A0A087XVV7_POEFO Loading...

Pseudouridylate synthase TRUB1

Pseudouridine synthase that catalyzes pseudouridylation of mRNAs and tRNAs. Mediates pseudouridylation of mRNAs with the consensus sequence 5'-GUUCNANNC-3', harboring a stem-loop structure. Constitutes the major pseudouridine synthase acting on mRNAs. Also catalyzes pseudouridylation of some tRNAs, including synthesis of pseudouridine(55) from uracil-55, in the psi GC loop of a subset of tRNAs. Promotes the processing of pri-let-7 microRNAs (pri-miRNAs) independently of its RNA pseudouridylate synthase activity. Acts by binding to the stem-loop structure on pri-let-7, preventing LIN28-binding (LIN28A and/or LIN28B), thereby enhancing the interaction between pri-let-7 and the microprocessor DGCR8, which mediates miRNA maturation.

AlphaFold DB , UniProt , Accession A0A087XVV7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 273 aa.

Structure Viewer

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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	V	36.3	Very low	55.7	Low	203 Å²	203	98.2 Å²	98.2	100%	1.23	70%	0.698	S	S	*	*				0	100.5	0	-176.3	0	0	0	0	107.4	G3	V1-G3 PolarHBondContact O-N 3.39Å
2	S	38.9	Very low	58.4	Low	119 Å²	119	93.5 Å²	93.5	83%	0.832	66%	0.664	S	S	*	*			trans	-79.5	105.3	-177.5	163.2	0	0	0	0	109	A4	S2-A4 PolarHBondContact O-N 3.48Å; S2-A4 VanDerWaalsContact O-N 3.12Å
3	G	35.7	Very low	60.9	Low	77 Å²	77	94 Å²	94	79%	0.794	65%	0.647	S	S	*	*			trans	-73.3	96	173	0	0	0	0	0	110.3	V1 A5	V1-G3 PolarHBondContact O-N 3.39Å; G3-A5 PolarHBondContact O-N 3.16Å
4	A	38.7	Very low	63	Low	94 Å²	94	87.4 Å²	87.4	78%	0.777	60%	0.601	S	S	*	*			trans	-66.1	114.3	168.7	0	0	0	0	0	108.7	S2 G6	S2-A4 PolarHBondContact O-N 3.48Å; S2-A4 VanDerWaalsContact O-N 3.12Å; A4-G6 PolarHBondContact O-N 3.24Å
5	A	45	Very low	64.9	Low	97 Å²	97	87.6 Å²	87.6	80%	0.802	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-60.7	121.8	170.4	0	0	0	0	0	108.8	G3	G3-A5 PolarHBondContact O-N 3.16Å
6	G	46.6	Very low	66.7	Low	55 Å²	55	86.8 Å²	86.8	57%	0.567	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-58.6	162.9	173.9	0	0	0	0	0	111.9	A4 I8	A4-G6 PolarHBondContact O-N 3.24Å; G6-I8 PolarHBondContact O-N 3.43Å; G6-I8 VanDerWaalsContact O-N 3.1Å
7	P	53.8	Low	68.3	Low	138 Å²	138	82.5 Å²	82.5	90%	0.896	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-55.6	120.2	-176.8	20.5	-30.4	0	0	0	111	S9	P7-S9 PolarHBondContact O-N 2.77Å
8	I	62.5	Low	69.8	Low	123 Å²	123	81.2 Å²	81.2	63%	0.631	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-57	123.2	175.1	-64.6	176.8	0	0	0	107.8	G6 S12 K13	G6-I8 PolarHBondContact O-N 3.43Å; G6-I8 VanDerWaalsContact O-N 3.1Å; I8-S12 WeakPolarHBondContact CG2-OG 3.34Å; I8-K13 HydrophobicContact CG2-CB 4.01Å
9	S	83.1	Confident	71.3	Confident	69 Å²	69	76.9 Å²	76.9	48%	0.483	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-59.6	147.6	176.6	68.1	0	0	0	0	110.9	P7 L11 S12 K13	P7-S9 PolarHBondContact O-N 2.77Å; S9-L11 PolarHBondContact O-N 3.39Å; S9-S12 PolarHBondContact N-OG 2.81Å; S9-S12 PolarHBondContact O-N 3.12Å; S9-S12 PolarHBondContact O-OG 2.72Å; S9-S12 PolarHBondContact OG-N 2.97Å; S9-S12 PolarHBondContact OG-OG 2.9Å; S9-K13 PolarHBondContact O-N 3.22Å
10	S	84.9	Confident	72.6	Confident	66 Å²	66	73.2 Å²	73.2	46%	0.462	49%	0.488	S	S	.	.	H	α-helix	trans	-52.2	-34.5	178.7	-56.1	0	0	0	0	112.9	L14	S10-L14 WeakPolarHBondContact O-CB 2.99Å; S10-L14 PolarHBondContact O-N 2.94Å
11	L	87.3	Confident	73.8	Confident	39 Å²	39	69.7 Å²	69.7	20%	0.204	46%	0.464	C	S	.	.	H	α-helix	trans	-66.3	-44.5	174.4	-178.5	60.6	0	0	0	113.1	S9 K13 L14 Q15 L43 A46 V48	S9-L11 PolarHBondContact O-N 3.39Å; L11-K13 VanDerWaalsContact C-N 3.34Å; L11-L14 PolarHBondContact O-N 3.24Å; L11-Q15 HydrophobicContact CD1-CG 4.31Å; L11-Q15 WeakPolarHBondContact O-CB 3.5Å; L11-Q15 VanDerWaalsContact O-CG 3.23Å; L11-Q15 WeakPolarHBondContact O-CG 3.33Å; L11-Q15 PolarHBondContact O-N 3.32Å; L11-L43 HydrophobicContact CD1-CD2 4.26Å; L11-A46 HydrophobicContact CB-CB 4.25Å; L11-A46 HydrophobicContact CD1-CB 4.36Å; L11-V48 HydrophobicContact CD1-CG2 3.77Å; L11-V48 HydrophobicContact CD2-CG2 4.05Å; L11-V48 HydrophobicContact CG-CG2 4.45Å
12	S	88.4	Confident	76.8	Confident	42 Å²	42	60 Å²	60	29%	0.294	41%	0.406	S	S	.	.	H	α-helix	trans	-68.3	-35.5	178.4	51.6	0	0	0	0	111.7	I8 S9 Q15 S16	I8-S12 WeakPolarHBondContact CG2-OG 3.34Å; S9-S12 PolarHBondContact N-OG 2.81Å; S9-S12 PolarHBondContact O-N 3.12Å; S9-S12 PolarHBondContact O-OG 2.72Å; S9-S12 PolarHBondContact OG-N 2.97Å; S9-S12 PolarHBondContact OG-OG 2.9Å; S12-Q15 PolarHBondContact O-N 3.26Å; S12-S16 PolarHBondContact O-N 2.94Å
13	K	90.6	Very high	79.6	Confident	100 Å²	100	54.3 Å²	54.3	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-49.3	170.6	-173.1	171.1	179.1	179.2	0	111.4	I8 S9 L11 Q15 S16 L246	I8-K13 HydrophobicContact CG2-CB 4.01Å; S9-K13 PolarHBondContact O-N 3.22Å; L11-K13 VanDerWaalsContact C-N 3.34Å; K13-Q15 VanDerWaalsContact C-N 3.29Å; K13-Q15 PolarHBondContact O-N 3.1Å; K13-S16 PolarHBondContact O-N 3.36Å; K13-S16 VanDerWaalsContact O-N 3.14Å; K13-S16 PolarHBondContact O-OG 2.78Å; K13-L246 HydrophobicContact CB-CD2 4.25Å; K13-L246 HydrophobicContact CD-CD2 4.01Å; K13-L246 HydrophobicContact CG-CD2 4.13Å
14	L	90.8	Very high	82.6	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-58.4	-39.7	176.3	177.3	59.7	0	0	0	112.4	S10 L11 S16 L17 L42 L43 A46 L61 I81 L246	S10-L14 WeakPolarHBondContact O-CB 2.99Å; S10-L14 PolarHBondContact O-N 2.94Å; L11-L14 PolarHBondContact O-N 3.24Å; L14-S16 VanDerWaalsContact C-N 3.32Å; L14-S16 PolarHBondContact O-N 3.11Å; L14-L17 HydrophobicContact CD1-CD1 4.21Å; L14-L17 PolarHBondContact O-N 3.31Å; L14-L42 HydrophobicContact CD1-CB 4.24Å; L14-L42 HydrophobicContact CD1-CD1 3.9Å; L14-L42 HydrophobicContact CD2-CB 3.99Å; L14-L43 HydrophobicContact CD2-CD2 4.25Å; L14-A46 HydrophobicContact CD2-CB 3.95Å; L14-L61 HydrophobicContact CD1-CD1 4.13Å; L14-L61 HydrophobicContact CD1-CD2 3.93Å; L14-L61 HydrophobicContact CD2-CD2 4.14Å; L14-L61 HydrophobicContact CG-CD1 3.9Å; L14-L61 HydrophobicContact CG-CD2 4.09Å; L14-I81 HydrophobicContact CD1-CD1 4.2Å; L14-L246 HydrophobicContact CB-CD1 4.05Å; L14-L246 HydrophobicContact CD1-CD1 3.98Å
15	Q	91.4	Very high	85.4	Confident	90 Å²	90	49.3 Å²	49.3	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-70.8	-25.4	178.5	-75.9	174.3	-23.6	0	0	113.8	L11 S12 K13 L17 Y60	L11-Q15 HydrophobicContact CD1-CG 4.31Å; L11-Q15 WeakPolarHBondContact O-CB 3.5Å; L11-Q15 VanDerWaalsContact O-CG 3.23Å; L11-Q15 WeakPolarHBondContact O-CG 3.33Å; L11-Q15 PolarHBondContact O-N 3.32Å; S12-Q15 PolarHBondContact O-N 3.26Å; K13-Q15 VanDerWaalsContact C-N 3.29Å; K13-Q15 PolarHBondContact O-N 3.1Å; Q15-L17 VanDerWaalsContact C-N 3.29Å; Q15-Y60 VanDerWaalsContact CG-O 3.27Å; Q15-Y60 WeakPolarHBondContact CG-O 3.36Å; Q15-Y60 PolarHBondContact NE2-O 3.3Å
16	S	92.9	Very high	87.9	Confident	74 Å²	74	49.9 Å²	49.9	52%	0.517	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.9	177.6	73.6	0	0	0	0	114.1	S12 K13 L14 N18	S12-S16 PolarHBondContact O-N 2.94Å; K13-S16 PolarHBondContact O-N 3.36Å; K13-S16 VanDerWaalsContact O-N 3.14Å; K13-S16 PolarHBondContact O-OG 2.78Å; L14-S16 VanDerWaalsContact C-N 3.32Å; L14-S16 PolarHBondContact O-N 3.11Å; S16-N18 PolarHBondContact O-N 2.81Å; S16-N18 PolarHBondContact O-ND2 2.86Å
17	L	94.4	Very high	90.3	Very high	15 Å²	15	53 Å²	53	8%	0.079	29%	0.288	C	S	.	.			trans	-71.6	130.7	-178.2	-59.6	-173.4	0	0	0	111.9	L14 Q15 I81 L246 V249 V250 L253	L14-L17 HydrophobicContact CD1-CD1 4.21Å; L14-L17 PolarHBondContact O-N 3.31Å; Q15-L17 VanDerWaalsContact C-N 3.29Å; L17-I81 HydrophobicContact CB-CD1 3.73Å; L17-I81 HydrophobicContact CB-CG1 4.11Å; L17-I81 HydrophobicContact CB-CG2 4.08Å; L17-I81 HydrophobicContact CD1-CD1 3.96Å; L17-I81 HydrophobicContact CG-CD1 4.43Å; L17-L246 HydrophobicContact CD1-CD1 3.77Å; L17-V249 HydrophobicContact CD1-CG1 3.88Å; L17-V250 HydrophobicContact CD1-CG2 4.24Å; L17-V250 HydrophobicContact CD2-CG2 3.76Å; L17-L253 HydrophobicContact CB-CD2 4.3Å; L17-L253 HydrophobicContact CD2-CD2 4.3Å
18	N	96	Very high	92.3	Very high	58 Å²	58	48.7 Å²	48.7	31%	0.31	27%	0.269	S	S	.	.			trans	-139.2	115.6	179.9	-66.4	-76.2	0	0	0	109.6	S16 I81 N83	S16-N18 PolarHBondContact O-N 2.81Å; S16-N18 PolarHBondContact O-ND2 2.86Å; N18-I81 WeakPolarHBondContact CA-O 3.33Å; N18-N83 HydrophobicContact CB-CB 4.3Å; N18-N83 WeakPolarHBondContact OD1-CB 3.29Å; N18-N83 PolarHBondContact OD1-N 3.03Å
19	G	96.8	Very high	93.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160	-168	178.2	0	0	0	0	0	113.9	G80 I81 G84 Q254	G19-G80 WeakPolarHBondContact O-CA 2.86Å; G19-I81 PolarHBondContact N-O 3.43Å; G19-I81 PolarHBondContact O-N 2.77Å; G19-G84 WeakPolarHBondContact O-CA 3.33Å; G19-Q254 CarbonylContact C-O 3.54Å; G19-Q254 VanDerWaalsContact CA-O 3.22Å; G19-Q254 WeakPolarHBondContact CA-O 3.41Å
20	L	97.8	Very high	94.5	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	145.8	177.3	-62.7	-179.2	0	0	0	110.4	V78 V79 G84 M87 L88 M91 F232 Q254	L20-V78 HydrophobicContact CD2-CG1 4.4Å; L20-V79 WeakPolarHBondContact CA-O 3.31Å; L20-G84 WeakPolarHBondContact CD2-O 3.27Å; L20-M87 HydrophobicContact CD1-CB 3.96Å; L20-M87 HydrophobicContact CD1-CE 3.94Å; L20-M87 HydrophobicContact CD1-SD 4.31Å; L20-M87 HydrophobicContact CD2-CB 4.26Å; L20-M87 HydrophobicContact CG-CB 4.26Å; L20-M87 HydrophobicContact CG-CE 4.45Å; L20-M87 HydrophobicContact CG-SD 4.25Å; L20-L88 HydrophobicContact CD2-CD2 3.61Å; L20-L88 HydrophobicContact CD2-CG 4.36Å; L20-M91 HydrophobicContact CD1-CE 3.71Å; L20-M91 HydrophobicContact CD1-CG 4.27Å; L20-M91 HydrophobicContact CD1-SD 4.44Å; L20-F232 HydrophobicContact CB-CE2 4.06Å; L20-F232 HydrophobicContact CB-CZ 3.69Å; L20-F232 HydrophobicContact CD1-CE2 4.46Å; L20-Q254 PolarHBondContact N-O 3.11Å; L20-Q254 PolarHBondContact O-N 3.5Å
21	F	98.1	Very high	95.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	175.9	168.9	61.4	-79.1	0	0	0	108.3	I23 F38 V78 V79 I81 L239 V249 A252 L253	F21-I23 HydrophobicContact CD2-CG2 3.93Å; F21-I23 HydrophobicContact CE2-CG2 3.53Å; F21-F38 AromaticContact CE2-CE1 3.9Å; F21-F38 HydrophobicContact CE2-CE1 3.9Å; F21-F38 HydrophobicContact CE2-CE2 4.02Å; F21-F38 AromaticContact CE2-CZ 3.37Å; F21-F38 HydrophobicContact CE2-CZ 3.37Å; F21-F38 AromaticContact CZ-CE1 3.51Å; F21-F38 HydrophobicContact CZ-CE1 3.51Å; F21-F38 HydrophobicContact CZ-CE2 4.45Å; F21-F38 AromaticContact CZ-CZ 3.41Å; F21-F38 HydrophobicContact CZ-CZ 3.41Å; F21-F38 VanDerWaalsContact CZ-CZ 3.41Å; F21-V78 CarbonylContact O-C 3.6Å; F21-V78 WeakPolarHBondContact O-CA 3.45Å; F21-V79 HydrophobicContact CD1-CB 4.48Å; F21-V79 HydrophobicContact CD2-CB 4.45Å; F21-V79 HydrophobicContact CE1-CB 3.98Å; F21-V79 HydrophobicContact CE1-CG1 3.73Å; F21-V79 HydrophobicContact CE2-CB 3.96Å; F21-V79 HydrophobicContact CE2-CG1 4.17Å; F21-V79 HydrophobicContact CE2-CG2 4.49Å; F21-V79 HydrophobicContact CZ-CB 3.69Å; F21-V79 HydrophobicContact CZ-CG1 3.44Å; F21-V79 VanDerWaalsContact CZ-CG1 3.44Å; F21-V79 PolarHBondContact N-O 2.84Å; F21-V79 PolarHBondContact O-N 3.13Å; F21-I81 HydrophobicContact CD1-CG2 4.4Å; F21-I81 HydrophobicContact CE1-CB 4.1Å; F21-I81 HydrophobicContact CE1-CG2 4.01Å; F21-L239 HydrophobicContact CD2-CD1 4.3Å; F21-V249 HydrophobicContact CD1-CG1 4.38Å; F21-V249 HydrophobicContact CE1-CG1 4.16Å; F21-V249 HydrophobicContact CE2-CG2 4.47Å; F21-V249 HydrophobicContact CZ-CG1 4.27Å; F21-A252 HydrophobicContact CB-CB 4.36Å; F21-L253 HydrophobicContact CD1-CD1 3.86Å
22	A	98.3	Very high	95.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.3	177.7	0	0	0	0	0	111.9	V76 F232 V238 L239	A22-V76 HydrophobicContact CB-CG1 4Å; A22-F232 HydrophobicContact CB-CB 3.78Å; A22-F232 HydrophobicContact CB-CD1 3.88Å; A22-F232 HydrophobicContact CB-CG 3.97Å; A22-V238 HydrophobicContact CB-CG2 3.97Å; A22-L239 PolarHBondContact O-N 3.42Å
23	I	98.6	Very high	95.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.2	170.8	66.9	178.1	0	0	0	110.4	F21 V34 F38 L77 V79 L239 W244	F21-I23 HydrophobicContact CD2-CG2 3.93Å; F21-I23 HydrophobicContact CE2-CG2 3.53Å; I23-V34 HydrophobicContact CD1-CG1 3.7Å; I23-V34 HydrophobicContact CG1-CG1 4.5Å; I23-F38 HydrophobicContact CD1-CB 4.28Å; I23-F38 HydrophobicContact CD1-CD2 4.39Å; I23-F38 HydrophobicContact CD1-CG 4.31Å; I23-F38 HydrophobicContact CG2-CD2 4.08Å; I23-F38 HydrophobicContact CG2-CE2 3.9Å; I23-F38 HydrophobicContact CG2-CZ 4.42Å; I23-L77 HydrophobicContact CD1-CD2 4.03Å; I23-L77 HydrophobicContact CG1-CB 4.12Å; I23-L77 HydrophobicContact CG1-CD2 4.03Å; I23-L77 PolarHBondContact N-O 3.08Å; I23-L77 PolarHBondContact O-N 3.25Å; I23-V79 HydrophobicContact CD1-CG2 3.79Å; I23-V79 HydrophobicContact CG1-CG2 3.83Å; I23-V79 HydrophobicContact CG2-CG2 4.35Å; I23-L239 WeakPolarHBondContact CA-O 3.36Å; I23-L239 HydrophobicContact CG2-CB 4.37Å; I23-W244 HydrophobicContact CD1-CZ2 4.33Å
24	Y	98.6	Very high	96	Very high	66 Å²	66	38.2 Å²	38.2	26%	0.259	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.7	176.2	-173	-117.6	0	0	0	108.4	K26 S74 L234 V238 L239 H240	Y24-K26 HydrophobicContact CE1-CB 4.06Å; Y24-S74 WeakPolarHBondContact OH-CB 3.24Å; Y24-L234 HydrophobicContact CD2-CD1 3.63Å; Y24-L234 HydrophobicContact CE2-CD1 3.82Å; Y24-V238 VanDerWaalsContact CA-CG1 3.42Å; Y24-V238 HydrophobicContact CD2-CG1 4.24Å; Y24-V238 HydrophobicContact CG-CG1 4.25Å; Y24-L239 PolarHBondContact N-O 2.68Å; Y24-H240 AromaticContact CD1-CE1 3.91Å; Y24-H240 AromaticContact CD1-ND1 3.78Å; Y24-H240 AromaticContact CG-CE1 3.72Å; Y24-H240 AromaticContact CG-ND1 3.87Å
25	K	98.4	Very high	96.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.3	163.6	170.4	177	177.4	-46.9	0	108.4	P29 V34 L69 D70 S71 A73 S74 G75 L77	K25-P29 WeakPolarHBondContact CE-O 3.22Å; K25-P29 PolarHBondContact NZ-O 3.02Å; K25-V34 HydrophobicContact CG-CG2 4.06Å; K25-L69 HydrophobicContact CD-CB 4.09Å; K25-L69 HydrophobicContact CD-CD2 3.74Å; K25-L69 HydrophobicContact CG-CD2 4.34Å; K25-D70 WeakPolarHBondContact CE-O 3.39Å; K25-D70 PolarHBondContact NZ-O 3.14Å; K25-S71 PolarHBondContact NZ-O 3.49Å; K25-A73 PolarHBondContact NZ-O 3.34Å; K25-S74 CarbonylContact O-C 3.57Å; K25-S74 WeakPolarHBondContact O-CA 3.45Å; K25-S74 VanDerWaalsContact O-CB 3.26Å; K25-S74 WeakPolarHBondContact O-CB 3.3Å; K25-G75 PolarHBondContact N-O 3.19Å; K25-G75 PolarHBondContact O-N 2.93Å; K25-L77 HydrophobicContact CB-CB 4.17Å; K25-L77 HydrophobicContact CB-CG 4.47Å
26	K	97.7	Very high	96.4	Very high	108 Å²	108	38.9 Å²	38.9	47%	0.47	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-74.1	162.4	166.1	66.9	-174.7	-177.8	-171.3	0	112.2	Y24 P29 E241	Y24-K26 HydrophobicContact CE1-CB 4.06Å; K26-P29 HydrophobicContact CG-CG 4.06Å; K26-E241 IonicContact NZ-OE2 3.78Å
27	Q	96.8	Very high	96.6	Very high	121 Å²	121	39.5 Å²	39.5	57%	0.565	21%	0.214	S	C	*	.	S	Bend	trans	-63.1	142	169.2	178.3	175.1	38.7	0	0	110.7	P29 A72	Q27-P29 VanDerWaalsContact C-CD 3.43Å; Q27-P29 WeakPolarHBondContact O-CD 3.3Å; Q27-A72 VanDerWaalsContact CG-O 3.27Å; Q27-A72 WeakPolarHBondContact CG-O 3.4Å; Q27-A72 PolarHBondContact NE2-O 2.68Å; Q27-A72 VanDerWaalsContact NE2-O 3.13Å
28	G	95.4	Very high	96.6	Very high	48 Å²	48	38.8 Å²	38.8	50%	0.495	21%	0.21	S	C	.	.	S	Bend	trans	115.1	-73.3	179.2	0	0	0	0	0	114.2	S71	G28-S71 CarbonylContact C-O 3.55Å; G28-S71 PolarHBondContact N-O 2.8Å; G28-S71 WeakPolarHBondContact O-CB 3.14Å
29	P	95.6	Very high	96.5	Very high	34 Å²	34	37.9 Å²	37.9	22%	0.221	20%	0.203	C	C	.	.	S	Bend	trans	-67.1	158	-174.9	28.3	-35	0	0	0	112	K25 K26 Q27 D33 V34 S71	K25-P29 WeakPolarHBondContact CE-O 3.22Å; K25-P29 PolarHBondContact NZ-O 3.02Å; K26-P29 HydrophobicContact CG-CG 4.06Å; Q27-P29 VanDerWaalsContact C-CD 3.43Å; Q27-P29 WeakPolarHBondContact O-CD 3.3Å; P29-D33 HydrophobicContact CB-CB 4.17Å; P29-V34 HydrophobicContact CB-CG2 3.85Å; P29-V34 HydrophobicContact CG-CG2 3.55Å; P29-S71 WeakPolarHBondContact O-CA 3.38Å
30	T	95.9	Very high	96.4	Very high	54 Å²	54	40.3 Å²	40.3	33%	0.331	22%	0.217	S	C	.	.			trans	-74.4	161.2	169.1	73.2	0	0	0	0	110.7	A32 D33 V34 S71	T30-A32 PolarHBondContact O-N 3.35Å; T30-A32 PolarHBondContact OG1-N 3.24Å; T30-D33 VanDerWaalsContact CB-OD2 3.29Å; T30-D33 WeakPolarHBondContact CB-OD2 3.25Å; T30-D33 WeakPolarHBondContact CG2-OD2 3.06Å; T30-D33 PolarHBondContact N-OD2 2.92Å; T30-D33 PolarHBondContact O-N 3.34Å; T30-D33 VanDerWaalsContact O-N 3.16Å; T30-D33 PolarHBondContact OG1-N 2.97Å; T30-D33 VanDerWaalsContact OG1-N 3.09Å; T30-D33 PolarHBondContact OG1-OD1 2.87Å; T30-D33 PolarHBondContact OG1-OD2 2.83Å; T30-V34 WeakPolarHBondContact O-CG2 3.45Å; T30-V34 PolarHBondContact O-N 3.03Å; T30-V34 VanDerWaalsContact O-N 3.12Å; T30-S71 WeakPolarHBondContact CG2-OG 3.49Å
31	S	96.5	Very high	96.2	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-56.7	-33.8	172.3	-63	0	0	0	0	112.8	L35 L69	S31-L35 WeakPolarHBondContact O-CB 3.22Å; S31-L35 PolarHBondContact O-N 3.04Å; S31-L35 VanDerWaalsContact O-N 3.11Å; S31-L69 PolarHBondContact OG-N 3.27Å; S31-L69 PolarHBondContact OG-O 3.04Å
32	A	94.8	Very high	96	Very high	35 Å²	35	42.5 Å²	42.5	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-71.6	-38.8	178.1	0	0	0	0	0	112	T30 L35 N36	T30-A32 PolarHBondContact O-N 3.35Å; T30-A32 PolarHBondContact OG1-N 3.24Å; A32-L35 PolarHBondContact O-N 3.27Å; A32-N36 WeakPolarHBondContact O-CB 3.43Å; A32-N36 VanDerWaalsContact O-CG 3.22Å; A32-N36 PolarHBondContact O-N 3.26Å; A32-N36 PolarHBondContact O-ND2 2.98Å; A32-N36 VanDerWaalsContact O-ND2 3.13Å
33	D	95.3	Very high	95.7	Very high	84 Å²	84	42.7 Å²	42.7	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-44.5	177.3	-57.8	-37.8	0	0	0	111.1	P29 T30 L35 N36 K37	P29-D33 HydrophobicContact CB-CB 4.17Å; T30-D33 VanDerWaalsContact CB-OD2 3.29Å; T30-D33 WeakPolarHBondContact CB-OD2 3.25Å; T30-D33 WeakPolarHBondContact CG2-OD2 3.06Å; T30-D33 PolarHBondContact N-OD2 2.92Å; T30-D33 PolarHBondContact O-N 3.34Å; T30-D33 VanDerWaalsContact O-N 3.16Å; T30-D33 PolarHBondContact OG1-N 2.97Å; T30-D33 VanDerWaalsContact OG1-N 3.09Å; T30-D33 PolarHBondContact OG1-OD1 2.87Å; T30-D33 PolarHBondContact OG1-OD2 2.83Å; D33-L35 PolarHBondContact O-N 2.93Å; D33-N36 PolarHBondContact O-N 3.28Å; D33-K37 WeakPolarHBondContact O-CB 3.42Å; D33-K37 PolarHBondContact O-N 2.99Å
34	V	97.1	Very high	95.3	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.055	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-45.7	175.9	178.5	0	0	0	0	110.7	I23 K25 P29 T30 N36 K37 F38 W244	I23-V34 HydrophobicContact CD1-CG1 3.7Å; I23-V34 HydrophobicContact CG1-CG1 4.5Å; K25-V34 HydrophobicContact CG-CG2 4.06Å; P29-V34 HydrophobicContact CB-CG2 3.85Å; P29-V34 HydrophobicContact CG-CG2 3.55Å; T30-V34 WeakPolarHBondContact O-CG2 3.45Å; T30-V34 PolarHBondContact O-N 3.03Å; T30-V34 VanDerWaalsContact O-N 3.12Å; V34-N36 PolarHBondContact O-N 2.99Å; V34-K37 PolarHBondContact O-N 3.26Å; V34-F38 VanDerWaalsContact O-CB 3.3Å; V34-F38 WeakPolarHBondContact O-CB 3.45Å; V34-F38 PolarHBondContact O-N 2.9Å; V34-W244 HydrophobicContact CG1-CH2 3.96Å; V34-W244 HydrophobicContact CG1-CZ2 4.12Å
35	L	96.1	Very high	95	Very high	15 Å²	15	52 Å²	52	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-39.6	179.1	-171.9	67.3	0	0	0	112.5	S31 A32 D33 K39 L63 H65 V79	S31-L35 WeakPolarHBondContact O-CB 3.22Å; S31-L35 PolarHBondContact O-N 3.04Å; S31-L35 VanDerWaalsContact O-N 3.11Å; A32-L35 PolarHBondContact O-N 3.27Å; D33-L35 PolarHBondContact O-N 2.93Å; L35-K39 WeakPolarHBondContact O-CB 3.46Å; L35-K39 PolarHBondContact O-N 2.98Å; L35-L63 HydrophobicContact CD1-CB 4.17Å; L35-L63 HydrophobicContact CD2-CB 4.47Å; L35-L63 HydrophobicContact CG-CB 4.39Å; L35-H65 HydrophobicContact CD2-CB 4.43Å; L35-V79 HydrophobicContact CD1-CB 4.4Å; L35-V79 HydrophobicContact CD1-CG1 3.65Å; L35-V79 HydrophobicContact CD1-CG2 3.84Å
36	N	94.4	Very high	94.6	Very high	92 Å²	92	52.7 Å²	52.7	49%	0.492	28%	0.276	S	S	.	.	H	α-helix	trans	-67.6	-43.7	176.6	-73	-32.4	0	0	0	111.4	A32 D33 V34 K39 D40	A32-N36 WeakPolarHBondContact O-CB 3.43Å; A32-N36 VanDerWaalsContact O-CG 3.22Å; A32-N36 PolarHBondContact O-N 3.26Å; A32-N36 PolarHBondContact O-ND2 2.98Å; A32-N36 VanDerWaalsContact O-ND2 3.13Å; D33-N36 PolarHBondContact O-N 3.28Å; V34-N36 PolarHBondContact O-N 2.99Å; N36-K39 WeakPolarHBondContact O-CB 3.47Å; N36-K39 PolarHBondContact O-N 3.45Å; N36-D40 PolarHBondContact O-N 3.19Å
37	K	95.4	Very high	94.2	Very high	86 Å²	86	50.4 Å²	50.4	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-47.7	175.5	-172	-176.2	176	-178.8	0	111.1	D33 V34 K39 D40 T41 E241 W244	D33-K37 WeakPolarHBondContact O-CB 3.42Å; D33-K37 PolarHBondContact O-N 2.99Å; V34-K37 PolarHBondContact O-N 3.26Å; K37-K39 VanDerWaalsContact C-N 3.34Å; K37-K39 PolarHBondContact O-N 3.47Å; K37-D40 PolarHBondContact O-N 2.87Å; K37-T41 PolarHBondContact O-N 3.41Å; K37-T41 PolarHBondContact O-OG1 3.22Å; K37-T41 VanDerWaalsContact O-OG1 3.13Å; K37-E241 WeakPolarHBondContact CE-OE1 3.47Å; K37-E241 IonicContact NZ-OE1 2.81Å; K37-E241 PolarHBondContact NZ-OE1 3.17Å; K37-E241 IonicContact NZ-OE2 3.86Å; K37-E241 PolarHBondContact NZ-OE2 2.89Å; K37-W244 HydrophobicContact CB-CZ3 4.35Å; K37-W244 HydrophobicContact CD-CZ3 4.13Å; K37-W244 HydrophobicContact CG-CZ3 4.04Å
38	F	96	Very high	93.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-55.4	-48.2	175.2	175.1	-94.6	0	0	0	111.8	F21 I23 V34 D40 T41 L42 L63 W244 V249	F21-F38 AromaticContact CE2-CE1 3.9Å; F21-F38 HydrophobicContact CE2-CE1 3.9Å; F21-F38 HydrophobicContact CE2-CE2 4.02Å; F21-F38 AromaticContact CE2-CZ 3.37Å; F21-F38 HydrophobicContact CE2-CZ 3.37Å; F21-F38 AromaticContact CZ-CE1 3.51Å; F21-F38 HydrophobicContact CZ-CE1 3.51Å; F21-F38 HydrophobicContact CZ-CE2 4.45Å; F21-F38 AromaticContact CZ-CZ 3.41Å; F21-F38 HydrophobicContact CZ-CZ 3.41Å; F21-F38 VanDerWaalsContact CZ-CZ 3.41Å; I23-F38 HydrophobicContact CD1-CB 4.28Å; I23-F38 HydrophobicContact CD1-CD2 4.39Å; I23-F38 HydrophobicContact CD1-CG 4.31Å; I23-F38 HydrophobicContact CG2-CD2 4.08Å; I23-F38 HydrophobicContact CG2-CE2 3.9Å; I23-F38 HydrophobicContact CG2-CZ 4.42Å; V34-F38 VanDerWaalsContact O-CB 3.3Å; V34-F38 WeakPolarHBondContact O-CB 3.45Å; V34-F38 PolarHBondContact O-N 2.9Å; F38-D40 VanDerWaalsContact C-N 3.35Å; F38-D40 PolarHBondContact O-N 3.43Å; F38-T41 PolarHBondContact O-N 2.64Å; F38-L42 HydrophobicContact CD1-CD1 4.13Å; F38-L42 HydrophobicContact CE1-CD1 3.35Å; F38-L42 HydrophobicContact CE1-CG 4.18Å; F38-L42 HydrophobicContact CE2-CD1 4.27Å; F38-L42 HydrophobicContact CE2-CG 4.48Å; F38-L42 HydrophobicContact CZ-CD1 3.45Å; F38-L42 VanDerWaalsContact CZ-CD1 3.45Å; F38-L42 HydrophobicContact CZ-CG 4.11Å; F38-L42 PolarHBondContact O-N 3.44Å; F38-L42 VanDerWaalsContact O-N 3.12Å; F38-L63 HydrophobicContact CD1-CD1 4.03Å; F38-L63 HydrophobicContact CE1-CD1 4.26Å; F38-L63 HydrophobicContact CE1-CD2 4.45Å; F38-W244 HydrophobicContact CB-CD2 4.39Å; F38-W244 HydrophobicContact CB-CE3 4.07Å; F38-W244 HydrophobicContact CB-CH2 4.23Å; F38-W244 HydrophobicContact CB-CZ3 3.99Å; F38-W244 HydrophobicContact CD2-CB 4.12Å; F38-W244 AromaticContact CD2-CD1 3.77Å; F38-W244 AromaticContact CD2-CD2 3.47Å; F38-W244 HydrophobicContact CD2-CD2 3.47Å; F38-W244 VanDerWaalsContact CD2-CD2 3.47Å; F38-W244 AromaticContact CD2-CE2 3.71Å; F38-W244 AromaticContact CD2-CE3 3.93Å; F38-W244 HydrophobicContact CD2-CE3 3.93Å; F38-W244 AromaticContact CD2-CG 3.53Å; F38-W244 HydrophobicContact CD2-CG 3.53Å; F38-W244 HydrophobicContact CD2-CZ2 4.39Å; F38-W244 AromaticContact CD2-NE1 3.88Å; F38-W244 HydrophobicContact CE2-CB 4.15Å; F38-W244 AromaticContact CE2-CD1 3.81Å; F38-W244 HydrophobicContact CE2-CD2 4.23Å; F38-W244 AromaticContact CE2-CG 3.8Å; F38-W244 HydrophobicContact CE2-CG 3.8Å; F38-W244 HydrophobicContact CG-CD2 4.4Å; F38-W244 HydrophobicContact CG-CE3 4.49Å; F38-V249 HydrophobicContact CE2-CG2 4.16Å; F38-V249 HydrophobicContact CZ-CG2 3.66Å
39	K	94.1	Very high	92.7	Very high	39 Å²	39	51 Å²	51	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-57.5	-46.9	176.3	179.9	170.8	171.5	166.2	0	112.2	L35 N36 K37 T41 L42 L43 L61 L63	L35-K39 WeakPolarHBondContact O-CB 3.46Å; L35-K39 PolarHBondContact O-N 2.98Å; N36-K39 WeakPolarHBondContact O-CB 3.47Å; N36-K39 PolarHBondContact O-N 3.45Å; K37-K39 VanDerWaalsContact C-N 3.34Å; K37-K39 PolarHBondContact O-N 3.47Å; K39-T41 VanDerWaalsContact C-N 3.34Å; K39-L42 PolarHBondContact O-N 3.01Å; K39-L43 HydrophobicContact CG-CD1 3.91Å; K39-L43 HydrophobicContact CG-CG 4.44Å; K39-L43 WeakPolarHBondContact O-CB 3.46Å; K39-L43 VanDerWaalsContact O-CG 3.3Å; K39-L43 WeakPolarHBondContact O-CG 3.43Å; K39-L43 PolarHBondContact O-N 3.5Å; K39-L61 WeakPolarHBondContact CE-O 3.42Å; K39-L61 HydrophobicContact CG-CD2 4.48Å; K39-L61 PolarHBondContact NZ-O 2.68Å; K39-L63 HydrophobicContact CB-CD1 3.61Å; K39-L63 HydrophobicContact CD-CD1 4.17Å; K39-L63 HydrophobicContact CG-CD1 3.9Å
40	D	92.8	Very high	91.2	Very high	52 Å²	52	58.6 Å²	58.6	28%	0.278	30%	0.299	S	S	.	.	H	α-helix	trans	-65.7	-37.9	-178.9	-73.1	-13.3	0	0	0	111.6	N36 K37 F38 L43 R44	N36-D40 PolarHBondContact O-N 3.19Å; K37-D40 PolarHBondContact O-N 2.87Å; F38-D40 VanDerWaalsContact C-N 3.35Å; F38-D40 PolarHBondContact O-N 3.43Å; D40-L43 PolarHBondContact O-N 3Å; D40-R44 VanDerWaalsContact O-CG 3.26Å; D40-R44 WeakPolarHBondContact O-CG 3.48Å; D40-R44 PolarHBondContact O-N 2.99Å
41	T	94.2	Very high	89.6	Confident	47 Å²	47	57.6 Å²	57.6	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-58.8	-52.4	174	-61.6	0	0	0	0	111.4	K37 F38 K39 L43 R44 E45 W244	K37-T41 PolarHBondContact O-N 3.41Å; K37-T41 PolarHBondContact O-OG1 3.22Å; K37-T41 VanDerWaalsContact O-OG1 3.13Å; F38-T41 PolarHBondContact O-N 2.64Å; K39-T41 VanDerWaalsContact C-N 3.34Å; T41-L43 VanDerWaalsContact C-N 3.35Å; T41-L43 PolarHBondContact O-N 2.96Å; T41-R44 PolarHBondContact O-N 3.25Å; T41-E45 PolarHBondContact O-N 3.18Å; T41-W244 HydrophobicContact CG2-CB 4.14Å
42	L	93.8	Very high	87.6	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-37.2	-179.9	-66.5	-175.8	0	0	0	113	L14 F38 K39 E45 A46 L61 V249	L14-L42 HydrophobicContact CD1-CB 4.24Å; L14-L42 HydrophobicContact CD1-CD1 3.9Å; L14-L42 HydrophobicContact CD2-CB 3.99Å; F38-L42 HydrophobicContact CD1-CD1 4.13Å; F38-L42 HydrophobicContact CE1-CD1 3.35Å; F38-L42 HydrophobicContact CE1-CG 4.18Å; F38-L42 HydrophobicContact CE2-CD1 4.27Å; F38-L42 HydrophobicContact CE2-CG 4.48Å; F38-L42 HydrophobicContact CZ-CD1 3.45Å; F38-L42 VanDerWaalsContact CZ-CD1 3.45Å; F38-L42 HydrophobicContact CZ-CG 4.11Å; F38-L42 PolarHBondContact O-N 3.44Å; F38-L42 VanDerWaalsContact O-N 3.12Å; K39-L42 PolarHBondContact O-N 3.01Å; L42-E45 PolarHBondContact O-N 3.45Å; L42-A46 WeakPolarHBondContact O-CB 2.8Å; L42-A46 PolarHBondContact O-N 3.11Å; L42-L61 HydrophobicContact CD1-CD2 4.47Å; L42-V249 HydrophobicContact CD1-CG2 4.24Å; L42-V249 HydrophobicContact CD2-CG2 4.22Å
43	L	92	Very high	85.6	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-38	177.3	-73.1	174	0	0	0	111.8	L11 L14 K39 D40 T41 A46 G47 V48 P51 L61	L11-L43 HydrophobicContact CD1-CD2 4.26Å; L14-L43 HydrophobicContact CD2-CD2 4.25Å; K39-L43 HydrophobicContact CG-CD1 3.91Å; K39-L43 HydrophobicContact CG-CG 4.44Å; K39-L43 WeakPolarHBondContact O-CB 3.46Å; K39-L43 VanDerWaalsContact O-CG 3.3Å; K39-L43 WeakPolarHBondContact O-CG 3.43Å; K39-L43 PolarHBondContact O-N 3.5Å; D40-L43 PolarHBondContact O-N 3Å; T41-L43 VanDerWaalsContact C-N 3.35Å; T41-L43 PolarHBondContact O-N 2.96Å; L43-A46 PolarHBondContact O-N 3.16Å; L43-G47 PolarHBondContact O-N 2.65Å; L43-V48 HydrophobicContact CB-CB 4.25Å; L43-V48 HydrophobicContact CB-CG2 4.44Å; L43-V48 HydrophobicContact CD2-CG2 4.16Å; L43-V48 VanDerWaalsContact O-CB 3.29Å; L43-V48 WeakPolarHBondContact O-CB 3.48Å; L43-V48 WeakPolarHBondContact O-CG2 3.37Å; L43-V48 PolarHBondContact O-N 3.01Å; L43-P51 HydrophobicContact CD1-CB 4.34Å; L43-L61 HydrophobicContact CD2-CB 4.34Å
44	R	91	Very high	83.4	Confident	170 Å²	170	73.9 Å²	73.9	64%	0.642	36%	0.362	S	S	*	.	H	α-helix	trans	-65.9	-44.9	174.9	-72.8	174.7	-164.3	-177.4	5.6	111.4	D40 T41 A46 G47	D40-R44 VanDerWaalsContact O-CG 3.26Å; D40-R44 WeakPolarHBondContact O-CG 3.48Å; D40-R44 PolarHBondContact O-N 2.99Å; T41-R44 PolarHBondContact O-N 3.25Å; R44-A46 PolarHBondContact O-N 3.01Å; R44-G47 PolarHBondContact O-N 3.32Å
45	E	92.2	Very high	81	Confident	91 Å²	91	82.3 Å²	82.3	43%	0.425	40%	0.398	S	S	.	.	H	α-helix	trans	-57.8	-38.7	174.2	-174.2	-168.4	-176.6	0	0	111.5	T41 L42 G47 T245 L246	T41-E45 PolarHBondContact O-N 3.18Å; L42-E45 PolarHBondContact O-N 3.45Å; E45-G47 PolarHBondContact O-N 2.94Å; E45-T245 WeakPolarHBondContact OE1-CB 3.45Å; E45-T245 VanDerWaalsContact OE2-CA 3.28Å; E45-T245 WeakPolarHBondContact OE2-CA 3.19Å; E45-L246 VanDerWaalsContact CD-N 3.3Å; E45-L246 PolarHBondContact OE1-N 2.92Å; E45-L246 PolarHBondContact OE2-N 3.48Å
46	A	90.5	Very high	78.7	Confident	16 Å²	16	94.3 Å²	94.3	13%	0.132	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	4.3	176.2	0	0	0	0	0	114.9	L11 L14 L42 L43 R44	L11-A46 HydrophobicContact CB-CB 4.25Å; L11-A46 HydrophobicContact CD1-CB 4.36Å; L14-A46 HydrophobicContact CD2-CB 3.95Å; L42-A46 WeakPolarHBondContact O-CB 2.8Å; L42-A46 PolarHBondContact O-N 3.11Å; L43-A46 PolarHBondContact O-N 3.16Å; R44-A46 PolarHBondContact O-N 3.01Å
47	G	89.3	Confident	76.7	Confident	59 Å²	59	96 Å²	96	61%	0.608	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	14	176.3	0	0	0	0	0	115.4	L43 R44 E45 Q49	L43-G47 PolarHBondContact O-N 2.65Å; R44-G47 PolarHBondContact O-N 3.32Å; E45-G47 PolarHBondContact O-N 2.94Å; G47-Q49 PolarHBondContact O-N 2.79Å
48	V	86.6	Confident	74.8	Confident	20 Å²	20	99.8 Å²	99.8	12%	0.121	46%	0.462	C	S	.	.			trans	-78.7	109.4	178.7	-176.9	0	0	0	0	110.4	L11 L43	L11-V48 HydrophobicContact CD1-CG2 3.77Å; L11-V48 HydrophobicContact CD2-CG2 4.05Å; L11-V48 HydrophobicContact CG-CG2 4.45Å; L43-V48 HydrophobicContact CB-CB 4.25Å; L43-V48 HydrophobicContact CB-CG2 4.44Å; L43-V48 HydrophobicContact CD2-CG2 4.16Å; L43-V48 VanDerWaalsContact O-CB 3.29Å; L43-V48 WeakPolarHBondContact O-CB 3.48Å; L43-V48 WeakPolarHBondContact O-CG2 3.37Å; L43-V48 PolarHBondContact O-N 3.01Å
49	Q	72.4	Confident	73.4	Confident	161 Å²	161	106.3 Å²	106.3	75%	0.752	49%	0.492	S	S	*	.			trans	-79.4	126.9	173.9	-61.3	-175.4	-3.3	0	0	110.2	G47	G47-Q49 PolarHBondContact O-N 2.79Å
50	Y	65.9	Low	72.6	Confident	194 Å²	194	108.7 Å²	108.7	76%	0.761	50%	0.501	S	S	*	.			trans	60.8	76.5	176.8	-47.2	-82	0	0	0	116.1	N52	Y50-N52 PolarHBondContact O-N 2.99Å
51	P	61.7	Low	72.4	Confident	34 Å²	34	106.5 Å²	106.5	22%	0.221	49%	0.489	C	S	.	.			trans	-67.5	23.2	172.1	27.5	-33.7	0	0	0	114.9	L43	L43-P51 HydrophobicContact CD1-CB 4.34Å
52	N	54	Low	72.3	Confident	141 Å²	141	108.5 Å²	108.5	75%	0.754	49%	0.494	S	S	*	.			trans	-68.2	143.5	-156.9	-129.1	-9	0	0	0	115.4	Y50 R54	Y50-N52 PolarHBondContact O-N 2.99Å; N52-R54 PolarHBondContact O-N 2.99Å
53	S	52.1	Low	72.4	Confident	68 Å²	68	109.8 Å²	109.8	48%	0.476	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	10.1	-144.1	-85.8	0	0	0	0	118.5	K57	S53-K57 WeakPolarHBondContact O-CE 3.33Å; S53-K57 PolarHBondContact OG-NZ 2.91Å
54	R	50.7	Low	72.6	Confident	253 Å²	253	110.3 Å²	110.3	96%	0.955	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	1.3	-166.6	-71.6	-175.2	-175.5	164.4	1.7	117.8	N52	N52-R54 PolarHBondContact O-N 2.99Å
55	K	46.3	Very low	72.9	Confident	187 Å²	187	104.3 Å²	104.3	81%	0.813	49%	0.486	S	S	*	.	S	Bend	trans	-107.1	136.1	166.9	-82.1	-178.7	175.6	177.6	0	109.1	K57	K55-K57 VanDerWaalsContact O-CA 3.27Å; K55-K57 WeakPolarHBondContact O-CA 3.23Å; K55-K57 VanDerWaalsContact O-CG 3.29Å; K55-K57 WeakPolarHBondContact O-CG 3.27Å; K55-K57 PolarHBondContact O-N 3.38Å
56	R	47	Very low	72.9	Confident	266 Å²	266	100 Å²	100	100%	1.004	47%	0.466	S	S	*	.	S	Bend	trans	-42.2	105	177.3	-118.6	172.7	167.8	167.6	-5	108.7
57	K	52.4	Low	73	Confident	129 Å²	129	99.5 Å²	99.5	56%	0.561	46%	0.462	S	S	*	.			trans	-76.2	130	-150.5	-71.8	176	169.8	-179.4	0	112.1	S53 K55 Q59	S53-K57 WeakPolarHBondContact O-CE 3.33Å; S53-K57 PolarHBondContact OG-NZ 2.91Å; K55-K57 VanDerWaalsContact O-CA 3.27Å; K55-K57 WeakPolarHBondContact O-CA 3.23Å; K55-K57 VanDerWaalsContact O-CG 3.29Å; K55-K57 WeakPolarHBondContact O-CG 3.27Å; K55-K57 PolarHBondContact O-N 3.38Å; K57-Q59 PolarHBondContact O-N 3.14Å; K57-Q59 VanDerWaalsContact O-N 3.08Å
58	K	55.7	Low	73.3	Confident	164 Å²	164	99.7 Å²	99.7	71%	0.713	45%	0.452	S	S	*	.			trans	-58.9	112.1	149.8	-165.4	174.5	-175.5	178.4	0	106	Y60	K58-Y60 VanDerWaalsContact C-N 3.28Å; K58-Y60 HydrophobicContact CB-CE2 4.38Å; K58-Y60 HydrophobicContact CD-CE1 4.25Å; K58-Y60 VanDerWaalsContact O-CD2 3.31Å; K58-Y60 WeakPolarHBondContact O-CD2 3.34Å; K58-Y60 PolarHBondContact O-N 3.43Å
59	Q	66.8	Low	73.6	Confident	137 Å²	137	99 Å²	99	64%	0.64	45%	0.447	S	S	*	.			trans	-76.8	83.7	-176	-162.9	172.9	14.3	0	0	108.5	K57 L61	K57-Q59 PolarHBondContact O-N 3.14Å; K57-Q59 VanDerWaalsContact O-N 3.08Å; Q59-L61 PolarHBondContact O-N 3.48Å; Q59-L61 VanDerWaalsContact O-N 3.14Å
60	Y	77.9	Confident	74.7	Confident	89 Å²	89	93.5 Å²	93.5	35%	0.349	42%	0.423	S	S	.	.	S	Bend	trans	-56.7	-30.5	-176.4	-72	-77.9	0	0	0	113.7	Q15 K58	Q15-Y60 VanDerWaalsContact CG-O 3.27Å; Q15-Y60 WeakPolarHBondContact CG-O 3.36Å; Q15-Y60 PolarHBondContact NE2-O 3.3Å; K58-Y60 VanDerWaalsContact C-N 3.28Å; K58-Y60 HydrophobicContact CB-CE2 4.38Å; K58-Y60 HydrophobicContact CD-CE1 4.25Å; K58-Y60 VanDerWaalsContact O-CD2 3.31Å; K58-Y60 WeakPolarHBondContact O-CD2 3.34Å; K58-Y60 PolarHBondContact O-N 3.43Å
61	L	87.8	Confident	76	Confident	6 Å²	6	86.6 Å²	86.6	3%	0.031	40%	0.403	C	S	.	.	S	Bend	trans	-148.6	129.3	180	-167.1	62.2	0	0	0	110.3	L14 K39 L42 L43 Q59 L63 I81	L14-L61 HydrophobicContact CD1-CD1 4.13Å; L14-L61 HydrophobicContact CD1-CD2 3.93Å; L14-L61 HydrophobicContact CD2-CD2 4.14Å; L14-L61 HydrophobicContact CG-CD1 3.9Å; L14-L61 HydrophobicContact CG-CD2 4.09Å; K39-L61 WeakPolarHBondContact CE-O 3.42Å; K39-L61 HydrophobicContact CG-CD2 4.48Å; K39-L61 PolarHBondContact NZ-O 2.68Å; L42-L61 HydrophobicContact CD1-CD2 4.47Å; L43-L61 HydrophobicContact CD2-CB 4.34Å; Q59-L61 PolarHBondContact O-N 3.48Å; Q59-L61 VanDerWaalsContact O-N 3.14Å; L61-L63 HydrophobicContact CD2-CD1 3.66Å; L61-L63 HydrophobicContact CD2-CG 4.03Å; L61-L63 HydrophobicContact CG-CD1 4.21Å; L61-L63 HydrophobicContact CG-CG 4.08Å; L61-I81 HydrophobicContact CD1-CD1 3.97Å; L61-I81 HydrophobicContact CD1-CG1 4.09Å; L61-I81 HydrophobicContact CD2-CD1 4.34Å; L61-I81 HydrophobicContact CG-CD1 4.46Å
62	K	93.2	Very high	77.6	Confident	89 Å²	89	86 Å²	86	39%	0.387	40%	0.401	S	S	.	.			trans	-91.9	115.8	175.5	-169	-174.9	-177.8	-162.8	0	108.9	I81 G82 T85	K62-I81 WeakPolarHBondContact O-CA 3.4Å; K62-G82 PolarHBondContact O-N 2.87Å; K62-T85 HydrophobicContact CD-CG2 4.42Å; K62-T85 WeakPolarHBondContact CE-OG1 3.3Å; K62-T85 HydrophobicContact CG-CG2 4.09Å; K62-T85 PolarHBondContact NZ-OG1 2.78Å
63	L	95.5	Very high	79.7	Confident	28 Å²	28	79.3 Å²	79.3	15%	0.147	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.5	178.8	-74.9	170.4	0	0	0	110.2	L35 F38 K39 L61 V79 G80 I81	L35-L63 HydrophobicContact CD1-CB 4.17Å; L35-L63 HydrophobicContact CD2-CB 4.47Å; L35-L63 HydrophobicContact CG-CB 4.39Å; F38-L63 HydrophobicContact CD1-CD1 4.03Å; F38-L63 HydrophobicContact CE1-CD1 4.26Å; F38-L63 HydrophobicContact CE1-CD2 4.45Å; K39-L63 HydrophobicContact CB-CD1 3.61Å; K39-L63 HydrophobicContact CD-CD1 4.17Å; K39-L63 HydrophobicContact CG-CD1 3.9Å; L61-L63 HydrophobicContact CD2-CD1 3.66Å; L61-L63 HydrophobicContact CD2-CG 4.03Å; L61-L63 HydrophobicContact CG-CD1 4.21Å; L61-L63 HydrophobicContact CG-CG 4.08Å; L63-V79 HydrophobicContact CD2-CG1 3.71Å; L63-G80 VanDerWaalsContact CA-O 3.3Å; L63-G80 WeakPolarHBondContact CA-O 3.23Å; L63-I81 HydrophobicContact CD2-CB 3.7Å; L63-I81 HydrophobicContact CD2-CD1 4.12Å; L63-I81 HydrophobicContact CD2-CG1 3.82Å
64	G	96	Very high	81.9	Confident	15 Å²	15	76.7 Å²	76.7	16%	0.155	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	167.8	172.4	0	0	0	0	0	110.5	V79 G80	G64-V79 WeakPolarHBondContact O-CA 2.99Å; G64-G80 PolarHBondContact N-O 2.97Å; G64-G80 PolarHBondContact O-N 3.27Å
65	H	96.6	Very high	84.2	Confident	44 Å²	44	64.7 Å²	64.7	20%	0.204	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.4	176.1	67.6	83.3	0	0	0	112.1	L35 G67 L77 V78	L35-H65 HydrophobicContact CD2-CB 4.43Å; H65-G67 VanDerWaalsContact C-N 3.29Å; H65-G67 PolarHBondContact O-N 3.5Å; H65-L77 HydrophobicContact CB-CD1 3.77Å; H65-L77 HydrophobicContact CB-CD2 4.29Å; H65-V78 CarbonylContact C-O 3.52Å; H65-V78 VanDerWaalsContact CA-O 3.24Å; H65-V78 WeakPolarHBondContact CA-O 3.45Å
66	G	92.9	Very high	86.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-84.5	5.3	-170	0	0	0	0	0	115.1	V78 M91 L92 Q229	G66-V78 PolarHBondContact N-O 3Å; G66-M91 CarbonylContact O-C 3.4Å; G66-M91 VanDerWaalsContact O-C 3.29Å; G66-L92 VanDerWaalsContact O-CD2 3.27Å; G66-L92 WeakPolarHBondContact O-CD2 3.41Å; G66-L92 PolarHBondContact O-N 3.24Å; G66-Q229 PolarHBondContact O-NE2 3.1Å
67	G	92.4	Very high	89.1	Confident	5 Å²	5	43.1 Å²	43.1	5%	0.052	22%	0.215	C	C	.	.	S	Bend	trans	160.4	131.5	179	0	0	0	0	0	111.5	H65 L69 R226	H65-G67 VanDerWaalsContact C-N 3.29Å; H65-G67 PolarHBondContact O-N 3.5Å; G67-L69 PolarHBondContact O-N 3.13Å; G67-R226 PolarHBondContact O-NH2 3.24Å
68	T	94.4	Very high	91.3	Very high	64 Å²	64	37 Å²	37	39%	0.393	19%	0.188	S	C	.	.			trans	-63.2	131.7	179	-52.3	0	0	0	0	109.9
69	L	94.6	Very high	93.3	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.031	15%	0.154	C	C	.	.			trans	-106.8	132.3	165	-162.2	136.5	0	0	0	107.4	K25 S31 G67 A73 R226	K25-L69 HydrophobicContact CD-CB 4.09Å; K25-L69 HydrophobicContact CD-CD2 3.74Å; K25-L69 HydrophobicContact CG-CD2 4.34Å; S31-L69 PolarHBondContact OG-N 3.27Å; S31-L69 PolarHBondContact OG-O 3.04Å; G67-L69 PolarHBondContact O-N 3.13Å; L69-A73 HydrophobicContact CD2-CB 3.37Å; L69-A73 WeakPolarHBondContact CD2-O 3.3Å; L69-A73 HydrophobicContact CG-CB 4.04Å; L69-R226 HydrophobicContact CD1-CB 3.35Å; L69-R226 HydrophobicContact CD1-CG 4.27Å
70	D	93.7	Very high	94.8	Very high	45 Å²	45	22.6 Å²	22.6	24%	0.241	12%	0.124	C	C	.	.			trans	-56.5	151	-176.2	-69.6	-38.3	0	0	0	111	K25 A72 A73 R205	K25-D70 WeakPolarHBondContact CE-O 3.39Å; K25-D70 PolarHBondContact NZ-O 3.14Å; D70-A72 PolarHBondContact O-N 3Å; D70-A73 HydrophobicContact CB-CB 4.2Å; D70-A73 PolarHBondContact O-N 3.17Å; D70-R205 IonicContact OD1-CZ 3.84Å; D70-R205 IonicContact OD1-NH2 3.08Å; D70-R205 PolarHBondContact OD1-NH2 2.95Å; D70-R205 IonicContact OD2-CZ 2.88Å; D70-R205 VanDerWaalsContact OD2-CZ 3.22Å; D70-R205 IonicContact OD2-NE 3Å; D70-R205 PolarHBondContact OD2-NE 3.26Å; D70-R205 IonicContact OD2-NH2 3.92Å; D70-R205 PolarHBondContact OD2-NH2 2.88Å
71	S	93.9	Very high	95.7	Very high	48 Å²	48	18.4 Å²	18.4	34%	0.336	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-42.3	-179.6	-79.7	0	0	0	0	111.8	K25 G28 P29 T30 A73	K25-S71 PolarHBondContact NZ-O 3.49Å; G28-S71 CarbonylContact C-O 3.55Å; G28-S71 PolarHBondContact N-O 2.8Å; G28-S71 WeakPolarHBondContact O-CB 3.14Å; P29-S71 WeakPolarHBondContact O-CA 3.38Å; T30-S71 WeakPolarHBondContact CG2-OG 3.49Å; S71-A73 PolarHBondContact O-N 3.42Å
72	A	95.2	Very high	96	Very high	21 Å²	21	18.7 Å²	18.7	17%	0.174	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-14.5	178.7	0	0	0	0	0	114.4	Q27 D70 T114	Q27-A72 VanDerWaalsContact CG-O 3.27Å; Q27-A72 WeakPolarHBondContact CG-O 3.4Å; Q27-A72 PolarHBondContact NE2-O 2.68Å; Q27-A72 VanDerWaalsContact NE2-O 3.13Å; D70-A72 PolarHBondContact O-N 3Å; A72-T114 HydrophobicContact CB-CG2 3.58Å
73	A	97.8	Very high	96.1	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	12%	0.115	C	C	.	.			trans	-94.1	159.7	-179.2	0	0	0	0	0	111.4	K25 L69 D70 S71 L224	K25-A73 PolarHBondContact NZ-O 3.34Å; L69-A73 HydrophobicContact CD2-CB 3.37Å; L69-A73 WeakPolarHBondContact CD2-O 3.3Å; L69-A73 HydrophobicContact CG-CB 4.04Å; D70-A73 HydrophobicContact CB-CB 4.2Å; D70-A73 PolarHBondContact O-N 3.17Å; S71-A73 PolarHBondContact O-N 3.42Å; A73-L224 CarbonylContact C-O 3.59Å; A73-L224 WeakPolarHBondContact CA-O 3.48Å; A73-L224 HydrophobicContact CB-CB 3.82Å; A73-L224 HydrophobicContact CB-CD2 3.92Å; A73-L224 HydrophobicContact CB-CG 3.88Å; A73-L224 WeakPolarHBondContact CB-O 3.34Å
74	S	98.8	Very high	96.1	Very high	14 Å²	14	17.2 Å²	17.2	10%	0.098	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	177.1	172.5	67.9	0	0	0	0	112.3	Y24 K25 L224 V225 R226	Y24-S74 WeakPolarHBondContact OH-CB 3.24Å; K25-S74 CarbonylContact O-C 3.57Å; K25-S74 WeakPolarHBondContact O-CA 3.45Å; K25-S74 VanDerWaalsContact O-CB 3.26Å; K25-S74 WeakPolarHBondContact O-CB 3.3Å; S74-L224 PolarHBondContact N-O 3.32Å; S74-V225 CarbonylContact O-C 3.12Å; S74-V225 WeakPolarHBondContact O-CA 3.47Å; S74-R226 PolarHBondContact O-N 3.05Å
75	G	98.6	Very high	96.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.3	-154	170.7	0	0	0	0	0	114.6	K25 L77 R226	K25-G75 PolarHBondContact N-O 3.19Å; K25-G75 PolarHBondContact O-N 2.93Å; G75-L77 PolarHBondContact O-N 3.3Å; G75-R226 CarbonylContact C-O 3.6Å; G75-R226 WeakPolarHBondContact CA-O 3.37Å
76	V	98.6	Very high	96	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	123.8	-171.3	-179.1	0	0	0	0	110.9	A22 V78 R226 Q229 F232 L234 V238	A22-V76 HydrophobicContact CB-CG1 4Å; V76-V78 HydrophobicContact CG1-CG2 4.22Å; V76-R226 WeakPolarHBondContact CG2-O 3.35Å; V76-R226 PolarHBondContact N-O 3.4Å; V76-R226 PolarHBondContact O-NE 3.09Å; V76-R226 PolarHBondContact O-NH2 2.93Å; V76-Q229 HydrophobicContact CG1-CB 4.08Å; V76-F232 HydrophobicContact CG1-CB 4.01Å; V76-L234 HydrophobicContact CG2-CB 3.87Å; V76-L234 HydrophobicContact CG2-CD1 4.44Å; V76-V238 HydrophobicContact CB-CG2 4.29Å; V76-V238 HydrophobicContact CG1-CG2 4.31Å; V76-V238 HydrophobicContact CG2-CG2 3.79Å
77	L	98.4	Very high	96	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	102.1	172	-159.4	6.8	0	0	0	108.5	I23 K25 H65 G75 V79	I23-L77 HydrophobicContact CD1-CD2 4.03Å; I23-L77 HydrophobicContact CG1-CB 4.12Å; I23-L77 HydrophobicContact CG1-CD2 4.03Å; I23-L77 PolarHBondContact N-O 3.08Å; I23-L77 PolarHBondContact O-N 3.25Å; K25-L77 HydrophobicContact CB-CB 4.17Å; K25-L77 HydrophobicContact CB-CG 4.47Å; H65-L77 HydrophobicContact CB-CD1 3.77Å; H65-L77 HydrophobicContact CB-CD2 4.29Å; G75-L77 PolarHBondContact O-N 3.3Å; L77-V79 HydrophobicContact CD2-CG2 4.34Å; L77-V79 PolarHBondContact O-N 2.76Å
78	V	98.2	Very high	96.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.1	180	179	0	0	0	0	109.9	L20 F21 H65 G66 V76 M91 Q229 F232	L20-V78 HydrophobicContact CD2-CG1 4.4Å; F21-V78 CarbonylContact O-C 3.6Å; F21-V78 WeakPolarHBondContact O-CA 3.45Å; H65-V78 CarbonylContact C-O 3.52Å; H65-V78 VanDerWaalsContact CA-O 3.24Å; H65-V78 WeakPolarHBondContact CA-O 3.45Å; G66-V78 PolarHBondContact N-O 3Å; V76-V78 HydrophobicContact CG1-CG2 4.22Å; V78-M91 HydrophobicContact CG1-CG 3.94Å; V78-M91 HydrophobicContact CG1-SD 4.1Å; V78-M91 HydrophobicContact CG2-SD 4.43Å; V78-Q229 HydrophobicContact CG2-CB 3.82Å; V78-Q229 HydrophobicContact CG2-CG 3.73Å; V78-F232 HydrophobicContact CB-CD2 4.43Å; V78-F232 HydrophobicContact CG1-CD2 4.03Å; V78-F232 HydrophobicContact CG1-CE2 3.89Å; V78-F232 HydrophobicContact CG2-CB 4.09Å; V78-F232 HydrophobicContact CG2-CD2 3.49Å; V78-F232 VanDerWaalsContact CG2-CD2 3.49Å; V78-F232 HydrophobicContact CG2-CE2 4.23Å; V78-F232 HydrophobicContact CG2-CG 3.99Å
79	V	98.3	Very high	96	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.3	-178.1	178.2	0	0	0	0	109.4	L20 F21 I23 L35 L63 G64 L77	L20-V79 WeakPolarHBondContact CA-O 3.31Å; F21-V79 HydrophobicContact CD1-CB 4.48Å; F21-V79 HydrophobicContact CD2-CB 4.45Å; F21-V79 HydrophobicContact CE1-CB 3.98Å; F21-V79 HydrophobicContact CE1-CG1 3.73Å; F21-V79 HydrophobicContact CE2-CB 3.96Å; F21-V79 HydrophobicContact CE2-CG1 4.17Å; F21-V79 HydrophobicContact CE2-CG2 4.49Å; F21-V79 HydrophobicContact CZ-CB 3.69Å; F21-V79 HydrophobicContact CZ-CG1 3.44Å; F21-V79 VanDerWaalsContact CZ-CG1 3.44Å; F21-V79 PolarHBondContact N-O 2.84Å; F21-V79 PolarHBondContact O-N 3.13Å; I23-V79 HydrophobicContact CD1-CG2 3.79Å; I23-V79 HydrophobicContact CG1-CG2 3.83Å; I23-V79 HydrophobicContact CG2-CG2 4.35Å; L35-V79 HydrophobicContact CD1-CB 4.4Å; L35-V79 HydrophobicContact CD1-CG1 3.65Å; L35-V79 HydrophobicContact CD1-CG2 3.84Å; L63-V79 HydrophobicContact CD2-CG1 3.71Å; G64-V79 WeakPolarHBondContact O-CA 2.99Å; L77-V79 HydrophobicContact CD2-CG2 4.34Å; L77-V79 PolarHBondContact O-N 2.76Å
80	G	97.9	Very high	95.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.7	170.9	0	0	0	0	0	109.8	G19 L63 G64 T85	G19-G80 WeakPolarHBondContact O-CA 2.86Å; L63-G80 VanDerWaalsContact CA-O 3.3Å; L63-G80 WeakPolarHBondContact CA-O 3.23Å; G64-G80 PolarHBondContact N-O 2.97Å; G64-G80 PolarHBondContact O-N 3.27Å; G80-T85 VanDerWaalsContact O-CG2 3.22Å; G80-T85 WeakPolarHBondContact O-CG2 3.44Å
81	I	96.8	Very high	95.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.7	175.7	-171.3	164.4	0	0	0	110	L14 L17 N18 G19 F21 L61 K62 L63 N83 G84 L253	L14-I81 HydrophobicContact CD1-CD1 4.2Å; L17-I81 HydrophobicContact CB-CD1 3.73Å; L17-I81 HydrophobicContact CB-CG1 4.11Å; L17-I81 HydrophobicContact CB-CG2 4.08Å; L17-I81 HydrophobicContact CD1-CD1 3.96Å; L17-I81 HydrophobicContact CG-CD1 4.43Å; N18-I81 WeakPolarHBondContact CA-O 3.33Å; G19-I81 PolarHBondContact N-O 3.43Å; G19-I81 PolarHBondContact O-N 2.77Å; F21-I81 HydrophobicContact CD1-CG2 4.4Å; F21-I81 HydrophobicContact CE1-CB 4.1Å; F21-I81 HydrophobicContact CE1-CG2 4.01Å; L61-I81 HydrophobicContact CD1-CD1 3.97Å; L61-I81 HydrophobicContact CD1-CG1 4.09Å; L61-I81 HydrophobicContact CD2-CD1 4.34Å; L61-I81 HydrophobicContact CG-CD1 4.46Å; K62-I81 WeakPolarHBondContact O-CA 3.4Å; L63-I81 HydrophobicContact CD2-CB 3.7Å; L63-I81 HydrophobicContact CD2-CD1 4.12Å; L63-I81 HydrophobicContact CD2-CG1 3.82Å; I81-N83 PolarHBondContact O-N 2.88Å; I81-G84 WeakPolarHBondContact O-CA 3.26Å; I81-G84 PolarHBondContact O-N 3.34Å; I81-L253 HydrophobicContact CG2-CD1 3.62Å
82	G	95.3	Very high	95.7	Very high	13 Å²	13	28.8 Å²	28.8	13%	0.134	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	57.6	-128.5	-179.4	0	0	0	0	0	112.1	K62 G84 T85	K62-G82 PolarHBondContact O-N 2.87Å; G82-G84 PolarHBondContact O-N 3.03Å; G82-T85 WeakPolarHBondContact O-CB 3.46Å; G82-T85 WeakPolarHBondContact O-CG2 3.34Å; G82-T85 PolarHBondContact O-N 2.88Å; G82-T85 PolarHBondContact O-OG1 3.14Å
83	N	94.3	Very high	95.4	Very high	85 Å²	85	32.9 Å²	32.9	46%	0.455	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-65.8	-21.6	175.8	-75.1	-24.9	0	0	0	113.7	N18 I81 T85 K86	N18-N83 HydrophobicContact CB-CB 4.3Å; N18-N83 WeakPolarHBondContact OD1-CB 3.29Å; N18-N83 PolarHBondContact OD1-N 3.03Å; I81-N83 PolarHBondContact O-N 2.88Å; N83-T85 PolarHBondContact O-N 2.82Å; N83-T85 VanDerWaalsContact O-N 3.11Å; N83-K86 WeakPolarHBondContact O-CB 3.49Å; N83-K86 WeakPolarHBondContact O-CG 3.49Å; N83-K86 PolarHBondContact O-N 2.89Å
84	G	95.8	Very high	95.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-60.7	-21.1	173.5	0	0	0	0	0	113.3	G19 L20 I81 G82 K86 M87	G19-G84 WeakPolarHBondContact O-CA 3.33Å; L20-G84 WeakPolarHBondContact CD2-O 3.27Å; I81-G84 WeakPolarHBondContact O-CA 3.26Å; I81-G84 PolarHBondContact O-N 3.34Å; G82-G84 PolarHBondContact O-N 3.03Å; G84-K86 PolarHBondContact O-N 2.88Å; G84-K86 VanDerWaalsContact O-N 3.16Å; G84-M87 WeakPolarHBondContact O-CB 3.29Å; G84-M87 PolarHBondContact O-N 2.98Å
85	T	95.6	Very high	95	Very high	23 Å²	23	34.7 Å²	34.7	14%	0.141	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-58.5	-25.7	170.8	56.4	0	0	0	0	114	K62 G80 G82 N83 M87 L88	K62-T85 HydrophobicContact CD-CG2 4.42Å; K62-T85 WeakPolarHBondContact CE-OG1 3.3Å; K62-T85 HydrophobicContact CG-CG2 4.09Å; K62-T85 PolarHBondContact NZ-OG1 2.78Å; G80-T85 VanDerWaalsContact O-CG2 3.22Å; G80-T85 WeakPolarHBondContact O-CG2 3.44Å; G82-T85 WeakPolarHBondContact O-CB 3.46Å; G82-T85 WeakPolarHBondContact O-CG2 3.34Å; G82-T85 PolarHBondContact O-N 2.88Å; G82-T85 PolarHBondContact O-OG1 3.14Å; N83-T85 PolarHBondContact O-N 2.82Å; N83-T85 VanDerWaalsContact O-N 3.11Å; T85-M87 VanDerWaalsContact C-N 3.29Å; T85-L88 HydrophobicContact CG2-CD1 4.39Å; T85-L88 WeakPolarHBondContact O-CG 3.44Å; T85-L88 PolarHBondContact O-N 2.89Å
86	K	94.3	Very high	94.9	Very high	137 Å²	137	35.3 Å²	35.3	60%	0.596	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-70.5	-26.6	175.8	-62.3	178.4	179.9	178.1	0	112.1	N83 G84 L88 S89	N83-K86 WeakPolarHBondContact O-CB 3.49Å; N83-K86 WeakPolarHBondContact O-CG 3.49Å; N83-K86 PolarHBondContact O-N 2.89Å; G84-K86 PolarHBondContact O-N 2.88Å; G84-K86 VanDerWaalsContact O-N 3.16Å; K86-L88 VanDerWaalsContact C-N 3.32Å; K86-S89 PolarHBondContact O-OG 2.79Å
87	M	92.6	Very high	94.9	Very high	43 Å²	43	38 Å²	38	21%	0.212	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-80.4	-12.4	-179.4	-59.7	174.8	68.2	0	0	113.1	L20 G84 T85 S89 T90 C256 P257	L20-M87 HydrophobicContact CD1-CB 3.96Å; L20-M87 HydrophobicContact CD1-CE 3.94Å; L20-M87 HydrophobicContact CD1-SD 4.31Å; L20-M87 HydrophobicContact CD2-CB 4.26Å; L20-M87 HydrophobicContact CG-CB 4.26Å; L20-M87 HydrophobicContact CG-CE 4.45Å; L20-M87 HydrophobicContact CG-SD 4.25Å; G84-M87 WeakPolarHBondContact O-CB 3.29Å; G84-M87 PolarHBondContact O-N 2.98Å; T85-M87 VanDerWaalsContact C-N 3.29Å; M87-S89 PolarHBondContact O-N 3.47Å; M87-S89 VanDerWaalsContact O-N 3.11Å; M87-T90 WeakPolarHBondContact O-CB 3.28Å; M87-T90 PolarHBondContact O-N 3.02Å; M87-T90 PolarHBondContact O-OG1 3.12Å; M87-C256 HydrophobicContact SD-CB 3.87Å; M87-P257 VanDerWaalsContact CE-CD 3.42Å; M87-P257 HydrophobicContact CE-CG 4.21Å
88	L	94.7	Very high	95	Very high	16 Å²	16	39.1 Å²	39.1	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-21.6	-174.7	-65.2	175.2	0	0	0	113.7	L20 T85 K86 T90 M91 L92	L20-L88 HydrophobicContact CD2-CD2 3.61Å; L20-L88 HydrophobicContact CD2-CG 4.36Å; T85-L88 HydrophobicContact CG2-CD1 4.39Å; T85-L88 WeakPolarHBondContact O-CG 3.44Å; T85-L88 PolarHBondContact O-N 2.89Å; K86-L88 VanDerWaalsContact C-N 3.32Å; L88-T90 VanDerWaalsContact C-N 3.28Å; L88-T90 PolarHBondContact O-N 2.81Å; L88-M91 WeakPolarHBondContact O-CB 3.4Å; L88-M91 PolarHBondContact O-N 3.44Å; L88-L92 PolarHBondContact O-N 3.03Å
89	S	92.3	Very high	95	Very high	72 Å²	72	41.3 Å²	41.3	50%	0.503	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-38.8	172.1	52.5	0	0	0	0	112.3	K86 M87 M91 L92 T93	K86-S89 PolarHBondContact O-OG 2.79Å; M87-S89 PolarHBondContact O-N 3.47Å; M87-S89 VanDerWaalsContact O-N 3.11Å; S89-M91 VanDerWaalsContact C-N 3.28Å; S89-M91 PolarHBondContact O-N 3.03Å; S89-L92 WeakPolarHBondContact O-CB 3.45Å; S89-L92 PolarHBondContact O-N 3.47Å; S89-T93 PolarHBondContact O-N 2.97Å
90	T	92.1	Very high	95	Very high	74 Å²	74	41.3 Å²	41.3	45%	0.454	23%	0.234	S	C	.	.	H	α-helix	trans	-65.9	-33.2	177.5	68.1	0	0	0	0	111.9	M87 L88 L92 T93 G94	M87-T90 WeakPolarHBondContact O-CB 3.28Å; M87-T90 PolarHBondContact O-N 3.02Å; M87-T90 PolarHBondContact O-OG1 3.12Å; L88-T90 VanDerWaalsContact C-N 3.28Å; L88-T90 PolarHBondContact O-N 2.81Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.41Å; T90-T93 PolarHBondContact O-N 3.23Å; T90-T93 PolarHBondContact O-OG1 3.47Å; T90-G94 PolarHBondContact O-N 2.96Å
91	M	93.8	Very high	95.1	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.064	24%	0.241	C	C	.	.	H	α-helix	trans	-72.2	-26	177.4	-61.9	-65.7	132.6	0	0	112.3	L20 G66 V78 L88 S89 K96 Q229 F232	L20-M91 HydrophobicContact CD1-CE 3.71Å; L20-M91 HydrophobicContact CD1-CG 4.27Å; L20-M91 HydrophobicContact CD1-SD 4.44Å; G66-M91 CarbonylContact O-C 3.4Å; G66-M91 VanDerWaalsContact O-C 3.29Å; V78-M91 HydrophobicContact CG1-CG 3.94Å; V78-M91 HydrophobicContact CG1-SD 4.1Å; V78-M91 HydrophobicContact CG2-SD 4.43Å; L88-M91 WeakPolarHBondContact O-CB 3.4Å; L88-M91 PolarHBondContact O-N 3.44Å; S89-M91 VanDerWaalsContact C-N 3.28Å; S89-M91 PolarHBondContact O-N 3.03Å; M91-K96 PolarHBondContact O-NZ 3.35Å; M91-Q229 PolarHBondContact O-NE2 3.37Å; M91-F232 HydrophobicContact SD-CE2 4.39Å
92	L	90.4	Very high	95.2	Very high	93 Å²	93	42.5 Å²	42.5	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-69.3	-43.4	175.3	-67.9	170.7	0	0	0	110.7	G66 L88 S89 T90 K96 G200	G66-L92 VanDerWaalsContact O-CD2 3.27Å; G66-L92 WeakPolarHBondContact O-CD2 3.41Å; G66-L92 PolarHBondContact O-N 3.24Å; L88-L92 PolarHBondContact O-N 3.03Å; S89-L92 WeakPolarHBondContact O-CB 3.45Å; S89-L92 PolarHBondContact O-N 3.47Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.41Å; L92-K96 PolarHBondContact O-NZ 3.4Å; L92-G200 WeakPolarHBondContact O-CA 3.35Å
93	T	89.3	Confident	95.3	Very high	107 Å²	107	42.8 Å²	42.8	66%	0.656	24%	0.239	S	C	*	.	H	α-helix	trans	-84.7	-24.2	-178.6	56.3	0	0	0	0	113.6	S89 T90 G200	S89-T93 PolarHBondContact O-N 2.97Å; T90-T93 PolarHBondContact O-N 3.23Å; T90-T93 PolarHBondContact O-OG1 3.47Å; T93-G200 PolarHBondContact O-N 3.41Å; T93-G200 VanDerWaalsContact O-N 3.17Å
94	G	91.6	Very high	95.6	Very high	23 Å²	23	38.9 Å²	38.9	24%	0.237	22%	0.217	C	C	.	.	S	Bend	trans	-69.7	166.8	-177	0	0	0	0	0	115.4	T90 K96	T90-G94 PolarHBondContact O-N 2.96Å; G94-K96 PolarHBondContact O-NZ 3.29Å
95	S	95.6	Very high	95.7	Very high	29 Å²	29	39.1 Å²	39.1	20%	0.203	22%	0.22	C	C	.	.			trans	-60.9	146.1	179.8	172.1	0	0	0	0	112.5	E197 C198 G230	S95-E197 WeakPolarHBondContact OG-CG 3.37Å; S95-E197 PolarHBondContact OG-OE1 3.38Å; S95-C198 CarbonylContact C-O 3.54Å; S95-C198 WeakPolarHBondContact CA-O 3.43Å; S95-G230 PolarHBondContact O-N 2.96Å
96	K	98	Very high	95.8	Very high	13 Å²	13	41.4 Å²	41.4	6%	0.057	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.8	176.8	-62.8	169.3	-163.3	66.2	0	108.7	M91 L92 G94 Y98 E197 C198 K228 Q229	M91-K96 PolarHBondContact O-NZ 3.35Å; L92-K96 PolarHBondContact O-NZ 3.4Å; G94-K96 PolarHBondContact O-NZ 3.29Å; K96-Y98 HydrophobicContact CB-CD2 4.31Å; K96-Y98 HydrophobicContact CB-CE2 3.45Å; K96-Y98 VanDerWaalsContact CB-CE2 3.45Å; K96-Y98 HydrophobicContact CD-CE2 4.35Å; K96-Y98 VanDerWaalsContact CD-OH 3.31Å; K96-Y98 WeakPolarHBondContact CD-OH 3.29Å; K96-Y98 HydrophobicContact CG-CE2 4.5Å; K96-E197 WeakPolarHBondContact O-CA 3.22Å; K96-C198 PolarHBondContact N-O 3.12Å; K96-C198 PolarHBondContact O-N 2.95Å; K96-K228 WeakPolarHBondContact CA-O 3.47Å; K96-Q229 HydrophobicContact CG-CB 4.46Å; K96-Q229 HydrophobicContact CG-CG 4.24Å
97	K	98.7	Very high	96	Very high	57 Å²	57	35.2 Å²	35.2	25%	0.248	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	143	170.1	-62.7	-170.2	173	-149.5	0	111.8	I196 E197 R226 T227 K228	K97-I196 CarbonylContact C-O 3.5Å; K97-I196 WeakPolarHBondContact CA-O 3.27Å; K97-E197 WeakPolarHBondContact CE-OE1 3.2Å; K97-E197 WeakPolarHBondContact CE-OE2 3.39Å; K97-E197 HydrophobicContact CG-CB 4.02Å; K97-E197 HydrophobicContact CG-CG 3.9Å; K97-E197 IonicContact NZ-OE2 2.88Å; K97-E197 PolarHBondContact NZ-OE2 3Å; K97-R226 CarbonylContact O-C 3.54Å; K97-R226 WeakPolarHBondContact O-CA 3.39Å; K97-R226 WeakPolarHBondContact O-CG 3.27Å; K97-T227 VanDerWaalsContact CB-OG1 3.29Å; K97-T227 WeakPolarHBondContact CB-OG1 3.49Å; K97-T227 PolarHBondContact O-N 3.25Å; K97-T227 PolarHBondContact O-OG1 3.49Å; K97-K228 HydrophobicContact CB-CB 3.73Å; K97-K228 HydrophobicContact CD-CB 4.38Å; K97-K228 HydrophobicContact CD-CD 4.06Å; K97-K228 HydrophobicContact CG-CB 3.97Å; K97-K228 HydrophobicContact CG-CD 4.09Å; K97-K228 PolarHBondContact N-O 3.28Å; K97-K228 PolarHBondContact O-N 2.95Å
98	Y	98.9	Very high	96.3	Very high	23 Å²	23	33.3 Å²	33.3	9%	0.09	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.6	-179.8	-59.1	-92.8	0	0	0	110.9	K96 I196 V204 L224 V225 R226	K96-Y98 HydrophobicContact CB-CD2 4.31Å; K96-Y98 HydrophobicContact CB-CE2 3.45Å; K96-Y98 VanDerWaalsContact CB-CE2 3.45Å; K96-Y98 HydrophobicContact CD-CE2 4.35Å; K96-Y98 VanDerWaalsContact CD-OH 3.31Å; K96-Y98 WeakPolarHBondContact CD-OH 3.29Å; K96-Y98 HydrophobicContact CG-CE2 4.5Å; Y98-I196 PolarHBondContact N-O 2.83Å; Y98-I196 PolarHBondContact O-N 3.35Å; Y98-V204 HydrophobicContact CD1-CG2 4.25Å; Y98-V204 HydrophobicContact CD2-CG2 3.97Å; Y98-V204 HydrophobicContact CE2-CG2 4.41Å; Y98-V204 HydrophobicContact CG-CG2 3.88Å; Y98-L224 HydrophobicContact CD1-CD1 3.81Å; Y98-L224 HydrophobicContact CD1-CG 4.32Å; Y98-L224 HydrophobicContact CG-CD1 4.29Å; Y98-V225 CarbonylContact C-O 3.52Å; Y98-V225 VanDerWaalsContact CA-O 3.23Å; Y98-V225 WeakPolarHBondContact CA-O 3.27Å; Y98-R226 HydrophobicContact CD1-CB 3.76Å; Y98-R226 HydrophobicContact CD1-CG 4.06Å; Y98-R226 HydrophobicContact CE1-CB 3.59Å; Y98-R226 HydrophobicContact CE1-CG 3.69Å
99	V	98.9	Very high	96.3	Very high	47 Å²	47	35.6 Å²	35.6	29%	0.285	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.2	157.3	175.8	0	0	0	0	106.9	T193 L194 V225 T227	V99-T193 HydrophobicContact CG1-CG2 3.76Å; V99-L194 WeakPolarHBondContact CA-O 3.42Å; V99-V225 PolarHBondContact N-O 2.78Å; V99-V225 PolarHBondContact O-N 3.35Å; V99-T227 HydrophobicContact CB-CG2 4.46Å; V99-T227 HydrophobicContact CG2-CG2 3.9Å
100	A	98.8	Very high	96.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129	-176.8	0	0	0	0	0	110.7	T193 L194 I196 V204 E223 L224	A100-T193 CarbonylContact O-C 3.02Å; A100-T193 WeakPolarHBondContact O-CA 3.28Å; A100-L194 PolarHBondContact N-O 3.43Å; A100-L194 PolarHBondContact O-N 3.42Å; A100-I196 HydrophobicContact CB-CD1 4.11Å; A100-V204 HydrophobicContact CB-CG1 3.56Å; A100-E223 WeakPolarHBondContact CA-O 3.39Å; A100-L224 HydrophobicContact CB-CD1 3.85Å
101	V	98.9	Very high	96.7	Very high	25 Å²	25	30.3 Å²	30.3	15%	0.152	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.3	169.2	-175.6	0	0	0	0	107.7	L191 F192 K222 E223	V101-L191 HydrophobicContact CG1-CB 4.46Å; V101-L191 HydrophobicContact CG1-CD2 4.27Å; V101-F192 CarbonylContact C-O 3.49Å; V101-F192 VanDerWaalsContact CA-O 3.28Å; V101-F192 WeakPolarHBondContact CA-O 3.31Å; V101-K222 HydrophobicContact CB-CB 4.37Å; V101-K222 HydrophobicContact CG1-CB 4.16Å; V101-K222 WeakPolarHBondContact O-CA 3.31Å; V101-K222 WeakPolarHBondContact O-CB 3.44Å; V101-K222 PolarHBondContact O-N 3.32Å; V101-E223 HydrophobicContact CB-CB 4Å; V101-E223 HydrophobicContact CG2-CB 4.09Å; V101-E223 PolarHBondContact N-O 3.23Å; V101-E223 PolarHBondContact O-N 3.44Å; V101-E223 VanDerWaalsContact O-N 3.16Å
102	G	98.8	Very high	96.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	152	171.7	0	0	0	0	0	111.8	L191 F192 H220	G102-L191 WeakPolarHBondContact O-CA 3.29Å; G102-F192 PolarHBondContact N-O 2.89Å; G102-F192 WeakPolarHBondContact O-CD1 3.35Å; G102-F192 PolarHBondContact O-N 3.34Å; G102-F192 VanDerWaalsContact O-N 3.08Å; G102-H220 WeakPolarHBondContact CA-O 3.45Å
103	E	98.9	Very high	97.2	Very high	19 Å²	19	28.1 Å²	28.1	9%	0.089	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.9	171.4	-175.9	177.4	154.4	0	0	108.7	K106 P190 L191 A219 H220 K222	E103-K106 IonicContact OE1-NZ 3.23Å; E103-K106 PolarHBondContact OE1-NZ 3.01Å; E103-P190 WeakPolarHBondContact CA-O 3.5Å; E103-P190 HydrophobicContact CG-CB 4.3Å; E103-P190 HydrophobicContact CG-CG 4.49Å; E103-L191 HydrophobicContact CB-CD2 3.88Å; E103-L191 HydrophobicContact CG-CD2 4.08Å; E103-A219 WeakPolarHBondContact O-CA 3.19Å; E103-A219 WeakPolarHBondContact O-CB 3.41Å; E103-H220 PolarHBondContact N-O 3.2Å; E103-H220 PolarHBondContact O-N 2.93Å; E103-H220 IonicContact OE2-CE1 3.75Å; E103-H220 IonicContact OE2-NE2 3.22Å; E103-K222 HydrophobicContact CB-CB 4.41Å; E103-K222 IonicContact OE2-NZ 2.95Å; E103-K222 PolarHBondContact OE2-NZ 2.64Å
104	L	98.9	Very high	97.5	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	157.5	173.9	-70.9	170.8	0	0	0	111.6	K106 F123 I126 M131 F187 P190 F192 L215 C218 A219	L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 2.94Å; L104-F123 HydrophobicContact CB-CB 3.87Å; L104-F123 HydrophobicContact CB-CD1 4.49Å; L104-F123 HydrophobicContact CB-CG 4.04Å; L104-F123 HydrophobicContact CD1-CB 4.26Å; L104-I126 HydrophobicContact CD1-CB 4.41Å; L104-I126 HydrophobicContact CD1-CD1 4Å; L104-I126 HydrophobicContact CD1-CG2 4.21Å; L104-I126 HydrophobicContact CD2-CD1 3.9Å; L104-M131 HydrophobicContact CD1-CE 3.55Å; L104-M131 HydrophobicContact CD2-CE 4.05Å; L104-M131 HydrophobicContact CG-CE 4.01Å; L104-F187 HydrophobicContact CD1-CE2 4.13Å; L104-P190 HydrophobicContact CB-CB 4.43Å; L104-P190 PolarHBondContact N-O 3Å; L104-F192 HydrophobicContact CD2-CD1 4.46Å; L104-F192 HydrophobicContact CD2-CE1 3.98Å; L104-F192 HydrophobicContact CG-CD1 3.97Å; L104-F192 HydrophobicContact CG-CE1 3.87Å; L104-L215 HydrophobicContact CD2-CD1 4.37Å; L104-C218 CarbonylContact C-O 3.52Å; L104-C218 WeakPolarHBondContact CA-O 3.37Å; L104-A219 HydrophobicContact CD2-CB 4.26Å
105	G	98.6	Very high	97.7	Very high	5 Å²	5	27.5 Å²	27.5	5%	0.052	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-1.7	172.2	0	0	0	0	0	115	E120 K121 C218	G105-E120 CarbonylContact O-C 3.6Å; G105-E120 WeakPolarHBondContact O-CA 3.3Å; G105-K121 WeakPolarHBondContact CA-O 3.42Å; G105-K121 PolarHBondContact O-N 3.49Å; G105-C218 PolarHBondContact N-O 3.24Å
106	K	98.7	Very high	97.7	Very high	72 Å²	72	30.9 Å²	30.9	31%	0.313	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.7	175	-64.1	178.9	-173.2	154.1	0	111.8	E103 L104 V117 M119 E120 C218 A219 H220	E103-K106 IonicContact OE1-NZ 3.23Å; E103-K106 PolarHBondContact OE1-NZ 3.01Å; L104-K106 VanDerWaalsContact C-N 3.28Å; L104-K106 PolarHBondContact O-N 2.94Å; K106-V117 HydrophobicContact CD-CG2 4.41Å; K106-M119 WeakPolarHBondContact CA-O 3.35Å; K106-E120 HydrophobicContact CG-CG 4.24Å; K106-C218 PolarHBondContact N-SG 3.22Å; K106-C218 VanDerWaalsContact N-SG 3.39Å; K106-A219 CarbonylContact O-C 3.51Å; K106-A219 WeakPolarHBondContact O-CA 3.41Å; K106-H220 PolarHBondContact O-N 3.19Å; K106-H220 PolarHBondContact O-ND1 3.28Å
107	A	98.4	Very high	97.8	Very high	6 Å²	6	33.3 Å²	33.3	5%	0.05	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	145	164.1	0	0	0	0	0	110.6	V117 I118 M119 C218	A107-V117 WeakPolarHBondContact O-CA 3.44Å; A107-I118 HydrophobicContact CB-CG1 4.2Å; A107-I118 PolarHBondContact O-N 3.38Å; A107-M119 HydrophobicContact CB-CB 4.1Å; A107-M119 PolarHBondContact N-O 2.92Å; A107-C218 HydrophobicContact CB-CB 3.97Å
108	T	98.3	Very high	97.7	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	156.7	173.5	64	0	0	0	0	111	T110 L111 D112 T116 V117 H220	T108-T110 PolarHBondContact O-N 2.89Å; T108-L111 PolarHBondContact O-N 2.93Å; T108-L111 VanDerWaalsContact O-N 3.15Å; T108-L111 PolarHBondContact OG1-N 3.42Å; T108-D112 WeakPolarHBondContact CB-O 3.23Å; T108-D112 PolarHBondContact OG1-N 2.94Å; T108-D112 VanDerWaalsContact OG1-N 3.1Å; T108-D112 PolarHBondContact OG1-O 2.86Å; T108-T116 WeakPolarHBondContact CA-O 3.19Å; T108-T116 WeakPolarHBondContact CB-O 3.42Å; T108-V117 HydrophobicContact CG2-CG2 4.33Å; T108-H220 HydrophobicContact CG2-CB 4.31Å
109	D	94.8	Very high	97.7	Very high	64 Å²	64	39.1 Å²	39.1	34%	0.342	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.7	178.1	64.9	-21.5	0	0	0	114.2	G115 T116 I118 F149	D109-G115 WeakPolarHBondContact OD1-CA 3.35Å; D109-T116 PolarHBondContact N-O 2.84Å; D109-T116 VanDerWaalsContact N-O 3.11Å; D109-T116 PolarHBondContact OD1-N 2.8Å; D109-I118 HydrophobicContact CB-CG2 4.01Å; D109-F149 HydrophobicContact CB-CE2 4.44Å; D109-F149 WeakPolarHBondContact O-CD2 3.36Å; D109-F149 WeakPolarHBondContact O-CE2 3.39Å
110	T	95.3	Very high	97.7	Very high	13 Å²	13	43.3 Å²	43.3	8%	0.08	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-6	175.8	62.7	0	0	0	0	114	T108 D112 G115 F149 R205	T108-T110 PolarHBondContact O-N 2.89Å; T110-D112 PolarHBondContact O-N 2.85Å; T110-D112 PolarHBondContact OG1-N 2.9Å; T110-D112 PolarHBondContact OG1-O 3.38Å; T110-D112 PolarHBondContact OG1-OD1 2.87Å; T110-G115 WeakPolarHBondContact OG1-CA 3.43Å; T110-G115 PolarHBondContact OG1-N 2.99Å; T110-F149 HydrophobicContact CG2-CD1 4.18Å; T110-F149 HydrophobicContact CG2-CD2 3.8Å; T110-F149 HydrophobicContact CG2-CE1 4.28Å; T110-F149 HydrophobicContact CG2-CE2 3.9Å; T110-F149 HydrophobicContact CG2-CG 3.92Å; T110-F149 HydrophobicContact CG2-CZ 4.14Å; T110-R205 PolarHBondContact O-NH1 3.17Å
111	L	97.9	Very high	97.6	Very high	23 Å²	23	47.7 Å²	47.7	12%	0.12	26%	0.263	C	S	.	.	S	Bend	trans	59.9	18.5	-170.6	-49.9	-174.7	0	0	0	113.9	T108 P147 R205 D209 V221	T108-L111 PolarHBondContact O-N 2.93Å; T108-L111 VanDerWaalsContact O-N 3.15Å; T108-L111 PolarHBondContact OG1-N 3.42Å; L111-P147 HydrophobicContact CD1-CB 3.96Å; L111-R205 HydrophobicContact CB-CB 3.89Å; L111-D209 HydrophobicContact CD1-CB 4.03Å; L111-D209 HydrophobicContact CD2-CB 3.85Å; L111-D209 HydrophobicContact CG-CB 4.39Å; L111-V221 PolarHBondContact O-N 3.39Å; L111-V221 VanDerWaalsContact O-N 3.1Å
112	D	97.8	Very high	97.6	Very high	12 Å²	12	51.3 Å²	51.3	6%	0.064	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-141.4	173.8	172.5	63.9	37.4	0	0	0	111.8	T108 T110 T114 G115 R205 V221	T108-D112 WeakPolarHBondContact CB-O 3.23Å; T108-D112 PolarHBondContact OG1-N 2.94Å; T108-D112 VanDerWaalsContact OG1-N 3.1Å; T108-D112 PolarHBondContact OG1-O 2.86Å; T110-D112 PolarHBondContact O-N 2.85Å; T110-D112 PolarHBondContact OG1-N 2.9Å; T110-D112 PolarHBondContact OG1-O 3.38Å; T110-D112 PolarHBondContact OG1-OD1 2.87Å; D112-T114 PolarHBondContact O-N 2.76Å; D112-T114 WeakPolarHBondContact OD1-CB 3.44Å; D112-T114 PolarHBondContact OD1-N 3.33Å; D112-T114 PolarHBondContact OD1-OG1 2.86Å; D112-G115 PolarHBondContact O-N 2.84Å; D112-R205 HydrophobicContact CB-CG 4.31Å; D112-R205 WeakPolarHBondContact OD2-CD 3.4Å; D112-R205 IonicContact OD2-NE 2.82Å; D112-V221 CarbonylContact C-O 3.58Å; D112-V221 WeakPolarHBondContact CA-O 3.34Å; D112-V221 HydrophobicContact CB-CB 4.22Å
113	A	97	Very high	97.6	Very high	48 Å²	48	53.7 Å²	53.7	40%	0.397	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-3.3	-176.2	0	0	0	0	0	114.9	H220 V221 K222	A113-H220 PolarHBondContact N-CD2 3.28Å; A113-V221 PolarHBondContact N-O 2.99Å; A113-K222 HydrophobicContact CB-CD 3.96Å
114	T	95.6	Very high	97.6	Very high	98 Å²	98	59.5 Å²	59.5	60%	0.601	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-10.5	177.4	69.9	0	0	0	0	113.8	A72 D112	A72-T114 HydrophobicContact CB-CG2 3.58Å; D112-T114 PolarHBondContact O-N 2.76Å; D112-T114 WeakPolarHBondContact OD1-CB 3.44Å; D112-T114 PolarHBondContact OD1-N 3.33Å; D112-T114 PolarHBondContact OD1-OG1 2.86Å
115	G	94.9	Very high	97.5	Very high	19 Å²	19	63.9 Å²	63.9	20%	0.196	34%	0.343	C	S	.	.	S	Bend	trans	-84.6	174.6	178.7	0	0	0	0	0	113.7	D109 T110 D112	D109-G115 WeakPolarHBondContact OD1-CA 3.35Å; T110-G115 WeakPolarHBondContact OG1-CA 3.43Å; T110-G115 PolarHBondContact OG1-N 2.99Å; D112-G115 PolarHBondContact O-N 2.84Å
116	T	96.6	Very high	97.5	Very high	99 Å²	99	64.1 Å²	64.1	61%	0.607	34%	0.343	S	S	*	.			trans	-85.4	138.2	171.5	-56.2	0	0	0	0	109.1	T108 D109 I118	T108-T116 WeakPolarHBondContact CA-O 3.19Å; T108-T116 WeakPolarHBondContact CB-O 3.42Å; D109-T116 PolarHBondContact N-O 2.84Å; D109-T116 VanDerWaalsContact N-O 3.11Å; D109-T116 PolarHBondContact OD1-N 2.8Å; T116-I118 PolarHBondContact O-N 2.94Å
117	V	98.2	Very high	97.5	Very high	65 Å²	65	63.8 Å²	63.8	39%	0.394	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	125.5	173.6	179.9	0	0	0	0	109.4	K106 A107 T108 E120	K106-V117 HydrophobicContact CD-CG2 4.41Å; A107-V117 WeakPolarHBondContact O-CA 3.44Å; T108-V117 HydrophobicContact CG2-CG2 4.33Å; V117-E120 HydrophobicContact CG1-CG 3.79Å
118	I	97.8	Very high	97.5	Very high	111 Å²	111	68.8 Å²	68.8	57%	0.569	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	-14.2	-179	59	169.4	0	0	0	113.1	A107 D109 T116	A107-I118 HydrophobicContact CB-CG1 4.2Å; A107-I118 PolarHBondContact O-N 3.38Å; D109-I118 HydrophobicContact CB-CG2 4.01Å; T116-I118 PolarHBondContact O-N 2.94Å
119	M	98.1	Very high	97.6	Very high	90 Å²	90	74.7 Å²	74.7	44%	0.443	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	136.7	-180	-176.3	-177.3	-63.3	0	0	109.9	K106 A107 K121 C218	K106-M119 WeakPolarHBondContact CA-O 3.35Å; A107-M119 HydrophobicContact CB-CB 4.1Å; A107-M119 PolarHBondContact N-O 2.92Å; M119-K121 HydrophobicContact CG-CG 4.37Å; M119-K121 HydrophobicContact SD-CD 4.2Å; M119-K121 VanDerWaalsContact SD-CE 3.57Å; M119-K121 HydrophobicContact SD-CG 4.43Å; M119-C218 HydrophobicContact SD-CB 4.45Å
120	E	98.6	Very high	97.7	Very high	135 Å²	135	74.3 Å²	74.3	63%	0.631	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.7	169.3	-57.8	-166.9	179.3	0	0	110.1	G105 K106 V117	G105-E120 CarbonylContact O-C 3.6Å; G105-E120 WeakPolarHBondContact O-CA 3.3Å; K106-E120 HydrophobicContact CG-CG 4.24Å; V117-E120 HydrophobicContact CG1-CG 3.79Å
121	K	98.6	Very high	97.8	Very high	93 Å²	93	73.7 Å²	73.7	40%	0.404	39%	0.39	S	S	.	.			trans	-144.7	153.5	177.3	-74	-175.3	174.6	176.4	0	110.5	G105 M119 S217	G105-K121 WeakPolarHBondContact CA-O 3.42Å; G105-K121 PolarHBondContact O-N 3.49Å; M119-K121 HydrophobicContact CG-CG 4.37Å; M119-K121 HydrophobicContact SD-CD 4.2Å; M119-K121 VanDerWaalsContact SD-CE 3.57Å; M119-K121 HydrophobicContact SD-CG 4.43Å; K121-S217 WeakPolarHBondContact CD-O 3.46Å
122	V	98.5	Very high	97.9	Very high	100 Å²	100	75.5 Å²	75.5	61%	0.606	40%	0.398	S	S	*	.			trans	-61.7	150.4	170.5	-63.9	0	0	0	0	110.9	E124 S217	V122-E124 WeakPolarHBondContact CB-OE2 3.26Å; V122-S217 WeakPolarHBondContact O-CB 3.44Å; V122-S217 PolarHBondContact O-OG 3.13Å
123	F	98.4	Very high	97.9	Very high	50 Å²	50	79.6 Å²	79.6	22%	0.219	42%	0.416	C	S	.	.			trans	-139.4	-1.6	-178.9	63.8	-97.2	0	0	0	113.2	L104 H125 I126 P189 P190	L104-F123 HydrophobicContact CB-CB 3.87Å; L104-F123 HydrophobicContact CB-CD1 4.49Å; L104-F123 HydrophobicContact CB-CG 4.04Å; L104-F123 HydrophobicContact CD1-CB 4.26Å; F123-H125 PolarHBondContact O-N 3.37Å; F123-H125 VanDerWaalsContact O-N 3.15Å; F123-I126 HydrophobicContact CB-CD1 4.06Å; F123-I126 WeakPolarHBondContact O-CB 3.41Å; F123-I126 PolarHBondContact O-N 3.11Å; F123-P189 HydrophobicContact CD2-CB 4.08Å; F123-P189 HydrophobicContact CE2-CB 4.04Å; F123-P190 HydrophobicContact CD2-CB 4.48Å; F123-P190 HydrophobicContact CE1-CB 4.02Å; F123-P190 HydrophobicContact CE2-CB 3.94Å; F123-P190 HydrophobicContact CZ-CB 3.68Å; F123-P190 HydrophobicContact CZ-CG 4.27Å
124	E	98.2	Very high	98	Very high	142 Å²	142	80.4 Å²	80.4	66%	0.664	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.1	-176.2	-67.1	80.5	176.4	0	0	112.7	V122 I126	V122-E124 WeakPolarHBondContact CB-OE2 3.26Å; E124-I126 VanDerWaalsContact C-N 3.3Å
125	H	98.2	Very high	98.1	Very high	94 Å²	94	76.1 Å²	76.1	44%	0.435	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.7	175.3	65.3	-77.7	0	0	0	113.7	F123 L215	F123-H125 PolarHBondContact O-N 3.37Å; F123-H125 VanDerWaalsContact O-N 3.15Å; H125-L215 PolarHBondContact NE2-O 2.91Å
126	I	98.6	Very high	98.2	Very high	10 Å²	10	82.7 Å²	82.7	5%	0.051	41%	0.407	C	S	.	.			trans	-83.7	122	-172.8	-60.4	174.2	0	0	0	110	L104 F123 E124 M131 F187 L215	L104-I126 HydrophobicContact CD1-CB 4.41Å; L104-I126 HydrophobicContact CD1-CD1 4Å; L104-I126 HydrophobicContact CD1-CG2 4.21Å; L104-I126 HydrophobicContact CD2-CD1 3.9Å; F123-I126 HydrophobicContact CB-CD1 4.06Å; F123-I126 WeakPolarHBondContact O-CB 3.41Å; F123-I126 PolarHBondContact O-N 3.11Å; E124-I126 VanDerWaalsContact C-N 3.3Å; I126-M131 HydrophobicContact CG2-CE 4.24Å; I126-M131 HydrophobicContact CG2-CG 4.14Å; I126-F187 HydrophobicContact CG2-CE2 4.49Å; I126-F187 HydrophobicContact CG2-CZ 4.14Å; I126-F187 WeakPolarHBondContact O-CZ 3.2Å; I126-L215 HydrophobicContact CD1-CB 3.76Å; I126-L215 HydrophobicContact CD1-CD1 4.38Å; I126-L215 HydrophobicContact CG1-CB 4.25Å; I126-L215 HydrophobicContact CG2-CD1 4.17Å; I126-L215 HydrophobicContact CG2-CD2 4.22Å
127	T	98.6	Very high	98.3	Very high	65 Å²	65	81.6 Å²	81.6	40%	0.399	41%	0.409	S	S	.	.			trans	-102.4	166.7	174.7	74.1	0	0	0	0	112.2	L129 D130 M131	T127-L129 PolarHBondContact O-N 2.94Å; T127-L129 PolarHBondContact OG1-N 3.3Å; T127-D130 VanDerWaalsContact CB-OD2 3.31Å; T127-D130 WeakPolarHBondContact CB-OD2 3.44Å; T127-D130 WeakPolarHBondContact CG2-OD2 3.42Å; T127-D130 PolarHBondContact N-OD2 3.35Å; T127-D130 PolarHBondContact O-N 2.97Å; T127-D130 PolarHBondContact OG1-N 2.78Å; T127-D130 PolarHBondContact OG1-OD2 2.87Å; T127-M131 PolarHBondContact O-N 2.94Å
128	R	98.4	Very high	98.3	Very high	111 Å²	111	79.9 Å²	79.9	42%	0.419	40%	0.396	S	S	.	.	H	α-helix	trans	-57.3	-39.5	172	-170.3	174.3	-177.1	-77.2	-12.9	111.6	M131 E132 L184 F187	R128-M131 PolarHBondContact O-N 2.91Å; R128-E132 IonicContact CZ-OE1 2.82Å; R128-E132 IonicContact CZ-OE2 3.95Å; R128-E132 IonicContact NH1-OE1 2.64Å; R128-E132 PolarHBondContact NH1-OE1 2.87Å; R128-E132 IonicContact NH1-OE2 2.63Å; R128-E132 PolarHBondContact NH1-OE2 3.2Å; R128-E132 VanDerWaalsContact NH1-OE2 3.08Å; R128-E132 IonicContact NH2-OE1 3.84Å; R128-E132 PolarHBondContact NH2-OE1 3.43Å; R128-E132 WeakPolarHBondContact O-CG 3.39Å; R128-E132 PolarHBondContact O-N 3.34Å; R128-L184 HydrophobicContact CG-CD2 3.75Å; R128-F187 HydrophobicContact CB-CB 4.44Å; R128-F187 HydrophobicContact CB-CD1 3.66Å; R128-F187 HydrophobicContact CB-CE1 4.3Å; R128-F187 HydrophobicContact CB-CG 4.26Å; R128-F187 HydrophobicContact CG-CB 4.15Å; R128-F187 HydrophobicContact CG-CD1 4.3Å; R128-F187 HydrophobicContact CG-CG 4.46Å; R128-F187 VanDerWaalsContact N-CE1 3.31Å
129	L	98.4	Very high	98.3	Very high	127 Å²	127	77.3 Å²	77.3	67%	0.665	39%	0.385	S	S	*	.	H	α-helix	trans	-66.7	-41.5	-179.4	-67.9	174	0	0	0	111.3	T127 M131 E132 E133	T127-L129 PolarHBondContact O-N 2.94Å; T127-L129 PolarHBondContact OG1-N 3.3Å; L129-M131 VanDerWaalsContact C-N 3.32Å; L129-M131 PolarHBondContact O-N 3.34Å; L129-E132 PolarHBondContact O-N 2.91Å; L129-E133 WeakPolarHBondContact O-CB 3.34Å; L129-E133 PolarHBondContact O-N 3.45Å
130	D	98.2	Very high	98.3	Very high	56 Å²	56	74.3 Å²	74.3	30%	0.299	38%	0.378	S	S	.	.	H	α-helix	trans	-60.5	-43.8	176	-56.7	-49.8	0	0	0	110.8	T127 E133 K134 L215	T127-D130 VanDerWaalsContact CB-OD2 3.31Å; T127-D130 WeakPolarHBondContact CB-OD2 3.44Å; T127-D130 WeakPolarHBondContact CG2-OD2 3.42Å; T127-D130 PolarHBondContact N-OD2 3.35Å; T127-D130 PolarHBondContact O-N 2.97Å; T127-D130 PolarHBondContact OG1-N 2.78Å; T127-D130 PolarHBondContact OG1-OD2 2.87Å; D130-E133 PolarHBondContact O-N 2.89Å; D130-K134 WeakPolarHBondContact O-CG 3.38Å; D130-K134 PolarHBondContact O-N 3.29Å; D130-L215 HydrophobicContact CB-CD2 3.93Å
131	M	98.1	Very high	98.3	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-59.1	-54.1	174.7	-77	-156.3	174.2	0	0	112.1	L104 I126 T127 R128 L129 E133 K134 L135 L184 F187 F192 L215	L104-M131 HydrophobicContact CD1-CE 3.55Å; L104-M131 HydrophobicContact CD2-CE 4.05Å; L104-M131 HydrophobicContact CG-CE 4.01Å; I126-M131 HydrophobicContact CG2-CE 4.24Å; I126-M131 HydrophobicContact CG2-CG 4.14Å; T127-M131 PolarHBondContact O-N 2.94Å; R128-M131 PolarHBondContact O-N 2.91Å; L129-M131 VanDerWaalsContact C-N 3.32Å; L129-M131 PolarHBondContact O-N 3.34Å; M131-E133 PolarHBondContact O-N 3.43Å; M131-K134 PolarHBondContact O-N 3.13Å; M131-K134 VanDerWaalsContact O-N 3.12Å; M131-L135 VanDerWaalsContact O-CG 3.26Å; M131-L135 WeakPolarHBondContact O-CG 3.5Å; M131-L135 PolarHBondContact O-N 2.95Å; M131-L184 HydrophobicContact CB-CD2 3.82Å; M131-L184 HydrophobicContact SD-CD1 3.89Å; M131-L184 HydrophobicContact SD-CD2 4.17Å; M131-F187 HydrophobicContact CE-CD2 3.57Å; M131-F187 HydrophobicContact CE-CE2 3.17Å; M131-F187 HydrophobicContact CE-CZ 4.21Å; M131-F187 HydrophobicContact CG-CD2 4.38Å; M131-F187 HydrophobicContact CG-CE2 4.23Å; M131-F187 HydrophobicContact SD-CD2 3.38Å; M131-F187 WeakPolarHBondContact SD-CD2 3.14Å; M131-F187 HydrophobicContact SD-CE2 3.57Å; M131-F187 VanDerWaalsContact SD-CE2 3.57Å; M131-F187 HydrophobicContact SD-CG 4.34Å; M131-F192 HydrophobicContact CE-CB 3.87Å; M131-F192 HydrophobicContact CE-CD1 3.55Å; M131-F192 HydrophobicContact CE-CD2 4.32Å; M131-F192 HydrophobicContact CE-CE1 4.08Å; M131-F192 HydrophobicContact CE-CG 3.66Å; M131-F192 HydrophobicContact SD-CB 3.88Å; M131-F192 HydrophobicContact SD-CD1 4.45Å; M131-F192 HydrophobicContact SD-CD2 4.27Å; M131-F192 HydrophobicContact SD-CG 3.97Å; M131-L215 HydrophobicContact CE-CD1 4.26Å; M131-L215 HydrophobicContact CG-CD1 4Å
132	E	98.4	Very high	98.3	Very high	61 Å²	61	71.2 Å²	71.2	29%	0.285	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-34.6	-179	-71.7	178.7	142.7	0	0	112.2	R128 L129 L184	R128-E132 IonicContact CZ-OE1 2.82Å; R128-E132 IonicContact CZ-OE2 3.95Å; R128-E132 IonicContact NH1-OE1 2.64Å; R128-E132 PolarHBondContact NH1-OE1 2.87Å; R128-E132 IonicContact NH1-OE2 2.63Å; R128-E132 PolarHBondContact NH1-OE2 3.2Å; R128-E132 VanDerWaalsContact NH1-OE2 3.08Å; R128-E132 IonicContact NH2-OE1 3.84Å; R128-E132 PolarHBondContact NH2-OE1 3.43Å; R128-E132 WeakPolarHBondContact O-CG 3.39Å; R128-E132 PolarHBondContact O-N 3.34Å; L129-E132 PolarHBondContact O-N 2.91Å; E132-L184 HydrophobicContact CG-CB 4.22Å; E132-L184 HydrophobicContact CG-CD2 3.86Å
133	E	98.4	Very high	98.2	Very high	98 Å²	98	72.2 Å²	72.2	46%	0.458	37%	0.369	S	S	.	.	H	α-helix	trans	-65.1	-50.8	172.7	-170.1	-137	132	0	0	111.2	L129 D130 M131 L135 K136	L129-E133 WeakPolarHBondContact O-CB 3.34Å; L129-E133 PolarHBondContact O-N 3.45Å; D130-E133 PolarHBondContact O-N 2.89Å; M131-E133 PolarHBondContact O-N 3.43Å; E133-L135 PolarHBondContact O-N 3.16Å; E133-K136 WeakPolarHBondContact O-CB 3.44Å; E133-K136 PolarHBondContact O-N 3.3Å
134	K	98.3	Very high	98.2	Very high	64 Å²	64	70 Å²	70	28%	0.278	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-34.9	-178.2	-65.4	-46.6	173.8	-148.6	0	113.3	D130 M131 K136 A137 F138 L211 A214 L215	D130-K134 WeakPolarHBondContact O-CG 3.38Å; D130-K134 PolarHBondContact O-N 3.29Å; M131-K134 PolarHBondContact O-N 3.13Å; M131-K134 VanDerWaalsContact O-N 3.12Å; K134-K136 PolarHBondContact O-N 3.25Å; K134-K136 VanDerWaalsContact O-N 3.1Å; K134-A137 PolarHBondContact O-N 2.94Å; K134-F138 WeakPolarHBondContact O-CD2 3.47Å; K134-L211 HydrophobicContact CB-CD1 3.76Å; K134-A214 HydrophobicContact CG-CB 4.42Å; K134-L215 HydrophobicContact CB-CD2 4.26Å; K134-L215 HydrophobicContact CG-CD2 3.61Å; K134-L215 HydrophobicContact CG-CG 4.19Å
135	L	98.4	Very high	98.1	Very high	8 Å²	8	66.4 Å²	66.4	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-56.9	-27.2	178	-70.8	175	0	0	0	113.2	M131 E133 A137 F138 T139 L182 L184 L194 L211	M131-L135 VanDerWaalsContact O-CG 3.26Å; M131-L135 WeakPolarHBondContact O-CG 3.5Å; M131-L135 PolarHBondContact O-N 2.95Å; E133-L135 PolarHBondContact O-N 3.16Å; L135-A137 VanDerWaalsContact C-N 3.27Å; L135-A137 PolarHBondContact O-N 3.47Å; L135-F138 PolarHBondContact O-N 2.73Å; L135-T139 PolarHBondContact O-N 3.07Å; L135-T139 PolarHBondContact O-OG1 3.33Å; L135-L182 HydrophobicContact CB-CD2 4.25Å; L135-L182 HydrophobicContact CB-CG 4.35Å; L135-L182 HydrophobicContact CD2-CD1 4.11Å; L135-L182 HydrophobicContact CD2-CD2 3.69Å; L135-L182 HydrophobicContact CD2-CG 3.82Å; L135-L182 HydrophobicContact CG-CG 4.49Å; L135-L184 HydrophobicContact CD1-CB 3.81Å; L135-L194 HydrophobicContact CD1-CD2 3.92Å; L135-L194 HydrophobicContact CD2-CD1 4.35Å; L135-L194 HydrophobicContact CD2-CD2 3.92Å; L135-L211 HydrophobicContact CD2-CD1 4.16Å; L135-L211 HydrophobicContact CD2-CD2 3.76Å
136	K	98.1	Very high	97.9	Very high	157 Å²	157	62.1 Å²	62.1	68%	0.683	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-59.8	-37.2	177	-62.4	174.7	-173.9	173.3	0	112.4	E133 K134 F138 T139	E133-K136 WeakPolarHBondContact O-CB 3.44Å; E133-K136 PolarHBondContact O-N 3.3Å; K134-K136 PolarHBondContact O-N 3.25Å; K134-K136 VanDerWaalsContact O-N 3.1Å; K136-F138 PolarHBondContact O-N 2.88Å; K136-T139 PolarHBondContact O-N 2.94Å
137	A	97.8	Very high	97.6	Very high	77 Å²	77	62 Å²	62	64%	0.636	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-72.4	-14.2	178.9	0	0	0	0	0	113.3	K134 L135	K134-A137 PolarHBondContact O-N 2.94Å; L135-A137 VanDerWaalsContact C-N 3.27Å; L135-A137 PolarHBondContact O-N 3.47Å
138	F	98.2	Very high	97.3	Very high	29 Å²	29	61.9 Å²	61.9	13%	0.127	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-104.5	9.5	178.9	-61.3	-79.1	0	0	0	113	K134 L135 K136 V179 L182 L207 D210 L211 A214	K134-F138 WeakPolarHBondContact O-CD2 3.47Å; L135-F138 PolarHBondContact O-N 2.73Å; K136-F138 PolarHBondContact O-N 2.88Å; F138-V179 WeakPolarHBondContact O-CB 3.47Å; F138-V179 WeakPolarHBondContact O-CG2 3.4Å; F138-L182 HydrophobicContact CB-CD2 3.66Å; F138-L207 HydrophobicContact CB-CD1 3.52Å; F138-L207 HydrophobicContact CD1-CD1 3.77Å; F138-L207 HydrophobicContact CD2-CD1 4.47Å; F138-L207 HydrophobicContact CG-CD1 3.68Å; F138-D210 HydrophobicContact CE1-CB 3.75Å; F138-D210 HydrophobicContact CZ-CB 4.16Å; F138-L211 HydrophobicContact CD2-CD1 4.22Å; F138-L211 HydrophobicContact CE2-CB 4.29Å; F138-L211 HydrophobicContact CE2-CD1 3.88Å; F138-A214 HydrophobicContact CE2-CB 4.09Å; F138-A214 HydrophobicContact CZ-CB 4.02Å
139	T	98.3	Very high	96.8	Very high	56 Å²	56	58.7 Å²	58.7	34%	0.344	31%	0.313	S	S	.	.	S	Bend	trans	-108.4	145.1	179.5	-53.5	0	0	0	0	110.2	L135 K136	L135-T139 PolarHBondContact O-N 3.07Å; L135-T139 PolarHBondContact O-OG1 3.33Å; K136-T139 PolarHBondContact O-N 2.94Å
140	G	98.4	Very high	96.3	Very high	28 Å²	28	52.9 Å²	52.9	29%	0.289	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89.1	-150.7	-175	0	0	0	0	0	112.7	V179	G140-V179 WeakPolarHBondContact CA-O 3.4Å; G140-V179 PolarHBondContact N-O 3.35Å; G140-V179 PolarHBondContact O-N 2.56Å
141	D	98.2	Very high	95.7	Very high	134 Å²	134	52 Å²	52	72%	0.717	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	116.2	178.6	-67.6	-33.8	0	0	0	110.4	T178	D141-T178 WeakPolarHBondContact OD1-CB 3.43Å; D141-T178 VanDerWaalsContact OD1-CG2 3.3Å; D141-T178 WeakPolarHBondContact OD1-CG2 3.26Å; D141-T178 PolarHBondContact OD1-OG1 3.32Å
142	I	97.8	Very high	95.1	Very high	29 Å²	29	54 Å²	54	15%	0.149	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	162	-175.8	68	172.9	0	0	0	111.3	P176 V177 V179 F202	I142-P176 WeakPolarHBondContact O-CA 3.37Å; I142-V177 HydrophobicContact CD1-CG2 4.25Å; I142-V177 HydrophobicContact CG1-CG2 3.59Å; I142-V177 PolarHBondContact N-O 2.88Å; I142-V177 PolarHBondContact O-N 3.41Å; I142-V179 HydrophobicContact CD1-CG2 4.02Å; I142-V179 HydrophobicContact CG1-CG2 4.42Å; I142-F202 HydrophobicContact CD1-CE2 4.3Å
143	M	97.7	Very high	94.5	Very high	120 Å²	120	57.1 Å²	57.1	59%	0.591	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	127.7	171.3	-65.9	-60.8	-71.6	0	0	109.5	A174 P176	M143-A174 HydrophobicContact CB-CB 4.24Å; M143-A174 HydrophobicContact CE-CB 4.08Å; M143-A174 WeakPolarHBondContact CE-O 3.22Å; M143-P176 HydrophobicContact SD-CB 4.08Å
144	Q	97.1	Very high	93.9	Very high	3 Å²	3	56.2 Å²	56.2	1%	0.014	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.2	-179.8	-171.6	178	69.3	0	0	111.3	P146 A174 R175 V177 Y203	Q144-P146 WeakPolarHBondContact O-CD 2.89Å; Q144-A174 WeakPolarHBondContact O-CA 3.37Å; Q144-R175 PolarHBondContact N-O 3.06Å; Q144-R175 PolarHBondContact O-N 2.92Å; Q144-V177 HydrophobicContact CB-CG2 3.76Å; Q144-Y203 PolarHBondContact NE2-O 2.93Å
145	V	95.9	Very high	93.2	Very high	67 Å²	67	60.3 Å²	60.3	41%	0.406	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-81.9	119.6	168.7	179.5	0	0	0	0	108.7	A171 A174 S206	V145-A171 HydrophobicContact CG1-CB 4.14Å; V145-A174 HydrophobicContact CG2-CB 3.85Å; V145-S206 PolarHBondContact O-OG 3.3Å
146	P	94.4	Very high	92.6	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.032	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-61.2	145.1	174.7	-26.3	37.7	0	0	0	112.2	Q144 L152 K172 R175 Y203	Q144-P146 WeakPolarHBondContact O-CD 2.89Å; P146-L152 HydrophobicContact CB-CD1 3.5Å; P146-L152 HydrophobicContact CG-CD1 3.76Å; P146-K172 HydrophobicContact CG-CB 4.4Å; P146-R175 HydrophobicContact CG-CG 4.44Å; P146-Y203 HydrophobicContact CB-CD2 4.1Å; P146-Y203 HydrophobicContact CB-CE2 3.54Å; P146-Y203 HydrophobicContact CG-CE2 4.03Å
147	P	93.3	Very high	92	Very high	7 Å²	7	59.3 Å²	59.3	5%	0.045	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-66.6	148.8	175.6	27.8	-30.7	0	0	0	110.9	L111 F149 S150 Y203 S206	L111-P147 HydrophobicContact CD1-CB 3.96Å; P147-F149 VanDerWaalsContact C-N 3.31Å; P147-F149 PolarHBondContact O-N 3.1Å; P147-S150 WeakPolarHBondContact O-CB 3.42Å; P147-S150 PolarHBondContact O-OG 2.92Å; P147-Y203 VanDerWaalsContact CD-CD1 3.45Å; P147-Y203 HydrophobicContact CG-CD1 3.61Å; P147-Y203 HydrophobicContact CG-CE1 4.02Å; P147-Y203 HydrophobicContact CG-CG 3.94Å; P147-S206 WeakPolarHBondContact CD-OG 3.14Å
148	L	90.8	Very high	91.6	Very high	62 Å²	62	60.6 Å²	60.6	33%	0.325	33%	0.328	S	S	.	.	S	Bend	trans	-57.7	-45.7	175	-73.6	177.7	0	0	0	111.1	S150 L159 L163 V169 A171	L148-S150 VanDerWaalsContact C-N 3.25Å; L148-S150 PolarHBondContact O-N 3.43Å; L148-L159 VanDerWaalsContact O-CB 3.27Å; L148-L159 WeakPolarHBondContact O-CB 3.26Å; L148-L163 HydrophobicContact CB-CD1 3.77Å; L148-L163 WeakPolarHBondContact O-CD1 3.34Å; L148-V169 HydrophobicContact CD2-CG1 4.39Å; L148-V169 WeakPolarHBondContact CD2-O 3.39Å; L148-A171 HydrophobicContact CD2-CB 4.17Å
149	F	88.9	Confident	91.1	Very high	45 Å²	45	59.4 Å²	59.4	20%	0.197	32%	0.322	C	S	.	.	S	Bend	trans	-77.3	72.9	172.4	-70.2	-89.2	0	0	0	111.6	D109 T110 P147 L163 R205	D109-F149 HydrophobicContact CB-CE2 4.44Å; D109-F149 WeakPolarHBondContact O-CD2 3.36Å; D109-F149 WeakPolarHBondContact O-CE2 3.39Å; T110-F149 HydrophobicContact CG2-CD1 4.18Å; T110-F149 HydrophobicContact CG2-CD2 3.8Å; T110-F149 HydrophobicContact CG2-CE1 4.28Å; T110-F149 HydrophobicContact CG2-CE2 3.9Å; T110-F149 HydrophobicContact CG2-CG 3.92Å; T110-F149 HydrophobicContact CG2-CZ 4.14Å; P147-F149 VanDerWaalsContact C-N 3.31Å; P147-F149 PolarHBondContact O-N 3.1Å; F149-L163 HydrophobicContact CD1-CD1 4.17Å; F149-L163 HydrophobicContact CD2-CD1 4.12Å; F149-L163 HydrophobicContact CE1-CB 4Å; F149-L163 HydrophobicContact CE1-CD1 4.23Å; F149-L163 HydrophobicContact CE2-CD1 4.19Å; F149-L163 HydrophobicContact CG-CD1 4.13Å; F149-L163 HydrophobicContact CZ-CB 4.19Å; F149-L163 HydrophobicContact CZ-CD1 4.25Å; F149-R205 PolarHBondContact O-NH1 2.91Å; F149-R205 PolarHBondContact O-NH2 3.14Å
150	S	87.9	Confident	90.5	Very high	4 Å²	4	58 Å²	58	3%	0.028	32%	0.315	C	S	.	.	S	Bend	trans	-130	174.5	178.2	64.9	0	0	0	0	113.2	P147 L148 L152 S160	P147-S150 WeakPolarHBondContact O-CB 3.42Å; P147-S150 PolarHBondContact O-OG 2.92Å; L148-S150 VanDerWaalsContact C-N 3.25Å; L148-S150 PolarHBondContact O-N 3.43Å; S150-L152 VanDerWaalsContact C-N 3.27Å; S150-S160 WeakPolarHBondContact O-CB 3.41Å; S150-S160 PolarHBondContact O-N 3.25Å; S150-S160 PolarHBondContact O-OG 3.31Å
151	A	85.5	Confident	89.9	Confident	39 Å²	39	59.5 Å²	59.5	32%	0.322	32%	0.319	S	S	.	.	S	Bend	trans	-84	1.6	173.9	0	0	0	0	0	113.5
152	L	85.7	Confident	89.4	Confident	40 Å²	40	54 Å²	54	21%	0.209	29%	0.289	C	S	.	.			trans	-61	154.7	174.5	-69.1	179.3	0	0	0	110.9	P146 S150 R158 L159 K172	P146-L152 HydrophobicContact CB-CD1 3.5Å; P146-L152 HydrophobicContact CG-CD1 3.76Å; S150-L152 VanDerWaalsContact C-N 3.27Å; L152-R158 CarbonylContact O-C 3.43Å; L152-R158 VanDerWaalsContact O-CA 3.23Å; L152-R158 WeakPolarHBondContact O-CA 3.42Å; L152-L159 HydrophobicContact CB-CD1 4.02Å; L152-L159 HydrophobicContact CB-CG 4.08Å; L152-L159 WeakPolarHBondContact O-CG 3.5Å; L152-L159 PolarHBondContact O-N 3.12Å; L152-K172 HydrophobicContact CD1-CB 4.29Å; L152-K172 HydrophobicContact CD1-CG 4.01Å
153	K	86	Confident	88.9	Confident	127 Å²	127	54.4 Å²	54.4	55%	0.552	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	147.2	-176.9	-68.2	-177.6	173.5	-169.7	0	112.8	G156 Q157 R158 K172	K153-G156 WeakPolarHBondContact CD-O 3.34Å; K153-Q157 CarbonylContact C-O 3.15Å; K153-Q157 WeakPolarHBondContact CA-O 3.37Å; K153-Q157 WeakPolarHBondContact CB-O 3.5Å; K153-R158 HydrophobicContact CG-CG 4.31Å; K153-K172 PolarHBondContact O-NZ 2.9Å
154	K	85.4	Confident	88.3	Confident	79 Å²	79	57 Å²	57	34%	0.343	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.6	163.3	-176.6	174.4	179.7	177.4	0	106.2	G156 Q157 L159 L162	K154-G156 VanDerWaalsContact C-N 3.27Å; K154-G156 PolarHBondContact O-N 3.42Å; K154-Q157 PolarHBondContact N-O 3.03Å; K154-Q157 PolarHBondContact O-N 2.96Å; K154-Q157 VanDerWaalsContact O-O 3.09Å; K154-L159 HydrophobicContact CB-CD2 3.66Å; K154-L162 HydrophobicContact CB-CD1 4.23Å
155	D	84.3	Confident	88	Confident	150 Å²	150	62.4 Å²	62.4	80%	0.802	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	45.2	179.9	-48.1	-40.5	0	0	0	113.5	Q157	D155-Q157 PolarHBondContact O-N 3.02Å; D155-Q157 VanDerWaalsContact O-N 3.15Å
156	G	85.8	Confident	87.6	Confident	57 Å²	57	62.5 Å²	62.5	59%	0.588	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-15.5	179	0	0	0	0	0	115.9	K153 K154	K153-G156 WeakPolarHBondContact CD-O 3.34Å; K154-G156 VanDerWaalsContact C-N 3.27Å; K154-G156 PolarHBondContact O-N 3.42Å
157	Q	85.1	Confident	87.2	Confident	87 Å²	87	67.3 Å²	67.3	41%	0.407	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	147	178.8	-64.5	-171.4	56.1	0	0	112	K153 K154 D155 L162	K153-Q157 CarbonylContact C-O 3.15Å; K153-Q157 WeakPolarHBondContact CA-O 3.37Å; K153-Q157 WeakPolarHBondContact CB-O 3.5Å; K154-Q157 PolarHBondContact N-O 3.03Å; K154-Q157 PolarHBondContact O-N 2.96Å; K154-Q157 VanDerWaalsContact O-O 3.09Å; D155-Q157 PolarHBondContact O-N 3.02Å; D155-Q157 VanDerWaalsContact O-N 3.15Å; Q157-L162 HydrophobicContact CB-CD1 4.33Å; Q157-L162 HydrophobicContact CB-CD2 4.02Å; Q157-L162 HydrophobicContact CB-CG 4.08Å
158	R	88.5	Confident	86.8	Confident	105 Å²	105	76.3 Å²	76.3	40%	0.396	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	141.1	177.7	-69.3	-179.8	176.9	171.9	0.2	110.8	L152 K153 S160 V161 L162	L152-R158 CarbonylContact O-C 3.43Å; L152-R158 VanDerWaalsContact O-CA 3.23Å; L152-R158 WeakPolarHBondContact O-CA 3.42Å; K153-R158 HydrophobicContact CG-CG 4.31Å; R158-S160 VanDerWaalsContact C-N 3.31Å; R158-S160 PolarHBondContact O-N 3.03Å; R158-V161 HydrophobicContact CB-CB 4.32Å; R158-V161 HydrophobicContact CB-CG2 4.01Å; R158-V161 WeakPolarHBondContact O-CB 3.38Å; R158-V161 PolarHBondContact O-N 2.94Å; R158-L162 PolarHBondContact O-N 2.69Å; R158-L162 VanDerWaalsContact O-N 3.09Å
159	L	87.8	Confident	86.7	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.016	39%	0.39	C	S	.	.	H	α-helix	trans	-55.7	-46.3	178.5	-58.8	-165.7	0	0	0	111.6	L148 L152 K154 V161 L162 L163 V169 K172	L148-L159 VanDerWaalsContact O-CB 3.27Å; L148-L159 WeakPolarHBondContact O-CB 3.26Å; L152-L159 HydrophobicContact CB-CD1 4.02Å; L152-L159 HydrophobicContact CB-CG 4.08Å; L152-L159 WeakPolarHBondContact O-CG 3.5Å; L152-L159 PolarHBondContact O-N 3.12Å; K154-L159 HydrophobicContact CB-CD2 3.66Å; L159-V161 VanDerWaalsContact C-N 3.25Å; L159-V161 PolarHBondContact O-N 2.88Å; L159-L162 WeakPolarHBondContact O-CB 3.27Å; L159-L162 PolarHBondContact O-N 3.13Å; L159-L162 VanDerWaalsContact O-N 3.13Å; L159-L163 WeakPolarHBondContact O-CG 3.14Å; L159-L163 PolarHBondContact O-N 3.08Å; L159-V169 HydrophobicContact CB-CG1 4.08Å; L159-V169 HydrophobicContact CD1-CG1 4.05Å; L159-V169 HydrophobicContact CD2-CG1 3.66Å; L159-V169 HydrophobicContact CG-CG1 4.09Å; L159-K172 HydrophobicContact CD1-CG 4.14Å
160	S	86	Confident	86.6	Confident	28 Å²	28	79.4 Å²	79.4	20%	0.196	42%	0.415	C	S	.	.	H	α-helix	trans	-59.5	-30.6	175.9	48.4	0	0	0	0	114.3	S150 R158 K164	S150-S160 WeakPolarHBondContact O-CB 3.41Å; S150-S160 PolarHBondContact O-N 3.25Å; S150-S160 PolarHBondContact O-OG 3.31Å; R158-S160 VanDerWaalsContact C-N 3.31Å; R158-S160 PolarHBondContact O-N 3.03Å; S160-K164 WeakPolarHBondContact O-CB 3.08Å; S160-K164 VanDerWaalsContact O-CG 3.29Å; S160-K164 WeakPolarHBondContact O-CG 3.19Å; S160-K164 PolarHBondContact O-N 3.16Å
161	V	86.1	Confident	86.5	Confident	59 Å²	59	82 Å²	82	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-76	-39.2	176.5	172.9	0	0	0	0	110.7	R158 L159 K165	R158-V161 HydrophobicContact CB-CB 4.32Å; R158-V161 HydrophobicContact CB-CG2 4.01Å; R158-V161 WeakPolarHBondContact O-CB 3.38Å; R158-V161 PolarHBondContact O-N 2.94Å; L159-V161 VanDerWaalsContact C-N 3.25Å; L159-V161 PolarHBondContact O-N 2.88Å; V161-K165 HydrophobicContact CG1-CD 4.38Å; V161-K165 WeakPolarHBondContact O-CG 3.41Å; V161-K165 PolarHBondContact O-N 3.09Å
162	L	87.6	Confident	86.8	Confident	18 Å²	18	83.9 Å²	83.9	9%	0.094	44%	0.438	C	S	.	.	H	α-helix	trans	-63.4	-46.3	176.2	-67.8	172.7	0	0	0	111	K154 Q157 R158 L159 K164 K165 G166 H167 V169	K154-L162 HydrophobicContact CB-CD1 4.23Å; Q157-L162 HydrophobicContact CB-CD1 4.33Å; Q157-L162 HydrophobicContact CB-CD2 4.02Å; Q157-L162 HydrophobicContact CB-CG 4.08Å; R158-L162 PolarHBondContact O-N 2.69Å; R158-L162 VanDerWaalsContact O-N 3.09Å; L159-L162 WeakPolarHBondContact O-CB 3.27Å; L159-L162 PolarHBondContact O-N 3.13Å; L159-L162 VanDerWaalsContact O-N 3.13Å; L162-K164 PolarHBondContact O-N 3.23Å; L162-K165 CarbonylContact O-C 3.59Å; L162-K165 WeakPolarHBondContact O-CA 3.46Å; L162-K165 WeakPolarHBondContact O-CB 3.23Å; L162-K165 PolarHBondContact O-N 3.39Å; L162-G166 PolarHBondContact O-N 2.7Å; L162-H167 HydrophobicContact CB-CB 4.19Å; L162-H167 WeakPolarHBondContact O-CB 3.19Å; L162-H167 PolarHBondContact O-N 2.95Å; L162-V169 HydrophobicContact CB-CG2 3.59Å; L162-V169 HydrophobicContact CD1-CG2 4.17Å
163	L	87.1	Confident	87.2	Confident	37 Å²	37	87 Å²	87	19%	0.194	46%	0.461	C	S	.	.	H	α-helix	trans	-59.9	-44.5	177	-71.3	162.5	0	0	0	112.3	L148 F149 L159 K165 G166 V169	L148-L163 HydrophobicContact CB-CD1 3.77Å; L148-L163 WeakPolarHBondContact O-CD1 3.34Å; F149-L163 HydrophobicContact CD1-CD1 4.17Å; F149-L163 HydrophobicContact CD2-CD1 4.12Å; F149-L163 HydrophobicContact CE1-CB 4Å; F149-L163 HydrophobicContact CE1-CD1 4.23Å; F149-L163 HydrophobicContact CE2-CD1 4.19Å; F149-L163 HydrophobicContact CG-CD1 4.13Å; F149-L163 HydrophobicContact CZ-CB 4.19Å; F149-L163 HydrophobicContact CZ-CD1 4.25Å; L159-L163 WeakPolarHBondContact O-CG 3.14Å; L159-L163 PolarHBondContact O-N 3.08Å; L163-K165 PolarHBondContact O-N 2.82Å; L163-G166 WeakPolarHBondContact O-CA 3.39Å; L163-G166 PolarHBondContact O-N 2.84Å; L163-V169 HydrophobicContact CD2-CB 4.01Å; L163-V169 HydrophobicContact CD2-CG2 4.15Å; L163-V169 HydrophobicContact CG-CB 4.18Å; L163-V169 HydrophobicContact CG-CG2 4.01Å
164	K	86	Confident	87.6	Confident	174 Å²	174	83.1 Å²	83.1	76%	0.757	45%	0.452	S	S	*	.	H	α-helix	trans	-63.6	-22.6	176	-75.8	-179.5	178.3	-169.8	0	113.7	S160 L162 G166	S160-K164 WeakPolarHBondContact O-CB 3.08Å; S160-K164 VanDerWaalsContact O-CG 3.29Å; S160-K164 WeakPolarHBondContact O-CG 3.19Å; S160-K164 PolarHBondContact O-N 3.16Å; L162-K164 PolarHBondContact O-N 3.23Å; K164-G166 VanDerWaalsContact C-N 3.27Å
165	K	89.2	Confident	88.2	Confident	118 Å²	118	82.6 Å²	82.6	51%	0.513	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	10.6	172.2	-67.4	174.7	179.3	-179.2	0	112.5	V161 L162 L163 H167	V161-K165 HydrophobicContact CG1-CD 4.38Å; V161-K165 WeakPolarHBondContact O-CG 3.41Å; V161-K165 PolarHBondContact O-N 3.09Å; L162-K165 CarbonylContact O-C 3.59Å; L162-K165 WeakPolarHBondContact O-CA 3.46Å; L162-K165 WeakPolarHBondContact O-CB 3.23Å; L162-K165 PolarHBondContact O-N 3.39Å; L163-K165 PolarHBondContact O-N 2.82Å; K165-H167 VanDerWaalsContact C-N 3.26Å; K165-H167 WeakPolarHBondContact CB-ND1 3.4Å; K165-H167 PolarHBondContact O-N 2.94Å; K165-H167 PolarHBondContact O-ND1 2.83Å
166	G	87.6	Confident	88.8	Confident	68 Å²	68	80.5 Å²	80.5	70%	0.701	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	12.5	-178.7	0	0	0	0	0	114.9	L162 L163 K164	L162-G166 PolarHBondContact O-N 2.7Å; L163-G166 WeakPolarHBondContact O-CA 3.39Å; L163-G166 PolarHBondContact O-N 2.84Å; K164-G166 VanDerWaalsContact C-N 3.27Å
167	H	87.4	Confident	89.3	Confident	106 Å²	106	78 Å²	78	49%	0.491	42%	0.416	S	S	.	.			trans	-79.2	138.4	177.8	-66.2	53.3	0	0	0	110.1	L162 K165 V169	L162-H167 HydrophobicContact CB-CB 4.19Å; L162-H167 WeakPolarHBondContact O-CB 3.19Å; L162-H167 PolarHBondContact O-N 2.95Å; K165-H167 VanDerWaalsContact C-N 3.26Å; K165-H167 WeakPolarHBondContact CB-ND1 3.4Å; K165-H167 PolarHBondContact O-N 2.94Å; K165-H167 PolarHBondContact O-ND1 2.83Å; H167-V169 PolarHBondContact O-N 3.43Å
168	Q	85.1	Confident	89.9	Confident	197 Å²	197	76.1 Å²	76.1	92%	0.921	41%	0.41	S	S	*	.			trans	-68.7	131.2	170.8	-72.7	-171	-20.2	0	0	110.5
169	V	86.8	Confident	90.4	Very high	18 Å²	18	71.2 Å²	71.2	11%	0.109	39%	0.392	C	S	.	.			trans	-131.3	126.1	179.8	178.6	0	0	0	0	108	L148 L159 L162 L163 H167	L148-V169 HydrophobicContact CD2-CG1 4.39Å; L148-V169 WeakPolarHBondContact CD2-O 3.39Å; L159-V169 HydrophobicContact CB-CG1 4.08Å; L159-V169 HydrophobicContact CD1-CG1 4.05Å; L159-V169 HydrophobicContact CD2-CG1 3.66Å; L159-V169 HydrophobicContact CG-CG1 4.09Å; L162-V169 HydrophobicContact CB-CG2 3.59Å; L162-V169 HydrophobicContact CD1-CG2 4.17Å; L163-V169 HydrophobicContact CD2-CB 4.01Å; L163-V169 HydrophobicContact CD2-CG2 4.15Å; L163-V169 HydrophobicContact CG-CB 4.18Å; L163-V169 HydrophobicContact CG-CG2 4.01Å; H167-V169 PolarHBondContact O-N 3.43Å
170	E	87.4	Confident	90.9	Very high	153 Å²	153	75.9 Å²	75.9	72%	0.715	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-80.3	148.5	173.3	-66.9	172.4	171	0	0	111
171	A	86	Confident	91.5	Very high	60 Å²	60	76.2 Å²	76.2	50%	0.496	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60.3	141.4	172.7	0	0	0	0	0	110.1	V145 L148	V145-A171 HydrophobicContact CG1-CB 4.14Å; L148-A171 HydrophobicContact CD2-CB 4.17Å
172	K	91.3	Very high	92.1	Very high	77 Å²	77	74.2 Å²	74.2	34%	0.335	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-71.3	150.2	169.1	-70.2	-68.9	-173.9	177	0	108.8	P146 L152 K153 L159	P146-K172 HydrophobicContact CG-CB 4.4Å; L152-K172 HydrophobicContact CD1-CB 4.29Å; L152-K172 HydrophobicContact CD1-CG 4.01Å; K153-K172 PolarHBondContact O-NZ 2.9Å; L159-K172 HydrophobicContact CD1-CG 4.14Å
173	P	93.8	Very high	92.6	Very high	107 Å²	107	76.1 Å²	76.1	70%	0.695	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-58.4	156.2	177.4	25.8	-35.1	0	0	0	111.1
174	A	96.3	Very high	93.2	Very high	44 Å²	44	75 Å²	75	36%	0.364	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-57.2	142.6	173	0	0	0	0	0	110.3	M143 Q144 V145	M143-A174 HydrophobicContact CB-CB 4.24Å; M143-A174 HydrophobicContact CE-CB 4.08Å; M143-A174 WeakPolarHBondContact CE-O 3.22Å; Q144-A174 WeakPolarHBondContact O-CA 3.37Å; V145-A174 HydrophobicContact CG2-CB 3.85Å
175	R	96.2	Very high	93.8	Very high	68 Å²	68	72.3 Å²	72.3	26%	0.257	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	151.7	-179.1	68.2	-174.9	-171.5	-176.2	3.6	111	Q144 P146 V177 G201 Y203	Q144-R175 PolarHBondContact N-O 3.06Å; Q144-R175 PolarHBondContact O-N 2.92Å; P146-R175 HydrophobicContact CG-CG 4.44Å; R175-V177 HydrophobicContact CG-CG1 4.42Å; R175-G201 PolarHBondContact NH2-O 2.88Å; R175-Y203 PolarHBondContact NH2-OH 2.89Å
176	P	97.2	Very high	94.2	Very high	106 Å²	106	70.5 Å²	70.5	69%	0.688	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	137.3	177.4	28.2	-34.8	0	0	0	110.3	I142 M143	I142-P176 WeakPolarHBondContact O-CA 3.37Å; M143-P176 HydrophobicContact SD-CB 4.08Å
177	V	97.4	Very high	94.8	Very high	5 Å²	5	69.1 Å²	69.1	3%	0.03	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	152.5	172.3	-64.8	0	0	0	0	108.5	I142 Q144 R175 F202	I142-V177 HydrophobicContact CD1-CG2 4.25Å; I142-V177 HydrophobicContact CG1-CG2 3.59Å; I142-V177 PolarHBondContact N-O 2.88Å; I142-V177 PolarHBondContact O-N 3.41Å; Q144-V177 HydrophobicContact CB-CG2 3.76Å; R175-V177 HydrophobicContact CG-CG1 4.42Å; V177-F202 HydrophobicContact CB-CD2 4.2Å; V177-F202 HydrophobicContact CG2-CD2 3.8Å; V177-F202 HydrophobicContact CG2-CE2 4.42Å
178	T	98.2	Very high	95.3	Very high	48 Å²	48	70.6 Å²	70.6	29%	0.294	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.2	178.4	-52.9	0	0	0	0	110.1	D141 C198 G199	D141-T178 WeakPolarHBondContact OD1-CB 3.43Å; D141-T178 VanDerWaalsContact OD1-CG2 3.3Å; D141-T178 WeakPolarHBondContact OD1-CG2 3.26Å; D141-T178 PolarHBondContact OD1-OG1 3.32Å; T178-C198 WeakPolarHBondContact O-CA 3.19Å; T178-C198 WeakPolarHBondContact O-CB 3.25Å; T178-G199 PolarHBondContact O-N 2.81Å
179	V	98.5	Very high	95.9	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	106.2	172	-176.4	0	0	0	0	107.6	F138 G140 I142 L182 E197 F202	F138-V179 WeakPolarHBondContact O-CB 3.47Å; F138-V179 WeakPolarHBondContact O-CG2 3.4Å; G140-V179 WeakPolarHBondContact CA-O 3.4Å; G140-V179 PolarHBondContact N-O 3.35Å; G140-V179 PolarHBondContact O-N 2.56Å; I142-V179 HydrophobicContact CD1-CG2 4.02Å; I142-V179 HydrophobicContact CG1-CG2 4.42Å; V179-L182 HydrophobicContact CG1-CB 3.86Å; V179-E197 CarbonylContact C-O 3.29Å; V179-F202 HydrophobicContact CG2-CD2 3.74Å; V179-F202 HydrophobicContact CG2-CE2 3.28Å; V179-F202 HydrophobicContact CG2-CZ 3.88Å
180	H	98.3	Very high	96.4	Very high	101 Å²	101	65.5 Å²	65.5	47%	0.468	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-40.2	-176.6	-57.6	-58	0	0	0	112	E197	H180-E197 HydrophobicContact CB-CB 4.19Å; H180-E197 HydrophobicContact CB-CG 3.99Å; H180-E197 PolarHBondContact N-O 3.5Å
181	S	98.5	Very high	97	Very high	35 Å²	35	61.5 Å²	61.5	25%	0.245	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	144.6	172.6	68	0	0	0	0	110.8	I196 E197	S181-I196 CarbonylContact O-C 3.56Å; S181-I196 WeakPolarHBondContact O-CA 3.44Å; S181-E197 PolarHBondContact N-O 3.02Å; S181-E197 VanDerWaalsContact N-O 3.13Å; S181-E197 PolarHBondContact O-N 2.89Å; S181-E197 VanDerWaalsContact OG-CB 3.23Å; S181-E197 WeakPolarHBondContact OG-CB 2.97Å
182	L	98.8	Very high	97.6	Very high	16 Å²	16	58.8 Å²	58.8	8%	0.084	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	116	177.6	175	59.4	0	0	0	108.6	L135 F138 V179 L194 D195 I196 L207	L135-L182 HydrophobicContact CB-CD2 4.25Å; L135-L182 HydrophobicContact CB-CG 4.35Å; L135-L182 HydrophobicContact CD2-CD1 4.11Å; L135-L182 HydrophobicContact CD2-CD2 3.69Å; L135-L182 HydrophobicContact CD2-CG 3.82Å; L135-L182 HydrophobicContact CG-CG 4.49Å; F138-L182 HydrophobicContact CB-CD2 3.66Å; V179-L182 HydrophobicContact CG1-CB 3.86Å; L182-L194 HydrophobicContact CD1-CB 4.38Å; L182-L194 HydrophobicContact CD1-CD1 4.22Å; L182-D195 WeakPolarHBondContact CA-O 3.34Å; L182-I196 HydrophobicContact CD1-CD1 4.45Å; L182-I196 HydrophobicContact CD1-CG1 3.78Å; L182-L207 HydrophobicContact CD1-CD2 3.87Å; L182-L207 HydrophobicContact CD2-CD1 4.06Å; L182-L207 HydrophobicContact CD2-CD2 4.3Å
183	T	98.5	Very high	97.9	Very high	58 Å²	58	56.1 Å²	56.1	36%	0.356	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.6	-174.4	59.4	0	0	0	0	111.7	Q185 L194 D195	T183-Q185 PolarHBondContact OG1-NE2 2.86Å; T183-L194 WeakPolarHBondContact O-CA 3.33Å; T183-D195 PolarHBondContact N-O 3.18Å; T183-D195 PolarHBondContact O-N 2.89Å
184	L	98.8	Very high	98.2	Very high	13 Å²	13	51 Å²	51	7%	0.068	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	109.4	172.9	-176.5	64.4	0	0	0	109.5	R128 M131 E132 L135 E186 F187 F192 L194	R128-L184 HydrophobicContact CG-CD2 3.75Å; M131-L184 HydrophobicContact CB-CD2 3.82Å; M131-L184 HydrophobicContact SD-CD1 3.89Å; M131-L184 HydrophobicContact SD-CD2 4.17Å; E132-L184 HydrophobicContact CG-CB 4.22Å; E132-L184 HydrophobicContact CG-CD2 3.86Å; L135-L184 HydrophobicContact CD1-CB 3.81Å; L184-E186 WeakPolarHBondContact CD1-O 3.35Å; L184-F187 HydrophobicContact CD1-CB 4.46Å; L184-F187 HydrophobicContact CD2-CB 4.09Å; L184-F187 HydrophobicContact CG-CB 4.48Å; L184-F192 HydrophobicContact CD1-CB 4.12Å; L184-L194 HydrophobicContact CD1-CD2 3.95Å
185	Q	98.6	Very high	98.3	Very high	118 Å²	118	50.9 Å²	50.9	55%	0.551	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	-44.4	-179.9	-63.9	-61.7	-44.1	0	0	111.5	T183 T193 D195	T183-Q185 PolarHBondContact OG1-NE2 2.86Å; Q185-T193 HydrophobicContact CB-CG2 4.23Å; Q185-T193 PolarHBondContact N-O 3.15Å; Q185-D195 HydrophobicContact CG-CB 3.73Å
186	E	98.6	Very high	98.4	Very high	81 Å²	81	47.6 Å²	47.6	38%	0.379	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.4	-177.8	-172.4	171.3	-151.9	0	0	110.4	L184 K188 F192 T193	L184-E186 WeakPolarHBondContact CD1-O 3.35Å; E186-K188 HydrophobicContact CG-CD 4.21Å; E186-K188 HydrophobicContact CG-CG 4.11Å; E186-K188 WeakPolarHBondContact OE1-CD 3.42Å; E186-K188 WeakPolarHBondContact OE1-CE 3.36Å; E186-K188 IonicContact OE1-NZ 2.7Å; E186-K188 PolarHBondContact OE1-NZ 2.82Å; E186-F192 CarbonylContact O-C 3.6Å; E186-F192 VanDerWaalsContact O-CA 3.31Å; E186-F192 WeakPolarHBondContact O-CA 3.38Å; E186-T193 PolarHBondContact N-O 3.41Å; E186-T193 PolarHBondContact O-N 2.93Å
187	F	98.6	Very high	98.5	Very high	38 Å²	38	44.4 Å²	44.4	17%	0.167	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	103.6	174.7	-176.8	-114.7	0	0	0	109.6	L104 I126 R128 M131 L184 P189 F192	L104-F187 HydrophobicContact CD1-CE2 4.13Å; I126-F187 HydrophobicContact CG2-CE2 4.49Å; I126-F187 HydrophobicContact CG2-CZ 4.14Å; I126-F187 WeakPolarHBondContact O-CZ 3.2Å; R128-F187 HydrophobicContact CB-CB 4.44Å; R128-F187 HydrophobicContact CB-CD1 3.66Å; R128-F187 HydrophobicContact CB-CE1 4.3Å; R128-F187 HydrophobicContact CB-CG 4.26Å; R128-F187 HydrophobicContact CG-CB 4.15Å; R128-F187 HydrophobicContact CG-CD1 4.3Å; R128-F187 HydrophobicContact CG-CG 4.46Å; R128-F187 VanDerWaalsContact N-CE1 3.31Å; M131-F187 HydrophobicContact CE-CD2 3.57Å; M131-F187 HydrophobicContact CE-CE2 3.17Å; M131-F187 HydrophobicContact CE-CZ 4.21Å; M131-F187 HydrophobicContact CG-CD2 4.38Å; M131-F187 HydrophobicContact CG-CE2 4.23Å; M131-F187 HydrophobicContact SD-CD2 3.38Å; M131-F187 WeakPolarHBondContact SD-CD2 3.14Å; M131-F187 HydrophobicContact SD-CE2 3.57Å; M131-F187 VanDerWaalsContact SD-CE2 3.57Å; M131-F187 HydrophobicContact SD-CG 4.34Å; L184-F187 HydrophobicContact CD1-CB 4.46Å; L184-F187 HydrophobicContact CD2-CB 4.09Å; L184-F187 HydrophobicContact CG-CB 4.48Å; F187-P189 HydrophobicContact CE1-CG 3.97Å; F187-P189 HydrophobicContact CE2-CB 4.18Å; F187-P189 HydrophobicContact CE2-CG 4.27Å; F187-P189 HydrophobicContact CZ-CB 4.02Å; F187-P189 HydrophobicContact CZ-CG 3.77Å; F187-F192 HydrophobicContact CD2-CB 3.95Å
188	K	98.3	Very high	98.6	Very high	137 Å²	137	44.2 Å²	44.2	60%	0.596	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	74.6	179.3	-71.6	-177.6	179.8	161.2	0	107.9	E186 L191	E186-K188 HydrophobicContact CG-CD 4.21Å; E186-K188 HydrophobicContact CG-CG 4.11Å; E186-K188 WeakPolarHBondContact OE1-CD 3.42Å; E186-K188 WeakPolarHBondContact OE1-CE 3.36Å; E186-K188 IonicContact OE1-NZ 2.7Å; E186-K188 PolarHBondContact OE1-NZ 2.82Å; K188-L191 CarbonylContact C-O 3.59Å; K188-L191 PolarHBondContact N-O 2.98Å; K188-L191 CarbonylContact O-C 3.51Å; K188-L191 WeakPolarHBondContact O-CA 3.38Å; K188-L191 PolarHBondContact O-N 3.09Å
189	P	97.4	Very high	98.5	Very high	63 Å²	63	42.4 Å²	42.4	41%	0.409	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	141	-170.3	19.8	-31.7	0	0	0	111.8	F123 F187 L191	F123-P189 HydrophobicContact CD2-CB 4.08Å; F123-P189 HydrophobicContact CE2-CB 4.04Å; F187-P189 HydrophobicContact CE1-CG 3.97Å; F187-P189 HydrophobicContact CE2-CB 4.18Å; F187-P189 HydrophobicContact CE2-CG 4.27Å; F187-P189 HydrophobicContact CZ-CB 4.02Å; F187-P189 HydrophobicContact CZ-CG 3.77Å; P189-L191 VanDerWaalsContact C-N 3.27Å; P189-L191 VanDerWaalsContact CA-N 3.3Å
190	P	98.3	Very high	98.2	Very high	45 Å²	45	43.6 Å²	43.6	29%	0.292	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	cis	-76.7	-3.9	9.8	31.7	-35.8	0	0	0	114.5	E103 L104 F123	E103-P190 WeakPolarHBondContact CA-O 3.5Å; E103-P190 HydrophobicContact CG-CB 4.3Å; E103-P190 HydrophobicContact CG-CG 4.49Å; L104-P190 HydrophobicContact CB-CB 4.43Å; L104-P190 PolarHBondContact N-O 3Å; F123-P190 HydrophobicContact CD2-CB 4.48Å; F123-P190 HydrophobicContact CE1-CB 4.02Å; F123-P190 HydrophobicContact CE2-CB 3.94Å; F123-P190 HydrophobicContact CZ-CB 3.68Å; F123-P190 HydrophobicContact CZ-CG 4.27Å
191	L	98.9	Very high	98	Very high	70 Å²	70	40.2 Å²	40.2	37%	0.366	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	146.7	-176.8	-58.3	-180	0	0	0	113.5	V101 G102 E103 K188 P189 K222	V101-L191 HydrophobicContact CG1-CB 4.46Å; V101-L191 HydrophobicContact CG1-CD2 4.27Å; G102-L191 WeakPolarHBondContact O-CA 3.29Å; E103-L191 HydrophobicContact CB-CD2 3.88Å; E103-L191 HydrophobicContact CG-CD2 4.08Å; K188-L191 CarbonylContact C-O 3.59Å; K188-L191 PolarHBondContact N-O 2.98Å; K188-L191 CarbonylContact O-C 3.51Å; K188-L191 WeakPolarHBondContact O-CA 3.38Å; K188-L191 PolarHBondContact O-N 3.09Å; P189-L191 VanDerWaalsContact C-N 3.27Å; P189-L191 VanDerWaalsContact CA-N 3.3Å; L191-K222 HydrophobicContact CD2-CG 4.5Å
192	F	98.9	Very high	97.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.009	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	150.8	171.5	63.4	-87.3	0	0	0	110.7	V101 G102 L104 M131 L184 E186 F187 L194 V208 L211 A219	V101-F192 CarbonylContact C-O 3.49Å; V101-F192 VanDerWaalsContact CA-O 3.28Å; V101-F192 WeakPolarHBondContact CA-O 3.31Å; G102-F192 PolarHBondContact N-O 2.89Å; G102-F192 WeakPolarHBondContact O-CD1 3.35Å; G102-F192 PolarHBondContact O-N 3.34Å; G102-F192 VanDerWaalsContact O-N 3.08Å; L104-F192 HydrophobicContact CD2-CD1 4.46Å; L104-F192 HydrophobicContact CD2-CE1 3.98Å; L104-F192 HydrophobicContact CG-CD1 3.97Å; L104-F192 HydrophobicContact CG-CE1 3.87Å; M131-F192 HydrophobicContact CE-CB 3.87Å; M131-F192 HydrophobicContact CE-CD1 3.55Å; M131-F192 HydrophobicContact CE-CD2 4.32Å; M131-F192 HydrophobicContact CE-CE1 4.08Å; M131-F192 HydrophobicContact CE-CG 3.66Å; M131-F192 HydrophobicContact SD-CB 3.88Å; M131-F192 HydrophobicContact SD-CD1 4.45Å; M131-F192 HydrophobicContact SD-CD2 4.27Å; M131-F192 HydrophobicContact SD-CG 3.97Å; L184-F192 HydrophobicContact CD1-CB 4.12Å; E186-F192 CarbonylContact O-C 3.6Å; E186-F192 VanDerWaalsContact O-CA 3.31Å; E186-F192 WeakPolarHBondContact O-CA 3.38Å; F187-F192 HydrophobicContact CD2-CB 3.95Å; F192-L194 HydrophobicContact CD2-CD1 4.33Å; F192-L194 HydrophobicContact CD2-CD2 4.09Å; F192-L194 HydrophobicContact CD2-CG 3.91Å; F192-L194 HydrophobicContact CE2-CD1 3.85Å; F192-L194 HydrophobicContact CE2-CD2 4.37Å; F192-L194 HydrophobicContact CE2-CG 3.93Å; F192-V208 HydrophobicContact CZ-CG1 4.03Å; F192-L211 HydrophobicContact CE2-CD2 3.97Å; F192-L211 HydrophobicContact CZ-CD2 4.24Å; F192-A219 HydrophobicContact CE1-CB 4.34Å; F192-A219 HydrophobicContact CZ-CB 4.44Å
193	T	98.9	Very high	97.8	Very high	21 Å²	21	40.3 Å²	40.3	13%	0.129	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.2	-177.1	-55.9	0	0	0	0	110.3	V99 A100 Q185 E186	V99-T193 HydrophobicContact CG1-CG2 3.76Å; A100-T193 CarbonylContact O-C 3.02Å; A100-T193 WeakPolarHBondContact O-CA 3.28Å; Q185-T193 HydrophobicContact CB-CG2 4.23Å; Q185-T193 PolarHBondContact N-O 3.15Å; E186-T193 PolarHBondContact N-O 3.41Å; E186-T193 PolarHBondContact O-N 2.93Å
194	L	98.9	Very high	97.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.8	176.8	-58.1	178.9	0	0	0	110.6	V99 A100 L135 L182 T183 L184 F192 I196 L207 V208 L211	V99-L194 WeakPolarHBondContact CA-O 3.42Å; A100-L194 PolarHBondContact N-O 3.43Å; A100-L194 PolarHBondContact O-N 3.42Å; L135-L194 HydrophobicContact CD1-CD2 3.92Å; L135-L194 HydrophobicContact CD2-CD1 4.35Å; L135-L194 HydrophobicContact CD2-CD2 3.92Å; L182-L194 HydrophobicContact CD1-CB 4.38Å; L182-L194 HydrophobicContact CD1-CD1 4.22Å; T183-L194 WeakPolarHBondContact O-CA 3.33Å; L184-L194 HydrophobicContact CD1-CD2 3.95Å; F192-L194 HydrophobicContact CD2-CD1 4.33Å; F192-L194 HydrophobicContact CD2-CD2 4.09Å; F192-L194 HydrophobicContact CD2-CG 3.91Å; F192-L194 HydrophobicContact CE2-CD1 3.85Å; F192-L194 HydrophobicContact CE2-CD2 4.37Å; F192-L194 HydrophobicContact CE2-CG 3.93Å; L194-I196 HydrophobicContact CB-CD1 4.12Å; L194-I196 HydrophobicContact CB-CG1 3.96Å; L194-L207 HydrophobicContact CD1-CD2 4.09Å; L194-V208 HydrophobicContact CD1-CG2 4.41Å; L194-L211 HydrophobicContact CD1-CD2 4.31Å
195	D	98.9	Very high	97.8	Very high	41 Å²	41	37.5 Å²	37.5	22%	0.219	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.9	161.4	-176.7	-83.4	0	0	0	109.3	L182 T183 Q185	L182-D195 WeakPolarHBondContact CA-O 3.34Å; T183-D195 PolarHBondContact N-O 3.18Å; T183-D195 PolarHBondContact O-N 2.89Å; Q185-D195 HydrophobicContact CG-CB 3.73Å
196	I	98.9	Very high	97.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.3	-166	-46.9	172.1	0	0	0	109.2	K97 Y98 A100 S181 L182 L194 C198 F202 V204 L207	K97-I196 CarbonylContact C-O 3.5Å; K97-I196 WeakPolarHBondContact CA-O 3.27Å; Y98-I196 PolarHBondContact N-O 2.83Å; Y98-I196 PolarHBondContact O-N 3.35Å; A100-I196 HydrophobicContact CB-CD1 4.11Å; S181-I196 CarbonylContact O-C 3.56Å; S181-I196 WeakPolarHBondContact O-CA 3.44Å; L182-I196 HydrophobicContact CD1-CD1 4.45Å; L182-I196 HydrophobicContact CD1-CG1 3.78Å; L194-I196 HydrophobicContact CB-CD1 4.12Å; L194-I196 HydrophobicContact CB-CG1 3.96Å; I196-C198 HydrophobicContact CG2-CB 4.37Å; I196-F202 HydrophobicContact CG2-CE1 4Å; I196-V204 HydrophobicContact CD1-CB 4.42Å; I196-V204 HydrophobicContact CD1-CG1 3.65Å; I196-V204 HydrophobicContact CD1-CG2 3.99Å; I196-L207 HydrophobicContact CD1-CD2 3.72Å; I196-L207 HydrophobicContact CG1-CD2 4.44Å
197	E	98.7	Very high	97.8	Very high	39 Å²	39	28.2 Å²	28.2	18%	0.182	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.2	163.1	-172.9	166.6	-161.7	0	0	109.5	S95 K96 K97 V179 H180 S181	S95-E197 WeakPolarHBondContact OG-CG 3.37Å; S95-E197 PolarHBondContact OG-OE1 3.38Å; K96-E197 WeakPolarHBondContact O-CA 3.22Å; K97-E197 WeakPolarHBondContact CE-OE1 3.2Å; K97-E197 WeakPolarHBondContact CE-OE2 3.39Å; K97-E197 HydrophobicContact CG-CB 4.02Å; K97-E197 HydrophobicContact CG-CG 3.9Å; K97-E197 IonicContact NZ-OE2 2.88Å; K97-E197 PolarHBondContact NZ-OE2 3Å; V179-E197 CarbonylContact C-O 3.29Å; H180-E197 HydrophobicContact CB-CB 4.19Å; H180-E197 HydrophobicContact CB-CG 3.99Å; H180-E197 PolarHBondContact N-O 3.5Å; S181-E197 PolarHBondContact N-O 3.02Å; S181-E197 VanDerWaalsContact N-O 3.13Å; S181-E197 PolarHBondContact O-N 2.89Å; S181-E197 VanDerWaalsContact OG-CB 3.23Å; S181-E197 WeakPolarHBondContact OG-CB 2.97Å
198	C	98.4	Very high	97.8	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162.4	-173.7	61.3	0	0	0	0	113	S95 K96 T178 I196 F202	S95-C198 CarbonylContact C-O 3.54Å; S95-C198 WeakPolarHBondContact CA-O 3.43Å; K96-C198 PolarHBondContact N-O 3.12Å; K96-C198 PolarHBondContact O-N 2.95Å; T178-C198 WeakPolarHBondContact O-CA 3.19Å; T178-C198 WeakPolarHBondContact O-CB 3.25Å; I196-C198 HydrophobicContact CG2-CB 4.37Å; C198-F202 HydrophobicContact CB-CB 3.87Å; C198-F202 HydrophobicContact CB-CD1 3.81Å; C198-F202 HydrophobicContact CB-CD2 4.33Å; C198-F202 HydrophobicContact CB-CE1 4.41Å; C198-F202 HydrophobicContact CB-CG 3.74Å; C198-F202 WeakPolarHBondContact SG-CD1 3.5Å
199	G	97.1	Very high	97.8	Very high	9 Å²	9	20.9 Å²	20.9	9%	0.093	13%	0.129	C	C	.	.			trans	-79.1	-170.3	178	0	0	0	0	0	114.6	T178	T178-G199 PolarHBondContact O-N 2.81Å
200	G	92.9	Very high	97.9	Very high	27 Å²	27	20 Å²	20	28%	0.278	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	141.5	170.9	0	0	0	0	0	113.6	L92 T93 F202	L92-G200 WeakPolarHBondContact O-CA 3.35Å; T93-G200 PolarHBondContact O-N 3.41Å; T93-G200 VanDerWaalsContact O-N 3.17Å; G200-F202 VanDerWaalsContact C-N 3.31Å; G200-F202 PolarHBondContact O-N 2.86Å
201	G	92.4	Very high	97.9	Very high	31 Å²	31	17.9 Å²	17.9	32%	0.32	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-0.5	172.1	0	0	0	0	0	116.2	R175 Y203	R175-G201 PolarHBondContact NH2-O 2.88Å; G201-Y203 WeakPolarHBondContact O-CD2 3.44Å
202	F	96.9	Very high	97.9	Very high	14 Å²	14	14.6 Å²	14.6	6%	0.061	9%	0.09	C	C	.	.			trans	-71.1	137.2	172.7	-173.9	-99.2	0	0	0	112.3	I142 V177 V179 I196 C198 G200 V204 L207	I142-F202 HydrophobicContact CD1-CE2 4.3Å; V177-F202 HydrophobicContact CB-CD2 4.2Å; V177-F202 HydrophobicContact CG2-CD2 3.8Å; V177-F202 HydrophobicContact CG2-CE2 4.42Å; V179-F202 HydrophobicContact CG2-CD2 3.74Å; V179-F202 HydrophobicContact CG2-CE2 3.28Å; V179-F202 HydrophobicContact CG2-CZ 3.88Å; I196-F202 HydrophobicContact CG2-CE1 4Å; C198-F202 HydrophobicContact CB-CB 3.87Å; C198-F202 HydrophobicContact CB-CD1 3.81Å; C198-F202 HydrophobicContact CB-CD2 4.33Å; C198-F202 HydrophobicContact CB-CE1 4.41Å; C198-F202 HydrophobicContact CB-CG 3.74Å; C198-F202 WeakPolarHBondContact SG-CD1 3.5Å; G200-F202 VanDerWaalsContact C-N 3.31Å; G200-F202 PolarHBondContact O-N 2.86Å; F202-V204 HydrophobicContact CD1-CG2 4.09Å; F202-V204 HydrophobicContact CE1-CB 4.48Å; F202-V204 HydrophobicContact CE1-CG2 3.89Å; F202-L207 HydrophobicContact CE1-CB 4.28Å; F202-L207 HydrophobicContact CE1-CD2 4.26Å; F202-L207 HydrophobicContact CZ-CB 3.7Å; F202-L207 HydrophobicContact CZ-CD1 4.36Å; F202-L207 HydrophobicContact CZ-CD2 3.85Å; F202-L207 HydrophobicContact CZ-CG 4.16Å
203	Y	97.4	Very high	97.8	Very high	38 Å²	38	19.4 Å²	19.4	15%	0.149	11%	0.111	C	C	.	.			trans	-112.9	111.2	173.7	-66.6	-85.4	0	0	0	110.6	Q144 P146 P147 R175 G201 R205 S206 L207	Q144-Y203 PolarHBondContact NE2-O 2.93Å; P146-Y203 HydrophobicContact CB-CD2 4.1Å; P146-Y203 HydrophobicContact CB-CE2 3.54Å; P146-Y203 HydrophobicContact CG-CE2 4.03Å; P147-Y203 VanDerWaalsContact CD-CD1 3.45Å; P147-Y203 HydrophobicContact CG-CD1 3.61Å; P147-Y203 HydrophobicContact CG-CE1 4.02Å; P147-Y203 HydrophobicContact CG-CG 3.94Å; R175-Y203 PolarHBondContact NH2-OH 2.89Å; G201-Y203 WeakPolarHBondContact O-CD2 3.44Å; Y203-R205 PolarHBondContact O-N 3.49Å; Y203-S206 PolarHBondContact O-N 3.46Å; Y203-L207 PolarHBondContact O-N 3.44Å; Y203-L207 VanDerWaalsContact O-N 3.14Å
204	V	98.4	Very high	97.8	Very high	6 Å²	6	20.3 Å²	20.3	4%	0.036	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-33.4	174.6	179.1	0	0	0	0	111.6	Y98 A100 I196 F202 L207 V208 V221 L224	Y98-V204 HydrophobicContact CD1-CG2 4.25Å; Y98-V204 HydrophobicContact CD2-CG2 3.97Å; Y98-V204 HydrophobicContact CE2-CG2 4.41Å; Y98-V204 HydrophobicContact CG-CG2 3.88Å; A100-V204 HydrophobicContact CB-CG1 3.56Å; I196-V204 HydrophobicContact CD1-CB 4.42Å; I196-V204 HydrophobicContact CD1-CG1 3.65Å; I196-V204 HydrophobicContact CD1-CG2 3.99Å; F202-V204 HydrophobicContact CD1-CG2 4.09Å; F202-V204 HydrophobicContact CE1-CB 4.48Å; F202-V204 HydrophobicContact CE1-CG2 3.89Å; V204-L207 WeakPolarHBondContact O-CB 3.45Å; V204-L207 PolarHBondContact O-N 3.29Å; V204-V208 PolarHBondContact O-N 2.89Å; V204-V221 HydrophobicContact CG1-CG2 4.38Å; V204-L224 HydrophobicContact CB-CD1 4.06Å; V204-L224 HydrophobicContact CB-CD2 4.28Å; V204-L224 HydrophobicContact CG1-CD1 3.79Å; V204-L224 HydrophobicContact CG2-CD1 4.12Å
205	R	98.3	Very high	97.8	Very high	7 Å²	7	20.8 Å²	20.8	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-46.4	175.5	-75.5	-174.4	-70.7	139.8	-6.4	113.1	D70 T110 L111 D112 F149 Y203 V208 D209 V221	D70-R205 IonicContact OD1-CZ 3.84Å; D70-R205 IonicContact OD1-NH2 3.08Å; D70-R205 PolarHBondContact OD1-NH2 2.95Å; D70-R205 IonicContact OD2-CZ 2.88Å; D70-R205 VanDerWaalsContact OD2-CZ 3.22Å; D70-R205 IonicContact OD2-NE 3Å; D70-R205 PolarHBondContact OD2-NE 3.26Å; D70-R205 IonicContact OD2-NH2 3.92Å; D70-R205 PolarHBondContact OD2-NH2 2.88Å; T110-R205 PolarHBondContact O-NH1 3.17Å; L111-R205 HydrophobicContact CB-CB 3.89Å; D112-R205 HydrophobicContact CB-CG 4.31Å; D112-R205 WeakPolarHBondContact OD2-CD 3.4Å; D112-R205 IonicContact OD2-NE 2.82Å; F149-R205 PolarHBondContact O-NH1 2.91Å; F149-R205 PolarHBondContact O-NH2 3.14Å; Y203-R205 PolarHBondContact O-N 3.49Å; R205-V208 PolarHBondContact O-N 3.33Å; R205-D209 PolarHBondContact O-N 3.01Å; R205-D209 VanDerWaalsContact O-N 3.17Å; R205-V221 HydrophobicContact CB-CG2 4.34Å; R205-V221 HydrophobicContact CG-CB 4.18Å; R205-V221 HydrophobicContact CG-CG2 3.83Å
206	S	98.3	Very high	97.8	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.028	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-40.2	174.6	-59.9	0	0	0	0	111.6	V145 P147 Y203 V208 D209 D210	V145-S206 PolarHBondContact O-OG 3.3Å; P147-S206 WeakPolarHBondContact CD-OG 3.14Å; Y203-S206 PolarHBondContact O-N 3.46Å; S206-V208 PolarHBondContact O-N 2.92Å; S206-D209 PolarHBondContact O-N 2.76Å; S206-D210 WeakPolarHBondContact O-CB 3.34Å; S206-D210 VanDerWaalsContact O-CG 3.25Å; S206-D210 PolarHBondContact O-N 3.21Å
207	L	98.6	Very high	97.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-54.9	-50.3	175.5	170.1	71.4	0	0	0	111.6	F138 L182 L194 I196 F202 Y203 V204 D210 L211	F138-L207 HydrophobicContact CB-CD1 3.52Å; F138-L207 HydrophobicContact CD1-CD1 3.77Å; F138-L207 HydrophobicContact CD2-CD1 4.47Å; F138-L207 HydrophobicContact CG-CD1 3.68Å; L182-L207 HydrophobicContact CD1-CD2 3.87Å; L182-L207 HydrophobicContact CD2-CD1 4.06Å; L182-L207 HydrophobicContact CD2-CD2 4.3Å; L194-L207 HydrophobicContact CD1-CD2 4.09Å; I196-L207 HydrophobicContact CD1-CD2 3.72Å; I196-L207 HydrophobicContact CG1-CD2 4.44Å; F202-L207 HydrophobicContact CE1-CB 4.28Å; F202-L207 HydrophobicContact CE1-CD2 4.26Å; F202-L207 HydrophobicContact CZ-CB 3.7Å; F202-L207 HydrophobicContact CZ-CD1 4.36Å; F202-L207 HydrophobicContact CZ-CD2 3.85Å; F202-L207 HydrophobicContact CZ-CG 4.16Å; Y203-L207 PolarHBondContact O-N 3.44Å; Y203-L207 VanDerWaalsContact O-N 3.14Å; V204-L207 WeakPolarHBondContact O-CB 3.45Å; V204-L207 PolarHBondContact O-N 3.29Å; L207-D210 PolarHBondContact O-N 3.44Å; L207-L211 VanDerWaalsContact O-CB 3.25Å; L207-L211 WeakPolarHBondContact O-CB 3.29Å; L207-L211 PolarHBondContact O-N 3.01Å
208	V	98.8	Very high	97.8	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-42.9	-176.5	166.3	0	0	0	0	111.5	F192 L194 V204 R205 S206 L211 G212 A219 H220 V221	F192-V208 HydrophobicContact CZ-CG1 4.03Å; L194-V208 HydrophobicContact CD1-CG2 4.41Å; V204-V208 PolarHBondContact O-N 2.89Å; R205-V208 PolarHBondContact O-N 3.33Å; S206-V208 PolarHBondContact O-N 2.92Å; V208-L211 PolarHBondContact O-N 3.38Å; V208-G212 PolarHBondContact O-N 3.35Å; V208-A219 HydrophobicContact CG1-CB 3.8Å; V208-H220 VanDerWaalsContact CG1-C 3.43Å; V208-V221 HydrophobicContact CB-CG2 3.8Å; V208-V221 HydrophobicContact CG1-CG2 4.19Å; V208-V221 HydrophobicContact CG2-CG2 3.74Å
209	D	98.7	Very high	97.8	Very high	20 Å²	20	21.6 Å²	21.6	11%	0.107	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-47.5	175.3	178	49.1	0	0	0	111.9	L111 R205 S206 L211 G212 K213	L111-D209 HydrophobicContact CD1-CB 4.03Å; L111-D209 HydrophobicContact CD2-CB 3.85Å; L111-D209 HydrophobicContact CG-CB 4.39Å; R205-D209 PolarHBondContact O-N 3.01Å; R205-D209 VanDerWaalsContact O-N 3.17Å; S206-D209 PolarHBondContact O-N 2.76Å; D209-L211 PolarHBondContact O-N 3.19Å; D209-G212 PolarHBondContact O-N 3.04Å; D209-K213 VanDerWaalsContact CG-CE 3.48Å; D209-K213 WeakPolarHBondContact O-CG 3.33Å; D209-K213 PolarHBondContact O-N 2.79Å; D209-K213 VanDerWaalsContact O-N 3.09Å; D209-K213 WeakPolarHBondContact OD1-CE 3.43Å; D209-K213 IonicContact OD1-NZ 3.88Å; D209-K213 WeakPolarHBondContact OD2-CE 3.15Å; D209-K213 IonicContact OD2-NZ 2.56Å; D209-K213 PolarHBondContact OD2-NZ 2.85Å
210	D	98.5	Very high	97.9	Very high	45 Å²	45	21.5 Å²	21.5	24%	0.241	13%	0.134	C	C	.	.	H	α-helix	trans	-68.2	-35.4	179.8	-67.8	-25.6	0	0	0	112.5	F138 S206 L207 K213 A214	F138-D210 HydrophobicContact CE1-CB 3.75Å; F138-D210 HydrophobicContact CZ-CB 4.16Å; S206-D210 WeakPolarHBondContact O-CB 3.34Å; S206-D210 VanDerWaalsContact O-CG 3.25Å; S206-D210 PolarHBondContact O-N 3.21Å; L207-D210 PolarHBondContact O-N 3.44Å; D210-K213 PolarHBondContact O-N 3.28Å; D210-K213 IonicContact OD1-NZ 2.81Å; D210-K213 PolarHBondContact OD1-NZ 2.85Å; D210-A214 WeakPolarHBondContact O-CB 3.48Å; D210-A214 PolarHBondContact O-N 2.87Å
211	L	98.7	Very high	98.1	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-44	171.6	178.7	63.3	0	0	0	111.1	K134 L135 F138 F192 L194 L207 V208 D209 K213 A214 L215	K134-L211 HydrophobicContact CB-CD1 3.76Å; L135-L211 HydrophobicContact CD2-CD1 4.16Å; L135-L211 HydrophobicContact CD2-CD2 3.76Å; F138-L211 HydrophobicContact CD2-CD1 4.22Å; F138-L211 HydrophobicContact CE2-CB 4.29Å; F138-L211 HydrophobicContact CE2-CD1 3.88Å; F192-L211 HydrophobicContact CE2-CD2 3.97Å; F192-L211 HydrophobicContact CZ-CD2 4.24Å; L194-L211 HydrophobicContact CD1-CD2 4.31Å; L207-L211 VanDerWaalsContact O-CB 3.25Å; L207-L211 WeakPolarHBondContact O-CB 3.29Å; L207-L211 PolarHBondContact O-N 3.01Å; V208-L211 PolarHBondContact O-N 3.38Å; D209-L211 PolarHBondContact O-N 3.19Å; L211-K213 VanDerWaalsContact C-N 3.31Å; L211-K213 PolarHBondContact O-N 3.02Å; L211-A214 PolarHBondContact O-N 3.16Å; L211-L215 HydrophobicContact CD1-CD1 4.05Å; L211-L215 HydrophobicContact CD1-CG 4.37Å; L211-L215 HydrophobicContact CG-CD1 3.95Å; L211-L215 WeakPolarHBondContact O-CG 3.31Å; L211-L215 PolarHBondContact O-N 3.13Å
212	G	98.6	Very high	98.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.2	-43.9	175.1	0	0	0	0	0	112.2	V208 D209 L215 S217	V208-G212 PolarHBondContact O-N 3.35Å; D209-G212 PolarHBondContact O-N 3.04Å; G212-L215 PolarHBondContact O-N 2.63Å; G212-S217 CarbonylContact C-O 3.58Å; G212-S217 CarbonylContact O-C 3.48Å; G212-S217 WeakPolarHBondContact O-CA 3.5Å; G212-S217 PolarHBondContact O-N 3.3Å
213	K	98.5	Very high	98.5	Very high	104 Å²	104	27.6 Å²	27.6	45%	0.452	15%	0.146	S	C	.	.	H	α-helix	trans	-63.8	-43.1	175.4	-63.9	168.1	-158.5	154.8	0	112.1	D209 D210 L211 L215 S216	D209-K213 VanDerWaalsContact CG-CE 3.48Å; D209-K213 WeakPolarHBondContact O-CG 3.33Å; D209-K213 PolarHBondContact O-N 2.79Å; D209-K213 VanDerWaalsContact O-N 3.09Å; D209-K213 WeakPolarHBondContact OD1-CE 3.43Å; D209-K213 IonicContact OD1-NZ 3.88Å; D209-K213 WeakPolarHBondContact OD2-CE 3.15Å; D209-K213 IonicContact OD2-NZ 2.56Å; D209-K213 PolarHBondContact OD2-NZ 2.85Å; D210-K213 PolarHBondContact O-N 3.28Å; D210-K213 IonicContact OD1-NZ 2.81Å; D210-K213 PolarHBondContact OD1-NZ 2.85Å; L211-K213 VanDerWaalsContact C-N 3.31Å; L211-K213 PolarHBondContact O-N 3.02Å; K213-L215 PolarHBondContact O-N 2.64Å; K213-S216 PolarHBondContact O-N 3.48Å
214	A	98.4	Very high	98.6	Very high	40 Å²	40	26.5 Å²	26.5	33%	0.331	14%	0.142	S	C	.	.	H	α-helix	trans	-64.4	-23.4	179	0	0	0	0	0	113.2	K134 F138 D210 L211 S216	K134-A214 HydrophobicContact CG-CB 4.42Å; F138-A214 HydrophobicContact CE2-CB 4.09Å; F138-A214 HydrophobicContact CZ-CB 4.02Å; D210-A214 WeakPolarHBondContact O-CB 3.48Å; D210-A214 PolarHBondContact O-N 2.87Å; L211-A214 PolarHBondContact O-N 3.16Å; A214-S216 VanDerWaalsContact C-N 3.29Å
215	L	98.4	Very high	98.6	Very high	9 Å²	9	27.9 Å²	27.9	5%	0.047	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	13.3	173.8	-65.5	165.4	0	0	0	113	L104 H125 I126 D130 M131 K134 L211 G212 K213 S217	L104-L215 HydrophobicContact CD2-CD1 4.37Å; H125-L215 PolarHBondContact NE2-O 2.91Å; I126-L215 HydrophobicContact CD1-CB 3.76Å; I126-L215 HydrophobicContact CD1-CD1 4.38Å; I126-L215 HydrophobicContact CG1-CB 4.25Å; I126-L215 HydrophobicContact CG2-CD1 4.17Å; I126-L215 HydrophobicContact CG2-CD2 4.22Å; D130-L215 HydrophobicContact CB-CD2 3.93Å; M131-L215 HydrophobicContact CE-CD1 4.26Å; M131-L215 HydrophobicContact CG-CD1 4Å; K134-L215 HydrophobicContact CB-CD2 4.26Å; K134-L215 HydrophobicContact CG-CD2 3.61Å; K134-L215 HydrophobicContact CG-CG 4.19Å; L211-L215 HydrophobicContact CD1-CD1 4.05Å; L211-L215 HydrophobicContact CD1-CG 4.37Å; L211-L215 HydrophobicContact CG-CD1 3.95Å; L211-L215 WeakPolarHBondContact O-CG 3.31Å; L211-L215 PolarHBondContact O-N 3.13Å; G212-L215 PolarHBondContact O-N 2.63Å; K213-L215 PolarHBondContact O-N 2.64Å; L215-S217 PolarHBondContact O-N 2.96Å
216	S	98.4	Very high	98.6	Very high	95 Å²	95	27.6 Å²	27.6	66%	0.664	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	27.3	-176.6	-59.4	0	0	0	0	113.9	K213 A214	K213-S216 PolarHBondContact O-N 3.48Å; A214-S216 VanDerWaalsContact C-N 3.29Å
217	S	98.6	Very high	98.6	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.007	16%	0.159	C	C	.	.	S	Bend	trans	-130.3	-144.9	176.7	-168.3	0	0	0	0	109.6	K121 V122 G212 L215	K121-S217 WeakPolarHBondContact CD-O 3.46Å; V122-S217 WeakPolarHBondContact O-CB 3.44Å; V122-S217 PolarHBondContact O-OG 3.13Å; G212-S217 CarbonylContact C-O 3.58Å; G212-S217 CarbonylContact O-C 3.48Å; G212-S217 WeakPolarHBondContact O-CA 3.5Å; G212-S217 PolarHBondContact O-N 3.3Å; L215-S217 PolarHBondContact O-N 2.96Å
218	C	98.7	Very high	98.6	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.02	17%	0.171	C	C	.	.			trans	-146.5	161.6	169.2	55.9	0	0	0	0	110.1	L104 G105 K106 A107 M119	L104-C218 CarbonylContact C-O 3.52Å; L104-C218 WeakPolarHBondContact CA-O 3.37Å; G105-C218 PolarHBondContact N-O 3.24Å; K106-C218 PolarHBondContact N-SG 3.22Å; K106-C218 VanDerWaalsContact N-SG 3.39Å; A107-C218 HydrophobicContact CB-CB 3.97Å; M119-C218 HydrophobicContact SD-CB 4.45Å
219	A	98.8	Very high	98.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	162.2	175.8	0	0	0	0	0	111.7	E103 L104 K106 F192 V208	E103-A219 WeakPolarHBondContact O-CA 3.19Å; E103-A219 WeakPolarHBondContact O-CB 3.41Å; L104-A219 HydrophobicContact CD2-CB 4.26Å; K106-A219 CarbonylContact O-C 3.51Å; K106-A219 WeakPolarHBondContact O-CA 3.41Å; F192-A219 HydrophobicContact CE1-CB 4.34Å; F192-A219 HydrophobicContact CZ-CB 4.44Å; V208-A219 HydrophobicContact CG1-CB 3.8Å
220	H	98.8	Very high	98.4	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.032	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	161.7	169	69.2	-82.7	0	0	0	110.6	G102 E103 K106 T108 A113 V208 K222	G102-H220 WeakPolarHBondContact CA-O 3.45Å; E103-H220 PolarHBondContact N-O 3.2Å; E103-H220 PolarHBondContact O-N 2.93Å; E103-H220 IonicContact OE2-CE1 3.75Å; E103-H220 IonicContact OE2-NE2 3.22Å; K106-H220 PolarHBondContact O-N 3.19Å; K106-H220 PolarHBondContact O-ND1 3.28Å; T108-H220 HydrophobicContact CG2-CB 4.31Å; A113-H220 PolarHBondContact N-CD2 3.28Å; V208-H220 VanDerWaalsContact CG1-C 3.43Å; H220-K222 PolarHBondContact O-N 2.82Å
221	V	98.8	Very high	98.2	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.03	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	118.2	175.3	175.1	0	0	0	0	109.9	L111 D112 A113 V204 R205 V208 E223 L224	L111-V221 PolarHBondContact O-N 3.39Å; L111-V221 VanDerWaalsContact O-N 3.1Å; D112-V221 CarbonylContact C-O 3.58Å; D112-V221 WeakPolarHBondContact CA-O 3.34Å; D112-V221 HydrophobicContact CB-CB 4.22Å; A113-V221 PolarHBondContact N-O 2.99Å; V204-V221 HydrophobicContact CG1-CG2 4.38Å; R205-V221 HydrophobicContact CB-CG2 4.34Å; R205-V221 HydrophobicContact CG-CB 4.18Å; R205-V221 HydrophobicContact CG-CG2 3.83Å; V208-V221 HydrophobicContact CB-CG2 3.8Å; V208-V221 HydrophobicContact CG1-CG2 4.19Å; V208-V221 HydrophobicContact CG2-CG2 3.74Å; V221-E223 WeakPolarHBondContact CG1-O 3.45Å; V221-L224 HydrophobicContact CG1-CB 3.88Å
222	K	98.6	Very high	98.2	Very high	83 Å²	83	33.5 Å²	33.5	36%	0.361	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-49.5	173.7	-171.6	58.5	163.3	-147.5	0	111.8	V101 E103 A113 L191 H220	V101-K222 HydrophobicContact CB-CB 4.37Å; V101-K222 HydrophobicContact CG1-CB 4.16Å; V101-K222 WeakPolarHBondContact O-CA 3.31Å; V101-K222 WeakPolarHBondContact O-CB 3.44Å; V101-K222 PolarHBondContact O-N 3.32Å; E103-K222 HydrophobicContact CB-CB 4.41Å; E103-K222 IonicContact OE2-NZ 2.95Å; E103-K222 PolarHBondContact OE2-NZ 2.64Å; A113-K222 HydrophobicContact CB-CD 3.96Å; L191-K222 HydrophobicContact CD2-CG 4.5Å; H220-K222 PolarHBondContact O-N 2.82Å
223	E	98.6	Very high	98.2	Very high	111 Å²	111	35 Å²	35	52%	0.519	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147	179.5	-60.6	-178.5	-168.4	0	0	110.5	A100 V101 V221	A100-E223 WeakPolarHBondContact CA-O 3.39Å; V101-E223 HydrophobicContact CB-CB 4Å; V101-E223 HydrophobicContact CG2-CB 4.09Å; V101-E223 PolarHBondContact N-O 3.23Å; V101-E223 PolarHBondContact O-N 3.44Å; V101-E223 VanDerWaalsContact O-N 3.16Å; V221-E223 WeakPolarHBondContact CG1-O 3.45Å
224	L	98.8	Very high	98.1	Very high	16 Å²	16	32.4 Å²	32.4	8%	0.084	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	122.7	-179.8	-178	59.3	0	0	0	111.1	A73 S74 Y98 A100 V204 V221	A73-L224 CarbonylContact C-O 3.59Å; A73-L224 WeakPolarHBondContact CA-O 3.48Å; A73-L224 HydrophobicContact CB-CB 3.82Å; A73-L224 HydrophobicContact CB-CD2 3.92Å; A73-L224 HydrophobicContact CB-CG 3.88Å; A73-L224 WeakPolarHBondContact CB-O 3.34Å; S74-L224 PolarHBondContact N-O 3.32Å; Y98-L224 HydrophobicContact CD1-CD1 3.81Å; Y98-L224 HydrophobicContact CD1-CG 4.32Å; Y98-L224 HydrophobicContact CG-CD1 4.29Å; A100-L224 HydrophobicContact CB-CD1 3.85Å; V204-L224 HydrophobicContact CB-CD1 4.06Å; V204-L224 HydrophobicContact CB-CD2 4.28Å; V204-L224 HydrophobicContact CG1-CD1 3.79Å; V204-L224 HydrophobicContact CG2-CD1 4.12Å; V221-L224 HydrophobicContact CG1-CB 3.88Å
225	V	98.9	Very high	98.1	Very high	35 Å²	35	39 Å²	39	21%	0.212	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.7	176.8	-171.7	0	0	0	0	109	S74 Y98 V99 T227 L234	S74-V225 CarbonylContact O-C 3.12Å; S74-V225 WeakPolarHBondContact O-CA 3.47Å; Y98-V225 CarbonylContact C-O 3.52Å; Y98-V225 VanDerWaalsContact CA-O 3.23Å; Y98-V225 WeakPolarHBondContact CA-O 3.27Å; V99-V225 PolarHBondContact N-O 2.78Å; V99-V225 PolarHBondContact O-N 3.35Å; V225-T227 HydrophobicContact CG1-CG2 4.25Å; V225-T227 PolarHBondContact O-N 3.23Å; V225-L234 HydrophobicContact CG1-CD2 3.89Å
226	R	98.8	Very high	98	Very high	1 Å²	1	44 Å²	44	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	106.9	167.3	-172.9	161.6	65	-162.1	-2.1	109	G67 L69 S74 G75 V76 K97 Y98 K228 Q229	G67-R226 PolarHBondContact O-NH2 3.24Å; L69-R226 HydrophobicContact CD1-CB 3.35Å; L69-R226 HydrophobicContact CD1-CG 4.27Å; S74-R226 PolarHBondContact O-N 3.05Å; G75-R226 CarbonylContact C-O 3.6Å; G75-R226 WeakPolarHBondContact CA-O 3.37Å; V76-R226 WeakPolarHBondContact CG2-O 3.35Å; V76-R226 PolarHBondContact N-O 3.4Å; V76-R226 PolarHBondContact O-NE 3.09Å; V76-R226 PolarHBondContact O-NH2 2.93Å; K97-R226 CarbonylContact O-C 3.54Å; K97-R226 WeakPolarHBondContact O-CA 3.39Å; K97-R226 WeakPolarHBondContact O-CG 3.27Å; Y98-R226 HydrophobicContact CD1-CB 3.76Å; Y98-R226 HydrophobicContact CD1-CG 4.06Å; Y98-R226 HydrophobicContact CE1-CB 3.59Å; Y98-R226 HydrophobicContact CE1-CG 3.69Å; R226-K228 VanDerWaalsContact CG-O 3.26Å; R226-K228 WeakPolarHBondContact CG-O 3.48Å; R226-Q229 VanDerWaalsContact CZ-OE1 3.27Å; R226-Q229 VanDerWaalsContact NH2-OE1 3.11Å
227	T	98.8	Very high	98	Very high	37 Å²	37	42.2 Å²	42.2	23%	0.227	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-19	-178.4	55.9	0	0	0	0	112.8	K97 V99 V225 T233 L234	K97-T227 VanDerWaalsContact CB-OG1 3.29Å; K97-T227 WeakPolarHBondContact CB-OG1 3.49Å; K97-T227 PolarHBondContact O-N 3.25Å; K97-T227 PolarHBondContact O-OG1 3.49Å; V99-T227 HydrophobicContact CB-CG2 4.46Å; V99-T227 HydrophobicContact CG2-CG2 3.9Å; V225-T227 HydrophobicContact CG1-CG2 4.25Å; V225-T227 PolarHBondContact O-N 3.23Å; T227-T233 CarbonylContact O-C 3.55Å; T227-L234 HydrophobicContact CG2-CD2 4.47Å; T227-L234 WeakPolarHBondContact O-CB 3.41Å; T227-L234 PolarHBondContact O-N 2.7Å
228	K	98.6	Very high	97.9	Very high	56 Å²	56	42.8 Å²	42.8	24%	0.243	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	147.1	177.2	-174.6	-179.3	167.6	-173.5	0	112.5	K96 K97 R226 G230 F232 T233	K96-K228 WeakPolarHBondContact CA-O 3.47Å; K97-K228 HydrophobicContact CB-CB 3.73Å; K97-K228 HydrophobicContact CD-CB 4.38Å; K97-K228 HydrophobicContact CD-CD 4.06Å; K97-K228 HydrophobicContact CG-CB 3.97Å; K97-K228 HydrophobicContact CG-CD 4.09Å; K97-K228 PolarHBondContact N-O 3.28Å; K97-K228 PolarHBondContact O-N 2.95Å; R226-K228 VanDerWaalsContact CG-O 3.26Å; R226-K228 WeakPolarHBondContact CG-O 3.48Å; K228-G230 WeakPolarHBondContact CE-O 3.48Å; K228-G230 WeakPolarHBondContact CG-O 3.48Å; K228-F232 CarbonylContact C-O 3.47Å; K228-F232 VanDerWaalsContact CA-O 3.27Å; K228-F232 WeakPolarHBondContact CA-O 3.47Å; K228-T233 HydrophobicContact CD-CG2 4.49Å; K228-T233 HydrophobicContact CG-CG2 4.31Å
229	Q	97.6	Very high	97.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	118.9	163.2	176.9	172.1	21.2	0	0	110.1	G66 V76 V78 M91 K96 R226 Q231 F232	G66-Q229 PolarHBondContact O-NE2 3.1Å; V76-Q229 HydrophobicContact CG1-CB 4.08Å; V78-Q229 HydrophobicContact CG2-CB 3.82Å; V78-Q229 HydrophobicContact CG2-CG 3.73Å; M91-Q229 PolarHBondContact O-NE2 3.37Å; K96-Q229 HydrophobicContact CG-CB 4.46Å; K96-Q229 HydrophobicContact CG-CG 4.24Å; R226-Q229 VanDerWaalsContact CZ-OE1 3.27Å; R226-Q229 VanDerWaalsContact NH2-OE1 3.11Å; Q229-Q231 PolarHBondContact O-N 3.29Å; Q229-F232 PolarHBondContact N-O 3.01Å; Q229-F232 PolarHBondContact O-N 3.1Å
230	G	94.9	Very high	97.9	Very high	20 Å²	20	46.3 Å²	46.3	21%	0.206	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	-127.6	-172.3	0	0	0	0	0	110.1	S95 K228	S95-G230 PolarHBondContact O-N 2.96Å; K228-G230 WeakPolarHBondContact CE-O 3.48Å; K228-G230 WeakPolarHBondContact CG-O 3.48Å
231	Q	94.6	Very high	97.7	Very high	80 Å²	80	49.8 Å²	49.8	37%	0.374	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.7	175.1	67.5	-87.6	44.6	0	0	114	Q229 T233 H237	Q229-Q231 PolarHBondContact O-N 3.29Å; Q231-T233 PolarHBondContact O-N 3.25Å; Q231-H237 PolarHBondContact O-CE1 3.36Å
232	F	97.9	Very high	97.6	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.1	-172.1	-57.4	-83.8	0	0	0	111.1	L20 A22 V76 V78 M91 K228 Q229 H237 Q254	L20-F232 HydrophobicContact CB-CE2 4.06Å; L20-F232 HydrophobicContact CB-CZ 3.69Å; L20-F232 HydrophobicContact CD1-CE2 4.46Å; A22-F232 HydrophobicContact CB-CB 3.78Å; A22-F232 HydrophobicContact CB-CD1 3.88Å; A22-F232 HydrophobicContact CB-CG 3.97Å; V76-F232 HydrophobicContact CG1-CB 4.01Å; V78-F232 HydrophobicContact CB-CD2 4.43Å; V78-F232 HydrophobicContact CG1-CD2 4.03Å; V78-F232 HydrophobicContact CG1-CE2 3.89Å; V78-F232 HydrophobicContact CG2-CB 4.09Å; V78-F232 HydrophobicContact CG2-CD2 3.49Å; V78-F232 VanDerWaalsContact CG2-CD2 3.49Å; V78-F232 HydrophobicContact CG2-CE2 4.23Å; V78-F232 HydrophobicContact CG2-CG 3.99Å; M91-F232 HydrophobicContact SD-CE2 4.39Å; K228-F232 CarbonylContact C-O 3.47Å; K228-F232 VanDerWaalsContact CA-O 3.27Å; K228-F232 WeakPolarHBondContact CA-O 3.47Å; Q229-F232 PolarHBondContact N-O 3.01Å; Q229-F232 PolarHBondContact O-N 3.1Å; F232-H237 HydrophobicContact CB-CB 4.2Å; F232-H237 HydrophobicContact CD1-CB 3.95Å; F232-Q254 HydrophobicContact CE1-CG 4.08Å; F232-Q254 HydrophobicContact CZ-CB 4.32Å; F232-Q254 HydrophobicContact CZ-CG 4.22Å
233	T	98.4	Very high	97.5	Very high	32 Å²	32	56.6 Å²	56.6	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	152.2	177.3	61.3	0	0	0	0	110.9	T227 K228 Q231 Q235 D236 H237	T227-T233 CarbonylContact O-C 3.55Å; K228-T233 HydrophobicContact CD-CG2 4.49Å; K228-T233 HydrophobicContact CG-CG2 4.31Å; Q231-T233 PolarHBondContact O-N 3.25Å; T233-Q235 VanDerWaalsContact C-N 3.26Å; T233-Q235 PolarHBondContact O-N 3.15Å; T233-D236 WeakPolarHBondContact OG1-CB 3.43Å; T233-D236 PolarHBondContact OG1-N 3Å; T233-D236 PolarHBondContact OG1-OD2 2.63Å; T233-H237 PolarHBondContact N-ND1 2.84Å; T233-H237 VanDerWaalsContact N-ND1 3.14Å; T233-H237 PolarHBondContact O-N 3.18Å; T233-H237 PolarHBondContact OG1-ND1 3.41Å
234	L	97.9	Very high	97.4	Very high	48 Å²	48	51.7 Å²	51.7	25%	0.251	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-35.1	176.6	-178	59.3	0	0	0	112.1	Y24 V76 V225 T227 V238	Y24-L234 HydrophobicContact CD2-CD1 3.63Å; Y24-L234 HydrophobicContact CE2-CD1 3.82Å; V76-L234 HydrophobicContact CG2-CB 3.87Å; V76-L234 HydrophobicContact CG2-CD1 4.44Å; V225-L234 HydrophobicContact CG1-CD2 3.89Å; T227-L234 HydrophobicContact CG2-CD2 4.47Å; T227-L234 WeakPolarHBondContact O-CB 3.41Å; T227-L234 PolarHBondContact O-N 2.7Å; L234-V238 HydrophobicContact CD1-CB 4.48Å; L234-V238 HydrophobicContact CD1-CG1 4.43Å; L234-V238 HydrophobicContact CD1-CG2 4.24Å
235	Q	96.9	Very high	97.3	Very high	178 Å²	178	53.1 Å²	53.1	83%	0.832	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-41.8	-175.7	-174.6	172.3	-0.9	0	0	112.8	T233	T233-Q235 VanDerWaalsContact C-N 3.26Å; T233-Q235 PolarHBondContact O-N 3.15Å
236	D	96.7	Very high	97.1	Very high	114 Å²	114	52.4 Å²	52.4	61%	0.61	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-22.3	-164	-43.2	-63	0	0	0	113.8	T233	T233-D236 WeakPolarHBondContact OG1-CB 3.43Å; T233-D236 PolarHBondContact OG1-N 3Å; T233-D236 PolarHBondContact OG1-OD2 2.63Å
237	H	98.1	Very high	97	Very high	58 Å²	58	60 Å²	60	27%	0.269	30%	0.299	S	S	.	.	S	Bend	trans	-118.7	-13.4	-164.3	-62.7	87.3	0	0	0	115.1	Q231 F232 T233	Q231-H237 PolarHBondContact O-CE1 3.36Å; F232-H237 HydrophobicContact CB-CB 4.2Å; F232-H237 HydrophobicContact CD1-CB 3.95Å; T233-H237 PolarHBondContact N-ND1 2.84Å; T233-H237 VanDerWaalsContact N-ND1 3.14Å; T233-H237 PolarHBondContact O-N 3.18Å; T233-H237 PolarHBondContact OG1-ND1 3.41Å
238	V	97.7	Very high	96.9	Very high	14 Å²	14	60 Å²	60	9%	0.085	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.4	-165.4	163.6	0	0	0	0	111.5	A22 Y24 V76 L234	A22-V238 HydrophobicContact CB-CG2 3.97Å; Y24-V238 VanDerWaalsContact CA-CG1 3.42Å; Y24-V238 HydrophobicContact CD2-CG1 4.24Å; Y24-V238 HydrophobicContact CG-CG1 4.25Å; V76-V238 HydrophobicContact CB-CG2 4.29Å; V76-V238 HydrophobicContact CG1-CG2 4.31Å; V76-V238 HydrophobicContact CG2-CG2 3.79Å; L234-V238 HydrophobicContact CD1-CB 4.48Å; L234-V238 HydrophobicContact CD1-CG1 4.43Å; L234-V238 HydrophobicContact CD1-CG2 4.24Å
239	L	98.3	Very high	96.9	Very high	15 Å²	15	57.3 Å²	57.3	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.5	168.6	-59.9	-179.9	0	0	0	111.3	F21 A22 I23 Y24 Q243 W244 V249 A252	F21-L239 HydrophobicContact CD2-CD1 4.3Å; A22-L239 PolarHBondContact O-N 3.42Å; I23-L239 WeakPolarHBondContact CA-O 3.36Å; I23-L239 HydrophobicContact CG2-CB 4.37Å; Y24-L239 PolarHBondContact N-O 2.68Å; L239-Q243 HydrophobicContact CD2-CB 4.34Å; L239-W244 PolarHBondContact O-NE1 2.94Å; L239-V249 HydrophobicContact CD1-CG2 4.08Å; L239-A252 HydrophobicContact CD1-CB 4.01Å; L239-A252 HydrophobicContact CD2-CB 4.17Å; L239-A252 HydrophobicContact CG-CB 4.14Å
240	H	97.9	Very high	96.8	Very high	61 Å²	61	60.2 Å²	60.2	28%	0.282	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-79.7	165.6	171.8	-70.1	-105.6	0	0	0	111.8	Y24 E242 Q243 W244	Y24-H240 AromaticContact CD1-CE1 3.91Å; Y24-H240 AromaticContact CD1-ND1 3.78Å; Y24-H240 AromaticContact CG-CE1 3.72Å; Y24-H240 AromaticContact CG-ND1 3.87Å; H240-E242 VanDerWaalsContact C-N 3.27Å; H240-E242 VanDerWaalsContact CB-CD 3.4Å; H240-E242 HydrophobicContact CB-CG 4.43Å; H240-E242 WeakPolarHBondContact CB-OE1 3.1Å; H240-E242 WeakPolarHBondContact CB-OE2 3.46Å; H240-E242 IonicContact CG-OE1 2.76Å; H240-E242 PolarHBondContact O-N 3.35Å; H240-Q243 WeakPolarHBondContact O-CA 3.2Å; H240-Q243 WeakPolarHBondContact O-CB 3.35Å; H240-Q243 PolarHBondContact O-N 2.73Å; H240-W244 PolarHBondContact O-N 2.6Å; H240-W244 PolarHBondContact O-NE1 3.08Å; H240-W244 VanDerWaalsContact O-NE1 3.16Å
241	E	96	Very high	96.8	Very high	81 Å²	81	62.8 Å²	62.8	38%	0.379	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-58.3	-39.4	-169.8	-170.5	177.6	142	0	0	112.8	K26 K37 Q243 W244	K26-E241 IonicContact NZ-OE2 3.78Å; K37-E241 WeakPolarHBondContact CE-OE1 3.47Å; K37-E241 IonicContact NZ-OE1 2.81Å; K37-E241 PolarHBondContact NZ-OE1 3.17Å; K37-E241 IonicContact NZ-OE2 3.86Å; K37-E241 PolarHBondContact NZ-OE2 2.89Å; E241-Q243 PolarHBondContact O-N 3.26Å; E241-W244 HydrophobicContact CB-CD2 4.38Å; E241-W244 HydrophobicContact CB-CH2 4.39Å; E241-W244 HydrophobicContact CB-CZ2 4.23Å; E241-W244 HydrophobicContact CG-CD2 4.16Å; E241-W244 HydrophobicContact CG-CE3 3.85Å; E241-W244 HydrophobicContact CG-CH2 4.02Å; E241-W244 HydrophobicContact CG-CZ2 4.32Å; E241-W244 HydrophobicContact CG-CZ3 3.79Å; E241-W244 WeakPolarHBondContact O-CB 3.44Å; E241-W244 PolarHBondContact O-N 2.9Å
242	E	95.9	Very high	97	Very high	151 Å²	151	60.3 Å²	60.3	71%	0.706	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-66	-17.6	175.4	62.2	-82.8	-165.3	0	0	113.8	H240	H240-E242 VanDerWaalsContact C-N 3.27Å; H240-E242 VanDerWaalsContact CB-CD 3.4Å; H240-E242 HydrophobicContact CB-CG 4.43Å; H240-E242 WeakPolarHBondContact CB-OE1 3.1Å; H240-E242 WeakPolarHBondContact CB-OE2 3.46Å; H240-E242 IonicContact CG-OE1 2.76Å; H240-E242 PolarHBondContact O-N 3.35Å
243	Q	96.9	Very high	96.9	Very high	79 Å²	79	61.9 Å²	61.9	37%	0.369	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-99.7	3.9	178.4	-59.4	171.7	-50.2	0	0	112.6	L239 H240 E241 T245 S248	L239-Q243 HydrophobicContact CD2-CB 4.34Å; H240-Q243 WeakPolarHBondContact O-CA 3.2Å; H240-Q243 WeakPolarHBondContact O-CB 3.35Å; H240-Q243 PolarHBondContact O-N 2.73Å; E241-Q243 PolarHBondContact O-N 3.26Å; Q243-T245 PolarHBondContact O-N 3.48Å; Q243-S248 WeakPolarHBondContact O-CB 3.33Å; Q243-S248 PolarHBondContact O-OG 2.97Å
244	W	96.8	Very high	96.7	Very high	9 Å²	9	63.5 Å²	63.5	3%	0.034	34%	0.339	C	S	.	.			trans	-74.2	70.8	-177.4	-65.8	-5.8	0	0	0	112.5	I23 V34 K37 F38 T41 L239 H240 E241	I23-W244 HydrophobicContact CD1-CZ2 4.33Å; V34-W244 HydrophobicContact CG1-CH2 3.96Å; V34-W244 HydrophobicContact CG1-CZ2 4.12Å; K37-W244 HydrophobicContact CB-CZ3 4.35Å; K37-W244 HydrophobicContact CD-CZ3 4.13Å; K37-W244 HydrophobicContact CG-CZ3 4.04Å; F38-W244 HydrophobicContact CB-CD2 4.39Å; F38-W244 HydrophobicContact CB-CE3 4.07Å; F38-W244 HydrophobicContact CB-CH2 4.23Å; F38-W244 HydrophobicContact CB-CZ3 3.99Å; F38-W244 HydrophobicContact CD2-CB 4.12Å; F38-W244 AromaticContact CD2-CD1 3.77Å; F38-W244 AromaticContact CD2-CD2 3.47Å; F38-W244 HydrophobicContact CD2-CD2 3.47Å; F38-W244 VanDerWaalsContact CD2-CD2 3.47Å; F38-W244 AromaticContact CD2-CE2 3.71Å; F38-W244 AromaticContact CD2-CE3 3.93Å; F38-W244 HydrophobicContact CD2-CE3 3.93Å; F38-W244 AromaticContact CD2-CG 3.53Å; F38-W244 HydrophobicContact CD2-CG 3.53Å; F38-W244 HydrophobicContact CD2-CZ2 4.39Å; F38-W244 AromaticContact CD2-NE1 3.88Å; F38-W244 HydrophobicContact CE2-CB 4.15Å; F38-W244 AromaticContact CE2-CD1 3.81Å; F38-W244 HydrophobicContact CE2-CD2 4.23Å; F38-W244 AromaticContact CE2-CG 3.8Å; F38-W244 HydrophobicContact CE2-CG 3.8Å; F38-W244 HydrophobicContact CG-CD2 4.4Å; F38-W244 HydrophobicContact CG-CE3 4.49Å; T41-W244 HydrophobicContact CG2-CB 4.14Å; L239-W244 PolarHBondContact O-NE1 2.94Å; H240-W244 PolarHBondContact O-N 2.6Å; H240-W244 PolarHBondContact O-NE1 3.08Å; H240-W244 VanDerWaalsContact O-NE1 3.16Å; E241-W244 HydrophobicContact CB-CD2 4.38Å; E241-W244 HydrophobicContact CB-CH2 4.39Å; E241-W244 HydrophobicContact CB-CZ2 4.23Å; E241-W244 HydrophobicContact CG-CD2 4.16Å; E241-W244 HydrophobicContact CG-CE3 3.85Å; E241-W244 HydrophobicContact CG-CH2 4.02Å; E241-W244 HydrophobicContact CG-CZ2 4.32Å; E241-W244 HydrophobicContact CG-CZ3 3.79Å; E241-W244 WeakPolarHBondContact O-CB 3.44Å; E241-W244 PolarHBondContact O-N 2.9Å
245	T	96.6	Very high	96.1	Very high	46 Å²	46	65.8 Å²	65.8	28%	0.282	36%	0.357	S	S	.	.	S	Bend	trans	-119.2	156.7	175.2	70.8	0	0	0	0	110.5	E45 Q243 Q247 S248 V249	E45-T245 WeakPolarHBondContact OE1-CB 3.45Å; E45-T245 VanDerWaalsContact OE2-CA 3.28Å; E45-T245 WeakPolarHBondContact OE2-CA 3.19Å; Q243-T245 PolarHBondContact O-N 3.48Å; T245-Q247 PolarHBondContact O-N 3Å; T245-S248 PolarHBondContact O-N 3.4Å; T245-S248 PolarHBondContact OG1-N 2.88Å; T245-S248 VanDerWaalsContact OG1-N 3.13Å; T245-S248 PolarHBondContact OG1-OG 3.45Å; T245-V249 WeakPolarHBondContact O-CG2 3.11Å; T245-V249 PolarHBondContact O-N 3.05Å
246	L	95	Very high	95.3	Very high	19 Å²	19	59.2 Å²	59.2	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-56.6	-38.7	175.4	178.2	61.4	0	0	0	111.4	K13 L14 L17 E45 V249 V250	K13-L246 HydrophobicContact CB-CD2 4.25Å; K13-L246 HydrophobicContact CD-CD2 4.01Å; K13-L246 HydrophobicContact CG-CD2 4.13Å; L14-L246 HydrophobicContact CB-CD1 4.05Å; L14-L246 HydrophobicContact CD1-CD1 3.98Å; L17-L246 HydrophobicContact CD1-CD1 3.77Å; E45-L246 VanDerWaalsContact CD-N 3.3Å; E45-L246 PolarHBondContact OE1-N 2.92Å; E45-L246 PolarHBondContact OE2-N 3.48Å; L246-V249 PolarHBondContact O-N 3.06Å; L246-V250 HydrophobicContact CD1-CG2 4.36Å; L246-V250 VanDerWaalsContact O-CG2 3.25Å; L246-V250 WeakPolarHBondContact O-CG2 3.46Å; L246-V250 PolarHBondContact O-N 3.21Å
247	Q	96.1	Very high	94.1	Very high	162 Å²	162	58.4 Å²	58.4	76%	0.757	33%	0.331	S	S	*	.	H	α-helix	trans	-64.2	-48.5	178.5	-177.5	179.1	-4.9	0	0	111.8	T245 V249 V250 G251	T245-Q247 PolarHBondContact O-N 3Å; Q247-V249 VanDerWaalsContact C-N 3.32Å; Q247-V249 PolarHBondContact O-N 3.32Å; Q247-V250 PolarHBondContact O-N 2.77Å; Q247-G251 PolarHBondContact O-N 3.39Å
248	S	97.1	Very high	92.2	Very high	36 Å²	36	64.4 Å²	64.4	25%	0.252	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-40.7	178.4	-60	0	0	0	0	111.6	Q243 T245 G251 A252	Q243-S248 WeakPolarHBondContact O-CB 3.33Å; Q243-S248 PolarHBondContact O-OG 2.97Å; T245-S248 PolarHBondContact O-N 3.4Å; T245-S248 PolarHBondContact OG1-N 2.88Å; T245-S248 VanDerWaalsContact OG1-N 3.13Å; T245-S248 PolarHBondContact OG1-OG 3.45Å; S248-G251 PolarHBondContact O-N 2.78Å; S248-A252 WeakPolarHBondContact O-CB 3.2Å; S248-A252 PolarHBondContact O-N 2.86Å
249	V	96.8	Very high	90	Very high	0 Å²	0	72 Å²	72	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-62.6	-45.1	177	175.3	0	0	0	0	110.7	L17 F21 F38 L42 L239 T245 L246 Q247 G251 A252 L253	L17-V249 HydrophobicContact CD1-CG1 3.88Å; F21-V249 HydrophobicContact CD1-CG1 4.38Å; F21-V249 HydrophobicContact CE1-CG1 4.16Å; F21-V249 HydrophobicContact CE2-CG2 4.47Å; F21-V249 HydrophobicContact CZ-CG1 4.27Å; F38-V249 HydrophobicContact CE2-CG2 4.16Å; F38-V249 HydrophobicContact CZ-CG2 3.66Å; L42-V249 HydrophobicContact CD1-CG2 4.24Å; L42-V249 HydrophobicContact CD2-CG2 4.22Å; L239-V249 HydrophobicContact CD1-CG2 4.08Å; T245-V249 WeakPolarHBondContact O-CG2 3.11Å; T245-V249 PolarHBondContact O-N 3.05Å; L246-V249 PolarHBondContact O-N 3.06Å; Q247-V249 VanDerWaalsContact C-N 3.32Å; Q247-V249 PolarHBondContact O-N 3.32Å; V249-G251 VanDerWaalsContact C-N 3.31Å; V249-G251 PolarHBondContact O-N 3.21Å; V249-A252 PolarHBondContact O-N 3.01Å; V249-L253 VanDerWaalsContact O-CB 3.3Å; V249-L253 WeakPolarHBondContact O-CB 3.43Å; V249-L253 PolarHBondContact O-N 2.84Å
250	V	95.9	Very high	87.1	Confident	61 Å²	61	78.6 Å²	78.6	37%	0.37	43%	0.43	S	S	.	.	H	α-helix	trans	-59.8	-42	175.9	168.7	0	0	0	0	111.3	L17 L246 Q247	L17-V250 HydrophobicContact CD1-CG2 4.24Å; L17-V250 HydrophobicContact CD2-CG2 3.76Å; L246-V250 HydrophobicContact CD1-CG2 4.36Å; L246-V250 VanDerWaalsContact O-CG2 3.25Å; L246-V250 WeakPolarHBondContact O-CG2 3.46Å; L246-V250 PolarHBondContact O-N 3.21Å; Q247-V250 PolarHBondContact O-N 2.77Å
251	G	96.3	Very high	84.2	Confident	73 Å²	73	84.4 Å²	84.4	75%	0.753	46%	0.457	S	S	*	.	H	α-helix	trans	-67.9	-33.3	178.6	0	0	0	0	0	114.1	Q247 S248 V249	Q247-G251 PolarHBondContact O-N 3.39Å; S248-G251 PolarHBondContact O-N 2.78Å; V249-G251 VanDerWaalsContact C-N 3.31Å; V249-G251 PolarHBondContact O-N 3.21Å
252	A	96.7	Very high	81.5	Confident	29 Å²	29	91.8 Å²	91.8	24%	0.24	48%	0.481	C	S	.	.	H	α-helix	trans	-90.2	-7.7	-179.9	0	0	0	0	0	113.9	F21 L239 S248 V249 Q254	F21-A252 HydrophobicContact CB-CB 4.36Å; L239-A252 HydrophobicContact CD1-CB 4.01Å; L239-A252 HydrophobicContact CD2-CB 4.17Å; L239-A252 HydrophobicContact CG-CB 4.14Å; S248-A252 WeakPolarHBondContact O-CB 3.2Å; S248-A252 PolarHBondContact O-N 2.86Å; V249-A252 PolarHBondContact O-N 3.01Å; A252-Q254 PolarHBondContact O-N 3.31Å
253	L	96.5	Very high	78.7	Confident	33 Å²	33	90 Å²	90	17%	0.173	48%	0.481	C	S	.	.			trans	-71.1	117.4	-172.6	-166.8	68	0	0	0	110.5	L17 F21 I81 V249 P255	L17-L253 HydrophobicContact CB-CD2 4.3Å; L17-L253 HydrophobicContact CD2-CD2 4.3Å; F21-L253 HydrophobicContact CD1-CD1 3.86Å; I81-L253 HydrophobicContact CG2-CD1 3.62Å; V249-L253 VanDerWaalsContact O-CB 3.3Å; V249-L253 WeakPolarHBondContact O-CB 3.43Å; V249-L253 PolarHBondContact O-N 2.84Å; L253-P255 WeakPolarHBondContact O-CD 3.35Å
254	Q	94.3	Very high	75.9	Confident	66 Å²	66	94 Å²	94	31%	0.308	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	111.4	163	-65.5	-161.8	-21.5	0	0	108.6	G19 L20 F232 A252	G19-Q254 CarbonylContact C-O 3.54Å; G19-Q254 VanDerWaalsContact CA-O 3.22Å; G19-Q254 WeakPolarHBondContact CA-O 3.41Å; L20-Q254 PolarHBondContact N-O 3.11Å; L20-Q254 PolarHBondContact O-N 3.5Å; F232-Q254 HydrophobicContact CE1-CG 4.08Å; F232-Q254 HydrophobicContact CZ-CB 4.32Å; F232-Q254 HydrophobicContact CZ-CG 4.22Å; A252-Q254 PolarHBondContact O-N 3.31Å
255	P	86.6	Confident	73	Confident	97 Å²	97	97.9 Å²	97.9	63%	0.63	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	156.2	-177.9	25.4	-32.1	0	0	0	110.9	L253	L253-P255 WeakPolarHBondContact O-CD 3.35Å
256	C	79.7	Confident	70.3	Confident	39 Å²	39	101.7 Å²	101.7	26%	0.264	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-58.1	140.1	168.3	-58.9	0	0	0	0	109	M87 E258	M87-C256 HydrophobicContact SD-CB 3.87Å; C256-E258 PolarHBondContact O-N 2.67Å
257	P	71.3	Confident	67.7	Low	97 Å²	97	112.4 Å²	112.4	63%	0.63	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-51.4	134.1	165	-20.3	30	0	0	0	108.3	M87 E259	M87-P257 VanDerWaalsContact CE-CD 3.42Å; M87-P257 HydrophobicContact CE-CG 4.21Å; P257-E259 PolarHBondContact O-N 2.96Å
258	E	58	Low	65	Low	184 Å²	184	109.7 Å²	109.7	86%	0.86	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.4	170.7	-66.5	-170.9	166.4	0	0	107.3	C256 D260	C256-E258 PolarHBondContact O-N 2.67Å; E258-D260 PolarHBondContact O-N 3.15Å
259	E	50.7	Low	62.5	Low	175 Å²	175	113.9 Å²	113.9	82%	0.818	62%	0.623	S	S	*	*			trans	-59.8	109.2	168.5	-75.3	178.3	177.3	0	0	105.4	P257 Q261	P257-E259 PolarHBondContact O-N 2.96Å; E259-Q261 PolarHBondContact O-N 3.4Å
260	D	37.7	Very low	60	Low	153 Å²	153	123 Å²	123	82%	0.818	67%	0.666	S	S	*	*			trans	-45.5	114.1	169.3	-96.3	-31.1	0	0	0	106.5	E258 R262	E258-D260 PolarHBondContact O-N 3.15Å; D260-R262 PolarHBondContact O-N 2.81Å
261	Q	36.7	Very low	57.3	Low	182 Å²	182	127.5 Å²	127.5	85%	0.85	69%	0.687	S	S	*	*			trans	-59.7	93.6	168.5	-66.9	-177.9	20.7	0	0	105.2	E259 T263	E259-Q261 PolarHBondContact O-N 3.4Å; Q261-T263 PolarHBondContact O-N 2.93Å
262	R	40	Very low	54.6	Low	236 Å²	236	128.9 Å²	128.9	89%	0.891	69%	0.692	S	S	*	*			trans	-59.4	101.5	165.6	-74	-174.6	-168.4	179	3.4	104.8	D260 D264	D260-R262 PolarHBondContact O-N 2.81Å; R262-D264 PolarHBondContact O-N 3.03Å
263	T	36.3	Very low	52.3	Low	114 Å²	114	137.7 Å²	137.7	70%	0.699	74%	0.743	S	S	*	*			trans	-55.5	106	165.6	42.5	0	0	0	0	106.2	Q261 S265	Q261-T263 PolarHBondContact O-N 2.93Å; T263-S265 PolarHBondContact O-N 3.23Å; T263-S265 PolarHBondContact O-OG 2.81Å
264	D	39.3	Very low	50.1	Low	164 Å²	164	142.9 Å²	142.9	88%	0.877	77%	0.771	S	S	*	*			trans	-59.5	91.1	163.1	-105.2	-22	0	0	0	106.4	R262	R262-D264 PolarHBondContact O-N 3.03Å
265	S	35.8	Very low	47.7	Very low	90 Å²	90	146.9 Å²	146.9	63%	0.629	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.6	122.1	170.2	-56.7	0	0	0	0	106.1	T263 R267	T263-S265 PolarHBondContact O-N 3.23Å; T263-S265 PolarHBondContact O-OG 2.81Å; S265-R267 PolarHBondContact O-N 3.23Å
266	P	40.4	Very low	45.6	Very low	125 Å²	125	149.7 Å²	149.7	81%	0.812	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.6	126.7	179	-5.3	14.6	0	0	0	109.1	S268	P266-S268 PolarHBondContact O-N 3.02Å; P266-S268 VanDerWaalsContact O-N 3.16Å
267	R	40	Very low	43.6	Very low	244 Å²	244	156.2 Å²	156.2	92%	0.921	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-57.1	120.2	170.7	-78.8	-179.4	179.8	177.6	-0.5	109.1	S265	S265-R267 PolarHBondContact O-N 3.23Å
268	S	38.3	Very low	41.8	Very low	105 Å²	105	159.9 Å²	159.9	73%	0.734	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-61.9	141.5	168.1	-42.6	0	0	0	0	109.9	P266 Q270	P266-S268 PolarHBondContact O-N 3.02Å; P266-S268 VanDerWaalsContact O-N 3.16Å; S268-Q270 PolarHBondContact O-N 2.9Å
269	P	46	Very low	40.8	Very low	124 Å²	124	158.3 Å²	158.3	81%	0.805	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-69	126.9	176	-5.1	20.3	0	0	0	109.3	N271	P269-N271 PolarHBondContact O-N 3.35Å
270	Q	44	Very low	40.1	Very low	193 Å²	193	157.1 Å²	157.1	90%	0.902	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-71.7	126.8	168.2	-74.4	-178.2	-10.1	0	0	109	S268	S268-Q270 PolarHBondContact O-N 2.9Å
271	N	39.2	Very low	40.2	Very low	154 Å²	154	157.5 Å²	157.5	82%	0.824	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-62.3	132	172.4	-76.8	-26.9	0	0	0	110.4	P269	P269-N271 PolarHBondContact O-N 3.35Å
272	A	40.2	Very low	40.5	Very low	102 Å²	102	155.4 Å²	155.4	84%	0.843	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-77.9	124.8	163.1	0	0	0	0	0	109.5
273	T	47	Very low	40.6	Very low	214 Å²	214	148.1 Å²	148.1	100%	1.313	85%	0.851	S	S	*	*			trans	-154	0	150.3	13.3	0	0	0	0	108

Retrieved 273 of 273 residues in 202.9 ms (Link to these results)

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