHBondContact O-OG 3.34Å; Y649-S651 PolarHBondContact O-N 3.44Å; S651-D654 PolarHBondContact O-N 3.39Å; S651-E655 PolarHBondContact O-N 2.92Å; S651-E655 VanDerWaalsContact O-N 3.08Å
652	R	90.7	Very high	88.8	Confident	108 Å²	108	82.8 Å²	82.8	41%	0.408	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-39.1	173.4	-69.9	-176.2	-172.5	171.5	4.2	112.1	L608 E612 S648 Y649 Q650 D654 E655 L656	L608-R652 HydrophobicContact CD1-CB 4.42Å; E612-R652 IonicContact OE1-CZ 3.36Å; E612-R652 IonicContact OE1-NH1 3.65Å; E612-R652 PolarHBondContact OE1-NH1 3.47Å; E612-R652 IonicContact OE2-NH1 3.65Å; S648-R652 PolarHBondContact O-N 2.67Å; Y649-R652 PolarHBondContact O-N 3.16Å; Q650-R652 VanDerWaalsContact C-N 3.33Å; Q650-R652 PolarHBondContact O-N 2.82Å; R652-D654 VanDerWaalsContact C-N 3.3Å; R652-D654 PolarHBondContact O-N 2.77Å; R652-E655 PolarHBondContact O-N 3.44Å; R652-L656 WeakPolarHBondContact O-CG 3.45Å; R652-L656 PolarHBondContact O-N 2.7Å
653	V	91.2	Very high	88.9	Confident	6 Å²	6	80.3 Å²	80.3	4%	0.036	41%	0.414	C	S	.	.	H	α-helix	trans	-60.6	-42.4	173.4	173.8	0	0	0	0	110.6	A605 L608 Y649 Q650 E655 L656 K657	A605-V653 HydrophobicContact CB-CG2 3.87Å; L608-V653 HydrophobicContact CD1-CG2 3.55Å; Y649-V653 WeakPolarHBondContact O-CG2 3.45Å; Y649-V653 PolarHBondContact O-N 3.38Å; Q650-V653 WeakPolarHBondContact O-CB 3.44Å; Q650-V653 PolarHBondContact O-N 3.47Å; Q650-V653 VanDerWaalsContact O-N 3.13Å; V653-E655 PolarHBondContact O-N 2.98Å; V653-L656 PolarHBondContact O-N 2.74Å; V653-K657 HydrophobicContact CG1-CD 4.13Å; V653-K657 HydrophobicContact CG1-CG 4.28Å; V653-K657 WeakPolarHBondContact O-CB 3.03Å; V653-K657 WeakPolarHBondContact O-CG 3.38Å; V653-K657 PolarHBondContact O-N 3.25Å
654	D	89.1	Confident	89.1	Confident	66 Å²	66	78 Å²	78	35%	0.353	39%	0.393	S	S	.	.	H	α-helix	trans	-67.1	-35.9	-178.7	-62.5	-22.4	0	0	0	112.1	Q650 S651 R652 K658	Q650-D654 PolarHBondContact NE2-OD1 2.88Å; Q650-D654 VanDerWaalsContact O-CG 3.25Å; Q650-D654 PolarHBondContact O-N 3.05Å; S651-D654 PolarHBondContact O-N 3.39Å; R652-D654 VanDerWaalsContact C-N 3.3Å; R652-D654 PolarHBondContact O-N 2.77Å; D654-K658 WeakPolarHBondContact O-CG 3.01Å; D654-K658 PolarHBondContact O-N 3.22Å; D654-K658 VanDerWaalsContact O-N 3.12Å
655	E	91.1	Very high	89.2	Confident	135 Å²	135	80.3 Å²	80.3	63%	0.631	39%	0.39	S	S	*	.	H	α-helix	trans	-65.3	-44.8	170.9	-72.9	177.8	-177.6	0	0	112.2	S651 R652 V653 K657 K658 K659	S651-E655 PolarHBondContact O-N 2.92Å; S651-E655 VanDerWaalsContact O-N 3.08Å; R652-E655 PolarHBondContact O-N 3.44Å; V653-E655 PolarHBondContact O-N 2.98Å; E655-K657 VanDerWaalsContact C-N 3.33Å; E655-K657 PolarHBondContact O-N 2.91Å; E655-K658 WeakPolarHBondContact O-CB 3.3Å; E655-K658 PolarHBondContact O-N 2.86Å; E655-K659 PolarHBondContact O-N 3.1Å
656	L	90.4	Very high	89.2	Confident	71 Å²	71	82 Å²	82	37%	0.372	39%	0.393	S	S	.	.	H	α-helix	trans	-64.9	-36.2	176.8	-69.6	171.9	0	0	0	112.1	P602 L608 R652 V653 K659 Y660	P602-L656 HydrophobicContact CB-CB 3.75Å; L608-L656 HydrophobicContact CD1-CD1 3.95Å; L608-L656 HydrophobicContact CD2-CD1 4.08Å; R652-L656 WeakPolarHBondContact O-CG 3.45Å; R652-L656 PolarHBondContact O-N 2.7Å; V653-L656 PolarHBondContact O-N 2.74Å; L656-K659 PolarHBondContact O-N 2.94Å; L656-Y660 WeakPolarHBondContact O-CB 3.49Å; L656-Y660 PolarHBondContact O-N 2.8Å
657	K	90.1	Very high	89.1	Confident	98 Å²	98	81.4 Å²	81.4	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-61.8	-42.3	172.6	-79.6	178.9	176.7	-179	0	111.9	P602 V653 E655 Y660 Q661	P602-K657 HydrophobicContact CG-CG 3.73Å; V653-K657 HydrophobicContact CG1-CD 4.13Å; V653-K657 HydrophobicContact CG1-CG 4.28Å; V653-K657 WeakPolarHBondContact O-CB 3.03Å; V653-K657 WeakPolarHBondContact O-CG 3.38Å; V653-K657 PolarHBondContact O-N 3.25Å; E655-K657 VanDerWaalsContact C-N 3.33Å; E655-K657 PolarHBondContact O-N 2.91Å; K657-Y660 PolarHBondContact O-N 2.72Å; K657-Q661 WeakPolarHBondContact O-CG 3.45Å; K657-Q661 PolarHBondContact O-N 2.85Å
658	K	90.3	Very high	88.9	Confident	143 Å²	143	84.3 Å²	84.3	62%	0.622	40%	0.395	S	S	*	.	H	α-helix	trans	-62.8	-43.5	175.8	-72.6	171.6	-175.9	173.6	0	111.7	D654 E655 Q661 E662	D654-K658 WeakPolarHBondContact O-CG 3.01Å; D654-K658 PolarHBondContact O-N 3.22Å; D654-K658 VanDerWaalsContact O-N 3.12Å; E655-K658 WeakPolarHBondContact O-CB 3.3Å; E655-K658 PolarHBondContact O-N 2.86Å; K658-Q661 PolarHBondContact O-N 2.91Å; K658-E662 PolarHBondContact O-N 3.46Å
659	K	89.9	Confident	88.5	Confident	134 Å²	134	84.8 Å²	84.8	58%	0.583	40%	0.399	S	S	*	.	H	α-helix	trans	-63.6	-44.8	176.7	-167.9	179.5	178.2	-177	0	111.7	E655 L656 Q661 E662 D663	E655-K659 PolarHBondContact O-N 3.1Å; L656-K659 PolarHBondContact O-N 2.94Å; K659-Q661 VanDerWaalsContact C-N 3.34Å; K659-Q661 PolarHBondContact O-N 3.49Å; K659-E662 PolarHBondContact O-N 3.03Å; K659-D663 PolarHBondContact O-N 3.02Å
660	Y	89.5	Confident	87.9	Confident	47 Å²	47	88 Å²	88	18%	0.184	42%	0.418	C	S	.	.	H	α-helix	trans	-58.2	-42.7	175.7	174.2	-108.5	0	0	0	112.8	P599 T600 R601 L656 K657 E662 D663 L664	P599-Y660 HydrophobicContact CB-CD2 4.05Å; P599-Y660 HydrophobicContact CB-CE2 3.99Å; P599-Y660 HydrophobicContact CG-CE2 4.25Å; P599-Y660 WeakPolarHBondContact O-CE2 3.28Å; T600-Y660 WeakPolarHBondContact O-CD2 3.29Å; T600-Y660 WeakPolarHBondContact O-CE2 3.4Å; R601-Y660 HydrophobicContact CG-CE1 4.23Å; R601-Y660 HydrophobicContact CG-CE2 4.19Å; R601-Y660 WeakPolarHBondContact CG-OH 3.16Å; L656-Y660 WeakPolarHBondContact O-CB 3.49Å; L656-Y660 PolarHBondContact O-N 2.8Å; K657-Y660 PolarHBondContact O-N 2.72Å; Y660-E662 VanDerWaalsContact C-N 3.33Å; Y660-E662 PolarHBondContact O-N 3.24Å; Y660-D663 PolarHBondContact O-N 3.41Å; Y660-L664 HydrophobicContact CE1-CD1 3.82Å; Y660-L664 HydrophobicContact CE2-CD1 4.04Å; Y660-L664 VanDerWaalsContact CZ-CD1 3.42Å; Y660-L664 WeakPolarHBondContact O-CB 3.23Å; Y660-L664 PolarHBondContact O-N 3.06Å; Y660-L664 WeakPolarHBondContact OH-CD1 3.44Å
661	Q	87.1	Confident	87.1	Confident	131 Å²	131	88.7 Å²	88.7	61%	0.612	42%	0.424	S	S	*	.	H	α-helix	trans	-63.2	-38.8	177.2	-75	175	-2.4	0	0	112.5	K657 K658 K659 R665	K657-Q661 WeakPolarHBondContact O-CG 3.45Å; K657-Q661 PolarHBondContact O-N 2.85Å; K658-Q661 PolarHBondContact O-N 2.91Å; K659-Q661 VanDerWaalsContact C-N 3.34Å; K659-Q661 PolarHBondContact O-N 3.49Å; Q661-R665 WeakPolarHBondContact O-CB 3.48Å; Q661-R665 PolarHBondContact O-N 2.97Å
662	E	89.4	Confident	85.6	Confident	79 Å²	79	89 Å²	89	37%	0.369	44%	0.436	S	S	.	.	H	α-helix	trans	-67.9	-46.8	175.7	-176.8	58.9	-166.1	0	0	111.6	K658 K659 Y660 L664 R665 I666	K658-E662 PolarHBondContact O-N 3.46Å; K659-E662 PolarHBondContact O-N 3.03Å; Y660-E662 VanDerWaalsContact C-N 3.33Å; Y660-E662 PolarHBondContact O-N 3.24Å; E662-L664 VanDerWaalsContact C-N 3.27Å; E662-L664 PolarHBondContact O-N 3.09Å; E662-R665 VanDerWaalsContact CD-NH2 3.32Å; E662-R665 WeakPolarHBondContact O-CB 3.5Å; E662-R665 PolarHBondContact O-N 2.76Å; E662-R665 VanDerWaalsContact O-N 3.15Å; E662-R665 IonicContact OE1-CZ 3.93Å; E662-R665 IonicContact OE1-NE 3.59Å; E662-R665 IonicContact OE1-NH2 2.79Å; E662-R665 PolarHBondContact OE1-NH2 2.97Å; E662-R665 IonicContact OE2-CZ 3.57Å; E662-R665 IonicContact OE2-NE 3.74Å; E662-R665 PolarHBondContact OE2-NE 3.43Å; E662-R665 IonicContact OE2-NH2 2.81Å; E662-R665 PolarHBondContact OE2-NH2 2.78Å; E662-I666 HydrophobicContact CG-CD1 4.25Å; E662-I666 WeakPolarHBondContact O-CG1 3.37Å; E662-I666 PolarHBondContact O-N 3.34Å
663	D	88	Confident	83.8	Confident	67 Å²	67	87.9 Å²	87.9	36%	0.358	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-38.4	177.4	-65.9	-21.3	0	0	0	111.2	P599 K659 Y660 I666 Y667	P599-D663 HydrophobicContact CB-CB 3.89Å; P599-D663 HydrophobicContact CG-CB 4.32Å; K659-D663 PolarHBondContact O-N 3.02Å; Y660-D663 PolarHBondContact O-N 3.41Å; D663-I666 PolarHBondContact O-N 2.95Å; D663-Y667 WeakPolarHBondContact O-CB 3.42Å; D663-Y667 PolarHBondContact O-N 3.05Å
664	L	88	Confident	81.8	Confident	47 Å²	47	94.7 Å²	94.7	25%	0.246	48%	0.481	C	S	.	.	H	α-helix	trans	-68.5	-35.2	177.3	-166.2	136	0	0	0	112.3	P599 Y660 E662 Q668	P599-L664 HydrophobicContact CG-CB 3.98Å; P599-L664 HydrophobicContact CG-CD1 4.45Å; P599-L664 HydrophobicContact CG-CG 4.41Å; Y660-L664 HydrophobicContact CE1-CD1 3.82Å; Y660-L664 HydrophobicContact CE2-CD1 4.04Å; Y660-L664 VanDerWaalsContact CZ-CD1 3.42Å; Y660-L664 WeakPolarHBondContact O-CB 3.23Å; Y660-L664 PolarHBondContact O-N 3.06Å; Y660-L664 WeakPolarHBondContact OH-CD1 3.44Å; E662-L664 VanDerWaalsContact C-N 3.27Å; E662-L664 PolarHBondContact O-N 3.09Å; L664-Q668 HydrophobicContact CD2-CG 4.35Å; L664-Q668 VanDerWaalsContact CD2-NE2 3.28Å; L664-Q668 WeakPolarHBondContact O-CB 3.45Å; L664-Q668 VanDerWaalsContact O-CG 3.25Å; L664-Q668 WeakPolarHBondContact O-CG 3.43Å; L664-Q668 PolarHBondContact O-N 3.08Å
665	R	87.3	Confident	79.3	Confident	156 Å²	156	100.7 Å²	100.7	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-44.1	172.9	-171.2	176.6	71.8	128.3	5	111.6	Q661 E662 Q668 S669	Q661-R665 WeakPolarHBondContact O-CB 3.48Å; Q661-R665 PolarHBondContact O-N 2.97Å; E662-R665 VanDerWaalsContact CD-NH2 3.32Å; E662-R665 WeakPolarHBondContact O-CB 3.5Å; E662-R665 PolarHBondContact O-N 2.76Å; E662-R665 VanDerWaalsContact O-N 3.15Å; E662-R665 IonicContact OE1-CZ 3.93Å; E662-R665 IonicContact OE1-NE 3.59Å; E662-R665 IonicContact OE1-NH2 2.79Å; E662-R665 PolarHBondContact OE1-NH2 2.97Å; E662-R665 IonicContact OE2-CZ 3.57Å; E662-R665 IonicContact OE2-NE 3.74Å; E662-R665 PolarHBondContact OE2-NE 3.43Å; E662-R665 IonicContact OE2-NH2 2.81Å; E662-R665 PolarHBondContact OE2-NH2 2.78Å; R665-Q668 PolarHBondContact O-N 3.33Å; R665-S669 PolarHBondContact O-N 2.89Å; R665-S669 PolarHBondContact O-OG 2.96Å
666	I	85.4	Confident	76.7	Confident	75 Å²	75	103.3 Å²	103.3	39%	0.385	52%	0.516	S	S	.	.	H	α-helix	trans	-64.8	-44	176.6	-64.6	166.7	0	0	0	110.8	E662 D663 S669 N670	E662-I666 HydrophobicContact CG-CD1 4.25Å; E662-I666 WeakPolarHBondContact O-CG1 3.37Å; E662-I666 PolarHBondContact O-N 3.34Å; D663-I666 PolarHBondContact O-N 2.95Å; I666-S669 WeakPolarHBondContact CA-OG 3.33Å; I666-S669 PolarHBondContact O-N 3.02Å; I666-S669 PolarHBondContact O-OG 3.16Å; I666-N670 PolarHBondContact O-N 3.21Å; I666-N670 VanDerWaalsContact O-N 3.1Å
667	Y	86.5	Confident	74.2	Confident	49 Å²	49	105.2 Å²	105.2	19%	0.192	53%	0.533	C	S	.	.	H	α-helix	trans	-61	-45.9	177	175.3	-101.8	0	0	0	111.8	D595 N597 A598 D663 S669 N670 L671	D595-Y667 WeakPolarHBondContact CB-OH 3.3Å; D595-Y667 VanDerWaalsContact CG-OH 3.25Å; D595-Y667 PolarHBondContact OD2-OH 2.81Å; N597-Y667 VanDerWaalsContact C-CE2 3.49Å; N597-Y667 HydrophobicContact CB-CD2 4.29Å; N597-Y667 HydrophobicContact CB-CE2 3.98Å; N597-Y667 WeakPolarHBondContact O-CD2 3.15Å; N597-Y667 WeakPolarHBondContact O-CE2 3.04Å; A598-Y667 HydrophobicContact CB-CE1 4.27Å; A598-Y667 HydrophobicContact CB-CE2 4.18Å; D663-Y667 WeakPolarHBondContact O-CB 3.42Å; D663-Y667 PolarHBondContact O-N 3.05Å; Y667-S669 PolarHBondContact O-N 2.87Å; Y667-N670 PolarHBondContact O-N 3.27Å; Y667-L671 HydrophobicContact CD1-CD1 4.12Å; Y667-L671 HydrophobicContact CD2-CD1 3.95Å; Y667-L671 HydrophobicContact CE1-CD1 3.7Å; Y667-L671 HydrophobicContact CE1-CD2 4.35Å; Y667-L671 HydrophobicContact CE2-CD1 3.52Å; Y667-L671 HydrophobicContact CG-CD1 4.24Å; Y667-L671 WeakPolarHBondContact O-CD1 3.3Å; Y667-L671 PolarHBondContact O-N 3.02Å; Y667-L671 VanDerWaalsContact O-N 3.15Å
668	Q	83.7	Confident	71.4	Confident	127 Å²	127	108.8 Å²	108.8	59%	0.593	56%	0.557	S	S	*	*	H	α-helix	trans	-63.3	-37.2	176.8	-75.9	177.6	-8.9	0	0	112.9	L664 R665	L664-Q668 HydrophobicContact CD2-CG 4.35Å; L664-Q668 VanDerWaalsContact CD2-NE2 3.28Å; L664-Q668 WeakPolarHBondContact O-CB 3.45Å; L664-Q668 VanDerWaalsContact O-CG 3.25Å; L664-Q668 WeakPolarHBondContact O-CG 3.43Å; L664-Q668 PolarHBondContact O-N 3.08Å; R665-Q668 PolarHBondContact O-N 3.33Å
669	S	81.6	Confident	68.9	Low	72 Å²	72	109.1 Å²	109.1	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-66.3	-37.9	175.1	53.1	0	0	0	0	112.8	R665 I666 Y667 G672	R665-S669 PolarHBondContact O-N 2.89Å; R665-S669 PolarHBondContact O-OG 2.96Å; I666-S669 WeakPolarHBondContact CA-OG 3.33Å; I666-S669 PolarHBondContact O-N 3.02Å; I666-S669 PolarHBondContact O-OG 3.16Å; Y667-S669 PolarHBondContact O-N 2.87Å; S669-G672 PolarHBondContact O-N 2.93Å
670	N	78	Confident	66.4	Low	95 Å²	95	108.7 Å²	108.7	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-74	-25	-178.9	-70	-13.1	0	0	0	113.2	I666 Y667 G672 S673	I666-N670 PolarHBondContact O-N 3.21Å; I666-N670 VanDerWaalsContact O-N 3.1Å; Y667-N670 PolarHBondContact O-N 3.27Å; N670-G672 PolarHBondContact O-N 3.05Å; N670-S673 PolarHBondContact O-OG 2.98Å
671	L	72.3	Confident	64	Low	95 Å²	95	111.3 Å²	111.3	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-67.6	-22.5	173	-103.5	77.7	0	0	0	113.1	Y667	Y667-L671 HydrophobicContact CD1-CD1 4.12Å; Y667-L671 HydrophobicContact CD2-CD1 3.95Å; Y667-L671 HydrophobicContact CE1-CD1 3.7Å; Y667-L671 HydrophobicContact CE1-CD2 4.35Å; Y667-L671 HydrophobicContact CE2-CD1 3.52Å; Y667-L671 HydrophobicContact CG-CD1 4.24Å; Y667-L671 WeakPolarHBondContact O-CD1 3.3Å; Y667-L671 PolarHBondContact O-N 3.02Å; Y667-L671 VanDerWaalsContact O-N 3.15Å
672	G	57.7	Low	61.6	Low	67 Å²	67	113.1 Å²	113.1	69%	0.691	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-19.5	-178.8	0	0	0	0	0	114.9	S669 N670	S669-G672 PolarHBondContact O-N 2.93Å; N670-G672 PolarHBondContact O-N 3.05Å
673	S	54.1	Low	59.2	Low	85 Å²	85	113.8 Å²	113.8	59%	0.594	63%	0.631	S	S	*	*	S	Bend	trans	-98.4	-5.4	-172.3	47.9	0	0	0	0	115.4	N670	N670-S673 PolarHBondContact O-OG 2.98Å
674	N	47.9	Very low	56.9	Low	150 Å²	150	115.6 Å²	115.6	80%	0.802	65%	0.649	S	S	*	*			trans	-106.2	30.9	-175.7	-92.6	-7.9	0	0	0	114.5
675	K	36.2	Very low	54.8	Low	191 Å²	191	122.9 Å²	122.9	83%	0.83	70%	0.704	S	S	*	*			trans	-119.2	80.3	172.6	-76.3	-175.4	177.8	176.9	0	110.8
676	E	36.9	Very low	53.1	Low	190 Å²	190	121.3 Å²	121.3	89%	0.888	71%	0.71	S	S	*	*			trans	-116.9	139.5	157.9	-84	-170.6	158.6	0	0	109.7
677	P	37.8	Very low	51.4	Low	111 Å²	111	123.7 Å²	123.7	72%	0.721	73%	0.727	S	S	*	*			trans	-91.4	131.7	-175.6	34.2	-29.6	0	0	0	112.3	L679	P677-L679 PolarHBondContact O-N 3.12Å
678	D	32.8	Very low	49.5	Very low	173 Å²	173	127.8 Å²	127.8	93%	0.925	76%	0.757	S	S	*	*			trans	-61.3	111.4	167.2	-83.2	-34	0	0	0	111
679	L	37.1	Very low	47.5	Very low	151 Å²	151	127.9 Å²	127.9	79%	0.791	77%	0.766	S	S	*	*			trans	-144.9	125	166.4	-85.5	170.3	0	0	0	110.1	P677	P677-L679 PolarHBondContact O-N 3.12Å
680	S	36.4	Very low	45.4	Very low	124 Å²	124	131.4 Å²	131.4	87%	0.867	78%	0.783	S	S	*	*			trans	71.8	139.9	172.1	73.3	0	0	0	0	116.3
681	S	40.4	Very low	43.2	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	80%	0.801	S	S	*	*			cis	-156.3	140.2	26.7	51.4	0	0	0	0	111.5
682	D	35.7	Very low	41.1	Very low	169 Å²	169	136.6 Å²	136.6	90%	0.904	82%	0.823	S	S	*	*			trans	-77.5	121.6	162.9	-164.8	3.9	0	0	0	108.6
683	S	39.7	Very low	39.8	Very low	92 Å²	92	141.9 Å²	141.9	64%	0.643	83%	0.833	S	S	*	*			trans	-169.9	116.9	158.7	61.5	0	0	0	0	112.7
684	S	39.4	Very low	38.6	Very low	105 Å²	105	146.7 Å²	146.7	73%	0.734	85%	0.853	S	S	*	*			trans	66.4	101.2	142.6	48.3	0	0	0	0	120.5
685	S	43.2	Very low	37.8	Very low	201 Å²	201	146.4 Å²	146.4	100%	1.406	86%	0.857	S	S	*	*				-165.4	0	121.1	-71.3	0	0	0	0	110.1

Retrieved 685 of 685 residues in 1055.4 ms (Link to these results)

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