A0A087X442_POEFO Loading...

Sodium/potassium-transporting ATPase subunit beta

This is the non-catalytic component of the active enzyme, which catalyzes the hydrolysis of ATP coupled with the exchange of Na(+) and K(+) ions across the plasma membrane. The beta subunit regulates, through assembly of alpha/beta heterodimers, the number of sodium pumps transported to the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087X442, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 304 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	52.2	Low	245 Å²	245	136.3 Å²	136.3	100%	1.207	77%	0.771	S	S	*	*				0	116.3	0	-76.6	175.8	179.7	0	0	108.3	G3	M1-G3 PolarHBondContact O-N 3.36Å
2	A	45.7	Very low	53.9	Low	110 Å²	110	142.5 Å²	142.5	91%	0.909	77%	0.773	S	S	*	*			trans	-70.6	114.4	178.4	0	0	0	0	0	109.6	K4	A2-K4 PolarHBondContact O-N 2.74Å
3	G	40.8	Very low	55.1	Low	78 Å²	78	139.6 Å²	139.6	80%	0.804	75%	0.748	S	S	*	*			trans	-86.5	99	174.8	0	0	0	0	0	110.9	M1	M1-G3 PolarHBondContact O-N 3.36Å
4	K	41	Very low	56.5	Low	165 Å²	165	139 Å²	139	72%	0.717	74%	0.736	S	S	*	*			trans	21.9	113.9	156	-81.8	179.1	161.4	-164.6	0	118.6	A2 E6	A2-K4 PolarHBondContact O-N 2.74Å; K4-E6 HydrophobicContact CD-CG 4.46Å; K4-E6 IonicContact NZ-OE1 2.83Å; K4-E6 PolarHBondContact NZ-OE1 3.07Å; K4-E6 PolarHBondContact O-N 3.23Å
5	K	53.1	Low	58.1	Low	218 Å²	218	132.8 Å²	132.8	95%	0.948	70%	0.703	S	S	*	*			trans	-66.5	108.8	143.4	-87.2	178.7	173.1	176.6	0	107.7
6	E	47.9	Very low	59.7	Low	148 Å²	148	133.2 Å²	133.2	69%	0.692	69%	0.692	S	S	*	*			trans	-102	109.6	160.5	-86.4	179.6	-175.6	0	0	108.3	K4 D8	K4-E6 HydrophobicContact CD-CG 4.46Å; K4-E6 IonicContact NZ-OE1 2.83Å; K4-E6 PolarHBondContact NZ-OE1 3.07Å; K4-E6 PolarHBondContact O-N 3.23Å; E6-D8 PolarHBondContact O-N 2.87Å
7	S	58.3	Low	60.9	Low	112 Å²	112	126.8 Å²	126.8	78%	0.783	66%	0.659	S	S	*	*			trans	-71.4	108.6	154.7	61.8	0	0	0	0	107.1
8	D	52.6	Low	61.8	Low	141 Å²	141	124.7 Å²	124.7	75%	0.754	66%	0.657	S	S	*	*				-175.2	129.1	115.7	-121.6	-22.9	0	0	0	112.4	E6 K13	E6-D8 PolarHBondContact O-N 2.87Å; D8-K13 PolarHBondContact O-NZ 3.26Å
9	G	55.4	Low	62.7	Low	36 Å²	36	127 Å²	127	37%	0.371	66%	0.664	S	S	.	*			trans	176.7	87.7	-178.3	0	0	0	0	0	108.3
10	G	72.3	Confident	63.4	Low	55 Å²	55	127.4 Å²	127.4	57%	0.567	66%	0.66	S	S	*	*			trans	-49.8	166.8	173.9	0	0	0	0	0	112.2	R12 K13 F14	G10-R12 CarbonylContact O-C 3.56Å; G10-R12 PolarHBondContact O-N 3.04Å; G10-K13 PolarHBondContact O-N 3.17Å; G10-F14 PolarHBondContact O-N 2.78Å
11	W	72.3	Confident	64.1	Low	191 Å²	191	130.8 Å²	130.8	72%	0.723	66%	0.664	S	S	*	*	H	α-helix	trans	-37.9	-35	-172.5	-176.6	79.3	0	0	0	116	F14 L15	W11-F14 PolarHBondContact O-N 3.27Å; W11-L15 HydrophobicContact CD2-CD1 3.53Å; W11-L15 HydrophobicContact CD2-CG 4.41Å; W11-L15 VanDerWaalsContact CE2-CD1 3.44Å; W11-L15 HydrophobicContact CE3-CD1 3.5Å; W11-L15 HydrophobicContact CG-CD1 4.41Å; W11-L15 HydrophobicContact CH2-CD1 3.37Å; W11-L15 HydrophobicContact CZ2-CD1 3.4Å; W11-L15 VanDerWaalsContact CZ2-CD1 3.4Å; W11-L15 HydrophobicContact CZ2-CG 4.41Å; W11-L15 HydrophobicContact CZ3-CD1 3.41Å; W11-L15 VanDerWaalsContact CZ3-CD1 3.41Å; W11-L15 PolarHBondContact O-N 3.45Å
12	R	72.6	Confident	66.5	Low	211 Å²	211	121.6 Å²	121.6	80%	0.796	62%	0.618	S	S	*	*	H	α-helix	trans	-61.4	-42	174.2	-64.8	-176.8	178.4	-176.1	-0.7	114.5	G10 L15 W16	G10-R12 CarbonylContact O-C 3.56Å; G10-R12 PolarHBondContact O-N 3.04Å; R12-L15 PolarHBondContact O-N 2.67Å; R12-W16 PolarHBondContact O-N 2.76Å
13	K	70.3	Confident	68.3	Low	105 Å²	105	120.6 Å²	120.6	46%	0.457	59%	0.593	S	S	.	*	H	α-helix	trans	-77.4	-25.7	178.7	-166.9	171.8	177.9	-174.2	0	112.2	D8 G10	D8-K13 PolarHBondContact O-NZ 3.26Å; G10-K13 PolarHBondContact O-N 3.17Å
14	F	74.4	Confident	70.4	Confident	131 Å²	131	120 Å²	120	58%	0.575	57%	0.572	S	S	*	*	H	α-helix	trans	-69.6	-42.2	169.4	176.7	-101	0	0	0	111.9	G10 W11 L24	G10-F14 PolarHBondContact O-N 2.78Å; W11-F14 PolarHBondContact O-N 3.27Å; F14-L24 HydrophobicContact CD1-CD2 3.98Å; F14-L24 HydrophobicContact CE1-CD2 3.58Å; F14-L24 HydrophobicContact CZ-CD2 4.27Å; F14-L24 WeakPolarHBondContact O-CA 3.43Å
15	L	80.7	Confident	72.3	Confident	46 Å²	46	114.7 Å²	114.7	24%	0.241	56%	0.564	C	S	.	*	H	α-helix	trans	-66.2	-50.8	174.7	-83.9	166.1	0	0	0	112.4	W11 R12 F23 L24	W11-L15 HydrophobicContact CD2-CD1 3.53Å; W11-L15 HydrophobicContact CD2-CG 4.41Å; W11-L15 VanDerWaalsContact CE2-CD1 3.44Å; W11-L15 HydrophobicContact CE3-CD1 3.5Å; W11-L15 HydrophobicContact CG-CD1 4.41Å; W11-L15 HydrophobicContact CH2-CD1 3.37Å; W11-L15 HydrophobicContact CZ2-CD1 3.4Å; W11-L15 VanDerWaalsContact CZ2-CD1 3.4Å; W11-L15 HydrophobicContact CZ2-CG 4.41Å; W11-L15 HydrophobicContact CZ3-CD1 3.41Å; W11-L15 VanDerWaalsContact CZ3-CD1 3.41Å; W11-L15 PolarHBondContact O-N 3.45Å; R12-L15 PolarHBondContact O-N 2.67Å; L15-F23 WeakPolarHBondContact O-CA 3.16Å; L15-F23 WeakPolarHBondContact O-CD2 3.1Å; L15-L24 HydrophobicContact CD2-CD2 3.93Å; L15-L24 PolarHBondContact O-N 3.3Å
16	W	82.7	Confident	73.8	Confident	139 Å²	139	110.1 Å²	110.1	53%	0.527	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	118.7	-176.2	-178.3	-106.2	0	0	0	111.7	R12 F23	R12-W16 PolarHBondContact O-N 2.76Å; W16-F23 HydrophobicContact CE3-CB 3.99Å; W16-F23 HydrophobicContact CE3-CD2 4.21Å; W16-F23 HydrophobicContact CZ3-CB 4.06Å
17	N	80.9	Confident	75.8	Confident	25 Å²	25	106 Å²	106	13%	0.134	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	101	171.2	-173	-19.7	0	0	0	109.5	E19 K20 R21 E22	N17-E19 VanDerWaalsContact C-N 3.31Å; N17-E19 PolarHBondContact O-N 2.99Å; N17-E19 PolarHBondContact OD1-N 3.09Å; N17-E19 VanDerWaalsContact OD1-N 3.15Å; N17-K20 PolarHBondContact OD1-N 3.05Å; N17-R21 VanDerWaalsContact O-CA 3.28Å; N17-R21 WeakPolarHBondContact O-CA 3.22Å; N17-R21 PolarHBondContact O-N 2.83Å; N17-E22 HydrophobicContact CB-CB 4.25Å; N17-E22 PolarHBondContact N-O 3.24Å; N17-E22 PolarHBondContact O-N 3.06Å; N17-E22 VanDerWaalsContact O-N 3.1Å
18	S	76.8	Confident	77.1	Confident	89 Å²	89	103 Å²	103	62%	0.622	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.4	-179	-164.6	0	0	0	0	113.2
19	E	78.8	Confident	78.8	Confident	168 Å²	168	98.5 Å²	98.5	79%	0.785	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-41.7	-177	-65.5	176.7	167.7	0	0	112	N17	N17-E19 VanDerWaalsContact C-N 3.31Å; N17-E19 PolarHBondContact O-N 2.99Å; N17-E19 PolarHBondContact OD1-N 3.09Å; N17-E19 VanDerWaalsContact OD1-N 3.15Å
20	K	76.2	Confident	80.4	Confident	135 Å²	135	98.6 Å²	98.6	59%	0.587	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-4.2	179.5	-63.6	-174.1	179.1	-179.9	0	113.6	N17 E22	N17-K20 PolarHBondContact OD1-N 3.05Å; K20-E22 VanDerWaalsContact C-N 3.3Å; K20-E22 HydrophobicContact CB-CG 3.84Å; K20-E22 PolarHBondContact O-N 2.83Å
21	R	78.6	Confident	81.3	Confident	198 Å²	198	100.5 Å²	100.5	75%	0.747	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	46.9	-171.9	-57.9	-179.4	178.1	179.6	-1	112	N17	N17-R21 VanDerWaalsContact O-CA 3.28Å; N17-R21 WeakPolarHBondContact O-CA 3.22Å; N17-R21 PolarHBondContact O-N 2.83Å
22	E	84.9	Confident	82.3	Confident	52 Å²	52	97.1 Å²	97.1	24%	0.243	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.5	-179.8	-66.4	171.4	168.7	0	0	110.8	N17 K20 R26 T27	N17-E22 HydrophobicContact CB-CB 4.25Å; N17-E22 PolarHBondContact N-O 3.24Å; N17-E22 PolarHBondContact O-N 3.06Å; N17-E22 VanDerWaalsContact O-N 3.1Å; K20-E22 VanDerWaalsContact C-N 3.3Å; K20-E22 HydrophobicContact CB-CG 3.84Å; K20-E22 PolarHBondContact O-N 2.83Å; E22-R26 CarbonylContact C-O 3.5Å; E22-R26 VanDerWaalsContact CA-O 3.28Å; E22-R26 WeakPolarHBondContact CA-O 3.01Å; E22-T27 HydrophobicContact CG-CG2 3.78Å
23	F	83.6	Confident	83.3	Confident	89 Å²	89	94.8 Å²	94.8	39%	0.39	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.1	170.7	178.4	-107.7	0	0	0	108.9	L15 W16 G25 R26 W31	L15-F23 WeakPolarHBondContact O-CA 3.16Å; L15-F23 WeakPolarHBondContact O-CD2 3.1Å; W16-F23 HydrophobicContact CE3-CB 3.99Å; W16-F23 HydrophobicContact CE3-CD2 4.21Å; W16-F23 HydrophobicContact CZ3-CB 4.06Å; F23-G25 PolarHBondContact O-N 3.09Å; F23-R26 PolarHBondContact N-O 2.87Å; F23-R26 PolarHBondContact O-N 3.2Å; F23-R26 VanDerWaalsContact O-O 3.13Å; F23-W31 HydrophobicContact CD1-CZ2 4.34Å; F23-W31 AromaticContact CD1-NE1 3.69Å; F23-W31 PolarHBondContact O-NE1 2.88Å
24	L	84.5	Confident	84.4	Confident	66 Å²	66	91.5 Å²	91.5	35%	0.346	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	42.3	-176.6	-66.4	174	0	0	0	113.3	F14 L15 R26 W31	F14-L24 HydrophobicContact CD1-CD2 3.98Å; F14-L24 HydrophobicContact CE1-CD2 3.58Å; F14-L24 HydrophobicContact CZ-CD2 4.27Å; F14-L24 WeakPolarHBondContact O-CA 3.43Å; L15-L24 HydrophobicContact CD2-CD2 3.93Å; L15-L24 PolarHBondContact O-N 3.3Å; L24-R26 PolarHBondContact O-N 2.83Å; L24-W31 HydrophobicContact CB-CZ2 4.29Å; L24-W31 HydrophobicContact CD1-CZ2 4.38Å
25	G	80.6	Confident	85.4	Confident	54 Å²	54	91.7 Å²	91.7	56%	0.557	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	13.7	178.1	0	0	0	0	0	115.9	F23	F23-G25 PolarHBondContact O-N 3.09Å
26	R	85.4	Confident	86.2	Confident	121 Å²	121	94 Å²	94	46%	0.457	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.6	175.3	-67.8	-177.7	171.5	167.6	-4.6	111.9	E22 F23 L24	E22-R26 CarbonylContact C-O 3.5Å; E22-R26 VanDerWaalsContact CA-O 3.28Å; E22-R26 WeakPolarHBondContact CA-O 3.01Å; F23-R26 PolarHBondContact N-O 2.87Å; F23-R26 PolarHBondContact O-N 3.2Å; F23-R26 VanDerWaalsContact O-O 3.13Å; L24-R26 PolarHBondContact O-N 2.83Å
27	T	89.9	Confident	86.9	Confident	61 Å²	61	93 Å²	93	37%	0.374	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	154.2	174.3	59.4	0	0	0	0	111.2	E22 G29 S30 W31	E22-T27 HydrophobicContact CG-CG2 3.78Å; T27-G29 PolarHBondContact O-N 3.25Å; T27-S30 WeakPolarHBondContact O-CA 3.39Å; T27-S30 WeakPolarHBondContact O-CB 3.17Å; T27-S30 PolarHBondContact O-N 3.35Å; T27-S30 PolarHBondContact OG1-N 3.23Å; T27-W31 PolarHBondContact O-N 3.33Å
28	G	86.1	Confident	87.7	Confident	51 Å²	51	97.2 Å²	97.2	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-55.3	-35.2	177.5	0	0	0	0	0	113.7	W31 L32	G28-W31 PolarHBondContact O-N 3.06Å; G28-L32 PolarHBondContact O-N 2.93Å
29	G	87.1	Confident	88.7	Confident	45 Å²	45	96.6 Å²	96.6	46%	0.464	48%	0.483	S	S	.	.	H	α-helix	trans	-68	-32.5	174.1	0	0	0	0	0	113.7	T27 K33	T27-G29 PolarHBondContact O-N 3.25Å; G29-K33 VanDerWaalsContact O-CG 3.26Å; G29-K33 WeakPolarHBondContact O-CG 3.45Å; G29-K33 PolarHBondContact O-N 3.25Å
30	S	89.2	Confident	89.6	Confident	39 Å²	39	93.3 Å²	93.3	27%	0.273	47%	0.469	S	S	.	.	H	α-helix	trans	-69.4	-45.2	171.9	-179.7	0	0	0	0	110.8	T27 L32 K33 I34	T27-S30 WeakPolarHBondContact O-CA 3.39Å; T27-S30 WeakPolarHBondContact O-CB 3.17Å; T27-S30 PolarHBondContact O-N 3.35Å; T27-S30 PolarHBondContact OG1-N 3.23Å; S30-L32 PolarHBondContact O-N 2.81Å; S30-K33 PolarHBondContact O-N 2.79Å; S30-I34 VanDerWaalsContact O-CD1 3.32Å; S30-I34 WeakPolarHBondContact O-CD1 3.36Å; S30-I34 WeakPolarHBondContact O-CG1 3.36Å; S30-I34 PolarHBondContact O-N 3.05Å
31	W	91.1	Very high	90.6	Very high	95 Å²	95	91.4 Å²	91.4	36%	0.36	46%	0.461	S	S	.	.	H	α-helix	trans	-57.6	-44.6	175	-90.1	111.4	0	0	0	112.8	F23 L24 T27 G28 K33 I34 F35	F23-W31 HydrophobicContact CD1-CZ2 4.34Å; F23-W31 AromaticContact CD1-NE1 3.69Å; F23-W31 PolarHBondContact O-NE1 2.88Å; L24-W31 HydrophobicContact CB-CZ2 4.29Å; L24-W31 HydrophobicContact CD1-CZ2 4.38Å; T27-W31 PolarHBondContact O-N 3.33Å; G28-W31 PolarHBondContact O-N 3.06Å; W31-K33 VanDerWaalsContact C-N 3.35Å; W31-K33 PolarHBondContact O-N 2.6Å; W31-I34 PolarHBondContact O-N 2.89Å; W31-F35 VanDerWaalsContact O-CB 3.24Å; W31-F35 WeakPolarHBondContact O-CB 3.47Å; W31-F35 PolarHBondContact O-N 2.75Å
32	L	93.5	Very high	91.6	Very high	119 Å²	119	88.6 Å²	88.6	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-62	-41.6	176.4	-176.8	63.6	0	0	0	111.9	G28 S30 F35 L36	G28-L32 PolarHBondContact O-N 2.93Å; S30-L32 PolarHBondContact O-N 2.81Å; L32-F35 PolarHBondContact O-N 2.84Å; L32-L36 VanDerWaalsContact O-CB 3.24Å; L32-L36 WeakPolarHBondContact O-CB 3.47Å; L32-L36 PolarHBondContact O-N 3.18Å
33	K	93.5	Very high	92.2	Very high	162 Å²	162	88.1 Å²	88.1	70%	0.704	46%	0.461	S	S	*	.	H	α-helix	trans	-63.9	-44.2	176.6	-73.2	172.4	-176.2	-177.5	0	112.1	G29 S30 W31 F37	G29-K33 VanDerWaalsContact O-CG 3.26Å; G29-K33 WeakPolarHBondContact O-CG 3.45Å; G29-K33 PolarHBondContact O-N 3.25Å; S30-K33 PolarHBondContact O-N 2.79Å; W31-K33 VanDerWaalsContact C-N 3.35Å; W31-K33 PolarHBondContact O-N 2.6Å; K33-F37 VanDerWaalsContact O-CB 3.3Å; K33-F37 WeakPolarHBondContact O-CB 3.45Å; K33-F37 PolarHBondContact O-N 2.87Å
34	I	94.4	Very high	92.9	Very high	37 Å²	37	87.3 Å²	87.3	19%	0.19	47%	0.465	C	S	.	.	H	α-helix	trans	-65.5	-45.7	177.9	-68.2	153.4	0	0	0	110.3	S30 W31 F37 Y38	S30-I34 VanDerWaalsContact O-CD1 3.32Å; S30-I34 WeakPolarHBondContact O-CD1 3.36Å; S30-I34 WeakPolarHBondContact O-CG1 3.36Å; S30-I34 PolarHBondContact O-N 3.05Å; W31-I34 PolarHBondContact O-N 2.89Å; I34-F37 WeakPolarHBondContact O-CB 3.28Å; I34-F37 PolarHBondContact O-N 2.87Å; I34-Y38 HydrophobicContact CG2-CD2 3.74Å; I34-Y38 HydrophobicContact CG2-CE2 3.81Å; I34-Y38 VanDerWaalsContact O-CD2 3.28Å; I34-Y38 WeakPolarHBondContact O-CD2 3.16Å; I34-Y38 PolarHBondContact O-N 2.83Å
35	F	95.3	Very high	93.6	Very high	134 Å²	134	88.3 Å²	88.3	59%	0.588	47%	0.47	S	S	*	.	H	α-helix	trans	-59.4	-50.5	177.1	178.7	-99.6	0	0	0	111.1	W31 L32 F37 Y38 V39	W31-F35 VanDerWaalsContact O-CB 3.24Å; W31-F35 WeakPolarHBondContact O-CB 3.47Å; W31-F35 PolarHBondContact O-N 2.75Å; L32-F35 PolarHBondContact O-N 2.84Å; F35-F37 VanDerWaalsContact C-N 3.32Å; F35-F37 PolarHBondContact O-N 2.81Å; F35-Y38 PolarHBondContact O-N 2.87Å; F35-Y38 VanDerWaalsContact O-N 3.16Å; F35-V39 HydrophobicContact CD1-CG2 4.05Å; F35-V39 HydrophobicContact CD2-CG2 4.49Å; F35-V39 HydrophobicContact CE1-CG2 3.65Å; F35-V39 HydrophobicContact CE2-CG2 4.12Å; F35-V39 HydrophobicContact CG-CG2 4.46Å; F35-V39 HydrophobicContact CZ-CG2 3.68Å; F35-V39 WeakPolarHBondContact O-CG2 3.3Å; F35-V39 PolarHBondContact O-N 2.9Å
36	L	96.9	Very high	94.4	Very high	96 Å²	96	87.9 Å²	87.9	50%	0.503	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-42.2	177.5	-178.1	62.9	0	0	0	112	L32 Y38 V39 I40	L32-L36 VanDerWaalsContact O-CB 3.24Å; L32-L36 WeakPolarHBondContact O-CB 3.47Å; L32-L36 PolarHBondContact O-N 3.18Å; L36-Y38 PolarHBondContact O-N 3.28Å; L36-V39 PolarHBondContact O-N 3.31Å; L36-I40 HydrophobicContact CD1-CD1 3.99Å; L36-I40 HydrophobicContact CD1-CG1 4.28Å; L36-I40 HydrophobicContact CG-CD1 3.97Å; L36-I40 WeakPolarHBondContact O-CG1 3.41Å; L36-I40 PolarHBondContact O-N 2.85Å
37	F	97.1	Very high	95	Very high	118 Å²	118	85 Å²	85	52%	0.518	46%	0.464	S	S	.	.	H	α-helix	trans	-56	-50.4	173.9	167.2	-95.8	0	0	0	111.1	K33 I34 F35 V39 I40 F41	K33-F37 VanDerWaalsContact O-CB 3.3Å; K33-F37 WeakPolarHBondContact O-CB 3.45Å; K33-F37 PolarHBondContact O-N 2.87Å; I34-F37 WeakPolarHBondContact O-CB 3.28Å; I34-F37 PolarHBondContact O-N 2.87Å; F35-F37 VanDerWaalsContact C-N 3.32Å; F35-F37 PolarHBondContact O-N 2.81Å; F37-V39 PolarHBondContact O-N 2.68Å; F37-I40 PolarHBondContact O-N 2.89Å; F37-F41 HydrophobicContact CE1-CB 4.43Å; F37-F41 HydrophobicContact CZ-CB 4.39Å; F37-F41 HydrophobicContact CZ-CD2 4.34Å; F37-F41 HydrophobicContact CZ-CG 4.41Å; F37-F41 WeakPolarHBondContact O-CB 3.5Å; F37-F41 PolarHBondContact O-N 2.89Å
38	Y	97.6	Very high	95.4	Very high	113 Å²	113	87.8 Å²	87.8	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-67.8	-35.2	179.9	-84.1	-70.8	0	0	0	112.9	I34 F35 L36 F41 Y42	I34-Y38 HydrophobicContact CG2-CD2 3.74Å; I34-Y38 HydrophobicContact CG2-CE2 3.81Å; I34-Y38 VanDerWaalsContact O-CD2 3.28Å; I34-Y38 WeakPolarHBondContact O-CD2 3.16Å; I34-Y38 PolarHBondContact O-N 2.83Å; F35-Y38 PolarHBondContact O-N 2.87Å; F35-Y38 VanDerWaalsContact O-N 3.16Å; L36-Y38 PolarHBondContact O-N 3.28Å; Y38-F41 PolarHBondContact O-N 2.65Å; Y38-Y42 AromaticContact CD1-CD2 3.84Å; Y38-Y42 HydrophobicContact CD1-CD2 3.84Å; Y38-Y42 AromaticContact CD1-CE2 3.37Å; Y38-Y42 HydrophobicContact CD1-CE2 3.37Å; Y38-Y42 HydrophobicContact CE1-CE2 4Å; Y38-Y42 HydrophobicContact CG-CD2 4.5Å; Y38-Y42 HydrophobicContact CG-CE2 4.28Å; Y38-Y42 WeakPolarHBondContact O-CB 3.34Å; Y38-Y42 VanDerWaalsContact O-CD2 3.27Å; Y38-Y42 WeakPolarHBondContact O-CD2 3.39Å; Y38-Y42 PolarHBondContact O-N 2.76Å
39	V	98.1	Very high	96	Very high	76 Å²	76	91.6 Å²	91.6	46%	0.461	48%	0.478	S	S	.	.	H	α-helix	trans	-60.8	-49	174.2	168.3	0	0	0	0	110.6	F35 L36 F37 G43	F35-V39 HydrophobicContact CD1-CG2 4.05Å; F35-V39 HydrophobicContact CD2-CG2 4.49Å; F35-V39 HydrophobicContact CE1-CG2 3.65Å; F35-V39 HydrophobicContact CE2-CG2 4.12Å; F35-V39 HydrophobicContact CG-CG2 4.46Å; F35-V39 HydrophobicContact CZ-CG2 3.68Å; F35-V39 WeakPolarHBondContact O-CG2 3.3Å; F35-V39 PolarHBondContact O-N 2.9Å; L36-V39 PolarHBondContact O-N 3.31Å; F37-V39 PolarHBondContact O-N 2.68Å; V39-G43 PolarHBondContact O-N 3.29Å
40	I	98.1	Very high	96.6	Very high	98 Å²	98	94.1 Å²	94.1	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-66.7	-47.1	178.4	-64.5	169.3	0	0	0	110.2	L36 F37 G43 C44	L36-I40 HydrophobicContact CD1-CD1 3.99Å; L36-I40 HydrophobicContact CD1-CG1 4.28Å; L36-I40 HydrophobicContact CG-CD1 3.97Å; L36-I40 WeakPolarHBondContact O-CG1 3.41Å; L36-I40 PolarHBondContact O-N 2.85Å; F37-I40 PolarHBondContact O-N 2.89Å; I40-G43 PolarHBondContact O-N 2.76Å; I40-C44 PolarHBondContact O-N 2.97Å; I40-C44 PolarHBondContact O-SG 3.16Å; I40-C44 VanDerWaalsContact O-SG 3.34Å
41	F	98.1	Very high	97	Very high	96 Å²	96	94.2 Å²	94.2	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-51.8	-178.6	176.5	-97.6	0	0	0	112.2	F37 Y38 G43 C44 L45	F37-F41 HydrophobicContact CE1-CB 4.43Å; F37-F41 HydrophobicContact CZ-CB 4.39Å; F37-F41 HydrophobicContact CZ-CD2 4.34Å; F37-F41 HydrophobicContact CZ-CG 4.41Å; F37-F41 WeakPolarHBondContact O-CB 3.5Å; F37-F41 PolarHBondContact O-N 2.89Å; Y38-F41 PolarHBondContact O-N 2.65Å; F41-G43 VanDerWaalsContact C-N 3.33Å; F41-C44 PolarHBondContact O-N 2.96Å; F41-L45 HydrophobicContact CE1-CD1 4.05Å; F41-L45 HydrophobicContact CZ-CD1 4.22Å; F41-L45 WeakPolarHBondContact O-CB 3.23Å; F41-L45 PolarHBondContact O-N 3.21Å
42	Y	98.3	Very high	97.3	Very high	138 Å²	138	93.6 Å²	93.6	54%	0.541	49%	0.493	S	S	.	.	H	α-helix	trans	-69.9	-30.3	177.4	-78	-66.9	0	0	0	112.4	Y38 L45 A46	Y38-Y42 AromaticContact CD1-CD2 3.84Å; Y38-Y42 HydrophobicContact CD1-CD2 3.84Å; Y38-Y42 AromaticContact CD1-CE2 3.37Å; Y38-Y42 HydrophobicContact CD1-CE2 3.37Å; Y38-Y42 HydrophobicContact CE1-CE2 4Å; Y38-Y42 HydrophobicContact CG-CD2 4.5Å; Y38-Y42 HydrophobicContact CG-CE2 4.28Å; Y38-Y42 WeakPolarHBondContact O-CB 3.34Å; Y38-Y42 VanDerWaalsContact O-CD2 3.27Å; Y38-Y42 WeakPolarHBondContact O-CD2 3.39Å; Y38-Y42 PolarHBondContact O-N 2.76Å; Y42-L45 PolarHBondContact O-N 3Å; Y42-A46 VanDerWaalsContact O-CB 3.24Å; Y42-A46 WeakPolarHBondContact O-CB 3.37Å; Y42-A46 PolarHBondContact O-N 2.91Å
43	G	98.4	Very high	97.5	Very high	42 Å²	42	90.9 Å²	90.9	43%	0.433	48%	0.479	S	S	.	.	H	α-helix	trans	-59.8	-48.3	170.3	0	0	0	0	0	111.9	V39 I40 F41 A46 A47	V39-G43 PolarHBondContact O-N 3.29Å; I40-G43 PolarHBondContact O-N 2.76Å; F41-G43 VanDerWaalsContact C-N 3.33Å; G43-A46 PolarHBondContact O-N 2.77Å; G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 3.48Å
44	C	98.3	Very high	97.7	Very high	72 Å²	72	88.2 Å²	88.2	49%	0.486	47%	0.469	S	S	.	.	H	α-helix	trans	-63.8	-43.2	175	-68.1	0	0	0	0	112.1	I40 F41 A46 A47 I48	I40-C44 PolarHBondContact O-N 2.97Å; I40-C44 PolarHBondContact O-SG 3.16Å; I40-C44 VanDerWaalsContact O-SG 3.34Å; F41-C44 PolarHBondContact O-N 2.96Å; C44-A46 PolarHBondContact O-N 3.12Å; C44-A47 PolarHBondContact O-N 2.72Å; C44-I48 WeakPolarHBondContact O-CG1 3.49Å; C44-I48 PolarHBondContact O-N 3.34Å
45	L	98.3	Very high	97.9	Very high	87 Å²	87	89.2 Å²	89.2	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-43.7	178.2	-166.9	156.1	0	0	0	111.4	F41 Y42 I48 F49	F41-L45 HydrophobicContact CE1-CD1 4.05Å; F41-L45 HydrophobicContact CZ-CD1 4.22Å; F41-L45 WeakPolarHBondContact O-CB 3.23Å; F41-L45 PolarHBondContact O-N 3.21Å; Y42-L45 PolarHBondContact O-N 3Å; L45-I48 PolarHBondContact O-N 2.93Å; L45-F49 PolarHBondContact O-N 3.23Å
46	A	98.4	Very high	97.9	Very high	46 Å²	46	87.2 Å²	87.2	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-41.1	175	0	0	0	0	0	111.8	Y42 G43 C44 F49 I50	Y42-A46 VanDerWaalsContact O-CB 3.24Å; Y42-A46 WeakPolarHBondContact O-CB 3.37Å; Y42-A46 PolarHBondContact O-N 2.91Å; G43-A46 PolarHBondContact O-N 2.77Å; C44-A46 PolarHBondContact O-N 3.12Å; A46-F49 PolarHBondContact O-N 3.12Å; A46-I50 VanDerWaalsContact O-CG1 3.26Å; A46-I50 WeakPolarHBondContact O-CG1 3.29Å; A46-I50 PolarHBondContact O-N 2.88Å
47	A	98.3	Very high	97.8	Very high	61 Å²	61	87.1 Å²	87.1	50%	0.504	48%	0.477	S	S	.	.	H	α-helix	trans	-62.9	-42.6	176.3	0	0	0	0	0	112.2	G43 C44 I50 G51	G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 3.48Å; C44-A47 PolarHBondContact O-N 2.72Å; A47-I50 PolarHBondContact O-N 3.32Å; A47-G51 PolarHBondContact O-N 2.85Å
48	I	98.3	Very high	97.7	Very high	119 Å²	119	88.8 Å²	88.8	61%	0.61	49%	0.491	S	S	*	.	H	α-helix	trans	-61	-47.5	174	-67.9	166.8	0	0	0	110	C44 L45 I50 G51 T52	C44-I48 WeakPolarHBondContact O-CG1 3.49Å; C44-I48 PolarHBondContact O-N 3.34Å; L45-I48 PolarHBondContact O-N 2.93Å; I48-I50 PolarHBondContact O-N 2.88Å; I48-G51 PolarHBondContact O-N 2.89Å; I48-T52 HydrophobicContact CG2-CG2 4.41Å; I48-T52 WeakPolarHBondContact O-CG2 3.32Å; I48-T52 PolarHBondContact O-N 3.41Å; I48-T52 PolarHBondContact O-OG1 3.48Å
49	F	98.3	Very high	97.6	Very high	130 Å²	130	88.3 Å²	88.3	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-58.2	-49	178.2	179.4	-107.8	0	0	0	111.9	L45 A46 G51 T52 I53	L45-F49 PolarHBondContact O-N 3.23Å; A46-F49 PolarHBondContact O-N 3.12Å; F49-G51 VanDerWaalsContact C-N 3.32Å; F49-G51 PolarHBondContact O-N 3.4Å; F49-T52 PolarHBondContact O-N 3.48Å; F49-T52 PolarHBondContact O-OG1 3.31Å; F49-I53 HydrophobicContact CD1-CG1 4.41Å; F49-I53 HydrophobicContact CD2-CG1 4.38Å; F49-I53 HydrophobicContact CE1-CG1 4Å; F49-I53 HydrophobicContact CE2-CD1 4.13Å; F49-I53 HydrophobicContact CE2-CG1 3.96Å; F49-I53 HydrophobicContact CZ-CD1 4.01Å; F49-I53 HydrophobicContact CZ-CG1 3.76Å; F49-I53 WeakPolarHBondContact O-CG1 3.39Å; F49-I53 PolarHBondContact O-N 3.19Å
50	I	98.4	Very high	97.3	Very high	99 Å²	99	88.4 Å²	88.4	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-57.3	-46.8	175.4	-68.3	164.7	0	0	0	110.5	A46 A47 I48 T52 I53 Q54	A46-I50 VanDerWaalsContact O-CG1 3.26Å; A46-I50 WeakPolarHBondContact O-CG1 3.29Å; A46-I50 PolarHBondContact O-N 2.88Å; A47-I50 PolarHBondContact O-N 3.32Å; I48-I50 PolarHBondContact O-N 2.88Å; I50-T52 VanDerWaalsContact C-N 3.35Å; I50-T52 PolarHBondContact O-N 2.89Å; I50-I53 PolarHBondContact O-N 3.45Å; I50-Q54 HydrophobicContact CG2-CG 4.23Å; I50-Q54 VanDerWaalsContact O-CG 3.3Å; I50-Q54 WeakPolarHBondContact O-CG 3.14Å; I50-Q54 PolarHBondContact O-N 2.97Å
51	G	98.3	Very high	96.9	Very high	41 Å²	41	87.6 Å²	87.6	42%	0.423	49%	0.494	S	S	.	.	H	α-helix	trans	-57.4	-45.3	177.3	0	0	0	0	0	112.8	A47 I48 F49 Q54 A55	A47-G51 PolarHBondContact O-N 2.85Å; I48-G51 PolarHBondContact O-N 2.89Å; F49-G51 VanDerWaalsContact C-N 3.32Å; F49-G51 PolarHBondContact O-N 3.4Å; G51-Q54 PolarHBondContact O-N 2.03Å; G51-A55 PolarHBondContact O-N 2.9Å
52	T	97.9	Very high	96.5	Very high	81 Å²	81	88 Å²	88	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-66	-38.1	177.6	59.7	0	0	0	0	112.9	I48 F49 I50 L56	I48-T52 HydrophobicContact CG2-CG2 4.41Å; I48-T52 WeakPolarHBondContact O-CG2 3.32Å; I48-T52 PolarHBondContact O-N 3.41Å; I48-T52 PolarHBondContact O-OG1 3.48Å; F49-T52 PolarHBondContact O-N 3.48Å; F49-T52 PolarHBondContact O-OG1 3.31Å; I50-T52 VanDerWaalsContact C-N 3.35Å; I50-T52 PolarHBondContact O-N 2.89Å; T52-L56 PolarHBondContact O-N 3.19Å
53	I	98	Very high	96.1	Very high	63 Å²	63	83.1 Å²	83.1	32%	0.323	48%	0.479	S	S	.	.	H	α-helix	trans	-67.8	-40.6	175.2	-68.7	-65.2	0	0	0	110.9	F49 I50 L56 L57	F49-I53 HydrophobicContact CD1-CG1 4.41Å; F49-I53 HydrophobicContact CD2-CG1 4.38Å; F49-I53 HydrophobicContact CE1-CG1 4Å; F49-I53 HydrophobicContact CE2-CD1 4.13Å; F49-I53 HydrophobicContact CE2-CG1 3.96Å; F49-I53 HydrophobicContact CZ-CD1 4.01Å; F49-I53 HydrophobicContact CZ-CG1 3.76Å; F49-I53 WeakPolarHBondContact O-CG1 3.39Å; F49-I53 PolarHBondContact O-N 3.19Å; I50-I53 PolarHBondContact O-N 3.45Å; I53-L56 WeakPolarHBondContact O-CB 3.36Å; I53-L56 PolarHBondContact O-N 3.14Å; I53-L57 HydrophobicContact CG2-CD1 4.06Å; I53-L57 HydrophobicContact CG2-CG 4.31Å; I53-L57 WeakPolarHBondContact O-CG 3.06Å; I53-L57 PolarHBondContact O-N 2.98Å
54	Q	97.1	Very high	95.7	Very high	105 Å²	105	85.4 Å²	85.4	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-44.1	176.4	-71.6	-61.9	-27.2	0	0	111.6	I50 G51 L56 L57 L58	I50-Q54 HydrophobicContact CG2-CG 4.23Å; I50-Q54 VanDerWaalsContact O-CG 3.3Å; I50-Q54 WeakPolarHBondContact O-CG 3.14Å; I50-Q54 PolarHBondContact O-N 2.97Å; G51-Q54 PolarHBondContact O-N 2.03Å; Q54-L56 VanDerWaalsContact C-N 3.3Å; Q54-L56 PolarHBondContact O-N 2.91Å; Q54-L57 PolarHBondContact O-N 2.94Å; Q54-L58 WeakPolarHBondContact O-CG 3.28Å; Q54-L58 PolarHBondContact O-N 2.83Å
55	A	97.4	Very high	95.4	Very high	58 Å²	58	84.7 Å²	84.7	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-57.5	-43.8	173.8	0	0	0	0	0	111.6	G51 L58 T59	G51-A55 PolarHBondContact O-N 2.9Å; A55-L58 PolarHBondContact O-N 2.97Å; A55-T59 WeakPolarHBondContact O-CG2 3.48Å
56	L	96.1	Very high	95	Very high	93 Å²	93	85 Å²	85	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-60.8	-47.1	174.2	175.3	65.7	0	0	0	112.2	T52 I53 Q54 L58 T59 I60	T52-L56 PolarHBondContact O-N 3.19Å; I53-L56 WeakPolarHBondContact O-CB 3.36Å; I53-L56 PolarHBondContact O-N 3.14Å; Q54-L56 VanDerWaalsContact C-N 3.3Å; Q54-L56 PolarHBondContact O-N 2.91Å; L56-L58 PolarHBondContact O-N 2.94Å; L56-T59 WeakPolarHBondContact O-CB 3.05Å; L56-T59 PolarHBondContact O-N 3.26Å; L56-T59 PolarHBondContact O-OG1 2.62Å; L56-I60 HydrophobicContact CG-CD1 4.4Å
57	L	95.8	Very high	94.7	Very high	94 Å²	94	90 Å²	90	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-32.4	-179.4	-71.7	174.5	0	0	0	112.6	I53 Q54 T59 I60	I53-L57 HydrophobicContact CG2-CD1 4.06Å; I53-L57 HydrophobicContact CG2-CG 4.31Å; I53-L57 WeakPolarHBondContact O-CG 3.06Å; I53-L57 PolarHBondContact O-N 2.98Å; Q54-L57 PolarHBondContact O-N 2.94Å; L57-T59 PolarHBondContact O-N 3.22Å; L57-I60 PolarHBondContact O-N 2.92Å
58	L	94.4	Very high	94.4	Very high	153 Å²	153	89.4 Å²	89.4	80%	0.801	48%	0.479	S	S	*	.	H	α-helix	trans	-67.8	-18.8	174	-67.8	173.3	0	0	0	113.7	Q54 A55 L56	Q54-L58 WeakPolarHBondContact O-CG 3.28Å; Q54-L58 PolarHBondContact O-N 2.83Å; A55-L58 PolarHBondContact O-N 2.97Å; L56-L58 PolarHBondContact O-N 2.94Å
59	T	94.4	Very high	93.9	Very high	103 Å²	103	88.5 Å²	88.5	63%	0.632	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-9.1	176.3	70.4	0	0	0	0	113.7	A55 L56 L57	A55-T59 WeakPolarHBondContact O-CG2 3.48Å; L56-T59 WeakPolarHBondContact O-CB 3.05Å; L56-T59 PolarHBondContact O-N 3.26Å; L56-T59 PolarHBondContact O-OG1 2.62Å; L57-T59 PolarHBondContact O-N 3.22Å
60	I	93.1	Very high	93.5	Very high	78 Å²	78	92.9 Å²	92.9	40%	0.4	49%	0.488	S	S	.	.	S	Bend	trans	-99.2	128.9	-174.8	-60.4	172.1	0	0	0	109.5	L56 L57	L56-I60 HydrophobicContact CG-CD1 4.4Å; L57-I60 PolarHBondContact O-N 2.92Å
61	D	89.6	Confident	92.9	Very high	81 Å²	81	92.1 Å²	92.1	43%	0.433	49%	0.487	S	S	.	.			trans	-73.1	134	172.5	-174.9	-77.8	0	0	0	111	F63 K64	D61-F63 VanDerWaalsContact C-N 3.32Å; D61-F63 PolarHBondContact O-N 3.4Å; D61-F63 WeakPolarHBondContact OD1-CA 3.4Å; D61-F63 WeakPolarHBondContact OD1-CB 3.26Å; D61-F63 PolarHBondContact OD1-N 2.89Å; D61-K64 PolarHBondContact OD1-N 3.26Å
62	E	88.8	Confident	92.1	Very high	105 Å²	105	92.5 Å²	92.5	49%	0.491	49%	0.487	S	S	.	.	S	Bend	trans	-73.6	-20.6	-176.1	-70.7	-149.8	119.2	0	0	114.4	R248	E62-R248 VanDerWaalsContact CG-NH1 3.29Å; E62-R248 WeakPolarHBondContact O-CD 3.32Å; E62-R248 IonicContact OE1-CZ 3.95Å; E62-R248 IonicContact OE1-NH1 3.09Å; E62-R248 PolarHBondContact OE1-NH1 3.44Å; E62-R248 IonicContact OE1-NH2 3.79Å; E62-R248 PolarHBondContact OE1-NH2 3.4Å; E62-R248 IonicContact OE2-NH1 3.54Å
63	F	89.8	Confident	91.6	Very high	35 Å²	35	89.9 Å²	89.9	15%	0.154	47%	0.471	C	S	.	.	S	Bend	trans	-106.2	-25.6	-171.1	-53.3	-64.7	0	0	0	112.4	D61 L138 K140 R248 L249	D61-F63 VanDerWaalsContact C-N 3.32Å; D61-F63 PolarHBondContact O-N 3.4Å; D61-F63 WeakPolarHBondContact OD1-CA 3.4Å; D61-F63 WeakPolarHBondContact OD1-CB 3.26Å; D61-F63 PolarHBondContact OD1-N 2.89Å; F63-L138 HydrophobicContact CB-CB 4.42Å; F63-K140 HydrophobicContact CE1-CG 4.5Å; F63-K140 HydrophobicContact CE2-CG 3.64Å; F63-K140 HydrophobicContact CZ-CB 4.44Å; F63-K140 HydrophobicContact CZ-CD 4.45Å; F63-K140 HydrophobicContact CZ-CG 3.42Å; F63-K140 VanDerWaalsContact CZ-CG 3.42Å; F63-R248 HydrophobicContact CD1-CB 4.33Å; F63-L249 HydrophobicContact CB-CD1 4.05Å; F63-L249 HydrophobicContact CD1-CD1 3.96Å; F63-L249 HydrophobicContact CD1-CD2 3.55Å; F63-L249 HydrophobicContact CD1-CG 3.65Å; F63-L249 HydrophobicContact CE1-CD2 3.74Å; F63-L249 HydrophobicContact CE1-CG 4.34Å; F63-L249 HydrophobicContact CG-CD1 4.22Å; F63-L249 HydrophobicContact CG-CD2 4.47Å; F63-L249 HydrophobicContact CG-CG 4.4Å
64	K	89.8	Confident	91.4	Very high	89 Å²	89	86.9 Å²	86.9	39%	0.387	46%	0.456	S	S	.	.	S	Bend	trans	-136.3	129.7	178.7	-170.3	-173.9	172.8	-172.1	0	112	D61 L138	D61-K64 PolarHBondContact OD1-N 3.26Å; K64-L138 HydrophobicContact CB-CD1 4.17Å; K64-L138 HydrophobicContact CD-CD1 4.07Å; K64-L138 HydrophobicContact CG-CD1 4.18Å
65	P	92.4	Very high	91.3	Very high	58 Å²	58	82.2 Å²	82.2	38%	0.377	44%	0.436	S	S	.	.			trans	-65.1	138	171.5	28.5	-34.8	0	0	0	111.3	H67 Q68	P65-H67 VanDerWaalsContact C-N 3.29Å; P65-H67 PolarHBondContact O-N 3.31Å; P65-Q68 HydrophobicContact CB-CG 4.46Å; P65-Q68 HydrophobicContact CG-CG 3.66Å
66	T	91.1	Very high	91.3	Very high	93 Å²	93	79.5 Å²	79.5	57%	0.571	41%	0.414	S	S	*	.	S	Bend	trans	-60.1	-38.1	-180	-45.8	0	0	0	0	112.6
67	H	91.9	Very high	91.2	Very high	151 Å²	151	75.7 Å²	75.7	70%	0.699	40%	0.395	S	S	*	.			trans	-124.4	131.2	-178.5	-62.6	-64.5	0	0	0	110.7	P65	P65-H67 VanDerWaalsContact C-N 3.29Å; P65-H67 PolarHBondContact O-N 3.31Å
68	Q	90.6	Very high	91.2	Very high	49 Å²	49	71.6 Å²	71.6	23%	0.229	37%	0.373	C	S	.	.			trans	-129	2.5	-179.3	-65.9	-174.9	-57	0	0	113.2	P65 R70 V71 A72 V182	P65-Q68 HydrophobicContact CB-CG 4.46Å; P65-Q68 HydrophobicContact CG-CG 3.66Å; Q68-R70 PolarHBondContact O-N 3.22Å; Q68-V71 HydrophobicContact CB-CG2 4.1Å; Q68-V71 VanDerWaalsContact O-CG2 3.22Å; Q68-V71 WeakPolarHBondContact O-CG2 3.46Å; Q68-V71 PolarHBondContact O-N 2.66Å; Q68-V71 VanDerWaalsContact O-N 3.16Å; Q68-A72 PolarHBondContact O-N 3.48Å; Q68-A72 VanDerWaalsContact O-N 3.16Å; Q68-V182 PolarHBondContact NE2-O 3.45Å
69	D	89	Confident	91.2	Very high	100 Å²	100	64.7 Å²	64.7	54%	0.535	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.3	178.9	58.8	-59.2	0	0	0	113.2
70	R	88.6	Confident	91.2	Very high	221 Å²	221	59.8 Å²	59.8	83%	0.834	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-9.5	180	-57.9	-58.3	178.1	152.8	4.4	114.8	Q68	Q68-R70 PolarHBondContact O-N 3.22Å
71	V	86.9	Confident	90.9	Very high	83 Å²	83	64.5 Å²	64.5	50%	0.503	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-15.2	-177.7	-63	0	0	0	0	113	Q68 P73 I181	Q68-V71 HydrophobicContact CB-CG2 4.1Å; Q68-V71 VanDerWaalsContact O-CG2 3.22Å; Q68-V71 WeakPolarHBondContact O-CG2 3.46Å; Q68-V71 PolarHBondContact O-N 2.66Å; Q68-V71 VanDerWaalsContact O-N 3.16Å; V71-P73 CarbonylContact O-C 3.4Å; V71-P73 VanDerWaalsContact O-O 3.1Å; V71-I181 HydrophobicContact CG2-CG2 4.33Å; V71-I181 WeakPolarHBondContact O-CD1 3.34Å
72	A	81.6	Confident	90.5	Very high	50 Å²	50	61.8 Å²	61.8	41%	0.413	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-93.7	134.6	169.2	0	0	0	0	0	108.7	Q68	Q68-A72 PolarHBondContact O-N 3.48Å; Q68-A72 VanDerWaalsContact O-N 3.16Å
73	P	88.1	Confident	89.7	Confident	25 Å²	25	64 Å²	64	16%	0.162	32%	0.323	C	S	.	.	S	Bend	cis	-75.3	158.5	-0.3	-19	34.4	0	0	0	115.1	V71 D283 Q291	V71-P73 CarbonylContact O-C 3.4Å; V71-P73 VanDerWaalsContact O-O 3.1Å; P73-D283 HydrophobicContact CB-CB 4.44Å; P73-D283 HydrophobicContact CG-CB 3.66Å; P73-D283 WeakPolarHBondContact CG-OD2 3.37Å; P73-Q291 HydrophobicContact CB-CG 4.38Å; P73-Q291 VanDerWaalsContact CG-NE2 3.35Å
74	P	93.9	Very high	89.4	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66	142	-177.8	29.6	-37.2	0	0	0	112.7	L178 N179 I181 F184 I282 G292	P74-L178 HydrophobicContact CB-CD1 4.03Å; P74-L178 HydrophobicContact CB-CD2 4.39Å; P74-L178 HydrophobicContact CB-CG 4Å; P74-L178 HydrophobicContact CG-CD1 4.07Å; P74-L178 HydrophobicContact CG-CD2 4.21Å; P74-L178 HydrophobicContact CG-CG 4.25Å; P74-N179 HydrophobicContact CB-CB 4.5Å; P74-I181 HydrophobicContact CB-CD1 3.72Å; P74-I181 HydrophobicContact CG-CD1 4.44Å; P74-F184 HydrophobicContact CB-CE1 4.48Å; P74-F184 HydrophobicContact CG-CD1 4.5Å; P74-F184 HydrophobicContact CG-CE1 3.69Å; P74-F184 HydrophobicContact CG-CE2 4.35Å; P74-F184 HydrophobicContact CG-CZ 3.61Å; P74-I282 HydrophobicContact CG-CD1 3.43Å; P74-I282 VanDerWaalsContact CG-CD1 3.43Å; P74-G292 PolarHBondContact O-N 2.94Å
75	G	94.8	Very high	89.3	Confident	8 Å²	8	67.8 Å²	67.8	8%	0.082	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-78.2	157.4	168.4	0	0	0	0	0	113.3	N179 Y290	G75-N179 WeakPolarHBondContact O-CB 3.31Å; G75-N179 PolarHBondContact O-N 3Å; G75-Y290 CarbonylContact C-O 3.46Å; G75-Y290 WeakPolarHBondContact CA-O 3.28Å
76	L	95.7	Very high	89.3	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127	172.4	-167.1	65	0	0	0	108.7	V176 L178 I210 F237 V277 Y290 F294	L76-V176 HydrophobicContact CD1-CG1 3.48Å; L76-V176 VanDerWaalsContact CD1-CG1 3.48Å; L76-V176 HydrophobicContact CD2-CG1 4.14Å; L76-V176 HydrophobicContact CG-CG1 3.67Å; L76-L178 HydrophobicContact CD1-CD1 4.21Å; L76-I210 HydrophobicContact CD1-CD1 4.41Å; L76-I210 HydrophobicContact CD2-CD1 3.84Å; L76-F237 HydrophobicContact CD1-CE2 3.94Å; L76-F237 HydrophobicContact CD1-CZ 4.04Å; L76-V277 HydrophobicContact CD1-CB 4.46Å; L76-V277 HydrophobicContact CD1-CG2 3.65Å; L76-V277 HydrophobicContact CD2-CB 4.36Å; L76-V277 HydrophobicContact CD2-CG2 3.95Å; L76-V277 HydrophobicContact CG-CG2 4.42Å; L76-Y290 PolarHBondContact N-O 3.41Å; L76-F294 HydrophobicContact CB-CD1 4.32Å; L76-F294 HydrophobicContact CD2-CD1 3.59Å; L76-F294 HydrophobicContact CD2-CE1 3.83Å; L76-F294 HydrophobicContact CG-CD1 3.73Å; L76-F294 HydrophobicContact CG-CE1 4.12Å
77	S	94.4	Very high	89.5	Confident	13 Å²	13	63.9 Å²	63.9	9%	0.091	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.1	-178.7	61.8	0	0	0	0	111	V176 K177	S77-V176 WeakPolarHBondContact O-CA 3.47Å; S77-V176 WeakPolarHBondContact O-CG1 3.17Å; S77-K177 PolarHBondContact N-O 3.05Å; S77-K177 PolarHBondContact O-N 2.03Å; S77-K177 WeakPolarHBondContact OG-CE 3.35Å; S77-K177 WeakPolarHBondContact OG-CG 3.26Å; S77-K177 PolarHBondContact OG-O 3.31Å
78	H	95.4	Very high	89.7	Confident	8 Å²	8	59 Å²	59	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	158.9	178	63.2	-88.5	0	0	0	111.4	P80 R81 I175 V176 F294	H78-P80 PolarHBondContact CD2-O 3.23Å; H78-P80 VanDerWaalsContact CD2-O 3.26Å; H78-R81 WeakPolarHBondContact O-CG 3.26Å; H78-I175 CarbonylContact C-O 3.59Å; H78-I175 VanDerWaalsContact CA-O 3.24Å; H78-I175 WeakPolarHBondContact CA-O 3.47Å; H78-V176 HydrophobicContact CB-CG2 4.1Å; H78-F294 HydrophobicContact CB-CE1 4.29Å; H78-F294 HydrophobicContact CB-CE2 4.32Å; H78-F294 HydrophobicContact CB-CZ 4.11Å; H78-F294 AromaticContact CE1-CD2 3.59Å; H78-F294 AromaticContact CG-CE2 3.98Å; H78-F294 AromaticContact ND1-CD2 3.18Å; H78-F294 WeakPolarHBondContact ND1-CD2 3.36Å; H78-F294 AromaticContact ND1-CE2 3.55Å; H78-F294 AromaticContact ND1-CG 3.44Å; H78-F294 WeakPolarHBondContact ND1-CG 3.24Å
79	T	95.6	Very high	89.9	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.049	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.2	168.7	-53.2	0	0	0	0	106.8	M104 F107 I175	T79-M104 HydrophobicContact CG2-CG 4.34Å; T79-M104 HydrophobicContact CG2-SD 3.63Å; T79-F107 HydrophobicContact CG2-CB 3.78Å; T79-F107 HydrophobicContact CG2-CD1 4.29Å; T79-F107 HydrophobicContact CG2-CG 4.04Å; T79-I175 PolarHBondContact N-O 3.29Å; T79-I175 PolarHBondContact O-N 3.49Å
80	P	94.3	Very high	90.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.	S	Bend	cis	-66.5	147.6	-0.6	32.7	-39.5	0	0	0	112.1	H78 I87 Y100 M104 F167 L174	H78-P80 PolarHBondContact CD2-O 3.23Å; H78-P80 VanDerWaalsContact CD2-O 3.26Å; P80-I87 HydrophobicContact CG-CD1 4.08Å; P80-Y100 HydrophobicContact CB-CD1 3.86Å; P80-Y100 HydrophobicContact CB-CG 4.36Å; P80-Y100 HydrophobicContact CG-CD1 3.89Å; P80-Y100 HydrophobicContact CG-CG 4.19Å; P80-M104 HydrophobicContact CB-CG 4.34Å; P80-M104 VanDerWaalsContact CD-SD 3.51Å; P80-M104 VanDerWaalsContact N-SD 3.4Å; P80-F167 HydrophobicContact CG-CZ 4.14Å; P80-L174 HydrophobicContact CG-CD2 4.41Å
81	R	85.7	Confident	90.4	Very high	177 Å²	177	44.6 Å²	44.6	67%	0.668	24%	0.235	S	C	*	.			trans	-85.9	138.9	168.2	-67.3	-163.5	-169.3	-167.6	2.9	109.2	H78	H78-R81 WeakPolarHBondContact O-CG 3.26Å
82	S	81.2	Confident	90.7	Very high	24 Å²	24	47.9 Å²	47.9	17%	0.168	24%	0.242	C	C	.	.			trans	-128.2	154	173.1	63	0	0	0	0	111.4	K84 S85 E86	S82-K84 PolarHBondContact O-N 3.22Å; S82-S85 PolarHBondContact O-N 2.75Å; S82-E86 WeakPolarHBondContact CB-O 3.39Å; S82-E86 VanDerWaalsContact OG-C 3.24Å; S82-E86 PolarHBondContact OG-N 3.39Å; S82-E86 PolarHBondContact OG-O 3.16Å
83	D	73.9	Confident	91.3	Very high	152 Å²	152	49 Å²	49	81%	0.813	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-63.7	129.6	174.3	-61.7	-37.5	0	0	0	108.8	S85	D83-S85 PolarHBondContact O-N 2.97Å
84	K	83	Confident	91.6	Very high	185 Å²	185	50.5 Å²	50.5	80%	0.804	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	61.9	19.1	-177.1	-50	174.4	-177.6	172.1	0	115.3	S82 E86	S82-K84 PolarHBondContact O-N 3.22Å; K84-E86 PolarHBondContact O-N 3.36Å
85	S	87.6	Confident	91.6	Very high	18 Å²	18	55.9 Å²	55.9	13%	0.126	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	61.7	29.7	179.4	-39.6	0	0	0	0	113.6	S82 D83 Y290 D295 V296 K297	S82-S85 PolarHBondContact O-N 2.75Å; D83-S85 PolarHBondContact O-N 2.97Å; S85-Y290 PolarHBondContact OG-OH 3.26Å; S85-D295 WeakPolarHBondContact CB-O 3.48Å; S85-V296 WeakPolarHBondContact O-CA 3.26Å; S85-K297 PolarHBondContact O-N 3Å
86	E	92.8	Very high	91.6	Very high	68 Å²	68	56.8 Å²	56.8	32%	0.318	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.9	-178.6	-171.7	-175.2	148.3	0	0	111.1	S82 K84 T88 K297	S82-E86 WeakPolarHBondContact CB-O 3.39Å; S82-E86 VanDerWaalsContact OG-C 3.24Å; S82-E86 PolarHBondContact OG-N 3.39Å; S82-E86 PolarHBondContact OG-O 3.16Å; K84-E86 PolarHBondContact O-N 3.36Å; E86-T88 PolarHBondContact OE1-OG1 3.03Å; E86-K297 CarbonylContact C-O 3.48Å; E86-K297 HydrophobicContact CB-CB 4.42Å; E86-K297 HydrophobicContact CG-CB 4.25Å
87	I	94.9	Very high	91.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	96.9	178.7	-61.4	175.1	0	0	0	107.4	P80 F89 Y100 F167 L174 V296 K297 F298 T299	P80-I87 HydrophobicContact CG-CD1 4.08Å; I87-F89 HydrophobicContact CG2-CD1 4.03Å; I87-F89 HydrophobicContact CG2-CE1 4.28Å; I87-Y100 HydrophobicContact CG1-CE1 4.36Å; I87-Y100 HydrophobicContact CG2-CD2 4.24Å; I87-Y100 HydrophobicContact CG2-CE1 4.16Å; I87-Y100 HydrophobicContact CG2-CE2 3.92Å; I87-F167 HydrophobicContact CG2-CE1 3.92Å; I87-L174 HydrophobicContact CD1-CD2 3.52Å; I87-V296 HydrophobicContact CD1-CG2 3.82Å; I87-V296 HydrophobicContact CG1-CG2 4.19Å; I87-K297 PolarHBondContact N-O 3.23Å; I87-F298 HydrophobicContact CB-CD1 3.76Å; I87-F298 HydrophobicContact CB-CE1 3.74Å; I87-F298 HydrophobicContact CD1-CE1 3.8Å; I87-F298 HydrophobicContact CD1-CZ 4.12Å; I87-F298 HydrophobicContact CG1-CE1 4.35Å; I87-F298 HydrophobicContact CG2-CD1 3.9Å; I87-F298 HydrophobicContact CG2-CE1 3.74Å; I87-F298 WeakPolarHBondContact O-CA 3.18Å; I87-T299 PolarHBondContact O-N 3.37Å
88	T	94.8	Very high	91.6	Very high	50 Å²	50	63.4 Å²	63.4	31%	0.307	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.6	179.2	-57.3	0	0	0	0	108.9	E86 Y100 T299	E86-T88 PolarHBondContact OE1-OG1 3.03Å; T88-Y100 PolarHBondContact N-OH 3.15Å; T88-Y100 WeakPolarHBondContact O-CE2 3.06Å; T88-Y100 PolarHBondContact O-OH 3.17Å; T88-T299 WeakPolarHBondContact CA-O 3.44Å; T88-T299 HydrophobicContact CG2-CG2 4.17Å
89	F	94.9	Very high	91.5	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	163.4	176.7	67.1	-82.3	0	0	0	111.7	I87 V91 Y97 Y100 F167 P172 T299 V300 T301	I87-F89 HydrophobicContact CG2-CD1 4.03Å; I87-F89 HydrophobicContact CG2-CE1 4.28Å; F89-V91 HydrophobicContact CE2-CG2 4.2Å; F89-Y97 HydrophobicContact CD2-CD1 4.02Å; F89-Y100 HydrophobicContact CB-CE2 4.16Å; F89-F167 AromaticContact CD1-CD1 3.88Å; F89-F167 HydrophobicContact CD1-CD1 3.88Å; F89-F167 HydrophobicContact CD1-CE1 4.04Å; F89-F167 HydrophobicContact CD2-CD1 4.2Å; F89-F167 AromaticContact CE1-CD1 3.72Å; F89-F167 HydrophobicContact CE1-CD1 3.72Å; F89-F167 AromaticContact CE1-CE1 3.91Å; F89-F167 HydrophobicContact CE1-CE1 3.91Å; F89-F167 HydrophobicContact CE2-CB 4.44Å; F89-F167 HydrophobicContact CE2-CD1 4.06Å; F89-F167 VanDerWaalsContact CE2-O 3.31Å; F89-F167 WeakPolarHBondContact CE2-O 3.45Å; F89-F167 HydrophobicContact CG-CD1 4.11Å; F89-F167 AromaticContact CZ-CD1 3.82Å; F89-F167 HydrophobicContact CZ-CD1 3.82Å; F89-F167 HydrophobicContact CZ-CE1 4.42Å; F89-P172 HydrophobicContact CE1-CB 4.08Å; F89-P172 HydrophobicContact CE1-CG 4.09Å; F89-P172 HydrophobicContact CZ-CB 4.07Å; F89-P172 HydrophobicContact CZ-CG 4.06Å; F89-T299 PolarHBondContact N-O 2.93Å; F89-T299 VanDerWaalsContact N-O 3.12Å; F89-V300 HydrophobicContact CD1-CG2 4.5Å; F89-V300 HydrophobicContact CE1-CG1 4.47Å; F89-V300 HydrophobicContact CE1-CG2 3.71Å; F89-V300 HydrophobicContact CE2-CG1 3.87Å; F89-V300 HydrophobicContact CZ-CB 4.38Å; F89-V300 HydrophobicContact CZ-CG1 3.84Å; F89-V300 HydrophobicContact CZ-CG2 3.73Å; F89-T301 PolarHBondContact O-N 3.21Å; F89-T301 PolarHBondContact O-OG1 2.9Å
90	N	95.4	Very high	91.5	Very high	26 Å²	26	69.3 Å²	69.3	14%	0.139	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.6	174.8	-174.9	-24.8	0	0	0	108.8	K92 D93 S96 T301 K303	N90-K92 PolarHBondContact O-N 2.84Å; N90-K92 PolarHBondContact OD1-N 3.49Å; N90-D93 HydrophobicContact CB-CB 4.09Å; N90-D93 PolarHBondContact O-N 2.04Å; N90-D93 VanDerWaalsContact O-O 3.09Å; N90-S96 PolarHBondContact N-OG 2.73Å; N90-S96 PolarHBondContact O-OG 2.88Å; N90-T301 WeakPolarHBondContact CA-O 3.26Å; N90-T301 WeakPolarHBondContact CA-OG1 3.3Å; N90-T301 VanDerWaalsContact CB-OG1 3.26Å; N90-T301 WeakPolarHBondContact CB-OG1 3.24Å; N90-T301 PolarHBondContact OD1-O 2.86Å; N90-K303 PolarHBondContact ND2-O 2.97Å
91	V	93.8	Very high	91.5	Very high	37 Å²	37	70.2 Å²	70.2	22%	0.224	35%	0.345	C	S	.	.	S	Bend	trans	-64.1	-29.7	-178	-175	0	0	0	0	111.5	F89 S168 V300 T301	F89-V91 HydrophobicContact CE2-CG2 4.2Å; V91-S168 VanDerWaalsContact CG1-O 3.26Å; V91-S168 WeakPolarHBondContact CG1-O 3.14Å; V91-V300 HydrophobicContact CG2-CG1 3.49Å; V91-V300 VanDerWaalsContact CG2-CG1 3.49Å; V91-T301 PolarHBondContact N-O 3.35Å
92	K	92.9	Very high	92	Very high	152 Å²	152	64.4 Å²	64.4	66%	0.661	34%	0.335	S	S	*	.	S	Bend	trans	-83.7	-22.9	-179.6	-66.8	179	177.4	163.8	0	113.8	N90 S302	N90-K92 PolarHBondContact O-N 2.84Å; N90-K92 PolarHBondContact OD1-N 3.49Å; K92-S302 WeakPolarHBondContact CD-O 3.24Å; K92-S302 WeakPolarHBondContact CE-O 3.37Å; K92-S302 PolarHBondContact NZ-O 3.4Å
93	D	94.9	Very high	92.7	Very high	74 Å²	74	65 Å²	65	40%	0.396	34%	0.34	S	S	.	.			trans	-103.1	106	-179.3	174.1	21.8	0	0	0	110.6	N90 D95 S96 Y97	N90-D93 HydrophobicContact CB-CB 4.09Å; N90-D93 PolarHBondContact O-N 2.04Å; N90-D93 VanDerWaalsContact O-O 3.09Å; D93-D95 VanDerWaalsContact C-N 3.25Å; D93-D95 PolarHBondContact O-N 3.45Å; D93-D95 PolarHBondContact OD1-N 3.01Å; D93-S96 WeakPolarHBondContact O-CB 3.04Å; D93-S96 PolarHBondContact O-N 2.99Å; D93-S96 PolarHBondContact O-OG 2.77Å; D93-S96 WeakPolarHBondContact OD2-CB 3.45Å; D93-S96 PolarHBondContact OD2-N 2.83Å; D93-Y97 WeakPolarHBondContact O-CD1 3.31Å; D93-Y97 WeakPolarHBondContact O-CE1 3.14Å
94	A	94.1	Very high	93.7	Very high	56 Å²	56	57.8 Å²	57.8	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-64.4	-27.7	-178.7	0	0	0	0	0	113.7	S96 K98	A94-S96 VanDerWaalsContact C-N 3.31Å; A94-K98 PolarHBondContact O-N 3.3Å
95	D	94.4	Very high	94.3	Very high	112 Å²	112	53.3 Å²	53.3	60%	0.599	28%	0.281	S	S	*	.	H	α-helix	trans	-73.3	-28.3	179.7	-75.7	-39.5	0	0	0	111.5	D93 Y97 K98	D93-D95 VanDerWaalsContact C-N 3.25Å; D93-D95 PolarHBondContact O-N 3.45Å; D93-D95 PolarHBondContact OD1-N 3.01Å; D95-Y97 VanDerWaalsContact C-N 3.29Å; D95-Y97 PolarHBondContact O-N 3.01Å; D95-K98 WeakPolarHBondContact O-CB 3.43Å; D95-K98 PolarHBondContact O-N 2.83Å; D95-K98 IonicContact OD1-NZ 3.05Å
96	S	94.4	Very high	94.7	Very high	27 Å²	27	59.1 Å²	59.1	19%	0.189	31%	0.307	C	S	.	.	H	α-helix	trans	-58.5	-36.8	179.9	76.4	0	0	0	0	113.7	N90 D93 A94	N90-S96 PolarHBondContact N-OG 2.73Å; N90-S96 PolarHBondContact O-OG 2.88Å; D93-S96 WeakPolarHBondContact O-CB 3.04Å; D93-S96 PolarHBondContact O-N 2.99Å; D93-S96 PolarHBondContact O-OG 2.77Å; D93-S96 WeakPolarHBondContact OD2-CB 3.45Å; D93-S96 PolarHBondContact OD2-N 2.83Å; A94-S96 VanDerWaalsContact C-N 3.31Å
97	Y	94.1	Very high	94.8	Very high	23 Å²	23	57.6 Å²	57.6	9%	0.09	30%	0.299	C	S	.	.	H	α-helix	trans	-106.9	-0.8	-177.8	56.9	-104.5	0	0	0	114.5	F89 D93 D95 K99 Y100 I101 F167	F89-Y97 HydrophobicContact CD2-CD1 4.02Å; D93-Y97 WeakPolarHBondContact O-CD1 3.31Å; D93-Y97 WeakPolarHBondContact O-CE1 3.14Å; D95-Y97 VanDerWaalsContact C-N 3.29Å; D95-Y97 PolarHBondContact O-N 3.01Å; Y97-K99 VanDerWaalsContact C-N 3.27Å; Y97-K99 PolarHBondContact O-N 3.2Å; Y97-Y100 WeakPolarHBondContact O-CB 3.42Å; Y97-Y100 PolarHBondContact O-N 2.78Å; Y97-I101 HydrophobicContact CD2-CD1 3.36Å; Y97-I101 HydrophobicContact CD2-CG1 4.11Å; Y97-I101 HydrophobicContact CE2-CD1 3.54Å; Y97-I101 PolarHBondContact O-N 2.79Å; Y97-I101 VanDerWaalsContact O-N 3.12Å; Y97-F167 HydrophobicContact CD1-CB 4.36Å; Y97-F167 HydrophobicContact CD2-CB 3.77Å; Y97-F167 HydrophobicContact CE2-CB 4.36Å; Y97-F167 HydrophobicContact CG-CB 3.77Å; Y97-F167 HydrophobicContact CG-CG 4.47Å
98	K	94.8	Very high	94.8	Very high	131 Å²	131	57.6 Å²	57.6	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-56.3	-39	179.3	-172.2	176.6	-175.6	174.3	0	113.1	A94 D95 Y100 I101 A102	A94-K98 PolarHBondContact O-N 3.3Å; D95-K98 WeakPolarHBondContact O-CB 3.43Å; D95-K98 PolarHBondContact O-N 2.83Å; D95-K98 IonicContact OD1-NZ 3.05Å; K98-Y100 VanDerWaalsContact C-N 3.31Å; K98-Y100 PolarHBondContact O-N 2.85Å; K98-I101 PolarHBondContact O-N 2.76Å; K98-A102 WeakPolarHBondContact O-CB 3.49Å; K98-A102 PolarHBondContact O-N 2.81Å
99	K	94.4	Very high	94.8	Very high	132 Å²	132	60 Å²	60	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-61.6	-37.7	176.8	67.8	-178.3	-177.5	177.5	0	112.7	Y97 S103	Y97-K99 VanDerWaalsContact C-N 3.27Å; Y97-K99 PolarHBondContact O-N 3.2Å; K99-S103 PolarHBondContact O-N 2.79Å; K99-S103 VanDerWaalsContact O-N 3.12Å
100	Y	95.1	Very high	94.6	Very high	7 Å²	7	66.9 Å²	66.9	3%	0.027	34%	0.337	C	S	.	.	H	α-helix	trans	-71.5	-44.9	179.5	-57.4	-52.9	0	0	0	110.4	P80 I87 T88 F89 Y97 K98 A102 S103 M104 F167	P80-Y100 HydrophobicContact CB-CD1 3.86Å; P80-Y100 HydrophobicContact CB-CG 4.36Å; P80-Y100 HydrophobicContact CG-CD1 3.89Å; P80-Y100 HydrophobicContact CG-CG 4.19Å; I87-Y100 HydrophobicContact CG1-CE1 4.36Å; I87-Y100 HydrophobicContact CG2-CD2 4.24Å; I87-Y100 HydrophobicContact CG2-CE1 4.16Å; I87-Y100 HydrophobicContact CG2-CE2 3.92Å; T88-Y100 PolarHBondContact N-OH 3.15Å; T88-Y100 WeakPolarHBondContact O-CE2 3.06Å; T88-Y100 PolarHBondContact O-OH 3.17Å; F89-Y100 HydrophobicContact CB-CE2 4.16Å; Y97-Y100 WeakPolarHBondContact O-CB 3.42Å; Y97-Y100 PolarHBondContact O-N 2.78Å; K98-Y100 VanDerWaalsContact C-N 3.31Å; K98-Y100 PolarHBondContact O-N 2.85Å; Y100-A102 VanDerWaalsContact C-N 3.35Å; Y100-A102 PolarHBondContact O-N 2.85Å; Y100-S103 PolarHBondContact O-N 3.11Å; Y100-M104 WeakPolarHBondContact O-CG 3.38Å; Y100-M104 PolarHBondContact O-N 3.18Å; Y100-F167 HydrophobicContact CD2-CD1 4.14Å; Y100-F167 AromaticContact CD2-CE1 3.65Å; Y100-F167 HydrophobicContact CD2-CE1 3.65Å; Y100-F167 HydrophobicContact CD2-CZ 4.32Å; Y100-F167 HydrophobicContact CE2-CE1 4.5Å; Y100-F167 AromaticContact CG-CE1 3.95Å; Y100-F167 HydrophobicContact CG-CE1 3.95Å; Y100-F167 HydrophobicContact CG-CZ 4.15Å
101	I	95.3	Very high	94.6	Very high	19 Å²	19	66 Å²	66	10%	0.097	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-46.9	175.1	-65.6	174	0	0	0	110.7	Y97 K98 S103 M104 K105 D163 T164 F165	Y97-I101 HydrophobicContact CD2-CD1 3.36Å; Y97-I101 HydrophobicContact CD2-CG1 4.11Å; Y97-I101 HydrophobicContact CE2-CD1 3.54Å; Y97-I101 PolarHBondContact O-N 2.79Å; Y97-I101 VanDerWaalsContact O-N 3.12Å; K98-I101 PolarHBondContact O-N 2.76Å; I101-S103 PolarHBondContact O-N 2.7Å; I101-M104 WeakPolarHBondContact O-CB 3.09Å; I101-M104 PolarHBondContact O-N 3.34Å; I101-K105 HydrophobicContact CG2-CD 3.91Å; I101-K105 HydrophobicContact CG2-CG 4.21Å; I101-K105 WeakPolarHBondContact O-CG 3.37Å; I101-K105 PolarHBondContact O-N 3.4Å; I101-D163 WeakPolarHBondContact CG2-O 3.39Å; I101-T164 HydrophobicContact CD1-CG2 4.15Å; I101-F165 HydrophobicContact CG1-CD2 4.48Å; I101-F165 HydrophobicContact CG2-CD2 4.24Å; I101-F165 HydrophobicContact CG2-CE2 4.2Å
102	A	95.3	Very high	94.5	Very high	55 Å²	55	66.1 Å²	66.1	46%	0.455	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-47.5	-180	0	0	0	0	0	111.6	K98 Y100 M104 K105 E106	K98-A102 WeakPolarHBondContact O-CB 3.49Å; K98-A102 PolarHBondContact O-N 2.81Å; Y100-A102 VanDerWaalsContact C-N 3.35Å; Y100-A102 PolarHBondContact O-N 2.85Å; A102-M104 VanDerWaalsContact C-N 3.28Å; A102-M104 PolarHBondContact O-N 3.27Å; A102-K105 PolarHBondContact O-N 2.91Å; A102-E106 WeakPolarHBondContact O-CB 3.47Å; A102-E106 PolarHBondContact O-N 3.46Å
103	S	95.3	Very high	94.4	Very high	38 Å²	38	61.5 Å²	61.5	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-37.4	176.3	-178.5	0	0	0	0	112.7	K99 Y100 I101 F107	K99-S103 PolarHBondContact O-N 2.79Å; K99-S103 VanDerWaalsContact O-N 3.12Å; Y100-S103 PolarHBondContact O-N 3.11Å; I101-S103 PolarHBondContact O-N 2.7Å; S103-F107 VanDerWaalsContact O-CB 3.3Å; S103-F107 WeakPolarHBondContact O-CB 3.35Å; S103-F107 PolarHBondContact O-N 3.25Å
104	M	95.3	Very high	94.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-44.5	177	-69.8	-75.5	-92	0	0	112.3	T79 P80 Y100 I101 A102 F107 L108 F165 C173 I175	T79-M104 HydrophobicContact CG2-CG 4.34Å; T79-M104 HydrophobicContact CG2-SD 3.63Å; P80-M104 HydrophobicContact CB-CG 4.34Å; P80-M104 VanDerWaalsContact CD-SD 3.51Å; P80-M104 VanDerWaalsContact N-SD 3.4Å; Y100-M104 WeakPolarHBondContact O-CG 3.38Å; Y100-M104 PolarHBondContact O-N 3.18Å; I101-M104 WeakPolarHBondContact O-CB 3.09Å; I101-M104 PolarHBondContact O-N 3.34Å; A102-M104 VanDerWaalsContact C-N 3.28Å; A102-M104 PolarHBondContact O-N 3.27Å; M104-F107 PolarHBondContact O-N 3.04Å; M104-L108 WeakPolarHBondContact O-CB 3.31Å; M104-L108 WeakPolarHBondContact O-CG 3.46Å; M104-L108 PolarHBondContact O-N 3.26Å; M104-F165 HydrophobicContact CB-CD1 4.44Å; M104-F165 HydrophobicContact CB-CD2 3.99Å; M104-F165 HydrophobicContact CB-CE1 4.25Å; M104-F165 HydrophobicContact CB-CE2 3.78Å; M104-F165 HydrophobicContact CB-CG 4.32Å; M104-F165 HydrophobicContact CB-CZ 3.92Å; M104-F165 HydrophobicContact CE-CB 4.42Å; M104-F165 HydrophobicContact CE-CD1 3.99Å; M104-F165 HydrophobicContact CE-CG 4.25Å; M104-C173 HydrophobicContact CE-CB 4.49Å; M104-C173 WeakPolarHBondContact CE-O 3.14Å; M104-I175 HydrophobicContact CE-CB 4.2Å; M104-I175 HydrophobicContact CE-CD1 3.37Å; M104-I175 HydrophobicContact CE-CG1 3.54Å; M104-I175 HydrophobicContact SD-CB 4.35Å; M104-I175 HydrophobicContact SD-CD1 3.83Å; M104-I175 HydrophobicContact SD-CG1 4.22Å
105	K	95.4	Very high	94	Very high	90 Å²	90	65.1 Å²	65.1	39%	0.391	32%	0.321	S	S	.	.	H	α-helix	trans	-62.1	-47	176.6	-70.4	-176.8	177.4	177.4	0	110.8	I101 A102 F107 L108 E109 D163 F165	I101-K105 HydrophobicContact CG2-CD 3.91Å; I101-K105 HydrophobicContact CG2-CG 4.21Å; I101-K105 WeakPolarHBondContact O-CG 3.37Å; I101-K105 PolarHBondContact O-N 3.4Å; A102-K105 PolarHBondContact O-N 2.91Å; K105-F107 VanDerWaalsContact C-N 3.34Å; K105-F107 PolarHBondContact O-N 3.41Å; K105-L108 PolarHBondContact O-N 3.12Å; K105-E109 PolarHBondContact O-N 3.47Å; K105-D163 WeakPolarHBondContact CE-O 3.49Å; K105-D163 IonicContact NZ-OD2 3.91Å; K105-D163 PolarHBondContact NZ-OD2 3.12Å; K105-F165 HydrophobicContact CG-CE2 3.79Å; K105-F165 HydrophobicContact CG-CZ 4.14Å
106	E	95.6	Very high	93.8	Very high	140 Å²	140	59.9 Å²	59.9	65%	0.654	29%	0.292	S	S	*	.	H	α-helix	trans	-60.6	-41.9	176.6	-173.5	-172.6	169.7	0	0	111.9	A102 E109	A102-E106 WeakPolarHBondContact O-CB 3.47Å; A102-E106 PolarHBondContact O-N 3.46Å; E106-E109 WeakPolarHBondContact O-CB 3.27Å; E106-E109 PolarHBondContact O-N 3.01Å
107	F	95.4	Very high	93.4	Very high	36 Å²	36	63.6 Å²	63.6	16%	0.158	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-43.2	177.9	175.9	-107.5	0	0	0	112.7	T79 S103 M104 K105 E109 Y111 I175 K177 L257	T79-F107 HydrophobicContact CG2-CB 3.78Å; T79-F107 HydrophobicContact CG2-CD1 4.29Å; T79-F107 HydrophobicContact CG2-CG 4.04Å; S103-F107 VanDerWaalsContact O-CB 3.3Å; S103-F107 WeakPolarHBondContact O-CB 3.35Å; S103-F107 PolarHBondContact O-N 3.25Å; M104-F107 PolarHBondContact O-N 3.04Å; K105-F107 VanDerWaalsContact C-N 3.34Å; K105-F107 PolarHBondContact O-N 3.41Å; F107-E109 VanDerWaalsContact C-N 3.3Å; F107-E109 PolarHBondContact O-N 3.37Å; F107-Y111 HydrophobicContact CE1-CE2 4.39Å; F107-Y111 HydrophobicContact CZ-CE2 4.11Å; F107-I175 HydrophobicContact CD1-CG2 4.28Å; F107-I175 HydrophobicContact CE1-CG2 3.69Å; F107-K177 HydrophobicContact CE2-CD 3.97Å; F107-K177 HydrophobicContact CZ-CD 3.79Å; F107-L257 HydrophobicContact CE1-CD1 3.84Å; F107-L257 HydrophobicContact CE1-CD2 3.91Å; F107-L257 HydrophobicContact CZ-CD1 4.31Å; F107-L257 HydrophobicContact CZ-CD2 3.73Å
108	L	95.4	Very high	93.1	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-77	-12.1	-178.5	-75.6	-178.8	0	0	0	114.1	M104 K105 K110 Y111 D112 L154 F165 I175 L257	M104-L108 WeakPolarHBondContact O-CB 3.31Å; M104-L108 WeakPolarHBondContact O-CG 3.46Å; M104-L108 PolarHBondContact O-N 3.26Å; K105-L108 PolarHBondContact O-N 3.12Å; L108-K110 PolarHBondContact O-N 2.63Å; L108-K110 VanDerWaalsContact O-N 3.09Å; L108-Y111 HydrophobicContact CD2-CD2 4.41Å; L108-Y111 CarbonylContact O-C 3.42Å; L108-Y111 WeakPolarHBondContact O-CA 3.4Å; L108-Y111 WeakPolarHBondContact O-CB 3.25Å; L108-Y111 PolarHBondContact O-N 3.16Å; L108-D112 PolarHBondContact O-N 2.81Å; L108-L154 HydrophobicContact CD2-CD1 3.85Å; L108-F165 HydrophobicContact CD1-CE1 3.6Å; L108-F165 HydrophobicContact CD1-CZ 4Å; L108-I175 HydrophobicContact CD1-CD1 3.65Å; L108-I175 HydrophobicContact CD2-CD1 3.93Å; L108-I175 HydrophobicContact CG-CD1 3.83Å; L108-L257 HydrophobicContact CD2-CD1 4Å
109	E	94.1	Very high	92.6	Very high	100 Å²	100	65.8 Å²	65.8	47%	0.467	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-58.6	-24.4	178.8	-149.3	-151.6	135.8	0	0	113.4	K105 E106 F107 Y111 K115	K105-E109 PolarHBondContact O-N 3.47Å; E106-E109 WeakPolarHBondContact O-CB 3.27Å; E106-E109 PolarHBondContact O-N 3.01Å; F107-E109 VanDerWaalsContact C-N 3.3Å; F107-E109 PolarHBondContact O-N 3.37Å; E109-Y111 VanDerWaalsContact C-N 3.32Å; E109-K115 WeakPolarHBondContact O-CD 3.43Å; E109-K115 PolarHBondContact O-NZ 3.2Å; E109-K115 IonicContact OE1-NZ 3.44Å; E109-K115 PolarHBondContact OE1-NZ 2.75Å
110	K	91.9	Very high	92.2	Very high	149 Å²	149	65.9 Å²	65.9	65%	0.648	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-78.7	-19.1	175	-64	-178.8	-176.7	176.6	0	113.2	L108 L254	L108-K110 PolarHBondContact O-N 2.63Å; L108-K110 VanDerWaalsContact O-N 3.09Å; K110-L254 HydrophobicContact CB-CD2 4.28Å
111	Y	94.4	Very high	91.9	Very high	9 Å²	9	68 Å²	68	4%	0.035	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-99.4	10.1	-178.9	-68.1	-94	0	0	0	111.7	F107 L108 E109 D113 Q116 F149 R151 L254 Q255 L257	F107-Y111 HydrophobicContact CE1-CE2 4.39Å; F107-Y111 HydrophobicContact CZ-CE2 4.11Å; L108-Y111 HydrophobicContact CD2-CD2 4.41Å; L108-Y111 CarbonylContact O-C 3.42Å; L108-Y111 WeakPolarHBondContact O-CA 3.4Å; L108-Y111 WeakPolarHBondContact O-CB 3.25Å; L108-Y111 PolarHBondContact O-N 3.16Å; E109-Y111 VanDerWaalsContact C-N 3.32Å; Y111-D113 PolarHBondContact O-N 3.46Å; Y111-Q116 VanDerWaalsContact C-NE2 3.29Å; Y111-Q116 PolarHBondContact O-NE2 2.88Å; Y111-F149 HydrophobicContact CD1-CB 3.99Å; Y111-F149 AromaticContact CD1-CD1 3.67Å; Y111-F149 HydrophobicContact CD1-CD1 3.67Å; Y111-F149 HydrophobicContact CD1-CG 4.19Å; Y111-F149 HydrophobicContact CE1-CB 4.03Å; Y111-F149 AromaticContact CE1-CD1 3.92Å; Y111-F149 HydrophobicContact CE1-CD1 3.92Å; Y111-F149 HydrophobicContact CE1-CG 4.18Å; Y111-R151 WeakPolarHBondContact O-CG 3.28Å; Y111-L254 HydrophobicContact CD1-CB 4.37Å; Y111-L254 HydrophobicContact CD1-CD1 4.14Å; Y111-L254 HydrophobicContact CD1-CD2 4.21Å; Y111-L254 HydrophobicContact CD1-CG 4.47Å; Y111-L254 HydrophobicContact CD2-CD2 4.45Å; Y111-L254 HydrophobicContact CE1-CB 3.84Å; Y111-L254 HydrophobicContact CE1-CD1 4.42Å; Y111-L254 HydrophobicContact CE1-CD2 4Å; Y111-L254 HydrophobicContact CE1-CG 4.3Å; Y111-L254 HydrophobicContact CE2-CD2 4.21Å; Y111-L254 HydrophobicContact CG-CD2 4.45Å; Y111-Q255 WeakPolarHBondContact CE1-O 3.48Å; Y111-Q255 WeakPolarHBondContact OH-CG 3.49Å; Y111-Q255 PolarHBondContact OH-O 3.43Å; Y111-L257 HydrophobicContact CD1-CD1 3.93Å; Y111-L257 HydrophobicContact CD2-CD1 3.95Å; Y111-L257 HydrophobicContact CE1-CD1 3.63Å; Y111-L257 HydrophobicContact CE1-CG 3.84Å; Y111-L257 HydrophobicContact CE2-CD1 3.7Å; Y111-L257 HydrophobicContact CE2-CD2 4.47Å; Y111-L257 HydrophobicContact CE2-CG 4.36Å; Y111-L257 HydrophobicContact CG-CD1 4.06Å
112	D	92.9	Very high	91.7	Very high	38 Å²	38	68.1 Å²	68.1	20%	0.203	34%	0.342	C	S	.	.			trans	-63.1	126.7	176.6	-72.3	-24.6	0	0	0	111.5	L108 N114 K115 Q116 R151	L108-D112 PolarHBondContact O-N 2.81Å; D112-N114 VanDerWaalsContact C-N 3.27Å; D112-N114 PolarHBondContact O-N 2.84Å; D112-K115 HydrophobicContact CB-CD 4.26Å; D112-K115 HydrophobicContact CB-CG 4.2Å; D112-K115 PolarHBondContact O-N 3.45Å; D112-K115 VanDerWaalsContact O-N 3.1Å; D112-K115 IonicContact OD2-NZ 3.99Å; D112-Q116 PolarHBondContact O-N 3.47Å; D112-R151 IonicContact OD1-CZ 3.47Å; D112-R151 IonicContact OD1-NE 2.84Å; D112-R151 IonicContact OD1-NH1 3.34Å; D112-R151 PolarHBondContact OD1-NH1 3.34Å
113	D	90.6	Very high	91.4	Very high	55 Å²	55	67.4 Å²	67.4	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-57.4	-40.6	-174.1	-60.1	-1.1	0	0	0	111.3	Y111 K115 Q116 L117 L150 R151	Y111-D113 PolarHBondContact O-N 3.46Å; D113-K115 PolarHBondContact O-N 3.16Å; D113-Q116 PolarHBondContact O-N 2.84Å; D113-Q116 VanDerWaalsContact O-N 3.12Å; D113-L117 VanDerWaalsContact O-CG 3.3Å; D113-L117 WeakPolarHBondContact O-CG 3.36Å; D113-L117 PolarHBondContact O-N 3.2Å; D113-L150 HydrophobicContact CB-CD2 4.36Å; D113-R151 PolarHBondContact OD1-N 2.99Å
114	N	90	Very high	90.9	Very high	119 Å²	119	71.7 Å²	71.7	64%	0.636	35%	0.35	S	S	*	.	H	α-helix	trans	-58.8	-44.1	177.7	-64.5	-18	0	0	0	112.5	D112 Q116 L117 E118	D112-N114 VanDerWaalsContact C-N 3.27Å; D112-N114 PolarHBondContact O-N 2.84Å; N114-Q116 VanDerWaalsContact C-N 3.26Å; N114-Q116 PolarHBondContact O-N 3.03Å; N114-L117 PolarHBondContact O-N 3.12Å; N114-E118 WeakPolarHBondContact O-CG 3.47Å; N114-E118 PolarHBondContact O-N 3.23Å; N114-E118 VanDerWaalsContact O-N 3.15Å
115	K	89	Confident	90.5	Very high	88 Å²	88	73.3 Å²	73.3	38%	0.383	36%	0.361	S	S	.	.	H	α-helix	trans	-67.4	-29.3	179	-63.4	-176.8	-175.5	170.7	0	112.1	E109 D112 D113	E109-K115 WeakPolarHBondContact O-CD 3.43Å; E109-K115 PolarHBondContact O-NZ 3.2Å; E109-K115 IonicContact OE1-NZ 3.44Å; E109-K115 PolarHBondContact OE1-NZ 2.75Å; D112-K115 HydrophobicContact CB-CD 4.26Å; D112-K115 HydrophobicContact CB-CG 4.2Å; D112-K115 PolarHBondContact O-N 3.45Å; D112-K115 VanDerWaalsContact O-N 3.1Å; D112-K115 IonicContact OD2-NZ 3.99Å; D113-K115 PolarHBondContact O-N 3.16Å
116	Q	90.9	Very high	90.1	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-78.9	-31.6	177.3	-65.6	-177.2	67.1	0	0	112.6	Y111 D112 D113 N114 Y122 R148 F149 L254	Y111-Q116 VanDerWaalsContact C-NE2 3.29Å; Y111-Q116 PolarHBondContact O-NE2 2.88Å; D112-Q116 PolarHBondContact O-N 3.47Å; D113-Q116 PolarHBondContact O-N 2.84Å; D113-Q116 VanDerWaalsContact O-N 3.12Å; N114-Q116 VanDerWaalsContact C-N 3.26Å; N114-Q116 PolarHBondContact O-N 3.03Å; Q116-Y122 HydrophobicContact CB-CD2 4.21Å; Q116-Y122 HydrophobicContact CB-CE2 4.29Å; Q116-Y122 HydrophobicContact CG-CE2 4.21Å; Q116-Y122 WeakPolarHBondContact O-CD2 3.27Å; Q116-R148 HydrophobicContact CB-CG 4.4Å; Q116-R148 PolarHBondContact O-NE 3.45Å; Q116-R148 PolarHBondContact O-NH2 2.99Å; Q116-R148 VanDerWaalsContact OE1-CA 3.3Å; Q116-F149 PolarHBondContact NE2-O 3.03Å; Q116-F149 PolarHBondContact OE1-O 3.29Å; Q116-L254 VanDerWaalsContact CD-CD1 3.43Å; Q116-L254 HydrophobicContact CG-CD1 3.81Å
117	L	87.3	Confident	89.7	Confident	105 Å²	105	70.8 Å²	70.8	55%	0.55	36%	0.357	S	S	.	.	H	α-helix	trans	-73.3	-38.7	178.2	-71.7	169.9	0	0	0	112.2	D113 N114 N119	D113-L117 VanDerWaalsContact O-CG 3.3Å; D113-L117 WeakPolarHBondContact O-CG 3.36Å; D113-L117 PolarHBondContact O-N 3.2Å; N114-L117 PolarHBondContact O-N 3.12Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 2.67Å
118	E	86.3	Confident	89.4	Confident	162 Å²	162	74.3 Å²	74.3	76%	0.757	38%	0.377	S	S	*	.	S	Bend	trans	-71.3	-20.9	179.1	-70.3	173.2	-173	0	0	113.3	N114	N114-E118 WeakPolarHBondContact O-CG 3.47Å; N114-E118 PolarHBondContact O-N 3.23Å; N114-E118 VanDerWaalsContact O-N 3.15Å
119	N	85.5	Confident	89.2	Confident	39 Å²	39	75.5 Å²	75.5	21%	0.209	38%	0.384	C	S	.	.			trans	-99.2	118.2	-174.6	-175.1	-7.3	0	0	0	112.2	L117 N121 Y122 D252	L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 2.67Å; N119-N121 PolarHBondContact O-N 3.43Å; N119-N121 VanDerWaalsContact OD1-CB 3.22Å; N119-N121 WeakPolarHBondContact OD1-CB 2.93Å; N119-N121 PolarHBondContact OD1-N 3.16Å; N119-N121 PolarHBondContact OD1-ND2 3.01Å; N119-Y122 HydrophobicContact CB-CD2 3.72Å; N119-Y122 HydrophobicContact CB-CE2 3.71Å; N119-Y122 PolarHBondContact O-N 3.23Å; N119-D252 VanDerWaalsContact ND2-CG 3.25Å; N119-D252 PolarHBondContact ND2-OD2 3.05Å
120	N	85.5	Confident	89.2	Confident	134 Å²	134	74.7 Å²	74.7	72%	0.717	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-5.7	178.8	-66.6	-29.9	0	0	0	114.4	Y122	N120-Y122 PolarHBondContact O-N 3.41Å
121	N	88.1	Confident	89.3	Confident	50 Å²	50	71.5 Å²	71.5	27%	0.267	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	2.8	175.8	-63.8	-25	0	0	0	112.9	N119 R145 S146 D252	N119-N121 PolarHBondContact O-N 3.43Å; N119-N121 VanDerWaalsContact OD1-CB 3.22Å; N119-N121 WeakPolarHBondContact OD1-CB 2.93Å; N119-N121 PolarHBondContact OD1-N 3.16Å; N119-N121 PolarHBondContact OD1-ND2 3.01Å; N121-R145 CarbonylContact O-C 3.55Å; N121-R145 WeakPolarHBondContact O-CA 3.02Å; N121-R145 WeakPolarHBondContact O-CB 3.47Å; N121-S146 PolarHBondContact O-N 2.97Å; N121-D252 HydrophobicContact CB-CB 4.3Å; N121-D252 WeakPolarHBondContact CB-OD2 2.97Å; N121-D252 PolarHBondContact ND2-OD2 2.98Å
122	Y	90.7	Very high	89.3	Confident	23 Å²	23	73.5 Å²	73.5	9%	0.09	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.8	176	-62.9	-74.1	0	0	0	112.7	Q116 N119 N120 S146 R148 D252 L254	Q116-Y122 HydrophobicContact CB-CD2 4.21Å; Q116-Y122 HydrophobicContact CB-CE2 4.29Å; Q116-Y122 HydrophobicContact CG-CE2 4.21Å; Q116-Y122 WeakPolarHBondContact O-CD2 3.27Å; N119-Y122 HydrophobicContact CB-CD2 3.72Å; N119-Y122 HydrophobicContact CB-CE2 3.71Å; N119-Y122 PolarHBondContact O-N 3.23Å; N120-Y122 PolarHBondContact O-N 3.41Å; Y122-S146 CarbonylContact C-O 3.17Å; Y122-S146 WeakPolarHBondContact CA-O 3.39Å; Y122-R148 VanDerWaalsContact CB-CG 3.49Å; Y122-R148 HydrophobicContact CD1-CG 4.36Å; Y122-R148 HydrophobicContact CG-CG 4.08Å; Y122-D252 HydrophobicContact CE1-CB 4.28Å; Y122-D252 WeakPolarHBondContact CE1-O 3.29Å; Y122-D252 HydrophobicContact CE2-CB 4.39Å; Y122-D252 PolarHBondContact OH-O 3.24Å; Y122-L254 HydrophobicContact CE1-CD1 3.66Å; Y122-L254 HydrophobicContact CE1-CG 3.81Å
123	D	89.1	Confident	89.3	Confident	39 Å²	39	73.8 Å²	73.8	21%	0.209	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.4	169.7	-64.6	-44.9	0	0	0	110.4	C125 R135 R145 S146 R148	D123-C125 PolarHBondContact O-N 3.48Å; D123-R135 IonicContact OD2-CZ 2.8Å; D123-R135 IonicContact OD2-NH1 2.69Å; D123-R135 PolarHBondContact OD2-NH1 3.32Å; D123-R135 IonicContact OD2-NH2 2.59Å; D123-R145 WeakPolarHBondContact OD1-CD 3.38Å; D123-R145 IonicContact OD1-CZ 3.2Å; D123-R145 IonicContact OD1-NE 3.84Å; D123-R145 IonicContact OD1-NH1 2.96Å; D123-R145 PolarHBondContact OD1-NH1 2.99Å; D123-R145 WeakPolarHBondContact OD2-CB 3.39Å; D123-S146 PolarHBondContact N-O 2.99Å; D123-R148 PolarHBondContact O-N 3.36Å
124	D	85.6	Confident	89.4	Confident	128 Å²	128	75.4 Å²	75.4	68%	0.684	39%	0.393	S	S	*	.			trans	-77.3	98.4	169.2	-69.6	-46.3	0	0	0	109.5	R148	D124-R148 WeakPolarHBondContact OD1-CD 3.45Å; D124-R148 IonicContact OD1-CZ 2.65Å; D124-R148 IonicContact OD1-NE 3.68Å; D124-R148 IonicContact OD1-NH1 3.54Å; D124-R148 PolarHBondContact OD1-NH1 2.73Å; D124-R148 IonicContact OD2-NH1 3.58Å; D124-R148 PolarHBondContact OD2-NH1 2.75Å; D124-R148 VanDerWaalsContact OD2-NH1 3.09Å
125	C	87.3	Confident	89.4	Confident	34 Å²	34	71.8 Å²	71.8	23%	0.23	37%	0.37	C	S	.	.			trans	-88.5	155.6	174.6	-62.8	0	0	0	0	110.3	D123 C147	D123-C125 PolarHBondContact O-N 3.48Å; C125-C147 HydrophobicContact CB-CB 3.65Å; C125-C147 WeakPolarHBondContact CB-SG 3.44Å; C125-C147 WeakPolarHBondContact SG-CA 3.48Å; C125-C147 WeakPolarHBondContact SG-CB 2.99Å; C125-C147 CovalentContact SG-SG 2.03Å; C125-C147 PolarHBondContact SG-SG 3.31Å
126	N	86.7	Confident	89.3	Confident	77 Å²	77	70 Å²	70	41%	0.412	38%	0.378	S	S	.	.			trans	-62.9	148	-177.6	-160.4	-12.2	0	0	0	111.9	L128 Q130 Q240	N126-L128 PolarHBondContact O-N 3.3Å; N126-Q130 HydrophobicContact CB-CG 4.18Å; N126-Q130 PolarHBondContact ND2-NE2 3.26Å; N126-Q240 PolarHBondContact O-NE2 2.95Å
127	D	86.4	Confident	89.1	Confident	101 Å²	101	77.6 Å²	77.6	54%	0.54	41%	0.41	S	S	.	.	S	Bend	trans	-72.2	-12.3	178.2	-69	-36.8	0	0	0	113	L231	D127-L231 WeakPolarHBondContact O-CG 3.38Å
128	L	89.7	Confident	88.9	Confident	110 Å²	110	74.4 Å²	74.4	58%	0.576	39%	0.394	S	S	*	.	S	Bend	trans	-105.2	146.1	172.9	-64.3	174.4	0	0	0	110.7	N126 Q130 Q240	N126-L128 PolarHBondContact O-N 3.3Å; L128-Q130 PolarHBondContact O-N 2.89Å; L128-Q240 PolarHBondContact O-OE1 3.07Å; L128-Q240 VanDerWaalsContact O-OE1 3.04Å
129	P	91.8	Very high	88.7	Confident	24 Å²	24	68.6 Å²	68.6	16%	0.156	37%	0.368	C	S	.	.			trans	-61.1	124.9	178.9	-16	25.1	0	0	0	112.6	N206 L234 P238	P129-N206 HydrophobicContact CB-CB 4.17Å; P129-N206 WeakPolarHBondContact CB-O 3.39Å; P129-L234 HydrophobicContact CB-CD1 4.4Å; P129-L234 HydrophobicContact CG-CD1 3.01Å; P129-P238 HydrophobicContact CB-CB 3.95Å; P129-P238 HydrophobicContact CG-CB 4.4Å
130	Q	93.4	Very high	88.3	Confident	84 Å²	84	75.1 Å²	75.1	39%	0.393	40%	0.395	S	S	.	.			trans	-110.1	167.4	171	-61.4	-170.8	-26.1	0	0	111	N126 L128 N206 Q240	N126-Q130 HydrophobicContact CB-CG 4.18Å; N126-Q130 PolarHBondContact ND2-NE2 3.26Å; L128-Q130 PolarHBondContact O-N 2.89Å; Q130-N206 WeakPolarHBondContact O-CB 3.49Å; Q130-Q240 HydrophobicContact CB-CB 4.15Å; Q130-Q240 PolarHBondContact O-N 3.04Å; Q130-Q240 VanDerWaalsContact O-N 3.07Å
131	T	94.8	Very high	87.7	Confident	82 Å²	82	75 Å²	75	50%	0.503	39%	0.39	S	S	.	.	S	Bend	trans	-59.3	172.5	171.5	-166.6	0	0	0	0	111.5	Q240	T131-Q240 VanDerWaalsContact O-CA 3.3Å; T131-Q240 WeakPolarHBondContact O-CA 3.3Å
132	Y	94.6	Very high	87.2	Confident	51 Å²	51	75 Å²	75	20%	0.2	40%	0.401	C	S	.	.			trans	-52.5	140	179.3	-50.1	-81.2	0	0	0	112.3	R185 P186 L239	Y132-R185 HydrophobicContact CD1-CB 4.24Å; Y132-R185 HydrophobicContact CD1-CG 4.17Å; Y132-R185 HydrophobicContact CE1-CB 3.67Å; Y132-R185 HydrophobicContact CE1-CG 4.12Å; Y132-P186 PolarHBondContact OH-O 2.75Å; Y132-L239 HydrophobicContact CD1-CB 4.09Å; Y132-L239 HydrophobicContact CE1-CB 4.05Å; Y132-L239 HydrophobicContact CE1-CD1 4.1Å; Y132-L239 HydrophobicContact CE1-CD2 4Å; Y132-L239 HydrophobicContact CE1-CG 4.25Å; Y132-L239 HydrophobicContact CE2-CD1 4.09Å
133	V	92.4	Very high	87.1	Confident	44 Å²	44	77.6 Å²	77.6	27%	0.267	42%	0.419	S	S	.	.			trans	-104.3	101.6	174.4	180	0	0	0	0	108.3	R135 Q240 Y242	V133-R135 HydrophobicContact CG1-CG 4.34Å; V133-Q240 HydrophobicContact CG2-CB 4.03Å; V133-Q240 WeakPolarHBondContact CG2-O 3.4Å; V133-Y242 PolarHBondContact N-O 3.29Å
134	D	91.6	Very high	87.1	Confident	89 Å²	89	76.6 Å²	76.6	48%	0.476	41%	0.413	S	S	.	.			trans	-81	121.9	178.9	-79.3	-36.4	0	0	0	111.4	R185	D134-R185 IonicContact OD1-CZ 3.68Å; D134-R185 IonicContact OD1-NE 3.18Å; D134-R185 IonicContact OD1-NH1 3.96Å; D134-R185 IonicContact OD1-NH2 2.97Å; D134-R185 PolarHBondContact OD1-NH2 2.86Å; D134-R185 IonicContact OD2-CZ 2.68Å; D134-R185 IonicContact OD2-NH1 3.99Å; D134-R185 PolarHBondContact OD2-NH1 3.1Å; D134-R185 IonicContact OD2-NH2 3.84Å; D134-R185 PolarHBondContact OD2-NH2 3.45Å
135	R	90.1	Very high	87.3	Confident	42 Å²	42	76.8 Å²	76.8	16%	0.158	40%	0.404	C	S	.	.			trans	-106.7	28.1	-174.5	-55.4	178.9	177.4	-86.8	5.5	112.5	D123 V133 K144 R145 Y245	D123-R135 IonicContact OD2-CZ 2.8Å; D123-R135 IonicContact OD2-NH1 2.69Å; D123-R135 PolarHBondContact OD2-NH1 3.32Å; D123-R135 IonicContact OD2-NH2 2.59Å; V133-R135 HydrophobicContact CG1-CG 4.34Å; R135-K144 HydrophobicContact CB-CB 4.28Å; R135-K144 HydrophobicContact CB-CD 4.3Å; R135-K144 HydrophobicContact CB-CG 4.39Å; R135-K144 VanDerWaalsContact O-CD 3.28Å; R135-K144 WeakPolarHBondContact O-CD 3.11Å; R135-K144 WeakPolarHBondContact O-CE 3.49Å; R135-K144 PolarHBondContact O-NZ 3.45Å; R135-R145 WeakPolarHBondContact CD-O 3.26Å; R135-R145 PolarHBondContact NE-O 3.28Å; R135-R145 PolarHBondContact NH1-O 2.88Å; R135-Y245 HydrophobicContact CB-CD2 4.3Å; R135-Y245 HydrophobicContact CB-CE1 4.5Å; R135-Y245 HydrophobicContact CB-CE2 3.7Å; R135-Y245 HydrophobicContact CG-CE2 4.05Å; R135-Y245 PolarHBondContact N-OH 3.19Å
136	G	87.5	Confident	87.4	Confident	52 Å²	52	75.2 Å²	75.2	54%	0.536	39%	0.393	S	S	.	.			trans	87.9	-154.3	-179.7	0	0	0	0	0	113.8	Y245	G136-Y245 VanDerWaalsContact O-CE1 3.3Å; G136-Y245 WeakPolarHBondContact O-CE1 3.3Å; G136-Y245 PolarHBondContact O-OH 3.46Å
137	K	87.1	Confident	87.6	Confident	159 Å²	159	71.6 Å²	71.6	69%	0.691	37%	0.374	S	S	*	.			trans	-89.4	165.8	-177.1	-66.2	177.4	-175.5	173.2	0	111.9	D139 K144	K137-D139 VanDerWaalsContact C-N 3.27Å; K137-D139 WeakPolarHBondContact CB-OD2 3.46Å; K137-D139 PolarHBondContact O-N 2.9Å; K137-K144 WeakPolarHBondContact O-CE 3.49Å
138	L	83.5	Confident	87.9	Confident	38 Å²	38	68.6 Å²	68.6	20%	0.199	36%	0.355	C	S	.	.	S	Bend	trans	-85.8	66.4	174.6	-67.2	166.4	0	0	0	109.9	F63 K64 V182 N183 Y245 L249	F63-L138 HydrophobicContact CB-CB 4.42Å; K64-L138 HydrophobicContact CB-CD1 4.17Å; K64-L138 HydrophobicContact CD-CD1 4.07Å; K64-L138 HydrophobicContact CG-CD1 4.18Å; L138-V182 HydrophobicContact CD1-CG1 4Å; L138-V182 HydrophobicContact CD2-CG1 4.01Å; L138-N183 HydrophobicContact CD1-CB 4.28Å; L138-Y245 HydrophobicContact CD2-CD1 3.56Å; L138-Y245 HydrophobicContact CD2-CE1 4.42Å; L138-Y245 HydrophobicContact CD2-CG 4.19Å; L138-Y245 WeakPolarHBondContact CD2-O 3.49Å; L138-Y245 HydrophobicContact CG-CD1 4.29Å; L138-L249 HydrophobicContact CB-CD1 4.33Å; L138-L249 HydrophobicContact CD2-CD1 4.04Å
139	D	81.8	Confident	88.1	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.219	33%	0.328	C	S	.	.	S	Bend	trans	-132.3	-179.5	-177.6	54.5	18	0	0	0	111.3	K137 E141 L249	K137-D139 VanDerWaalsContact C-N 3.27Å; K137-D139 WeakPolarHBondContact CB-OD2 3.46Å; K137-D139 PolarHBondContact O-N 2.9Å; D139-E141 PolarHBondContact O-N 3.38Å; D139-E141 VanDerWaalsContact OD1-CB 3.27Å; D139-E141 WeakPolarHBondContact OD1-CB 3.24Å; D139-E141 WeakPolarHBondContact OD1-CG 3.36Å; D139-E141 PolarHBondContact OD1-N 3.17Å; D139-L249 WeakPolarHBondContact O-CD2 3.11Å
140	K	76.5	Confident	88.1	Confident	176 Å²	176	64.9 Å²	64.9	77%	0.765	34%	0.335	S	S	*	.	S	Bend	trans	-64.5	2.7	-178.7	-72.3	-179.4	-179.6	-176.7	0	114.2	F63 G142	F63-K140 HydrophobicContact CE1-CG 4.5Å; F63-K140 HydrophobicContact CE2-CG 3.64Å; F63-K140 HydrophobicContact CZ-CB 4.44Å; F63-K140 HydrophobicContact CZ-CD 4.45Å; F63-K140 HydrophobicContact CZ-CG 3.42Å; F63-K140 VanDerWaalsContact CZ-CG 3.42Å; K140-G142 VanDerWaalsContact C-N 3.31Å; K140-G142 PolarHBondContact O-N 3.34Å
141	E	73.4	Confident	88.1	Confident	132 Å²	132	63 Å²	63	62%	0.617	32%	0.324	S	S	*	.	S	Bend	trans	-74.4	82.5	-177.6	-64	-175.6	170.8	0	0	111.8	D139 K144	D139-E141 PolarHBondContact O-N 3.38Å; D139-E141 VanDerWaalsContact OD1-CB 3.27Å; D139-E141 WeakPolarHBondContact OD1-CB 3.24Å; D139-E141 WeakPolarHBondContact OD1-CG 3.36Å; D139-E141 PolarHBondContact OD1-N 3.17Å; E141-K144 PolarHBondContact O-NZ 2.93Å
142	G	77.6	Confident	88	Confident	48 Å²	48	62.2 Å²	62.2	50%	0.495	32%	0.322	S	S	.	.			trans	64.2	170.8	165.8	0	0	0	0	0	115.4	K140 K144	K140-G142 VanDerWaalsContact C-N 3.31Å; K140-G142 PolarHBondContact O-N 3.34Å; G142-K144 PolarHBondContact O-N 3.02Å
143	V	87.4	Confident	88	Confident	78 Å²	78	60.9 Å²	60.9	47%	0.473	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-75.7	124.8	171.1	178.8	0	0	0	0	108.3	P251	V143-P251 HydrophobicContact CG1-CG 3.85Å
144	K	90.4	Very high	88.1	Confident	19 Å²	19	58.8 Å²	58.8	8%	0.083	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-76.5	134.2	173.7	-50.5	-51.3	-172.2	-170.6	0	108.7	R135 K137 E141 G142 Y245 L249 H250	R135-K144 HydrophobicContact CB-CB 4.28Å; R135-K144 HydrophobicContact CB-CD 4.3Å; R135-K144 HydrophobicContact CB-CG 4.39Å; R135-K144 VanDerWaalsContact O-CD 3.28Å; R135-K144 WeakPolarHBondContact O-CD 3.11Å; R135-K144 WeakPolarHBondContact O-CE 3.49Å; R135-K144 PolarHBondContact O-NZ 3.45Å; K137-K144 WeakPolarHBondContact O-CE 3.49Å; E141-K144 PolarHBondContact O-NZ 2.93Å; G142-K144 PolarHBondContact O-N 3.02Å; K144-Y245 HydrophobicContact CG-CD1 4.46Å; K144-Y245 HydrophobicContact CG-CG 4.23Å; K144-L249 HydrophobicContact CG-CB 4.13Å; K144-L249 PolarHBondContact N-O 3.21Å; K144-H250 PolarHBondContact O-CD2 3.35Å
145	R	90.1	Very high	88.2	Confident	131 Å²	131	58.5 Å²	58.5	49%	0.494	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-75.3	155.5	177.7	-64.3	-175.8	-176.2	176.3	-1.3	111.9	N121 D123 R135 H250	N121-R145 CarbonylContact O-C 3.55Å; N121-R145 WeakPolarHBondContact O-CA 3.02Å; N121-R145 WeakPolarHBondContact O-CB 3.47Å; D123-R145 WeakPolarHBondContact OD1-CD 3.38Å; D123-R145 IonicContact OD1-CZ 3.2Å; D123-R145 IonicContact OD1-NE 3.84Å; D123-R145 IonicContact OD1-NH1 2.96Å; D123-R145 PolarHBondContact OD1-NH1 2.99Å; D123-R145 WeakPolarHBondContact OD2-CB 3.39Å; R135-R145 WeakPolarHBondContact CD-O 3.26Å; R135-R145 PolarHBondContact NE-O 3.28Å; R135-R145 PolarHBondContact NH1-O 2.88Å; R145-H250 VanDerWaalsContact C-NE2 3.28Å; R145-H250 PolarHBondContact O-NE2 2.86Å
146	S	88.1	Confident	88.3	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.1	175.7	-173.1	0	0	0	0	110.8	N121 Y122 D123 R148 H250 Y253 L254	N121-S146 PolarHBondContact O-N 2.97Å; Y122-S146 CarbonylContact C-O 3.17Å; Y122-S146 WeakPolarHBondContact CA-O 3.39Å; D123-S146 PolarHBondContact N-O 2.99Å; S146-R148 PolarHBondContact O-N 3.43Å; S146-H250 VanDerWaalsContact CA-NE2 3.26Å; S146-H250 WeakPolarHBondContact CA-NE2 3.32Å; S146-H250 VanDerWaalsContact CB-NE2 3.32Å; S146-H250 WeakPolarHBondContact CB-NE2 3.26Å; S146-H250 PolarHBondContact N-NE2 3.26Å; S146-Y253 WeakPolarHBondContact OG-CD2 3.3Å; S146-L254 PolarHBondContact OG-N 3.06Å
147	C	91.4	Very high	88.6	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	137.4	162.9	-71.6	0	0	0	0	109.6	C125 Y241	C125-C147 HydrophobicContact CB-CB 3.65Å; C125-C147 WeakPolarHBondContact CB-SG 3.44Å; C125-C147 WeakPolarHBondContact SG-CA 3.48Å; C125-C147 WeakPolarHBondContact SG-CB 2.99Å; C125-C147 CovalentContact SG-SG 2.03Å; C125-C147 PolarHBondContact SG-SG 3.31Å; C147-Y241 HydrophobicContact CB-CD1 3.71Å; C147-Y241 HydrophobicContact CB-CE1 3.46Å; C147-Y241 VanDerWaalsContact CB-CE1 3.46Å; C147-Y241 HydrophobicContact CB-CG 4.36Å
148	R	92.7	Very high	89	Confident	38 Å²	38	50 Å²	50	14%	0.143	25%	0.254	C	S	.	.			trans	-63.6	144.3	165.9	-66.2	-174.6	176.6	147.6	-2	109.9	Q116 Y122 D123 D124 S146 Y241	Q116-R148 HydrophobicContact CB-CG 4.4Å; Q116-R148 PolarHBondContact O-NE 3.45Å; Q116-R148 PolarHBondContact O-NH2 2.99Å; Q116-R148 VanDerWaalsContact OE1-CA 3.3Å; Y122-R148 VanDerWaalsContact CB-CG 3.49Å; Y122-R148 HydrophobicContact CD1-CG 4.36Å; Y122-R148 HydrophobicContact CG-CG 4.08Å; D123-R148 PolarHBondContact O-N 3.36Å; D124-R148 WeakPolarHBondContact OD1-CD 3.45Å; D124-R148 IonicContact OD1-CZ 2.65Å; D124-R148 IonicContact OD1-NE 3.68Å; D124-R148 IonicContact OD1-NH1 3.54Å; D124-R148 PolarHBondContact OD1-NH1 2.73Å; D124-R148 IonicContact OD2-NH1 3.58Å; D124-R148 PolarHBondContact OD2-NH1 2.75Å; D124-R148 VanDerWaalsContact OD2-NH1 3.09Å; S146-R148 PolarHBondContact O-N 3.43Å; R148-Y241 PolarHBondContact O-OH 3.39Å
149	F	93.6	Very high	89.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.			trans	-127.4	103.6	169.2	-173.9	-83.5	0	0	0	108.3	Y111 Q116 N153 L154 Y241 P256 L257	Y111-F149 HydrophobicContact CD1-CB 3.99Å; Y111-F149 AromaticContact CD1-CD1 3.67Å; Y111-F149 HydrophobicContact CD1-CD1 3.67Å; Y111-F149 HydrophobicContact CD1-CG 4.19Å; Y111-F149 HydrophobicContact CE1-CB 4.03Å; Y111-F149 AromaticContact CE1-CD1 3.92Å; Y111-F149 HydrophobicContact CE1-CD1 3.92Å; Y111-F149 HydrophobicContact CE1-CG 4.18Å; Q116-F149 PolarHBondContact NE2-O 3.03Å; Q116-F149 PolarHBondContact OE1-O 3.29Å; F149-N153 HydrophobicContact CE1-CB 4.37Å; F149-N153 HydrophobicContact CE2-CB 4.5Å; F149-N153 HydrophobicContact CZ-CB 4.02Å; F149-L154 HydrophobicContact CE1-CD1 4.42Å; F149-L154 HydrophobicContact CE1-CD2 4.08Å; F149-L154 HydrophobicContact CE1-CG 4.06Å; F149-L154 HydrophobicContact CZ-CD2 3.99Å; F149-L154 HydrophobicContact CZ-CG 4.41Å; F149-Y241 HydrophobicContact CB-CE1 4.06Å; F149-Y241 HydrophobicContact CD2-CE1 4.18Å; F149-Y241 AromaticContact CD2-CZ 3.91Å; F149-Y241 WeakPolarHBondContact CD2-OH 3.4Å; F149-P256 HydrophobicContact CD2-CB 4.44Å; F149-P256 HydrophobicContact CE2-CB 4.43Å; F149-L257 HydrophobicContact CD1-CD1 4.38Å; F149-L257 HydrophobicContact CD1-CG 4.42Å; F149-L257 HydrophobicContact CE1-CB 3.75Å; F149-L257 HydrophobicContact CE1-CD1 4.13Å; F149-L257 HydrophobicContact CE1-CG 4.12Å; F149-L257 HydrophobicContact CE2-CB 4.48Å; F149-L257 HydrophobicContact CZ-CB 3.74Å; F149-L257 HydrophobicContact CZ-CG 4.48Å; F149-L257 VanDerWaalsContact CZ-O 3.31Å; F149-L257 WeakPolarHBondContact CZ-O 3.46Å
150	L	92.6	Very high	89.6	Confident	56 Å²	56	52 Å²	52	29%	0.293	27%	0.272	S	S	.	.			trans	-74.8	140.3	-178.4	-56.3	178.5	0	0	0	111	D113 S152 N153	D113-L150 HydrophobicContact CB-CD2 4.36Å; L150-S152 WeakPolarHBondContact CB-OG 3.38Å; L150-S152 PolarHBondContact O-N 3.49Å; L150-N153 WeakPolarHBondContact O-CB 3.16Å; L150-N153 PolarHBondContact O-N 3.21Å; L150-N153 PolarHBondContact O-ND2 3.36Å; L150-N153 VanDerWaalsContact O-ND2 3.16Å
151	R	93.4	Very high	90.2	Very high	43 Å²	43	51.8 Å²	51.8	16%	0.162	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.6	-27.5	176.6	-77.6	173.1	65.4	-174.7	-2.3	112.4	Y111 D112 D113 N153 L154 S158	Y111-R151 WeakPolarHBondContact O-CG 3.28Å; D112-R151 IonicContact OD1-CZ 3.47Å; D112-R151 IonicContact OD1-NE 2.84Å; D112-R151 IonicContact OD1-NH1 3.34Å; D112-R151 PolarHBondContact OD1-NH1 3.34Å; D113-R151 PolarHBondContact OD1-N 2.99Å; R151-N153 PolarHBondContact O-N 3.29Å; R151-N153 VanDerWaalsContact O-N 3.17Å; R151-L154 WeakPolarHBondContact O-CB 3.37Å; R151-L154 PolarHBondContact O-N 3.25Å; R151-S158 VanDerWaalsContact CZ-O 3.3Å; R151-S158 PolarHBondContact NE-O 3.17Å; R151-S158 PolarHBondContact NH2-O 3.17Å; R151-S158 WeakPolarHBondContact O-CB 3.23Å
152	S	92.6	Very high	91	Very high	66 Å²	66	46.7 Å²	46.7	46%	0.462	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-55.3	-29.5	176.6	57.7	0	0	0	0	113.3	L150 L154 Q155	L150-S152 WeakPolarHBondContact CB-OG 3.38Å; L150-S152 PolarHBondContact O-N 3.49Å; S152-L154 PolarHBondContact O-N 2.82Å; S152-Q155 PolarHBondContact O-N 2.89Å
153	N	93.6	Very high	91.7	Very high	23 Å²	23	48.5 Å²	48.5	12%	0.123	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-61.9	-25.9	176.3	-68.9	-48.6	0	0	0	113.3	F149 L150 R151 Q155	F149-N153 HydrophobicContact CE1-CB 4.37Å; F149-N153 HydrophobicContact CE2-CB 4.5Å; F149-N153 HydrophobicContact CZ-CB 4.02Å; L150-N153 WeakPolarHBondContact O-CB 3.16Å; L150-N153 PolarHBondContact O-N 3.21Å; L150-N153 PolarHBondContact O-ND2 3.36Å; L150-N153 VanDerWaalsContact O-ND2 3.16Å; R151-N153 PolarHBondContact O-N 3.29Å; R151-N153 VanDerWaalsContact O-N 3.17Å; N153-Q155 PolarHBondContact O-N 3.16Å
154	L	94.9	Very high	92.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-82.6	0.9	176.9	-56.8	178.9	0	0	0	113	L108 F149 R151 S152 N156 C157 I175 F229 L257 A259	L108-L154 HydrophobicContact CD2-CD1 3.85Å; F149-L154 HydrophobicContact CE1-CD1 4.42Å; F149-L154 HydrophobicContact CE1-CD2 4.08Å; F149-L154 HydrophobicContact CE1-CG 4.06Å; F149-L154 HydrophobicContact CZ-CD2 3.99Å; F149-L154 HydrophobicContact CZ-CG 4.41Å; R151-L154 WeakPolarHBondContact O-CB 3.37Å; R151-L154 PolarHBondContact O-N 3.25Å; S152-L154 PolarHBondContact O-N 2.82Å; L154-N156 PolarHBondContact O-N 3.27Å; L154-C157 PolarHBondContact O-N 2.71Å; L154-I175 HydrophobicContact CD1-CD1 4.16Å; L154-I175 HydrophobicContact CD1-CG1 4.34Å; L154-F229 WeakPolarHBondContact O-CB 3.39Å; L154-L257 HydrophobicContact CD1-CD1 4.22Å; L154-L257 HydrophobicContact CD2-CB 3.99Å; L154-A259 HydrophobicContact CB-CB 4.21Å; L154-A259 HydrophobicContact CD2-CB 3.97Å
155	Q	93.7	Very high	92.3	Very high	83 Å²	83	44.9 Å²	44.9	39%	0.388	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	48.2	-118.1	176.3	-57	-174.1	2.6	0	0	112.8	S152 N153 C157 S158 F229	S152-Q155 PolarHBondContact O-N 2.89Å; N153-Q155 PolarHBondContact O-N 3.16Å; Q155-C157 PolarHBondContact O-N 3.31Å; Q155-S158 WeakPolarHBondContact O-CB 3.45Å; Q155-S158 PolarHBondContact O-N 3.02Å; Q155-S158 VanDerWaalsContact O-N 3.12Å; Q155-S158 PolarHBondContact O-OG 2.9Å; Q155-F229 HydrophobicContact CB-CB 4.23Å; Q155-F229 HydrophobicContact CB-CD1 3.98Å; Q155-F229 HydrophobicContact CB-CE1 4.48Å; Q155-F229 HydrophobicContact CB-CG 4.03Å; Q155-F229 HydrophobicContact CG-CB 4.31Å; Q155-F229 HydrophobicContact CG-CD1 4.13Å; Q155-F229 HydrophobicContact CG-CG 4.4Å; Q155-F229 VanDerWaalsContact OE1-CE1 3.28Å
156	N	92.3	Very high	92.5	Very high	71 Å²	71	38.7 Å²	38.7	38%	0.38	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-64.5	-23.6	-176.7	-69.8	-7.8	0	0	0	113	L154 S158 F229	L154-N156 PolarHBondContact O-N 3.27Å; N156-S158 VanDerWaalsContact C-N 3.35Å; N156-F229 HydrophobicContact CB-CE2 4.32Å
157	C	95	Very high	92.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-95.1	11.9	178.8	-55.2	0	0	0	0	112.8	L154 Q155 G159 F165 C173 A259	L154-C157 PolarHBondContact O-N 2.71Å; Q155-C157 PolarHBondContact O-N 3.31Å; C157-G159 VanDerWaalsContact C-N 3.3Å; C157-G159 PolarHBondContact O-N 2.93Å; C157-F165 VanDerWaalsContact O-CD1 3.29Å; C157-F165 WeakPolarHBondContact O-CD1 3.47Å; C157-F165 WeakPolarHBondContact O-CE1 3.17Å; C157-C173 HydrophobicContact CB-CB 3.59Å; C157-C173 WeakPolarHBondContact CB-SG 3.48Å; C157-C173 WeakPolarHBondContact SG-CB 3.24Å; C157-C173 CovalentContact SG-SG 2.04Å; C157-C173 PolarHBondContact SG-SG 3.41Å; C157-A259 HydrophobicContact CB-CB 3.42Å; C157-A259 VanDerWaalsContact CB-CB 3.42Å
158	S	93.9	Very high	92.9	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.028	22%	0.216	C	C	.	.	S	Bend	trans	-72.4	-19.2	-179	60.1	0	0	0	0	114.1	R151 Q155 N156 V160	R151-S158 VanDerWaalsContact CZ-O 3.3Å; R151-S158 PolarHBondContact NE-O 3.17Å; R151-S158 PolarHBondContact NH2-O 3.17Å; R151-S158 WeakPolarHBondContact O-CB 3.23Å; Q155-S158 WeakPolarHBondContact O-CB 3.45Å; Q155-S158 PolarHBondContact O-N 3.02Å; Q155-S158 VanDerWaalsContact O-N 3.12Å; Q155-S158 PolarHBondContact O-OG 2.9Å; N156-S158 VanDerWaalsContact C-N 3.35Å; S158-V160 VanDerWaalsContact C-N 3.25Å; S158-V160 PolarHBondContact O-N 2.8Å; S158-V160 PolarHBondContact OG-N 2.59Å
159	G	90.5	Very high	93	Very high	13 Å²	13	45.4 Å²	45.4	13%	0.134	24%	0.238	C	C	.	.	S	Bend	trans	79.2	2.7	-171.1	0	0	0	0	0	114.4	C157 D162	C157-G159 VanDerWaalsContact C-N 3.3Å; C157-G159 PolarHBondContact O-N 2.93Å; G159-D162 VanDerWaalsContact CA-O 3.24Å; G159-D162 WeakPolarHBondContact CA-O 3Å
160	V	88.6	Confident	92.9	Very high	107 Å²	107	45.9 Å²	45.9	65%	0.648	24%	0.243	S	C	*	.	S	Bend	trans	-93.2	-49.2	-179.8	-178.2	0	0	0	0	111.1	S158	S158-V160 VanDerWaalsContact C-N 3.25Å; S158-V160 PolarHBondContact O-N 2.8Å; S158-V160 PolarHBondContact OG-N 2.59Å
161	K	87.9	Confident	93.1	Very high	172 Å²	172	46.2 Å²	46.2	75%	0.748	24%	0.243	S	C	*	.	S	Bend	trans	-82.6	-36.4	177.3	-65.7	-176.2	-179.6	-179.9	0	112.7
162	D	90.7	Very high	93.2	Very high	26 Å²	26	44.2 Å²	44.2	14%	0.139	24%	0.236	C	C	.	.			trans	-132.2	109.5	179.3	177.8	5.5	0	0	0	107.9	G159 T164 F165 G166	G159-D162 VanDerWaalsContact CA-O 3.24Å; G159-D162 WeakPolarHBondContact CA-O 3Å; D162-T164 PolarHBondContact O-N 3.44Å; D162-T164 WeakPolarHBondContact OD1-CA 3.49Å; D162-T164 WeakPolarHBondContact OD1-CB 3.44Å; D162-T164 PolarHBondContact OD1-N 3.08Å; D162-T164 PolarHBondContact OD1-OG1 3.48Å; D162-F165 PolarHBondContact OD1-N 3.05Å; D162-G166 WeakPolarHBondContact OD2-CA 3.48Å; D162-G166 PolarHBondContact OD2-N 2.83Å
163	D	93.1	Very high	93.4	Very high	86 Å²	86	41 Å²	41	46%	0.46	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.8	-178.8	84.7	-47.7	0	0	0	112.6	I101 K105 F165	I101-D163 WeakPolarHBondContact CG2-O 3.39Å; K105-D163 WeakPolarHBondContact CE-O 3.49Å; K105-D163 IonicContact NZ-OD2 3.91Å; K105-D163 PolarHBondContact NZ-OD2 3.12Å; D163-F165 WeakPolarHBondContact O-CD2 3.12Å; D163-F165 WeakPolarHBondContact O-CE2 3.31Å
164	T	94.4	Very high	93.5	Very high	21 Å²	21	40 Å²	40	13%	0.129	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-1	175.5	73	0	0	0	0	113.3	I101 D162 G166 F167 S168	I101-T164 HydrophobicContact CD1-CG2 4.15Å; D162-T164 PolarHBondContact O-N 3.44Å; D162-T164 WeakPolarHBondContact OD1-CA 3.49Å; D162-T164 WeakPolarHBondContact OD1-CB 3.44Å; D162-T164 PolarHBondContact OD1-N 3.08Å; D162-T164 PolarHBondContact OD1-OG1 3.48Å; T164-G166 PolarHBondContact O-N 3.47Å; T164-G166 VanDerWaalsContact O-N 3.16Å; T164-F167 WeakPolarHBondContact O-CB 3.41Å; T164-F167 VanDerWaalsContact O-CD2 3.27Å; T164-F167 WeakPolarHBondContact O-CD2 3.18Å; T164-F167 PolarHBondContact O-N 2.65Å; T164-S168 WeakPolarHBondContact OG1-CB 3.22Å; T164-S168 PolarHBondContact OG1-OG 2.99Å
165	F	95.4	Very high	93.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	38	177.8	-56.7	-89.9	0	0	0	113.2	I101 M104 K105 L108 C157 D162 D163 F167 C173	I101-F165 HydrophobicContact CG1-CD2 4.48Å; I101-F165 HydrophobicContact CG2-CD2 4.24Å; I101-F165 HydrophobicContact CG2-CE2 4.2Å; M104-F165 HydrophobicContact CB-CD1 4.44Å; M104-F165 HydrophobicContact CB-CD2 3.99Å; M104-F165 HydrophobicContact CB-CE1 4.25Å; M104-F165 HydrophobicContact CB-CE2 3.78Å; M104-F165 HydrophobicContact CB-CG 4.32Å; M104-F165 HydrophobicContact CB-CZ 3.92Å; M104-F165 HydrophobicContact CE-CB 4.42Å; M104-F165 HydrophobicContact CE-CD1 3.99Å; M104-F165 HydrophobicContact CE-CG 4.25Å; K105-F165 HydrophobicContact CG-CE2 3.79Å; K105-F165 HydrophobicContact CG-CZ 4.14Å; L108-F165 HydrophobicContact CD1-CE1 3.6Å; L108-F165 HydrophobicContact CD1-CZ 4Å; C157-F165 VanDerWaalsContact O-CD1 3.29Å; C157-F165 WeakPolarHBondContact O-CD1 3.47Å; C157-F165 WeakPolarHBondContact O-CE1 3.17Å; D162-F165 PolarHBondContact OD1-N 3.05Å; D163-F165 WeakPolarHBondContact O-CD2 3.12Å; D163-F165 WeakPolarHBondContact O-CE2 3.31Å; F165-F167 HydrophobicContact CB-CD2 4.1Å; F165-F167 HydrophobicContact CB-CE2 4.32Å; F165-F167 PolarHBondContact O-N 3.48Å; F165-C173 HydrophobicContact CB-CB 4.22Å; F165-C173 WeakPolarHBondContact O-CB 3.22Å; F165-C173 PolarHBondContact O-N 2.82Å; F165-C173 PolarHBondContact O-SG 3.06Å
166	G	94.6	Very high	93.8	Very high	1 Å²	1	36 Å²	36	1%	0.01	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-4.7	-179.4	0	0	0	0	0	116.2	D162 T164 S168 K169 G170 Q171	D162-G166 WeakPolarHBondContact OD2-CA 3.48Å; D162-G166 PolarHBondContact OD2-N 2.83Å; T164-G166 PolarHBondContact O-N 3.47Å; T164-G166 VanDerWaalsContact O-N 3.16Å; G166-S168 VanDerWaalsContact C-N 3.34Å; G166-S168 PolarHBondContact O-N 3.31Å; G166-K169 PolarHBondContact O-N 3.09Å; G166-K169 VanDerWaalsContact O-N 3.15Å; G166-G170 PolarHBondContact O-N 3.14Å; G166-Q171 CarbonylContact C-O 3.47Å; G166-Q171 VanDerWaalsContact CA-O 3.26Å; G166-Q171 WeakPolarHBondContact CA-O 3.37Å; G166-Q171 CarbonylContact O-C 3.6Å; G166-Q171 VanDerWaalsContact O-C 3.32Å; G166-Q171 WeakPolarHBondContact O-CA 3.43Å; G166-Q171 PolarHBondContact O-N 3.47Å
167	F	94.7	Very high	94	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-62	-39.1	179.8	-77	-93.3	0	0	0	112.5	P80 I87 F89 Y97 Y100 T164 F165 K169 G170 P172	P80-F167 HydrophobicContact CG-CZ 4.14Å; I87-F167 HydrophobicContact CG2-CE1 3.92Å; F89-F167 AromaticContact CD1-CD1 3.88Å; F89-F167 HydrophobicContact CD1-CD1 3.88Å; F89-F167 HydrophobicContact CD1-CE1 4.04Å; F89-F167 HydrophobicContact CD2-CD1 4.2Å; F89-F167 AromaticContact CE1-CD1 3.72Å; F89-F167 HydrophobicContact CE1-CD1 3.72Å; F89-F167 AromaticContact CE1-CE1 3.91Å; F89-F167 HydrophobicContact CE1-CE1 3.91Å; F89-F167 HydrophobicContact CE2-CB 4.44Å; F89-F167 HydrophobicContact CE2-CD1 4.06Å; F89-F167 VanDerWaalsContact CE2-O 3.31Å; F89-F167 WeakPolarHBondContact CE2-O 3.45Å; F89-F167 HydrophobicContact CG-CD1 4.11Å; F89-F167 AromaticContact CZ-CD1 3.82Å; F89-F167 HydrophobicContact CZ-CD1 3.82Å; F89-F167 HydrophobicContact CZ-CE1 4.42Å; Y97-F167 HydrophobicContact CD1-CB 4.36Å; Y97-F167 HydrophobicContact CD2-CB 3.77Å; Y97-F167 HydrophobicContact CE2-CB 4.36Å; Y97-F167 HydrophobicContact CG-CB 3.77Å; Y97-F167 HydrophobicContact CG-CG 4.47Å; Y100-F167 HydrophobicContact CD2-CD1 4.14Å; Y100-F167 AromaticContact CD2-CE1 3.65Å; Y100-F167 HydrophobicContact CD2-CE1 3.65Å; Y100-F167 HydrophobicContact CD2-CZ 4.32Å; Y100-F167 HydrophobicContact CE2-CE1 4.5Å; Y100-F167 AromaticContact CG-CE1 3.95Å; Y100-F167 HydrophobicContact CG-CE1 3.95Å; Y100-F167 HydrophobicContact CG-CZ 4.15Å; T164-F167 WeakPolarHBondContact O-CB 3.41Å; T164-F167 VanDerWaalsContact O-CD2 3.27Å; T164-F167 WeakPolarHBondContact O-CD2 3.18Å; T164-F167 PolarHBondContact O-N 2.65Å; F165-F167 HydrophobicContact CB-CD2 4.1Å; F165-F167 HydrophobicContact CB-CE2 4.32Å; F165-F167 PolarHBondContact O-N 3.48Å; F167-K169 PolarHBondContact O-N 2.86Å; F167-K169 VanDerWaalsContact O-N 3.16Å; F167-G170 PolarHBondContact O-N 3.25Å; F167-G170 VanDerWaalsContact O-N 3.12Å; F167-P172 HydrophobicContact CD1-CB 4.08Å; F167-P172 HydrophobicContact CE1-CB 3.84Å; F167-P172 HydrophobicContact CE2-CB 4.3Å; F167-P172 HydrophobicContact CG-CB 4.42Å; F167-P172 HydrophobicContact CZ-CB 3.95Å
168	S	93.6	Very high	94.1	Very high	41 Å²	41	34.4 Å²	34.4	29%	0.287	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-62.8	-21	177.5	60.8	0	0	0	0	114.2	V91 T164 G166	V91-S168 VanDerWaalsContact CG1-O 3.26Å; V91-S168 WeakPolarHBondContact CG1-O 3.14Å; T164-S168 WeakPolarHBondContact OG1-CB 3.22Å; T164-S168 PolarHBondContact OG1-OG 2.99Å; G166-S168 VanDerWaalsContact C-N 3.34Å; G166-S168 PolarHBondContact O-N 3.31Å
169	K	93.6	Very high	94.1	Very high	140 Å²	140	37.6 Å²	37.6	61%	0.609	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-102.1	1.8	-179.7	-63.4	175.7	-176.4	168.8	0	112.8	G166 F167 Q171	G166-K169 PolarHBondContact O-N 3.09Å; G166-K169 VanDerWaalsContact O-N 3.15Å; F167-K169 PolarHBondContact O-N 2.86Å; F167-K169 VanDerWaalsContact O-N 3.16Å; K169-Q171 HydrophobicContact CB-CG 4.34Å; K169-Q171 PolarHBondContact O-N 2.89Å
170	G	93	Very high	94.4	Very high	10 Å²	10	42.8 Å²	42.8	10%	0.103	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	18.7	-170.5	0	0	0	0	0	113.6	G166 F167 P172	G166-G170 PolarHBondContact O-N 3.14Å; F167-G170 PolarHBondContact O-N 3.25Å; F167-G170 VanDerWaalsContact O-N 3.12Å; G170-P172 VanDerWaalsContact C-CD 3.43Å; G170-P172 VanDerWaalsContact O-CD 3.26Å; G170-P172 WeakPolarHBondContact O-CD 3.29Å
171	Q	95.2	Very high	94.7	Very high	64 Å²	64	38.3 Å²	38.3	30%	0.299	18%	0.184	S	C	.	.			trans	-117.2	64.4	-178.9	-61.4	-174.8	-25.4	0	0	110.8	G166 K169 F262 T263	G166-Q171 CarbonylContact C-O 3.47Å; G166-Q171 VanDerWaalsContact CA-O 3.26Å; G166-Q171 WeakPolarHBondContact CA-O 3.37Å; G166-Q171 CarbonylContact O-C 3.6Å; G166-Q171 VanDerWaalsContact O-C 3.32Å; G166-Q171 WeakPolarHBondContact O-CA 3.43Å; G166-Q171 PolarHBondContact O-N 3.47Å; K169-Q171 HydrophobicContact CB-CG 4.34Å; K169-Q171 PolarHBondContact O-N 2.89Å; Q171-F262 CarbonylContact C-O 3.57Å; Q171-F262 WeakPolarHBondContact CA-O 3.08Å; Q171-F262 WeakPolarHBondContact CB-O 3.37Å; Q171-T263 WeakPolarHBondContact CG-O 3.3Å; Q171-T263 PolarHBondContact NE2-O 3.15Å
172	P	95.8	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.			trans	-64	140.5	-167.4	28.4	-35.2	0	0	0	111.8	F89 F167 G170 F262 L265 F298	F89-P172 HydrophobicContact CE1-CB 4.08Å; F89-P172 HydrophobicContact CE1-CG 4.09Å; F89-P172 HydrophobicContact CZ-CB 4.07Å; F89-P172 HydrophobicContact CZ-CG 4.06Å; F167-P172 HydrophobicContact CD1-CB 4.08Å; F167-P172 HydrophobicContact CE1-CB 3.84Å; F167-P172 HydrophobicContact CE2-CB 4.3Å; F167-P172 HydrophobicContact CG-CB 4.42Å; F167-P172 HydrophobicContact CZ-CB 3.95Å; G170-P172 VanDerWaalsContact C-CD 3.43Å; G170-P172 VanDerWaalsContact O-CD 3.26Å; G170-P172 WeakPolarHBondContact O-CD 3.29Å; P172-F262 PolarHBondContact O-N 3.44Å; P172-L265 HydrophobicContact CG-CD1 3.92Å; P172-F298 HydrophobicContact CB-CE1 3.99Å; P172-F298 HydrophobicContact CG-CD1 4.01Å; P172-F298 HydrophobicContact CG-CE1 3.61Å; P172-F298 HydrophobicContact CG-CZ 4.12Å
173	C	96.3	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.5	169.9	-68	0	0	0	0	111.5	M104 C157 F165 I260	M104-C173 HydrophobicContact CE-CB 4.49Å; M104-C173 WeakPolarHBondContact CE-O 3.14Å; C157-C173 HydrophobicContact CB-CB 3.59Å; C157-C173 WeakPolarHBondContact CB-SG 3.48Å; C157-C173 WeakPolarHBondContact SG-CB 3.24Å; C157-C173 CovalentContact SG-SG 2.04Å; C157-C173 PolarHBondContact SG-SG 3.41Å; F165-C173 HydrophobicContact CB-CB 4.22Å; F165-C173 WeakPolarHBondContact O-CB 3.22Å; F165-C173 PolarHBondContact O-N 2.82Å; F165-C173 PolarHBondContact O-SG 3.06Å; C173-I260 CarbonylContact C-O 3.48Å; C173-I260 WeakPolarHBondContact CA-O 3.26Å
174	L	97.2	Very high	95.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.7	163.8	-58.8	-176.2	0	0	0	109.7	P80 I87 A259 I260 F262 F294 V296 F298	P80-L174 HydrophobicContact CG-CD2 4.41Å; I87-L174 HydrophobicContact CD1-CD2 3.52Å; L174-A259 CarbonylContact O-C 3.59Å; L174-A259 VanDerWaalsContact O-CA 3.28Å; L174-A259 WeakPolarHBondContact O-CA 3.5Å; L174-I260 PolarHBondContact N-O 3.46Å; L174-I260 PolarHBondContact O-N 2.83Å; L174-F262 HydrophobicContact CD1-CE2 3.76Å; L174-F262 HydrophobicContact CD1-CZ 4.33Å; L174-F262 HydrophobicContact CG-CE2 3.92Å; L174-F294 HydrophobicContact CD1-CE2 4.05Å; L174-F294 HydrophobicContact CD1-CZ 4.35Å; L174-V296 HydrophobicContact CD1-CB 4.39Å; L174-V296 HydrophobicContact CD1-CG1 3.99Å; L174-V296 HydrophobicContact CD1-CG2 4.25Å; L174-F298 HydrophobicContact CD1-CE2 4.21Å; L174-F298 HydrophobicContact CD1-CZ 3.87Å; L174-F298 HydrophobicContact CD2-CZ 3.97Å; L174-F298 HydrophobicContact CG-CZ 3.97Å
175	I	97.6	Very high	95.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.4	171.1	-66.3	162.9	0	0	0	108.4	H78 T79 M104 F107 L108 L154 L257 A259	H78-I175 CarbonylContact C-O 3.59Å; H78-I175 VanDerWaalsContact CA-O 3.24Å; H78-I175 WeakPolarHBondContact CA-O 3.47Å; T79-I175 PolarHBondContact N-O 3.29Å; T79-I175 PolarHBondContact O-N 3.49Å; M104-I175 HydrophobicContact CE-CB 4.2Å; M104-I175 HydrophobicContact CE-CD1 3.37Å; M104-I175 HydrophobicContact CE-CG1 3.54Å; M104-I175 HydrophobicContact SD-CB 4.35Å; M104-I175 HydrophobicContact SD-CD1 3.83Å; M104-I175 HydrophobicContact SD-CG1 4.22Å; F107-I175 HydrophobicContact CD1-CG2 4.28Å; F107-I175 HydrophobicContact CE1-CG2 3.69Å; L108-I175 HydrophobicContact CD1-CD1 3.65Å; L108-I175 HydrophobicContact CD2-CD1 3.93Å; L108-I175 HydrophobicContact CG-CD1 3.83Å; L154-I175 HydrophobicContact CD1-CD1 4.16Å; L154-I175 HydrophobicContact CD1-CG1 4.34Å; I175-L257 HydrophobicContact CG2-CB 4.1Å; I175-L257 HydrophobicContact CG2-CD1 3.98Å; I175-L257 HydrophobicContact CG2-CD2 4.19Å; I175-L257 HydrophobicContact CG2-CG 4.32Å; I175-A259 HydrophobicContact CG1-CB 4.3Å
176	V	97.2	Very high	95.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144.6	-173.6	-171.5	0	0	0	0	110.4	L76 S77 H78 I210 F237 V258 I260 F294	L76-V176 HydrophobicContact CD1-CG1 3.48Å; L76-V176 VanDerWaalsContact CD1-CG1 3.48Å; L76-V176 HydrophobicContact CD2-CG1 4.14Å; L76-V176 HydrophobicContact CG-CG1 3.67Å; S77-V176 WeakPolarHBondContact O-CA 3.47Å; S77-V176 WeakPolarHBondContact O-CG1 3.17Å; H78-V176 HydrophobicContact CB-CG2 4.1Å; V176-I210 HydrophobicContact CB-CD1 4.2Å; V176-I210 HydrophobicContact CG1-CD1 3.69Å; V176-I210 HydrophobicContact CG2-CD1 4.43Å; V176-F237 HydrophobicContact CG1-CZ 4.17Å; V176-V258 PolarHBondContact N-O 3.26Å; V176-V258 PolarHBondContact O-N 2.84Å; V176-I260 HydrophobicContact CB-CD1 4.42Å; V176-I260 HydrophobicContact CG2-CD1 3.5Å; V176-I260 HydrophobicContact CG2-CG1 3.88Å; V176-F294 HydrophobicContact CB-CE1 4.36Å; V176-F294 HydrophobicContact CG1-CD1 4.36Å; V176-F294 HydrophobicContact CG1-CE1 3.64Å; V176-F294 HydrophobicContact CG2-CE1 3.69Å; V176-F294 HydrophobicContact CG2-CZ 3.75Å
177	K	96	Very high	95.2	Very high	36 Å²	36	39.1 Å²	39.1	16%	0.157	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.2	-178.4	80.8	-174.4	-175.5	178.5	0	111.3	S77 F107 Q255 L257	S77-K177 PolarHBondContact N-O 3.05Å; S77-K177 PolarHBondContact O-N 2.03Å; S77-K177 WeakPolarHBondContact OG-CE 3.35Å; S77-K177 WeakPolarHBondContact OG-CG 3.26Å; S77-K177 PolarHBondContact OG-O 3.31Å; F107-K177 HydrophobicContact CE2-CD 3.97Å; F107-K177 HydrophobicContact CZ-CD 3.79Å; K177-Q255 VanDerWaalsContact CG-NE2 3.29Å; K177-L257 HydrophobicContact CB-CD2 3.71Å
178	L	96.1	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	142.6	174.3	-162.1	67.8	0	0	0	111	P74 L76 R180 F184 P186 Y242 Q255 V277	P74-L178 HydrophobicContact CB-CD1 4.03Å; P74-L178 HydrophobicContact CB-CD2 4.39Å; P74-L178 HydrophobicContact CB-CG 4Å; P74-L178 HydrophobicContact CG-CD1 4.07Å; P74-L178 HydrophobicContact CG-CD2 4.21Å; P74-L178 HydrophobicContact CG-CG 4.25Å; L76-L178 HydrophobicContact CD1-CD1 4.21Å; L178-R180 PolarHBondContact O-N 3.19Å; L178-F184 HydrophobicContact CD2-CE1 4.24Å; L178-P186 HydrophobicContact CD2-CG 4.31Å; L178-Y242 HydrophobicContact CD2-CE1 4.38Å; L178-Y242 WeakPolarHBondContact CD2-OH 3.4Å; L178-Q255 PolarHBondContact O-NE2 2.69Å; L178-V277 HydrophobicContact CD1-CG1 4.4Å
179	N	95.8	Very high	95	Very high	71 Å²	71	39.5 Å²	39.5	38%	0.38	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-64.2	135.7	176.6	-78.5	-6.1	0	0	0	111.4	P74 G75 I181	P74-N179 HydrophobicContact CB-CB 4.5Å; G75-N179 WeakPolarHBondContact O-CB 3.31Å; G75-N179 PolarHBondContact O-N 3Å; N179-I181 PolarHBondContact O-N 2.93Å
180	R	95.2	Very high	94.7	Very high	123 Å²	123	38.1 Å²	38.1	46%	0.464	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-76.3	120.7	-179.8	-60.3	-178.4	-68.8	-176.1	2.3	110.1	L178 Y244 Y253 Q255	L178-R180 PolarHBondContact O-N 3.19Å; R180-Y244 HydrophobicContact CB-CD1 3.82Å; R180-Y244 HydrophobicContact CB-CE1 4.01Å; R180-Y244 HydrophobicContact CB-CG 4.36Å; R180-Y253 HydrophobicContact CG-CD1 4.36Å; R180-Y253 HydrophobicContact CG-CE1 3.98Å; R180-Q255 HydrophobicContact CG-CB 4.37Å
181	I	94.9	Very high	93.9	Very high	13 Å²	13	42.2 Å²	42.2	7%	0.067	21%	0.207	C	C	.	.			trans	-122.6	129.3	173.2	-59.4	172.1	0	0	0	108	V71 P74 N179 N183 F184	V71-I181 HydrophobicContact CG2-CG2 4.33Å; V71-I181 WeakPolarHBondContact O-CD1 3.34Å; P74-I181 HydrophobicContact CB-CD1 3.72Å; P74-I181 HydrophobicContact CG-CD1 4.44Å; N179-I181 PolarHBondContact O-N 2.93Å; I181-N183 PolarHBondContact O-N 2.65Å; I181-F184 HydrophobicContact CB-CB 3.61Å; I181-F184 HydrophobicContact CB-CG 4.24Å; I181-F184 HydrophobicContact CG2-CB 3.87Å; I181-F184 WeakPolarHBondContact O-CB 3.39Å; I181-F184 PolarHBondContact O-N 2.97Å
182	V	94.4	Very high	92.8	Very high	19 Å²	19	44.6 Å²	44.6	12%	0.115	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-61	129.7	-179.9	178.6	0	0	0	0	109.6	Q68 L138 F184 Y244	Q68-V182 PolarHBondContact NE2-O 3.45Å; L138-V182 HydrophobicContact CD1-CG1 4Å; L138-V182 HydrophobicContact CD2-CG1 4.01Å; V182-F184 PolarHBondContact O-N 3.3Å; V182-Y244 CarbonylContact C-O 3.48Å; V182-Y244 WeakPolarHBondContact CA-O 3.31Å; V182-Y244 HydrophobicContact CG2-CD1 4.11Å; V182-Y244 HydrophobicContact CG2-CE1 4.22Å
183	N	92.8	Very high	91.5	Very high	75 Å²	75	50.1 Å²	50.1	40%	0.401	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	17.5	-177.9	-154.5	30	0	0	0	115.9	L138 I181 Y244	L138-N183 HydrophobicContact CD1-CB 4.28Å; I181-N183 PolarHBondContact O-N 2.65Å; N183-Y244 PolarHBondContact N-O 3.38Å
184	F	94.4	Very high	90.5	Very high	23 Å²	23	53.8 Å²	53.8	10%	0.101	28%	0.28	C	S	.	.			trans	-78.1	134.3	176	-179.1	-105.2	0	0	0	111.6	P74 L178 I181 V182 P186 P243 N281 I282	P74-F184 HydrophobicContact CB-CE1 4.48Å; P74-F184 HydrophobicContact CG-CD1 4.5Å; P74-F184 HydrophobicContact CG-CE1 3.69Å; P74-F184 HydrophobicContact CG-CE2 4.35Å; P74-F184 HydrophobicContact CG-CZ 3.61Å; L178-F184 HydrophobicContact CD2-CE1 4.24Å; I181-F184 HydrophobicContact CB-CB 3.61Å; I181-F184 HydrophobicContact CB-CG 4.24Å; I181-F184 HydrophobicContact CG2-CB 3.87Å; I181-F184 WeakPolarHBondContact O-CB 3.39Å; I181-F184 PolarHBondContact O-N 2.97Å; V182-F184 PolarHBondContact O-N 3.3Å; F184-P186 HydrophobicContact CD1-CG 3.88Å; F184-P186 HydrophobicContact CE1-CB 3.86Å; F184-P186 HydrophobicContact CE1-CG 3.58Å; F184-P186 HydrophobicContact CZ-CB 4.48Å; F184-P243 WeakPolarHBondContact O-CA 3.33Å; F184-N281 WeakPolarHBondContact CE2-ND2 3.42Å; F184-I282 HydrophobicContact CE1-CD1 4.39Å; F184-I282 HydrophobicContact CZ-CD1 3.97Å
185	R	95.3	Very high	90	Very high	92 Å²	92	54.1 Å²	54.1	35%	0.347	28%	0.282	S	S	.	.			trans	-121.4	100.4	177.5	-67.6	-171	-176.1	-160.8	4	109.2	Y132 D134 K187 P243 N281	Y132-R185 HydrophobicContact CD1-CB 4.24Å; Y132-R185 HydrophobicContact CD1-CG 4.17Å; Y132-R185 HydrophobicContact CE1-CB 3.67Å; Y132-R185 HydrophobicContact CE1-CG 4.12Å; D134-R185 IonicContact OD1-CZ 3.68Å; D134-R185 IonicContact OD1-NE 3.18Å; D134-R185 IonicContact OD1-NH1 3.96Å; D134-R185 IonicContact OD1-NH2 2.97Å; D134-R185 PolarHBondContact OD1-NH2 2.86Å; D134-R185 IonicContact OD2-CZ 2.68Å; D134-R185 IonicContact OD2-NH1 3.99Å; D134-R185 PolarHBondContact OD2-NH1 3.1Å; D134-R185 IonicContact OD2-NH2 3.84Å; D134-R185 PolarHBondContact OD2-NH2 3.45Å; R185-K187 PolarHBondContact O-N 2.8Å; R185-P243 HydrophobicContact CG-CB 4.19Å; R185-N281 PolarHBondContact O-ND2 3.38Å
186	P	95.1	Very high	89.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.			trans	-63.5	131.2	179.4	-14.4	24	0	0	0	111.1	Y132 L178 F184 I208 L239 Y242	Y132-P186 PolarHBondContact OH-O 2.75Å; L178-P186 HydrophobicContact CD2-CG 4.31Å; F184-P186 HydrophobicContact CD1-CG 3.88Å; F184-P186 HydrophobicContact CE1-CB 3.86Å; F184-P186 HydrophobicContact CE1-CG 3.58Å; F184-P186 HydrophobicContact CZ-CB 4.48Å; P186-I208 HydrophobicContact CB-CD1 3.63Å; P186-I208 HydrophobicContact CB-CG1 3.37Å; P186-I208 HydrophobicContact CG-CG1 4.4Å; P186-L239 HydrophobicContact CB-CD2 4.12Å; P186-L239 HydrophobicContact CG-CD2 4.46Å; P186-L239 WeakPolarHBondContact O-CD2 3.38Å; P186-Y242 VanDerWaalsContact CD-CG 3.4Å; P186-Y242 HydrophobicContact CG-CD1 3.66Å; P186-Y242 HydrophobicContact CG-CD2 3.71Å; P186-Y242 HydrophobicContact CG-CE1 3.67Å; P186-Y242 HydrophobicContact CG-CE2 3.72Å; P186-Y242 HydrophobicContact CG-CG 3.68Å
187	K	94.8	Very high	88.9	Confident	114 Å²	114	61.4 Å²	61.4	50%	0.496	32%	0.322	S	S	.	.			trans	-104.4	122	-179.7	-66.5	-178.2	-179.1	-179.5	0	110.7	R185 I208 G279 D280 N281	R185-K187 PolarHBondContact O-N 2.8Å; K187-I208 WeakPolarHBondContact O-CD1 3.3Å; K187-G279 CarbonylContact O-C 3.41Å; K187-G279 WeakPolarHBondContact O-CA 3.48Å; K187-D280 HydrophobicContact CB-CB 4.02Å; K187-D280 PolarHBondContact O-N 3.32Å; K187-N281 PolarHBondContact N-OD1 3.5Å
188	P	93.6	Very high	88.4	Confident	30 Å²	30	62 Å²	62	20%	0.195	33%	0.334	C	S	.	.			trans	-55.7	152.3	175.3	-24.4	33.9	0	0	0	111.7	T190 F204 I208 L239	P188-T190 PolarHBondContact O-N 3.32Å; P188-F204 HydrophobicContact CB-CB 4.13Å; P188-I208 HydrophobicContact CB-CD1 4.38Å; P188-I208 HydrophobicContact CG-CD1 4.06Å; P188-I208 VanDerWaalsContact N-CD1 3.26Å; P188-L239 HydrophobicContact CG-CD1 3.91Å
189	P	91.7	Very high	87.9	Confident	18 Å²	18	62.5 Å²	62.5	12%	0.117	34%	0.337	C	S	.	.			trans	-70.1	119.8	-176	27.4	-32	0	0	0	110.3	L195 F204 P209 Y278 D280	P189-L195 HydrophobicContact CB-CD1 4.5Å; P189-L195 HydrophobicContact CB-CD2 4.01Å; P189-L195 HydrophobicContact CG-CD1 4.32Å; P189-L195 HydrophobicContact CG-CD2 3.98Å; P189-F204 HydrophobicContact CG-CD2 3.67Å; P189-F204 HydrophobicContact CG-CE2 4Å; P189-F204 HydrophobicContact CG-CG 4.32Å; P189-P209 HydrophobicContact CG-CG 3.9Å; P189-Y278 WeakPolarHBondContact CD-O 3.27Å; P189-D280 WeakPolarHBondContact CA-OD1 3.49Å
190	T	85.8	Confident	87.3	Confident	112 Å²	112	63.8 Å²	63.8	69%	0.687	34%	0.339	S	S	*	.			trans	-85.5	-34.5	175.2	-52.2	0	0	0	0	110.9	P188 K192 D280	P188-T190 PolarHBondContact O-N 3.32Å; T190-K192 PolarHBondContact O-N 3.38Å; T190-D280 VanDerWaalsContact CB-OD2 3.27Å; T190-D280 WeakPolarHBondContact CB-OD2 3.22Å; T190-D280 PolarHBondContact N-OD1 2.95Å; T190-D280 PolarHBondContact N-OD2 3.48Å; T190-D280 PolarHBondContact OG1-OD2 3.16Å
191	N	76.3	Confident	86.5	Confident	96 Å²	96	61 Å²	61	51%	0.513	35%	0.349	S	S	.	.			trans	-85.8	103.2	-177.5	-167.6	-7	0	0	0	112.2	T193	N191-T193 VanDerWaalsContact C-N 3.3Å; N191-T193 PolarHBondContact O-N 3.46Å; N191-T193 PolarHBondContact OD1-N 3.24Å; N191-T193 PolarHBondContact OD1-OG1 3.2Å
192	K	72.1	Confident	86	Confident	114 Å²	114	65.8 Å²	65.8	50%	0.496	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-72.4	-14.9	-176.7	-62.6	-176	-179.4	-177.5	0	114.5	T190	T190-K192 PolarHBondContact O-N 3.38Å
193	T	68.4	Low	85.5	Confident	116 Å²	116	69.2 Å²	69.2	71%	0.712	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-78.4	-27.3	-176.4	56.8	0	0	0	0	113.4	N191 L195	N191-T193 VanDerWaalsContact C-N 3.3Å; N191-T193 PolarHBondContact O-N 3.46Å; N191-T193 PolarHBondContact OD1-N 3.24Å; N191-T193 PolarHBondContact OD1-OG1 3.2Å; T193-L195 VanDerWaalsContact C-N 3.3Å
194	A	75.8	Confident	85.3	Confident	76 Å²	76	66.5 Å²	66.5	63%	0.628	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-84.1	-2.9	178.9	0	0	0	0	0	113.7
195	L	86.6	Confident	85.1	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.042	40%	0.402	C	S	.	.	S	Bend	trans	-82.2	146.8	179.8	-67.3	176	0	0	0	111.4	P189 T193 L199 K200 F204 Y278	P189-L195 HydrophobicContact CB-CD1 4.5Å; P189-L195 HydrophobicContact CB-CD2 4.01Å; P189-L195 HydrophobicContact CG-CD1 4.32Å; P189-L195 HydrophobicContact CG-CD2 3.98Å; T193-L195 VanDerWaalsContact C-N 3.3Å; L195-L199 HydrophobicContact CB-CB 4.13Å; L195-L199 HydrophobicContact CD1-CB 4.46Å; L195-L199 HydrophobicContact CD2-CD1 4.36Å; L195-K200 HydrophobicContact CB-CG 4.38Å; L195-K200 WeakPolarHBondContact O-CE 3.47Å; L195-F204 HydrophobicContact CD1-CE2 3.66Å; L195-F204 HydrophobicContact CD1-CZ 4.31Å; L195-Y278 HydrophobicContact CD2-CD1 3.87Å; L195-Y278 HydrophobicContact CD2-CG 3.95Å
196	P	86.8	Confident	85	Confident	28 Å²	28	70.6 Å²	70.6	18%	0.182	40%	0.4	C	S	.	.			trans	-63.2	154.6	170.8	28.3	-34.8	0	0	0	110.5	A198 L199 K200 Y278	P196-A198 PolarHBondContact O-N 2.94Å; P196-A198 VanDerWaalsContact O-N 3.09Å; P196-L199 HydrophobicContact CG-CB 4.02Å; P196-L199 HydrophobicContact CG-CD1 3.79Å; P196-L199 HydrophobicContact CG-CG 3.84Å; P196-L199 WeakPolarHBondContact O-CA 3.38Å; P196-L199 PolarHBondContact O-N 3.29Å; P196-K200 PolarHBondContact O-N 3.36Å; P196-Y278 HydrophobicContact CG-CE1 4.34Å; P196-Y278 HydrophobicContact CG-CE2 4.25Å
197	D	85.4	Confident	85	Confident	125 Å²	125	71.9 Å²	71.9	67%	0.668	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-34.7	-174.9	-61.8	-43	0	0	0	113.1	L199 K200	D197-L199 PolarHBondContact O-N 3.12Å; D197-K200 PolarHBondContact O-N 3.25Å; D197-K200 WeakPolarHBondContact OD1-CD 3.38Å; D197-K200 WeakPolarHBondContact OD1-CE 3.41Å; D197-K200 IonicContact OD1-NZ 2.74Å; D197-K200 PolarHBondContact OD1-NZ 3.13Å
198	A	84.4	Confident	85.1	Confident	50 Å²	50	66.4 Å²	66.4	41%	0.413	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.4	175.8	0	0	0	0	0	114.9	P196 K202	P196-A198 PolarHBondContact O-N 2.94Å; P196-A198 VanDerWaalsContact O-N 3.09Å; A198-K202 VanDerWaalsContact O-CE 3.28Å; A198-K202 WeakPolarHBondContact O-CE 3.37Å; A198-K202 PolarHBondContact O-NZ 2.97Å
199	L	86.1	Confident	85.2	Confident	10 Å²	10	65 Å²	65	5%	0.052	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-14.1	178.5	-66.6	-172.7	0	0	0	112.6	L195 P196 D197 K202 F204 P209 H211 Y278	L195-L199 HydrophobicContact CB-CB 4.13Å; L195-L199 HydrophobicContact CD1-CB 4.46Å; L195-L199 HydrophobicContact CD2-CD1 4.36Å; P196-L199 HydrophobicContact CG-CB 4.02Å; P196-L199 HydrophobicContact CG-CD1 3.79Å; P196-L199 HydrophobicContact CG-CG 3.84Å; P196-L199 WeakPolarHBondContact O-CA 3.38Å; P196-L199 PolarHBondContact O-N 3.29Å; D197-L199 PolarHBondContact O-N 3.12Å; L199-K202 PolarHBondContact O-N 3.22Å; L199-F204 HydrophobicContact CB-CZ 4.02Å; L199-F204 HydrophobicContact CD2-CE1 4.15Å; L199-F204 HydrophobicContact CD2-CZ 4.12Å; L199-F204 HydrophobicContact CG-CZ 4.47Å; L199-P209 HydrophobicContact CD1-CB 4.18Å; L199-P209 HydrophobicContact CD1-CG 4.46Å; L199-P209 HydrophobicContact CD2-CB 4.42Å; L199-H211 HydrophobicContact CD1-CB 3.83Å; L199-H211 HydrophobicContact CG-CB 4.19Å; L199-Y278 HydrophobicContact CD1-CD2 3.78Å; L199-Y278 HydrophobicContact CD1-CE2 4.09Å; L199-Y278 HydrophobicContact CD1-CG 4.3Å
200	K	84.1	Confident	85.4	Confident	98 Å²	98	64.2 Å²	64.2	43%	0.426	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	138.9	176.6	-71.6	-177.7	-171.3	167.1	0	110.2	L195 P196 D197 K202	L195-K200 HydrophobicContact CB-CG 4.38Å; L195-K200 WeakPolarHBondContact O-CE 3.47Å; P196-K200 PolarHBondContact O-N 3.36Å; D197-K200 PolarHBondContact O-N 3.25Å; D197-K200 WeakPolarHBondContact OD1-CD 3.38Å; D197-K200 WeakPolarHBondContact OD1-CE 3.41Å; D197-K200 IonicContact OD1-NZ 2.74Å; D197-K200 PolarHBondContact OD1-NZ 3.13Å; K200-K202 PolarHBondContact O-N 2.74Å
201	G	78.2	Confident	85.9	Confident	65 Å²	65	60.5 Å²	60.5	67%	0.67	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-9.4	-179.7	0	0	0	0	0	115.4
202	K	83.8	Confident	86.8	Confident	112 Å²	112	56 Å²	56	49%	0.487	32%	0.318	S	S	.	.			trans	-80.1	148.6	173.7	-65.3	-176.7	178.8	164.6	0	111.4	A198 L199 K200 F204	A198-K202 VanDerWaalsContact O-CE 3.28Å; A198-K202 WeakPolarHBondContact O-CE 3.37Å; A198-K202 PolarHBondContact O-NZ 2.97Å; L199-K202 PolarHBondContact O-N 3.22Å; K200-K202 PolarHBondContact O-N 2.74Å; K202-F204 HydrophobicContact CB-CE1 4.09Å; K202-F204 HydrophobicContact CB-CE2 4.39Å; K202-F204 HydrophobicContact CB-CZ 3.79Å
203	T	84.6	Confident	87.9	Confident	91 Å²	91	55 Å²	55	56%	0.558	31%	0.314	S	S	*	.			trans	-101.7	133.2	172.3	-51.3	0	0	0	0	108.9	E205 Y207	T203-E205 HydrophobicContact CG2-CG 3.74Å; T203-Y207 PolarHBondContact O-OH 2.84Å
204	F	89.1	Confident	89.1	Confident	19 Å²	19	51.5 Å²	51.5	8%	0.083	29%	0.29	C	S	.	.			trans	-108.8	76.7	-177.8	-54.1	-73.1	0	0	0	109.5	P188 P189 L195 L199 K202 N206 Y207 P209	P188-F204 HydrophobicContact CB-CB 4.13Å; P189-F204 HydrophobicContact CG-CD2 3.67Å; P189-F204 HydrophobicContact CG-CE2 4Å; P189-F204 HydrophobicContact CG-CG 4.32Å; L195-F204 HydrophobicContact CD1-CE2 3.66Å; L195-F204 HydrophobicContact CD1-CZ 4.31Å; L199-F204 HydrophobicContact CB-CZ 4.02Å; L199-F204 HydrophobicContact CD2-CE1 4.15Å; L199-F204 HydrophobicContact CD2-CZ 4.12Å; L199-F204 HydrophobicContact CG-CZ 4.47Å; K202-F204 HydrophobicContact CB-CE1 4.09Å; K202-F204 HydrophobicContact CB-CE2 4.39Å; K202-F204 HydrophobicContact CB-CZ 3.79Å; F204-N206 PolarHBondContact O-N 3.06Å; F204-Y207 HydrophobicContact CB-CE1 4.35Å; F204-Y207 HydrophobicContact CD1-CE1 4.37Å; F204-Y207 AromaticContact CD1-CE2 3.63Å; F204-Y207 HydrophobicContact CD1-CE2 3.63Å; F204-Y207 AromaticContact CD1-CZ 3.52Å; F204-Y207 VanDerWaalsContact CD1-OH 3.25Å; F204-Y207 WeakPolarHBondContact CD1-OH 3.4Å; F204-Y207 HydrophobicContact CE1-CE2 4.37Å; F204-P209 HydrophobicContact CD1-CB 3.6Å; F204-P209 HydrophobicContact CD1-CG 3.51Å; F204-P209 HydrophobicContact CD2-CG 4.28Å; F204-P209 HydrophobicContact CE1-CB 3.43Å; F204-P209 VanDerWaalsContact CE1-CB 3.43Å; F204-P209 HydrophobicContact CE1-CG 3.57Å; F204-P209 HydrophobicContact CE2-CG 4.31Å; F204-P209 HydrophobicContact CG-CB 4.47Å; F204-P209 HydrophobicContact CG-CG 3.91Å; F204-P209 HydrophobicContact CZ-CB 4.18Å; F204-P209 HydrophobicContact CZ-CG 3.98Å
205	E	89.8	Confident	89.9	Confident	141 Å²	141	51.6 Å²	51.6	66%	0.659	28%	0.277	S	S	*	.	S	Bend	trans	-79.4	107.9	-179	-63.1	-173.7	-177.8	0	0	110.5	T203 Y207	T203-E205 HydrophobicContact CG2-CG 3.74Å; E205-Y207 VanDerWaalsContact C-N 3.27Å; E205-Y207 VanDerWaalsContact O-CD1 3.31Å; E205-Y207 WeakPolarHBondContact O-CD1 3.43Å; E205-Y207 PolarHBondContact O-N 2.79Å
206	N	93.7	Very high	90	Very high	59 Å²	59	55.4 Å²	55.4	32%	0.316	29%	0.291	S	S	.	.	S	Bend	trans	60.1	29.6	175.6	-52.9	-47.5	0	0	0	115.5	P129 Q130 F204 L239	P129-N206 HydrophobicContact CB-CB 4.17Å; P129-N206 WeakPolarHBondContact CB-O 3.39Å; Q130-N206 WeakPolarHBondContact O-CB 3.49Å; F204-N206 PolarHBondContact O-N 3.06Å; N206-L239 VanDerWaalsContact C-CG 3.49Å; N206-L239 HydrophobicContact CB-CD1 4.47Å; N206-L239 WeakPolarHBondContact O-CG 3.43Å; N206-L239 PolarHBondContact O-N 3.46Å
207	Y	95.1	Very high	90	Very high	27 Å²	27	60.6 Å²	60.6	11%	0.106	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	158.9	168.1	73	-84.5	0	0	0	112.6	T203 F204 E205 P209 L234 F237	T203-Y207 PolarHBondContact O-OH 2.84Å; F204-Y207 HydrophobicContact CB-CE1 4.35Å; F204-Y207 HydrophobicContact CD1-CE1 4.37Å; F204-Y207 AromaticContact CD1-CE2 3.63Å; F204-Y207 HydrophobicContact CD1-CE2 3.63Å; F204-Y207 AromaticContact CD1-CZ 3.52Å; F204-Y207 VanDerWaalsContact CD1-OH 3.25Å; F204-Y207 WeakPolarHBondContact CD1-OH 3.4Å; F204-Y207 HydrophobicContact CE1-CE2 4.37Å; E205-Y207 VanDerWaalsContact C-N 3.27Å; E205-Y207 VanDerWaalsContact O-CD1 3.31Å; E205-Y207 WeakPolarHBondContact O-CD1 3.43Å; E205-Y207 PolarHBondContact O-N 2.79Å; Y207-P209 HydrophobicContact CE2-CB 4.27Å; Y207-L234 HydrophobicContact CD1-CD1 4.15Å; Y207-L234 HydrophobicContact CE1-CD1 4.48Å; Y207-L234 HydrophobicContact CE1-CD2 4.16Å; Y207-L234 HydrophobicContact CG-CD1 4.38Å; Y207-F237 CarbonylContact C-O 3.32Å; Y207-F237 VanDerWaalsContact CA-O 3.23Å; Y207-F237 WeakPolarHBondContact CA-O 3.5Å; Y207-F237 WeakPolarHBondContact CB-O 3.23Å
208	I	95.4	Very high	90.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.5	175.4	-55.5	-61.7	0	0	0	109.8	P186 K187 P188 G236 F237 L239 V277 Y278	P186-I208 HydrophobicContact CB-CD1 3.63Å; P186-I208 HydrophobicContact CB-CG1 3.37Å; P186-I208 HydrophobicContact CG-CG1 4.4Å; K187-I208 WeakPolarHBondContact O-CD1 3.3Å; P188-I208 HydrophobicContact CB-CD1 4.38Å; P188-I208 HydrophobicContact CG-CD1 4.06Å; P188-I208 VanDerWaalsContact N-CD1 3.26Å; I208-G236 CarbonylContact O-C 3.55Å; I208-G236 WeakPolarHBondContact O-CA 3.38Å; I208-F237 HydrophobicContact CB-CB 4.46Å; I208-F237 PolarHBondContact N-O 3.45Å; I208-F237 PolarHBondContact O-N 3.37Å; I208-L239 HydrophobicContact CD1-CD2 4.05Å; I208-L239 HydrophobicContact CG1-CD2 3.94Å; I208-V277 HydrophobicContact CG2-CG1 3.48Å; I208-V277 VanDerWaalsContact CG2-CG1 3.48Å; I208-Y278 VanDerWaalsContact CG2-O 3.31Å; I208-Y278 WeakPolarHBondContact CG2-O 3.4Å
209	P	95.9	Very high	90.3	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	145.9	-178.1	28.5	-35.7	0	0	0	113.1	P189 L199 F204 Y207 A235 V277 Y278	P189-P209 HydrophobicContact CG-CG 3.9Å; L199-P209 HydrophobicContact CD1-CB 4.18Å; L199-P209 HydrophobicContact CD1-CG 4.46Å; L199-P209 HydrophobicContact CD2-CB 4.42Å; F204-P209 HydrophobicContact CD1-CB 3.6Å; F204-P209 HydrophobicContact CD1-CG 3.51Å; F204-P209 HydrophobicContact CD2-CG 4.28Å; F204-P209 HydrophobicContact CE1-CB 3.43Å; F204-P209 VanDerWaalsContact CE1-CB 3.43Å; F204-P209 HydrophobicContact CE1-CG 3.57Å; F204-P209 HydrophobicContact CE2-CG 4.31Å; F204-P209 HydrophobicContact CG-CB 4.47Å; F204-P209 HydrophobicContact CG-CG 3.91Å; F204-P209 HydrophobicContact CZ-CB 4.18Å; F204-P209 HydrophobicContact CZ-CG 3.98Å; Y207-P209 HydrophobicContact CE2-CB 4.27Å; P209-A235 WeakPolarHBondContact CA-O 3.42Å; P209-V277 WeakPolarHBondContact O-CA 3.41Å; P209-Y278 WeakPolarHBondContact CD-O 3.33Å; P209-Y278 PolarHBondContact O-N 2.83Å
210	I	96.2	Very high	90.2	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.2	167.7	-176	167.8	0	0	0	109.3	L76 V176 Y228 A235 F237 V258 I260 K276 V277	L76-I210 HydrophobicContact CD1-CD1 4.41Å; L76-I210 HydrophobicContact CD2-CD1 3.84Å; V176-I210 HydrophobicContact CB-CD1 4.2Å; V176-I210 HydrophobicContact CG1-CD1 3.69Å; V176-I210 HydrophobicContact CG2-CD1 4.43Å; I210-Y228 HydrophobicContact CG2-CD1 4.22Å; I210-Y228 HydrophobicContact CG2-CE1 4.49Å; I210-A235 PolarHBondContact N-O 3.4Å; I210-F237 HydrophobicContact CD1-CE2 4.49Å; I210-V258 HydrophobicContact CG2-CG1 4.03Å; I210-I260 HydrophobicContact CD1-CD1 3.83Å; I210-I260 HydrophobicContact CG1-CD1 4.43Å; I210-K276 WeakPolarHBondContact CA-O 3.15Å; I210-V277 HydrophobicContact CB-CG2 3.96Å; I210-V277 HydrophobicContact CD1-CG2 4.25Å; I210-V277 HydrophobicContact CG1-CG2 4.14Å
211	H	96.1	Very high	90.4	Very high	34 Å²	34	64.7 Å²	64.7	16%	0.157	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135.1	175.1	178.8	67.3	0	0	0	110.8	L199 K276 Y278	L199-H211 HydrophobicContact CD1-CB 3.83Å; L199-H211 HydrophobicContact CG-CB 4.19Å; H211-K276 PolarHBondContact N-O 3.19Å; H211-K276 PolarHBondContact O-N 3.4Å; H211-Y278 HydrophobicContact CB-CE2 3.95Å
212	C	95.8	Very high	91	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.014	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.9	176.3	-58.1	0	0	0	0	110.5	I226 Y228 I260 I273 E274 C275	C212-I226 HydrophobicContact CB-CD1 3.9Å; C212-Y228 PolarHBondContact N-OH 3.2Å; C212-I260 WeakPolarHBondContact SG-CD1 3.39Å; C212-I273 HydrophobicContact CB-CG2 4.02Å; C212-E274 CarbonylContact C-O 3.6Å; C212-E274 VanDerWaalsContact CA-O 3.29Å; C212-E274 WeakPolarHBondContact CA-O 3.47Å; C212-C275 HydrophobicContact CB-CB 4.09Å; C212-C275 WeakPolarHBondContact CB-SG 3.43Å; C212-C275 WeakPolarHBondContact SG-CB 3.28Å; C212-C275 CovalentContact SG-SG 2.03Å; C212-C275 PolarHBondContact SG-SG 3.07Å
213	K	94.4	Very high	91.4	Very high	93 Å²	93	60.4 Å²	60.4	40%	0.404	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	164.2	175.5	63.4	170.4	-169.4	162.9	0	111.2	I273 E274	K213-I273 WeakPolarHBondContact O-CA 3.36Å; K213-I273 WeakPolarHBondContact O-CG2 3.17Å; K213-E274 PolarHBondContact N-O 2.86Å; K213-E274 PolarHBondContact O-N 3.02Å
214	N	93.9	Very high	91.7	Very high	41 Å²	41	57.5 Å²	57.5	22%	0.219	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	141	167.4	59.2	-56.9	0	0	0	110.2	R216 D219 I223	N214-R216 PolarHBondContact ND2-O 3.32Å; N214-D219 HydrophobicContact CB-CB 4.06Å; N214-I223 HydrophobicContact CB-CD1 3.84Å
215	K	91.8	Very high	91.9	Very high	79 Å²	79	62.6 Å²	62.6	34%	0.343	32%	0.321	S	S	.	.	S	Bend	trans	-88.3	-33.4	179.5	-177.2	167.8	-173.1	145.2	0	112.4	R272 E274 D295	K215-R272 HydrophobicContact CB-CB 3.92Å; K215-R272 WeakPolarHBondContact CB-O 3.09Å; K215-R272 PolarHBondContact N-O 2.96Å; K215-E274 HydrophobicContact CB-CB 4.38Å; K215-D295 IonicContact NZ-OD1 3.85Å; K215-D295 PolarHBondContact NZ-OD1 3.1Å; K215-D295 IonicContact NZ-OD2 2.7Å; K215-D295 PolarHBondContact NZ-OD2 2.91Å
216	R	89.4	Confident	92.1	Very high	88 Å²	88	57.2 Å²	57.2	33%	0.332	30%	0.297	S	S	.	.	S	Bend	trans	-105.8	142	176.9	-67.3	172.7	165.7	169.7	-12.5	109	N214 E218 D219 E270 R272	N214-R216 PolarHBondContact ND2-O 3.32Å; R216-E218 PolarHBondContact O-N 3.09Å; R216-D219 HydrophobicContact CB-CB 4.43Å; R216-D219 PolarHBondContact O-N 2.67Å; R216-E270 IonicContact NH1-OE1 2.78Å; R216-R272 VanDerWaalsContact NH2-NH2 3.2Å
217	D	87.7	Confident	92.3	Very high	136 Å²	136	58.4 Å²	58.4	73%	0.727	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-65.2	-29.4	174.8	-55.3	-28.5	0	0	0	110.7	D219 E220	D217-D219 PolarHBondContact O-N 3.19Å; D217-E220 WeakPolarHBondContact O-CB 3.35Å; D217-E220 PolarHBondContact O-N 2.81Å
218	E	88.3	Confident	92.3	Very high	148 Å²	148	59.1 Å²	59.1	69%	0.692	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-63	-22.6	172.8	-62.3	171.5	-174.5	0	0	114.1	R216 E220 K222	R216-E218 PolarHBondContact O-N 3.09Å; E218-E220 VanDerWaalsContact C-N 3.32Å; E218-K222 WeakPolarHBondContact O-CE 3.45Å
219	D	86.6	Confident	92.3	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.027	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-89.9	-0.7	177.4	-64.9	-25.5	0	0	0	111.7	N214 R216 D217 G221 K222 I223 R272	N214-D219 HydrophobicContact CB-CB 4.06Å; R216-D219 HydrophobicContact CB-CB 4.43Å; R216-D219 PolarHBondContact O-N 2.67Å; D217-D219 PolarHBondContact O-N 3.19Å; D219-G221 PolarHBondContact O-N 3.01Å; D219-K222 WeakPolarHBondContact O-CB 3.47Å; D219-K222 PolarHBondContact O-N 3.05Å; D219-K222 VanDerWaalsContact O-N 3.17Å; D219-I223 HydrophobicContact CB-CD1 4.45Å; D219-R272 PolarHBondContact OD2-N 3.32Å
220	E	85.2	Confident	92.3	Very high	141 Å²	141	59.8 Å²	59.8	66%	0.659	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	131.4	176.9	-166.8	169.9	-166	0	0	110.4	D217 E218 K222	D217-E220 WeakPolarHBondContact O-CB 3.35Å; D217-E220 PolarHBondContact O-N 2.81Å; E218-E220 VanDerWaalsContact C-N 3.32Å; E220-K222 PolarHBondContact O-N 2.7Å
221	G	87	Confident	92.2	Very high	76 Å²	76	59.8 Å²	59.8	78%	0.784	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-11	-175	0	0	0	0	0	115.6	D219	D219-G221 PolarHBondContact O-N 3.01Å
222	K	91.1	Very high	91.8	Very high	61 Å²	61	60.4 Å²	60.4	27%	0.265	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-17.1	174.7	-58.4	-171.3	-175	178	0	113.9	E218 D219 E220 T266 E269 L271	E218-K222 WeakPolarHBondContact O-CE 3.45Å; D219-K222 WeakPolarHBondContact O-CB 3.47Å; D219-K222 PolarHBondContact O-N 3.05Å; D219-K222 VanDerWaalsContact O-N 3.17Å; E220-K222 PolarHBondContact O-N 2.7Å; K222-T266 WeakPolarHBondContact CA-OG1 3.41Å; K222-T266 WeakPolarHBondContact CB-OG1 3.11Å; K222-T266 PolarHBondContact O-N 2.94Å; K222-T266 PolarHBondContact O-OG1 3.49Å; K222-T266 VanDerWaalsContact O-OG1 3.09Å; K222-E269 WeakPolarHBondContact CE-OE2 3.22Å; K222-E269 IonicContact NZ-OE2 2.67Å; K222-E269 PolarHBondContact NZ-OE2 2.86Å; K222-L271 HydrophobicContact CB-CD2 3.62Å; K222-L271 HydrophobicContact CD-CD2 3.78Å; K222-L271 HydrophobicContact CG-CD2 4.38Å
223	I	92.4	Very high	91.6	Very high	26 Å²	26	62.2 Å²	62.2	13%	0.133	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-109.7	114	174.7	-60.7	150.8	0	0	0	106.6	N214 D219 I226 F262 L265 L271 I273	N214-I223 HydrophobicContact CB-CD1 3.84Å; D219-I223 HydrophobicContact CB-CD1 4.45Å; I223-I226 HydrophobicContact CG2-CD1 4.04Å; I223-I226 HydrophobicContact CG2-CG1 4.05Å; I223-F262 HydrophobicContact CG2-CD1 4.48Å; I223-L265 HydrophobicContact CB-CD2 4.44Å; I223-L265 HydrophobicContact CG1-CD2 4.05Å; I223-L265 HydrophobicContact CG2-CD2 4.09Å; I223-L271 HydrophobicContact CG1-CB 4.45Å; I223-L271 HydrophobicContact CG1-CD1 4.11Å; I223-I273 HydrophobicContact CD1-CD1 3.93Å; I223-I273 HydrophobicContact CD1-CG1 3.64Å; I223-I273 HydrophobicContact CG1-CD1 4.17Å; I223-I273 HydrophobicContact CG1-CG1 4.4Å; I223-I273 HydrophobicContact CG2-CD1 4.26Å
224	G	90.6	Very high	91.4	Very high	30 Å²	30	59.9 Å²	59.9	31%	0.309	33%	0.331	S	S	.	.			trans	-77.1	-153.5	176.8	0	0	0	0	0	112.7	I226 N264	G224-I226 PolarHBondContact O-N 3.4Å; G224-N264 PolarHBondContact N-O 3.39Å
225	E	92.7	Very high	91.4	Very high	125 Å²	125	59.3 Å²	59.3	58%	0.584	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-60.4	127.1	-177.2	-170	-170	-171.5	0	0	111.6	K227 T263	E225-K227 VanDerWaalsContact CD-CE 3.5Å; E225-K227 HydrophobicContact CG-CG 4.43Å; E225-K227 WeakPolarHBondContact OE2-CE 3.5Å; E225-K227 IonicContact OE2-NZ 3.84Å; E225-T263 PolarHBondContact O-N 2.88Å; E225-T263 PolarHBondContact O-OG1 3.39Å
226	I	95.4	Very high	91.6	Very high	29 Å²	29	55.6 Å²	55.6	15%	0.149	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	119.4	172.8	-55.5	173.3	0	0	0	108.2	C212 I223 G224 Y228 I260 F262	C212-I226 HydrophobicContact CB-CD1 3.9Å; I223-I226 HydrophobicContact CG2-CD1 4.04Å; I223-I226 HydrophobicContact CG2-CG1 4.05Å; G224-I226 PolarHBondContact O-N 3.4Å; I226-Y228 HydrophobicContact CB-CE2 4.28Å; I226-Y228 HydrophobicContact CG2-CE1 4.21Å; I226-Y228 HydrophobicContact CG2-CE2 3.98Å; I226-Y228 WeakPolarHBondContact O-CE2 3.44Å; I226-I260 HydrophobicContact CG2-CG2 3.39Å; I226-F262 HydrophobicContact CD1-CD1 4.2Å; I226-F262 HydrophobicContact CD1-CE1 3.86Å; I226-F262 HydrophobicContact CG1-CD1 3.94Å; I226-F262 HydrophobicContact CG1-CE1 4.05Å; I226-F262 HydrophobicContact CG2-CD1 4.32Å; I226-F262 HydrophobicContact CG2-CE1 4.1Å
227	K	96.2	Very high	92	Very high	84 Å²	84	51.4 Å²	51.4	37%	0.365	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	141.8	178.3	-66.6	-174.8	179.8	177.2	0	110.6	E225 F229 I260 Q261 T263	E225-K227 VanDerWaalsContact CD-CE 3.5Å; E225-K227 HydrophobicContact CG-CG 4.43Å; E225-K227 WeakPolarHBondContact OE2-CE 3.5Å; E225-K227 IonicContact OE2-NZ 3.84Å; K227-F229 HydrophobicContact CB-CE1 4.23Å; K227-F229 HydrophobicContact CB-CE2 4.3Å; K227-F229 HydrophobicContact CB-CZ 3.79Å; K227-F229 HydrophobicContact CD-CZ 4.38Å; K227-I260 CarbonylContact O-C 3.59Å; K227-I260 WeakPolarHBondContact O-CA 3.35Å; K227-Q261 HydrophobicContact CB-CB 4.45Å; K227-Q261 PolarHBondContact N-O 2.89Å; K227-Q261 PolarHBondContact O-N 2.75Å; K227-T263 HydrophobicContact CB-CG2 4.42Å; K227-T263 HydrophobicContact CD-CG2 3.72Å; K227-T263 HydrophobicContact CG-CG2 3.84Å
228	Y	96.4	Very high	92.4	Very high	41 Å²	41	45.1 Å²	45.1	16%	0.161	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134	-179.8	-55.9	-94.5	0	0	0	109.3	I210 C212 I226 A235 A259 I260	I210-Y228 HydrophobicContact CG2-CD1 4.22Å; I210-Y228 HydrophobicContact CG2-CE1 4.49Å; C212-Y228 PolarHBondContact N-OH 3.2Å; I226-Y228 HydrophobicContact CB-CE2 4.28Å; I226-Y228 HydrophobicContact CG2-CE1 4.21Å; I226-Y228 HydrophobicContact CG2-CE2 3.98Å; I226-Y228 WeakPolarHBondContact O-CE2 3.44Å; Y228-A235 HydrophobicContact CD1-CB 4.1Å; Y228-A235 HydrophobicContact CD2-CB 3.96Å; Y228-A235 HydrophobicContact CG-CB 3.6Å; Y228-A259 CarbonylContact C-O 3.42Å; Y228-A259 WeakPolarHBondContact CA-O 3.28Å; Y228-I260 HydrophobicContact CD1-CD1 4.2Å; Y228-I260 HydrophobicContact CD1-CG1 3.96Å; Y228-I260 HydrophobicContact CD1-CG2 4.27Å; Y228-I260 HydrophobicContact CE1-CD1 4.05Å; Y228-I260 HydrophobicContact CE1-CG1 4.23Å; Y228-I260 HydrophobicContact CE1-CG2 4.05Å
229	F	96	Very high	92.7	Very high	15 Å²	15	38.2 Å²	38.2	7%	0.066	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	106.5	178.4	-47.6	-62.3	0	0	0	109.6	L154 Q155 N156 K227 A259 Q261	L154-F229 WeakPolarHBondContact O-CB 3.39Å; Q155-F229 HydrophobicContact CB-CB 4.23Å; Q155-F229 HydrophobicContact CB-CD1 3.98Å; Q155-F229 HydrophobicContact CB-CE1 4.48Å; Q155-F229 HydrophobicContact CB-CG 4.03Å; Q155-F229 HydrophobicContact CG-CB 4.31Å; Q155-F229 HydrophobicContact CG-CD1 4.13Å; Q155-F229 HydrophobicContact CG-CG 4.4Å; Q155-F229 VanDerWaalsContact OE1-CE1 3.28Å; N156-F229 HydrophobicContact CB-CE2 4.32Å; K227-F229 HydrophobicContact CB-CE1 4.23Å; K227-F229 HydrophobicContact CB-CE2 4.3Å; K227-F229 HydrophobicContact CB-CZ 3.79Å; K227-F229 HydrophobicContact CD-CZ 4.38Å; F229-A259 HydrophobicContact CB-CB 4.26Å; F229-A259 HydrophobicContact CD2-CB 4.34Å; F229-A259 PolarHBondContact N-O 2.96Å; F229-A259 PolarHBondContact O-N 3.33Å; F229-Q261 HydrophobicContact CD2-CB 4.49Å; F229-Q261 HydrophobicContact CE2-CB 3.71Å; F229-Q261 HydrophobicContact CZ-CB 4.5Å
230	G	94.7	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.234	C	C	.	.			trans	-131.6	-170.1	173.2	0	0	0	0	0	110.8	G232 G233 L234	G230-G232 PolarHBondContact O-N 3.5Å; G230-G233 WeakPolarHBondContact O-CA 3.42Å; G230-G233 PolarHBondContact O-N 3.42Å; G230-L234 WeakPolarHBondContact CA-O 3.33Å; G230-L234 PolarHBondContact N-O 3.34Å
231	L	94.2	Very high	93.6	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-52.6	130.2	174.1	-172	74.7	0	0	0	110.2	D127 G233 L234 P238 Y241	D127-L231 WeakPolarHBondContact O-CG 3.38Å; L231-G233 PolarHBondContact O-N 2.75Å; L231-G233 VanDerWaalsContact O-N 3.17Å; L231-L234 WeakPolarHBondContact O-CB 3.49Å; L231-L234 WeakPolarHBondContact O-CD1 3.32Å; L231-L234 WeakPolarHBondContact O-CG 3.05Å; L231-L234 PolarHBondContact O-N 2.75Å; L231-P238 HydrophobicContact CB-CG 4.11Å; L231-P238 HydrophobicContact CD2-CB 3.95Å; L231-P238 HydrophobicContact CD2-CG 3.77Å; L231-Y241 HydrophobicContact CD2-CE2 4.16Å
232	G	88.8	Confident	94	Very high	47 Å²	47	28.7 Å²	28.7	49%	0.485	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	62.7	17.6	-177.2	0	0	0	0	0	114.9	G230 L234	G230-G232 PolarHBondContact O-N 3.5Å; G232-L234 VanDerWaalsContact C-N 3.33Å
233	G	89.8	Confident	94.2	Very high	40 Å²	40	25.9 Å²	25.9	41%	0.412	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	76.4	16.9	-176.5	0	0	0	0	0	114.3	G230 L231	G230-G233 WeakPolarHBondContact O-CA 3.42Å; G230-G233 PolarHBondContact O-N 3.42Å; L231-G233 PolarHBondContact O-N 2.75Å; L231-G233 VanDerWaalsContact O-N 3.17Å
234	L	91.2	Very high	94.4	Very high	43 Å²	43	25.5 Å²	25.5	23%	0.225	15%	0.154	C	C	.	.			trans	-84.6	146.1	-174.4	-65.2	166.4	0	0	0	113.3	P129 Y207 G230 L231 G232 G236	P129-L234 HydrophobicContact CB-CD1 4.4Å; P129-L234 HydrophobicContact CG-CD1 3.01Å; Y207-L234 HydrophobicContact CD1-CD1 4.15Å; Y207-L234 HydrophobicContact CE1-CD1 4.48Å; Y207-L234 HydrophobicContact CE1-CD2 4.16Å; Y207-L234 HydrophobicContact CG-CD1 4.38Å; G230-L234 WeakPolarHBondContact CA-O 3.33Å; G230-L234 PolarHBondContact N-O 3.34Å; L231-L234 WeakPolarHBondContact O-CB 3.49Å; L231-L234 WeakPolarHBondContact O-CD1 3.32Å; L231-L234 WeakPolarHBondContact O-CG 3.05Å; L231-L234 PolarHBondContact O-N 2.75Å; G232-L234 VanDerWaalsContact C-N 3.33Å; L234-G236 VanDerWaalsContact C-N 3.25Å; L234-G236 PolarHBondContact O-N 3Å; L234-G236 VanDerWaalsContact O-N 3.11Å
235	A	94.4	Very high	94.6	Very high	30 Å²	30	24.3 Å²	24.3	25%	0.248	14%	0.14	C	C	.	.	S	Bend	trans	-84.2	63.2	169.6	0	0	0	0	0	110.7	P209 I210 Y228	P209-A235 WeakPolarHBondContact CA-O 3.42Å; I210-A235 PolarHBondContact N-O 3.4Å; Y228-A235 HydrophobicContact CD1-CB 4.1Å; Y228-A235 HydrophobicContact CD2-CB 3.96Å; Y228-A235 HydrophobicContact CG-CB 3.6Å
236	G	95.4	Very high	94.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.4	-179.5	-179.4	0	0	0	0	0	116.6	I208 L234 V258	I208-G236 CarbonylContact O-C 3.55Å; I208-G236 WeakPolarHBondContact O-CA 3.38Å; L234-G236 VanDerWaalsContact C-N 3.25Å; L234-G236 PolarHBondContact O-N 3Å; L234-G236 VanDerWaalsContact O-N 3.11Å; G236-V258 WeakPolarHBondContact O-CG2 3.34Å
237	F	96.8	Very high	94.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.9	-175.8	-59.2	-77.3	0	0	0	111.3	L76 V176 Y207 I208 I210 P256 V258 V277	L76-F237 HydrophobicContact CD1-CE2 3.94Å; L76-F237 HydrophobicContact CD1-CZ 4.04Å; V176-F237 HydrophobicContact CG1-CZ 4.17Å; Y207-F237 CarbonylContact C-O 3.32Å; Y207-F237 VanDerWaalsContact CA-O 3.23Å; Y207-F237 WeakPolarHBondContact CA-O 3.5Å; Y207-F237 WeakPolarHBondContact CB-O 3.23Å; I208-F237 HydrophobicContact CB-CB 4.46Å; I208-F237 PolarHBondContact N-O 3.45Å; I208-F237 PolarHBondContact O-N 3.37Å; I210-F237 HydrophobicContact CD1-CE2 4.49Å; F237-P256 HydrophobicContact CB-CG 4.34Å; F237-P256 HydrophobicContact CD1-CB 4.34Å; F237-P256 HydrophobicContact CD1-CG 4.11Å; F237-V258 HydrophobicContact CD1-CG2 4.02Å; F237-V258 HydrophobicContact CE1-CB 4.42Å; F237-V258 HydrophobicContact CE1-CG2 3.79Å; F237-V258 HydrophobicContact CE2-CG2 4.49Å; F237-V258 HydrophobicContact CG-CG2 4.48Å; F237-V258 HydrophobicContact CZ-CB 4.47Å; F237-V258 HydrophobicContact CZ-CG2 4.05Å; F237-V277 HydrophobicContact CD2-CG2 3.97Å; F237-V277 HydrophobicContact CE2-CG2 3.52Å
238	P	96.4	Very high	94.3	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.019	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	141.6	178.6	25.7	-35.1	0	0	0	112.9	P129 L231 Q240 Y241 P256	P129-P238 HydrophobicContact CB-CB 3.95Å; P129-P238 HydrophobicContact CG-CB 4.4Å; L231-P238 HydrophobicContact CB-CG 4.11Å; L231-P238 HydrophobicContact CD2-CB 3.95Å; L231-P238 HydrophobicContact CD2-CG 3.77Å; P238-Q240 HydrophobicContact CB-CG 4.38Å; P238-Q240 PolarHBondContact O-N 3.5Å; P238-Y241 HydrophobicContact CB-CD2 4.22Å; P238-Y241 HydrophobicContact CB-CE2 4.32Å; P238-Y241 HydrophobicContact CG-CD2 3.58Å; P238-Y241 HydrophobicContact CG-CE2 3.55Å; P238-P256 HydrophobicContact CG-CB 4.02Å
239	L	95.9	Very high	94.1	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-73.4	-24.7	-175.2	-63	-174.8	0	0	0	113.9	Y132 P186 P188 N206 I208 Y241 Y242	Y132-L239 HydrophobicContact CD1-CB 4.09Å; Y132-L239 HydrophobicContact CE1-CB 4.05Å; Y132-L239 HydrophobicContact CE1-CD1 4.1Å; Y132-L239 HydrophobicContact CE1-CD2 4Å; Y132-L239 HydrophobicContact CE1-CG 4.25Å; Y132-L239 HydrophobicContact CE2-CD1 4.09Å; P186-L239 HydrophobicContact CB-CD2 4.12Å; P186-L239 HydrophobicContact CG-CD2 4.46Å; P186-L239 WeakPolarHBondContact O-CD2 3.38Å; P188-L239 HydrophobicContact CG-CD1 3.91Å; N206-L239 VanDerWaalsContact C-CG 3.49Å; N206-L239 HydrophobicContact CB-CD1 4.47Å; N206-L239 WeakPolarHBondContact O-CG 3.43Å; N206-L239 PolarHBondContact O-N 3.46Å; I208-L239 HydrophobicContact CD1-CD2 4.05Å; I208-L239 HydrophobicContact CG1-CD2 3.94Å; L239-Y241 PolarHBondContact O-N 3.36Å; L239-Y242 PolarHBondContact O-N 2.75Å
240	Q	95.2	Very high	93.9	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-58.2	-18	-179.9	73.3	-163.5	41	0	0	115.3	N126 L128 Q130 T131 V133 P238 Y242	N126-Q240 PolarHBondContact O-NE2 2.95Å; L128-Q240 PolarHBondContact O-OE1 3.07Å; L128-Q240 VanDerWaalsContact O-OE1 3.04Å; Q130-Q240 HydrophobicContact CB-CB 4.15Å; Q130-Q240 PolarHBondContact O-N 3.04Å; Q130-Q240 VanDerWaalsContact O-N 3.07Å; T131-Q240 VanDerWaalsContact O-CA 3.3Å; T131-Q240 WeakPolarHBondContact O-CA 3.3Å; V133-Q240 HydrophobicContact CG2-CB 4.03Å; V133-Q240 WeakPolarHBondContact CG2-O 3.4Å; P238-Q240 HydrophobicContact CB-CG 4.38Å; P238-Q240 PolarHBondContact O-N 3.5Å; Q240-Y242 VanDerWaalsContact C-N 3.31Å
241	Y	95.6	Very high	93.7	Very high	11 Å²	11	29.2 Å²	29.2	4%	0.043	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-86.7	-2.4	175.9	-66.9	-102	0	0	0	113.2	C147 R148 F149 L231 P238 L239 Y253 L254 P256	C147-Y241 HydrophobicContact CB-CD1 3.71Å; C147-Y241 HydrophobicContact CB-CE1 3.46Å; C147-Y241 VanDerWaalsContact CB-CE1 3.46Å; C147-Y241 HydrophobicContact CB-CG 4.36Å; R148-Y241 PolarHBondContact O-OH 3.39Å; F149-Y241 HydrophobicContact CB-CE1 4.06Å; F149-Y241 HydrophobicContact CD2-CE1 4.18Å; F149-Y241 AromaticContact CD2-CZ 3.91Å; F149-Y241 WeakPolarHBondContact CD2-OH 3.4Å; L231-Y241 HydrophobicContact CD2-CE2 4.16Å; P238-Y241 HydrophobicContact CB-CD2 4.22Å; P238-Y241 HydrophobicContact CB-CE2 4.32Å; P238-Y241 HydrophobicContact CG-CD2 3.58Å; P238-Y241 HydrophobicContact CG-CE2 3.55Å; L239-Y241 PolarHBondContact O-N 3.36Å; Y241-Y253 VanDerWaalsContact O-CE2 3.23Å; Y241-Y253 WeakPolarHBondContact O-CE2 3.43Å; Y241-Y253 PolarHBondContact O-OH 3.4Å; Y241-L254 WeakPolarHBondContact CD1-O 3.44Å; Y241-P256 HydrophobicContact CD1-CB 4.38Å; Y241-P256 HydrophobicContact CD2-CB 4.01Å; Y241-P256 HydrophobicContact CD2-CG 4.27Å; Y241-P256 HydrophobicContact CE2-CB 4.35Å; Y241-P256 HydrophobicContact CG-CB 4.03Å; Y241-P256 HydrophobicContact CG-CG 4.02Å
242	Y	95.6	Very high	93.7	Very high	8 Å²	8	31.5 Å²	31.5	3%	0.031	18%	0.176	C	C	.	.			trans	-114.6	151.3	179.9	-61.8	-88.5	0	0	0	110	V133 L178 P186 L239 Q240 P256	V133-Y242 PolarHBondContact N-O 3.29Å; L178-Y242 HydrophobicContact CD2-CE1 4.38Å; L178-Y242 WeakPolarHBondContact CD2-OH 3.4Å; P186-Y242 VanDerWaalsContact CD-CG 3.4Å; P186-Y242 HydrophobicContact CG-CD1 3.66Å; P186-Y242 HydrophobicContact CG-CD2 3.71Å; P186-Y242 HydrophobicContact CG-CE1 3.67Å; P186-Y242 HydrophobicContact CG-CE2 3.72Å; P186-Y242 HydrophobicContact CG-CG 3.68Å; L239-Y242 PolarHBondContact O-N 2.75Å; Q240-Y242 VanDerWaalsContact C-N 3.31Å; Y242-P256 HydrophobicContact CE2-CG 4Å
243	P	95.2	Very high	94	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.019	16%	0.155	C	C	.	.	S	Bend	cis	-80.8	162.2	1	30.7	-32.9	0	0	0	114.7	F184 R185 Y245	F184-P243 WeakPolarHBondContact O-CA 3.33Å; R185-P243 HydrophobicContact CG-CB 4.19Å; P243-Y245 HydrophobicContact CG-CE2 3.82Å; P243-Y245 VanDerWaalsContact O-CD2 3.3Å; P243-Y245 WeakPolarHBondContact O-CD2 3.49Å; P243-Y245 VanDerWaalsContact O-CE2 3.29Å; P243-Y245 WeakPolarHBondContact O-CE2 3.47Å
244	Y	95.3	Very high	94.2	Very high	17 Å²	17	28.4 Å²	28.4	7%	0.067	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-86.1	133.4	171.1	174.7	-125.8	0	0	0	111.3	R180 V182 N183 G246 K247 H250 Y253	R180-Y244 HydrophobicContact CB-CD1 3.82Å; R180-Y244 HydrophobicContact CB-CE1 4.01Å; R180-Y244 HydrophobicContact CB-CG 4.36Å; V182-Y244 CarbonylContact C-O 3.48Å; V182-Y244 WeakPolarHBondContact CA-O 3.31Å; V182-Y244 HydrophobicContact CG2-CD1 4.11Å; V182-Y244 HydrophobicContact CG2-CE1 4.22Å; N183-Y244 PolarHBondContact N-O 3.38Å; Y244-G246 VanDerWaalsContact CE1-CA 3.49Å; Y244-G246 VanDerWaalsContact CZ-C 3.48Å; Y244-G246 VanDerWaalsContact CZ-CA 3.43Å; Y244-G246 VanDerWaalsContact OH-C 3.25Å; Y244-K247 WeakPolarHBondContact OH-CA 3.47Å; Y244-K247 PolarHBondContact OH-N 2.9Å; Y244-H250 HydrophobicContact CD2-CB 4.35Å; Y244-H250 AromaticContact CD2-ND1 3.79Å; Y244-H250 HydrophobicContact CE2-CB 3.99Å; Y244-Y253 AromaticContact CD2-CD1 3.33Å; Y244-Y253 HydrophobicContact CD2-CD1 3.33Å; Y244-Y253 HydrophobicContact CD2-CD2 4.19Å; Y244-Y253 AromaticContact CD2-CE1 3.73Å; Y244-Y253 HydrophobicContact CD2-CE1 3.73Å; Y244-Y253 AromaticContact CD2-CG 3.56Å; Y244-Y253 HydrophobicContact CD2-CG 3.56Å; Y244-Y253 AromaticContact CE2-CD1 3.55Å; Y244-Y253 HydrophobicContact CE2-CD1 3.55Å; Y244-Y253 HydrophobicContact CE2-CE1 4.36Å; Y244-Y253 AromaticContact CE2-CG 3.74Å; Y244-Y253 HydrophobicContact CE2-CG 3.74Å; Y244-Y253 HydrophobicContact CG-CD1 4.17Å; Y244-Y253 HydrophobicContact CG-CE1 4.17Å
245	Y	94.4	Very high	94.4	Very high	6 Å²	6	27 Å²	27	2%	0.024	13%	0.13	C	C	.	.			trans	-98.5	7.8	-173.9	-71.1	-95.1	0	0	0	114.7	R135 G136 L138 K144 P243	R135-Y245 HydrophobicContact CB-CD2 4.3Å; R135-Y245 HydrophobicContact CB-CE1 4.5Å; R135-Y245 HydrophobicContact CB-CE2 3.7Å; R135-Y245 HydrophobicContact CG-CE2 4.05Å; R135-Y245 PolarHBondContact N-OH 3.19Å; G136-Y245 VanDerWaalsContact O-CE1 3.3Å; G136-Y245 WeakPolarHBondContact O-CE1 3.3Å; G136-Y245 PolarHBondContact O-OH 3.46Å; L138-Y245 HydrophobicContact CD2-CD1 3.56Å; L138-Y245 HydrophobicContact CD2-CE1 4.42Å; L138-Y245 HydrophobicContact CD2-CG 4.19Å; L138-Y245 WeakPolarHBondContact CD2-O 3.49Å; L138-Y245 HydrophobicContact CG-CD1 4.29Å; K144-Y245 HydrophobicContact CG-CD1 4.46Å; K144-Y245 HydrophobicContact CG-CG 4.23Å; P243-Y245 HydrophobicContact CG-CE2 3.82Å; P243-Y245 VanDerWaalsContact O-CD2 3.3Å; P243-Y245 WeakPolarHBondContact O-CD2 3.49Å; P243-Y245 VanDerWaalsContact O-CE2 3.29Å; P243-Y245 WeakPolarHBondContact O-CE2 3.47Å
246	G	93.4	Very high	94.5	Very high	7 Å²	7	25.5 Å²	25.5	7%	0.072	12%	0.118	C	C	.	.			trans	84.7	158.2	-179.5	0	0	0	0	0	113.2	Y244 R248 L249 H250	Y244-G246 VanDerWaalsContact CE1-CA 3.49Å; Y244-G246 VanDerWaalsContact CZ-C 3.48Å; Y244-G246 VanDerWaalsContact CZ-CA 3.43Å; Y244-G246 VanDerWaalsContact OH-C 3.25Å; G246-R248 VanDerWaalsContact C-N 3.27Å; G246-R248 PolarHBondContact O-N 2.86Å; G246-L249 PolarHBondContact O-N 2.94Å; G246-H250 WeakPolarHBondContact O-CA 3.12Å; G246-H250 VanDerWaalsContact O-CB 3.26Å; G246-H250 WeakPolarHBondContact O-CB 3.43Å; G246-H250 PolarHBondContact O-N 3.42Å
247	K	93.3	Very high	94.6	Very high	166 Å²	166	25.5 Å²	25.5	72%	0.722	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.8	-170.3	-172.5	179.5	177.7	-173.5	0	113.1	Y244 P251	Y244-K247 WeakPolarHBondContact OH-CA 3.47Å; Y244-K247 PolarHBondContact OH-N 2.9Å; K247-P251 VanDerWaalsContact O-CA 3.28Å; K247-P251 WeakPolarHBondContact O-CA 3.48Å
248	R	91.6	Very high	94.6	Very high	152 Å²	152	25.5 Å²	25.5	57%	0.574	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-41	179.6	-75.6	-159.5	162.1	147.7	-23	112.9	E62 F63 G246	E62-R248 VanDerWaalsContact CG-NH1 3.29Å; E62-R248 WeakPolarHBondContact O-CD 3.32Å; E62-R248 IonicContact OE1-CZ 3.95Å; E62-R248 IonicContact OE1-NH1 3.09Å; E62-R248 PolarHBondContact OE1-NH1 3.44Å; E62-R248 IonicContact OE1-NH2 3.79Å; E62-R248 PolarHBondContact OE1-NH2 3.4Å; E62-R248 IonicContact OE2-NH1 3.54Å; F63-R248 HydrophobicContact CD1-CB 4.33Å; G246-R248 VanDerWaalsContact C-N 3.27Å; G246-R248 PolarHBondContact O-N 2.86Å
249	L	92.4	Very high	94.7	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.037	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-22.7	179.3	-60.4	179.6	0	0	0	112.4	F63 L138 D139 K144 G246	F63-L249 HydrophobicContact CB-CD1 4.05Å; F63-L249 HydrophobicContact CD1-CD1 3.96Å; F63-L249 HydrophobicContact CD1-CD2 3.55Å; F63-L249 HydrophobicContact CD1-CG 3.65Å; F63-L249 HydrophobicContact CE1-CD2 3.74Å; F63-L249 HydrophobicContact CE1-CG 4.34Å; F63-L249 HydrophobicContact CG-CD1 4.22Å; F63-L249 HydrophobicContact CG-CD2 4.47Å; F63-L249 HydrophobicContact CG-CG 4.4Å; L138-L249 HydrophobicContact CB-CD1 4.33Å; L138-L249 HydrophobicContact CD2-CD1 4.04Å; D139-L249 WeakPolarHBondContact O-CD2 3.11Å; K144-L249 HydrophobicContact CG-CB 4.13Å; K144-L249 PolarHBondContact N-O 3.21Å; G246-L249 PolarHBondContact O-N 2.94Å
250	H	91.6	Very high	94.8	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.019	12%	0.116	C	C	.	.			trans	-135.5	63.7	-172	-150.4	178.7	0	0	0	110.5	K144 R145 S146 Y244 G246 D252 Y253	K144-H250 PolarHBondContact O-CD2 3.35Å; R145-H250 VanDerWaalsContact C-NE2 3.28Å; R145-H250 PolarHBondContact O-NE2 2.86Å; S146-H250 VanDerWaalsContact CA-NE2 3.26Å; S146-H250 WeakPolarHBondContact CA-NE2 3.32Å; S146-H250 VanDerWaalsContact CB-NE2 3.32Å; S146-H250 WeakPolarHBondContact CB-NE2 3.26Å; S146-H250 PolarHBondContact N-NE2 3.26Å; Y244-H250 HydrophobicContact CD2-CB 4.35Å; Y244-H250 AromaticContact CD2-ND1 3.79Å; Y244-H250 HydrophobicContact CE2-CB 3.99Å; G246-H250 WeakPolarHBondContact O-CA 3.12Å; G246-H250 VanDerWaalsContact O-CB 3.26Å; G246-H250 WeakPolarHBondContact O-CB 3.43Å; G246-H250 PolarHBondContact O-N 3.42Å; H250-D252 VanDerWaalsContact C-N 3.34Å; H250-D252 PolarHBondContact O-N 2.87Å; H250-Y253 AromaticContact CE1-CD2 3.12Å; H250-Y253 WeakPolarHBondContact CE1-CD2 3.41Å; H250-Y253 AromaticContact CE1-CE2 3.83Å; H250-Y253 AromaticContact CE1-CG 3.86Å; H250-Y253 AromaticContact ND1-CD2 3.43Å; H250-Y253 WeakPolarHBondContact ND1-CD2 3.09Å; H250-Y253 AromaticContact ND1-CG 3.73Å; H250-Y253 AromaticContact NE2-CD2 3.67Å; H250-Y253 WeakPolarHBondContact O-CB 3.38Å; H250-Y253 PolarHBondContact O-N 3.39Å
251	P	91.9	Very high	94.8	Very high	60 Å²	60	25.6 Å²	25.6	39%	0.39	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-38.7	-171.3	26.3	-33.4	0	0	0	112.2	V143 K247 Y253	V143-P251 HydrophobicContact CG1-CG 3.85Å; K247-P251 VanDerWaalsContact O-CA 3.28Å; K247-P251 WeakPolarHBondContact O-CA 3.48Å; P251-Y253 VanDerWaalsContact C-N 3.34Å
252	D	93	Very high	94.9	Very high	51 Å²	51	25.1 Å²	25.1	27%	0.273	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	21.1	-176.9	-60.9	-41.7	0	0	0	112.5	N119 N121 Y122 H250 L254	N119-D252 VanDerWaalsContact ND2-CG 3.25Å; N119-D252 PolarHBondContact ND2-OD2 3.05Å; N121-D252 HydrophobicContact CB-CB 4.3Å; N121-D252 WeakPolarHBondContact CB-OD2 2.97Å; N121-D252 PolarHBondContact ND2-OD2 2.98Å; Y122-D252 HydrophobicContact CE1-CB 4.28Å; Y122-D252 WeakPolarHBondContact CE1-O 3.29Å; Y122-D252 HydrophobicContact CE2-CB 4.39Å; Y122-D252 PolarHBondContact OH-O 3.24Å; H250-D252 VanDerWaalsContact C-N 3.34Å; H250-D252 PolarHBondContact O-N 2.87Å; D252-L254 PolarHBondContact O-N 3.2Å; D252-L254 VanDerWaalsContact O-N 3.14Å
253	Y	94.9	Very high	94.8	Very high	11 Å²	11	26 Å²	26	4%	0.043	12%	0.122	C	C	.	.			trans	-62.3	119.4	179.5	178.5	-112.7	0	0	0	112.4	S146 R180 Y241 Y244 H250 P251 Q255	S146-Y253 WeakPolarHBondContact OG-CD2 3.3Å; R180-Y253 HydrophobicContact CG-CD1 4.36Å; R180-Y253 HydrophobicContact CG-CE1 3.98Å; Y241-Y253 VanDerWaalsContact O-CE2 3.23Å; Y241-Y253 WeakPolarHBondContact O-CE2 3.43Å; Y241-Y253 PolarHBondContact O-OH 3.4Å; Y244-Y253 AromaticContact CD2-CD1 3.33Å; Y244-Y253 HydrophobicContact CD2-CD1 3.33Å; Y244-Y253 HydrophobicContact CD2-CD2 4.19Å; Y244-Y253 AromaticContact CD2-CE1 3.73Å; Y244-Y253 HydrophobicContact CD2-CE1 3.73Å; Y244-Y253 AromaticContact CD2-CG 3.56Å; Y244-Y253 HydrophobicContact CD2-CG 3.56Å; Y244-Y253 AromaticContact CE2-CD1 3.55Å; Y244-Y253 HydrophobicContact CE2-CD1 3.55Å; Y244-Y253 HydrophobicContact CE2-CE1 4.36Å; Y244-Y253 AromaticContact CE2-CG 3.74Å; Y244-Y253 HydrophobicContact CE2-CG 3.74Å; Y244-Y253 HydrophobicContact CG-CD1 4.17Å; Y244-Y253 HydrophobicContact CG-CE1 4.17Å; H250-Y253 AromaticContact CE1-CD2 3.12Å; H250-Y253 WeakPolarHBondContact CE1-CD2 3.41Å; H250-Y253 AromaticContact CE1-CE2 3.83Å; H250-Y253 AromaticContact CE1-CG 3.86Å; H250-Y253 AromaticContact ND1-CD2 3.43Å; H250-Y253 WeakPolarHBondContact ND1-CD2 3.09Å; H250-Y253 AromaticContact ND1-CG 3.73Å; H250-Y253 AromaticContact NE2-CD2 3.67Å; H250-Y253 WeakPolarHBondContact O-CB 3.38Å; H250-Y253 PolarHBondContact O-N 3.39Å; P251-Y253 VanDerWaalsContact C-N 3.34Å; Y253-Q255 HydrophobicContact CD1-CB 4.47Å; Y253-Q255 HydrophobicContact CE1-CB 3.72Å
254	L	94.6	Very high	94.7	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.052	15%	0.148	C	C	.	.			trans	-100.4	111.4	169.9	-65.9	179	0	0	0	109.2	K110 Y111 Q116 Y122 S146 Y241 D252	K110-L254 HydrophobicContact CB-CD2 4.28Å; Y111-L254 HydrophobicContact CD1-CB 4.37Å; Y111-L254 HydrophobicContact CD1-CD1 4.14Å; Y111-L254 HydrophobicContact CD1-CD2 4.21Å; Y111-L254 HydrophobicContact CD1-CG 4.47Å; Y111-L254 HydrophobicContact CD2-CD2 4.45Å; Y111-L254 HydrophobicContact CE1-CB 3.84Å; Y111-L254 HydrophobicContact CE1-CD1 4.42Å; Y111-L254 HydrophobicContact CE1-CD2 4Å; Y111-L254 HydrophobicContact CE1-CG 4.3Å; Y111-L254 HydrophobicContact CE2-CD2 4.21Å; Y111-L254 HydrophobicContact CG-CD2 4.45Å; Q116-L254 VanDerWaalsContact CD-CD1 3.43Å; Q116-L254 HydrophobicContact CG-CD1 3.81Å; Y122-L254 HydrophobicContact CE1-CD1 3.66Å; Y122-L254 HydrophobicContact CE1-CG 3.81Å; S146-L254 PolarHBondContact OG-N 3.06Å; Y241-L254 WeakPolarHBondContact CD1-O 3.44Å; D252-L254 PolarHBondContact O-N 3.2Å; D252-L254 VanDerWaalsContact O-N 3.14Å
255	Q	95.4	Very high	94.6	Very high	13 Å²	13	30.4 Å²	30.4	6%	0.061	15%	0.147	C	C	.	.			trans	-71.2	147.6	173.9	55.9	-175.2	93	0	0	110.6	Y111 K177 L178 R180 Y253	Y111-Q255 WeakPolarHBondContact CE1-O 3.48Å; Y111-Q255 WeakPolarHBondContact OH-CG 3.49Å; Y111-Q255 PolarHBondContact OH-O 3.43Å; K177-Q255 VanDerWaalsContact CG-NE2 3.29Å; L178-Q255 PolarHBondContact O-NE2 2.69Å; R180-Q255 HydrophobicContact CG-CB 4.37Å; Y253-Q255 HydrophobicContact CD1-CB 4.47Å; Y253-Q255 HydrophobicContact CE1-CB 3.72Å
256	P	96.1	Very high	94.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.			trans	-66.3	145.4	178.8	27.4	-33.1	0	0	0	110.5	F149 F237 P238 Y241 Y242	F149-P256 HydrophobicContact CD2-CB 4.44Å; F149-P256 HydrophobicContact CE2-CB 4.43Å; F237-P256 HydrophobicContact CB-CG 4.34Å; F237-P256 HydrophobicContact CD1-CB 4.34Å; F237-P256 HydrophobicContact CD1-CG 4.11Å; P238-P256 HydrophobicContact CG-CB 4.02Å; Y241-P256 HydrophobicContact CD1-CB 4.38Å; Y241-P256 HydrophobicContact CD2-CB 4.01Å; Y241-P256 HydrophobicContact CD2-CG 4.27Å; Y241-P256 HydrophobicContact CE2-CB 4.35Å; Y241-P256 HydrophobicContact CG-CB 4.03Å; Y241-P256 HydrophobicContact CG-CG 4.02Å; Y242-P256 HydrophobicContact CE2-CG 4Å
257	L	97.4	Very high	94.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153	-179.6	-56.9	179.1	0	0	0	110.7	F107 L108 Y111 F149 L154 I175 K177	F107-L257 HydrophobicContact CE1-CD1 3.84Å; F107-L257 HydrophobicContact CE1-CD2 3.91Å; F107-L257 HydrophobicContact CZ-CD1 4.31Å; F107-L257 HydrophobicContact CZ-CD2 3.73Å; L108-L257 HydrophobicContact CD2-CD1 4Å; Y111-L257 HydrophobicContact CD1-CD1 3.93Å; Y111-L257 HydrophobicContact CD2-CD1 3.95Å; Y111-L257 HydrophobicContact CE1-CD1 3.63Å; Y111-L257 HydrophobicContact CE1-CG 3.84Å; Y111-L257 HydrophobicContact CE2-CD1 3.7Å; Y111-L257 HydrophobicContact CE2-CD2 4.47Å; Y111-L257 HydrophobicContact CE2-CG 4.36Å; Y111-L257 HydrophobicContact CG-CD1 4.06Å; F149-L257 HydrophobicContact CD1-CD1 4.38Å; F149-L257 HydrophobicContact CD1-CG 4.42Å; F149-L257 HydrophobicContact CE1-CB 3.75Å; F149-L257 HydrophobicContact CE1-CD1 4.13Å; F149-L257 HydrophobicContact CE1-CG 4.12Å; F149-L257 HydrophobicContact CE2-CB 4.48Å; F149-L257 HydrophobicContact CZ-CB 3.74Å; F149-L257 HydrophobicContact CZ-CG 4.48Å; F149-L257 VanDerWaalsContact CZ-O 3.31Å; F149-L257 WeakPolarHBondContact CZ-O 3.46Å; L154-L257 HydrophobicContact CD1-CD1 4.22Å; L154-L257 HydrophobicContact CD2-CB 3.99Å; I175-L257 HydrophobicContact CG2-CB 4.1Å; I175-L257 HydrophobicContact CG2-CD1 3.98Å; I175-L257 HydrophobicContact CG2-CD2 4.19Å; I175-L257 HydrophobicContact CG2-CG 4.32Å; K177-L257 HydrophobicContact CB-CD2 3.71Å
258	V	97.8	Very high	94.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.4	169	-178	0	0	0	0	107.9	V176 I210 G236 F237	V176-V258 PolarHBondContact N-O 3.26Å; V176-V258 PolarHBondContact O-N 2.84Å; I210-V258 HydrophobicContact CG2-CG1 4.03Å; G236-V258 WeakPolarHBondContact O-CG2 3.34Å; F237-V258 HydrophobicContact CD1-CG2 4.02Å; F237-V258 HydrophobicContact CE1-CB 4.42Å; F237-V258 HydrophobicContact CE1-CG2 3.79Å; F237-V258 HydrophobicContact CE2-CG2 4.49Å; F237-V258 HydrophobicContact CG-CG2 4.48Å; F237-V258 HydrophobicContact CZ-CB 4.47Å; F237-V258 HydrophobicContact CZ-CG2 4.05Å
259	A	97.7	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	142.2	169.4	0	0	0	0	0	110.7	L154 C157 L174 I175 Y228 F229	L154-A259 HydrophobicContact CB-CB 4.21Å; L154-A259 HydrophobicContact CD2-CB 3.97Å; C157-A259 HydrophobicContact CB-CB 3.42Å; C157-A259 VanDerWaalsContact CB-CB 3.42Å; L174-A259 CarbonylContact O-C 3.59Å; L174-A259 VanDerWaalsContact O-CA 3.28Å; L174-A259 WeakPolarHBondContact O-CA 3.5Å; I175-A259 HydrophobicContact CG1-CB 4.3Å; Y228-A259 CarbonylContact C-O 3.42Å; Y228-A259 WeakPolarHBondContact CA-O 3.28Å; F229-A259 HydrophobicContact CB-CB 4.26Å; F229-A259 HydrophobicContact CD2-CB 4.34Å; F229-A259 PolarHBondContact N-O 2.96Å; F229-A259 PolarHBondContact O-N 3.33Å
260	I	97.6	Very high	94.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.3	179.2	-51	-172.7	0	0	0	106.8	C173 L174 V176 I210 C212 I226 K227 Y228 F262	C173-I260 CarbonylContact C-O 3.48Å; C173-I260 WeakPolarHBondContact CA-O 3.26Å; L174-I260 PolarHBondContact N-O 3.46Å; L174-I260 PolarHBondContact O-N 2.83Å; V176-I260 HydrophobicContact CB-CD1 4.42Å; V176-I260 HydrophobicContact CG2-CD1 3.5Å; V176-I260 HydrophobicContact CG2-CG1 3.88Å; I210-I260 HydrophobicContact CD1-CD1 3.83Å; I210-I260 HydrophobicContact CG1-CD1 4.43Å; C212-I260 WeakPolarHBondContact SG-CD1 3.39Å; I226-I260 HydrophobicContact CG2-CG2 3.39Å; K227-I260 CarbonylContact O-C 3.59Å; K227-I260 WeakPolarHBondContact O-CA 3.35Å; Y228-I260 HydrophobicContact CD1-CD1 4.2Å; Y228-I260 HydrophobicContact CD1-CG1 3.96Å; Y228-I260 HydrophobicContact CD1-CG2 4.27Å; Y228-I260 HydrophobicContact CE1-CD1 4.05Å; Y228-I260 HydrophobicContact CE1-CG1 4.23Å; Y228-I260 HydrophobicContact CE1-CG2 4.05Å; I260-F262 HydrophobicContact CG2-CE1 4.34Å; I260-F262 HydrophobicContact CG2-CE2 4.03Å; I260-F262 HydrophobicContact CG2-CZ 3.8Å
261	Q	96.9	Very high	94.8	Very high	12 Å²	12	30 Å²	30	6%	0.056	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.7	179.6	-172.4	175.2	25.8	0	0	109.9	K227 F229 T263	K227-Q261 HydrophobicContact CB-CB 4.45Å; K227-Q261 PolarHBondContact N-O 2.89Å; K227-Q261 PolarHBondContact O-N 2.75Å; F229-Q261 HydrophobicContact CD2-CB 4.49Å; F229-Q261 HydrophobicContact CE2-CB 3.71Å; F229-Q261 HydrophobicContact CZ-CB 4.5Å; Q261-T263 PolarHBondContact O-N 3.41Å
262	F	96.4	Very high	94.9	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	103.5	174.1	-60.7	-82.3	0	0	0	108.6	Q171 P172 L174 I223 I226 I260 L265 I273 F298	Q171-F262 CarbonylContact C-O 3.57Å; Q171-F262 WeakPolarHBondContact CA-O 3.08Å; Q171-F262 WeakPolarHBondContact CB-O 3.37Å; P172-F262 PolarHBondContact O-N 3.44Å; L174-F262 HydrophobicContact CD1-CE2 3.76Å; L174-F262 HydrophobicContact CD1-CZ 4.33Å; L174-F262 HydrophobicContact CG-CE2 3.92Å; I223-F262 HydrophobicContact CG2-CD1 4.48Å; I226-F262 HydrophobicContact CD1-CD1 4.2Å; I226-F262 HydrophobicContact CD1-CE1 3.86Å; I226-F262 HydrophobicContact CG1-CD1 3.94Å; I226-F262 HydrophobicContact CG1-CE1 4.05Å; I226-F262 HydrophobicContact CG2-CD1 4.32Å; I226-F262 HydrophobicContact CG2-CE1 4.1Å; I260-F262 HydrophobicContact CG2-CE1 4.34Å; I260-F262 HydrophobicContact CG2-CE2 4.03Å; I260-F262 HydrophobicContact CG2-CZ 3.8Å; F262-L265 HydrophobicContact CB-CD1 3.85Å; F262-L265 HydrophobicContact CB-CD2 3.99Å; F262-L265 HydrophobicContact CB-CG 3.9Å; F262-L265 HydrophobicContact CD1-CD2 4.38Å; F262-L265 HydrophobicContact CG-CD2 4.44Å; F262-I273 HydrophobicContact CD1-CD1 3.56Å; F262-I273 HydrophobicContact CE1-CD1 3.29Å; F262-I273 HydrophobicContact CE1-CG1 4.46Å; F262-I273 HydrophobicContact CE1-CG2 3.91Å; F262-I273 HydrophobicContact CG-CD1 4.41Å; F262-I273 HydrophobicContact CZ-CD1 3.95Å; F262-I273 HydrophobicContact CZ-CG2 4.19Å; F262-F298 AromaticContact CD2-CE2 3.71Å; F262-F298 HydrophobicContact CD2-CE2 3.71Å; F262-F298 AromaticContact CD2-CZ 3.82Å; F262-F298 HydrophobicContact CD2-CZ 3.82Å; F262-F298 AromaticContact CE2-CE2 3.54Å; F262-F298 HydrophobicContact CE2-CE2 3.54Å; F262-F298 AromaticContact CE2-CZ 3.78Å; F262-F298 HydrophobicContact CE2-CZ 3.78Å; F262-F298 HydrophobicContact CG-CE2 4.31Å; F262-F298 AromaticContact CZ-CE2 4Å; F262-F298 HydrophobicContact CZ-CE2 4Å
263	T	94.1	Very high	95	Very high	25 Å²	25	27.9 Å²	27.9	15%	0.153	14%	0.14	C	C	.	.			trans	-81	-26.7	-169.5	64.3	0	0	0	0	113.9	Q171 E225 K227 Q261	Q171-T263 WeakPolarHBondContact CG-O 3.3Å; Q171-T263 PolarHBondContact NE2-O 3.15Å; E225-T263 PolarHBondContact O-N 2.88Å; E225-T263 PolarHBondContact O-OG1 3.39Å; K227-T263 HydrophobicContact CB-CG2 4.42Å; K227-T263 HydrophobicContact CD-CG2 3.72Å; K227-T263 HydrophobicContact CG-CG2 3.84Å; Q261-T263 PolarHBondContact O-N 3.41Å
264	N	92.8	Very high	95.1	Very high	106 Å²	106	27.9 Å²	27.9	57%	0.567	14%	0.141	S	C	*	.			trans	-144.7	115.2	179	-171.5	4	0	0	0	109	G224	G224-N264 PolarHBondContact N-O 3.39Å
265	L	94.2	Very high	95.2	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.037	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-124	131.2	176.4	-66.4	176.4	0	0	0	107.7	P172 I223 F262 L267 L271 I273 F298 V300	P172-L265 HydrophobicContact CG-CD1 3.92Å; I223-L265 HydrophobicContact CB-CD2 4.44Å; I223-L265 HydrophobicContact CG1-CD2 4.05Å; I223-L265 HydrophobicContact CG2-CD2 4.09Å; F262-L265 HydrophobicContact CB-CD1 3.85Å; F262-L265 HydrophobicContact CB-CD2 3.99Å; F262-L265 HydrophobicContact CB-CG 3.9Å; F262-L265 HydrophobicContact CD1-CD2 4.38Å; F262-L265 HydrophobicContact CG-CD2 4.44Å; L265-L267 PolarHBondContact O-N 3.19Å; L265-L271 HydrophobicContact CB-CD1 3.99Å; L265-L271 HydrophobicContact CD2-CD1 3.89Å; L265-L271 HydrophobicContact CG-CD1 4.5Å; L265-I273 HydrophobicContact CD2-CD1 4.32Å; L265-F298 HydrophobicContact CD1-CB 4.22Å; L265-F298 HydrophobicContact CD1-CD2 4.43Å; L265-F298 HydrophobicContact CD1-CG 4.17Å; L265-V300 HydrophobicContact CD1-CG2 4.02Å
266	T	93.4	Very high	95.2	Very high	54 Å²	54	28.6 Å²	28.6	33%	0.331	14%	0.143	S	C	.	.			trans	-58.2	128	170.4	-57	0	0	0	0	110	K222	K222-T266 WeakPolarHBondContact CA-OG1 3.41Å; K222-T266 WeakPolarHBondContact CB-OG1 3.11Å; K222-T266 PolarHBondContact O-N 2.94Å; K222-T266 PolarHBondContact O-OG1 3.49Å; K222-T266 VanDerWaalsContact O-OG1 3.09Å
267	L	93	Very high	95.2	Very high	72 Å²	72	28.6 Å²	28.6	38%	0.377	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	157.2	-176.2	-58.1	174.4	0	0	0	111.3	L265 E269 V300	L265-L267 PolarHBondContact O-N 3.19Å; L267-E269 PolarHBondContact O-N 3.36Å; L267-V300 CarbonylContact C-O 3.4Å; L267-V300 WeakPolarHBondContact CA-O 3.47Å; L267-V300 HydrophobicContact CD2-CB 3.87Å; L267-V300 HydrophobicContact CD2-CG1 3.56Å
268	D	91.8	Very high	95.1	Very high	58 Å²	58	29.7 Å²	29.7	31%	0.31	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	21.1	174.8	-53	-44.6	0	0	0	115.4	V300 T301 S302 K303	D268-V300 PolarHBondContact N-O 3.19Å; D268-T301 VanDerWaalsContact OD1-CA 3.28Å; D268-T301 WeakPolarHBondContact OD1-CA 3.33Å; D268-S302 PolarHBondContact OD1-N 3.46Å; D268-K303 WeakPolarHBondContact OD2-CE 3.33Å; D268-K303 IonicContact OD2-NZ 2.67Å
269	E	92.3	Very high	94.9	Very high	85 Å²	85	30.3 Å²	30.3	40%	0.397	15%	0.154	S	C	.	.	S	Bend	trans	-131.3	158.2	174.5	-65.3	-169.5	177.8	0	0	112.5	K222 L267	K222-E269 WeakPolarHBondContact CE-OE2 3.22Å; K222-E269 IonicContact NZ-OE2 2.67Å; K222-E269 PolarHBondContact NZ-OE2 2.86Å; L267-E269 PolarHBondContact O-N 3.36Å
270	E	94.1	Very high	94.6	Very high	62 Å²	62	34.1 Å²	34.1	29%	0.29	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	109	172.6	-174.3	-164.7	84.7	0	0	109.9	R216 R272 K297 F298	R216-E270 IonicContact NH1-OE1 2.78Å; E270-R272 IonicContact OE1-CZ 3.61Å; E270-R272 IonicContact OE1-NE 2.76Å; E270-R272 PolarHBondContact OE1-NE 3.5Å; E270-R272 IonicContact OE1-NH2 3.85Å; E270-R272 PolarHBondContact OE1-NH2 2.85Å; E270-R272 IonicContact OE2-NH2 3.21Å; E270-K297 HydrophobicContact CG-CB 4.4Å; E270-K297 HydrophobicContact CG-CD 4.36Å; E270-K297 IonicContact OE1-NZ 3.05Å; E270-K297 WeakPolarHBondContact OE2-CD 3.28Å; E270-K297 IonicContact OE2-NZ 3.64Å; E270-K297 PolarHBondContact OE2-NZ 2.93Å; E270-F298 WeakPolarHBondContact CA-O 3.37Å
271	L	95.2	Very high	94.4	Very high	2 Å²	2	36 Å²	36	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.8	177.1	-58.9	175.8	0	0	0	110.7	K222 I223 L265 K297 F298	K222-L271 HydrophobicContact CB-CD2 3.62Å; K222-L271 HydrophobicContact CD-CD2 3.78Å; K222-L271 HydrophobicContact CG-CD2 4.38Å; I223-L271 HydrophobicContact CG1-CB 4.45Å; I223-L271 HydrophobicContact CG1-CD1 4.11Å; L265-L271 HydrophobicContact CB-CD1 3.99Å; L265-L271 HydrophobicContact CD2-CD1 3.89Å; L265-L271 HydrophobicContact CG-CD1 4.5Å; L271-K297 CarbonylContact O-C 3.55Å; L271-K297 VanDerWaalsContact O-CA 3.3Å; L271-K297 WeakPolarHBondContact O-CA 3.28Å; L271-F298 PolarHBondContact N-O 2.94Å; L271-F298 PolarHBondContact O-N 3.43Å
272	R	94.9	Very high	94.2	Very high	66 Å²	66	35.8 Å²	35.8	25%	0.249	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.6	179.1	-59.5	-166.7	178.7	-177.9	1.8	111.6	K215 R216 D219 E270 K297	K215-R272 HydrophobicContact CB-CB 3.92Å; K215-R272 WeakPolarHBondContact CB-O 3.09Å; K215-R272 PolarHBondContact N-O 2.96Å; R216-R272 VanDerWaalsContact NH2-NH2 3.2Å; D219-R272 PolarHBondContact OD2-N 3.32Å; E270-R272 IonicContact OE1-CZ 3.61Å; E270-R272 IonicContact OE1-NE 2.76Å; E270-R272 PolarHBondContact OE1-NE 3.5Å; E270-R272 IonicContact OE1-NH2 3.85Å; E270-R272 PolarHBondContact OE1-NH2 2.85Å; E270-R272 IonicContact OE2-NH2 3.21Å; R272-K297 HydrophobicContact CG-CG 4.23Å
273	I	95.3	Very high	94	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.8	-176.9	-52	-174.5	0	0	0	108.8	C212 K213 I223 F262 L265 D295 V296 F298	C212-I273 HydrophobicContact CB-CG2 4.02Å; K213-I273 WeakPolarHBondContact O-CA 3.36Å; K213-I273 WeakPolarHBondContact O-CG2 3.17Å; I223-I273 HydrophobicContact CD1-CD1 3.93Å; I223-I273 HydrophobicContact CD1-CG1 3.64Å; I223-I273 HydrophobicContact CG1-CD1 4.17Å; I223-I273 HydrophobicContact CG1-CG1 4.4Å; I223-I273 HydrophobicContact CG2-CD1 4.26Å; F262-I273 HydrophobicContact CD1-CD1 3.56Å; F262-I273 HydrophobicContact CE1-CD1 3.29Å; F262-I273 HydrophobicContact CE1-CG1 4.46Å; F262-I273 HydrophobicContact CE1-CG2 3.91Å; F262-I273 HydrophobicContact CG-CD1 4.41Å; F262-I273 HydrophobicContact CZ-CD1 3.95Å; F262-I273 HydrophobicContact CZ-CG2 4.19Å; L265-I273 HydrophobicContact CD2-CD1 4.32Å; I273-D295 CarbonylContact O-C 3.56Å; I273-D295 WeakPolarHBondContact O-CA 3.39Å; I273-V296 HydrophobicContact CB-CG1 3.86Å; I273-V296 HydrophobicContact CG2-CG1 4.49Å; I273-V296 PolarHBondContact N-O 3.19Å; I273-V296 PolarHBondContact O-N 3.44Å; I273-F298 HydrophobicContact CD1-CD2 3.79Å; I273-F298 HydrophobicContact CD1-CE2 4.09Å; I273-F298 HydrophobicContact CG1-CD2 4.46Å
274	E	95.6	Very high	93.9	Very high	11 Å²	11	43 Å²	43	5%	0.051	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.8	171.8	-176.6	-175.3	-130	0	0	108.9	C212 K213 K215 K276 R293	C212-E274 CarbonylContact C-O 3.6Å; C212-E274 VanDerWaalsContact CA-O 3.29Å; C212-E274 WeakPolarHBondContact CA-O 3.47Å; K213-E274 PolarHBondContact N-O 2.86Å; K213-E274 PolarHBondContact O-N 3.02Å; K215-E274 HydrophobicContact CB-CB 4.38Å; E274-K276 HydrophobicContact CG-CD 4.45Å; E274-K276 HydrophobicContact CG-CG 4.34Å; E274-K276 VanDerWaalsContact OE1-CE 3.23Å; E274-K276 WeakPolarHBondContact OE1-CE 3.41Å; E274-K276 IonicContact OE1-NZ 3.01Å; E274-K276 PolarHBondContact OE1-NZ 2.82Å; E274-K276 WeakPolarHBondContact OE2-CE 2.91Å; E274-K276 IonicContact OE2-NZ 2.75Å; E274-K276 PolarHBondContact OE2-NZ 3.48Å; E274-R293 WeakPolarHBondContact OE1-CD 3.18Å; E274-R293 IonicContact OE1-CZ 3.89Å; E274-R293 IonicContact OE1-NE 3.7Å; E274-R293 IonicContact OE1-NH1 2.6Å; E274-R293 PolarHBondContact OE1-NH1 3.15Å
275	C	96.4	Very high	93.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	129	174.5	-64.4	0	0	0	0	110.1	C212 R293 F294	C212-C275 HydrophobicContact CB-CB 4.09Å; C212-C275 WeakPolarHBondContact CB-SG 3.43Å; C212-C275 WeakPolarHBondContact SG-CB 3.28Å; C212-C275 CovalentContact SG-SG 2.03Å; C212-C275 PolarHBondContact SG-SG 3.07Å; C275-R293 CarbonylContact O-C 3.52Å; C275-R293 WeakPolarHBondContact O-CA 3.33Å; C275-R293 VanDerWaalsContact O-CB 3.31Å; C275-R293 WeakPolarHBondContact O-CB 3.44Å; C275-F294 HydrophobicContact CB-CD1 3.94Å; C275-F294 HydrophobicContact CB-CD2 4.29Å; C275-F294 HydrophobicContact CB-CE1 3.4Å; C275-F294 VanDerWaalsContact CB-CE1 3.4Å; C275-F294 HydrophobicContact CB-CE2 3.82Å; C275-F294 HydrophobicContact CB-CG 4.35Å; C275-F294 HydrophobicContact CB-CZ 3.35Å; C275-F294 PolarHBondContact N-O 3.46Å; C275-F294 PolarHBondContact O-N 3.42Å; C275-F294 WeakPolarHBondContact SG-CZ 3.44Å
276	K	96.4	Very high	93.6	Very high	38 Å²	38	48.8 Å²	48.8	17%	0.165	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140	-176.6	-82.1	169.2	167.1	159.5	0	111.2	I210 H211 E274 Y278 Y284 R293	I210-K276 WeakPolarHBondContact CA-O 3.15Å; H211-K276 PolarHBondContact N-O 3.19Å; H211-K276 PolarHBondContact O-N 3.4Å; E274-K276 HydrophobicContact CG-CD 4.45Å; E274-K276 HydrophobicContact CG-CG 4.34Å; E274-K276 VanDerWaalsContact OE1-CE 3.23Å; E274-K276 WeakPolarHBondContact OE1-CE 3.41Å; E274-K276 IonicContact OE1-NZ 3.01Å; E274-K276 PolarHBondContact OE1-NZ 2.82Å; E274-K276 WeakPolarHBondContact OE2-CE 2.91Å; E274-K276 IonicContact OE2-NZ 2.75Å; E274-K276 PolarHBondContact OE2-NZ 3.48Å; K276-Y278 HydrophobicContact CB-CD2 4.28Å; K276-Y278 HydrophobicContact CB-CE2 3.52Å; K276-Y278 WeakPolarHBondContact O-CD2 3.3Å; K276-Y278 WeakPolarHBondContact O-CE2 3.41Å; K276-Y284 HydrophobicContact CB-CE1 4.26Å; K276-Y284 HydrophobicContact CD-CE1 4.45Å; K276-Y284 HydrophobicContact CG-CE1 3.99Å; K276-R293 HydrophobicContact CG-CB 3.61Å
277	V	95.8	Very high	93.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.5	167.3	148.8	0	0	0	0	108.8	L76 L178 I208 P209 I210 F237 I282 Y284 G292	L76-V277 HydrophobicContact CD1-CB 4.46Å; L76-V277 HydrophobicContact CD1-CG2 3.65Å; L76-V277 HydrophobicContact CD2-CB 4.36Å; L76-V277 HydrophobicContact CD2-CG2 3.95Å; L76-V277 HydrophobicContact CG-CG2 4.42Å; L178-V277 HydrophobicContact CD1-CG1 4.4Å; I208-V277 HydrophobicContact CG2-CG1 3.48Å; I208-V277 VanDerWaalsContact CG2-CG1 3.48Å; P209-V277 WeakPolarHBondContact O-CA 3.41Å; I210-V277 HydrophobicContact CB-CG2 3.96Å; I210-V277 HydrophobicContact CD1-CG2 4.25Å; I210-V277 HydrophobicContact CG1-CG2 4.14Å; F237-V277 HydrophobicContact CD2-CG2 3.97Å; F237-V277 HydrophobicContact CE2-CG2 3.52Å; V277-I282 HydrophobicContact CG1-CD1 4.18Å; V277-I282 HydrophobicContact CG1-CG1 3.95Å; V277-I282 HydrophobicContact CG1-CG2 4.12Å; V277-I282 WeakPolarHBondContact O-CG2 3.1Å; V277-Y284 PolarHBondContact O-OH 3.33Å; V277-G292 PolarHBondContact N-O 3.33Å
278	Y	94.8	Very high	93.2	Very high	24 Å²	24	55.7 Å²	55.7	9%	0.094	27%	0.267	C	S	.	.			trans	-109.8	124.5	-175.9	-61.6	-98.6	0	0	0	110.6	P189 L195 P196 L199 I208 P209 H211 K276	P189-Y278 WeakPolarHBondContact CD-O 3.27Å; L195-Y278 HydrophobicContact CD2-CD1 3.87Å; L195-Y278 HydrophobicContact CD2-CG 3.95Å; P196-Y278 HydrophobicContact CG-CE1 4.34Å; P196-Y278 HydrophobicContact CG-CE2 4.25Å; L199-Y278 HydrophobicContact CD1-CD2 3.78Å; L199-Y278 HydrophobicContact CD1-CE2 4.09Å; L199-Y278 HydrophobicContact CD1-CG 4.3Å; I208-Y278 VanDerWaalsContact CG2-O 3.31Å; I208-Y278 WeakPolarHBondContact CG2-O 3.4Å; P209-Y278 WeakPolarHBondContact CD-O 3.33Å; P209-Y278 PolarHBondContact O-N 2.83Å; H211-Y278 HydrophobicContact CB-CE2 3.95Å; K276-Y278 HydrophobicContact CB-CD2 4.28Å; K276-Y278 HydrophobicContact CB-CE2 3.52Å; K276-Y278 WeakPolarHBondContact O-CD2 3.3Å; K276-Y278 WeakPolarHBondContact O-CE2 3.41Å
279	G	93.5	Very high	93.1	Very high	13 Å²	13	60 Å²	60	13%	0.134	28%	0.278	C	S	.	.			trans	-166	160.7	175.9	0	0	0	0	0	111.4	K187 N281 I282	K187-G279 CarbonylContact O-C 3.41Å; K187-G279 WeakPolarHBondContact O-CA 3.48Å; G279-N281 PolarHBondContact O-N 2.8Å; G279-I282 PolarHBondContact O-N 2.85Å
280	D	92.6	Very high	93.1	Very high	80 Å²	80	60.7 Å²	60.7	43%	0.428	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.7	-175	-73.6	-10.3	0	0	0	113.4	K187 P189 T190	K187-D280 HydrophobicContact CB-CB 4.02Å; K187-D280 PolarHBondContact O-N 3.32Å; P189-D280 WeakPolarHBondContact CA-OD1 3.49Å; T190-D280 VanDerWaalsContact CB-OD2 3.27Å; T190-D280 WeakPolarHBondContact CB-OD2 3.22Å; T190-D280 PolarHBondContact N-OD1 2.95Å; T190-D280 PolarHBondContact N-OD2 3.48Å; T190-D280 PolarHBondContact OG1-OD2 3.16Å
281	N	92.7	Very high	93.2	Very high	40 Å²	40	59 Å²	59	21%	0.214	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	31.8	176.9	67.5	-22.1	0	0	0	112.6	F184 R185 K187 G279	F184-N281 WeakPolarHBondContact CE2-ND2 3.42Å; R185-N281 PolarHBondContact O-ND2 3.38Å; K187-N281 PolarHBondContact N-OD1 3.5Å; G279-N281 PolarHBondContact O-N 2.8Å
282	I	93.1	Very high	93.1	Very high	6 Å²	6	59 Å²	59	3%	0.031	27%	0.27	C	S	.	.			trans	-117.3	111.7	172.5	-53.8	-68.1	0	0	0	107.3	P74 F184 V277 G279 Y284	P74-I282 HydrophobicContact CG-CD1 3.43Å; P74-I282 VanDerWaalsContact CG-CD1 3.43Å; F184-I282 HydrophobicContact CE1-CD1 4.39Å; F184-I282 HydrophobicContact CZ-CD1 3.97Å; V277-I282 HydrophobicContact CG1-CD1 4.18Å; V277-I282 HydrophobicContact CG1-CG1 3.95Å; V277-I282 HydrophobicContact CG1-CG2 4.12Å; V277-I282 WeakPolarHBondContact O-CG2 3.1Å; G279-I282 PolarHBondContact O-N 2.85Å; I282-Y284 HydrophobicContact CG2-CE1 4.41Å
283	D	91.5	Very high	93.1	Very high	92 Å²	92	57.5 Å²	57.5	49%	0.492	26%	0.264	S	S	.	.			trans	-106.7	160.9	172.2	-36.4	-63	0	0	0	111.5	P73 Q291	P73-D283 HydrophobicContact CB-CB 4.44Å; P73-D283 HydrophobicContact CG-CB 3.66Å; P73-D283 WeakPolarHBondContact CG-OD2 3.37Å; D283-Q291 WeakPolarHBondContact O-CG 3.46Å; D283-Q291 PolarHBondContact O-NE2 3.25Å; D283-Q291 VanDerWaalsContact O-NE2 3.14Å
284	Y	92.7	Very high	93.2	Very high	85 Å²	85	57.4 Å²	57.4	33%	0.333	26%	0.264	S	S	.	.			trans	-117.1	154.7	-179.6	-44.5	-83.9	0	0	0	109.8	K276 V277 I282 G292 R293	K276-Y284 HydrophobicContact CB-CE1 4.26Å; K276-Y284 HydrophobicContact CD-CE1 4.45Å; K276-Y284 HydrophobicContact CG-CE1 3.99Å; V277-Y284 PolarHBondContact O-OH 3.33Å; I282-Y284 HydrophobicContact CG2-CE1 4.41Å; Y284-G292 WeakPolarHBondContact CE1-O 3.12Å; Y284-R293 HydrophobicContact CD1-CB 4.16Å; Y284-R293 HydrophobicContact CD1-CG 4.36Å; Y284-R293 HydrophobicContact CE1-CB 4.46Å
285	N	91.9	Very high	93.1	Very high	62 Å²	62	57.8 Å²	57.8	33%	0.332	27%	0.267	S	S	.	.			trans	-131.6	144	178.1	-170.1	-34.1	0	0	0	109.8	K287 D288 Q291 R293	N285-K287 WeakPolarHBondContact OD1-CB 3.27Å; N285-K287 PolarHBondContact OD1-N 3.49Å; N285-D288 HydrophobicContact CB-CB 4.11Å; N285-D288 CarbonylContact O-C 3.56Å; N285-D288 PolarHBondContact OD1-N 3.33Å; N285-Q291 HydrophobicContact CB-CB 4.22Å; N285-Q291 PolarHBondContact ND2-OE1 2.96Å; N285-R293 PolarHBondContact O-NH2 2.85Å
286	E	88.9	Confident	93	Very high	173 Å²	173	57.9 Å²	57.9	81%	0.808	27%	0.267	S	S	*	.	S	Bend	trans	-75.7	-33.8	177.2	-64.8	-168.9	158.1	0	0	112.2
287	K	89.3	Confident	93	Very high	199 Å²	199	58.4 Å²	58.4	87%	0.865	27%	0.269	S	S	*	.	S	Bend	trans	-76.7	-45.6	177.3	-64.2	-176.2	179.3	179.1	0	111	N285 R289	N285-K287 WeakPolarHBondContact OD1-CB 3.27Å; N285-K287 PolarHBondContact OD1-N 3.49Å; K287-R289 PolarHBondContact O-N 2.91Å
288	D	89.1	Confident	92.9	Very high	73 Å²	73	58.5 Å²	58.5	39%	0.39	27%	0.27	S	S	.	.			trans	-93.1	97.6	175.6	-170.9	-7.3	0	0	0	111	N285 Y290 Q291	N285-D288 HydrophobicContact CB-CB 4.11Å; N285-D288 CarbonylContact O-C 3.56Å; N285-D288 PolarHBondContact OD1-N 3.33Å; D288-Y290 PolarHBondContact O-N 3.23Å; D288-Y290 WeakPolarHBondContact OD1-CA 3.09Å; D288-Y290 WeakPolarHBondContact OD1-CB 3.32Å; D288-Y290 PolarHBondContact OD1-N 2.93Å; D288-Q291 HydrophobicContact CB-CB 4.13Å; D288-Q291 PolarHBondContact O-N 3.34Å; D288-Q291 PolarHBondContact OD1-N 2.86Å
289	R	89.7	Confident	92.9	Very high	148 Å²	148	58.5 Å²	58.5	56%	0.558	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-1	178.6	-61.9	-173	-176.5	178.9	2.9	114.1	K287	K287-R289 PolarHBondContact O-N 2.91Å
290	Y	92.6	Very high	93	Very high	100 Å²	100	58 Å²	58	39%	0.392	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-7.4	176.4	-67.6	-80.8	0	0	0	113.4	G75 L76 S85 D288 G292 R293 F294	G75-Y290 CarbonylContact C-O 3.46Å; G75-Y290 WeakPolarHBondContact CA-O 3.28Å; L76-Y290 PolarHBondContact N-O 3.41Å; S85-Y290 PolarHBondContact OG-OH 3.26Å; D288-Y290 PolarHBondContact O-N 3.23Å; D288-Y290 WeakPolarHBondContact OD1-CA 3.09Å; D288-Y290 WeakPolarHBondContact OD1-CB 3.32Å; D288-Y290 PolarHBondContact OD1-N 2.93Å; Y290-G292 PolarHBondContact O-N 2.9Å; Y290-R293 CarbonylContact C-O 3.46Å; Y290-R293 WeakPolarHBondContact CA-O 3.41Å; Y290-R293 VanDerWaalsContact O-O 3.09Å; Y290-F294 HydrophobicContact CD1-CB 4.1Å; Y290-F294 HydrophobicContact CE1-CB 4.24Å
291	Q	94.8	Very high	93.1	Very high	27 Å²	27	56.1 Å²	56.1	13%	0.126	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-75.5	111.4	179.3	-161.6	-169.5	-47.3	0	0	110.5	P73 D283 N285 D288 R293	P73-Q291 HydrophobicContact CB-CG 4.38Å; P73-Q291 VanDerWaalsContact CG-NE2 3.35Å; D283-Q291 WeakPolarHBondContact O-CG 3.46Å; D283-Q291 PolarHBondContact O-NE2 3.25Å; D283-Q291 VanDerWaalsContact O-NE2 3.14Å; N285-Q291 HydrophobicContact CB-CB 4.22Å; N285-Q291 PolarHBondContact ND2-OE1 2.96Å; D288-Q291 HydrophobicContact CB-CB 4.13Å; D288-Q291 PolarHBondContact O-N 3.34Å; D288-Q291 PolarHBondContact OD1-N 2.86Å; Q291-R293 PolarHBondContact O-N 2.84Å
292	G	94.1	Very high	92.8	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	66.3	-7.1	-176.6	0	0	0	0	0	116.4	P74 V277 Y284 Y290	P74-G292 PolarHBondContact O-N 2.94Å; V277-G292 PolarHBondContact N-O 3.33Å; Y284-G292 WeakPolarHBondContact CE1-O 3.12Å; Y290-G292 PolarHBondContact O-N 2.9Å
293	R	95.4	Very high	91.9	Very high	35 Å²	35	62.4 Å²	62.4	13%	0.132	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	169.1	-175	68.5	178.8	169	174.3	-7.2	111.9	E274 C275 K276 Y284 N285 Y290 Q291	E274-R293 WeakPolarHBondContact OE1-CD 3.18Å; E274-R293 IonicContact OE1-CZ 3.89Å; E274-R293 IonicContact OE1-NE 3.7Å; E274-R293 IonicContact OE1-NH1 2.6Å; E274-R293 PolarHBondContact OE1-NH1 3.15Å; C275-R293 CarbonylContact O-C 3.52Å; C275-R293 WeakPolarHBondContact O-CA 3.33Å; C275-R293 VanDerWaalsContact O-CB 3.31Å; C275-R293 WeakPolarHBondContact O-CB 3.44Å; K276-R293 HydrophobicContact CG-CB 3.61Å; Y284-R293 HydrophobicContact CD1-CB 4.16Å; Y284-R293 HydrophobicContact CD1-CG 4.36Å; Y284-R293 HydrophobicContact CE1-CB 4.46Å; N285-R293 PolarHBondContact O-NH2 2.85Å; Y290-R293 CarbonylContact C-O 3.46Å; Y290-R293 WeakPolarHBondContact CA-O 3.41Å; Y290-R293 VanDerWaalsContact O-O 3.09Å; Q291-R293 PolarHBondContact O-N 2.84Å
294	F	95.4	Very high	90.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.6	160.2	67	-93.3	0	0	0	110.1	L76 H78 L174 V176 C275 Y290 V296	L76-F294 HydrophobicContact CB-CD1 4.32Å; L76-F294 HydrophobicContact CD2-CD1 3.59Å; L76-F294 HydrophobicContact CD2-CE1 3.83Å; L76-F294 HydrophobicContact CG-CD1 3.73Å; L76-F294 HydrophobicContact CG-CE1 4.12Å; H78-F294 HydrophobicContact CB-CE1 4.29Å; H78-F294 HydrophobicContact CB-CE2 4.32Å; H78-F294 HydrophobicContact CB-CZ 4.11Å; H78-F294 AromaticContact CE1-CD2 3.59Å; H78-F294 AromaticContact CG-CE2 3.98Å; H78-F294 AromaticContact ND1-CD2 3.18Å; H78-F294 WeakPolarHBondContact ND1-CD2 3.36Å; H78-F294 AromaticContact ND1-CE2 3.55Å; H78-F294 AromaticContact ND1-CG 3.44Å; H78-F294 WeakPolarHBondContact ND1-CG 3.24Å; L174-F294 HydrophobicContact CD1-CE2 4.05Å; L174-F294 HydrophobicContact CD1-CZ 4.35Å; V176-F294 HydrophobicContact CB-CE1 4.36Å; V176-F294 HydrophobicContact CG1-CD1 4.36Å; V176-F294 HydrophobicContact CG1-CE1 3.64Å; V176-F294 HydrophobicContact CG2-CE1 3.69Å; V176-F294 HydrophobicContact CG2-CZ 3.75Å; C275-F294 HydrophobicContact CB-CD1 3.94Å; C275-F294 HydrophobicContact CB-CD2 4.29Å; C275-F294 HydrophobicContact CB-CE1 3.4Å; C275-F294 VanDerWaalsContact CB-CE1 3.4Å; C275-F294 HydrophobicContact CB-CE2 3.82Å; C275-F294 HydrophobicContact CB-CG 4.35Å; C275-F294 HydrophobicContact CB-CZ 3.35Å; C275-F294 PolarHBondContact N-O 3.46Å; C275-F294 PolarHBondContact O-N 3.42Å; C275-F294 WeakPolarHBondContact SG-CZ 3.44Å; Y290-F294 HydrophobicContact CD1-CB 4.1Å; Y290-F294 HydrophobicContact CE1-CB 4.24Å; F294-V296 HydrophobicContact CD2-CB 4.34Å; F294-V296 HydrophobicContact CE2-CB 4.24Å; F294-V296 HydrophobicContact CE2-CG1 4.1Å
295	D	94.4	Very high	90.3	Very high	19 Å²	19	65.2 Å²	65.2	10%	0.102	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	143.5	166.6	-60.7	-44.2	0	0	0	109.1	S85 K215 I273	S85-D295 WeakPolarHBondContact CB-O 3.48Å; K215-D295 IonicContact NZ-OD1 3.85Å; K215-D295 PolarHBondContact NZ-OD1 3.1Å; K215-D295 IonicContact NZ-OD2 2.7Å; K215-D295 PolarHBondContact NZ-OD2 2.91Å; I273-D295 CarbonylContact O-C 3.56Å; I273-D295 WeakPolarHBondContact O-CA 3.39Å
296	V	94.9	Very high	90.2	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.4	169	64.8	0	0	0	0	109.2	S85 I87 L174 I273 F294 F298	S85-V296 WeakPolarHBondContact O-CA 3.26Å; I87-V296 HydrophobicContact CD1-CG2 3.82Å; I87-V296 HydrophobicContact CG1-CG2 4.19Å; L174-V296 HydrophobicContact CD1-CB 4.39Å; L174-V296 HydrophobicContact CD1-CG1 3.99Å; L174-V296 HydrophobicContact CD1-CG2 4.25Å; I273-V296 HydrophobicContact CB-CG1 3.86Å; I273-V296 HydrophobicContact CG2-CG1 4.49Å; I273-V296 PolarHBondContact N-O 3.19Å; I273-V296 PolarHBondContact O-N 3.44Å; F294-V296 HydrophobicContact CD2-CB 4.34Å; F294-V296 HydrophobicContact CE2-CB 4.24Å; F294-V296 HydrophobicContact CE2-CG1 4.1Å; V296-F298 HydrophobicContact CB-CE2 4.48Å; V296-F298 HydrophobicContact CG1-CD2 4.16Å; V296-F298 HydrophobicContact CG1-CE2 3.66Å; V296-F298 HydrophobicContact CG1-CZ 4.45Å; V296-F298 HydrophobicContact CG2-CD2 4.36Å; V296-F298 HydrophobicContact CG2-CE2 3.96Å; V296-F298 HydrophobicContact CG2-CZ 4.11Å
297	K	95.1	Very high	90.3	Very high	50 Å²	50	59.3 Å²	59.3	22%	0.217	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.2	172.1	-50.6	-176.3	177.6	-175.1	0	109.4	S85 E86 I87 E270 L271 R272	S85-K297 PolarHBondContact O-N 3Å; E86-K297 CarbonylContact C-O 3.48Å; E86-K297 HydrophobicContact CB-CB 4.42Å; E86-K297 HydrophobicContact CG-CB 4.25Å; I87-K297 PolarHBondContact N-O 3.23Å; E270-K297 HydrophobicContact CG-CB 4.4Å; E270-K297 HydrophobicContact CG-CD 4.36Å; E270-K297 IonicContact OE1-NZ 3.05Å; E270-K297 WeakPolarHBondContact OE2-CD 3.28Å; E270-K297 IonicContact OE2-NZ 3.64Å; E270-K297 PolarHBondContact OE2-NZ 2.93Å; L271-K297 CarbonylContact O-C 3.55Å; L271-K297 VanDerWaalsContact O-CA 3.3Å; L271-K297 WeakPolarHBondContact O-CA 3.28Å; R272-K297 HydrophobicContact CG-CG 4.23Å
298	F	94.9	Very high	90.3	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.5	174	-75.8	-73.9	0	0	0	110.5	I87 P172 L174 F262 L265 E270 L271 I273 V296	I87-F298 HydrophobicContact CB-CD1 3.76Å; I87-F298 HydrophobicContact CB-CE1 3.74Å; I87-F298 HydrophobicContact CD1-CE1 3.8Å; I87-F298 HydrophobicContact CD1-CZ 4.12Å; I87-F298 HydrophobicContact CG1-CE1 4.35Å; I87-F298 HydrophobicContact CG2-CD1 3.9Å; I87-F298 HydrophobicContact CG2-CE1 3.74Å; I87-F298 WeakPolarHBondContact O-CA 3.18Å; P172-F298 HydrophobicContact CB-CE1 3.99Å; P172-F298 HydrophobicContact CG-CD1 4.01Å; P172-F298 HydrophobicContact CG-CE1 3.61Å; P172-F298 HydrophobicContact CG-CZ 4.12Å; L174-F298 HydrophobicContact CD1-CE2 4.21Å; L174-F298 HydrophobicContact CD1-CZ 3.87Å; L174-F298 HydrophobicContact CD2-CZ 3.97Å; L174-F298 HydrophobicContact CG-CZ 3.97Å; F262-F298 AromaticContact CD2-CE2 3.71Å; F262-F298 HydrophobicContact CD2-CE2 3.71Å; F262-F298 AromaticContact CD2-CZ 3.82Å; F262-F298 HydrophobicContact CD2-CZ 3.82Å; F262-F298 AromaticContact CE2-CE2 3.54Å; F262-F298 HydrophobicContact CE2-CE2 3.54Å; F262-F298 AromaticContact CE2-CZ 3.78Å; F262-F298 HydrophobicContact CE2-CZ 3.78Å; F262-F298 HydrophobicContact CG-CE2 4.31Å; F262-F298 AromaticContact CZ-CE2 4Å; F262-F298 HydrophobicContact CZ-CE2 4Å; L265-F298 HydrophobicContact CD1-CB 4.22Å; L265-F298 HydrophobicContact CD1-CD2 4.43Å; L265-F298 HydrophobicContact CD1-CG 4.17Å; E270-F298 WeakPolarHBondContact CA-O 3.37Å; L271-F298 PolarHBondContact N-O 2.94Å; L271-F298 PolarHBondContact O-N 3.43Å; I273-F298 HydrophobicContact CD1-CD2 3.79Å; I273-F298 HydrophobicContact CD1-CE2 4.09Å; I273-F298 HydrophobicContact CG1-CD2 4.46Å; V296-F298 HydrophobicContact CB-CE2 4.48Å; V296-F298 HydrophobicContact CG1-CD2 4.16Å; V296-F298 HydrophobicContact CG1-CE2 3.66Å; V296-F298 HydrophobicContact CG1-CZ 4.45Å; V296-F298 HydrophobicContact CG2-CD2 4.36Å; V296-F298 HydrophobicContact CG2-CE2 3.96Å; V296-F298 HydrophobicContact CG2-CZ 4.11Å
299	T	95.3	Very high	90.4	Very high	25 Å²	25	49.8 Å²	49.8	15%	0.153	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	99.9	166.6	-58.9	0	0	0	0	107.7	I87 T88 F89 T301	I87-T299 PolarHBondContact O-N 3.37Å; T88-T299 WeakPolarHBondContact CA-O 3.44Å; T88-T299 HydrophobicContact CG2-CG2 4.17Å; F89-T299 PolarHBondContact N-O 2.93Å; F89-T299 VanDerWaalsContact N-O 3.12Å; T299-T301 HydrophobicContact CG2-CG2 4.32Å
300	V	94.8	Very high	90.5	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	115.7	-177.8	-172.4	0	0	0	0	107.9	F89 V91 L265 L267 D268	F89-V300 HydrophobicContact CD1-CG2 4.5Å; F89-V300 HydrophobicContact CE1-CG1 4.47Å; F89-V300 HydrophobicContact CE1-CG2 3.71Å; F89-V300 HydrophobicContact CE2-CG1 3.87Å; F89-V300 HydrophobicContact CZ-CB 4.38Å; F89-V300 HydrophobicContact CZ-CG1 3.84Å; F89-V300 HydrophobicContact CZ-CG2 3.73Å; V91-V300 HydrophobicContact CG2-CG1 3.49Å; V91-V300 VanDerWaalsContact CG2-CG1 3.49Å; L265-V300 HydrophobicContact CD1-CG2 4.02Å; L267-V300 CarbonylContact C-O 3.4Å; L267-V300 WeakPolarHBondContact CA-O 3.47Å; L267-V300 HydrophobicContact CD2-CB 3.87Å; L267-V300 HydrophobicContact CD2-CG1 3.56Å; D268-V300 PolarHBondContact N-O 3.19Å
301	T	93.5	Very high	90.3	Very high	40 Å²	40	39.1 Å²	39.1	25%	0.245	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	149.5	-178.2	55.8	0	0	0	0	111.5	F89 N90 V91 D268 T299	F89-T301 PolarHBondContact O-N 3.21Å; F89-T301 PolarHBondContact O-OG1 2.9Å; N90-T301 WeakPolarHBondContact CA-O 3.26Å; N90-T301 WeakPolarHBondContact CA-OG1 3.3Å; N90-T301 VanDerWaalsContact CB-OG1 3.26Å; N90-T301 WeakPolarHBondContact CB-OG1 3.24Å; N90-T301 PolarHBondContact OD1-O 2.86Å; V91-T301 PolarHBondContact N-O 3.35Å; D268-T301 VanDerWaalsContact OD1-CA 3.28Å; D268-T301 WeakPolarHBondContact OD1-CA 3.33Å; T299-T301 HydrophobicContact CG2-CG2 4.32Å
302	S	86.5	Confident	90	Very high	37 Å²	37	40.1 Å²	40.1	26%	0.259	23%	0.226	S	C	.	.			trans	-126.1	0.9	174.7	71.4	0	0	0	0	113.9	K92 D268	K92-S302 WeakPolarHBondContact CD-O 3.24Å; K92-S302 WeakPolarHBondContact CE-O 3.37Å; K92-S302 PolarHBondContact NZ-O 3.4Å; D268-S302 PolarHBondContact OD1-N 3.46Å
303	K	75.6	Confident	89.6	Confident	141 Å²	141	43.4 Å²	43.4	61%	0.613	24%	0.244	S	C	*	.			trans	-77.4	144.8	176.6	-66.5	173.5	-178.5	163.3	0	109.8	N90 D268	N90-K303 PolarHBondContact ND2-O 2.97Å; D268-K303 WeakPolarHBondContact OD2-CE 3.33Å; D268-K303 IonicContact OD2-NZ 2.67Å
304	S	59.7	Low	89.1	Confident	169 Å²	169	44.2 Å²	44.2	100%	1.182	26%	0.255	S	S	*	.			trans	-76.4	0	174.3	-172.7	0	0	0	0	111.1

Retrieved 304 of 304 residues in 190.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).