A0A077ZM45_TRITR Loading...

DNA pol E B domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZM45, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 337 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	66	Low	72.9	Confident	89 Å²	89	116.5 Å²	116.5	44%	0.438	56%	0.558	S	S	.	*				0	146.1	0	-168.5	177.7	-174.4	0	0	107.9	L12 L14 F20	M1-L12 HydrophobicContact CB-CB 4.37Å; M1-L12 PolarHBondContact N-O 3.26Å; M1-L12 PolarHBondContact O-N 3.12Å; M1-L14 HydrophobicContact CB-CD1 3.64Å; M1-L14 HydrophobicContact CG-CD1 4.3Å; M1-L14 HydrophobicContact SD-CD1 3.65Å; M1-F20 HydrophobicContact CE-CB 3.4Å; M1-F20 HydrophobicContact CE-CG 4.08Å; M1-F20 HydrophobicContact SD-CB 3.45Å; M1-F20 WeakPolarHBondContact SD-CB 3.47Å; M1-F20 HydrophobicContact SD-CD2 3.89Å; M1-F20 HydrophobicContact SD-CG 3.87Å
2	L	71.1	Confident	72.2	Confident	127 Å²	127	107.3 Å²	107.3	67%	0.665	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	133.4	169.2	-70.8	169.5	0	0	0	107.7	K11	L2-K11 HydrophobicContact CD2-CB 4.29Å; L2-K11 HydrophobicContact CD2-CG 4.37Å
3	Y	75.3	Confident	71.4	Confident	81 Å²	81	107.7 Å²	107.7	32%	0.318	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.4	171.1	-176.2	-93.9	0	0	0	108.2	H9 Q10 L12 L26 V28	Y3-H9 WeakPolarHBondContact O-CA 3.49Å; Y3-Q10 PolarHBondContact N-O 3.43Å; Y3-Q10 PolarHBondContact O-N 2.8Å; Y3-L12 HydrophobicContact CD2-CD1 4.16Å; Y3-L12 HydrophobicContact CG-CD1 4.25Å; Y3-L12 HydrophobicContact CG-CD2 4.47Å; Y3-L12 HydrophobicContact CG-CG 4.5Å; Y3-L26 WeakPolarHBondContact CE2-O 3.42Å; Y3-L26 PolarHBondContact OH-O 3.38Å; Y3-V28 HydrophobicContact CD2-CG1 4.48Å; Y3-V28 HydrophobicContact CD2-CG2 4.47Å; Y3-V28 HydrophobicContact CE2-CG1 4.5Å; Y3-V28 HydrophobicContact CE2-CG2 4.31Å
4	E	78.6	Confident	70.6	Confident	139 Å²	139	102.1 Å²	102.1	65%	0.65	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.7	179.6	-176.1	165.4	177.1	0	0	109.4	H9	E4-H9 WeakPolarHBondContact CG-ND1 3.32Å; E4-H9 IonicContact OE1-CE1 3.39Å; E4-H9 PolarHBondContact OE1-CE1 2.96Å; E4-H9 IonicContact OE1-ND1 2.82Å; E4-H9 IonicContact OE2-CE1 3.27Å; E4-H9 PolarHBondContact OE2-CE1 2.99Å; E4-H9 VanDerWaalsContact OE2-CE1 3.29Å; E4-H9 IonicContact OE2-ND1 2.65Å; E4-H9 PolarHBondContact OE2-ND1 3.42Å
5	S	78.1	Confident	69.4	Low	51 Å²	51	103.2 Å²	103.2	36%	0.357	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	166.4	170.6	73.1	0	0	0	0	108.5	L7 G8	S5-L7 PolarHBondContact O-N 3.33Å; S5-L7 PolarHBondContact OG-N 2.91Å; S5-G8 PolarHBondContact N-O 2.7Å; S5-G8 PolarHBondContact O-N 2.9Å; S5-G8 VanDerWaalsContact O-N 3.09Å; S5-G8 PolarHBondContact OG-N 3.36Å; S5-G8 PolarHBondContact OG-O 3.13Å
6	R	74.9	Confident	68.6	Low	260 Å²	260	108.4 Å²	108.4	98%	0.981	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.3	174.6	-67	-175.1	179.2	-177.2	-0.9	114.2
7	L	71.7	Confident	68	Low	176 Å²	176	105.7 Å²	105.7	92%	0.921	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-6.8	-176.1	-63.1	173.3	0	0	0	113.4	S5	S5-L7 PolarHBondContact O-N 3.33Å; S5-L7 PolarHBondContact OG-N 2.91Å
8	G	72.8	Confident	67.4	Low	32 Å²	32	107.6 Å²	107.6	33%	0.33	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-174.6	-179.1	0	0	0	0	0	113.7	S5	S5-G8 PolarHBondContact N-O 2.7Å; S5-G8 PolarHBondContact O-N 2.9Å; S5-G8 VanDerWaalsContact O-N 3.09Å; S5-G8 PolarHBondContact OG-N 3.36Å; S5-G8 PolarHBondContact OG-O 3.13Å
9	H	75.7	Confident	67.1	Low	123 Å²	123	106.4 Å²	106.4	57%	0.569	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.7	-175.2	-46.4	-90.5	0	0	0	111.4	Y3 E4	Y3-H9 WeakPolarHBondContact O-CA 3.49Å; E4-H9 WeakPolarHBondContact CG-ND1 3.32Å; E4-H9 IonicContact OE1-CE1 3.39Å; E4-H9 PolarHBondContact OE1-CE1 2.96Å; E4-H9 IonicContact OE1-ND1 2.82Å; E4-H9 IonicContact OE2-CE1 3.27Å; E4-H9 PolarHBondContact OE2-CE1 2.99Å; E4-H9 VanDerWaalsContact OE2-CE1 3.29Å; E4-H9 IonicContact OE2-ND1 2.65Å; E4-H9 PolarHBondContact OE2-ND1 3.42Å
10	Q	66.3	Low	67	Low	67 Å²	67	102.5 Å²	102.5	31%	0.313	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.5	174.3	-170.2	62.3	26.3	0	0	109.6	Y3 L12 L32 G36 F38	Y3-Q10 PolarHBondContact N-O 3.43Å; Y3-Q10 PolarHBondContact O-N 2.8Å; Q10-L12 PolarHBondContact O-N 3.33Å; Q10-L32 VanDerWaalsContact NE2-CD1 3.29Å; Q10-G36 PolarHBondContact NE2-O 2.85Å; Q10-F38 HydrophobicContact CG-CB 3.94Å
11	K	71.7	Confident	67	Low	136 Å²	136	100 Å²	100	59%	0.591	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.9	174.5	-168	174.4	-178.3	179	0	109.4	L2 T37 F38	L2-K11 HydrophobicContact CD2-CB 4.29Å; L2-K11 HydrophobicContact CD2-CG 4.37Å; K11-T37 WeakPolarHBondContact O-CA 3.48Å; K11-F38 PolarHBondContact O-N 2.94Å
12	L	64.5	Low	67.5	Low	7 Å²	7	100.7 Å²	100.7	4%	0.037	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	132.4	175.4	-59.3	-175.3	0	0	0	110.8	M1 Y3 Q10 L14 V28 F38 V40	M1-L12 HydrophobicContact CB-CB 4.37Å; M1-L12 PolarHBondContact N-O 3.26Å; M1-L12 PolarHBondContact O-N 3.12Å; Y3-L12 HydrophobicContact CD2-CD1 4.16Å; Y3-L12 HydrophobicContact CG-CD1 4.25Å; Y3-L12 HydrophobicContact CG-CD2 4.47Å; Y3-L12 HydrophobicContact CG-CG 4.5Å; Q10-L12 PolarHBondContact O-N 3.33Å; L12-L14 HydrophobicContact CB-CD1 4.24Å; L12-L14 HydrophobicContact CB-CG 4.27Å; L12-L14 HydrophobicContact CD1-CD1 4.24Å; L12-V28 HydrophobicContact CD1-CG1 4.12Å; L12-F38 HydrophobicContact CD2-CB 3.8Å; L12-F38 HydrophobicContact CD2-CD1 3.77Å; L12-F38 HydrophobicContact CD2-CG 4.11Å; L12-V40 HydrophobicContact CB-CG2 4.38Å; L12-V40 HydrophobicContact CD1-CG2 4.25Å; L12-V40 HydrophobicContact CD2-CG2 4.07Å; L12-V40 HydrophobicContact CG-CG2 4.47Å
13	F	61	Low	68	Low	112 Å²	112	96.9 Å²	96.9	49%	0.491	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	106.2	164.9	-156.6	-101.2	0	0	0	108.4	L15 F38 V40	F13-L15 HydrophobicContact CD1-CD2 4.31Å; F13-L15 HydrophobicContact CD1-CG 3.96Å; F13-L15 HydrophobicContact CE1-CD1 4.34Å; F13-L15 HydrophobicContact CE1-CD2 3.56Å; F13-L15 HydrophobicContact CE1-CG 3.71Å; F13-L15 HydrophobicContact CZ-CD2 4.36Å; F13-F38 PolarHBondContact N-O 3.34Å; F13-V40 PolarHBondContact O-N 3.33Å
14	L	61.3	Low	68.5	Low	30 Å²	30	93.9 Å²	93.9	16%	0.157	47%	0.471	C	S	.	.			trans	-108.5	103.9	-178.4	-73.7	155.2	0	0	0	107.5	M1 L12 K16 F17 F20 V40	M1-L14 HydrophobicContact CB-CD1 3.64Å; M1-L14 HydrophobicContact CG-CD1 4.3Å; M1-L14 HydrophobicContact SD-CD1 3.65Å; L12-L14 HydrophobicContact CB-CD1 4.24Å; L12-L14 HydrophobicContact CB-CG 4.27Å; L12-L14 HydrophobicContact CD1-CD1 4.24Å; L14-K16 VanDerWaalsContact C-N 3.31Å; L14-F17 HydrophobicContact CB-CB 4.35Å; L14-F17 HydrophobicContact CB-CD2 4.49Å; L14-F17 HydrophobicContact CD2-CB 3.99Å; L14-F17 HydrophobicContact CD2-CD2 3.44Å; L14-F17 VanDerWaalsContact CD2-CD2 3.44Å; L14-F17 HydrophobicContact CD2-CE2 4.24Å; L14-F17 HydrophobicContact CD2-CG 4.03Å; L14-F20 HydrophobicContact CD1-CD2 3.87Å; L14-F20 HydrophobicContact CD1-CE2 4.18Å; L14-F20 HydrophobicContact CD2-CD2 4.46Å; L14-F20 HydrophobicContact CD2-CE2 3.95Å; L14-V40 HydrophobicContact CD2-CB 3.46Å; L14-V40 VanDerWaalsContact CD2-CB 3.46Å; L14-V40 HydrophobicContact CD2-CG1 3.62Å; L14-V40 HydrophobicContact CD2-CG2 3.56Å; L14-V40 HydrophobicContact CG-CB 4.33Å; L14-V40 HydrophobicContact CG-CG2 4.08Å
15	L	51.4	Low	68.9	Low	118 Å²	118	92.5 Å²	92.5	62%	0.618	47%	0.472	S	S	*	.	S	Bend	trans	-75.6	-19.4	178.6	-80.7	167	0	0	0	113.1	F13	F13-L15 HydrophobicContact CD1-CD2 4.31Å; F13-L15 HydrophobicContact CD1-CG 3.96Å; F13-L15 HydrophobicContact CE1-CD1 4.34Å; F13-L15 HydrophobicContact CE1-CD2 3.56Å; F13-L15 HydrophobicContact CE1-CG 3.71Å; F13-L15 HydrophobicContact CZ-CD2 4.36Å
16	K	56.8	Low	69.4	Low	187 Å²	187	90.6 Å²	90.6	81%	0.813	46%	0.457	S	S	*	.	S	Bend	trans	-125.7	-2.4	-169.4	-71.7	-174.9	177.9	177	0	116.1	L14	L14-K16 VanDerWaalsContact C-N 3.31Å
17	F	59.2	Low	70.1	Confident	62 Å²	62	80.8 Å²	80.8	27%	0.272	43%	0.432	S	S	.	.			trans	-122.5	82	-168.4	-56.7	-88	0	0	0	112.5	L14 S19 F20 V40 V43	L14-F17 HydrophobicContact CB-CB 4.35Å; L14-F17 HydrophobicContact CB-CD2 4.49Å; L14-F17 HydrophobicContact CD2-CB 3.99Å; L14-F17 HydrophobicContact CD2-CD2 3.44Å; L14-F17 VanDerWaalsContact CD2-CD2 3.44Å; L14-F17 HydrophobicContact CD2-CE2 4.24Å; L14-F17 HydrophobicContact CD2-CG 4.03Å; F17-S19 PolarHBondContact O-N 3.04Å; F17-F20 HydrophobicContact CB-CD2 3.5Å; F17-F20 VanDerWaalsContact CB-CD2 3.5Å; F17-F20 HydrophobicContact CB-CE2 3.12Å; F17-F20 HydrophobicContact CB-CZ 4.07Å; F17-F20 AromaticContact CD1-CE2 3.8Å; F17-F20 HydrophobicContact CD1-CE2 3.8Å; F17-F20 AromaticContact CD1-CZ 3.93Å; F17-F20 HydrophobicContact CD1-CZ 3.93Å; F17-F20 HydrophobicContact CD2-CE2 4.25Å; F17-F20 HydrophobicContact CG-CD2 4.36Å; F17-F20 AromaticContact CG-CE2 3.49Å; F17-F20 HydrophobicContact CG-CE2 3.49Å; F17-F20 VanDerWaalsContact CG-CE2 3.49Å; F17-F20 HydrophobicContact CG-CZ 4.09Å; F17-V40 HydrophobicContact CE2-CG1 4.2Å; F17-V43 HydrophobicContact CD1-CG2 4.01Å; F17-V43 HydrophobicContact CE1-CB 4.43Å; F17-V43 HydrophobicContact CE1-CG1 4.23Å; F17-V43 HydrophobicContact CE1-CG2 3.35Å; F17-V43 HydrophobicContact CE2-CG1 4.14Å; F17-V43 HydrophobicContact CZ-CB 4.45Å; F17-V43 HydrophobicContact CZ-CG1 3.97Å; F17-V43 HydrophobicContact CZ-CG2 3.71Å
18	N	56.7	Low	70.9	Confident	140 Å²	140	74.1 Å²	74.1	75%	0.749	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	0.1	177	-71.9	-17.8	0	0	0	113.9
19	S	61.7	Low	71.7	Confident	85 Å²	85	80.1 Å²	80.1	59%	0.594	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-3.3	-168.3	-58.2	0	0	0	0	114.8	F17	F17-S19 PolarHBondContact O-N 3.04Å
20	F	64.4	Low	72.4	Confident	28 Å²	28	75.1 Å²	75.1	12%	0.123	39%	0.394	C	S	.	.			trans	-75.9	143.6	-177.6	-66.2	-62.1	0	0	0	112.9	M1 L14 F17 L26 V43 F45	M1-F20 HydrophobicContact CE-CB 3.4Å; M1-F20 HydrophobicContact CE-CG 4.08Å; M1-F20 HydrophobicContact SD-CB 3.45Å; M1-F20 WeakPolarHBondContact SD-CB 3.47Å; M1-F20 HydrophobicContact SD-CD2 3.89Å; M1-F20 HydrophobicContact SD-CG 3.87Å; L14-F20 HydrophobicContact CD1-CD2 3.87Å; L14-F20 HydrophobicContact CD1-CE2 4.18Å; L14-F20 HydrophobicContact CD2-CD2 4.46Å; L14-F20 HydrophobicContact CD2-CE2 3.95Å; F17-F20 HydrophobicContact CB-CD2 3.5Å; F17-F20 VanDerWaalsContact CB-CD2 3.5Å; F17-F20 HydrophobicContact CB-CE2 3.12Å; F17-F20 HydrophobicContact CB-CZ 4.07Å; F17-F20 AromaticContact CD1-CE2 3.8Å; F17-F20 HydrophobicContact CD1-CE2 3.8Å; F17-F20 AromaticContact CD1-CZ 3.93Å; F17-F20 HydrophobicContact CD1-CZ 3.93Å; F17-F20 HydrophobicContact CD2-CE2 4.25Å; F17-F20 HydrophobicContact CG-CD2 4.36Å; F17-F20 AromaticContact CG-CE2 3.49Å; F17-F20 HydrophobicContact CG-CE2 3.49Å; F17-F20 VanDerWaalsContact CG-CE2 3.49Å; F17-F20 HydrophobicContact CG-CZ 4.09Å; F20-L26 HydrophobicContact CD1-CD2 3.61Å; F20-L26 HydrophobicContact CE1-CD2 3.55Å; F20-L26 HydrophobicContact CG-CD2 4.38Å; F20-L26 HydrophobicContact CZ-CD2 4.26Å; F20-V43 HydrophobicContact CE2-CG1 4.22Å; F20-V43 HydrophobicContact CZ-CB 4Å; F20-V43 HydrophobicContact CZ-CG1 3.78Å; F20-V43 HydrophobicContact CZ-CG2 3.9Å; F20-F45 HydrophobicContact CD1-CE1 4.21Å; F20-F45 HydrophobicContact CD1-CZ 4.24Å; F20-F45 AromaticContact CE1-CE1 3.63Å; F20-F45 HydrophobicContact CE1-CE1 3.63Å; F20-F45 AromaticContact CE1-CZ 3.44Å; F20-F45 HydrophobicContact CE1-CZ 3.44Å; F20-F45 VanDerWaalsContact CE1-CZ 3.44Å; F20-F45 HydrophobicContact CZ-CZ 4.3Å
21	R	68.9	Low	73.5	Confident	51 Å²	51	75.9 Å²	75.9	19%	0.192	40%	0.403	C	S	.	.			trans	-121.7	163.7	-177	-55.3	-61.9	166.6	-157.1	-15.3	110.5	V24 N230 W246	R21-V24 HydrophobicContact CB-CG2 4.17Å; R21-N230 WeakPolarHBondContact CD-O 2.99Å; R21-N230 PolarHBondContact NE-O 3.25Å; R21-N230 VanDerWaalsContact NE-O 3.13Å; R21-N230 PolarHBondContact NH1-O 2.86Å; R21-W246 HydrophobicContact CG-CH2 4.03Å; R21-W246 HydrophobicContact CG-CZ2 4.42Å
22	L	75.3	Confident	74.4	Confident	103 Å²	103	74.6 Å²	74.6	54%	0.539	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	140.8	175.1	-168.8	62.9	0	0	0	110.2	V24 D255	L22-V24 PolarHBondContact O-N 3.37Å; L22-D255 HydrophobicContact CD2-CB 3.62Å; L22-D255 WeakPolarHBondContact CD2-OD2 3.47Å; L22-D255 VanDerWaalsContact CG-OD2 3.32Å; L22-D255 WeakPolarHBondContact CG-OD2 3.41Å
23	G	81.8	Confident	75.5	Confident	47 Å²	47	76.2 Å²	76.2	49%	0.485	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	2	177.3	0	0	0	0	0	117.1	V25 P251	G23-V25 PolarHBondContact O-N 2.92Å; G23-P251 CarbonylContact C-O 3.5Å; G23-P251 VanDerWaalsContact CA-O 3.24Å; G23-P251 WeakPolarHBondContact CA-O 3.5Å
24	V	86.8	Confident	76.7	Confident	17 Å²	17	77.5 Å²	77.5	10%	0.103	44%	0.435	C	S	.	.			trans	-70.3	120.4	172.7	-179.8	0	0	0	0	109.9	R21 L22 L26 F45 W246 P251	R21-V24 HydrophobicContact CB-CG2 4.17Å; L22-V24 PolarHBondContact O-N 3.37Å; V24-L26 HydrophobicContact CG1-CD2 4.12Å; V24-F45 HydrophobicContact CG1-CD1 4.15Å; V24-F45 HydrophobicContact CG1-CE1 3.94Å; V24-W246 HydrophobicContact CG1-CB 4.26Å; V24-W246 HydrophobicContact CG1-CD2 4.34Å; V24-W246 HydrophobicContact CG1-CG 3.87Å; V24-W246 HydrophobicContact CG2-CD2 3.94Å; V24-W246 HydrophobicContact CG2-CE3 4.19Å; V24-W246 HydrophobicContact CG2-CG 4.31Å; V24-W246 HydrophobicContact CG2-CZ2 4.39Å; V24-P251 HydrophobicContact CG2-CB 3.83Å; V24-P251 HydrophobicContact CG2-CG 3.73Å
25	V	86.2	Confident	77.8	Confident	110 Å²	110	80.1 Å²	80.1	67%	0.667	46%	0.461	S	S	*	.			trans	-81.2	127.7	171.6	-177.7	0	0	0	0	109.2	G23 P46	G23-V25 PolarHBondContact O-N 2.92Å; V25-P46 VanDerWaalsContact O-CD 3.25Å; V25-P46 WeakPolarHBondContact O-CD 3.28Å
26	L	89	Confident	79.3	Confident	11 Å²	11	76.4 Å²	76.4	6%	0.058	45%	0.451	C	S	.	.			trans	-153.5	154.5	179.6	64.2	103.3	0	0	0	110.5	Y3 F20 V24 V28 V43 M44 F45	Y3-L26 WeakPolarHBondContact CE2-O 3.42Å; Y3-L26 PolarHBondContact OH-O 3.38Å; F20-L26 HydrophobicContact CD1-CD2 3.61Å; F20-L26 HydrophobicContact CE1-CD2 3.55Å; F20-L26 HydrophobicContact CG-CD2 4.38Å; F20-L26 HydrophobicContact CZ-CD2 4.26Å; V24-L26 HydrophobicContact CG1-CD2 4.12Å; L26-V28 HydrophobicContact CD1-CB 4.47Å; L26-V28 HydrophobicContact CD1-CG1 3.22Å; L26-V43 HydrophobicContact CD1-CG1 4.4Å; L26-M44 CarbonylContact C-O 3.57Å; L26-M44 WeakPolarHBondContact CA-O 3.45Å; L26-F45 HydrophobicContact CB-CD1 3.99Å; L26-F45 HydrophobicContact CB-CE1 4.19Å; L26-F45 HydrophobicContact CD2-CE1 4.39Å
27	A	88.7	Confident	80.6	Confident	55 Å²	55	69 Å²	69	46%	0.455	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.5	168.4	0	0	0	0	0	109.2	V43 M44	A27-V43 CarbonylContact O-C 3.46Å; A27-V43 WeakPolarHBondContact O-CA 3.27Å; A27-M44 HydrophobicContact CB-CB 4.33Å; A27-M44 PolarHBondContact N-O 2.73Å; A27-M44 PolarHBondContact O-N 2.99Å
28	V	89	Confident	81.8	Confident	36 Å²	36	68 Å²	68	22%	0.218	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.2	173.8	-65.5	0	0	0	0	110.2	Y3 L12 L26 F38 V40 V43	Y3-V28 HydrophobicContact CD2-CG1 4.48Å; Y3-V28 HydrophobicContact CD2-CG2 4.47Å; Y3-V28 HydrophobicContact CE2-CG1 4.5Å; Y3-V28 HydrophobicContact CE2-CG2 4.31Å; L12-V28 HydrophobicContact CD1-CG1 4.12Å; L26-V28 HydrophobicContact CD1-CB 4.47Å; L26-V28 HydrophobicContact CD1-CG1 3.22Å; V28-F38 HydrophobicContact CB-CE1 4.28Å; V28-F38 HydrophobicContact CG2-CD1 4.47Å; V28-F38 HydrophobicContact CG2-CE1 3.94Å; V28-V40 HydrophobicContact CB-CG1 4.29Å; V28-V40 HydrophobicContact CB-CG2 4.3Å; V28-V40 HydrophobicContact CG1-CG1 4.27Å; V28-V40 HydrophobicContact CG1-CG2 4.25Å; V28-V43 HydrophobicContact CG1-CG1 4.32Å
29	Y	90.3	Very high	83.3	Confident	158 Å²	158	65 Å²	65	62%	0.62	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.2	168	176.4	-107.5	0	0	0	109	L41 D42	Y29-L41 HydrophobicContact CD1-CB 4.01Å; Y29-L41 HydrophobicContact CD1-CD1 4.34Å; Y29-L41 HydrophobicContact CE1-CB 4.37Å; Y29-L41 HydrophobicContact CE1-CD1 3.93Å; Y29-L41 PolarHBondContact O-N 3.08Å; Y29-D42 HydrophobicContact CD1-CB 4.36Å; Y29-D42 PolarHBondContact N-O 3.15Å; Y29-D42 PolarHBondContact O-N 3.1Å
30	G	89.5	Confident	84.4	Confident	18 Å²	18	61.6 Å²	61.6	19%	0.186	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-169.6	-171.6	0	0	0	0	0	114.6	F38 E39	G30-F38 VanDerWaalsContact CA-CZ 3.46Å; G30-E39 CarbonylContact C-O 3.6Å; G30-E39 WeakPolarHBondContact CA-O 3.46Å
31	V	90.2	Very high	85.5	Confident	83 Å²	83	64.8 Å²	64.8	50%	0.503	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.7	-174.7	-175.6	0	0	0	0	110.2	E39 L41	V31-E39 PolarHBondContact N-O 3.22Å; V31-E39 PolarHBondContact O-N 3.23Å; V31-L41 HydrophobicContact CG2-CD1 4.08Å
32	L	89.7	Confident	86.4	Confident	108 Å²	108	67 Å²	67	57%	0.565	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	123.5	171.7	-173.1	70.4	0	0	0	109.6	Q10 F38	Q10-L32 VanDerWaalsContact NE2-CD1 3.29Å; L32-F38 HydrophobicContact CB-CD2 4.48Å
33	T	86.8	Confident	87	Confident	42 Å²	42	63.3 Å²	63.3	26%	0.258	39%	0.39	S	S	.	.			trans	-82.9	159.1	176.8	75.2	0	0	0	0	111.1	A35 G36 T37 E39	T33-A35 PolarHBondContact O-N 3.06Å; T33-A35 VanDerWaalsContact O-N 3.12Å; T33-A35 PolarHBondContact OG1-N 2.96Å; T33-G36 PolarHBondContact O-N 3.45Å; T33-T37 PolarHBondContact N-O 3.19Å; T33-T37 PolarHBondContact OG1-N 3.47Å; T33-T37 PolarHBondContact OG1-O 3.08Å; T33-T37 VanDerWaalsContact OG1-O 3.07Å; T33-T37 PolarHBondContact OG1-OG1 3.45Å; T33-E39 HydrophobicContact CG2-CB 4.17Å
34	S	86.2	Confident	87.3	Confident	139 Å²	139	67 Å²	67	97%	0.972	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.6	175.2	53.2	0	0	0	0	113.9	G36	S34-G36 VanDerWaalsContact C-N 3.25Å; S34-G36 PolarHBondContact O-N 2.87Å
35	A	85.2	Confident	87.3	Confident	84 Å²	84	69 Å²	69	69%	0.694	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	1.8	175.6	0	0	0	0	0	113.5	T33 T37	T33-A35 PolarHBondContact O-N 3.06Å; T33-A35 VanDerWaalsContact O-N 3.12Å; T33-A35 PolarHBondContact OG1-N 2.96Å; A35-T37 VanDerWaalsContact C-N 3.3Å; A35-T37 PolarHBondContact O-N 3.2Å
36	G	82.7	Confident	87.2	Confident	40 Å²	40	66.5 Å²	66.5	41%	0.412	39%	0.389	S	S	.	.	S	Bend	trans	74.6	19	-177	0	0	0	0	0	113.6	Q10 T33 S34	Q10-G36 PolarHBondContact NE2-O 2.85Å; T33-G36 PolarHBondContact O-N 3.45Å; S34-G36 VanDerWaalsContact C-N 3.25Å; S34-G36 PolarHBondContact O-N 2.87Å
37	T	84.9	Confident	86.6	Confident	33 Å²	33	71.1 Å²	71.1	20%	0.202	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	152.1	169.9	62.8	0	0	0	0	110	K11 T33 A35	K11-T37 WeakPolarHBondContact O-CA 3.48Å; T33-T37 PolarHBondContact N-O 3.19Å; T33-T37 PolarHBondContact OG1-N 3.47Å; T33-T37 PolarHBondContact OG1-O 3.08Å; T33-T37 VanDerWaalsContact OG1-O 3.07Å; T33-T37 PolarHBondContact OG1-OG1 3.45Å; A35-T37 VanDerWaalsContact C-N 3.3Å; A35-T37 PolarHBondContact O-N 3.2Å
38	F	84.9	Confident	86.3	Confident	41 Å²	41	69.4 Å²	69.4	18%	0.18	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.8	176.2	-170.4	-88.2	0	0	0	109.9	Q10 K11 L12 F13 V28 G30 L32 V40	Q10-F38 HydrophobicContact CG-CB 3.94Å; K11-F38 PolarHBondContact O-N 2.94Å; L12-F38 HydrophobicContact CD2-CB 3.8Å; L12-F38 HydrophobicContact CD2-CD1 3.77Å; L12-F38 HydrophobicContact CD2-CG 4.11Å; F13-F38 PolarHBondContact N-O 3.34Å; V28-F38 HydrophobicContact CB-CE1 4.28Å; V28-F38 HydrophobicContact CG2-CD1 4.47Å; V28-F38 HydrophobicContact CG2-CE1 3.94Å; G30-F38 VanDerWaalsContact CA-CZ 3.46Å; L32-F38 HydrophobicContact CB-CD2 4.48Å; F38-V40 HydrophobicContact CD1-CG2 3.8Å; F38-V40 HydrophobicContact CE1-CG2 4.12Å
39	E	87	Confident	86.1	Confident	76 Å²	76	71.1 Å²	71.1	36%	0.355	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.9	175.7	-176.1	177.8	-174.2	0	0	109.5	G30 V31 T33	G30-E39 CarbonylContact C-O 3.6Å; G30-E39 WeakPolarHBondContact CA-O 3.46Å; V31-E39 PolarHBondContact N-O 3.22Å; V31-E39 PolarHBondContact O-N 3.23Å; T33-E39 HydrophobicContact CG2-CB 4.17Å
40	V	85.8	Confident	85.8	Confident	13 Å²	13	66.3 Å²	66.3	8%	0.079	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.7	-175.3	177.7	0	0	0	0	110.1	L12 F13 L14 F17 V28 F38 D42 V43	L12-V40 HydrophobicContact CB-CG2 4.38Å; L12-V40 HydrophobicContact CD1-CG2 4.25Å; L12-V40 HydrophobicContact CD2-CG2 4.07Å; L12-V40 HydrophobicContact CG-CG2 4.47Å; F13-V40 PolarHBondContact O-N 3.33Å; L14-V40 HydrophobicContact CD2-CB 3.46Å; L14-V40 VanDerWaalsContact CD2-CB 3.46Å; L14-V40 HydrophobicContact CD2-CG1 3.62Å; L14-V40 HydrophobicContact CD2-CG2 3.56Å; L14-V40 HydrophobicContact CG-CB 4.33Å; L14-V40 HydrophobicContact CG-CG2 4.08Å; F17-V40 HydrophobicContact CE2-CG1 4.2Å; V28-V40 HydrophobicContact CB-CG1 4.29Å; V28-V40 HydrophobicContact CB-CG2 4.3Å; V28-V40 HydrophobicContact CG1-CG1 4.27Å; V28-V40 HydrophobicContact CG1-CG2 4.25Å; F38-V40 HydrophobicContact CD1-CG2 3.8Å; F38-V40 HydrophobicContact CE1-CG2 4.12Å; V40-D42 WeakPolarHBondContact CG1-O 3.36Å; V40-V43 HydrophobicContact CG1-CG1 3.49Å; V40-V43 VanDerWaalsContact CG1-CG1 3.49Å
41	L	87.3	Confident	85.6	Confident	96 Å²	96	66 Å²	66	50%	0.503	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-39.8	176.4	-64	176.5	0	0	0	112.2	Y29 V31	Y29-L41 HydrophobicContact CD1-CB 4.01Å; Y29-L41 HydrophobicContact CD1-CD1 4.34Å; Y29-L41 HydrophobicContact CE1-CB 4.37Å; Y29-L41 HydrophobicContact CE1-CD1 3.93Å; Y29-L41 PolarHBondContact O-N 3.08Å; V31-L41 HydrophobicContact CG2-CD1 4.08Å
42	D	88	Confident	85.3	Confident	98 Å²	98	64 Å²	64	52%	0.524	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.4	-179.2	-161.6	14.3	0	0	0	112	Y29 V40	Y29-D42 HydrophobicContact CD1-CB 4.36Å; Y29-D42 PolarHBondContact N-O 3.15Å; Y29-D42 PolarHBondContact O-N 3.1Å; V40-D42 WeakPolarHBondContact CG1-O 3.36Å
43	V	87	Confident	85.1	Confident	25 Å²	25	63.1 Å²	63.1	15%	0.152	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138.8	-176.1	-60.9	0	0	0	0	110.8	F17 F20 L26 A27 V28 V40	F17-V43 HydrophobicContact CD1-CG2 4.01Å; F17-V43 HydrophobicContact CE1-CB 4.43Å; F17-V43 HydrophobicContact CE1-CG1 4.23Å; F17-V43 HydrophobicContact CE1-CG2 3.35Å; F17-V43 HydrophobicContact CE2-CG1 4.14Å; F17-V43 HydrophobicContact CZ-CB 4.45Å; F17-V43 HydrophobicContact CZ-CG1 3.97Å; F17-V43 HydrophobicContact CZ-CG2 3.71Å; F20-V43 HydrophobicContact CE2-CG1 4.22Å; F20-V43 HydrophobicContact CZ-CB 4Å; F20-V43 HydrophobicContact CZ-CG1 3.78Å; F20-V43 HydrophobicContact CZ-CG2 3.9Å; L26-V43 HydrophobicContact CD1-CG1 4.4Å; A27-V43 CarbonylContact O-C 3.46Å; A27-V43 WeakPolarHBondContact O-CA 3.27Å; V28-V43 HydrophobicContact CG1-CG1 4.32Å; V40-V43 HydrophobicContact CG1-CG1 3.49Å; V40-V43 VanDerWaalsContact CG1-CG1 3.49Å
44	M	87.5	Confident	84.9	Confident	124 Å²	124	64.5 Å²	64.5	61%	0.611	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	137	177.3	177.2	-179.6	158.6	0	0	109.9	L26 A27	L26-M44 CarbonylContact C-O 3.57Å; L26-M44 WeakPolarHBondContact CA-O 3.45Å; A27-M44 HydrophobicContact CB-CB 4.33Å; A27-M44 PolarHBondContact N-O 2.73Å; A27-M44 PolarHBondContact O-N 2.99Å
45	F	87.1	Confident	84.5	Confident	60 Å²	60	61 Å²	61	26%	0.263	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-100	158.3	175.5	-60.6	-76.3	0	0	0	111	F20 V24 L26 S47 K245 W246	F20-F45 HydrophobicContact CD1-CE1 4.21Å; F20-F45 HydrophobicContact CD1-CZ 4.24Å; F20-F45 AromaticContact CE1-CE1 3.63Å; F20-F45 HydrophobicContact CE1-CE1 3.63Å; F20-F45 AromaticContact CE1-CZ 3.44Å; F20-F45 HydrophobicContact CE1-CZ 3.44Å; F20-F45 VanDerWaalsContact CE1-CZ 3.44Å; F20-F45 HydrophobicContact CZ-CZ 4.3Å; V24-F45 HydrophobicContact CG1-CD1 4.15Å; V24-F45 HydrophobicContact CG1-CE1 3.94Å; L26-F45 HydrophobicContact CB-CD1 3.99Å; L26-F45 HydrophobicContact CB-CE1 4.19Å; L26-F45 HydrophobicContact CD2-CE1 4.39Å; F45-S47 PolarHBondContact O-N 3.2Å; F45-K245 WeakPolarHBondContact CB-O 3.25Å; F45-W246 AromaticContact CD1-CD1 3.56Å; F45-W246 AromaticContact CE1-CD1 3.41Å; F45-W246 VanDerWaalsContact CE1-CD1 3.41Å; F45-W246 AromaticContact CE1-NE1 3.68Å; F45-W246 AromaticContact CZ-CD1 3.99Å; F45-W246 AromaticContact CZ-NE1 3.95Å
46	P	84.5	Confident	83.7	Confident	57 Å²	57	63.5 Å²	63.5	37%	0.37	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-54.9	129.4	169.8	-23.3	33.5	0	0	0	111	V25	V25-P46 VanDerWaalsContact O-CD 3.25Å; V25-P46 WeakPolarHBondContact O-CD 3.28Å
47	S	75.7	Confident	82.9	Confident	107 Å²	107	64 Å²	64	75%	0.748	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-86.4	119.3	173.8	56.9	0	0	0	0	110	F45	F45-S47 PolarHBondContact O-N 3.2Å
48	A	82.6	Confident	81.8	Confident	19 Å²	19	68.6 Å²	68.6	16%	0.157	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70.2	146.7	165.3	0	0	0	0	0	110.1	I270 L273	A48-I270 HydrophobicContact CB-CG2 4.44Å; A48-I270 WeakPolarHBondContact CB-O 3.42Å; A48-L273 HydrophobicContact CB-CD2 3.64Å; A48-L273 HydrophobicContact CB-CG 3.9Å
49	S	85	Confident	80.5	Confident	72 Å²	72	76.8 Å²	76.8	50%	0.503	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-64	143.9	173	-59.9	0	0	0	0	110.7	R271 Q272 L273	S49-R271 WeakPolarHBondContact CB-O 3.32Å; S49-R271 PolarHBondContact N-O 3.14Å; S49-Q272 WeakPolarHBondContact O-CA 3.24Å; S49-L273 WeakPolarHBondContact O-CG 3.26Å; S49-L273 PolarHBondContact O-N 3.42Å
50	P	85	Confident	79.1	Confident	58 Å²	58	77.5 Å²	77.5	38%	0.377	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-52.6	154.6	176.2	-26.2	34.4	0	0	0	112.9	Q272 N299 T300	P50-Q272 WeakPolarHBondContact O-CG 3.35Å; P50-Q272 PolarHBondContact O-NE2 3.29Å; P50-N299 HydrophobicContact CB-CB 4.23Å; P50-T300 HydrophobicContact CB-CG2 4.42Å
51	S	84.7	Confident	78.5	Confident	11 Å²	11	80.5 Å²	80.5	8%	0.077	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-63.9	160.1	173	72.9	0	0	0	0	109.7	L273 N299	S51-L273 WeakPolarHBondContact CA-O 3.44Å; S51-L273 VanDerWaalsContact CB-O 3.27Å; S51-L273 WeakPolarHBondContact CB-O 3.5Å; S51-N299 PolarHBondContact N-O 3.19Å; S51-N299 PolarHBondContact OG-O 3.44Å
52	S	84.9	Confident	78.3	Confident	40 Å²	40	81.8 Å²	81.8	28%	0.28	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-58.2	155.2	163.3	49.9	0	0	0	0	109.9	H275	S52-H275 PolarHBondContact O-NE2 3.42Å; S52-H275 PolarHBondContact OG-CE1 3.29Å; S52-H275 PolarHBondContact OG-NE2 2.87Å
53	P	83.8	Confident	78.3	Confident	90 Å²	90	78.4 Å²	78.4	58%	0.584	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-58	145.5	170.4	-21.6	32.7	0	0	0	110.7
54	L	83.4	Confident	78.6	Confident	72 Å²	72	79.4 Å²	79.4	38%	0.377	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-60.9	142.6	170.3	-67.8	174	0	0	0	109.7	V56 I214 L324	L54-V56 PolarHBondContact O-N 3.01Å; L54-I214 HydrophobicContact CD2-CD1 3.57Å; L54-L324 HydrophobicContact CD2-CD1 4.03Å; L54-L324 HydrophobicContact CD2-CG 4.4Å
55	P	77.1	Confident	79	Confident	66 Å²	66	74.8 Å²	74.8	43%	0.429	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-53.8	132.6	169.9	-22.1	32.2	0	0	0	110.1	A57 C212 I214	P55-A57 PolarHBondContact O-N 3.29Å; P55-C212 WeakPolarHBondContact CG-O 3.35Å; P55-I214 VanDerWaalsContact CD-CD1 3.48Å; P55-I214 HydrophobicContact CG-CD1 4.09Å
56	V	68.2	Low	79.5	Confident	135 Å²	135	72 Å²	72	82%	0.818	43%	0.426	S	S	*	.			trans	-70.4	103.7	174.4	-178.2	0	0	0	0	107.3	L54 Q58	L54-V56 PolarHBondContact O-N 3.01Å; V56-Q58 PolarHBondContact O-N 3.41Å
57	A	66.9	Low	80.2	Confident	50 Å²	50	69.2 Å²	69.2	41%	0.413	41%	0.409	S	S	.	.			trans	-63.8	126.3	171.8	0	0	0	0	0	108.7	P55 Q322	P55-A57 PolarHBondContact O-N 3.29Å; A57-Q322 HydrophobicContact CB-CG 4.24Å
58	Q	60.7	Low	81.2	Confident	131 Å²	131	64.1 Å²	64.1	61%	0.612	37%	0.373	S	S	*	.			trans	-75.8	145.4	166.3	-59.7	-166.5	-17	0	0	108	V56 S60 D61	V56-Q58 PolarHBondContact O-N 3.41Å; Q58-S60 PolarHBondContact O-N 3.41Å; Q58-D61 PolarHBondContact N-OD2 3.39Å; Q58-D61 WeakPolarHBondContact O-CB 3.36Å; Q58-D61 PolarHBondContact O-N 2.91Å
59	E	58	Low	82	Confident	212 Å²	212	63.3 Å²	63.3	99%	0.991	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.4	179.6	-68.8	-175.8	165.3	0	0	113.1
60	S	58.3	Low	82.5	Confident	91 Å²	91	59.9 Å²	59.9	64%	0.636	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-10.7	174.9	54.8	0	0	0	0	114.6	Q58 E62	Q58-S60 PolarHBondContact O-N 3.41Å; S60-E62 PolarHBondContact O-N 2.75Å
61	D	73.6	Confident	83	Confident	76 Å²	76	57.1 Å²	57.1	41%	0.406	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-79.6	122.3	-173.5	-67.9	-22.7	0	0	0	110.5	Q58 Q322	Q58-D61 PolarHBondContact N-OD2 3.39Å; Q58-D61 WeakPolarHBondContact O-CB 3.36Å; Q58-D61 PolarHBondContact O-N 2.91Å; D61-Q322 PolarHBondContact O-NE2 3.35Å
62	E	81.7	Confident	83.5	Confident	124 Å²	124	56.6 Å²	56.6	58%	0.579	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-65	143.9	172.3	-61.7	-164.5	174.1	0	0	111	S60 C64 R110 Q322	S60-E62 PolarHBondContact O-N 2.75Å; E62-C64 PolarHBondContact O-N 3.1Å; E62-R110 IonicContact OE1-NH2 3.55Å; E62-R110 IonicContact OE2-CZ 2.81Å; E62-R110 VanDerWaalsContact OE2-CZ 3.26Å; E62-R110 IonicContact OE2-NE 3.66Å; E62-R110 PolarHBondContact OE2-NE 3.38Å; E62-R110 IonicContact OE2-NH2 3.8Å; E62-R110 PolarHBondContact OE2-NH2 2.88Å; E62-Q322 PolarHBondContact O-NE2 3.25Å
63	P	88.2	Confident	83.8	Confident	27 Å²	27	57.2 Å²	57.2	18%	0.175	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-69.8	123.8	-176.7	27.6	-34.3	0	0	0	111.3	Y65 R110	P63-Y65 HydrophobicContact CB-CE2 4.12Å; P63-Y65 HydrophobicContact CG-CE2 4.17Å; P63-Y65 WeakPolarHBondContact O-CE2 3.45Å; P63-R110 WeakPolarHBondContact O-CB 3.44Å; P63-R110 VanDerWaalsContact O-CD 3.31Å; P63-R110 WeakPolarHBondContact O-CD 3.07Å
64	C	93.4	Very high	84.1	Confident	46 Å²	46	53.3 Å²	53.3	31%	0.311	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-93.3	146.9	172.1	-67.7	0	0	0	0	111.2	E62 V112 L321	E62-C64 PolarHBondContact O-N 3.1Å; C64-V112 HydrophobicContact CB-CG1 3.82Å; C64-L321 HydrophobicContact CB-CB 4.5Å; C64-L321 HydrophobicContact CB-CD1 3.97Å; C64-L321 WeakPolarHBondContact O-CB 3.4Å; C64-L321 WeakPolarHBondContact O-CG 3.08Å; C64-L321 PolarHBondContact O-N 3.49Å
65	Y	96.8	Very high	84.2	Confident	27 Å²	27	51.4 Å²	51.4	11%	0.106	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.3	-177.4	-57.8	-86.5	0	0	0	113.5	P63 K107 R110 I111 V112 L318 V319 N320	P63-Y65 HydrophobicContact CB-CE2 4.12Å; P63-Y65 HydrophobicContact CG-CE2 4.17Å; P63-Y65 WeakPolarHBondContact O-CE2 3.45Å; Y65-K107 HydrophobicContact CE2-CG 3.99Å; Y65-R110 HydrophobicContact CD2-CB 3.83Å; Y65-R110 HydrophobicContact CE2-CB 4.11Å; Y65-R110 PolarHBondContact N-O 2.77Å; Y65-I111 CarbonylContact O-C 3.56Å; Y65-I111 WeakPolarHBondContact O-CA 3.44Å; Y65-V112 WeakPolarHBondContact O-CG2 3.44Å; Y65-V112 PolarHBondContact O-N 3.06Å; Y65-L318 HydrophobicContact CD1-CD1 4.32Å; Y65-L318 HydrophobicContact CD1-CD2 3.8Å; Y65-L318 HydrophobicContact CD1-CG 3.72Å; Y65-L318 HydrophobicContact CE1-CD2 4.16Å; Y65-L318 HydrophobicContact CE1-CG 4.5Å; Y65-L318 HydrophobicContact CG-CD1 4.1Å; Y65-L318 HydrophobicContact CG-CD2 4.09Å; Y65-L318 HydrophobicContact CG-CG 4Å; Y65-V319 CarbonylContact C-O 3.46Å; Y65-V319 VanDerWaalsContact CA-O 3.26Å; Y65-V319 WeakPolarHBondContact CA-O 3.42Å; Y65-N320 HydrophobicContact CD1-CB 3.96Å; Y65-N320 HydrophobicContact CE1-CB 3.76Å
66	V	97.7	Very high	83.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.4	165.5	172.1	0	0	0	0	108.7	L68 V112 R113 I115 V211 F216 V319 L321	V66-L68 HydrophobicContact CG1-CD2 3.92Å; V66-L68 HydrophobicContact CG1-CG 4.48Å; V66-V112 HydrophobicContact CG2-CG2 4.04Å; V66-R113 WeakPolarHBondContact CA-O 3.3Å; V66-R113 HydrophobicContact CG2-CB 4.29Å; V66-I115 HydrophobicContact CG1-CD1 3.98Å; V66-I115 HydrophobicContact CG1-CG1 4.22Å; V66-V211 HydrophobicContact CG2-CB 4.4Å; V66-V211 HydrophobicContact CG2-CG1 3.85Å; V66-F216 HydrophobicContact CB-CE1 4.39Å; V66-F216 HydrophobicContact CB-CZ 3.98Å; V66-F216 HydrophobicContact CG1-CE1 4.21Å; V66-F216 HydrophobicContact CG1-CZ 4.2Å; V66-F216 HydrophobicContact CG2-CE2 4.26Å; V66-F216 HydrophobicContact CG2-CZ 4.01Å; V66-V319 PolarHBondContact N-O 2.7Å; V66-V319 PolarHBondContact O-N 2.85Å; V66-L321 HydrophobicContact CB-CD2 4.41Å; V66-L321 HydrophobicContact CG2-CD1 4.05Å; V66-L321 HydrophobicContact CG2-CD2 3.76Å; V66-L321 HydrophobicContact CG2-CG 4.21Å
67	L	98.1	Very high	83.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.2	174.8	-171	76.6	0	0	0	110	I69 L91 W94 L95 I111 R113 V114 I115 A316 A317 L318	L67-I69 HydrophobicContact CD2-CG2 4.17Å; L67-I69 HydrophobicContact CG-CG2 4.24Å; L67-L91 HydrophobicContact CD2-CD1 4.36Å; L67-W94 HydrophobicContact CD1-CH2 4.11Å; L67-W94 HydrophobicContact CD1-CZ3 3.96Å; L67-W94 HydrophobicContact CD2-CZ3 3.92Å; L67-L95 HydrophobicContact CD2-CD1 3.98Å; L67-L95 HydrophobicContact CD2-CD2 3.7Å; L67-L95 HydrophobicContact CD2-CG 4.2Å; L67-I111 HydrophobicContact CB-CG2 4.15Å; L67-R113 PolarHBondContact N-O 3.17Å; L67-V114 HydrophobicContact CB-CG2 4.21Å; L67-V114 HydrophobicContact CD2-CG1 4.32Å; L67-V114 HydrophobicContact CD2-CG2 4.39Å; L67-V114 CarbonylContact O-C 3.52Å; L67-V114 WeakPolarHBondContact O-CA 3.17Å; L67-I115 PolarHBondContact O-N 3.38Å; L67-A316 HydrophobicContact CD1-CB 3.92Å; L67-A316 HydrophobicContact CG-CB 4.45Å; L67-A317 CarbonylContact C-O 3.58Å; L67-A317 WeakPolarHBondContact CA-O 3.4Å; L67-L318 HydrophobicContact CB-CD1 4.41Å; L67-L318 HydrophobicContact CD1-CB 4.34Å; L67-L318 HydrophobicContact CD1-CD1 3.96Å
68	L	98.3	Very high	83.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.4	174	-53.6	175.2	0	0	0	109.6	V66 I115 F278 L305 L307 A317 V319	V66-L68 HydrophobicContact CG1-CD2 3.92Å; V66-L68 HydrophobicContact CG1-CG 4.48Å; L68-I115 HydrophobicContact CD2-CB 3.63Å; L68-I115 HydrophobicContact CD2-CD1 3.7Å; L68-I115 HydrophobicContact CD2-CG1 4.01Å; L68-I115 HydrophobicContact CD2-CG2 4.31Å; L68-F278 HydrophobicContact CD1-CB 4.28Å; L68-F278 HydrophobicContact CD1-CD1 4.21Å; L68-F278 HydrophobicContact CD1-CG 4.26Å; L68-F278 HydrophobicContact CD2-CE1 4.48Å; L68-L305 HydrophobicContact CD1-CD2 3.42Å; L68-L305 VanDerWaalsContact CD1-CD2 3.42Å; L68-L307 HydrophobicContact CB-CD1 3.6Å; L68-L307 HydrophobicContact CB-CD2 4.5Å; L68-L307 HydrophobicContact CD1-CD1 4.29Å; L68-A317 HydrophobicContact CB-CB 4.34Å; L68-A317 PolarHBondContact N-O 2.94Å; L68-A317 PolarHBondContact O-N 3.02Å; L68-V319 HydrophobicContact CD1-CG2 3.81Å; L68-V319 HydrophobicContact CG-CG2 4.25Å
69	I	97.6	Very high	83	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.3	176	55.1	177.7	0	0	0	109.9	L67 L72 L91 V114 I115 I116 A117 A316	L67-I69 HydrophobicContact CD2-CG2 4.17Å; L67-I69 HydrophobicContact CG-CG2 4.24Å; I69-L72 HydrophobicContact CD1-CD1 4.46Å; I69-L72 HydrophobicContact CD1-CD2 4.48Å; I69-L91 HydrophobicContact CD1-CD2 3.84Å; I69-L91 HydrophobicContact CG2-CD2 4.46Å; I69-V114 HydrophobicContact CD1-CG1 4.05Å; I69-V114 HydrophobicContact CG1-CG1 4.26Å; I69-I115 PolarHBondContact N-O 3.17Å; I69-I116 HydrophobicContact CD1-CD1 4.14Å; I69-I116 HydrophobicContact CD1-CG1 3.84Å; I69-I116 HydrophobicContact CG1-CB 4.31Å; I69-I116 HydrophobicContact CG1-CG1 3.83Å; I69-I116 HydrophobicContact CG1-CG2 4.41Å; I69-I116 CarbonylContact O-C 3.58Å; I69-I116 WeakPolarHBondContact O-CA 3.35Å; I69-A117 PolarHBondContact O-N 3.49Å; I69-A316 HydrophobicContact CG2-CB 3.39Å
70	C	97.1	Very high	83	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	25%	0.247	C	C	.	.			trans	-150.2	164.7	175.2	69.4	0	0	0	0	110.9	L72 A117 A280 N281 P308 F310	C70-L72 PolarHBondContact O-N 2.84Å; C70-A117 HydrophobicContact CB-CB 4.07Å; C70-A117 WeakPolarHBondContact CB-O 3.42Å; C70-A280 HydrophobicContact CB-CB 3.52Å; C70-N281 PolarHBondContact SG-N 3.46Å; C70-P308 PolarHBondContact SG-O 2.91Å; C70-F310 WeakPolarHBondContact O-CB 3.48Å; C70-F310 PolarHBondContact O-N 3.17Å
71	G	95.1	Very high	83.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.			trans	64.6	44.3	171.4	0	0	0	0	0	114	R73 G118 N119 N281 S309 C311	G71-R73 VanDerWaalsContact C-N 3.27Å; G71-G118 PolarHBondContact N-O 3.07Å; G71-N119 CarbonylContact C-O 3.29Å; G71-N119 WeakPolarHBondContact CA-O 3.41Å; G71-N281 WeakPolarHBondContact CA-OD1 3.25Å; G71-N281 PolarHBondContact N-OD1 3.03Å; G71-S309 WeakPolarHBondContact CA-OG 3.41Å; G71-S309 PolarHBondContact O-OG 3.17Å; G71-C311 WeakPolarHBondContact O-CB 3.48Å; G71-C311 PolarHBondContact O-N 3.3Å; G71-C311 PolarHBondContact O-SG 2.86Å; G71-C311 VanDerWaalsContact O-SG 3.41Å
72	L	94.5	Very high	83.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.234	C	C	.	.			trans	-67.1	-30.5	173.6	-67.3	176.8	0	0	0	112.2	I69 C70 F74 R88 L91 I116 N119 F157 F310	I69-L72 HydrophobicContact CD1-CD1 4.46Å; I69-L72 HydrophobicContact CD1-CD2 4.48Å; C70-L72 PolarHBondContact O-N 2.84Å; L72-F74 HydrophobicContact CB-CD2 4.11Å; L72-F74 HydrophobicContact CB-CE2 4.02Å; L72-F74 HydrophobicContact CD1-CE2 4.17Å; L72-F74 PolarHBondContact O-N 3.22Å; L72-R88 HydrophobicContact CD2-CG 4.44Å; L72-R88 PolarHBondContact O-NH1 2.84Å; L72-L91 HydrophobicContact CD2-CD2 4.01Å; L72-I116 HydrophobicContact CD1-CD1 4.16Å; L72-I116 HydrophobicContact CD1-CG2 3.95Å; L72-I116 HydrophobicContact CG-CG2 4.48Å; L72-N119 PolarHBondContact N-O 3.38Å; L72-F157 HydrophobicContact CD1-CD1 4.44Å; L72-F157 HydrophobicContact CD1-CE1 3.8Å; L72-F157 HydrophobicContact CD1-CZ 4.32Å; L72-F310 HydrophobicContact CD2-CB 4.32Å; L72-F310 HydrophobicContact CD2-CD1 3.83Å; L72-F310 HydrophobicContact CD2-CE1 4.48Å; L72-F310 HydrophobicContact CD2-CG 4.13Å
73	R	91.6	Very high	83.7	Confident	53 Å²	53	41.3 Å²	41.3	20%	0.2	23%	0.23	C	C	.	.			trans	44.2	57.7	172.9	-59.1	-176.4	-171.2	170.2	2.7	114.3	G71 D75 R88 N119 S120 M122 S309 C311 E312	G71-R73 VanDerWaalsContact C-N 3.27Å; R73-D75 PolarHBondContact O-N 3.12Å; R73-R88 PolarHBondContact O-NH1 3.46Å; R73-R88 VanDerWaalsContact O-NH1 3.14Å; R73-N119 WeakPolarHBondContact CG-O 3.23Å; R73-N119 PolarHBondContact N-O 2.92Å; R73-S120 CarbonylContact C-O 3.54Å; R73-S120 WeakPolarHBondContact CA-O 3.14Å; R73-S120 PolarHBondContact N-O 2.9Å; R73-M122 HydrophobicContact CB-CE 4.1Å; R73-M122 HydrophobicContact CG-CE 3.85Å; R73-S309 VanDerWaalsContact CZ-OG 3.3Å; R73-S309 PolarHBondContact NE-OG 2.84Å; R73-S309 PolarHBondContact NH2-OG 3.41Å; R73-C311 HydrophobicContact CB-CB 4.46Å; R73-C311 WeakPolarHBondContact CD-SG 3.44Å; R73-E312 IonicContact CZ-OE1 2.73Å; R73-E312 IonicContact NH1-OE1 3.77Å; R73-E312 PolarHBondContact NH1-OE1 3.45Å; R73-E312 IonicContact NH2-OE1 3.1Å; R73-E312 PolarHBondContact NH2-OE1 2.82Å; R73-E312 IonicContact NH2-OE2 3.66Å
74	F	91	Very high	83.7	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.031	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-57.7	134.3	167.4	-75.5	-94.2	0	0	0	110	L72 R88 S120 M122 A150 L154 F157	L72-F74 HydrophobicContact CB-CD2 4.11Å; L72-F74 HydrophobicContact CB-CE2 4.02Å; L72-F74 HydrophobicContact CD1-CE2 4.17Å; L72-F74 PolarHBondContact O-N 3.22Å; F74-R88 VanDerWaalsContact CZ-CD 3.49Å; F74-S120 WeakPolarHBondContact CD2-O 3.38Å; F74-S120 PolarHBondContact N-O 3.33Å; F74-M122 PolarHBondContact O-N 3.3Å; F74-A150 HydrophobicContact CB-CB 4.23Å; F74-A150 WeakPolarHBondContact O-CB 3.34Å; F74-L154 HydrophobicContact CB-CB 4.46Å; F74-L154 HydrophobicContact CD2-CB 3.88Å; F74-L154 HydrophobicContact CD2-CD1 3.7Å; F74-L154 HydrophobicContact CD2-CG 4.29Å; F74-L154 HydrophobicContact CE2-CB 4.2Å; F74-L154 HydrophobicContact CE2-CD1 3.5Å; F74-L154 VanDerWaalsContact CE2-CD1 3.5Å; F74-L154 HydrophobicContact CE2-CG 4.43Å; F74-L154 HydrophobicContact CG-CB 4.06Å; F74-L154 HydrophobicContact CZ-CD1 4.34Å; F74-F157 HydrophobicContact CE1-CB 4.34Å; F74-F157 HydrophobicContact CE2-CB 4.45Å; F74-F157 HydrophobicContact CE2-CD1 4.36Å; F74-F157 HydrophobicContact CE2-CG 4.31Å; F74-F157 HydrophobicContact CZ-CB 3.66Å; F74-F157 HydrophobicContact CZ-CD1 4.21Å; F74-F157 HydrophobicContact CZ-CD2 4.02Å; F74-F157 AromaticContact CZ-CG 3.72Å; F74-F157 HydrophobicContact CZ-CG 3.72Å
75	D	84.6	Confident	83.4	Confident	33 Å²	33	42 Å²	42	18%	0.176	23%	0.228	C	C	.	.			trans	-137.7	161	-179.5	72.2	-14.9	0	0	0	110.6	R73 K77 E78 M122	R73-D75 PolarHBondContact O-N 3.12Å; D75-K77 PolarHBondContact O-N 3.13Å; D75-E78 WeakPolarHBondContact O-CG 3.41Å; D75-E78 PolarHBondContact OD1-N 3.26Å; D75-M122 HydrophobicContact CB-CB 4.22Å
76	S	71.6	Confident	83.2	Confident	40 Å²	40	44.6 Å²	44.6	28%	0.28	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-14.6	177.3	76.8	0	0	0	0	113.1	E78 P146 E149	S76-E78 PolarHBondContact O-N 3.27Å; S76-P146 WeakPolarHBondContact CB-O 3.45Å; S76-P146 VanDerWaalsContact OG-CB 3.28Å; S76-P146 WeakPolarHBondContact OG-CB 3.17Å; S76-E149 WeakPolarHBondContact CB-OE2 3.43Å
77	K	65.9	Low	82.9	Confident	117 Å²	117	45.2 Å²	45.2	51%	0.509	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	35.4	-179.4	-64.2	-174.3	-176.5	175.3	0	110.6	D75 G79 K80	D75-K77 PolarHBondContact O-N 3.13Å; K77-G79 PolarHBondContact O-N 3.42Å; K77-K80 HydrophobicContact CB-CB 4.48Å; K77-K80 HydrophobicContact CD-CD 4.36Å; K77-K80 PolarHBondContact O-N 3.28Å
78	E	58.8	Low	82.7	Confident	45 Å²	45	45.6 Å²	45.6	21%	0.21	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.4	-36	171.1	-82.4	-129.5	141.4	0	0	112.2	D75 S76 K80 Q85 R88	D75-E78 WeakPolarHBondContact O-CG 3.41Å; D75-E78 PolarHBondContact OD1-N 3.26Å; S76-E78 PolarHBondContact O-N 3.27Å; E78-K80 PolarHBondContact O-N 3.05Å; E78-Q85 HydrophobicContact CB-CG 4.34Å; E78-Q85 HydrophobicContact CG-CG 4.45Å; E78-Q85 PolarHBondContact O-OE1 2.77Å; E78-Q85 PolarHBondContact OE2-NE2 3.04Å; E78-R88 IonicContact OE1-CZ 3.86Å; E78-R88 IonicContact OE1-NH2 3.26Å; E78-R88 PolarHBondContact OE1-NH2 3.26Å
79	G	50.4	Low	82.5	Confident	81 Å²	81	50.7 Å²	50.7	84%	0.835	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-11.4	175.9	0	0	0	0	0	118.2	K77	K77-G79 PolarHBondContact O-N 3.42Å
80	K	57.8	Low	82.3	Confident	166 Å²	166	53 Å²	53	72%	0.722	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-26.7	174.9	-69.3	-159.8	178.9	-160	0	113	K77 E78	K77-K80 HydrophobicContact CB-CB 4.48Å; K77-K80 HydrophobicContact CD-CD 4.36Å; K77-K80 PolarHBondContact O-N 3.28Å; E78-K80 PolarHBondContact O-N 3.05Å
81	N	65.5	Low	82.2	Confident	87 Å²	87	53 Å²	53	47%	0.465	28%	0.282	S	S	.	.			trans	-118.8	56.3	-178.8	-72	-9.4	0	0	0	110.4	E83 V84 Q85	N81-E83 PolarHBondContact O-N 2.81Å; N81-E83 VanDerWaalsContact O-N 3.14Å; N81-V84 HydrophobicContact CB-CB 4.32Å; N81-V84 HydrophobicContact CB-CG2 4.11Å; N81-V84 PolarHBondContact O-N 3.31Å; N81-Q85 PolarHBondContact O-N 3.23Å
82	G	80.2	Confident	82.2	Confident	29 Å²	29	53.5 Å²	53.5	30%	0.299	29%	0.285	S	S	.	.	H	α-helix	trans	-55.3	-32.4	-179.7	0	0	0	0	0	112.9	V84 Q85 I86	G82-V84 PolarHBondContact O-N 3.35Å; G82-Q85 WeakPolarHBondContact O-CB 3.4Å; G82-Q85 PolarHBondContact O-N 3.02Å; G82-I86 WeakPolarHBondContact O-CD1 3.46Å; G82-I86 VanDerWaalsContact O-CG1 3.24Å; G82-I86 WeakPolarHBondContact O-CG1 3.49Å; G82-I86 PolarHBondContact O-N 3.37Å
83	E	83.9	Confident	82.3	Confident	108 Å²	108	54.5 Å²	54.5	51%	0.505	29%	0.29	S	S	.	.	H	α-helix	trans	-59	-44.2	175.6	-64.6	179.7	173.1	0	0	112.7	N81 Q85 I86 L87 A335	N81-E83 PolarHBondContact O-N 2.81Å; N81-E83 VanDerWaalsContact O-N 3.14Å; E83-Q85 VanDerWaalsContact C-N 3.33Å; E83-Q85 PolarHBondContact O-N 3.42Å; E83-I86 PolarHBondContact O-N 3.14Å; E83-L87 WeakPolarHBondContact O-CG 3.05Å; E83-L87 PolarHBondContact O-N 3.3Å; E83-A335 WeakPolarHBondContact OE1-CB 3.38Å
84	V	87.5	Confident	82.4	Confident	25 Å²	25	52.3 Å²	52.3	15%	0.152	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-38.6	179.8	-179.6	0	0	0	0	110.7	N81 G82 I86 L87 R88 C311	N81-V84 HydrophobicContact CB-CB 4.32Å; N81-V84 HydrophobicContact CB-CG2 4.11Å; N81-V84 PolarHBondContact O-N 3.31Å; G82-V84 PolarHBondContact O-N 3.35Å; V84-I86 VanDerWaalsContact C-N 3.34Å; V84-L87 PolarHBondContact O-N 2.96Å; V84-R88 WeakPolarHBondContact O-CG 3.38Å; V84-R88 PolarHBondContact O-N 3.14Å; V84-C311 HydrophobicContact CG1-CB 3.63Å; V84-C311 HydrophobicContact CG2-CB 4.39Å
85	Q	88.2	Confident	82.7	Confident	63 Å²	63	52.8 Å²	52.8	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-43	174	-62.5	-175.1	-63.7	0	0	111.8	E78 N81 G82 E83 R88 H89	E78-Q85 HydrophobicContact CB-CG 4.34Å; E78-Q85 HydrophobicContact CG-CG 4.45Å; E78-Q85 PolarHBondContact O-OE1 2.77Å; E78-Q85 PolarHBondContact OE2-NE2 3.04Å; N81-Q85 PolarHBondContact O-N 3.23Å; G82-Q85 WeakPolarHBondContact O-CB 3.4Å; G82-Q85 PolarHBondContact O-N 3.02Å; E83-Q85 VanDerWaalsContact C-N 3.33Å; E83-Q85 PolarHBondContact O-N 3.42Å; Q85-R88 PolarHBondContact O-N 2.76Å; Q85-H89 WeakPolarHBondContact O-CB 3.28Å; Q85-H89 PolarHBondContact O-N 3.18Å
86	I	91	Very high	83.1	Confident	80 Å²	80	53.1 Å²	53.1	41%	0.41	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-43	177.8	-66.2	162.9	0	0	0	110.3	G82 E83 V84 R88 H89 H90 T333	G82-I86 WeakPolarHBondContact O-CD1 3.46Å; G82-I86 VanDerWaalsContact O-CG1 3.24Å; G82-I86 WeakPolarHBondContact O-CG1 3.49Å; G82-I86 PolarHBondContact O-N 3.37Å; E83-I86 PolarHBondContact O-N 3.14Å; V84-I86 VanDerWaalsContact C-N 3.34Å; I86-R88 PolarHBondContact O-N 3.14Å; I86-H89 CarbonylContact O-C 3.48Å; I86-H89 WeakPolarHBondContact O-CB 3.43Å; I86-H89 PolarHBondContact O-N 3.46Å; I86-H90 WeakPolarHBondContact CG2-NE2 3.4Å; I86-H90 PolarHBondContact O-CD2 3Å; I86-H90 PolarHBondContact O-N 3.43Å; I86-T333 HydrophobicContact CB-CG2 4.03Å; I86-T333 HydrophobicContact CG2-CG2 3.72Å
87	L	92.9	Very high	84.1	Confident	14 Å²	14	52.1 Å²	52.1	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-45.7	174.4	-72	174.4	0	0	0	112	E83 V84 H89 H90 L91 F310 F331 T333	E83-L87 WeakPolarHBondContact O-CG 3.05Å; E83-L87 PolarHBondContact O-N 3.3Å; V84-L87 PolarHBondContact O-N 2.96Å; L87-H89 VanDerWaalsContact C-N 3.32Å; L87-H89 PolarHBondContact O-N 3.27Å; L87-H90 PolarHBondContact O-N 3.39Å; L87-L91 PolarHBondContact O-N 3.18Å; L87-F310 HydrophobicContact CB-CE1 3.82Å; L87-F310 HydrophobicContact CB-CZ 4.26Å; L87-F331 HydrophobicContact CD2-CB 3.87Å; L87-F331 WeakPolarHBondContact CD2-O 3.47Å; L87-T333 HydrophobicContact CD2-CG2 3.87Å; L87-T333 HydrophobicContact CG-CG2 3.9Å
88	R	93.3	Very high	85.4	Confident	8 Å²	8	51.4 Å²	51.4	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-40.6	176.1	-68.9	-169.3	-68.2	-119.5	6.4	111.6	L72 R73 F74 E78 V84 Q85 I86 H90 L91 L92 F157 F310	L72-R88 HydrophobicContact CD2-CG 4.44Å; L72-R88 PolarHBondContact O-NH1 2.84Å; R73-R88 PolarHBondContact O-NH1 3.46Å; R73-R88 VanDerWaalsContact O-NH1 3.14Å; F74-R88 VanDerWaalsContact CZ-CD 3.49Å; E78-R88 IonicContact OE1-CZ 3.86Å; E78-R88 IonicContact OE1-NH2 3.26Å; E78-R88 PolarHBondContact OE1-NH2 3.26Å; V84-R88 WeakPolarHBondContact O-CG 3.38Å; V84-R88 PolarHBondContact O-N 3.14Å; Q85-R88 PolarHBondContact O-N 2.76Å; I86-R88 PolarHBondContact O-N 3.14Å; R88-H90 VanDerWaalsContact C-N 3.34Å; R88-L91 PolarHBondContact O-N 2.87Å; R88-L92 WeakPolarHBondContact O-CB 3.24Å; R88-L92 PolarHBondContact O-N 3.14Å; R88-F157 HydrophobicContact CB-CE2 4.5Å; R88-F310 HydrophobicContact CG-CE1 4.41Å
89	H	93.3	Very high	86.9	Confident	107 Å²	107	53.1 Å²	53.1	50%	0.495	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-39.6	175.8	-173.6	75.8	0	0	0	111.6	Q85 I86 L87 L92 N93	Q85-H89 WeakPolarHBondContact O-CB 3.28Å; Q85-H89 PolarHBondContact O-N 3.18Å; I86-H89 CarbonylContact O-C 3.48Å; I86-H89 WeakPolarHBondContact O-CB 3.43Å; I86-H89 PolarHBondContact O-N 3.46Å; L87-H89 VanDerWaalsContact C-N 3.32Å; L87-H89 PolarHBondContact O-N 3.27Å; H89-L92 PolarHBondContact O-N 3.11Å; H89-N93 PolarHBondContact CD2-ND2 3.21Å; H89-N93 PolarHBondContact CE1-ND2 2.88Å; H89-N93 PolarHBondContact NE2-ND2 3.26Å; H89-N93 PolarHBondContact O-N 2.8Å; H89-N93 PolarHBondContact O-ND2 2.97Å
90	H	94.2	Very high	88.7	Confident	50 Å²	50	51.2 Å²	51.2	23%	0.231	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-45.1	175.6	-72.7	-38.9	0	0	0	112.3	I86 L87 R88 L92 N93 W94 Y99 F331	I86-H90 WeakPolarHBondContact CG2-NE2 3.4Å; I86-H90 PolarHBondContact O-CD2 3Å; I86-H90 PolarHBondContact O-N 3.43Å; L87-H90 PolarHBondContact O-N 3.39Å; R88-H90 VanDerWaalsContact C-N 3.34Å; H90-L92 VanDerWaalsContact C-N 3.32Å; H90-L92 PolarHBondContact O-N 2.75Å; H90-N93 PolarHBondContact O-N 3.25Å; H90-W94 VanDerWaalsContact O-CB 3.28Å; H90-W94 WeakPolarHBondContact O-CB 3.44Å; H90-W94 PolarHBondContact O-N 2.89Å; H90-Y99 HydrophobicContact CB-CE2 3.93Å; H90-Y99 AromaticContact CG-CE2 3.97Å; H90-Y99 AromaticContact ND1-CE2 3.32Å; H90-Y99 VanDerWaalsContact ND1-CE2 3.32Å; H90-Y99 WeakPolarHBondContact ND1-CE2 3.22Å; H90-Y99 AromaticContact ND1-CZ 3.51Å; H90-Y99 PolarHBondContact ND1-OH 3.4Å; H90-F331 HydrophobicContact CB-CD1 3.92Å
91	L	95.4	Very high	90.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-46	174.1	173	65.1	0	0	0	111.7	L67 I69 L72 L87 R88 W94 L95 F157 F310 F331	L67-L91 HydrophobicContact CD2-CD1 4.36Å; I69-L91 HydrophobicContact CD1-CD2 3.84Å; I69-L91 HydrophobicContact CG2-CD2 4.46Å; L72-L91 HydrophobicContact CD2-CD2 4.01Å; L87-L91 PolarHBondContact O-N 3.18Å; R88-L91 PolarHBondContact O-N 2.87Å; L91-W94 HydrophobicContact CD1-CE3 4.35Å; L91-W94 PolarHBondContact O-N 3.1Å; L91-L95 HydrophobicContact CD1-CD1 3.98Å; L91-L95 HydrophobicContact CD1-CG 4.34Å; L91-L95 HydrophobicContact CG-CD1 4.17Å; L91-L95 WeakPolarHBondContact O-CB 3.29Å; L91-L95 WeakPolarHBondContact O-CG 3.42Å; L91-L95 PolarHBondContact O-N 3.01Å; L91-F157 HydrophobicContact CD2-CZ 4.19Å; L91-F310 HydrophobicContact CB-CE1 4.31Å; L91-F310 HydrophobicContact CB-CE2 4.15Å; L91-F310 HydrophobicContact CB-CZ 3.63Å; L91-F310 HydrophobicContact CD1-CE2 4.33Å; L91-F310 HydrophobicContact CD2-CD2 4.3Å; L91-F310 HydrophobicContact CD2-CE1 4.17Å; L91-F310 HydrophobicContact CD2-CE2 3.89Å; L91-F310 HydrophobicContact CD2-CZ 3.86Å; L91-F310 HydrophobicContact CG-CE2 4.36Å; L91-F310 HydrophobicContact CG-CZ 4.24Å; L91-F331 HydrophobicContact CB-CE2 4.46Å; L91-F331 HydrophobicContact CB-CZ 4.36Å; L91-F331 HydrophobicContact CD1-CE2 3.76Å; L91-F331 HydrophobicContact CD1-CZ 3.79Å
92	L	95.6	Very high	91.7	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-61.3	-51.8	179	-178.1	59.5	0	0	0	111.3	R88 H89 H90 W94 L95 L96 F157 Q160 L161	R88-L92 WeakPolarHBondContact O-CB 3.24Å; R88-L92 PolarHBondContact O-N 3.14Å; H89-L92 PolarHBondContact O-N 3.11Å; H90-L92 VanDerWaalsContact C-N 3.32Å; H90-L92 PolarHBondContact O-N 2.75Å; L92-W94 VanDerWaalsContact C-N 3.3Å; L92-W94 PolarHBondContact O-N 2.8Å; L92-L95 PolarHBondContact O-N 3.46Å; L92-L96 HydrophobicContact CD1-CD1 4.12Å; L92-L96 HydrophobicContact CD1-CG 4.24Å; L92-L96 HydrophobicContact CG-CD1 3.95Å; L92-L96 HydrophobicContact CG-CG 4.44Å; L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 WeakPolarHBondContact O-CG 3.33Å; L92-L96 PolarHBondContact O-N 3.46Å; L92-F157 HydrophobicContact CB-CD2 4.32Å; L92-F157 HydrophobicContact CB-CE2 3.86Å; L92-F157 HydrophobicContact CD1-CD2 4.41Å; L92-F157 HydrophobicContact CD1-CE2 4.33Å; L92-F157 HydrophobicContact CD2-CD2 4.18Å; L92-F157 HydrophobicContact CG-CE2 4.48Å; L92-Q160 HydrophobicContact CD1-CB 3.98Å; L92-Q160 HydrophobicContact CD2-CB 4.37Å; L92-L161 HydrophobicContact CD1-CD2 3.47Å; L92-L161 VanDerWaalsContact CD1-CD2 3.47Å; L92-L161 HydrophobicContact CD1-CG 3.77Å
93	N	95.1	Very high	92.3	Very high	21 Å²	21	57.1 Å²	57.1	11%	0.112	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-35.8	-179.7	-79.1	-68.5	0	0	0	113	H89 H90 L96 G97 N98 Y99	H89-N93 PolarHBondContact CD2-ND2 3.21Å; H89-N93 PolarHBondContact CE1-ND2 2.88Å; H89-N93 PolarHBondContact NE2-ND2 3.26Å; H89-N93 PolarHBondContact O-N 2.8Å; H89-N93 PolarHBondContact O-ND2 2.97Å; H90-N93 PolarHBondContact O-N 3.25Å; N93-L96 PolarHBondContact O-N 3.19Å; N93-G97 PolarHBondContact O-N 2.96Å; N93-N98 HydrophobicContact CB-CB 4.08Å; N93-N98 WeakPolarHBondContact O-CB 3.41Å; N93-N98 PolarHBondContact O-N 2.85Å; N93-N98 PolarHBondContact OD1-ND2 2.98Å; N93-Y99 HydrophobicContact CB-CD1 4.04Å; N93-Y99 HydrophobicContact CB-CD2 4.03Å; N93-Y99 HydrophobicContact CB-CE1 3.68Å; N93-Y99 HydrophobicContact CB-CE2 3.71Å; N93-Y99 HydrophobicContact CB-CG 4.19Å; N93-Y99 VanDerWaalsContact CB-CZ 3.49Å
94	W	95.4	Very high	92.7	Very high	6 Å²	6	55.7 Å²	55.7	2%	0.023	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-48.3	173.5	178.9	76.7	0	0	0	111.4	L67 H90 L91 L92 L96 G97 Y99 E104 V108 I111 I329 F331	L67-W94 HydrophobicContact CD1-CH2 4.11Å; L67-W94 HydrophobicContact CD1-CZ3 3.96Å; L67-W94 HydrophobicContact CD2-CZ3 3.92Å; H90-W94 VanDerWaalsContact O-CB 3.28Å; H90-W94 WeakPolarHBondContact O-CB 3.44Å; H90-W94 PolarHBondContact O-N 2.89Å; L91-W94 HydrophobicContact CD1-CE3 4.35Å; L91-W94 PolarHBondContact O-N 3.1Å; L92-W94 VanDerWaalsContact C-N 3.3Å; L92-W94 PolarHBondContact O-N 2.8Å; W94-L96 VanDerWaalsContact C-N 3.27Å; W94-L96 PolarHBondContact O-N 3.43Å; W94-G97 PolarHBondContact O-N 2.93Å; W94-Y99 HydrophobicContact CB-CD2 4.23Å; W94-E104 VanDerWaalsContact CD1-OE1 3.31Å; W94-E104 PolarHBondContact NE1-OE1 2.9Å; W94-V108 HydrophobicContact CD2-CG2 4.08Å; W94-V108 HydrophobicContact CH2-CG2 4.24Å; W94-V108 HydrophobicContact CZ2-CG2 3.65Å; W94-I111 HydrophobicContact CH2-CD1 4.01Å; W94-I111 HydrophobicContact CZ3-CD1 4.21Å; W94-I329 HydrophobicContact CH2-CB 4.49Å; W94-I329 HydrophobicContact CH2-CG1 3.92Å; W94-I329 HydrophobicContact CH2-CG2 4.17Å; W94-I329 HydrophobicContact CZ2-CD1 4.25Å; W94-I329 HydrophobicContact CZ2-CG1 4.07Å; W94-I329 HydrophobicContact CZ2-CG2 3.97Å; W94-F331 HydrophobicContact CB-CE1 3.74Å; W94-F331 HydrophobicContact CB-CZ 4.11Å; W94-F331 HydrophobicContact CD2-CE1 4.25Å; W94-F331 AromaticContact CD2-CZ 3.82Å; W94-F331 HydrophobicContact CD2-CZ 3.82Å; W94-F331 HydrophobicContact CE3-CE1 4.49Å; W94-F331 AromaticContact CE3-CZ 3.71Å; W94-F331 HydrophobicContact CE3-CZ 3.71Å; W94-F331 AromaticContact CG-CE1 3.92Å; W94-F331 HydrophobicContact CG-CE1 3.92Å; W94-F331 HydrophobicContact CG-CZ 4Å; W94-F331 HydrophobicContact CZ3-CZ 4.4Å
95	L	95.5	Very high	92.9	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-31.1	175.8	-81	173.1	0	0	0	113.6	L67 L91 L92 G97 V108 I111 V114 L161	L67-L95 HydrophobicContact CD2-CD1 3.98Å; L67-L95 HydrophobicContact CD2-CD2 3.7Å; L67-L95 HydrophobicContact CD2-CG 4.2Å; L91-L95 HydrophobicContact CD1-CD1 3.98Å; L91-L95 HydrophobicContact CD1-CG 4.34Å; L91-L95 HydrophobicContact CG-CD1 4.17Å; L91-L95 WeakPolarHBondContact O-CB 3.29Å; L91-L95 WeakPolarHBondContact O-CG 3.42Å; L91-L95 PolarHBondContact O-N 3.01Å; L92-L95 PolarHBondContact O-N 3.46Å; L95-G97 PolarHBondContact O-N 3.33Å; L95-V108 WeakPolarHBondContact O-CG1 3.38Å; L95-I111 HydrophobicContact CD2-CD1 3.93Å; L95-V114 HydrophobicContact CD2-CG2 4.26Å; L95-L161 HydrophobicContact CB-CD2 3.75Å; L95-L161 HydrophobicContact CD1-CD1 4.23Å; L95-L161 HydrophobicContact CD1-CD2 3.5Å; L95-L161 VanDerWaalsContact CD1-CD2 3.5Å; L95-L161 HydrophobicContact CG-CD2 4.24Å
96	L	94	Very high	93.2	Very high	41 Å²	41	59.1 Å²	59.1	22%	0.215	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.4	174.2	-66.4	176.4	0	0	0	113.2	L92 N93 W94 N98 Y164	L92-L96 HydrophobicContact CD1-CD1 4.12Å; L92-L96 HydrophobicContact CD1-CG 4.24Å; L92-L96 HydrophobicContact CG-CD1 3.95Å; L92-L96 HydrophobicContact CG-CG 4.44Å; L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 WeakPolarHBondContact O-CG 3.33Å; L92-L96 PolarHBondContact O-N 3.46Å; N93-L96 PolarHBondContact O-N 3.19Å; W94-L96 VanDerWaalsContact C-N 3.27Å; W94-L96 PolarHBondContact O-N 3.43Å; L96-N98 VanDerWaalsContact C-N 3.3Å; L96-N98 PolarHBondContact O-N 2.96Å; L96-Y164 HydrophobicContact CD2-CD2 3.26Å; L96-Y164 HydrophobicContact CD2-CE2 3.19Å; L96-Y164 HydrophobicContact CD2-CG 4.02Å
97	G	92.7	Very high	93.2	Very high	19 Å²	19	57.4 Å²	57.4	20%	0.196	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	13	-176.9	0	0	0	0	0	114.3	N93 W94 L95 Y99 Q105	N93-G97 PolarHBondContact O-N 2.96Å; W94-G97 PolarHBondContact O-N 2.93Å; L95-G97 PolarHBondContact O-N 3.33Å; G97-Y99 VanDerWaalsContact C-N 3.28Å; G97-Y99 PolarHBondContact O-N 2.89Å; G97-Q105 PolarHBondContact O-NE2 3.13Å
98	N	92.4	Very high	93.3	Very high	102 Å²	102	57.3 Å²	57.3	55%	0.545	29%	0.291	S	S	.	.			trans	-75.7	-18.8	179	-66.8	-24.7	0	0	0	112.7	N93 L96	N93-N98 HydrophobicContact CB-CB 4.08Å; N93-N98 WeakPolarHBondContact O-CB 3.41Å; N93-N98 PolarHBondContact O-N 2.85Å; N93-N98 PolarHBondContact OD1-ND2 2.98Å; L96-N98 VanDerWaalsContact C-N 3.3Å; L96-N98 PolarHBondContact O-N 2.96Å
99	Y	91.4	Very high	93.4	Very high	80 Å²	80	61 Å²	61	31%	0.314	32%	0.323	S	S	.	.	S	Bend	trans	-108.9	161.9	176.9	-65.2	-13.2	0	0	0	111.4	H90 N93 W94 G97	H90-Y99 HydrophobicContact CB-CE2 3.93Å; H90-Y99 AromaticContact CG-CE2 3.97Å; H90-Y99 AromaticContact ND1-CE2 3.32Å; H90-Y99 VanDerWaalsContact ND1-CE2 3.32Å; H90-Y99 WeakPolarHBondContact ND1-CE2 3.22Å; H90-Y99 AromaticContact ND1-CZ 3.51Å; H90-Y99 PolarHBondContact ND1-OH 3.4Å; N93-Y99 HydrophobicContact CB-CD1 4.04Å; N93-Y99 HydrophobicContact CB-CD2 4.03Å; N93-Y99 HydrophobicContact CB-CE1 3.68Å; N93-Y99 HydrophobicContact CB-CE2 3.71Å; N93-Y99 HydrophobicContact CB-CG 4.19Å; N93-Y99 VanDerWaalsContact CB-CZ 3.49Å; W94-Y99 HydrophobicContact CB-CD2 4.23Å; G97-Y99 VanDerWaalsContact C-N 3.28Å; G97-Y99 PolarHBondContact O-N 2.89Å
100	G	88.4	Confident	93.4	Very high	41 Å²	41	59.1 Å²	59.1	42%	0.423	31%	0.312	S	S	.	.	S	Bend	trans	87.4	167.9	175.7	0	0	0	0	0	114.3	E104	G100-E104 WeakPolarHBondContact CA-OE2 3.15Å
101	G	93	Very high	93.6	Very high	49 Å²	49	57.4 Å²	57.4	51%	0.505	30%	0.304	S	S	.	.			trans	-80.8	179.8	168.2	0	0	0	0	0	111.7	E103 E104 Q105	G101-E103 VanDerWaalsContact C-N 3.29Å; G101-E103 PolarHBondContact O-N 3.4Å; G101-E104 PolarHBondContact O-N 3.43Å; G101-E104 VanDerWaalsContact O-N 3.12Å; G101-Q105 WeakPolarHBondContact O-CG 3.41Å; G101-Q105 PolarHBondContact O-N 2.82Å
102	R	93.1	Very high	93.6	Very high	187 Å²	187	59.5 Å²	59.5	71%	0.706	32%	0.317	S	S	*	.	H	α-helix	trans	-54.6	-42.3	-179.2	-177.6	177.1	172	174.2	0.9	113.3	E104 Q105 E106	R102-E104 VanDerWaalsContact C-N 3.33Å; R102-E104 PolarHBondContact O-N 2.86Å; R102-Q105 PolarHBondContact O-N 3.34Å; R102-E106 HydrophobicContact CG-CG 4.36Å; R102-E106 WeakPolarHBondContact CG-OE1 3.44Å; R102-E106 IonicContact CZ-OE1 2.7Å; R102-E106 IonicContact NE-OE1 2.7Å; R102-E106 PolarHBondContact NE-OE1 2.99Å; R102-E106 IonicContact NH2-OE1 3.75Å; R102-E106 PolarHBondContact NH2-OE1 2.97Å; R102-E106 WeakPolarHBondContact O-CB 3.23Å; R102-E106 VanDerWaalsContact O-CG 3.3Å; R102-E106 WeakPolarHBondContact O-CG 3.1Å; R102-E106 PolarHBondContact O-N 3.21Å
103	E	92.1	Very high	93.7	Very high	170 Å²	170	61.8 Å²	61.8	79%	0.794	33%	0.325	S	S	*	.	H	α-helix	trans	-62.4	-39.5	179.7	-63.9	-179.1	176.3	0	0	112.5	G101 K107	G101-E103 VanDerWaalsContact C-N 3.29Å; G101-E103 PolarHBondContact O-N 3.4Å; E103-K107 WeakPolarHBondContact O-CB 3.45Å; E103-K107 PolarHBondContact O-N 2.86Å; E103-K107 VanDerWaalsContact O-N 3.09Å
104	E	91.5	Very high	93.8	Very high	79 Å²	79	60.8 Å²	60.8	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-72.4	-40.6	178.3	-173.4	170.9	-166.7	0	0	111.2	W94 G100 G101 R102 E106 K107 V108	W94-E104 VanDerWaalsContact CD1-OE1 3.31Å; W94-E104 PolarHBondContact NE1-OE1 2.9Å; G100-E104 WeakPolarHBondContact CA-OE2 3.15Å; G101-E104 PolarHBondContact O-N 3.43Å; G101-E104 VanDerWaalsContact O-N 3.12Å; R102-E104 VanDerWaalsContact C-N 3.33Å; R102-E104 PolarHBondContact O-N 2.86Å; E104-E106 PolarHBondContact O-N 3.49Å; E104-K107 WeakPolarHBondContact O-CB 3.47Å; E104-K107 PolarHBondContact O-N 3.23Å; E104-V108 WeakPolarHBondContact O-CG2 3.24Å; E104-V108 PolarHBondContact O-N 2.93Å
105	Q	93.4	Very high	93.9	Very high	83 Å²	83	60.5 Å²	60.5	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-42.2	174.3	-69.9	174.1	-13.3	0	0	112	G97 G101 R102 K107 V108 A109	G97-Q105 PolarHBondContact O-NE2 3.13Å; G101-Q105 WeakPolarHBondContact O-CG 3.41Å; G101-Q105 PolarHBondContact O-N 2.82Å; R102-Q105 PolarHBondContact O-N 3.34Å; Q105-K107 VanDerWaalsContact C-N 3.28Å; Q105-K107 PolarHBondContact O-N 3.39Å; Q105-V108 PolarHBondContact O-N 3.44Å; Q105-A109 WeakPolarHBondContact O-CB 3.36Å; Q105-A109 PolarHBondContact O-N 2.89Å
106	E	92.9	Very high	94.1	Very high	76 Å²	76	59.7 Å²	59.7	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-61.4	-38.2	174.4	-76.3	174	-175.3	0	0	111.3	R102 E104 R110	R102-E106 HydrophobicContact CG-CG 4.36Å; R102-E106 WeakPolarHBondContact CG-OE1 3.44Å; R102-E106 IonicContact CZ-OE1 2.7Å; R102-E106 IonicContact NE-OE1 2.7Å; R102-E106 PolarHBondContact NE-OE1 2.99Å; R102-E106 IonicContact NH2-OE1 3.75Å; R102-E106 PolarHBondContact NH2-OE1 2.97Å; R102-E106 WeakPolarHBondContact O-CB 3.23Å; R102-E106 VanDerWaalsContact O-CG 3.3Å; R102-E106 WeakPolarHBondContact O-CG 3.1Å; R102-E106 PolarHBondContact O-N 3.21Å; E104-E106 PolarHBondContact O-N 3.49Å; E106-R110 WeakPolarHBondContact O-CG 3.44Å; E106-R110 PolarHBondContact O-N 2.87Å
107	K	92.6	Very high	94.3	Very high	44 Å²	44	57.7 Å²	57.7	19%	0.191	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-44.5	174.8	-170.7	-177	-168.3	170.3	0	112.7	Y65 E103 E104 Q105 A109 R110 L318 E327	Y65-K107 HydrophobicContact CE2-CG 3.99Å; E103-K107 WeakPolarHBondContact O-CB 3.45Å; E103-K107 PolarHBondContact O-N 2.86Å; E103-K107 VanDerWaalsContact O-N 3.09Å; E104-K107 WeakPolarHBondContact O-CB 3.47Å; E104-K107 PolarHBondContact O-N 3.23Å; Q105-K107 VanDerWaalsContact C-N 3.28Å; Q105-K107 PolarHBondContact O-N 3.39Å; K107-A109 VanDerWaalsContact C-N 3.31Å; K107-A109 PolarHBondContact O-N 2.81Å; K107-R110 WeakPolarHBondContact O-CB 3.49Å; K107-R110 PolarHBondContact O-N 2.96Å; K107-R110 VanDerWaalsContact O-N 3.17Å; K107-L318 HydrophobicContact CD-CD2 4.2Å; K107-L318 VanDerWaalsContact CE-CD2 3.42Å; K107-L318 HydrophobicContact CG-CD2 4.31Å; K107-E327 WeakPolarHBondContact CE-OE2 3.34Å; K107-E327 IonicContact NZ-OE1 2.73Å; K107-E327 PolarHBondContact NZ-OE1 3.33Å; K107-E327 IonicContact NZ-OE2 3.2Å; K107-E327 PolarHBondContact NZ-OE2 2.83Å
108	V	94.6	Very high	94.4	Very high	12 Å²	12	56.8 Å²	56.8	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-39.5	176.4	171.2	0	0	0	0	110.9	W94 L95 E104 Q105 R110 I111	W94-V108 HydrophobicContact CD2-CG2 4.08Å; W94-V108 HydrophobicContact CH2-CG2 4.24Å; W94-V108 HydrophobicContact CZ2-CG2 3.65Å; L95-V108 WeakPolarHBondContact O-CG1 3.38Å; E104-V108 WeakPolarHBondContact O-CG2 3.24Å; E104-V108 PolarHBondContact O-N 2.93Å; Q105-V108 PolarHBondContact O-N 3.44Å; V108-R110 PolarHBondContact O-N 3.48Å; V108-R110 VanDerWaalsContact O-N 3.15Å; V108-I111 HydrophobicContact CB-CD1 4.48Å; V108-I111 HydrophobicContact CG1-CD1 4.28Å; V108-I111 VanDerWaalsContact O-CB 3.31Å; V108-I111 WeakPolarHBondContact O-CB 3.46Å; V108-I111 VanDerWaalsContact O-CG1 3.32Å; V108-I111 WeakPolarHBondContact O-CG1 3.49Å; V108-I111 PolarHBondContact O-N 2.84Å
109	A	94.4	Very high	94.5	Very high	85 Å²	85	52.5 Å²	52.5	70%	0.702	27%	0.271	S	S	*	.	H	α-helix	trans	-61.5	-22.4	176.7	0	0	0	0	0	113.4	Q105 K107 I111	Q105-A109 WeakPolarHBondContact O-CB 3.36Å; Q105-A109 PolarHBondContact O-N 2.89Å; K107-A109 VanDerWaalsContact C-N 3.31Å; K107-A109 PolarHBondContact O-N 2.81Å; A109-I111 VanDerWaalsContact C-N 3.33Å
110	R	94.8	Very high	94.6	Very high	69 Å²	69	48.7 Å²	48.7	26%	0.26	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.9	176.2	-68.3	170.9	178	153.7	2	113.7	E62 P63 Y65 E106 K107 V108 V112	E62-R110 IonicContact OE1-NH2 3.55Å; E62-R110 IonicContact OE2-CZ 2.81Å; E62-R110 VanDerWaalsContact OE2-CZ 3.26Å; E62-R110 IonicContact OE2-NE 3.66Å; E62-R110 PolarHBondContact OE2-NE 3.38Å; E62-R110 IonicContact OE2-NH2 3.8Å; E62-R110 PolarHBondContact OE2-NH2 2.88Å; P63-R110 WeakPolarHBondContact O-CB 3.44Å; P63-R110 VanDerWaalsContact O-CD 3.31Å; P63-R110 WeakPolarHBondContact O-CD 3.07Å; Y65-R110 HydrophobicContact CD2-CB 3.83Å; Y65-R110 HydrophobicContact CE2-CB 4.11Å; Y65-R110 PolarHBondContact N-O 2.77Å; E106-R110 WeakPolarHBondContact O-CG 3.44Å; E106-R110 PolarHBondContact O-N 2.87Å; K107-R110 WeakPolarHBondContact O-CB 3.49Å; K107-R110 PolarHBondContact O-N 2.96Å; K107-R110 VanDerWaalsContact O-N 3.17Å; V108-R110 PolarHBondContact O-N 3.48Å; V108-R110 VanDerWaalsContact O-N 3.15Å; R110-V112 PolarHBondContact O-N 2.89Å
111	I	96.5	Very high	94.7	Very high	13 Å²	13	46.8 Å²	46.8	7%	0.067	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	110.5	172.4	-61.4	173.1	0	0	0	108.7	Y65 L67 W94 L95 V108 A109 R113 V114 V165 L318	Y65-I111 CarbonylContact O-C 3.56Å; Y65-I111 WeakPolarHBondContact O-CA 3.44Å; L67-I111 HydrophobicContact CB-CG2 4.15Å; W94-I111 HydrophobicContact CH2-CD1 4.01Å; W94-I111 HydrophobicContact CZ3-CD1 4.21Å; L95-I111 HydrophobicContact CD2-CD1 3.93Å; V108-I111 HydrophobicContact CB-CD1 4.48Å; V108-I111 HydrophobicContact CG1-CD1 4.28Å; V108-I111 VanDerWaalsContact O-CB 3.31Å; V108-I111 WeakPolarHBondContact O-CB 3.46Å; V108-I111 VanDerWaalsContact O-CG1 3.32Å; V108-I111 WeakPolarHBondContact O-CG1 3.49Å; V108-I111 PolarHBondContact O-N 2.84Å; A109-I111 VanDerWaalsContact C-N 3.33Å; I111-R113 WeakPolarHBondContact CG2-O 3.49Å; I111-V114 HydrophobicContact CG2-CG2 4.15Å; I111-V165 HydrophobicContact CG2-CG2 4.25Å; I111-V165 WeakPolarHBondContact O-CG2 3.2Å; I111-L318 HydrophobicContact CD1-CD1 3.86Å; I111-L318 HydrophobicContact CG1-CD1 3.82Å
112	V	96.2	Very high	94.3	Very high	44 Å²	44	47 Å²	47	27%	0.267	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-20.6	-177.7	-62.3	0	0	0	0	112.9	C64 Y65 V66 R110 P166 V211 L321	C64-V112 HydrophobicContact CB-CG1 3.82Å; Y65-V112 WeakPolarHBondContact O-CG2 3.44Å; Y65-V112 PolarHBondContact O-N 3.06Å; V66-V112 HydrophobicContact CG2-CG2 4.04Å; R110-V112 PolarHBondContact O-N 2.89Å; V112-P166 WeakPolarHBondContact O-CD 3.39Å; V112-V211 HydrophobicContact CG2-CG1 3.93Å; V112-L321 HydrophobicContact CG2-CD1 3.77Å
113	R	97.3	Very high	93.2	Very high	59 Å²	59	39 Å²	39	22%	0.223	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	143.9	-177.1	-169.5	169.6	-77.1	-145.4	7.2	112	V66 L67 I111 I115 P166 D168 V211	V66-R113 WeakPolarHBondContact CA-O 3.3Å; V66-R113 HydrophobicContact CG2-CB 4.29Å; L67-R113 PolarHBondContact N-O 3.17Å; I111-R113 WeakPolarHBondContact CG2-O 3.49Å; R113-I115 HydrophobicContact CG-CG1 4.37Å; R113-P166 WeakPolarHBondContact CA-O 3.32Å; R113-D168 VanDerWaalsContact CD-OD2 3.28Å; R113-D168 WeakPolarHBondContact CD-OD2 3.37Å; R113-D168 IonicContact CZ-OD2 3.53Å; R113-D168 IonicContact NE-OD2 3.86Å; R113-D168 IonicContact NH1-OD1 2.86Å; R113-D168 IonicContact NH1-OD2 2.83Å; R113-D168 PolarHBondContact NH1-OD2 3.39Å; R113-V211 HydrophobicContact CB-CG1 4.41Å
114	V	98	Very high	91.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.7	170.4	-179.3	0	0	0	0	108.9	L67 I69 L95 I111 I116 V165 P166 V167 D168	L67-V114 HydrophobicContact CB-CG2 4.21Å; L67-V114 HydrophobicContact CD2-CG1 4.32Å; L67-V114 HydrophobicContact CD2-CG2 4.39Å; L67-V114 CarbonylContact O-C 3.52Å; L67-V114 WeakPolarHBondContact O-CA 3.17Å; I69-V114 HydrophobicContact CD1-CG1 4.05Å; I69-V114 HydrophobicContact CG1-CG1 4.26Å; L95-V114 HydrophobicContact CD2-CG2 4.26Å; I111-V114 HydrophobicContact CG2-CG2 4.15Å; V114-I116 HydrophobicContact CG1-CG1 4.25Å; V114-V165 HydrophobicContact CG2-CG1 3.66Å; V114-V165 HydrophobicContact CG2-CG2 4.06Å; V114-P166 PolarHBondContact N-O 2.74Å; V114-V167 HydrophobicContact CB-CG2 4.4Å; V114-V167 CarbonylContact O-C 3.45Å; V114-V167 WeakPolarHBondContact O-CA 3.39Å; V114-D168 PolarHBondContact O-N 3.44Å
115	I	98.3	Very high	90.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.9	174.8	-55.2	174.9	0	0	0	108.5	V66 L67 L68 I69 R113 D168 M170 Y207 F278	V66-I115 HydrophobicContact CG1-CD1 3.98Å; V66-I115 HydrophobicContact CG1-CG1 4.22Å; L67-I115 PolarHBondContact O-N 3.38Å; L68-I115 HydrophobicContact CD2-CB 3.63Å; L68-I115 HydrophobicContact CD2-CD1 3.7Å; L68-I115 HydrophobicContact CD2-CG1 4.01Å; L68-I115 HydrophobicContact CD2-CG2 4.31Å; I69-I115 PolarHBondContact N-O 3.17Å; R113-I115 HydrophobicContact CG-CG1 4.37Å; I115-D168 WeakPolarHBondContact CA-O 3.47Å; I115-D168 HydrophobicContact CG1-CB 4.38Å; I115-M170 HydrophobicContact CG2-SD 4.02Å; I115-Y207 HydrophobicContact CD1-CE1 4.05Å; I115-Y207 HydrophobicContact CG1-CE1 4.46Å; I115-Y207 HydrophobicContact CG2-CD1 4.24Å; I115-Y207 HydrophobicContact CG2-CE1 4.29Å; I115-F278 HydrophobicContact CG2-CZ 4.19Å
116	I	98.2	Very high	88.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	99.9	177.1	-49.7	-172.7	0	0	0	108.3	I69 L72 V114 G118 S120 L158 V167 D168 L169 M170	I69-I116 HydrophobicContact CD1-CD1 4.14Å; I69-I116 HydrophobicContact CD1-CG1 3.84Å; I69-I116 HydrophobicContact CG1-CB 4.31Å; I69-I116 HydrophobicContact CG1-CG1 3.83Å; I69-I116 HydrophobicContact CG1-CG2 4.41Å; I69-I116 CarbonylContact O-C 3.58Å; I69-I116 WeakPolarHBondContact O-CA 3.35Å; L72-I116 HydrophobicContact CD1-CD1 4.16Å; L72-I116 HydrophobicContact CD1-CG2 3.95Å; L72-I116 HydrophobicContact CG-CG2 4.48Å; V114-I116 HydrophobicContact CG1-CG1 4.25Å; I116-G118 PolarHBondContact O-N 3.3Å; I116-G118 VanDerWaalsContact O-N 3.1Å; I116-S120 WeakPolarHBondContact CG2-OG 3.22Å; I116-L158 HydrophobicContact CD1-CD2 3.6Å; I116-V167 HydrophobicContact CD1-CG1 3.78Å; I116-V167 HydrophobicContact CG1-CG1 4.04Å; I116-D168 PolarHBondContact N-O 2.85Å; I116-L169 HydrophobicContact CB-CD1 3.75Å; I116-L169 HydrophobicContact CD1-CD1 4.49Å; I116-L169 HydrophobicContact CG2-CD1 3.7Å; I116-M170 WeakPolarHBondContact O-CB 3.28Å; I116-M170 PolarHBondContact O-N 2.83Å
117	A	97.6	Very high	86.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	61.3	-168.8	0	0	0	0	0	113.6	I69 C70 M170 F278 A280 N281	I69-A117 PolarHBondContact O-N 3.49Å; C70-A117 HydrophobicContact CB-CB 4.07Å; C70-A117 WeakPolarHBondContact CB-O 3.42Å; A117-M170 HydrophobicContact CB-SD 3.82Å; A117-F278 HydrophobicContact CB-CD2 4.31Å; A117-F278 HydrophobicContact CB-CE2 3.66Å; A117-A280 HydrophobicContact CB-CB 3.48Å; A117-A280 VanDerWaalsContact CB-CB 3.48Å; A117-A280 WeakPolarHBondContact O-CB 3.39Å; A117-N281 PolarHBondContact O-ND2 3.33Å
118	G	95.4	Very high	84.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	76.6	171.9	170.6	0	0	0	0	0	116.4	G71 I116 S120 M170	G71-G118 PolarHBondContact N-O 3.07Å; I116-G118 PolarHBondContact O-N 3.3Å; I116-G118 VanDerWaalsContact O-N 3.1Å; G118-S120 VanDerWaalsContact C-N 3.32Å; G118-M170 WeakPolarHBondContact CA-O 3.48Å; G118-M170 PolarHBondContact N-O 3.02Å
119	N	94.6	Very high	82.2	Confident	12 Å²	12	45.4 Å²	45.4	6%	0.064	26%	0.256	C	S	.	.			trans	57	44.1	-174.2	-66.5	-10.5	0	0	0	112	G71 L72 R73 E173 T174 D175 N281	G71-N119 CarbonylContact C-O 3.29Å; G71-N119 WeakPolarHBondContact CA-O 3.41Å; L72-N119 PolarHBondContact N-O 3.38Å; R73-N119 WeakPolarHBondContact CG-O 3.23Å; R73-N119 PolarHBondContact N-O 2.92Å; N119-E173 PolarHBondContact OD1-N 3.32Å; N119-T174 WeakPolarHBondContact CA-OG1 3.31Å; N119-T174 PolarHBondContact OD1-N 3.2Å; N119-T174 PolarHBondContact OD1-OG1 2.76Å; N119-D175 WeakPolarHBondContact CA-OD2 3.28Å; N119-D175 PolarHBondContact N-OD2 3.04Å; N119-N281 WeakPolarHBondContact CB-OD1 3.5Å; N119-N281 PolarHBondContact ND2-ND2 3.44Å; N119-N281 PolarHBondContact ND2-OD1 3.21Å; N119-N281 VanDerWaalsContact ND2-OD1 3.1Å
120	S	94.4	Very high	80.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.			trans	-80.6	-33.4	-179.3	-55.8	0	0	0	0	112.1	R73 F74 I116 G118 L169 D175	R73-S120 CarbonylContact C-O 3.54Å; R73-S120 WeakPolarHBondContact CA-O 3.14Å; R73-S120 PolarHBondContact N-O 2.9Å; F74-S120 WeakPolarHBondContact CD2-O 3.38Å; F74-S120 PolarHBondContact N-O 3.33Å; I116-S120 WeakPolarHBondContact CG2-OG 3.22Å; G118-S120 VanDerWaalsContact C-N 3.32Å; S120-L169 VanDerWaalsContact OG-CD1 3.3Å; S120-L169 WeakPolarHBondContact OG-CD1 3.15Å; S120-D175 PolarHBondContact N-OD1 2.82Å; S120-D175 VanDerWaalsContact N-OD1 3.11Å; S120-D175 PolarHBondContact N-OD2 2.91Å
121	I	90.7	Very high	77.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-118.6	133.1	178.2	-56.1	174.3	0	0	0	108.9	A123 A150 A151 L154 T174 D175 P176 M190	I121-A123 VanDerWaalsContact C-N 3.25Å; I121-A123 HydrophobicContact CG2-CB 4.03Å; I121-A123 PolarHBondContact O-N 2.9Å; I121-A123 VanDerWaalsContact O-N 3.14Å; I121-A150 HydrophobicContact CG2-CB 3.84Å; I121-A151 HydrophobicContact CD1-CB 3.9Å; I121-L154 HydrophobicContact CD1-CD2 3.88Å; I121-L154 HydrophobicContact CG1-CD2 3.52Å; I121-T174 CarbonylContact O-C 3.59Å; I121-T174 VanDerWaalsContact O-C 3.29Å; I121-T174 WeakPolarHBondContact O-CB 3.42Å; I121-T174 VanDerWaalsContact O-O 3.07Å; I121-T174 PolarHBondContact O-OG1 3Å; I121-D175 PolarHBondContact N-OD1 2.88Å; I121-P176 HydrophobicContact CD1-CG 4.42Å; I121-M190 HydrophobicContact CD1-CE 3.24Å
122	M	83.8	Confident	75.7	Confident	53 Å²	53	47.8 Å²	47.8	26%	0.261	27%	0.267	S	S	.	.			trans	-86.2	62.4	170.6	-172.5	60.1	65.4	0	0	110.2	R73 F74 D75 T174	R73-M122 HydrophobicContact CB-CE 4.1Å; R73-M122 HydrophobicContact CG-CE 3.85Å; F74-M122 PolarHBondContact O-N 3.3Å; D75-M122 HydrophobicContact CB-CB 4.22Å; M122-T174 HydrophobicContact CE-CG2 4.24Å; M122-T174 HydrophobicContact SD-CG2 4.04Å
123	A	68.9	Low	73.7	Confident	21 Å²	21	49.4 Å²	49.4	17%	0.174	28%	0.28	C	S	.	.	S	Bend	trans	-76.8	-31.1	179.1	0	0	0	0	0	111.6	I121 T174 P176	I121-A123 VanDerWaalsContact C-N 3.25Å; I121-A123 HydrophobicContact CG2-CB 4.03Å; I121-A123 PolarHBondContact O-N 2.9Å; I121-A123 VanDerWaalsContact O-N 3.14Å; A123-T174 WeakPolarHBondContact CB-O 3.47Å; A123-T174 PolarHBondContact N-O 3.47Å; A123-P176 HydrophobicContact CB-CB 4.36Å
124	K	65.7	Low	71.6	Confident	30 Å²	30	54.7 Å²	54.7	13%	0.13	31%	0.307	C	S	.	.	S	Bend	trans	-123.7	137.3	178.5	-54.6	172.4	-168.4	144.4	0	108.4	T174 D175 T177 H179	K124-T174 PolarHBondContact N-O 3.06Å; K124-D175 PolarHBondContact NZ-O 2.9Å; K124-D175 VanDerWaalsContact NZ-O 3.1Å; K124-T177 PolarHBondContact NZ-O 2.83Å; K124-H179 WeakPolarHBondContact CD-NE2 3.48Å; K124-H179 WeakPolarHBondContact CE-CE1 3.47Å; K124-H179 PolarHBondContact NZ-CE1 3.28Å; K124-H179 PolarHBondContact NZ-NE2 3.01Å
125	K	62.4	Low	69.7	Low	149 Å²	149	59.4 Å²	59.4	65%	0.648	33%	0.33	S	S	*	.			trans	-68.9	138.7	164.3	-74.3	-170.8	174.5	-171.6	0	107.9	G127 G128	K125-G127 PolarHBondContact O-N 3.44Å; K125-G128 PolarHBondContact O-N 3.23Å
126	P	53	Low	67.7	Low	82 Å²	82	61.3 Å²	61.3	53%	0.532	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	123.5	172.5	-23.3	31.6	0	0	0	110	G128 T174	P126-G128 PolarHBondContact O-N 2.81Å; P126-T174 HydrophobicContact CG-CG2 4.07Å
127	G	52	Low	66	Low	86 Å²	86	69.9 Å²	69.9	89%	0.887	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	7.4	-176.5	0	0	0	0	0	117	K125	K125-G127 PolarHBondContact O-N 3.44Å
128	G	46.9	Very low	64.2	Low	34 Å²	34	78.1 Å²	78.1	35%	0.351	42%	0.416	S	S	.	.			trans	-110.7	144.8	-174	0	0	0	0	0	114.2	K125 P126	K125-G128 PolarHBondContact O-N 3.23Å; P126-G128 PolarHBondContact O-N 2.81Å
129	R	46.6	Very low	62.6	Low	217 Å²	217	81.7 Å²	81.7	82%	0.819	44%	0.435	S	S	*	.			trans	-60.8	144.1	166.4	-68.7	-178.4	-166.6	155.9	5.7	109.8	C131	R129-C131 PolarHBondContact O-N 2.96Å
130	N	51.1	Low	60.9	Low	77 Å²	77	82.8 Å²	82.8	41%	0.412	44%	0.443	S	S	.	.			trans	-45.8	125.4	173.8	-65.3	-6.2	0	0	0	109.7	F132 S133	N130-F132 PolarHBondContact O-N 3.44Å; N130-S133 WeakPolarHBondContact O-CB 3.45Å; N130-S133 PolarHBondContact O-N 2.83Å; N130-S133 PolarHBondContact O-OG 2.81Å
131	C	47.3	Very low	59.3	Low	95 Å²	95	93.4 Å²	93.4	64%	0.642	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-53.7	-29.9	-178.8	-165.6	0	0	0	0	111.7	R129 S133	R129-C131 PolarHBondContact O-N 2.96Å; C131-S133 VanDerWaalsContact C-N 3.34Å; C131-S133 PolarHBondContact O-N 2.96Å
132	F	51.9	Low	57.8	Low	45 Å²	45	103 Å²	103	20%	0.197	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-71.7	-20.1	177.4	-113.3	-108.1	0	0	0	115.4	N130 Q134 M135 M143 H145 P146	N130-F132 PolarHBondContact O-N 3.44Å; F132-Q134 PolarHBondContact O-N 3.28Å; F132-M135 PolarHBondContact O-N 2.95Å; F132-M143 HydrophobicContact CZ-CB 4.11Å; F132-H145 WeakPolarHBondContact CB-NE2 3.31Å; F132-H145 AromaticContact CD1-CD2 3.56Å; F132-H145 AromaticContact CD2-CD2 3.56Å; F132-H145 AromaticContact CD2-NE2 3.76Å; F132-H145 AromaticContact CG-CD2 3.28Å; F132-H145 WeakPolarHBondContact CG-CD2 3.32Å; F132-H145 AromaticContact CG-NE2 3.52Å; F132-P146 HydrophobicContact CD2-CG 4.21Å; F132-P146 HydrophobicContact CE2-CG 3.8Å
133	S	52.6	Low	56.8	Low	77 Å²	77	105 Å²	105	54%	0.538	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-65.9	-18.6	179.2	65.7	0	0	0	0	113.2	N130 C131	N130-S133 WeakPolarHBondContact O-CB 3.45Å; N130-S133 PolarHBondContact O-N 2.83Å; N130-S133 PolarHBondContact O-OG 2.81Å; C131-S133 VanDerWaalsContact C-N 3.34Å; C131-S133 PolarHBondContact O-N 2.96Å
134	Q	54.5	Low	56.7	Low	170 Å²	170	109.3 Å²	109.3	79%	0.794	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-89.8	-9.1	178.9	-66.3	-176.8	-1.4	0	0	113.6	F132	F132-Q134 PolarHBondContact O-N 3.28Å
135	M	57.6	Low	57	Low	99 Å²	99	110.7 Å²	110.7	49%	0.488	56%	0.56	S	S	.	*	S	Bend	trans	-86.8	138.6	177.4	-80.2	-83.9	170.9	0	0	110.8	F132 K137 L139	F132-M135 PolarHBondContact O-N 2.95Å; M135-K137 PolarHBondContact O-N 2.75Å; M135-L139 HydrophobicContact SD-CD1 4.27Å
136	A	56.9	Low	57.5	Low	40 Å²	40	105.7 Å²	105.7	33%	0.331	54%	0.543	S	S	.	.			trans	-61.2	135.1	175.1	0	0	0	0	0	110.7	Y138 L139 S140	A136-Y138 HydrophobicContact CB-CD1 3.68Å; A136-Y138 HydrophobicContact CB-CE1 3.23Å; A136-Y138 PolarHBondContact O-N 2.83Å; A136-L139 PolarHBondContact O-N 3.17Å; A136-S140 PolarHBondContact O-N 3.1Å
137	K	61.6	Low	58.8	Low	180 Å²	180	103.1 Å²	103.1	78%	0.783	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-24.5	-173.3	-69.8	-179.4	179.5	175.1	0	115	M135 S140	M135-K137 PolarHBondContact O-N 2.75Å; K137-S140 WeakPolarHBondContact CA-OG 3.33Å; K137-S140 PolarHBondContact O-OG 2.97Å
138	Y	60.9	Low	60.3	Low	174 Å²	174	103 Å²	103	68%	0.682	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-32.4	179.1	63.5	-93.5	0	0	0	112.9	A136	A136-Y138 HydrophobicContact CB-CD1 3.68Å; A136-Y138 HydrophobicContact CB-CE1 3.23Å; A136-Y138 PolarHBondContact O-N 2.83Å
139	L	60.5	Low	62.2	Low	75 Å²	75	105.4 Å²	105.4	39%	0.393	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-36.4	175.4	-66.8	169.8	0	0	0	111.1	M135 A136 R141 M143	M135-L139 HydrophobicContact SD-CD1 4.27Å; A136-L139 PolarHBondContact O-N 3.17Å; L139-R141 PolarHBondContact O-N 3.45Å; L139-M143 HydrophobicContact CB-CE 4.07Å; L139-M143 WeakPolarHBondContact O-CE 3.44Å
140	S	60.6	Low	64.2	Low	35 Å²	35	95.1 Å²	95.1	25%	0.245	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.7	-177	63.6	0	0	0	0	113.9	A136 K137	A136-S140 PolarHBondContact O-N 3.1Å; K137-S140 WeakPolarHBondContact CA-OG 3.33Å; K137-S140 PolarHBondContact O-OG 2.97Å
141	R	60	Low	66.1	Low	222 Å²	222	91.9 Å²	91.9	84%	0.838	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-26.6	-176.7	-83.4	-179.6	171.4	157	-2.9	114.5	L139	L139-R141 PolarHBondContact O-N 3.45Å
142	K	59.5	Low	68.3	Low	202 Å²	202	90.9 Å²	90.9	88%	0.878	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-11	-179.6	-72	-171	177.1	-175.3	0	113.5
143	M	62.4	Low	70.2	Confident	96 Å²	96	90.6 Å²	90.6	47%	0.473	45%	0.454	S	S	.	.	S	Bend	trans	-97.4	130.9	179.5	-77.1	-173.2	-97.3	0	0	110	F132 L139 H145	F132-M143 HydrophobicContact CZ-CB 4.11Å; L139-M143 HydrophobicContact CB-CE 4.07Å; L139-M143 WeakPolarHBondContact O-CE 3.44Å; M143-H145 PolarHBondContact O-N 2.91Å
144	I	67.4	Low	72.2	Confident	110 Å²	110	86.9 Å²	86.9	56%	0.564	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-61.1	129.9	166.2	-61.8	173.4	0	0	0	106.8	P146 V148 E149	I144-P146 WeakPolarHBondContact O-CD 3.38Å; I144-V148 HydrophobicContact CG2-CB 3.89Å; I144-V148 HydrophobicContact CG2-CG1 4.09Å; I144-E149 HydrophobicContact CG2-CG 3.94Å
145	H	70.7	Confident	74.2	Confident	59 Å²	59	79 Å²	79	27%	0.273	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-66	129.9	179.2	-172.1	-85.5	0	0	0	108.6	F132 M143 S147 V148	F132-H145 WeakPolarHBondContact CB-NE2 3.31Å; F132-H145 AromaticContact CD1-CD2 3.56Å; F132-H145 AromaticContact CD2-CD2 3.56Å; F132-H145 AromaticContact CD2-NE2 3.76Å; F132-H145 AromaticContact CG-CD2 3.28Å; F132-H145 WeakPolarHBondContact CG-CD2 3.32Å; F132-H145 AromaticContact CG-NE2 3.52Å; M143-H145 PolarHBondContact O-N 2.91Å; H145-S147 PolarHBondContact CE1-OG 2.82Å; H145-S147 WeakPolarHBondContact ND1-CB 3.38Å; H145-S147 PolarHBondContact ND1-N 3.02Å; H145-S147 PolarHBondContact ND1-OG 2.84Å; H145-S147 PolarHBondContact O-N 3.38Å; H145-V148 HydrophobicContact CB-CG2 4.11Å; H145-V148 VanDerWaalsContact O-CB 3.27Å; H145-V148 WeakPolarHBondContact O-CB 3.48Å; H145-V148 PolarHBondContact O-N 2.76Å
146	P	74.3	Confident	75.9	Confident	44 Å²	44	76.6 Å²	76.6	29%	0.286	38%	0.384	S	S	.	.	H	α-helix	trans	-44.6	-36.6	179.6	-39.9	40.9	0	0	0	115.9	S76 F132 I144 V148 E149 A150	S76-P146 WeakPolarHBondContact CB-O 3.45Å; S76-P146 VanDerWaalsContact OG-CB 3.28Å; S76-P146 WeakPolarHBondContact OG-CB 3.17Å; F132-P146 HydrophobicContact CD2-CG 4.21Å; F132-P146 HydrophobicContact CE2-CG 3.8Å; I144-P146 WeakPolarHBondContact O-CD 3.38Å; P146-V148 PolarHBondContact O-N 2.97Å; P146-E149 PolarHBondContact O-N 2.58Å; P146-A150 PolarHBondContact O-N 3.15Å; P146-A150 VanDerWaalsContact O-N 3.1Å
147	S	79.2	Confident	77.8	Confident	28 Å²	28	75.2 Å²	75.2	20%	0.196	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-24.6	178.5	71.5	0	0	0	0	113.5	H145 A151	H145-S147 PolarHBondContact CE1-OG 2.82Å; H145-S147 WeakPolarHBondContact ND1-CB 3.38Å; H145-S147 PolarHBondContact ND1-N 3.02Å; H145-S147 PolarHBondContact ND1-OG 2.84Å; H145-S147 PolarHBondContact O-N 3.38Å; S147-A151 VanDerWaalsContact O-CB 3.24Å; S147-A151 WeakPolarHBondContact O-CB 3.44Å; S147-A151 PolarHBondContact O-N 3.31Å
148	V	84.9	Confident	79.5	Confident	83 Å²	83	66.7 Å²	66.7	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-73.2	-44.8	178.9	179.4	0	0	0	0	109.7	I144 H145 P146 A151 S152	I144-V148 HydrophobicContact CG2-CB 3.89Å; I144-V148 HydrophobicContact CG2-CG1 4.09Å; H145-V148 HydrophobicContact CB-CG2 4.11Å; H145-V148 VanDerWaalsContact O-CB 3.27Å; H145-V148 WeakPolarHBondContact O-CB 3.48Å; H145-V148 PolarHBondContact O-N 2.76Å; P146-V148 PolarHBondContact O-N 2.97Å; V148-A151 PolarHBondContact O-N 2.89Å; V148-S152 PolarHBondContact O-N 3.5Å
149	E	85.4	Confident	81.2	Confident	85 Å²	85	61.9 Å²	61.9	40%	0.397	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-46.8	174.1	-67.6	174.9	-179.1	0	0	110.7	S76 I144 P146 A151 S152 S153	S76-E149 WeakPolarHBondContact CB-OE2 3.43Å; I144-E149 HydrophobicContact CG2-CG 3.94Å; P146-E149 PolarHBondContact O-N 2.58Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 2.81Å; E149-S152 WeakPolarHBondContact O-CB 3.46Å; E149-S152 PolarHBondContact O-N 3.34Å; E149-S152 VanDerWaalsContact O-N 3.12Å; E149-S153 PolarHBondContact O-N 2.98Å; E149-S153 PolarHBondContact O-OG 2.99Å
150	A	89.2	Confident	82.9	Confident	1 Å²	1	62 Å²	62	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-40.3	176.5	0	0	0	0	0	113	F74 I121 P146 S153 L154	F74-A150 HydrophobicContact CB-CB 4.23Å; F74-A150 WeakPolarHBondContact O-CB 3.34Å; I121-A150 HydrophobicContact CG2-CB 3.84Å; P146-A150 PolarHBondContact O-N 3.15Å; P146-A150 VanDerWaalsContact O-N 3.1Å; A150-S153 PolarHBondContact O-N 2.89Å; A150-L154 WeakPolarHBondContact O-CB 3.41Å; A150-L154 PolarHBondContact O-N 3.49Å
151	A	91.5	Very high	84.6	Confident	10 Å²	10	60.3 Å²	60.3	8%	0.083	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-40.3	174.4	0	0	0	0	0	111.8	I121 S147 V148 E149 L154 D155 M190	I121-A151 HydrophobicContact CD1-CB 3.9Å; S147-A151 VanDerWaalsContact O-CB 3.24Å; S147-A151 WeakPolarHBondContact O-CB 3.44Å; S147-A151 PolarHBondContact O-N 3.31Å; V148-A151 PolarHBondContact O-N 2.89Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 2.81Å; A151-L154 PolarHBondContact O-N 3.42Å; A151-D155 WeakPolarHBondContact O-CB 3.36Å; A151-D155 PolarHBondContact O-N 2.88Å; A151-M190 HydrophobicContact CB-CE 4.32Å
152	S	91.9	Very high	86.3	Confident	74 Å²	74	49.8 Å²	49.8	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-41.5	176.8	-168.7	0	0	0	0	112.5	V148 E149 L154 D155 S156	V148-S152 PolarHBondContact O-N 3.5Å; E149-S152 WeakPolarHBondContact O-CB 3.46Å; E149-S152 PolarHBondContact O-N 3.34Å; E149-S152 VanDerWaalsContact O-N 3.12Å; S152-L154 VanDerWaalsContact C-N 3.34Å; S152-D155 PolarHBondContact O-N 2.83Å; S152-S156 PolarHBondContact O-N 3.24Å
153	S	92	Very high	88	Confident	38 Å²	38	44.2 Å²	44.2	27%	0.266	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-40.6	175.4	-64.1	0	0	0	0	111.4	E149 A150 S156 F157	E149-S153 PolarHBondContact O-N 2.98Å; E149-S153 PolarHBondContact O-OG 2.99Å; A150-S153 PolarHBondContact O-N 2.89Å; S153-S156 PolarHBondContact O-N 3.41Å; S153-F157 PolarHBondContact O-N 3.44Å; S153-F157 VanDerWaalsContact O-N 3.07Å
154	L	94.8	Very high	89.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.7	-42.9	173.6	177.4	61.8	0	0	0	111.6	F74 I121 A150 A151 S152 S156 F157 L158 F191	F74-L154 HydrophobicContact CB-CB 4.46Å; F74-L154 HydrophobicContact CD2-CB 3.88Å; F74-L154 HydrophobicContact CD2-CD1 3.7Å; F74-L154 HydrophobicContact CD2-CG 4.29Å; F74-L154 HydrophobicContact CE2-CB 4.2Å; F74-L154 HydrophobicContact CE2-CD1 3.5Å; F74-L154 VanDerWaalsContact CE2-CD1 3.5Å; F74-L154 HydrophobicContact CE2-CG 4.43Å; F74-L154 HydrophobicContact CG-CB 4.06Å; F74-L154 HydrophobicContact CZ-CD1 4.34Å; I121-L154 HydrophobicContact CD1-CD2 3.88Å; I121-L154 HydrophobicContact CG1-CD2 3.52Å; A150-L154 WeakPolarHBondContact O-CB 3.41Å; A150-L154 PolarHBondContact O-N 3.49Å; A151-L154 PolarHBondContact O-N 3.42Å; S152-L154 VanDerWaalsContact C-N 3.34Å; L154-S156 VanDerWaalsContact C-N 3.35Å; L154-S156 PolarHBondContact O-N 3.28Å; L154-F157 HydrophobicContact CD1-CD1 4.42Å; L154-F157 WeakPolarHBondContact O-CB 3.36Å; L154-F157 PolarHBondContact O-N 2.79Å; L154-L158 HydrophobicContact CD1-CD1 3.84Å; L154-L158 HydrophobicContact CD1-CD2 4.3Å; L154-L158 HydrophobicContact CD1-CG 3.82Å; L154-L158 HydrophobicContact CD2-CD1 4.28Å; L154-L158 HydrophobicContact CG-CD1 3.65Å; L154-L158 HydrophobicContact CG-CG 4.12Å; L154-L158 WeakPolarHBondContact O-CB 3.41Å; L154-L158 WeakPolarHBondContact O-CG 3.34Å; L154-L158 PolarHBondContact O-N 3.1Å; L154-F191 HydrophobicContact CD2-CE1 3.79Å; L154-F191 HydrophobicContact CD2-CZ 4.15Å; L154-F191 HydrophobicContact CG-CE1 4.01Å
155	D	96.3	Very high	90.8	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-45.2	176.8	-171.6	36.9	0	0	0	111.8	A151 S152 F157 L158 K159 F191 P192 E193 A194	A151-D155 WeakPolarHBondContact O-CB 3.36Å; A151-D155 PolarHBondContact O-N 2.88Å; S152-D155 PolarHBondContact O-N 2.83Å; D155-F157 VanDerWaalsContact C-N 3.33Å; D155-F157 PolarHBondContact O-N 3.42Å; D155-L158 PolarHBondContact O-N 3.41Å; D155-K159 VanDerWaalsContact O-CB 3.29Å; D155-K159 WeakPolarHBondContact O-CB 3.44Å; D155-K159 PolarHBondContact O-N 2.88Å; D155-F191 HydrophobicContact CB-CD1 4.08Å; D155-F191 VanDerWaalsContact CG-CA 3.46Å; D155-F191 VanDerWaalsContact OD1-C 3.32Å; D155-F191 WeakPolarHBondContact OD1-CA 3.46Å; D155-F191 WeakPolarHBondContact OD1-CB 3.4Å; D155-P192 WeakPolarHBondContact OD2-CD 3.44Å; D155-P192 WeakPolarHBondContact OD2-CG 3.18Å; D155-E193 PolarHBondContact OD1-N 3.03Å; D155-E193 WeakPolarHBondContact OD2-CB 3.32Å; D155-E193 WeakPolarHBondContact OD2-CG 3.46Å; D155-E193 PolarHBondContact OD2-N 2.65Å; D155-A194 VanDerWaalsContact OD1-CB 3.25Å; D155-A194 WeakPolarHBondContact OD1-CB 3.42Å; D155-A194 PolarHBondContact OD1-N 3.27Å
156	S	95.2	Very high	92.1	Very high	49 Å²	49	41.9 Å²	41.9	34%	0.343	23%	0.228	S	C	.	.	H	α-helix	trans	-62.4	-39.2	176.6	-169.7	0	0	0	0	112.7	S152 S153 L154 Q160	S152-S156 PolarHBondContact O-N 3.24Å; S153-S156 PolarHBondContact O-N 3.41Å; L154-S156 VanDerWaalsContact C-N 3.35Å; L154-S156 PolarHBondContact O-N 3.28Å; S156-Q160 WeakPolarHBondContact O-CG 3.42Å; S156-Q160 PolarHBondContact O-N 3.23Å; S156-Q160 PolarHBondContact O-NE2 3.37Å; S156-Q160 VanDerWaalsContact O-NE2 3.12Å
157	F	95.6	Very high	93.2	Very high	12 Å²	12	39.8 Å²	39.8	5%	0.053	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-47.4	174.8	175.6	-90.3	0	0	0	111.7	L72 F74 R88 L91 L92 S153 L154 D155 Q160 L161	L72-F157 HydrophobicContact CD1-CD1 4.44Å; L72-F157 HydrophobicContact CD1-CE1 3.8Å; L72-F157 HydrophobicContact CD1-CZ 4.32Å; F74-F157 HydrophobicContact CE1-CB 4.34Å; F74-F157 HydrophobicContact CE2-CB 4.45Å; F74-F157 HydrophobicContact CE2-CD1 4.36Å; F74-F157 HydrophobicContact CE2-CG 4.31Å; F74-F157 HydrophobicContact CZ-CB 3.66Å; F74-F157 HydrophobicContact CZ-CD1 4.21Å; F74-F157 HydrophobicContact CZ-CD2 4.02Å; F74-F157 AromaticContact CZ-CG 3.72Å; F74-F157 HydrophobicContact CZ-CG 3.72Å; R88-F157 HydrophobicContact CB-CE2 4.5Å; L91-F157 HydrophobicContact CD2-CZ 4.19Å; L92-F157 HydrophobicContact CB-CD2 4.32Å; L92-F157 HydrophobicContact CB-CE2 3.86Å; L92-F157 HydrophobicContact CD1-CD2 4.41Å; L92-F157 HydrophobicContact CD1-CE2 4.33Å; L92-F157 HydrophobicContact CD2-CD2 4.18Å; L92-F157 HydrophobicContact CG-CE2 4.48Å; S153-F157 PolarHBondContact O-N 3.44Å; S153-F157 VanDerWaalsContact O-N 3.07Å; L154-F157 HydrophobicContact CD1-CD1 4.42Å; L154-F157 WeakPolarHBondContact O-CB 3.36Å; L154-F157 PolarHBondContact O-N 2.79Å; D155-F157 VanDerWaalsContact C-N 3.33Å; D155-F157 PolarHBondContact O-N 3.42Å; F157-Q160 PolarHBondContact O-N 3.16Å; F157-L161 HydrophobicContact CD1-CD1 3.94Å; F157-L161 HydrophobicContact CE1-CD1 3.28Å; F157-L161 HydrophobicContact CE1-CG 4.23Å; F157-L161 HydrophobicContact CZ-CD1 3.67Å; F157-L161 HydrophobicContact CZ-CG 4.44Å; F157-L161 PolarHBondContact O-N 3.2Å; F157-L161 VanDerWaalsContact O-N 3.13Å
158	L	97.1	Very high	94.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-40.7	-179.8	-70.2	169.6	0	0	0	112.1	I116 L154 D155 Q160 L161 A162 V167 L169 F191 A194 F200	I116-L158 HydrophobicContact CD1-CD2 3.6Å; L154-L158 HydrophobicContact CD1-CD1 3.84Å; L154-L158 HydrophobicContact CD1-CD2 4.3Å; L154-L158 HydrophobicContact CD1-CG 3.82Å; L154-L158 HydrophobicContact CD2-CD1 4.28Å; L154-L158 HydrophobicContact CG-CD1 3.65Å; L154-L158 HydrophobicContact CG-CG 4.12Å; L154-L158 WeakPolarHBondContact O-CB 3.41Å; L154-L158 WeakPolarHBondContact O-CG 3.34Å; L154-L158 PolarHBondContact O-N 3.1Å; D155-L158 PolarHBondContact O-N 3.41Å; L158-Q160 VanDerWaalsContact C-N 3.29Å; L158-Q160 PolarHBondContact O-N 2.63Å; L158-L161 PolarHBondContact O-N 3.1Å; L158-A162 VanDerWaalsContact O-CB 3.23Å; L158-A162 WeakPolarHBondContact O-CB 3.45Å; L158-A162 PolarHBondContact O-N 3.03Å; L158-V167 HydrophobicContact CD2-CG1 4.06Å; L158-L169 HydrophobicContact CD1-CD2 3.84Å; L158-F191 HydrophobicContact CD1-CD1 3.84Å; L158-F191 HydrophobicContact CD1-CE1 3.71Å; L158-F191 HydrophobicContact CD1-CZ 4.38Å; L158-A194 HydrophobicContact CB-CB 3.79Å; L158-F200 HydrophobicContact CB-CE2 4.4Å; L158-F200 HydrophobicContact CD1-CE2 3.77Å; L158-F200 HydrophobicContact CD1-CZ 3.73Å; L158-F200 HydrophobicContact CD2-CE2 4.01Å; L158-F200 HydrophobicContact CG-CE2 4.29Å
159	K	97	Very high	94.8	Very high	74 Å²	74	34.6 Å²	34.6	32%	0.322	18%	0.181	S	C	.	.	H	α-helix	trans	-55.7	-46.9	173.7	178.7	-157.4	-175.6	173.4	0	110.9	D155 N163 E193 L197	D155-K159 VanDerWaalsContact O-CB 3.29Å; D155-K159 WeakPolarHBondContact O-CB 3.44Å; D155-K159 PolarHBondContact O-N 2.88Å; K159-N163 PolarHBondContact O-N 3.5Å; K159-N163 PolarHBondContact O-ND2 3.28Å; K159-E193 HydrophobicContact CB-CB 4.18Å; K159-E193 HydrophobicContact CD-CB 3.87Å; K159-E193 HydrophobicContact CD-CG 4.45Å; K159-E193 HydrophobicContact CG-CB 4.12Å; K159-E193 IonicContact NZ-OE1 3.7Å; K159-E193 PolarHBondContact NZ-OE1 3.19Å; K159-L197 HydrophobicContact CG-CD1 4.15Å; K159-L197 WeakPolarHBondContact O-CD1 3.19Å
160	Q	96.2	Very high	95.4	Very high	76 Å²	76	30.5 Å²	30.5	36%	0.355	16%	0.162	S	C	.	.	H	α-helix	trans	-62.5	-43.6	179.5	-73.9	174.4	79.8	0	0	111.4	L92 S156 F157 L158 Y164	L92-Q160 HydrophobicContact CD1-CB 3.98Å; L92-Q160 HydrophobicContact CD2-CB 4.37Å; S156-Q160 WeakPolarHBondContact O-CG 3.42Å; S156-Q160 PolarHBondContact O-N 3.23Å; S156-Q160 PolarHBondContact O-NE2 3.37Å; S156-Q160 VanDerWaalsContact O-NE2 3.12Å; F157-Q160 PolarHBondContact O-N 3.16Å; L158-Q160 VanDerWaalsContact C-N 3.29Å; L158-Q160 PolarHBondContact O-N 2.63Å; Q160-Y164 WeakPolarHBondContact O-CD2 3.48Å; Q160-Y164 WeakPolarHBondContact O-CE2 3.44Å
161	L	95.7	Very high	95.7	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-67.1	-47.9	176.8	-70.1	-179.2	0	0	0	113.4	L92 L95 F157 L158 N163 Y164 V165 V167	L92-L161 HydrophobicContact CD1-CD2 3.47Å; L92-L161 VanDerWaalsContact CD1-CD2 3.47Å; L92-L161 HydrophobicContact CD1-CG 3.77Å; L95-L161 HydrophobicContact CB-CD2 3.75Å; L95-L161 HydrophobicContact CD1-CD1 4.23Å; L95-L161 HydrophobicContact CD1-CD2 3.5Å; L95-L161 VanDerWaalsContact CD1-CD2 3.5Å; L95-L161 HydrophobicContact CG-CD2 4.24Å; F157-L161 HydrophobicContact CD1-CD1 3.94Å; F157-L161 HydrophobicContact CE1-CD1 3.28Å; F157-L161 HydrophobicContact CE1-CG 4.23Å; F157-L161 HydrophobicContact CZ-CD1 3.67Å; F157-L161 HydrophobicContact CZ-CG 4.44Å; F157-L161 PolarHBondContact O-N 3.2Å; F157-L161 VanDerWaalsContact O-N 3.13Å; L158-L161 PolarHBondContact O-N 3.1Å; L161-N163 PolarHBondContact O-N 2.96Å; L161-N163 VanDerWaalsContact O-N 3.14Å; L161-Y164 PolarHBondContact O-N 3.32Å; L161-V165 PolarHBondContact O-N 3.26Å; L161-V167 HydrophobicContact CB-CG2 3.84Å
162	A	96.6	Very high	95.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-18.5	-174.8	0	0	0	0	0	113.2	L158 Y164 V165 V167 L197 N199 F200	L158-A162 VanDerWaalsContact O-CB 3.23Å; L158-A162 WeakPolarHBondContact O-CB 3.45Å; L158-A162 PolarHBondContact O-N 3.03Å; A162-Y164 PolarHBondContact O-N 2.82Å; A162-V165 WeakPolarHBondContact CA-O 3.28Å; A162-V167 HydrophobicContact CB-CG2 4.47Å; A162-L197 HydrophobicContact CB-CB 4.24Å; A162-L197 HydrophobicContact CB-CD1 3.72Å; A162-N199 HydrophobicContact CB-CB 4.35Å; A162-N199 WeakPolarHBondContact O-CB 3.47Å; A162-N199 PolarHBondContact O-ND2 3.38Å; A162-F200 HydrophobicContact CB-CB 3.93Å
163	N	95.5	Very high	95.9	Very high	85 Å²	85	30.1 Å²	30.1	46%	0.455	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.6	170.6	-78.6	-40.8	0	0	0	113.5	K159 L161 L197	K159-N163 PolarHBondContact O-N 3.5Å; K159-N163 PolarHBondContact O-ND2 3.28Å; L161-N163 PolarHBondContact O-N 2.96Å; L161-N163 VanDerWaalsContact O-N 3.14Å; N163-L197 WeakPolarHBondContact OD1-CD2 3.46Å
164	Y	93.2	Very high	95.8	Very high	164 Å²	164	28.4 Å²	28.4	64%	0.643	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-36.2	-173	-58.2	-90.4	0	0	0	113.1	L96 Q160 L161 A162	L96-Y164 HydrophobicContact CD2-CD2 3.26Å; L96-Y164 HydrophobicContact CD2-CE2 3.19Å; L96-Y164 HydrophobicContact CD2-CG 4.02Å; Q160-Y164 WeakPolarHBondContact O-CD2 3.48Å; Q160-Y164 WeakPolarHBondContact O-CE2 3.44Å; L161-Y164 PolarHBondContact O-N 3.32Å; A162-Y164 PolarHBondContact O-N 2.82Å
165	V	95.1	Very high	95.7	Very high	15 Å²	15	28.4 Å²	28.4	9%	0.091	14%	0.138	C	C	.	.	S	Bend	trans	-136.9	143.8	-174.7	65.4	0	0	0	0	111	I111 V114 L161 A162 V167	I111-V165 HydrophobicContact CG2-CG2 4.25Å; I111-V165 WeakPolarHBondContact O-CG2 3.2Å; V114-V165 HydrophobicContact CG2-CG1 3.66Å; V114-V165 HydrophobicContact CG2-CG2 4.06Å; L161-V165 PolarHBondContact O-N 3.26Å; A162-V165 WeakPolarHBondContact CA-O 3.28Å; V165-V167 HydrophobicContact CG1-CG2 4.23Å; V165-V167 WeakPolarHBondContact O-CG2 3.5Å; V165-V167 PolarHBondContact O-N 3.24Å
166	P	97.2	Very high	95.4	Very high	38 Å²	38	30.9 Å²	30.9	25%	0.247	16%	0.155	C	C	.	.			trans	-57.6	128.4	168.4	-26.6	36.2	0	0	0	112.2	V112 R113 V114 N199	V112-P166 WeakPolarHBondContact O-CD 3.39Å; R113-P166 WeakPolarHBondContact CA-O 3.32Å; V114-P166 PolarHBondContact N-O 2.74Å; P166-N199 CarbonylContact C-O 3.57Å; P166-N199 VanDerWaalsContact CA-O 3.32Å; P166-N199 WeakPolarHBondContact CA-O 3.45Å
167	V	98.1	Very high	95.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.7	-178.9	-175.8	0	0	0	0	110.1	V114 I116 L158 L161 A162 V165 N199 F200 N201	V114-V167 HydrophobicContact CB-CG2 4.4Å; V114-V167 CarbonylContact O-C 3.45Å; V114-V167 WeakPolarHBondContact O-CA 3.39Å; I116-V167 HydrophobicContact CD1-CG1 3.78Å; I116-V167 HydrophobicContact CG1-CG1 4.04Å; L158-V167 HydrophobicContact CD2-CG1 4.06Å; L161-V167 HydrophobicContact CB-CG2 3.84Å; A162-V167 HydrophobicContact CB-CG2 4.47Å; V165-V167 HydrophobicContact CG1-CG2 4.23Å; V165-V167 WeakPolarHBondContact O-CG2 3.5Å; V165-V167 PolarHBondContact O-N 3.24Å; V167-N199 PolarHBondContact N-O 3.09Å; V167-F200 HydrophobicContact CB-CD2 4.33Å; V167-F200 HydrophobicContact CG1-CD2 4.46Å; V167-N201 PolarHBondContact O-N 2.99Å
168	D	98.3	Very high	94.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.2	171.7	-62.3	-20.7	0	0	0	109.6	R113 V114 I115 I116 N201 V203 Y207	R113-D168 VanDerWaalsContact CD-OD2 3.28Å; R113-D168 WeakPolarHBondContact CD-OD2 3.37Å; R113-D168 IonicContact CZ-OD2 3.53Å; R113-D168 IonicContact NE-OD2 3.86Å; R113-D168 IonicContact NH1-OD1 2.86Å; R113-D168 IonicContact NH1-OD2 2.83Å; R113-D168 PolarHBondContact NH1-OD2 3.39Å; V114-D168 PolarHBondContact O-N 3.44Å; I115-D168 WeakPolarHBondContact CA-O 3.47Å; I115-D168 HydrophobicContact CG1-CB 4.38Å; I116-D168 PolarHBondContact N-O 2.85Å; D168-N201 WeakPolarHBondContact CA-O 3.38Å; D168-N201 VanDerWaalsContact OD1-CB 3.31Å; D168-N201 WeakPolarHBondContact OD1-CB 3.4Å; D168-N201 PolarHBondContact OD1-ND2 2.81Å; D168-V203 HydrophobicContact CB-CG1 4.31Å; D168-V203 HydrophobicContact CB-CG2 4.35Å; D168-Y207 HydrophobicContact CB-CE1 4.22Å; D168-Y207 PolarHBondContact OD2-OH 3.16Å
169	L	98.2	Very high	94.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.1	-179.5	179.6	66.1	0	0	0	111.1	I116 S120 L158 L186 F191 F200 N201 V203	I116-L169 HydrophobicContact CB-CD1 3.75Å; I116-L169 HydrophobicContact CD1-CD1 4.49Å; I116-L169 HydrophobicContact CG2-CD1 3.7Å; S120-L169 VanDerWaalsContact OG-CD1 3.3Å; S120-L169 WeakPolarHBondContact OG-CD1 3.15Å; L158-L169 HydrophobicContact CD1-CD2 3.84Å; L169-L186 HydrophobicContact CD2-CD1 3.8Å; L169-L186 HydrophobicContact CG-CD1 4.18Å; L169-F191 HydrophobicContact CD2-CE1 4.26Å; L169-F191 HydrophobicContact CD2-CE2 3.92Å; L169-F191 HydrophobicContact CD2-CZ 3.59Å; L169-F200 HydrophobicContact CB-CE2 3.8Å; L169-F200 HydrophobicContact CB-CZ 4.21Å; L169-F200 HydrophobicContact CD2-CE2 4.08Å; L169-F200 HydrophobicContact CD2-CZ 3.81Å; L169-N201 PolarHBondContact N-O 3.03Å; L169-V203 WeakPolarHBondContact O-CG2 3.03Å; L169-V203 PolarHBondContact O-N 3.05Å
170	M	98.1	Very high	94.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	145.3	172.1	-58.1	169.6	60.2	0	0	110.6	I115 I116 A117 G118 V203 N205 Y207 F278	I115-M170 HydrophobicContact CG2-SD 4.02Å; I116-M170 WeakPolarHBondContact O-CB 3.28Å; I116-M170 PolarHBondContact O-N 2.83Å; A117-M170 HydrophobicContact CB-SD 3.82Å; G118-M170 WeakPolarHBondContact CA-O 3.48Å; G118-M170 PolarHBondContact N-O 3.02Å; M170-V203 HydrophobicContact CB-CG2 4.28Å; M170-V203 HydrophobicContact CG-CG2 3.51Å; M170-N205 HydrophobicContact CE-CB 4.37Å; M170-Y207 HydrophobicContact CG-CD1 4.24Å; M170-Y207 HydrophobicContact CG-CG 4.26Å; M170-Y207 HydrophobicContact SD-CD1 3.98Å; M170-Y207 HydrophobicContact SD-CG 4.21Å; M170-F278 HydrophobicContact CE-CE2 4.29Å; M170-F278 HydrophobicContact CE-CZ 4.43Å; M170-F278 HydrophobicContact SD-CE2 3.85Å; M170-F278 HydrophobicContact SD-CZ 3.76Å
171	P	96.8	Very high	94.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.			trans	-78.9	146.1	169.1	32.4	-36.2	0	0	0	112	T177 Q183 Q184 L186 V203 N205 S220	P171-T177 HydrophobicContact CB-CG2 3.58Å; P171-T177 HydrophobicContact CG-CG2 4.45Å; P171-Q183 HydrophobicContact CB-CB 4.34Å; P171-Q183 HydrophobicContact CG-CB 3.74Å; P171-Q183 PolarHBondContact O-OE1 2.93Å; P171-Q184 WeakPolarHBondContact CG-O 3.46Å; P171-L186 HydrophobicContact CB-CD2 4.16Å; P171-L186 HydrophobicContact CB-CG 4.17Å; P171-V203 WeakPolarHBondContact CD-O 3.37Å; P171-N205 HydrophobicContact CG-CB 3.95Å; P171-N205 WeakPolarHBondContact O-CB 3.49Å; P171-S220 PolarHBondContact O-OG 3.16Å
172	G	94.6	Very high	94.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.			trans	-117.9	-162.8	170.8	0	0	0	0	0	114.1	D175 Q183	G172-D175 PolarHBondContact N-OD2 2.92Å; G172-Q183 PolarHBondContact O-NE2 3Å
173	E	91.6	Very high	94.1	Very high	77 Å²	77	35.6 Å²	35.6	36%	0.36	18%	0.179	S	C	.	.	S	Bend	trans	-70.5	-40.9	-177.2	-173.1	-176.1	173	0	0	112.2	N119 D175 Q222	N119-E173 PolarHBondContact OD1-N 3.32Å; E173-D175 VanDerWaalsContact C-N 3.29Å; E173-D175 PolarHBondContact O-N 2.85Å; E173-Q222 HydrophobicContact CB-CG 4.19Å
174	T	90.6	Very high	94.1	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	18%	0.182	C	C	.	.	S	Bend	trans	-81	-12.6	-175.9	65.2	0	0	0	0	113.3	N119 I121 M122 A123 K124 P126	N119-T174 WeakPolarHBondContact CA-OG1 3.31Å; N119-T174 PolarHBondContact OD1-N 3.2Å; N119-T174 PolarHBondContact OD1-OG1 2.76Å; I121-T174 CarbonylContact O-C 3.59Å; I121-T174 VanDerWaalsContact O-C 3.29Å; I121-T174 WeakPolarHBondContact O-CB 3.42Å; I121-T174 VanDerWaalsContact O-O 3.07Å; I121-T174 PolarHBondContact O-OG1 3Å; M122-T174 HydrophobicContact CE-CG2 4.24Å; M122-T174 HydrophobicContact SD-CG2 4.04Å; A123-T174 WeakPolarHBondContact CB-O 3.47Å; A123-T174 PolarHBondContact N-O 3.47Å; K124-T174 PolarHBondContact N-O 3.06Å; P126-T174 HydrophobicContact CG-CG2 4.07Å
175	D	92.1	Very high	94.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	-76.5	154.8	-175.1	-67.8	-48.5	0	0	0	112.3	N119 S120 I121 K124 G172 E173 T177 L186	N119-D175 WeakPolarHBondContact CA-OD2 3.28Å; N119-D175 PolarHBondContact N-OD2 3.04Å; S120-D175 PolarHBondContact N-OD1 2.82Å; S120-D175 VanDerWaalsContact N-OD1 3.11Å; S120-D175 PolarHBondContact N-OD2 2.91Å; I121-D175 PolarHBondContact N-OD1 2.88Å; K124-D175 PolarHBondContact NZ-O 2.9Å; K124-D175 VanDerWaalsContact NZ-O 3.1Å; G172-D175 PolarHBondContact N-OD2 2.92Å; E173-D175 VanDerWaalsContact C-N 3.29Å; E173-D175 PolarHBondContact O-N 2.85Å; D175-T177 PolarHBondContact O-N 2.81Å; D175-L186 HydrophobicContact CB-CD2 4.01Å
176	P	90.2	Very high	94.3	Very high	55 Å²	55	29.9 Å²	29.9	36%	0.357	16%	0.16	S	C	.	.	S	Bend	trans	-79.9	60.7	-179.4	35.1	-37.8	0	0	0	112.1	I121 A123 M190	I121-P176 HydrophobicContact CD1-CG 4.42Å; A123-P176 HydrophobicContact CB-CB 4.36Å; P176-M190 HydrophobicContact CG-CE 3.29Å; P176-M190 HydrophobicContact CG-SD 3.67Å
177	T	90.4	Very high	94.2	Very high	24 Å²	24	33.6 Å²	33.6	15%	0.147	18%	0.175	C	C	.	.	S	Bend	trans	-123.3	-174.1	172.7	-169.2	0	0	0	0	111.3	K124 P171 D175 Q183 Q184	K124-T177 PolarHBondContact NZ-O 2.83Å; P171-T177 HydrophobicContact CB-CG2 3.58Å; P171-T177 HydrophobicContact CG-CG2 4.45Å; D175-T177 PolarHBondContact O-N 2.81Å; T177-Q183 HydrophobicContact CG2-CB 4.19Å; T177-Q183 HydrophobicContact CG2-CG 4.45Å; T177-Q183 VanDerWaalsContact CG2-NE2 3.35Å; T177-Q184 PolarHBondContact OG1-O 2.75Å
178	N	91.2	Very high	94.1	Very high	59 Å²	59	36 Å²	36	32%	0.316	19%	0.191	S	C	.	.			trans	-62.6	144.8	170.6	61.2	-65	0	0	0	111.5	L180 P182 Q183 Q184	N178-L180 PolarHBondContact ND2-O 2.86Å; N178-P182 PolarHBondContact ND2-O 3.12Å; N178-Q183 WeakPolarHBondContact O-CG 3.06Å; N178-Q183 PolarHBondContact O-NE2 2.84Å; N178-Q184 PolarHBondContact OD1-N 3.25Å
179	H	87.7	Confident	93.8	Very high	123 Å²	123	40.4 Å²	40.4	57%	0.569	22%	0.221	S	C	*	.	S	Bend	trans	-83.1	-31.8	178.7	-77.5	92.7	0	0	0	113	K124	K124-H179 WeakPolarHBondContact CD-NE2 3.48Å; K124-H179 WeakPolarHBondContact CE-CE1 3.47Å; K124-H179 PolarHBondContact NZ-CE1 3.28Å; K124-H179 PolarHBondContact NZ-NE2 3.01Å
180	L	93.2	Very high	93.6	Very high	81 Å²	81	41.8 Å²	41.8	42%	0.424	23%	0.228	S	C	.	.	S	Bend	trans	-69.4	142.2	179.6	-59.1	176.9	0	0	0	110.1	N178 P182 G258	N178-L180 PolarHBondContact ND2-O 2.86Å; L180-P182 CarbonylContact O-C 3.59Å; L180-G258 WeakPolarHBondContact CA-O 3.36Å
181	L	93.6	Very high	93.4	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-79.4	144.4	167.5	-74.3	167.8	0	0	0	110.5	Q183 T223 M253 L257 G258 C259 Y260 F268	L181-Q183 HydrophobicContact CD2-CG 4.09Å; L181-T223 HydrophobicContact CD1-CG2 3.76Å; L181-M253 HydrophobicContact CB-SD 3.99Å; L181-M253 HydrophobicContact CD1-SD 3.6Å; L181-M253 HydrophobicContact CG-SD 4.43Å; L181-L257 HydrophobicContact CD1-CD2 3.54Å; L181-L257 HydrophobicContact CD1-CG 4.17Å; L181-G258 PolarHBondContact N-O 3.18Å; L181-C259 CarbonylContact O-C 3.58Å; L181-C259 WeakPolarHBondContact O-CA 3.12Å; L181-C259 WeakPolarHBondContact O-CB 3.27Å; L181-Y260 PolarHBondContact O-N 3.13Å; L181-F268 HydrophobicContact CB-CE1 3.92Å; L181-F268 HydrophobicContact CB-CZ 3.63Å
182	P	95.1	Very high	93.4	Very high	17 Å²	17	45.2 Å²	45.2	11%	0.11	25%	0.25	C	C	.	.	S	Bend	cis	-72.4	140.9	-7.3	30.5	-35	0	0	0	111.9	N178 L180 N205 Y262	N178-P182 PolarHBondContact ND2-O 3.12Å; L180-P182 CarbonylContact O-C 3.59Å; P182-N205 CarbonylContact C-O 3.52Å; P182-N205 WeakPolarHBondContact CA-O 3.32Å; P182-Y262 WeakPolarHBondContact CD-OH 3.41Å; P182-Y262 HydrophobicContact CG-CE2 4.31Å; P182-Y262 WeakPolarHBondContact CG-OH 3.37Å
183	Q	95.8	Very high	93.5	Very high	3 Å²	3	48.3 Å²	48.3	1%	0.014	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-79.4	129.5	173.6	-56.6	-176.4	-76.5	0	0	110.2	P171 G172 T177 N178 L181 T204 N205	P171-Q183 HydrophobicContact CB-CB 4.34Å; P171-Q183 HydrophobicContact CG-CB 3.74Å; P171-Q183 PolarHBondContact O-OE1 2.93Å; G172-Q183 PolarHBondContact O-NE2 3Å; T177-Q183 HydrophobicContact CG2-CB 4.19Å; T177-Q183 HydrophobicContact CG2-CG 4.45Å; T177-Q183 VanDerWaalsContact CG2-NE2 3.35Å; N178-Q183 WeakPolarHBondContact O-CG 3.06Å; N178-Q183 PolarHBondContact O-NE2 2.84Å; L181-Q183 HydrophobicContact CD2-CG 4.09Å; Q183-T204 WeakPolarHBondContact O-CA 3.3Å; Q183-T204 WeakPolarHBondContact O-CB 3.36Å; Q183-N205 HydrophobicContact CB-CB 4.15Å; Q183-N205 PolarHBondContact N-O 3.34Å; Q183-N205 PolarHBondContact O-N 2.73Å; Q183-N205 PolarHBondContact OE1-ND2 3.17Å
184	Q	95.7	Very high	93.7	Very high	110 Å²	110	44.7 Å²	44.7	51%	0.514	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-73.8	152.2	175.8	-62.5	-58.6	-55.6	0	0	110.4	P171 T177 N178	P171-Q184 WeakPolarHBondContact CG-O 3.46Å; T177-Q184 PolarHBondContact OG1-O 2.75Å; N178-Q184 PolarHBondContact OD1-N 3.25Å
185	A	96.9	Very high	93.9	Very high	33 Å²	33	46.8 Å²	46.8	27%	0.273	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-53.9	144.7	176.8	0	0	0	0	0	111.8	R202 V203	A185-R202 HydrophobicContact CB-CB 4Å; A185-V203 VanDerWaalsContact CA-O 3.28Å; A185-V203 WeakPolarHBondContact CA-O 3.48Å; A185-V203 WeakPolarHBondContact CB-O 3.49Å
186	L	95.2	Very high	94.1	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-59.2	143.5	178.5	-66.2	172.8	0	0	0	110.9	L169 P171 D175 M190 F191 R202	L169-L186 HydrophobicContact CD2-CD1 3.8Å; L169-L186 HydrophobicContact CG-CD1 4.18Å; P171-L186 HydrophobicContact CB-CD2 4.16Å; P171-L186 HydrophobicContact CB-CG 4.17Å; D175-L186 HydrophobicContact CB-CD2 4.01Å; L186-M190 HydrophobicContact CB-SD 4.42Å; L186-M190 HydrophobicContact CD2-CE 4.49Å; L186-M190 HydrophobicContact CD2-SD 4.46Å; L186-F191 HydrophobicContact CB-CE2 3.74Å; L186-F191 HydrophobicContact CB-CZ 4.32Å; L186-F191 HydrophobicContact CD1-CE2 4.19Å; L186-F191 HydrophobicContact CD1-CZ 3.96Å; L186-R202 WeakPolarHBondContact O-CD 3.5Å; L186-R202 PolarHBondContact O-NH1 3.4Å
187	H	95.4	Very high	94.4	Very high	117 Å²	117	55.5 Å²	55.5	54%	0.542	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-72.1	141.4	-173.4	-167.2	-91.5	0	0	0	111.7	C189 M190	H187-C189 WeakPolarHBondContact ND1-CB 3.38Å; H187-C189 PolarHBondContact ND1-N 2.87Å; H187-C189 VanDerWaalsContact ND1-N 3.2Å; H187-C189 PolarHBondContact ND1-SG 3.09Å; H187-C189 PolarHBondContact O-N 3.19Å; H187-M190 WeakPolarHBondContact O-CB 3.29Å; H187-M190 PolarHBondContact O-N 3.43Å; H187-M190 VanDerWaalsContact O-N 3.15Å
188	S	94.7	Very high	94.7	Very high	49 Å²	49	59.8 Å²	59.8	34%	0.343	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-64.4	-24.9	-174.3	48.9	0	0	0	0	113.2	M190 F191	S188-M190 PolarHBondContact O-N 2.99Å; S188-M190 VanDerWaalsContact O-N 3.1Å; S188-F191 CarbonylContact O-C 3.53Å; S188-F191 PolarHBondContact O-N 2.78Å
189	C	93.7	Very high	94.9	Very high	94 Å²	94	59.7 Å²	59.7	64%	0.635	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-60.6	-19.7	177.1	74.2	0	0	0	0	113.6	H187 F191	H187-C189 WeakPolarHBondContact ND1-CB 3.38Å; H187-C189 PolarHBondContact ND1-N 2.87Å; H187-C189 VanDerWaalsContact ND1-N 3.2Å; H187-C189 PolarHBondContact ND1-SG 3.09Å; H187-C189 PolarHBondContact O-N 3.19Å; C189-F191 VanDerWaalsContact C-N 3.3Å
190	M	92.4	Very high	95.4	Very high	29 Å²	29	54.4 Å²	54.4	14%	0.143	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-77.8	-18.9	176.3	-62.6	172.1	54.5	0	0	112.7	I121 A151 P176 L186 H187 S188 P192	I121-M190 HydrophobicContact CD1-CE 3.24Å; A151-M190 HydrophobicContact CB-CE 4.32Å; P176-M190 HydrophobicContact CG-CE 3.29Å; P176-M190 HydrophobicContact CG-SD 3.67Å; L186-M190 HydrophobicContact CB-SD 4.42Å; L186-M190 HydrophobicContact CD2-CE 4.49Å; L186-M190 HydrophobicContact CD2-SD 4.46Å; H187-M190 WeakPolarHBondContact O-CB 3.29Å; H187-M190 PolarHBondContact O-N 3.43Å; H187-M190 VanDerWaalsContact O-N 3.15Å; S188-M190 PolarHBondContact O-N 2.99Å; S188-M190 VanDerWaalsContact O-N 3.1Å; M190-P192 VanDerWaalsContact C-CD 3.41Å; M190-P192 WeakPolarHBondContact O-CD 3.34Å
191	F	95.4	Very high	95.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.289	C	S	.	.			trans	-128.6	59.8	-170.4	-51	-63.4	0	0	0	112.1	L154 D155 L158 L169 L186 S188 C189 E193 A194 C195 F200	L154-F191 HydrophobicContact CD2-CE1 3.79Å; L154-F191 HydrophobicContact CD2-CZ 4.15Å; L154-F191 HydrophobicContact CG-CE1 4.01Å; D155-F191 HydrophobicContact CB-CD1 4.08Å; D155-F191 VanDerWaalsContact CG-CA 3.46Å; D155-F191 VanDerWaalsContact OD1-C 3.32Å; D155-F191 WeakPolarHBondContact OD1-CA 3.46Å; D155-F191 WeakPolarHBondContact OD1-CB 3.4Å; L158-F191 HydrophobicContact CD1-CD1 3.84Å; L158-F191 HydrophobicContact CD1-CE1 3.71Å; L158-F191 HydrophobicContact CD1-CZ 4.38Å; L169-F191 HydrophobicContact CD2-CE1 4.26Å; L169-F191 HydrophobicContact CD2-CE2 3.92Å; L169-F191 HydrophobicContact CD2-CZ 3.59Å; L186-F191 HydrophobicContact CB-CE2 3.74Å; L186-F191 HydrophobicContact CB-CZ 4.32Å; L186-F191 HydrophobicContact CD1-CE2 4.19Å; L186-F191 HydrophobicContact CD1-CZ 3.96Å; S188-F191 CarbonylContact O-C 3.53Å; S188-F191 PolarHBondContact O-N 2.78Å; C189-F191 VanDerWaalsContact C-N 3.3Å; F191-E193 PolarHBondContact O-N 2.95Å; F191-A194 HydrophobicContact CB-CB 4.34Å; F191-C195 VanDerWaalsContact O-CB 3.23Å; F191-C195 WeakPolarHBondContact O-CB 3.44Å; F191-C195 PolarHBondContact O-N 3.42Å; F191-C195 VanDerWaalsContact O-N 3.08Å; F191-F200 HydrophobicContact CB-CE1 3.98Å; F191-F200 AromaticContact CD2-CE1 3.98Å; F191-F200 HydrophobicContact CD2-CE1 3.98Å; F191-F200 HydrophobicContact CD2-CZ 4.09Å; F191-F200 HydrophobicContact CE2-CZ 4.4Å; F191-F200 AromaticContact CG-CE1 3.99Å; F191-F200 HydrophobicContact CG-CE1 3.99Å; F191-F200 HydrophobicContact CG-CZ 4.19Å
192	P	95.9	Very high	95.8	Very high	72 Å²	72	57.9 Å²	57.9	47%	0.468	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.3	-177.3	25.1	-35.6	0	0	0	113.9	D155 M190 R196	D155-P192 WeakPolarHBondContact OD2-CD 3.44Å; D155-P192 WeakPolarHBondContact OD2-CG 3.18Å; M190-P192 VanDerWaalsContact C-CD 3.41Å; M190-P192 WeakPolarHBondContact O-CD 3.34Å; P192-R196 WeakPolarHBondContact O-CD 3.45Å; P192-R196 WeakPolarHBondContact O-CG 3.19Å; P192-R196 PolarHBondContact O-NE 3.32Å; P192-R196 VanDerWaalsContact O-NE 3.13Å
193	E	96.4	Very high	95.9	Very high	66 Å²	66	58 Å²	58	31%	0.308	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-53.1	177.5	-57	-164.4	96.6	0	0	112.2	D155 K159 F191 C195 R196	D155-E193 PolarHBondContact OD1-N 3.03Å; D155-E193 WeakPolarHBondContact OD2-CB 3.32Å; D155-E193 WeakPolarHBondContact OD2-CG 3.46Å; D155-E193 PolarHBondContact OD2-N 2.65Å; K159-E193 HydrophobicContact CB-CB 4.18Å; K159-E193 HydrophobicContact CD-CB 3.87Å; K159-E193 HydrophobicContact CD-CG 4.45Å; K159-E193 HydrophobicContact CG-CB 4.12Å; K159-E193 IonicContact NZ-OE1 3.7Å; K159-E193 PolarHBondContact NZ-OE1 3.19Å; F191-E193 PolarHBondContact O-N 2.95Å; E193-C195 PolarHBondContact O-N 2.92Å; E193-R196 WeakPolarHBondContact O-CB 3.22Å; E193-R196 PolarHBondContact O-N 2.86Å
194	A	96.5	Very high	96	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-67.1	-36.5	-174.2	0	0	0	0	0	112.5	D155 L158 F191 R196 L197 F200	D155-A194 VanDerWaalsContact OD1-CB 3.25Å; D155-A194 WeakPolarHBondContact OD1-CB 3.42Å; D155-A194 PolarHBondContact OD1-N 3.27Å; L158-A194 HydrophobicContact CB-CB 3.79Å; F191-A194 HydrophobicContact CB-CB 4.34Å; A194-R196 PolarHBondContact O-N 3.44Å; A194-R196 VanDerWaalsContact O-N 3.08Å; A194-L197 WeakPolarHBondContact O-CB 3.4Å; A194-L197 PolarHBondContact O-N 2.83Å; A194-F200 HydrophobicContact CB-CB 4.48Å; A194-F200 HydrophobicContact CB-CD1 3.64Å; A194-F200 HydrophobicContact CB-CE1 3.92Å; A194-F200 HydrophobicContact CB-CG 3.97Å; A194-F200 HydrophobicContact CB-CZ 4.5Å; A194-F200 WeakPolarHBondContact O-CB 3.32Å
195	C	95.5	Very high	96	Very high	46 Å²	46	55.2 Å²	55.2	31%	0.311	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-65.3	-11	177.4	-77.6	0	0	0	0	114.5	F191 E193 L197	F191-C195 VanDerWaalsContact O-CB 3.23Å; F191-C195 WeakPolarHBondContact O-CB 3.44Å; F191-C195 PolarHBondContact O-N 3.42Å; F191-C195 VanDerWaalsContact O-N 3.08Å; E193-C195 PolarHBondContact O-N 2.92Å; C195-L197 VanDerWaalsContact C-N 3.29Å
196	R	95.5	Very high	96	Very high	200 Å²	200	54.7 Å²	54.7	76%	0.755	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-79.3	-17.1	173.1	-63.4	177.4	179.8	157.7	2.7	112.4	P192 E193 A194	P192-R196 WeakPolarHBondContact O-CD 3.45Å; P192-R196 WeakPolarHBondContact O-CG 3.19Å; P192-R196 PolarHBondContact O-NE 3.32Å; P192-R196 VanDerWaalsContact O-NE 3.13Å; E193-R196 WeakPolarHBondContact O-CB 3.22Å; E193-R196 PolarHBondContact O-N 2.86Å; A194-R196 PolarHBondContact O-N 3.44Å; A194-R196 VanDerWaalsContact O-N 3.08Å
197	L	96.9	Very high	96.1	Very high	38 Å²	38	55.6 Å²	55.6	20%	0.199	29%	0.293	C	S	.	.	S	Bend	trans	-90.6	134.4	-177.8	-60.3	172.6	0	0	0	110	K159 A162 N163 A194 C195 N199 F200	K159-L197 HydrophobicContact CG-CD1 4.15Å; K159-L197 WeakPolarHBondContact O-CD1 3.19Å; A162-L197 HydrophobicContact CB-CB 4.24Å; A162-L197 HydrophobicContact CB-CD1 3.72Å; N163-L197 WeakPolarHBondContact OD1-CD2 3.46Å; A194-L197 WeakPolarHBondContact O-CB 3.4Å; A194-L197 PolarHBondContact O-N 2.83Å; C195-L197 VanDerWaalsContact C-N 3.29Å; L197-N199 PolarHBondContact O-N 3.42Å; L197-F200 PolarHBondContact O-N 3.15Å
198	P	95.6	Very high	96.2	Very high	114 Å²	114	54 Å²	54	74%	0.74	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.6	-179.6	28.5	-35.8	0	0	0	113.1	F200	P198-F200 VanDerWaalsContact C-N 3.32Å
199	N	96.2	Very high	96.2	Very high	57 Å²	57	52.6 Å²	52.6	31%	0.305	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.7	-178.2	-73.3	-13.4	0	0	0	113.4	A162 P166 V167 L197	A162-N199 HydrophobicContact CB-CB 4.35Å; A162-N199 WeakPolarHBondContact O-CB 3.47Å; A162-N199 PolarHBondContact O-ND2 3.38Å; P166-N199 CarbonylContact C-O 3.57Å; P166-N199 VanDerWaalsContact CA-O 3.32Å; P166-N199 WeakPolarHBondContact CA-O 3.45Å; V167-N199 PolarHBondContact N-O 3.09Å; L197-N199 PolarHBondContact O-N 3.42Å
200	F	97.8	Very high	96.3	Very high	13 Å²	13	51.6 Å²	51.6	6%	0.057	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.3	-179.7	178.2	-121.1	0	0	0	111.7	L158 A162 V167 L169 F191 A194 L197 P198 R202	L158-F200 HydrophobicContact CB-CE2 4.4Å; L158-F200 HydrophobicContact CD1-CE2 3.77Å; L158-F200 HydrophobicContact CD1-CZ 3.73Å; L158-F200 HydrophobicContact CD2-CE2 4.01Å; L158-F200 HydrophobicContact CG-CE2 4.29Å; A162-F200 HydrophobicContact CB-CB 3.93Å; V167-F200 HydrophobicContact CB-CD2 4.33Å; V167-F200 HydrophobicContact CG1-CD2 4.46Å; L169-F200 HydrophobicContact CB-CE2 3.8Å; L169-F200 HydrophobicContact CB-CZ 4.21Å; L169-F200 HydrophobicContact CD2-CE2 4.08Å; L169-F200 HydrophobicContact CD2-CZ 3.81Å; F191-F200 HydrophobicContact CB-CE1 3.98Å; F191-F200 AromaticContact CD2-CE1 3.98Å; F191-F200 HydrophobicContact CD2-CE1 3.98Å; F191-F200 HydrophobicContact CD2-CZ 4.09Å; F191-F200 HydrophobicContact CE2-CZ 4.4Å; F191-F200 AromaticContact CG-CE1 3.99Å; F191-F200 HydrophobicContact CG-CE1 3.99Å; F191-F200 HydrophobicContact CG-CZ 4.19Å; A194-F200 HydrophobicContact CB-CB 4.48Å; A194-F200 HydrophobicContact CB-CD1 3.64Å; A194-F200 HydrophobicContact CB-CE1 3.92Å; A194-F200 HydrophobicContact CB-CG 3.97Å; A194-F200 HydrophobicContact CB-CZ 4.5Å; A194-F200 WeakPolarHBondContact O-CB 3.32Å; L197-F200 PolarHBondContact O-N 3.15Å; P198-F200 VanDerWaalsContact C-N 3.32Å; F200-R202 HydrophobicContact CD1-CG 4.47Å; F200-R202 HydrophobicContact CE1-CG 3.69Å; F200-R202 HydrophobicContact CZ-CG 3.79Å
201	N	97.3	Very high	96.3	Very high	61 Å²	61	50.5 Å²	50.5	33%	0.326	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.5	178.7	-55	-55.9	0	0	0	111	V167 D168 L169 V203	V167-N201 PolarHBondContact O-N 2.99Å; D168-N201 WeakPolarHBondContact CA-O 3.38Å; D168-N201 VanDerWaalsContact OD1-CB 3.31Å; D168-N201 WeakPolarHBondContact OD1-CB 3.4Å; D168-N201 PolarHBondContact OD1-ND2 2.81Å; L169-N201 PolarHBondContact N-O 3.03Å; N201-V203 HydrophobicContact CB-CG1 4.36Å
202	R	97.2	Very high	96.1	Very high	96 Å²	96	54.4 Å²	54.4	36%	0.362	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.5	172.5	-58.1	167.8	-64.1	128	-0.9	106.7	A185 L186 F200	A185-R202 HydrophobicContact CB-CB 4Å; L186-R202 WeakPolarHBondContact O-CD 3.5Å; L186-R202 PolarHBondContact O-NH1 3.4Å; F200-R202 HydrophobicContact CD1-CG 4.47Å; F200-R202 HydrophobicContact CE1-CG 3.69Å; F200-R202 HydrophobicContact CZ-CG 3.79Å
203	V	97.7	Very high	95.8	Very high	20 Å²	20	52.6 Å²	52.6	12%	0.121	30%	0.296	C	S	.	.			trans	-119.6	172	-172.8	-60.8	0	0	0	0	110.8	D168 L169 M170 P171 A185 N201 Y207	D168-V203 HydrophobicContact CB-CG1 4.31Å; D168-V203 HydrophobicContact CB-CG2 4.35Å; L169-V203 WeakPolarHBondContact O-CG2 3.03Å; L169-V203 PolarHBondContact O-N 3.05Å; M170-V203 HydrophobicContact CB-CG2 4.28Å; M170-V203 HydrophobicContact CG-CG2 3.51Å; P171-V203 WeakPolarHBondContact CD-O 3.37Å; A185-V203 VanDerWaalsContact CA-O 3.28Å; A185-V203 WeakPolarHBondContact CA-O 3.48Å; A185-V203 WeakPolarHBondContact CB-O 3.49Å; N201-V203 HydrophobicContact CB-CG1 4.36Å; V203-Y207 HydrophobicContact CB-CD2 3.73Å; V203-Y207 HydrophobicContact CB-CE2 3.77Å; V203-Y207 HydrophobicContact CB-CG 4.36Å; V203-Y207 HydrophobicContact CG1-CD2 4.14Å; V203-Y207 HydrophobicContact CG1-CE2 3.63Å; V203-Y207 HydrophobicContact CG2-CD1 4.24Å; V203-Y207 HydrophobicContact CG2-CD2 3.84Å; V203-Y207 HydrophobicContact CG2-CE1 4.39Å; V203-Y207 HydrophobicContact CG2-CE2 4.05Å; V203-Y207 HydrophobicContact CG2-CG 3.96Å
204	T	97.4	Very high	95.6	Very high	54 Å²	54	49.5 Å²	49.5	33%	0.331	28%	0.281	S	S	.	.			trans	-86.7	171.1	-178.7	55.7	0	0	0	0	112.3	Q183 P206	Q183-T204 WeakPolarHBondContact O-CA 3.3Å; Q183-T204 WeakPolarHBondContact O-CB 3.36Å; T204-P206 CarbonylContact C-O 3.58Å; T204-P206 VanDerWaalsContact C-O 3.3Å; T204-P206 CarbonylContact O-C 3.53Å; T204-P206 PolarHBondContact OG1-O 3.02Å
205	N	97.1	Very high	95.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-123.6	119.7	162.5	171.9	35.2	0	0	0	108.5	M170 P171 P182 Q183 T219 S220 Q222	M170-N205 HydrophobicContact CE-CB 4.37Å; P171-N205 HydrophobicContact CG-CB 3.95Å; P171-N205 WeakPolarHBondContact O-CB 3.49Å; P182-N205 CarbonylContact C-O 3.52Å; P182-N205 WeakPolarHBondContact CA-O 3.32Å; Q183-N205 HydrophobicContact CB-CB 4.15Å; Q183-N205 PolarHBondContact N-O 3.34Å; Q183-N205 PolarHBondContact O-N 2.73Å; Q183-N205 PolarHBondContact OE1-ND2 3.17Å; N205-T219 WeakPolarHBondContact OD1-CA 3.48Å; N205-S220 WeakPolarHBondContact ND2-CB 3.43Å; N205-S220 PolarHBondContact OD1-N 2.84Å; N205-Q222 PolarHBondContact ND2-OE1 2.66Å
206	P	96.9	Very high	95.6	Very high	22 Å²	22	48.5 Å²	48.5	14%	0.143	27%	0.274	C	S	.	.	S	Bend	cis	-65.5	161.5	2.1	30	-36.6	0	0	0	113.2	T204 G218 T219 L249 F268	T204-P206 CarbonylContact C-O 3.58Å; T204-P206 VanDerWaalsContact C-O 3.3Å; T204-P206 CarbonylContact O-C 3.53Å; T204-P206 PolarHBondContact OG1-O 3.02Å; P206-G218 WeakPolarHBondContact CA-O 3.29Å; P206-T219 HydrophobicContact CB-CG2 4.17Å; P206-L249 HydrophobicContact CB-CD1 3.85Å; P206-L249 HydrophobicContact CG-CD1 3.91Å; P206-F268 HydrophobicContact CG-CD1 4.39Å; P206-F268 HydrophobicContact CG-CE1 4.29Å
207	Y	97.6	Very high	95.7	Very high	19 Å²	19	39.8 Å²	39.8	8%	0.075	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.5	177.3	-179.4	-137.7	0	0	0	110.6	I115 D168 M170 V203 A209 L217 G218	I115-Y207 HydrophobicContact CD1-CE1 4.05Å; I115-Y207 HydrophobicContact CG1-CE1 4.46Å; I115-Y207 HydrophobicContact CG2-CD1 4.24Å; I115-Y207 HydrophobicContact CG2-CE1 4.29Å; D168-Y207 HydrophobicContact CB-CE1 4.22Å; D168-Y207 PolarHBondContact OD2-OH 3.16Å; M170-Y207 HydrophobicContact CG-CD1 4.24Å; M170-Y207 HydrophobicContact CG-CG 4.26Å; M170-Y207 HydrophobicContact SD-CD1 3.98Å; M170-Y207 HydrophobicContact SD-CG 4.21Å; V203-Y207 HydrophobicContact CB-CD2 3.73Å; V203-Y207 HydrophobicContact CB-CE2 3.77Å; V203-Y207 HydrophobicContact CB-CG 4.36Å; V203-Y207 HydrophobicContact CG1-CD2 4.14Å; V203-Y207 HydrophobicContact CG1-CE2 3.63Å; V203-Y207 HydrophobicContact CG2-CD1 4.24Å; V203-Y207 HydrophobicContact CG2-CD2 3.84Å; V203-Y207 HydrophobicContact CG2-CE1 4.39Å; V203-Y207 HydrophobicContact CG2-CE2 4.05Å; V203-Y207 HydrophobicContact CG2-CG 3.96Å; Y207-A209 HydrophobicContact CE1-CB 4.04Å; Y207-A209 HydrophobicContact CE2-CB 3.68Å; Y207-A209 WeakPolarHBondContact OH-CB 3.45Å; Y207-L217 CarbonylContact O-C 3.38Å; Y207-L217 WeakPolarHBondContact O-CA 3.26Å; Y207-G218 PolarHBondContact N-O 2.83Å; Y207-G218 PolarHBondContact O-N 2.83Å
208	C	96.1	Very high	95.8	Very high	85 Å²	85	38 Å²	38	57%	0.574	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134	124.4	173.7	-173	0	0	0	0	109.3	F216 L217	C208-F216 VanDerWaalsContact CA-O 3.29Å; C208-F216 WeakPolarHBondContact CA-O 3.4Å; C208-L217 HydrophobicContact CB-CD1 4Å
209	A	95.5	Very high	95.9	Very high	19 Å²	19	32.6 Å²	32.6	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	152	179.4	0	0	0	0	0	112.1	Y207 T215 F216	Y207-A209 HydrophobicContact CE1-CB 4.04Å; Y207-A209 HydrophobicContact CE2-CB 3.68Å; Y207-A209 WeakPolarHBondContact OH-CB 3.45Å; A209-T215 CarbonylContact O-C 3.47Å; A209-T215 WeakPolarHBondContact O-CA 3.33Å; A209-F216 PolarHBondContact N-O 2.97Å; A209-F216 PolarHBondContact O-N 3.15Å
210	S	94.8	Very high	95.9	Very high	73 Å²	73	30 Å²	30	51%	0.51	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.2	170.7	-174.5	0	0	0	0	110	I214	S210-I214 WeakPolarHBondContact CA-O 3.31Å
211	V	93.3	Very high	95.8	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115.7	176.9	-174.9	0	0	0	0	107.4	V66 V112 R113 G213 I214 F216 L321	V66-V211 HydrophobicContact CG2-CB 4.4Å; V66-V211 HydrophobicContact CG2-CG1 3.85Å; V112-V211 HydrophobicContact CG2-CG1 3.93Å; R113-V211 HydrophobicContact CB-CG1 4.41Å; V211-G213 PolarHBondContact O-N 3.28Å; V211-I214 PolarHBondContact N-O 3.24Å; V211-I214 WeakPolarHBondContact O-CB 3.34Å; V211-I214 PolarHBondContact O-N 2.96Å; V211-F216 HydrophobicContact CB-CD2 4.29Å; V211-F216 HydrophobicContact CB-CE2 4.12Å; V211-F216 HydrophobicContact CG2-CD2 4.17Å; V211-F216 HydrophobicContact CG2-CE2 4.39Å; V211-L321 HydrophobicContact CG1-CD1 4.3Å
212	C	90.3	Very high	95.6	Very high	82 Å²	82	27.4 Å²	27.4	55%	0.554	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	38.3	-176.5	-55.5	0	0	0	0	113.5	P55 I214 L321	P55-C212 WeakPolarHBondContact CG-O 3.35Å; C212-I214 VanDerWaalsContact C-N 3.28Å; C212-I214 PolarHBondContact O-N 3.41Å; C212-L321 HydrophobicContact CB-CD1 3.93Å
213	G	89.6	Confident	95.5	Very high	34 Å²	34	23 Å²	23	35%	0.351	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	-8.6	-178	0	0	0	0	0	114.8	V211	V211-G213 PolarHBondContact O-N 3.28Å
214	I	93.4	Very high	95.4	Very high	0 Å²	0	22 Å²	22	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	110.2	177	-53.7	-57.6	0	0	0	109.8	L54 P55 S210 V211 C212 F216 H275 V276 L321 L324	L54-I214 HydrophobicContact CD2-CD1 3.57Å; P55-I214 VanDerWaalsContact CD-CD1 3.48Å; P55-I214 HydrophobicContact CG-CD1 4.09Å; S210-I214 WeakPolarHBondContact CA-O 3.31Å; V211-I214 PolarHBondContact N-O 3.24Å; V211-I214 WeakPolarHBondContact O-CB 3.34Å; V211-I214 PolarHBondContact O-N 2.96Å; C212-I214 VanDerWaalsContact C-N 3.28Å; C212-I214 PolarHBondContact O-N 3.41Å; I214-F216 HydrophobicContact CB-CE2 3.99Å; I214-F216 HydrophobicContact CG2-CD2 4.15Å; I214-F216 HydrophobicContact CG2-CE2 3.64Å; I214-F216 HydrophobicContact CG2-CZ 4.21Å; I214-F216 VanDerWaalsContact O-CD2 3.26Å; I214-F216 WeakPolarHBondContact O-CD2 3.49Å; I214-F216 PolarHBondContact O-N 3.1Å; I214-H275 HydrophobicContact CG2-CB 3.77Å; I214-V276 HydrophobicContact CG2-CG2 4.21Å; I214-L321 HydrophobicContact CB-CD2 4.26Å; I214-L321 HydrophobicContact CG1-CB 4.34Å; I214-L321 HydrophobicContact CG1-CD2 4.17Å; I214-L321 HydrophobicContact CG2-CD2 4.47Å; I214-L324 HydrophobicContact CD1-CD2 4.37Å; I214-L324 HydrophobicContact CG2-CD2 3.88Å
215	T	95.3	Very high	95.2	Very high	26 Å²	26	21.4 Å²	21.4	16%	0.16	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	116.5	168.5	-47.8	0	0	0	0	112.7	A209 P274 H275 V276	A209-T215 CarbonylContact O-C 3.47Å; A209-T215 WeakPolarHBondContact O-CA 3.33Å; T215-P274 HydrophobicContact CG2-CB 4.45Å; T215-H275 PolarHBondContact N-CE1 3.06Å; T215-H275 PolarHBondContact N-ND1 3.21Å; T215-H275 PolarHBondContact O-N 3.07Å; T215-V276 PolarHBondContact O-N 3.23Å
216	F	97.2	Very high	95	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.5	168	-71.8	-103.1	0	0	0	109.7	V66 C208 A209 V211 I214 V276 F278 V319 L321	V66-F216 HydrophobicContact CB-CE1 4.39Å; V66-F216 HydrophobicContact CB-CZ 3.98Å; V66-F216 HydrophobicContact CG1-CE1 4.21Å; V66-F216 HydrophobicContact CG1-CZ 4.2Å; V66-F216 HydrophobicContact CG2-CE2 4.26Å; V66-F216 HydrophobicContact CG2-CZ 4.01Å; C208-F216 VanDerWaalsContact CA-O 3.29Å; C208-F216 WeakPolarHBondContact CA-O 3.4Å; A209-F216 PolarHBondContact N-O 2.97Å; A209-F216 PolarHBondContact O-N 3.15Å; V211-F216 HydrophobicContact CB-CD2 4.29Å; V211-F216 HydrophobicContact CB-CE2 4.12Å; V211-F216 HydrophobicContact CG2-CD2 4.17Å; V211-F216 HydrophobicContact CG2-CE2 4.39Å; I214-F216 HydrophobicContact CB-CE2 3.99Å; I214-F216 HydrophobicContact CG2-CD2 4.15Å; I214-F216 HydrophobicContact CG2-CE2 3.64Å; I214-F216 HydrophobicContact CG2-CZ 4.21Å; I214-F216 VanDerWaalsContact O-CD2 3.26Å; I214-F216 WeakPolarHBondContact O-CD2 3.49Å; I214-F216 PolarHBondContact O-N 3.1Å; F216-V276 WeakPolarHBondContact CA-O 3.49Å; F216-V276 HydrophobicContact CD1-CB 3.65Å; F216-V276 HydrophobicContact CD1-CG1 3.78Å; F216-V276 HydrophobicContact CD1-CG2 4.16Å; F216-V276 HydrophobicContact CE1-CB 3.79Å; F216-V276 HydrophobicContact CE1-CG1 3.82Å; F216-V276 HydrophobicContact CE1-CG2 3.81Å; F216-V276 HydrophobicContact CG-CB 4.25Å; F216-V276 HydrophobicContact CZ-CB 4.47Å; F216-V276 HydrophobicContact CZ-CG2 4.07Å; F216-F278 HydrophobicContact CB-CE1 4.45Å; F216-V319 HydrophobicContact CE1-CG1 4.4Å; F216-V319 HydrophobicContact CZ-CG1 4.37Å; F216-L321 HydrophobicContact CE2-CD2 3.79Å; F216-L321 HydrophobicContact CZ-CD2 3.66Å
217	L	97.5	Very high	94.8	Very high	16 Å²	16	21 Å²	21	8%	0.084	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.6	167.4	177.5	62.8	0	0	0	107.6	Y207 C208 L249 I270 P274 V276 Y277 F278	Y207-L217 CarbonylContact O-C 3.38Å; Y207-L217 WeakPolarHBondContact O-CA 3.26Å; C208-L217 HydrophobicContact CB-CD1 4Å; L217-L249 HydrophobicContact CD1-CD1 4.5Å; L217-L249 HydrophobicContact CD2-CD2 3.94Å; L217-L249 HydrophobicContact CG-CD2 4.3Å; L217-I270 HydrophobicContact CD2-CD1 4.44Å; L217-P274 HydrophobicContact CB-CB 3.61Å; L217-P274 HydrophobicContact CB-CG 3.8Å; L217-P274 HydrophobicContact CD2-CG 3.98Å; L217-V276 PolarHBondContact N-O 2.88Å; L217-Y277 HydrophobicContact CB-CD2 4.36Å; L217-Y277 HydrophobicContact CD2-CD2 4.32Å; L217-Y277 HydrophobicContact CG-CD2 4.12Å; L217-Y277 HydrophobicContact CG-CE2 4.44Å; L217-Y277 CarbonylContact O-C 3.53Å; L217-Y277 VanDerWaalsContact O-CA 3.25Å; L217-Y277 WeakPolarHBondContact O-CA 3.32Å; L217-Y277 WeakPolarHBondContact O-CD2 3.14Å; L217-F278 WeakPolarHBondContact O-CD1 3.32Å; L217-F278 PolarHBondContact O-N 3.26Å
218	G	97.4	Very high	94.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	166	173.9	0	0	0	0	0	115.2	P206 Y207 F278	P206-G218 WeakPolarHBondContact CA-O 3.29Å; Y207-G218 PolarHBondContact N-O 2.83Å; Y207-G218 PolarHBondContact O-N 2.83Å; G218-F278 WeakPolarHBondContact CA-O 3.4Å
219	T	97.5	Very high	94.1	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	156.7	-177.4	68.9	0	0	0	0	109.9	N205 P206 G221 T223 L249 F278 A280	N205-T219 WeakPolarHBondContact OD1-CA 3.48Å; P206-T219 HydrophobicContact CB-CG2 4.17Å; T219-G221 PolarHBondContact O-N 3.1Å; T219-G221 VanDerWaalsContact O-N 3.16Å; T219-T223 HydrophobicContact CG2-CG2 4.37Å; T219-T223 PolarHBondContact OG1-OG1 3.44Å; T219-L249 HydrophobicContact CG2-CD2 4.31Å; T219-F278 PolarHBondContact N-O 2.97Å; T219-F278 VanDerWaalsContact N-O 3.11Å; T219-A280 PolarHBondContact O-N 3.11Å
220	S	96.9	Very high	93.5	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.014	16%	0.156	C	C	.	.			trans	-75.8	8.7	175.4	-61.9	0	0	0	0	114.7	P171 N205 N281	P171-S220 PolarHBondContact O-OG 3.16Å; N205-S220 WeakPolarHBondContact ND2-CB 3.43Å; N205-S220 PolarHBondContact OD1-N 2.84Å; S220-N281 PolarHBondContact O-ND2 2.97Å
221	G	95.4	Very high	92.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	109.2	-26.4	171.2	0	0	0	0	0	115.4	T219 T223 I224 D225 A280	T219-G221 PolarHBondContact O-N 3.1Å; T219-G221 VanDerWaalsContact O-N 3.16Å; G221-T223 PolarHBondContact O-N 2.89Å; G221-T223 VanDerWaalsContact O-N 3.1Å; G221-I224 PolarHBondContact O-N 3.19Å; G221-I224 VanDerWaalsContact O-N 3.07Å; G221-D225 PolarHBondContact O-N 2.88Å; G221-A280 WeakPolarHBondContact CA-O 3.17Å
222	Q	94.3	Very high	92.3	Very high	20 Å²	20	30.3 Å²	30.3	9%	0.093	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-35	-169.7	-56.8	100.2	-36.4	0	0	113.1	E173 N205 D226 L257	E173-Q222 HydrophobicContact CB-CG 4.19Å; N205-Q222 PolarHBondContact ND2-OE1 2.66Å; Q222-D226 WeakPolarHBondContact O-CB 3.4Å; Q222-D226 PolarHBondContact O-N 2.84Å; Q222-L257 HydrophobicContact CB-CD1 4.4Å; Q222-L257 HydrophobicContact CB-CD2 4.35Å
223	T	94.4	Very high	92	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-47.4	178.8	52.3	0	0	0	0	112.2	L181 T219 G221 D226 L227 C250 L257	L181-T223 HydrophobicContact CD1-CG2 3.76Å; T219-T223 HydrophobicContact CG2-CG2 4.37Å; T219-T223 PolarHBondContact OG1-OG1 3.44Å; G221-T223 PolarHBondContact O-N 2.89Å; G221-T223 VanDerWaalsContact O-N 3.1Å; T223-D226 PolarHBondContact O-N 2.6Å; T223-L227 VanDerWaalsContact O-CG 3.31Å; T223-L227 WeakPolarHBondContact O-CG 3.39Å; T223-L227 PolarHBondContact O-N 2.95Å; T223-C250 HydrophobicContact CG2-CB 3.58Å; T223-L257 HydrophobicContact CG2-CD2 4.23Å
224	I	95.1	Very high	91.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-70.8	-39.5	179.6	-58.7	-53.3	0	0	0	110.3	G221 D226 L227 C228 R236 V239 M240 T243 A279	G221-I224 PolarHBondContact O-N 3.19Å; G221-I224 VanDerWaalsContact O-N 3.07Å; I224-D226 VanDerWaalsContact C-N 3.32Å; I224-D226 PolarHBondContact O-N 2.73Å; I224-L227 HydrophobicContact CD1-CD1 4.41Å; I224-L227 PolarHBondContact O-N 2.88Å; I224-C228 WeakPolarHBondContact O-CB 3.07Å; I224-C228 PolarHBondContact O-N 2.93Å; I224-C228 PolarHBondContact O-SG 3.45Å; I224-R236 HydrophobicContact CG2-CB 4.36Å; I224-V239 HydrophobicContact CD1-CG1 4.28Å; I224-V239 HydrophobicContact CG2-CB 4.47Å; I224-V239 HydrophobicContact CG2-CG1 4.16Å; I224-M240 HydrophobicContact CD1-CB 4.44Å; I224-M240 HydrophobicContact CD1-CG 3.59Å; I224-M240 HydrophobicContact CG1-CG 3.86Å; I224-M240 HydrophobicContact CG2-CG 4.49Å; I224-T243 HydrophobicContact CD1-CG2 4.19Å; I224-A279 HydrophobicContact CB-CB 4.34Å; I224-A279 HydrophobicContact CG1-CB 3.65Å
225	D	93.6	Very high	91.8	Very high	42 Å²	42	36 Å²	36	23%	0.225	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-40.9	175.6	-69.5	-31.9	0	0	0	112.4	G221 C228 K229 R236 Q282	G221-D225 PolarHBondContact O-N 2.88Å; D225-C228 PolarHBondContact O-N 2.9Å; D225-K229 WeakPolarHBondContact O-CG 3.35Å; D225-K229 PolarHBondContact O-N 2.85Å; D225-K229 VanDerWaalsContact O-N 3.14Å; D225-R236 IonicContact OD1-CZ 3.98Å; D225-R236 IonicContact OD1-NH1 2.6Å; D225-R236 PolarHBondContact OD1-NH1 2.91Å; D225-Q282 PolarHBondContact OD1-NE2 2.96Å
226	D	92.7	Very high	91.7	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-42.5	175.8	-174.1	69.2	0	0	0	112.4	Q222 T223 I224 C228 K229 N230 T252 T256 L257	Q222-D226 WeakPolarHBondContact O-CB 3.4Å; Q222-D226 PolarHBondContact O-N 2.84Å; T223-D226 PolarHBondContact O-N 2.6Å; I224-D226 VanDerWaalsContact C-N 3.32Å; I224-D226 PolarHBondContact O-N 2.73Å; D226-C228 VanDerWaalsContact C-N 3.31Å; D226-C228 PolarHBondContact O-N 3.47Å; D226-K229 PolarHBondContact O-N 3.48Å; D226-N230 PolarHBondContact O-N 3.21Å; D226-N230 PolarHBondContact O-ND2 3.44Å; D226-T252 WeakPolarHBondContact OD2-CB 3.43Å; D226-T252 PolarHBondContact OD2-OG1 3.25Å; D226-T256 VanDerWaalsContact CG-OG1 3.24Å; D226-T256 VanDerWaalsContact OD1-CB 3.32Å; D226-T256 WeakPolarHBondContact OD1-CB 3.21Å; D226-T256 PolarHBondContact OD1-OG1 3.43Å; D226-T256 PolarHBondContact OD2-OG1 3.03Å; D226-L257 HydrophobicContact CB-CB 4.12Å; D226-L257 HydrophobicContact CB-CD2 4.18Å
227	L	92.2	Very high	91.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-36.9	175	-72.4	171.7	0	0	0	112.3	T223 I224 N230 S231 V239 T243 W246 P251 T252	T223-L227 VanDerWaalsContact O-CG 3.31Å; T223-L227 WeakPolarHBondContact O-CG 3.39Å; T223-L227 PolarHBondContact O-N 2.95Å; I224-L227 HydrophobicContact CD1-CD1 4.41Å; I224-L227 PolarHBondContact O-N 2.88Å; L227-N230 CarbonylContact O-C 3.59Å; L227-N230 PolarHBondContact O-N 3.1Å; L227-N230 VanDerWaalsContact O-N 3.11Å; L227-S231 VanDerWaalsContact O-CB 3.3Å; L227-S231 WeakPolarHBondContact O-CB 3.48Å; L227-S231 PolarHBondContact O-N 3.37Å; L227-S231 PolarHBondContact O-OG 2.87Å; L227-V239 HydrophobicContact CB-CG1 3.56Å; L227-V239 HydrophobicContact CD1-CG1 4.02Å; L227-V239 HydrophobicContact CG-CG1 4.46Å; L227-T243 HydrophobicContact CD1-CG2 3.25Å; L227-W246 HydrophobicContact CD1-CZ3 4.32Å; L227-W246 HydrophobicContact CD2-CZ3 4.07Å; L227-P251 HydrophobicContact CD2-CG 4.13Å; L227-T252 HydrophobicContact CD2-CG2 3.73Å
228	C	91.6	Very high	91.4	Very high	16 Å²	16	38.2 Å²	38.2	11%	0.108	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-35.9	176.9	-77.2	0	0	0	0	112.8	I224 D225 D226 N230 S231 R236	I224-C228 WeakPolarHBondContact O-CB 3.07Å; I224-C228 PolarHBondContact O-N 2.93Å; I224-C228 PolarHBondContact O-SG 3.45Å; D225-C228 PolarHBondContact O-N 2.9Å; D226-C228 VanDerWaalsContact C-N 3.31Å; D226-C228 PolarHBondContact O-N 3.47Å; C228-N230 PolarHBondContact O-N 2.87Å; C228-S231 VanDerWaalsContact CA-OG 3.26Å; C228-S231 WeakPolarHBondContact CA-OG 3.41Å; C228-S231 PolarHBondContact O-N 3Å; C228-S231 PolarHBondContact O-OG 3Å; C228-R236 WeakPolarHBondContact SG-CD 3.14Å; C228-R236 PolarHBondContact SG-NE 3.43Å; C228-R236 VanDerWaalsContact SG-NE 3.45Å
229	K	88.8	Confident	91.2	Very high	165 Å²	165	38.4 Å²	38.4	72%	0.717	21%	0.208	S	C	*	.	H	α-helix	trans	-62.3	-28.5	172.5	-69.2	167	-168.2	168	0	112.3	D225 D226	D225-K229 WeakPolarHBondContact O-CG 3.35Å; D225-K229 PolarHBondContact O-N 2.85Å; D225-K229 VanDerWaalsContact O-N 3.14Å; D226-K229 PolarHBondContact O-N 3.48Å
230	N	82	Confident	91	Very high	60 Å²	60	38.4 Å²	38.4	32%	0.321	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-1.2	-178.1	-67.3	-61.3	0	0	0	113.3	R21 D226 L227 C228	R21-N230 WeakPolarHBondContact CD-O 2.99Å; R21-N230 PolarHBondContact NE-O 3.25Å; R21-N230 VanDerWaalsContact NE-O 3.13Å; R21-N230 PolarHBondContact NH1-O 2.86Å; D226-N230 PolarHBondContact O-N 3.21Å; D226-N230 PolarHBondContact O-ND2 3.44Å; L227-N230 CarbonylContact O-C 3.59Å; L227-N230 PolarHBondContact O-N 3.1Å; L227-N230 VanDerWaalsContact O-N 3.11Å; C228-N230 PolarHBondContact O-N 2.87Å
231	S	82.2	Confident	90.8	Very high	29 Å²	29	39.8 Å²	39.8	20%	0.203	22%	0.215	C	C	.	.	S	Bend	trans	-96.8	164.1	-177.5	66.5	0	0	0	0	112.4	L227 C228 T233	L227-S231 VanDerWaalsContact O-CB 3.3Å; L227-S231 WeakPolarHBondContact O-CB 3.48Å; L227-S231 PolarHBondContact O-N 3.37Å; L227-S231 PolarHBondContact O-OG 2.87Å; C228-S231 VanDerWaalsContact CA-OG 3.26Å; C228-S231 WeakPolarHBondContact CA-OG 3.41Å; C228-S231 PolarHBondContact O-N 3Å; C228-S231 PolarHBondContact O-OG 3Å; S231-T233 PolarHBondContact OG-O 2.62Å
232	V	80.6	Confident	90.5	Very high	128 Å²	128	41.8 Å²	41.8	78%	0.776	23%	0.226	S	C	*	.	S	Bend	trans	-86.5	-21.3	171	176.3	0	0	0	0	111.3
233	T	83.6	Confident	90.4	Very high	59 Å²	59	40.8 Å²	40.8	36%	0.362	22%	0.221	S	C	.	.			trans	-110.8	137	-179.7	-177.2	0	0	0	0	110.5	S231 D235 V239	S231-T233 PolarHBondContact OG-O 2.62Å; T233-D235 VanDerWaalsContact C-N 3.32Å; T233-D235 PolarHBondContact OG1-N 3.32Å; T233-D235 VanDerWaalsContact OG1-N 3.14Å; T233-V239 HydrophobicContact CG2-CG2 4.2Å
234	D	86.5	Confident	90.3	Very high	110 Å²	110	40.8 Å²	40.8	59%	0.588	22%	0.221	S	C	*	.			trans	-89.7	1	171.9	-164.3	21.1	0	0	0	112.1	R236	D234-R236 WeakPolarHBondContact O-CD 3.48Å; D234-R236 PolarHBondContact O-N 3.43Å; D234-R236 VanDerWaalsContact O-N 3.11Å; D234-R236 PolarHBondContact O-NE 2.84Å; D234-R236 IonicContact OD1-CZ 3.18Å; D234-R236 IonicContact OD1-NE 3.42Å; D234-R236 PolarHBondContact OD1-NE 2.95Å; D234-R236 IonicContact OD1-NH2 3.29Å; D234-R236 PolarHBondContact OD1-NH2 2.63Å
235	D	92.7	Very high	90	Very high	65 Å²	65	43.8 Å²	43.8	35%	0.348	23%	0.234	S	C	.	.			trans	-70	109.6	175.1	177.4	35.2	0	0	0	111.3	T233 I237 S238 V239	T233-D235 VanDerWaalsContact C-N 3.32Å; T233-D235 PolarHBondContact OG1-N 3.32Å; T233-D235 VanDerWaalsContact OG1-N 3.14Å; D235-I237 VanDerWaalsContact C-N 3.32Å; D235-I237 PolarHBondContact O-N 3.14Å; D235-I237 PolarHBondContact OD1-N 3.28Å; D235-S238 PolarHBondContact O-N 3.05Å; D235-S238 WeakPolarHBondContact OD2-CB 3.35Å; D235-S238 PolarHBondContact OD2-N 3.41Å; D235-S238 PolarHBondContact OD2-OG 3.42Å; D235-V239 WeakPolarHBondContact O-CG2 3.12Å; D235-V239 PolarHBondContact O-N 3.49Å
236	R	94.3	Very high	89.9	Confident	33 Å²	33	42.8 Å²	42.8	13%	0.125	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-37.3	-176.4	-52.8	-48.8	174.5	126.7	-15.3	112.3	I224 D225 C228 D234 V239 M240	I224-R236 HydrophobicContact CG2-CB 4.36Å; D225-R236 IonicContact OD1-CZ 3.98Å; D225-R236 IonicContact OD1-NH1 2.6Å; D225-R236 PolarHBondContact OD1-NH1 2.91Å; C228-R236 WeakPolarHBondContact SG-CD 3.14Å; C228-R236 PolarHBondContact SG-NE 3.43Å; C228-R236 VanDerWaalsContact SG-NE 3.45Å; D234-R236 WeakPolarHBondContact O-CD 3.48Å; D234-R236 PolarHBondContact O-N 3.43Å; D234-R236 VanDerWaalsContact O-N 3.11Å; D234-R236 PolarHBondContact O-NE 2.84Å; D234-R236 IonicContact OD1-CZ 3.18Å; D234-R236 IonicContact OD1-NE 3.42Å; D234-R236 PolarHBondContact OD1-NE 2.95Å; D234-R236 IonicContact OD1-NH2 3.29Å; D234-R236 PolarHBondContact OD1-NH2 2.63Å; R236-V239 PolarHBondContact O-N 3.27Å; R236-M240 WeakPolarHBondContact O-CB 3.5Å; R236-M240 VanDerWaalsContact O-CG 3.23Å; R236-M240 WeakPolarHBondContact O-CG 3.45Å; R236-M240 PolarHBondContact O-N 3.44Å
237	I	94.8	Very high	89.8	Confident	12 Å²	12	42.6 Å²	42.6	6%	0.062	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-43.8	178.1	-63.5	-58.9	0	0	0	110.5	D235 V239 M240 L241 S286 L304	D235-I237 VanDerWaalsContact C-N 3.32Å; D235-I237 PolarHBondContact O-N 3.14Å; D235-I237 PolarHBondContact OD1-N 3.28Å; I237-V239 VanDerWaalsContact C-N 3.31Å; I237-V239 PolarHBondContact O-N 3.45Å; I237-M240 HydrophobicContact CD1-SD 4.33Å; I237-M240 PolarHBondContact O-N 3.3Å; I237-L241 WeakPolarHBondContact O-CB 3.25Å; I237-L241 PolarHBondContact O-N 2.84Å; I237-S286 VanDerWaalsContact CG1-OG 3.26Å; I237-S286 WeakPolarHBondContact CG1-OG 3.46Å; I237-L304 HydrophobicContact CD1-CB 3.99Å; I237-L304 HydrophobicContact CG2-CB 4.29Å; I237-L304 HydrophobicContact CG2-CD1 3.87Å
238	S	92.4	Very high	89.8	Confident	45 Å²	45	43.7 Å²	43.7	32%	0.315	23%	0.232	S	C	.	.	H	α-helix	trans	-61	-39.6	174.9	-69.7	0	0	0	0	112.5	D235 L241 N242	D235-S238 PolarHBondContact O-N 3.05Å; D235-S238 WeakPolarHBondContact OD2-CB 3.35Å; D235-S238 PolarHBondContact OD2-N 3.41Å; D235-S238 PolarHBondContact OD2-OG 3.42Å; S238-L241 PolarHBondContact O-N 3.2Å; S238-N242 PolarHBondContact O-N 3.28Å; S238-N242 PolarHBondContact O-ND2 2.79Å
239	V	93.1	Very high	89.9	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-66.2	-45.7	176.4	174.9	0	0	0	0	111.2	I224 L227 T233 D235 R236 I237 L241 N242 T243	I224-V239 HydrophobicContact CD1-CG1 4.28Å; I224-V239 HydrophobicContact CG2-CB 4.47Å; I224-V239 HydrophobicContact CG2-CG1 4.16Å; L227-V239 HydrophobicContact CB-CG1 3.56Å; L227-V239 HydrophobicContact CD1-CG1 4.02Å; L227-V239 HydrophobicContact CG-CG1 4.46Å; T233-V239 HydrophobicContact CG2-CG2 4.2Å; D235-V239 WeakPolarHBondContact O-CG2 3.12Å; D235-V239 PolarHBondContact O-N 3.49Å; R236-V239 PolarHBondContact O-N 3.27Å; I237-V239 VanDerWaalsContact C-N 3.31Å; I237-V239 PolarHBondContact O-N 3.45Å; V239-L241 VanDerWaalsContact C-N 3.31Å; V239-L241 PolarHBondContact O-N 3.17Å; V239-N242 WeakPolarHBondContact O-CB 3.5Å; V239-N242 PolarHBondContact O-N 3.16Å; V239-N242 VanDerWaalsContact O-N 3.11Å; V239-T243 PolarHBondContact O-N 3.33Å; V239-T243 VanDerWaalsContact O-N 3.09Å
240	M	94.2	Very high	90	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-37.9	173.7	-69.8	172.4	72.4	0	0	112.7	I224 R236 I237 N242 T243 L244 Y277 A279 L304 L305	I224-M240 HydrophobicContact CD1-CB 4.44Å; I224-M240 HydrophobicContact CD1-CG 3.59Å; I224-M240 HydrophobicContact CG1-CG 3.86Å; I224-M240 HydrophobicContact CG2-CG 4.49Å; R236-M240 WeakPolarHBondContact O-CB 3.5Å; R236-M240 VanDerWaalsContact O-CG 3.23Å; R236-M240 WeakPolarHBondContact O-CG 3.45Å; R236-M240 PolarHBondContact O-N 3.44Å; I237-M240 HydrophobicContact CD1-SD 4.33Å; I237-M240 PolarHBondContact O-N 3.3Å; M240-N242 VanDerWaalsContact C-N 3.27Å; M240-N242 PolarHBondContact O-N 3.27Å; M240-T243 PolarHBondContact O-N 2.91Å; M240-T243 PolarHBondContact O-OG1 3.02Å; M240-L244 PolarHBondContact O-N 2.96Å; M240-Y277 HydrophobicContact CB-CD1 4.13Å; M240-Y277 HydrophobicContact CB-CE1 3.75Å; M240-Y277 HydrophobicContact CE-CD1 3.74Å; M240-Y277 HydrophobicContact CE-CD2 4.4Å; M240-Y277 HydrophobicContact CE-CE1 3.92Å; M240-Y277 HydrophobicContact CE-CG 3.99Å; M240-Y277 WeakPolarHBondContact CE-O 3.37Å; M240-Y277 HydrophobicContact CG-CE1 4.05Å; M240-A279 HydrophobicContact CE-CB 3.91Å; M240-A279 HydrophobicContact CG-CB 4.31Å; M240-A279 HydrophobicContact SD-CB 3.67Å; M240-L304 HydrophobicContact CB-CD2 4.38Å; M240-L304 HydrophobicContact CE-CD2 4.46Å; M240-L305 WeakPolarHBondContact CE-O 3.3Å
241	L	91.9	Very high	90.5	Very high	31 Å²	31	32.8 Å²	32.8	16%	0.162	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-36.7	175.4	-178.9	62.4	0	0	0	111	I237 S238 V239 L244 K245 C290 L292 L304	I237-L241 WeakPolarHBondContact O-CB 3.25Å; I237-L241 PolarHBondContact O-N 2.84Å; S238-L241 PolarHBondContact O-N 3.2Å; V239-L241 VanDerWaalsContact C-N 3.31Å; V239-L241 PolarHBondContact O-N 3.17Å; L241-L244 PolarHBondContact O-N 2.81Å; L241-K245 WeakPolarHBondContact O-CG 3.46Å; L241-K245 PolarHBondContact O-N 3.09Å; L241-C290 HydrophobicContact CD1-CB 4.01Å; L241-L292 HydrophobicContact CD1-CD2 3.84Å; L241-L304 HydrophobicContact CB-CD1 3.85Å; L241-L304 HydrophobicContact CD1-CD1 4.28Å
242	N	90.3	Very high	90.8	Very high	42 Å²	42	31.5 Å²	31.5	23%	0.225	17%	0.172	C	C	.	.	H	α-helix	trans	-67.9	-38	176.4	-68.6	-28.2	0	0	0	112.3	S238 V239 M240 L244 K245 W246	S238-N242 PolarHBondContact O-N 3.28Å; S238-N242 PolarHBondContact O-ND2 2.79Å; V239-N242 WeakPolarHBondContact O-CB 3.5Å; V239-N242 PolarHBondContact O-N 3.16Å; V239-N242 VanDerWaalsContact O-N 3.11Å; M240-N242 VanDerWaalsContact C-N 3.27Å; M240-N242 PolarHBondContact O-N 3.27Å; N242-L244 VanDerWaalsContact C-N 3.3Å; N242-L244 PolarHBondContact O-N 3.19Å; N242-K245 WeakPolarHBondContact O-CB 3.49Å; N242-K245 PolarHBondContact O-N 3.4Å; N242-K245 VanDerWaalsContact O-N 3.13Å; N242-W246 HydrophobicContact CB-CD2 4.25Å; N242-W246 HydrophobicContact CB-CE3 4.34Å; N242-W246 HydrophobicContact CB-CH2 3.77Å; N242-W246 HydrophobicContact CB-CZ2 3.64Å; N242-W246 HydrophobicContact CB-CZ3 4.12Å; N242-W246 WeakPolarHBondContact O-CB 3.34Å; N242-W246 PolarHBondContact O-N 2.9Å
243	T	92.4	Very high	91.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-38.8	176.1	61.5	0	0	0	0	112.2	I224 L227 V239 M240 W246 G247 H248 L249 Y277	I224-T243 HydrophobicContact CD1-CG2 4.19Å; L227-T243 HydrophobicContact CD1-CG2 3.25Å; V239-T243 PolarHBondContact O-N 3.33Å; V239-T243 VanDerWaalsContact O-N 3.09Å; M240-T243 PolarHBondContact O-N 2.91Å; M240-T243 PolarHBondContact O-OG1 3.02Å; T243-W246 HydrophobicContact CG2-CE3 4.34Å; T243-W246 HydrophobicContact CG2-CZ3 4.35Å; T243-W246 PolarHBondContact O-N 2.88Å; T243-G247 PolarHBondContact O-N 3.45Å; T243-G247 VanDerWaalsContact O-N 3.1Å; T243-H248 VanDerWaalsContact CB-O 3.26Å; T243-H248 WeakPolarHBondContact CB-O 3.46Å; T243-H248 PolarHBondContact O-N 3.45Å; T243-H248 VanDerWaalsContact O-N 3.08Å; T243-L249 WeakPolarHBondContact CG2-O 3.26Å; T243-Y277 VanDerWaalsContact OG1-CE1 3.32Å; T243-Y277 WeakPolarHBondContact OG1-CE1 3.47Å; T243-Y277 PolarHBondContact OG1-OH 3.27Å
244	L	92.2	Very high	91.6	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-42.7	171.9	-65.9	179.3	0	0	0	112.3	M240 L241 N242 W246 G247 I270 L273 P274 Y277 L292 V302 L304	M240-L244 PolarHBondContact O-N 2.96Å; L241-L244 PolarHBondContact O-N 2.81Å; N242-L244 VanDerWaalsContact C-N 3.3Å; N242-L244 PolarHBondContact O-N 3.19Å; L244-W246 VanDerWaalsContact C-N 3.3Å; L244-W246 PolarHBondContact O-N 2.84Å; L244-G247 PolarHBondContact O-N 3.08Å; L244-G247 VanDerWaalsContact O-N 3.15Å; L244-I270 HydrophobicContact CD2-CD1 3.88Å; L244-L273 HydrophobicContact CD2-CD2 4.42Å; L244-P274 HydrophobicContact CD2-CG 4.45Å; L244-Y277 HydrophobicContact CD1-CD1 4.11Å; L244-Y277 HydrophobicContact CD2-CD1 4.03Å; L244-Y277 HydrophobicContact CD2-CE1 4.48Å; L244-Y277 HydrophobicContact CG-CD1 3.94Å; L244-Y277 HydrophobicContact CG-CE1 4.33Å; L244-L292 HydrophobicContact CB-CD1 4.43Å; L244-L292 HydrophobicContact CB-CD2 3.84Å; L244-V302 HydrophobicContact CD1-CB 4.03Å; L244-V302 HydrophobicContact CD1-CG1 3.9Å; L244-V302 HydrophobicContact CD1-CG2 4.14Å; L244-L304 HydrophobicContact CD1-CD2 3.66Å
245	K	89	Confident	91.7	Very high	64 Å²	64	27.4 Å²	27.4	28%	0.278	15%	0.148	S	C	.	.	H	α-helix	trans	-62.5	-36.9	175.9	-72.2	173.2	-173.4	173.8	0	112.8	F45 L241 N242 L292 P293	F45-K245 WeakPolarHBondContact CB-O 3.25Å; L241-K245 WeakPolarHBondContact O-CG 3.46Å; L241-K245 PolarHBondContact O-N 3.09Å; N242-K245 WeakPolarHBondContact O-CB 3.49Å; N242-K245 PolarHBondContact O-N 3.4Å; N242-K245 VanDerWaalsContact O-N 3.13Å; K245-L292 HydrophobicContact CG-CD2 3.92Å; K245-P293 HydrophobicContact CD-CG 4.45Å; K245-P293 VanDerWaalsContact CE-CD 3.48Å; K245-P293 VanDerWaalsContact CE-CG 3.49Å
246	W	89.8	Confident	91.5	Very high	21 Å²	21	27.4 Å²	27.4	8%	0.08	15%	0.15	C	C	.	.	H	α-helix	trans	-77.5	-12.7	178.3	-57.6	-28.1	0	0	0	112.6	R21 V24 F45 L227 N242 T243 L244 H248 P251	R21-W246 HydrophobicContact CG-CH2 4.03Å; R21-W246 HydrophobicContact CG-CZ2 4.42Å; V24-W246 HydrophobicContact CG1-CB 4.26Å; V24-W246 HydrophobicContact CG1-CD2 4.34Å; V24-W246 HydrophobicContact CG1-CG 3.87Å; V24-W246 HydrophobicContact CG2-CD2 3.94Å; V24-W246 HydrophobicContact CG2-CE3 4.19Å; V24-W246 HydrophobicContact CG2-CG 4.31Å; V24-W246 HydrophobicContact CG2-CZ2 4.39Å; F45-W246 AromaticContact CD1-CD1 3.56Å; F45-W246 AromaticContact CE1-CD1 3.41Å; F45-W246 VanDerWaalsContact CE1-CD1 3.41Å; F45-W246 AromaticContact CE1-NE1 3.68Å; F45-W246 AromaticContact CZ-CD1 3.99Å; F45-W246 AromaticContact CZ-NE1 3.95Å; L227-W246 HydrophobicContact CD1-CZ3 4.32Å; L227-W246 HydrophobicContact CD2-CZ3 4.07Å; N242-W246 HydrophobicContact CB-CD2 4.25Å; N242-W246 HydrophobicContact CB-CE3 4.34Å; N242-W246 HydrophobicContact CB-CH2 3.77Å; N242-W246 HydrophobicContact CB-CZ2 3.64Å; N242-W246 HydrophobicContact CB-CZ3 4.12Å; N242-W246 WeakPolarHBondContact O-CB 3.34Å; N242-W246 PolarHBondContact O-N 2.9Å; T243-W246 HydrophobicContact CG2-CE3 4.34Å; T243-W246 HydrophobicContact CG2-CZ3 4.35Å; T243-W246 PolarHBondContact O-N 2.88Å; L244-W246 VanDerWaalsContact C-N 3.3Å; L244-W246 PolarHBondContact O-N 2.84Å; W246-H248 VanDerWaalsContact C-N 3.27Å; W246-H248 PolarHBondContact O-N 2.82Å; W246-P251 HydrophobicContact CD2-CG 4.46Å; W246-P251 HydrophobicContact CE3-CG 3.57Å; W246-P251 HydrophobicContact CZ3-CG 3.81Å
247	G	90.8	Very high	91.3	Very high	5 Å²	5	27.3 Å²	27.3	5%	0.052	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	26.4	-175.3	0	0	0	0	0	113.1	T243 L244 I270	T243-G247 PolarHBondContact O-N 3.45Å; T243-G247 VanDerWaalsContact O-N 3.1Å; L244-G247 PolarHBondContact O-N 3.08Å; L244-G247 VanDerWaalsContact O-N 3.15Å; G247-I270 PolarHBondContact O-N 3.11Å
248	H	93.5	Very high	91.2	Very high	27 Å²	27	28.2 Å²	28.2	13%	0.125	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-150	130.9	-174	-163.5	-84.5	0	0	0	112.4	T243 W246 C250 P251 D266 F268	T243-H248 VanDerWaalsContact CB-O 3.26Å; T243-H248 WeakPolarHBondContact CB-O 3.46Å; T243-H248 PolarHBondContact O-N 3.45Å; T243-H248 VanDerWaalsContact O-N 3.08Å; W246-H248 VanDerWaalsContact C-N 3.27Å; W246-H248 PolarHBondContact O-N 2.82Å; H248-C250 PolarHBondContact CE1-O 3.23Å; H248-C250 PolarHBondContact ND1-N 2.92Å; H248-C250 VanDerWaalsContact ND1-N 3.19Å; H248-C250 PolarHBondContact ND1-O 3.04Å; H248-C250 PolarHBondContact O-N 2.76Å; H248-P251 WeakPolarHBondContact ND1-CA 3.42Å; H248-P251 VanDerWaalsContact ND1-N 3.16Å; H248-D266 IonicContact CD2-OD2 3.97Å; H248-D266 IonicContact NE2-OD1 2.79Å; H248-D266 IonicContact NE2-OD2 3.44Å; H248-D266 PolarHBondContact NE2-OD2 2.8Å; H248-D266 VanDerWaalsContact NE2-OD2 3.1Å; H248-F268 WeakPolarHBondContact CA-O 3.35Å; H248-F268 VanDerWaalsContact CE1-CB 3.46Å; H248-F268 WeakPolarHBondContact CE1-CB 3.11Å; H248-F268 WeakPolarHBondContact NE2-CB 3.27Å
249	L	93	Very high	91.2	Very high	6 Å²	6	27.2 Å²	27.2	3%	0.031	16%	0.157	C	C	.	.	S	Bend	trans	-63.1	-38.2	-175.3	-77.7	173.8	0	0	0	113.9	P206 L217 T219 T243 F268 I270 Y277	P206-L249 HydrophobicContact CB-CD1 3.85Å; P206-L249 HydrophobicContact CG-CD1 3.91Å; L217-L249 HydrophobicContact CD1-CD1 4.5Å; L217-L249 HydrophobicContact CD2-CD2 3.94Å; L217-L249 HydrophobicContact CG-CD2 4.3Å; T219-L249 HydrophobicContact CG2-CD2 4.31Å; T243-L249 WeakPolarHBondContact CG2-O 3.26Å; L249-F268 HydrophobicContact CB-CB 4.27Å; L249-F268 HydrophobicContact CD1-CD1 4.33Å; L249-F268 PolarHBondContact N-O 2.84Å; L249-I270 HydrophobicContact CD2-CD1 4.02Å; L249-I270 HydrophobicContact CD2-CG1 4.36Å; L249-I270 HydrophobicContact CG-CD1 4.2Å; L249-I270 HydrophobicContact CG-CG1 4.09Å; L249-Y277 HydrophobicContact CD2-CE2 3.85Å
250	C	91.8	Very high	91.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.			trans	-156.2	86.6	178.3	-171.5	0	0	0	0	110.6	T223 H248 T252 M253	T223-C250 HydrophobicContact CG2-CB 3.58Å; H248-C250 PolarHBondContact CE1-O 3.23Å; H248-C250 PolarHBondContact ND1-N 2.92Å; H248-C250 VanDerWaalsContact ND1-N 3.19Å; H248-C250 PolarHBondContact ND1-O 3.04Å; H248-C250 PolarHBondContact O-N 2.76Å; C250-T252 PolarHBondContact O-N 2.88Å; C250-T252 VanDerWaalsContact O-N 3.17Å; C250-T252 PolarHBondContact SG-OG1 2.9Å; C250-M253 HydrophobicContact CB-CE 3.7Å; C250-M253 HydrophobicContact CB-CG 4.11Å; C250-M253 HydrophobicContact CB-SD 4.16Å; C250-M253 PolarHBondContact O-N 3.44Å
251	P	91.1	Very high	91	Very high	6 Å²	6	38.2 Å²	38.2	4%	0.039	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.8	-176.4	24.5	-35.7	0	0	0	114	G23 V24 L227 W246 H248 M253	G23-P251 CarbonylContact C-O 3.5Å; G23-P251 VanDerWaalsContact CA-O 3.24Å; G23-P251 WeakPolarHBondContact CA-O 3.5Å; V24-P251 HydrophobicContact CG2-CB 3.83Å; V24-P251 HydrophobicContact CG2-CG 3.73Å; L227-P251 HydrophobicContact CD2-CG 4.13Å; W246-P251 HydrophobicContact CD2-CG 4.46Å; W246-P251 HydrophobicContact CE3-CG 3.57Å; W246-P251 HydrophobicContact CZ3-CG 3.81Å; H248-P251 WeakPolarHBondContact ND1-CA 3.42Å; H248-P251 VanDerWaalsContact ND1-N 3.16Å; P251-M253 PolarHBondContact O-N 2.99Å
252	T	89.4	Confident	90.9	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-3.6	179.3	49.7	0	0	0	0	113.7	D226 L227 C250 D255 T256	D226-T252 WeakPolarHBondContact OD2-CB 3.43Å; D226-T252 PolarHBondContact OD2-OG1 3.25Å; L227-T252 HydrophobicContact CD2-CG2 3.73Å; C250-T252 PolarHBondContact O-N 2.88Å; C250-T252 VanDerWaalsContact O-N 3.17Å; C250-T252 PolarHBondContact SG-OG1 2.9Å; T252-D255 PolarHBondContact O-N 2.91Å; T252-T256 VanDerWaalsContact CB-OG1 3.27Å; T252-T256 WeakPolarHBondContact CB-OG1 3.4Å; T252-T256 PolarHBondContact O-N 3.15Å; T252-T256 VanDerWaalsContact O-N 3.09Å; T252-T256 PolarHBondContact O-OG1 2.82Å
253	M	89.7	Confident	90.7	Very high	19 Å²	19	49.4 Å²	49.4	9%	0.094	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	138.8	170.2	-64.6	-173.3	-56	0	0	110.6	L181 C250 P251 L257 C259 F268	L181-M253 HydrophobicContact CB-SD 3.99Å; L181-M253 HydrophobicContact CD1-SD 3.6Å; L181-M253 HydrophobicContact CG-SD 4.43Å; C250-M253 HydrophobicContact CB-CE 3.7Å; C250-M253 HydrophobicContact CB-CG 4.11Å; C250-M253 HydrophobicContact CB-SD 4.16Å; C250-M253 PolarHBondContact O-N 3.44Å; P251-M253 PolarHBondContact O-N 2.99Å; M253-L257 HydrophobicContact CG-CB 3.82Å; M253-L257 HydrophobicContact CG-CD2 4.13Å; M253-L257 HydrophobicContact CG-CG 4.1Å; M253-L257 WeakPolarHBondContact CG-O 3.47Å; M253-L257 HydrophobicContact SD-CD2 3.97Å; M253-L257 HydrophobicContact SD-CG 4.19Å; M253-C259 HydrophobicContact CB-CB 4.11Å; M253-C259 HydrophobicContact CG-CB 4.4Å; M253-C259 HydrophobicContact SD-CB 3.91Å; M253-F268 HydrophobicContact CE-CB 4.06Å; M253-F268 HydrophobicContact CE-CD1 3.52Å; M253-F268 HydrophobicContact CE-CD2 3.29Å; M253-F268 HydrophobicContact CE-CE1 3.66Å; M253-F268 HydrophobicContact CE-CE2 3.45Å; M253-F268 VanDerWaalsContact CE-CE2 3.45Å; M253-F268 HydrophobicContact CE-CG 3.32Å; M253-F268 HydrophobicContact CE-CZ 3.62Å; M253-F268 HydrophobicContact SD-CE1 4.47Å; M253-F268 HydrophobicContact SD-CE2 4.32Å; M253-F268 HydrophobicContact SD-CZ 4.21Å
254	P	90.2	Very high	90.4	Very high	87 Å²	87	55.3 Å²	55.3	57%	0.565	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.1	-2.8	3.4	33.5	-35.5	0	0	0	115.5	T256 L257	P254-T256 PolarHBondContact O-N 3.34Å; P254-L257 CarbonylContact C-O 3.53Å; P254-L257 WeakPolarHBondContact CA-O 3.46Å
255	D	88.8	Confident	90.2	Very high	105 Å²	105	59.1 Å²	59.1	56%	0.561	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-42.7	-163.8	-68	-29.7	0	0	0	114.6	L22 T252	L22-D255 HydrophobicContact CD2-CB 3.62Å; L22-D255 WeakPolarHBondContact CD2-OD2 3.47Å; L22-D255 VanDerWaalsContact CG-OD2 3.32Å; L22-D255 WeakPolarHBondContact CG-OD2 3.41Å; T252-D255 PolarHBondContact O-N 2.91Å
256	T	89.2	Confident	90.4	Very high	65 Å²	65	58.9 Å²	58.9	40%	0.399	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-28.4	-179.9	52.5	0	0	0	0	113.3	D226 T252 P254	D226-T256 VanDerWaalsContact CG-OG1 3.24Å; D226-T256 VanDerWaalsContact OD1-CB 3.32Å; D226-T256 WeakPolarHBondContact OD1-CB 3.21Å; D226-T256 PolarHBondContact OD1-OG1 3.43Å; D226-T256 PolarHBondContact OD2-OG1 3.03Å; T252-T256 VanDerWaalsContact CB-OG1 3.27Å; T252-T256 WeakPolarHBondContact CB-OG1 3.4Å; T252-T256 PolarHBondContact O-N 3.15Å; T252-T256 VanDerWaalsContact O-N 3.09Å; T252-T256 PolarHBondContact O-OG1 2.82Å; P254-T256 PolarHBondContact O-N 3.34Å
257	L	90.6	Very high	90.5	Very high	31 Å²	31	60.6 Å²	60.6	16%	0.162	34%	0.336	C	S	.	.	S	Bend	trans	-118.9	124.4	175.5	-177.6	64.6	0	0	0	109.8	L181 Q222 T223 D226 M253 P254 C259	L181-L257 HydrophobicContact CD1-CD2 3.54Å; L181-L257 HydrophobicContact CD1-CG 4.17Å; Q222-L257 HydrophobicContact CB-CD1 4.4Å; Q222-L257 HydrophobicContact CB-CD2 4.35Å; T223-L257 HydrophobicContact CG2-CD2 4.23Å; D226-L257 HydrophobicContact CB-CB 4.12Å; D226-L257 HydrophobicContact CB-CD2 4.18Å; M253-L257 HydrophobicContact CG-CB 3.82Å; M253-L257 HydrophobicContact CG-CD2 4.13Å; M253-L257 HydrophobicContact CG-CG 4.1Å; M253-L257 WeakPolarHBondContact CG-O 3.47Å; M253-L257 HydrophobicContact SD-CD2 3.97Å; M253-L257 HydrophobicContact SD-CG 4.19Å; P254-L257 CarbonylContact C-O 3.53Å; P254-L257 WeakPolarHBondContact CA-O 3.46Å; L257-C259 PolarHBondContact O-N 2.74Å
258	G	91.3	Very high	90.7	Very high	32 Å²	32	60.6 Å²	60.6	33%	0.33	33%	0.334	S	S	.	.			trans	-68.1	126.6	-176	0	0	0	0	0	112.5	L180 L181	L180-G258 WeakPolarHBondContact CA-O 3.36Å; L181-G258 PolarHBondContact N-O 3.18Å
259	C	93.2	Very high	90.7	Very high	24 Å²	24	63 Å²	63	16%	0.162	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-124.3	164.2	171.6	71	0	0	0	0	111.7	L181 M253 L257 F268	L181-C259 CarbonylContact O-C 3.58Å; L181-C259 WeakPolarHBondContact O-CA 3.12Å; L181-C259 WeakPolarHBondContact O-CB 3.27Å; M253-C259 HydrophobicContact CB-CB 4.11Å; M253-C259 HydrophobicContact CG-CB 4.4Å; M253-C259 HydrophobicContact SD-CB 3.91Å; L257-C259 PolarHBondContact O-N 2.74Å; C259-F268 HydrophobicContact CB-CE2 4Å; C259-F268 HydrophobicContact CB-CZ 4.36Å
260	Y	92.5	Very high	90.7	Very high	134 Å²	134	63.2 Å²	63.2	53%	0.525	35%	0.348	S	S	.	.			trans	-68.8	134.2	171	-174.8	-92.6	0	0	0	109.8	L181 Y262	L181-Y260 PolarHBondContact O-N 3.13Å; Y260-Y262 VanDerWaalsContact C-N 3.35Å; Y260-Y262 HydrophobicContact CD1-CD1 4.18Å; Y260-Y262 AromaticContact CD1-CD2 3.98Å; Y260-Y262 HydrophobicContact CD1-CD2 3.98Å; Y260-Y262 HydrophobicContact CD1-CE1 4.09Å; Y260-Y262 AromaticContact CD1-CE2 3.87Å; Y260-Y262 HydrophobicContact CD1-CE2 3.87Å; Y260-Y262 HydrophobicContact CD1-CG 4.12Å; Y260-Y262 AromaticContact CD1-CZ 3.93Å; Y260-Y262 HydrophobicContact CG-CE2 4.33Å; Y260-Y262 VanDerWaalsContact O-CD2 3.22Å; Y260-Y262 WeakPolarHBondContact O-CD2 3.4Å; Y260-Y262 PolarHBondContact O-N 3.01Å
261	P	91.2	Very high	90.6	Very high	101 Å²	101	70.7 Å²	70.7	66%	0.656	38%	0.377	S	S	*	.			trans	-76.2	83.9	-177.4	31.7	-35.2	0	0	0	110.8
262	Y	89.2	Confident	90.6	Very high	106 Å²	106	75.1 Å²	75.1	42%	0.416	40%	0.397	S	S	.	.			trans	-69.1	137.5	173.2	-71.8	-84.2	0	0	0	111.1	P182 Y260 D265 P267	P182-Y262 WeakPolarHBondContact CD-OH 3.41Å; P182-Y262 HydrophobicContact CG-CE2 4.31Å; P182-Y262 WeakPolarHBondContact CG-OH 3.37Å; Y260-Y262 VanDerWaalsContact C-N 3.35Å; Y260-Y262 HydrophobicContact CD1-CD1 4.18Å; Y260-Y262 AromaticContact CD1-CD2 3.98Å; Y260-Y262 HydrophobicContact CD1-CD2 3.98Å; Y260-Y262 HydrophobicContact CD1-CE1 4.09Å; Y260-Y262 AromaticContact CD1-CE2 3.87Å; Y260-Y262 HydrophobicContact CD1-CE2 3.87Å; Y260-Y262 HydrophobicContact CD1-CG 4.12Å; Y260-Y262 AromaticContact CD1-CZ 3.93Å; Y260-Y262 HydrophobicContact CG-CE2 4.33Å; Y260-Y262 VanDerWaalsContact O-CD2 3.22Å; Y260-Y262 WeakPolarHBondContact O-CD2 3.4Å; Y260-Y262 PolarHBondContact O-N 3.01Å; Y262-D265 WeakPolarHBondContact CB-O 3.38Å; Y262-P267 HydrophobicContact CD2-CG 3.93Å; Y262-P267 HydrophobicContact CE2-CG 3.52Å
263	E	85	Confident	90.7	Very high	202 Å²	202	75.3 Å²	75.3	94%	0.944	40%	0.398	S	S	*	.	S	Bend	trans	-87	-38.2	-177.6	-64.8	-177.4	176.2	0	0	113.3
264	S	86.9	Confident	91	Very high	123 Å²	123	74.5 Å²	74.5	86%	0.86	39%	0.394	S	S	*	.	S	Bend	trans	-122.2	-40.5	-165	60.5	0	0	0	0	115
265	D	89.2	Confident	91.2	Very high	82 Å²	82	70.5 Å²	70.5	44%	0.439	37%	0.368	S	S	.	.			trans	-130	125	-175.4	-169	33.9	0	0	0	109.7	Y262 P267 R271	Y262-D265 WeakPolarHBondContact CB-O 3.38Å; D265-P267 WeakPolarHBondContact O-CD 3.37Å; D265-R271 IonicContact OD1-CZ 3.88Å; D265-R271 IonicContact OD1-NH2 3.39Å; D265-R271 PolarHBondContact OD1-NH2 3.11Å; D265-R271 IonicContact OD2-NH2 2.66Å
266	D	92	Very high	91.6	Very high	59 Å²	59	65.5 Å²	65.5	32%	0.316	34%	0.341	S	S	.	.			trans	-90.4	112.6	179	-174.9	-17.7	0	0	0	109.2	H248 F268 I269	H248-D266 IonicContact CD2-OD2 3.97Å; H248-D266 IonicContact NE2-OD1 2.79Å; H248-D266 IonicContact NE2-OD2 3.44Å; H248-D266 PolarHBondContact NE2-OD2 2.8Å; H248-D266 VanDerWaalsContact NE2-OD2 3.1Å; D266-F268 PolarHBondContact O-N 3.47Å; D266-F268 WeakPolarHBondContact OD1-CB 3.41Å; D266-F268 WeakPolarHBondContact OD1-CD2 3.3Å; D266-F268 PolarHBondContact OD1-N 3.31Å; D266-I269 HydrophobicContact CB-CD1 3.83Å; D266-I269 HydrophobicContact CB-CG1 3.99Å; D266-I269 PolarHBondContact O-N 2.6Å
267	P	92.6	Very high	91.9	Very high	57 Å²	57	62.4 Å²	62.4	37%	0.37	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-9.1	-177.5	32.5	-37.9	0	0	0	113.4	Y262 D265	Y262-P267 HydrophobicContact CD2-CG 3.93Å; Y262-P267 HydrophobicContact CE2-CG 3.52Å; D265-P267 WeakPolarHBondContact O-CD 3.37Å
268	F	94.4	Very high	92.3	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.022	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-5.9	-177.5	-56	-68.2	0	0	0	113.3	L181 P206 H248 L249 M253 C259 D266 I270	L181-F268 HydrophobicContact CB-CE1 3.92Å; L181-F268 HydrophobicContact CB-CZ 3.63Å; P206-F268 HydrophobicContact CG-CD1 4.39Å; P206-F268 HydrophobicContact CG-CE1 4.29Å; H248-F268 WeakPolarHBondContact CA-O 3.35Å; H248-F268 VanDerWaalsContact CE1-CB 3.46Å; H248-F268 WeakPolarHBondContact CE1-CB 3.11Å; H248-F268 WeakPolarHBondContact NE2-CB 3.27Å; L249-F268 HydrophobicContact CB-CB 4.27Å; L249-F268 HydrophobicContact CD1-CD1 4.33Å; L249-F268 PolarHBondContact N-O 2.84Å; M253-F268 HydrophobicContact CE-CB 4.06Å; M253-F268 HydrophobicContact CE-CD1 3.52Å; M253-F268 HydrophobicContact CE-CD2 3.29Å; M253-F268 HydrophobicContact CE-CE1 3.66Å; M253-F268 HydrophobicContact CE-CE2 3.45Å; M253-F268 VanDerWaalsContact CE-CE2 3.45Å; M253-F268 HydrophobicContact CE-CG 3.32Å; M253-F268 HydrophobicContact CE-CZ 3.62Å; M253-F268 HydrophobicContact SD-CE1 4.47Å; M253-F268 HydrophobicContact SD-CE2 4.32Å; M253-F268 HydrophobicContact SD-CZ 4.21Å; C259-F268 HydrophobicContact CB-CE2 4Å; C259-F268 HydrophobicContact CB-CZ 4.36Å; D266-F268 PolarHBondContact O-N 3.47Å; D266-F268 WeakPolarHBondContact OD1-CB 3.41Å; D266-F268 WeakPolarHBondContact OD1-CD2 3.3Å; D266-F268 PolarHBondContact OD1-N 3.31Å; F268-I270 PolarHBondContact O-N 2.89Å
269	I	93.5	Very high	92.6	Very high	78 Å²	78	59.4 Å²	59.4	40%	0.4	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-68.2	125.6	173	-63.9	173	0	0	0	110	D266 R271	D266-I269 HydrophobicContact CB-CD1 3.83Å; D266-I269 HydrophobicContact CB-CG1 3.99Å; D266-I269 PolarHBondContact O-N 2.6Å; I269-R271 HydrophobicContact CG2-CG 4.2Å; I269-R271 PolarHBondContact O-N 3.28Å
270	I	93.1	Very high	92.8	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.051	29%	0.291	C	S	.	.			trans	-85.9	93.2	177.3	-54	178.1	0	0	0	108.3	A48 L217 L244 G247 L249 F268 Q272	A48-I270 HydrophobicContact CB-CG2 4.44Å; A48-I270 WeakPolarHBondContact CB-O 3.42Å; L217-I270 HydrophobicContact CD2-CD1 4.44Å; L244-I270 HydrophobicContact CD2-CD1 3.88Å; G247-I270 PolarHBondContact O-N 3.11Å; L249-I270 HydrophobicContact CD2-CD1 4.02Å; L249-I270 HydrophobicContact CD2-CG1 4.36Å; L249-I270 HydrophobicContact CG-CD1 4.2Å; L249-I270 HydrophobicContact CG-CG1 4.09Å; F268-I270 PolarHBondContact O-N 2.89Å; I270-Q272 WeakPolarHBondContact CG2-O 3.31Å
271	R	89.9	Confident	93	Very high	157 Å²	157	52.8 Å²	52.8	59%	0.592	27%	0.271	S	S	*	.			trans	-73.3	-39.9	-179	-63	179.6	-179.3	-86.8	1.9	112.6	S49 D265 I269	S49-R271 WeakPolarHBondContact CB-O 3.32Å; S49-R271 PolarHBondContact N-O 3.14Å; D265-R271 IonicContact OD1-CZ 3.88Å; D265-R271 IonicContact OD1-NH2 3.39Å; D265-R271 PolarHBondContact OD1-NH2 3.11Å; D265-R271 IonicContact OD2-NH2 2.66Å; I269-R271 HydrophobicContact CG2-CG 4.2Å; I269-R271 PolarHBondContact O-N 3.28Å
272	Q	90.4	Very high	93.3	Very high	100 Å²	100	48.2 Å²	48.2	47%	0.467	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-128	140	179.6	-172.1	-180	9.8	0	0	109.6	S49 P50 I270	S49-Q272 WeakPolarHBondContact O-CA 3.24Å; P50-Q272 WeakPolarHBondContact O-CG 3.35Å; P50-Q272 PolarHBondContact O-NE2 3.29Å; I270-Q272 WeakPolarHBondContact CG2-O 3.31Å
273	L	92.8	Very high	93.5	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.026	25%	0.25	C	C	.	.			trans	-67.3	130.5	176.4	-64.2	174.7	0	0	0	111.1	A48 S49 S51 L244 L292 V302	A48-L273 HydrophobicContact CB-CD2 3.64Å; A48-L273 HydrophobicContact CB-CG 3.9Å; S49-L273 WeakPolarHBondContact O-CG 3.26Å; S49-L273 PolarHBondContact O-N 3.42Å; S51-L273 WeakPolarHBondContact CA-O 3.44Å; S51-L273 VanDerWaalsContact CB-O 3.27Å; S51-L273 WeakPolarHBondContact CB-O 3.5Å; L244-L273 HydrophobicContact CD2-CD2 4.42Å; L273-L292 HydrophobicContact CD1-CD1 3.56Å; L273-L292 HydrophobicContact CD2-CD1 3.4Å; L273-L292 VanDerWaalsContact CD2-CD1 3.4Å; L273-L292 HydrophobicContact CG-CD1 4.11Å; L273-V302 HydrophobicContact CB-CG2 4.36Å
274	P	94.5	Very high	94	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.013	23%	0.228	C	C	.	.			trans	-74.7	160.2	170.2	34.9	-36.9	0	0	0	110.1	T215 L217 L244 V302	T215-P274 HydrophobicContact CG2-CB 4.45Å; L217-P274 HydrophobicContact CB-CB 3.61Å; L217-P274 HydrophobicContact CB-CG 3.8Å; L217-P274 HydrophobicContact CD2-CG 3.98Å; L244-P274 HydrophobicContact CD2-CG 4.45Å; P274-V302 HydrophobicContact CG-CG1 4.2Å; P274-V302 WeakPolarHBondContact O-CG1 3.48Å; P274-V302 VanDerWaalsContact O-CG2 3.32Å; P274-V302 WeakPolarHBondContact O-CG2 3.32Å
275	H	94.7	Very high	94.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	20%	0.198	C	C	.	.	S	Bend	trans	-78.6	-35.5	169.1	-51.4	99	0	0	0	110.9	S52 I214 T215 R303 L324	S52-H275 PolarHBondContact O-NE2 3.42Å; S52-H275 PolarHBondContact OG-CE1 3.29Å; S52-H275 PolarHBondContact OG-NE2 2.87Å; I214-H275 HydrophobicContact CG2-CB 3.77Å; T215-H275 PolarHBondContact N-CE1 3.06Å; T215-H275 PolarHBondContact N-ND1 3.21Å; T215-H275 PolarHBondContact O-N 3.07Å; H275-R303 PolarHBondContact O-N 3.34Å; H275-L324 HydrophobicContact CB-CD1 4.09Å
276	V	96.6	Very high	94.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123	177.3	-175.8	0	0	0	0	109.1	I214 T215 F216 L217 R303 V319 L324	I214-V276 HydrophobicContact CG2-CG2 4.21Å; T215-V276 PolarHBondContact O-N 3.23Å; F216-V276 WeakPolarHBondContact CA-O 3.49Å; F216-V276 HydrophobicContact CD1-CB 3.65Å; F216-V276 HydrophobicContact CD1-CG1 3.78Å; F216-V276 HydrophobicContact CD1-CG2 4.16Å; F216-V276 HydrophobicContact CE1-CB 3.79Å; F216-V276 HydrophobicContact CE1-CG1 3.82Å; F216-V276 HydrophobicContact CE1-CG2 3.81Å; F216-V276 HydrophobicContact CG-CB 4.25Å; F216-V276 HydrophobicContact CZ-CB 4.47Å; F216-V276 HydrophobicContact CZ-CG2 4.07Å; L217-V276 PolarHBondContact N-O 2.88Å; V276-R303 CarbonylContact C-O 3.38Å; V276-R303 WeakPolarHBondContact CA-O 3.4Å; V276-R303 HydrophobicContact CG1-CG 4.35Å; V276-R303 HydrophobicContact CG2-CB 4.21Å; V276-V319 HydrophobicContact CG2-CG1 4.3Å; V276-L324 HydrophobicContact CG2-CD2 3.99Å
277	Y	97.4	Very high	95.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	116.5	172.1	177.9	-144.5	0	0	0	110	L217 M240 T243 L244 L249 R303 L304 L305	L217-Y277 HydrophobicContact CB-CD2 4.36Å; L217-Y277 HydrophobicContact CD2-CD2 4.32Å; L217-Y277 HydrophobicContact CG-CD2 4.12Å; L217-Y277 HydrophobicContact CG-CE2 4.44Å; L217-Y277 CarbonylContact O-C 3.53Å; L217-Y277 VanDerWaalsContact O-CA 3.25Å; L217-Y277 WeakPolarHBondContact O-CA 3.32Å; L217-Y277 WeakPolarHBondContact O-CD2 3.14Å; M240-Y277 HydrophobicContact CB-CD1 4.13Å; M240-Y277 HydrophobicContact CB-CE1 3.75Å; M240-Y277 HydrophobicContact CE-CD1 3.74Å; M240-Y277 HydrophobicContact CE-CD2 4.4Å; M240-Y277 HydrophobicContact CE-CE1 3.92Å; M240-Y277 HydrophobicContact CE-CG 3.99Å; M240-Y277 WeakPolarHBondContact CE-O 3.37Å; M240-Y277 HydrophobicContact CG-CE1 4.05Å; T243-Y277 VanDerWaalsContact OG1-CE1 3.32Å; T243-Y277 WeakPolarHBondContact OG1-CE1 3.47Å; T243-Y277 PolarHBondContact OG1-OH 3.27Å; L244-Y277 HydrophobicContact CD1-CD1 4.11Å; L244-Y277 HydrophobicContact CD2-CD1 4.03Å; L244-Y277 HydrophobicContact CD2-CE1 4.48Å; L244-Y277 HydrophobicContact CG-CD1 3.94Å; L244-Y277 HydrophobicContact CG-CE1 4.33Å; L249-Y277 HydrophobicContact CD2-CE2 3.85Å; Y277-R303 PolarHBondContact N-O 3.15Å; Y277-L304 HydrophobicContact CD1-CD2 3.69Å; Y277-L304 HydrophobicContact CG-CD2 4.29Å; Y277-L304 CarbonylContact O-C 3.57Å; Y277-L304 WeakPolarHBondContact O-CA 3.15Å; Y277-L305 PolarHBondContact O-N 2.9Å
278	F	98.1	Very high	95.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	144.1	-179.2	68.3	-92.4	0	0	0	113.4	L68 I115 A117 M170 F216 L217 G218 T219 L305 L307	L68-F278 HydrophobicContact CD1-CB 4.28Å; L68-F278 HydrophobicContact CD1-CD1 4.21Å; L68-F278 HydrophobicContact CD1-CG 4.26Å; L68-F278 HydrophobicContact CD2-CE1 4.48Å; I115-F278 HydrophobicContact CG2-CZ 4.19Å; A117-F278 HydrophobicContact CB-CD2 4.31Å; A117-F278 HydrophobicContact CB-CE2 3.66Å; M170-F278 HydrophobicContact CE-CE2 4.29Å; M170-F278 HydrophobicContact CE-CZ 4.43Å; M170-F278 HydrophobicContact SD-CE2 3.85Å; M170-F278 HydrophobicContact SD-CZ 3.76Å; F216-F278 HydrophobicContact CB-CE1 4.45Å; L217-F278 WeakPolarHBondContact O-CD1 3.32Å; L217-F278 PolarHBondContact O-N 3.26Å; G218-F278 WeakPolarHBondContact CA-O 3.4Å; T219-F278 PolarHBondContact N-O 2.97Å; T219-F278 VanDerWaalsContact N-O 3.11Å; F278-L305 CarbonylContact C-O 3.57Å; F278-L305 VanDerWaalsContact CA-O 3.25Å; F278-L305 WeakPolarHBondContact CA-O 3.34Å; F278-L305 HydrophobicContact CB-CB 4.02Å; F278-L305 HydrophobicContact CB-CD2 4.34Å; F278-L307 HydrophobicContact CB-CD1 4.46Å; F278-L307 HydrophobicContact CD2-CD1 4.34Å
279	A	98	Very high	95.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.2	169.7	0	0	0	0	0	108.7	I224 M240 Q282 L305 L307	I224-A279 HydrophobicContact CB-CB 4.34Å; I224-A279 HydrophobicContact CG1-CB 3.65Å; M240-A279 HydrophobicContact CE-CB 3.91Å; M240-A279 HydrophobicContact CG-CB 4.31Å; M240-A279 HydrophobicContact SD-CB 3.67Å; A279-Q282 HydrophobicContact CB-CG 4.04Å; A279-Q282 WeakPolarHBondContact O-CG 3.37Å; A279-L305 PolarHBondContact N-O 2.89Å; A279-L307 PolarHBondContact O-N 3.41Å
280	A	97.6	Very high	95	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	168.6	179.3	0	0	0	0	0	113.3	C70 A117 T219 G221 Q282 L307	C70-A280 HydrophobicContact CB-CB 3.52Å; A117-A280 HydrophobicContact CB-CB 3.48Å; A117-A280 VanDerWaalsContact CB-CB 3.48Å; A117-A280 WeakPolarHBondContact O-CB 3.39Å; T219-A280 PolarHBondContact O-N 3.11Å; G221-A280 WeakPolarHBondContact CA-O 3.17Å; A280-Q282 PolarHBondContact O-N 2.93Å; A280-Q282 VanDerWaalsContact O-N 3.16Å; A280-Q282 PolarHBondContact O-NE2 3.34Å; A280-L307 CarbonylContact C-O 3.3Å
281	N	96.3	Very high	94.7	Very high	20 Å²	20	37 Å²	37	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.1	31.8	176.2	-55.8	-74.7	0	0	0	114.5	C70 G71 A117 N119 S220 L307	C70-N281 PolarHBondContact SG-N 3.46Å; G71-N281 WeakPolarHBondContact CA-OD1 3.25Å; G71-N281 PolarHBondContact N-OD1 3.03Å; A117-N281 PolarHBondContact O-ND2 3.33Å; N119-N281 WeakPolarHBondContact CB-OD1 3.5Å; N119-N281 PolarHBondContact ND2-ND2 3.44Å; N119-N281 PolarHBondContact ND2-OD1 3.21Å; N119-N281 VanDerWaalsContact ND2-OD1 3.1Å; S220-N281 PolarHBondContact O-ND2 2.97Å; N281-L307 PolarHBondContact N-O 3.33Å
282	Q	96.5	Very high	94.3	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.019	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	164.9	178.7	-63.5	-55.4	-69.4	0	0	111.9	D225 A279 A280 A284 S306 L307 P308	D225-Q282 PolarHBondContact OD1-NE2 2.96Å; A279-Q282 HydrophobicContact CB-CG 4.04Å; A279-Q282 WeakPolarHBondContact O-CG 3.37Å; A280-Q282 PolarHBondContact O-N 2.93Å; A280-Q282 VanDerWaalsContact O-N 3.16Å; A280-Q282 PolarHBondContact O-NE2 3.34Å; Q282-A284 VanDerWaalsContact C-N 3.31Å; Q282-A284 PolarHBondContact O-N 3.09Å; Q282-S306 WeakPolarHBondContact CB-OG 3.4Å; Q282-S306 WeakPolarHBondContact CG-OG 3.27Å; Q282-L307 PolarHBondContact N-O 3.45Å; Q282-P308 WeakPolarHBondContact O-CA 3.14Å; Q282-P308 WeakPolarHBondContact O-CB 3.42Å
283	P	94.7	Very high	93.1	Very high	94 Å²	94	30.3 Å²	30.3	61%	0.61	19%	0.191	S	C	*	.	S	Bend	trans	-65.8	-29.6	-178	-24.6	35.3	0	0	0	114.7
284	A	95.2	Very high	91.7	Very high	58 Å²	58	34.5 Å²	34.5	48%	0.479	24%	0.236	S	C	.	.	S	Bend	trans	-147	154	-175.5	0	0	0	0	0	112.2	Q282 S306	Q282-A284 VanDerWaalsContact C-N 3.31Å; Q282-A284 PolarHBondContact O-N 3.09Å; A284-S306 PolarHBondContact O-OG 3.09Å
285	F	96.8	Very high	90.1	Very high	52 Å²	52	36.4 Å²	36.4	23%	0.228	25%	0.251	C	S	.	.			trans	-71.2	127.5	170.3	-178.2	-91.7	0	0	0	110.4	L305 S306 L307 P308 Y315 A317 V326 P328	F285-L305 HydrophobicContact CE2-CD1 3.76Å; F285-L305 HydrophobicContact CZ-CD1 3.96Å; F285-S306 WeakPolarHBondContact CA-O 3.41Å; F285-L307 HydrophobicContact CD2-CD2 4.38Å; F285-L307 HydrophobicContact CE2-CD2 4.32Å; F285-P308 HydrophobicContact CB-CG 3.98Å; F285-Y315 HydrophobicContact CB-CD1 3.89Å; F285-Y315 HydrophobicContact CB-CE1 4.15Å; F285-Y315 HydrophobicContact CB-CG 4.42Å; F285-Y315 HydrophobicContact CD2-CD1 4.24Å; F285-Y315 HydrophobicContact CG-CD1 4Å; F285-Y315 HydrophobicContact CG-CE1 4.38Å; F285-A317 HydrophobicContact CE2-CB 3.84Å; F285-V326 HydrophobicContact CE2-CG1 4.41Å; F285-V326 HydrophobicContact CZ-CG1 3.94Å; F285-P328 HydrophobicContact CD1-CB 4.28Å; F285-P328 HydrophobicContact CE1-CB 3.9Å; F285-P328 HydrophobicContact CE1-CG 4.14Å; F285-P328 HydrophobicContact CE2-CB 4.27Å; F285-P328 HydrophobicContact CZ-CB 3.89Å; F285-P328 HydrophobicContact CZ-CG 4.42Å
286	S	96.6	Very high	88.2	Confident	44 Å²	44	41.7 Å²	41.7	31%	0.308	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	143.4	172.5	-172.3	0	0	0	0	110.2	I237 S306	I237-S286 VanDerWaalsContact CG1-OG 3.26Å; I237-S286 WeakPolarHBondContact CG1-OG 3.46Å; S286-S306 PolarHBondContact N-O 3.38Å; S286-S306 VanDerWaalsContact N-O 3.09Å; S286-S306 PolarHBondContact O-N 3.33Å
287	S	96.4	Very high	86.6	Confident	41 Å²	41	47.6 Å²	47.6	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136	179.5	176.1	0	0	0	0	109.5	R303 L304	S287-R303 WeakPolarHBondContact OG-CD 3.42Å; S287-R303 PolarHBondContact OG-NH1 2.87Å; S287-L304 WeakPolarHBondContact CA-O 3.26Å
288	S	95.9	Very high	84.9	Confident	39 Å²	39	51.9 Å²	51.9	27%	0.273	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.4	176.8	-168.4	0	0	0	0	111.1	C290 R303 L304	S288-C290 PolarHBondContact OG-SG 3.13Å; S288-R303 VanDerWaalsContact C-NH1 3.29Å; S288-L304 PolarHBondContact N-O 3.08Å; S288-L304 PolarHBondContact O-N 3.43Å
289	F	94.2	Very high	83.7	Confident	91 Å²	91	54.1 Å²	54.1	40%	0.399	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	105.9	174.4	-162.1	-130.2	0	0	0	107.8	H301 R303 L324	F289-H301 HydrophobicContact CE1-CB 3.82Å; F289-H301 AromaticContact CE1-CD2 3.85Å; F289-H301 HydrophobicContact CE2-CB 3.81Å; F289-H301 HydrophobicContact CZ-CB 3.41Å; F289-H301 VanDerWaalsContact CZ-CB 3.41Å; F289-R303 HydrophobicContact CD2-CB 4.18Å; F289-L324 HydrophobicContact CE2-CD1 4.04Å
290	C	89.9	Confident	82.8	Confident	24 Å²	24	54.5 Å²	54.5	16%	0.162	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.7	-171.3	-61.3	0	0	0	0	110.7	L241 S288 H301 V302 L304	L241-C290 HydrophobicContact CD1-CB 4.01Å; S288-C290 PolarHBondContact OG-SG 3.13Å; C290-H301 WeakPolarHBondContact O-CA 3.32Å; C290-V302 PolarHBondContact N-O 3.33Å; C290-V302 VanDerWaalsContact N-O 3.08Å; C290-V302 PolarHBondContact O-N 3.4Å; C290-L304 HydrophobicContact CB-CD1 4.47Å
291	A	85.2	Confident	82.4	Confident	44 Å²	44	57.9 Å²	57.9	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	143.8	160.3	0	0	0	0	0	109.6
292	L	81.5	Confident	82.3	Confident	24 Å²	24	57 Å²	57	13%	0.126	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-71.6	136.8	169.1	-72.4	176.2	0	0	0	110.7	L241 L244 K245 L273 G294 A295 T300	L241-L292 HydrophobicContact CD1-CD2 3.84Å; L244-L292 HydrophobicContact CB-CD1 4.43Å; L244-L292 HydrophobicContact CB-CD2 3.84Å; K245-L292 HydrophobicContact CG-CD2 3.92Å; L273-L292 HydrophobicContact CD1-CD1 3.56Å; L273-L292 HydrophobicContact CD2-CD1 3.4Å; L273-L292 VanDerWaalsContact CD2-CD1 3.4Å; L273-L292 HydrophobicContact CG-CD1 4.11Å; L292-G294 PolarHBondContact O-N 3.44Å; L292-A295 PolarHBondContact O-N 3.11Å; L292-T300 PolarHBondContact N-O 3.42Å
293	P	67.3	Low	82.3	Confident	93 Å²	93	58.4 Å²	58.4	60%	0.604	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	134.3	177.2	-19.7	31	0	0	0	110.9	K245	K245-P293 HydrophobicContact CD-CG 4.45Å; K245-P293 VanDerWaalsContact CE-CD 3.48Å; K245-P293 VanDerWaalsContact CE-CG 3.49Å
294	G	63.2	Low	82.4	Confident	93 Å²	93	54 Å²	54	96%	0.959	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-2.4	178.9	0	0	0	0	0	114.9	L292	L292-G294 PolarHBondContact O-N 3.44Å
295	A	59.6	Low	82.5	Confident	42 Å²	42	51.2 Å²	51.2	35%	0.347	33%	0.331	S	S	.	.			trans	-95.6	119.9	173.5	0	0	0	0	0	111.9	L292 T300	L292-A295 PolarHBondContact O-N 3.11Å; A295-T300 HydrophobicContact CB-CG2 3.32Å; A295-T300 WeakPolarHBondContact CB-OG1 3.49Å
296	A	54.5	Low	82.5	Confident	112 Å²	112	48.8 Å²	48.8	93%	0.926	32%	0.321	S	S	*	.			trans	-84.2	-14.6	173.9	0	0	0	0	0	112.9
297	E	63.2	Low	82.6	Confident	125 Å²	125	46.9 Å²	46.9	58%	0.584	31%	0.308	S	S	*	.	S	Bend	trans	-96.3	142.9	-171.9	-63.3	-179	-175.6	0	0	112.1	N299 T300	E297-N299 PolarHBondContact O-N 3.04Å; E297-T300 PolarHBondContact O-N 3.07Å; E297-T300 PolarHBondContact O-OG1 3.41Å
298	S	62	Low	82.6	Confident	90 Å²	90	45.2 Å²	45.2	63%	0.629	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-58	-29.4	-179.5	50.7	0	0	0	0	113.7	T300 H301	S298-T300 PolarHBondContact O-N 3.48Å; S298-H301 PolarHBondContact O-N 2.83Å; S298-H301 PolarHBondContact O-ND1 3.29Å
299	N	72.6	Confident	82.6	Confident	46 Å²	46	43.4 Å²	43.4	25%	0.246	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-74.9	23.3	-177.8	-63.9	-11.9	0	0	0	114.3	P50 S51 E297	P50-N299 HydrophobicContact CB-CB 4.23Å; S51-N299 PolarHBondContact N-O 3.19Å; S51-N299 PolarHBondContact OG-O 3.44Å; E297-N299 PolarHBondContact O-N 3.04Å
300	T	79.6	Confident	82.6	Confident	9 Å²	9	39.1 Å²	39.1	6%	0.055	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-121.7	5.8	178.8	64.2	0	0	0	0	112.9	P50 L292 A295 E297 S298	P50-T300 HydrophobicContact CB-CG2 4.42Å; L292-T300 PolarHBondContact N-O 3.42Å; A295-T300 HydrophobicContact CB-CG2 3.32Å; A295-T300 WeakPolarHBondContact CB-OG1 3.49Å; E297-T300 PolarHBondContact O-N 3.07Å; E297-T300 PolarHBondContact O-OG1 3.41Å; S298-T300 PolarHBondContact O-N 3.48Å
301	H	89.2	Confident	82.7	Confident	71 Å²	71	38.7 Å²	38.7	33%	0.329	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.2	171.2	-66.3	75	0	0	0	110.3	F289 C290 S298	F289-H301 HydrophobicContact CE1-CB 3.82Å; F289-H301 AromaticContact CE1-CD2 3.85Å; F289-H301 HydrophobicContact CE2-CB 3.81Å; F289-H301 HydrophobicContact CZ-CB 3.41Å; F289-H301 VanDerWaalsContact CZ-CB 3.41Å; C290-H301 WeakPolarHBondContact O-CA 3.32Å; S298-H301 PolarHBondContact O-N 2.83Å; S298-H301 PolarHBondContact O-ND1 3.29Å
302	V	93.8	Very high	83	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.3	177.9	-174.8	0	0	0	0	108.9	L244 L273 P274 C290 L304	L244-V302 HydrophobicContact CD1-CB 4.03Å; L244-V302 HydrophobicContact CD1-CG1 3.9Å; L244-V302 HydrophobicContact CD1-CG2 4.14Å; L273-V302 HydrophobicContact CB-CG2 4.36Å; P274-V302 HydrophobicContact CG-CG1 4.2Å; P274-V302 WeakPolarHBondContact O-CG1 3.48Å; P274-V302 VanDerWaalsContact O-CG2 3.32Å; P274-V302 WeakPolarHBondContact O-CG2 3.32Å; C290-V302 PolarHBondContact N-O 3.33Å; C290-V302 VanDerWaalsContact N-O 3.08Å; C290-V302 PolarHBondContact O-N 3.4Å; V302-L304 HydrophobicContact CG1-CD2 4.13Å; V302-L304 PolarHBondContact O-N 3.4Å
303	R	96.3	Very high	83.5	Confident	34 Å²	34	43.8 Å²	43.8	13%	0.128	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	112.7	168.3	174.2	59.8	65.8	-170	-2.7	109	H275 V276 Y277 S287 S288 F289 L324 V326	H275-R303 PolarHBondContact O-N 3.34Å; V276-R303 CarbonylContact C-O 3.38Å; V276-R303 WeakPolarHBondContact CA-O 3.4Å; V276-R303 HydrophobicContact CG1-CG 4.35Å; V276-R303 HydrophobicContact CG2-CB 4.21Å; Y277-R303 PolarHBondContact N-O 3.15Å; S287-R303 WeakPolarHBondContact OG-CD 3.42Å; S287-R303 PolarHBondContact OG-NH1 2.87Å; S288-R303 VanDerWaalsContact C-NH1 3.29Å; F289-R303 HydrophobicContact CD2-CB 4.18Å; R303-L324 HydrophobicContact CB-CB 4.32Å; R303-L324 PolarHBondContact NE-O 3.1Å; R303-L324 PolarHBondContact NH2-O 3.45Å; R303-V326 HydrophobicContact CG-CG2 3.9Å
304	L	97.3	Very high	84.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.7	173.6	-58.5	-178.8	0	0	0	109.9	I237 M240 L241 L244 Y277 S287 S288 C290 V302	I237-L304 HydrophobicContact CD1-CB 3.99Å; I237-L304 HydrophobicContact CG2-CB 4.29Å; I237-L304 HydrophobicContact CG2-CD1 3.87Å; M240-L304 HydrophobicContact CB-CD2 4.38Å; M240-L304 HydrophobicContact CE-CD2 4.46Å; L241-L304 HydrophobicContact CB-CD1 3.85Å; L241-L304 HydrophobicContact CD1-CD1 4.28Å; L244-L304 HydrophobicContact CD1-CD2 3.66Å; Y277-L304 HydrophobicContact CD1-CD2 3.69Å; Y277-L304 HydrophobicContact CG-CD2 4.29Å; Y277-L304 CarbonylContact O-C 3.57Å; Y277-L304 WeakPolarHBondContact O-CA 3.15Å; S287-L304 WeakPolarHBondContact CA-O 3.26Å; S288-L304 PolarHBondContact N-O 3.08Å; S288-L304 PolarHBondContact O-N 3.43Å; C290-L304 HydrophobicContact CB-CD1 4.47Å; V302-L304 HydrophobicContact CG1-CD2 4.13Å; V302-L304 PolarHBondContact O-N 3.4Å
305	L	97.6	Very high	86.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	120.2	179.9	-171.8	69.5	0	0	0	112.5	L68 M240 Y277 F278 A279 F285 L307 A317 V326	L68-L305 HydrophobicContact CD1-CD2 3.42Å; L68-L305 VanDerWaalsContact CD1-CD2 3.42Å; M240-L305 WeakPolarHBondContact CE-O 3.3Å; Y277-L305 PolarHBondContact O-N 2.9Å; F278-L305 CarbonylContact C-O 3.57Å; F278-L305 VanDerWaalsContact CA-O 3.25Å; F278-L305 WeakPolarHBondContact CA-O 3.34Å; F278-L305 HydrophobicContact CB-CB 4.02Å; F278-L305 HydrophobicContact CB-CD2 4.34Å; A279-L305 PolarHBondContact N-O 2.89Å; F285-L305 HydrophobicContact CE2-CD1 3.76Å; F285-L305 HydrophobicContact CZ-CD1 3.96Å; L305-L307 HydrophobicContact CD1-CD2 4.35Å; L305-L307 HydrophobicContact CD2-CD1 4.03Å; L305-L307 HydrophobicContact CD2-CD2 3.53Å; L305-L307 HydrophobicContact CD2-CG 3.74Å; L305-L307 HydrophobicContact CG-CD2 3.82Å; L305-L307 HydrophobicContact CG-CG 3.9Å; L305-A317 HydrophobicContact CD1-CB 4.4Å; L305-A317 HydrophobicContact CD2-CB 3.73Å; L305-V326 HydrophobicContact CD1-CB 4.49Å; L305-V326 HydrophobicContact CD1-CG1 3.81Å; L305-V326 HydrophobicContact CD1-CG2 4.41Å
306	S	97.6	Very high	88.1	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.014	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.9	168.7	174.6	0	0	0	0	108.5	Q282 A284 F285 S286	Q282-S306 WeakPolarHBondContact CB-OG 3.4Å; Q282-S306 WeakPolarHBondContact CG-OG 3.27Å; A284-S306 PolarHBondContact O-OG 3.09Å; F285-S306 WeakPolarHBondContact CA-O 3.41Å; S286-S306 PolarHBondContact N-O 3.38Å; S286-S306 VanDerWaalsContact N-O 3.09Å; S286-S306 PolarHBondContact O-N 3.33Å
307	L	97.5	Very high	90.2	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.9	-177.3	-69.1	172.7	0	0	0	110.6	L68 F278 A279 A280 N281 Q282 F285 L305 A317	L68-L307 HydrophobicContact CB-CD1 3.6Å; L68-L307 HydrophobicContact CB-CD2 4.5Å; L68-L307 HydrophobicContact CD1-CD1 4.29Å; F278-L307 HydrophobicContact CB-CD1 4.46Å; F278-L307 HydrophobicContact CD2-CD1 4.34Å; A279-L307 PolarHBondContact O-N 3.41Å; A280-L307 CarbonylContact C-O 3.3Å; N281-L307 PolarHBondContact N-O 3.33Å; Q282-L307 PolarHBondContact N-O 3.45Å; F285-L307 HydrophobicContact CD2-CD2 4.38Å; F285-L307 HydrophobicContact CE2-CD2 4.32Å; L305-L307 HydrophobicContact CD1-CD2 4.35Å; L305-L307 HydrophobicContact CD2-CD1 4.03Å; L305-L307 HydrophobicContact CD2-CD2 3.53Å; L305-L307 HydrophobicContact CD2-CG 3.74Å; L305-L307 HydrophobicContact CG-CD2 3.82Å; L305-L307 HydrophobicContact CG-CG 3.9Å; L307-A317 HydrophobicContact CD2-CB 3.41Å; L307-A317 VanDerWaalsContact CD2-CB 3.41Å
308	P	97.2	Very high	91.8	Very high	6 Å²	6	25.2 Å²	25.2	4%	0.039	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	161.3	174.7	35.2	-35.6	0	0	0	112.4	C70 Q282 F285 F310 S313 Y315	C70-P308 PolarHBondContact SG-O 2.91Å; Q282-P308 WeakPolarHBondContact O-CA 3.14Å; Q282-P308 WeakPolarHBondContact O-CB 3.42Å; F285-P308 HydrophobicContact CB-CG 3.98Å; P308-F310 PolarHBondContact O-N 3.34Å; P308-S313 WeakPolarHBondContact CG-OG 3.45Å; P308-Y315 HydrophobicContact CG-CD2 4.47Å; P308-Y315 HydrophobicContact CG-CG 4.22Å
309	S	95	Very high	93.5	Very high	1 Å²	1	21 Å²	21	1%	0.007	10%	0.103	C	C	.	.			trans	-60.7	123.2	177.2	-168	0	0	0	0	110.3	G71 R73 C311 E312 S313	G71-S309 WeakPolarHBondContact CA-OG 3.41Å; G71-S309 PolarHBondContact O-OG 3.17Å; R73-S309 VanDerWaalsContact CZ-OG 3.3Å; R73-S309 PolarHBondContact NE-OG 2.84Å; R73-S309 PolarHBondContact NH2-OG 3.41Å; S309-C311 VanDerWaalsContact C-N 3.28Å; S309-C311 PolarHBondContact O-N 2.9Å; S309-C311 PolarHBondContact OG-SG 3.19Å; S309-E312 PolarHBondContact O-N 2.54Å; S309-E312 VanDerWaalsContact O-N 3.16Å; S309-S313 WeakPolarHBondContact O-CB 3.23Å; S309-S313 PolarHBondContact O-N 3.32Å; S309-S313 PolarHBondContact O-OG 3.41Å
310	F	95.6	Very high	94.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.6	-40.8	-177.8	-179.8	-90.3	0	0	0	111.8	C70 L72 L87 R88 L91 P308 E312 G314 Y315 F331	C70-F310 WeakPolarHBondContact O-CB 3.48Å; C70-F310 PolarHBondContact O-N 3.17Å; L72-F310 HydrophobicContact CD2-CB 4.32Å; L72-F310 HydrophobicContact CD2-CD1 3.83Å; L72-F310 HydrophobicContact CD2-CE1 4.48Å; L72-F310 HydrophobicContact CD2-CG 4.13Å; L87-F310 HydrophobicContact CB-CE1 3.82Å; L87-F310 HydrophobicContact CB-CZ 4.26Å; R88-F310 HydrophobicContact CG-CE1 4.41Å; L91-F310 HydrophobicContact CB-CE1 4.31Å; L91-F310 HydrophobicContact CB-CE2 4.15Å; L91-F310 HydrophobicContact CB-CZ 3.63Å; L91-F310 HydrophobicContact CD1-CE2 4.33Å; L91-F310 HydrophobicContact CD2-CD2 4.3Å; L91-F310 HydrophobicContact CD2-CE1 4.17Å; L91-F310 HydrophobicContact CD2-CE2 3.89Å; L91-F310 HydrophobicContact CD2-CZ 3.86Å; L91-F310 HydrophobicContact CG-CE2 4.36Å; L91-F310 HydrophobicContact CG-CZ 4.24Å; P308-F310 PolarHBondContact O-N 3.34Å; F310-E312 PolarHBondContact O-N 3.11Å; F310-G314 VanDerWaalsContact O-CA 3.29Å; F310-G314 WeakPolarHBondContact O-CA 3.46Å; F310-G314 PolarHBondContact O-N 3.38Å; F310-Y315 WeakPolarHBondContact CD2-O 3.26Å; F310-F331 AromaticContact CE2-CD2 3.51Å; F310-F331 HydrophobicContact CE2-CD2 3.51Å; F310-F331 AromaticContact CE2-CE2 4Å; F310-F331 HydrophobicContact CE2-CE2 4Å; F310-F331 HydrophobicContact CE2-CG 4.28Å; F310-F331 HydrophobicContact CZ-CB 4.33Å; F310-F331 AromaticContact CZ-CD2 3.88Å; F310-F331 HydrophobicContact CZ-CD2 3.88Å; F310-F331 HydrophobicContact CZ-CG 4.21Å
311	C	91.6	Very high	95.2	Very high	16 Å²	16	19.7 Å²	19.7	11%	0.108	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-26.1	-179.7	68.4	0	0	0	0	114.7	G71 R73 V84 S309	G71-C311 WeakPolarHBondContact O-CB 3.48Å; G71-C311 PolarHBondContact O-N 3.3Å; G71-C311 PolarHBondContact O-SG 2.86Å; G71-C311 VanDerWaalsContact O-SG 3.41Å; R73-C311 HydrophobicContact CB-CB 4.46Å; R73-C311 WeakPolarHBondContact CD-SG 3.44Å; V84-C311 HydrophobicContact CG1-CB 3.63Å; V84-C311 HydrophobicContact CG2-CB 4.39Å; S309-C311 VanDerWaalsContact C-N 3.28Å; S309-C311 PolarHBondContact O-N 2.9Å; S309-C311 PolarHBondContact OG-SG 3.19Å
312	E	90.4	Very high	95.2	Very high	137 Å²	137	19.7 Å²	19.7	64%	0.64	10%	0.095	S	C	*	.	H	α-helix	trans	-97.5	-37.1	-177	-76.5	166	-178.8	0	0	111.2	R73 S309 F310	R73-E312 IonicContact CZ-OE1 2.73Å; R73-E312 IonicContact NH1-OE1 3.77Å; R73-E312 PolarHBondContact NH1-OE1 3.45Å; R73-E312 IonicContact NH2-OE1 3.1Å; R73-E312 PolarHBondContact NH2-OE1 2.82Å; R73-E312 IonicContact NH2-OE2 3.66Å; S309-E312 PolarHBondContact O-N 2.54Å; S309-E312 VanDerWaalsContact O-N 3.16Å; F310-E312 PolarHBondContact O-N 3.11Å
313	S	92.7	Very high	95	Very high	37 Å²	37	24 Å²	24	26%	0.259	12%	0.119	S	C	.	.	H	α-helix	trans	-106.2	-27.3	-168.7	68	0	0	0	0	113.2	P308 S309 Y315	P308-S313 WeakPolarHBondContact CG-OG 3.45Å; S309-S313 WeakPolarHBondContact O-CB 3.23Å; S309-S313 PolarHBondContact O-N 3.32Å; S309-S313 PolarHBondContact O-OG 3.41Å; S313-Y315 WeakPolarHBondContact O-CD2 3.25Å; S313-Y315 PolarHBondContact O-N 2.72Å; S313-Y315 PolarHBondContact OG-N 3.33Å
314	G	93.8	Very high	94.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.			trans	69.4	14.8	-169.5	0	0	0	0	0	114.1	F310 I330 F331	F310-G314 VanDerWaalsContact O-CA 3.29Å; F310-G314 WeakPolarHBondContact O-CA 3.46Å; F310-G314 PolarHBondContact O-N 3.38Å; G314-I330 WeakPolarHBondContact O-CA 3.43Å; G314-F331 WeakPolarHBondContact O-CD2 3.36Å; G314-F331 PolarHBondContact O-N 2.92Å
315	Y	95.8	Very high	94.7	Very high	74 Å²	74	24.5 Å²	24.5	29%	0.29	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	136.3	-177.9	-78.4	-108.8	0	0	0	112.5	F285 P308 F310 S313 P328 I329 I330	F285-Y315 HydrophobicContact CB-CD1 3.89Å; F285-Y315 HydrophobicContact CB-CE1 4.15Å; F285-Y315 HydrophobicContact CB-CG 4.42Å; F285-Y315 HydrophobicContact CD2-CD1 4.24Å; F285-Y315 HydrophobicContact CG-CD1 4Å; F285-Y315 HydrophobicContact CG-CE1 4.38Å; P308-Y315 HydrophobicContact CG-CD2 4.47Å; P308-Y315 HydrophobicContact CG-CG 4.22Å; F310-Y315 WeakPolarHBondContact CD2-O 3.26Å; S313-Y315 WeakPolarHBondContact O-CD2 3.25Å; S313-Y315 PolarHBondContact O-N 2.72Å; S313-Y315 PolarHBondContact OG-N 3.33Å; Y315-P328 HydrophobicContact CD1-CB 3.89Å; Y315-P328 HydrophobicContact CE1-CB 4.01Å; Y315-I329 WeakPolarHBondContact CA-O 3.37Å; Y315-I330 HydrophobicContact CD1-CD1 4.33Å; Y315-I330 HydrophobicContact CD1-CG1 3.81Å; Y315-I330 HydrophobicContact CD2-CG1 4.49Å; Y315-I330 HydrophobicContact CD2-CG2 4.45Å; Y315-I330 HydrophobicContact CE1-CD1 3.51Å; Y315-I330 HydrophobicContact CE1-CG1 3.5Å; Y315-I330 VanDerWaalsContact CE1-CG1 3.5Å; Y315-I330 HydrophobicContact CE2-CD1 4.35Å; Y315-I330 HydrophobicContact CE2-CG1 4.23Å; Y315-I330 HydrophobicContact CE2-CG2 4.14Å; Y315-I330 HydrophobicContact CG-CG1 4.3Å; Y315-I330 WeakPolarHBondContact OH-CD1 3.46Å
316	A	96.8	Very high	94.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.6	160.6	0	0	0	0	0	109	L67 I69 P328 I329 F331	L67-A316 HydrophobicContact CD1-CB 3.92Å; L67-A316 HydrophobicContact CG-CB 4.45Å; I69-A316 HydrophobicContact CG2-CB 3.39Å; A316-P328 WeakPolarHBondContact O-CA 3.17Å; A316-I329 HydrophobicContact CB-CB 4.38Å; A316-I329 PolarHBondContact N-O 2.79Å; A316-I329 PolarHBondContact O-N 2.9Å; A316-F331 HydrophobicContact CB-CE2 4.3Å
317	A	97.8	Very high	94.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.4	177.5	0	0	0	0	0	110.8	L67 L68 F285 L305 L307 V326	L67-A317 CarbonylContact C-O 3.58Å; L67-A317 WeakPolarHBondContact CA-O 3.4Å; L68-A317 HydrophobicContact CB-CB 4.34Å; L68-A317 PolarHBondContact N-O 2.94Å; L68-A317 PolarHBondContact O-N 3.02Å; F285-A317 HydrophobicContact CE2-CB 3.84Å; L305-A317 HydrophobicContact CD1-CB 4.4Å; L305-A317 HydrophobicContact CD2-CB 3.73Å; L307-A317 HydrophobicContact CD2-CB 3.41Å; L307-A317 VanDerWaalsContact CD2-CB 3.41Å; A317-V326 HydrophobicContact CB-CG1 3.83Å
318	L	97.5	Very high	94.6	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	112.1	175.4	-169.4	73.4	0	0	0	109	Y65 L67 K107 I111 V326 E327 I329	Y65-L318 HydrophobicContact CD1-CD1 4.32Å; Y65-L318 HydrophobicContact CD1-CD2 3.8Å; Y65-L318 HydrophobicContact CD1-CG 3.72Å; Y65-L318 HydrophobicContact CE1-CD2 4.16Å; Y65-L318 HydrophobicContact CE1-CG 4.5Å; Y65-L318 HydrophobicContact CG-CD1 4.1Å; Y65-L318 HydrophobicContact CG-CD2 4.09Å; Y65-L318 HydrophobicContact CG-CG 4Å; L67-L318 HydrophobicContact CB-CD1 4.41Å; L67-L318 HydrophobicContact CD1-CB 4.34Å; L67-L318 HydrophobicContact CD1-CD1 3.96Å; K107-L318 HydrophobicContact CD-CD2 4.2Å; K107-L318 VanDerWaalsContact CE-CD2 3.42Å; K107-L318 HydrophobicContact CG-CD2 4.31Å; I111-L318 HydrophobicContact CD1-CD1 3.86Å; I111-L318 HydrophobicContact CG1-CD1 3.82Å; L318-V326 WeakPolarHBondContact O-CA 3.47Å; L318-E327 HydrophobicContact CB-CB 4.39Å; L318-E327 PolarHBondContact N-O 2.81Å; L318-E327 PolarHBondContact O-N 3.07Å; L318-I329 HydrophobicContact CB-CD1 4.49Å; L318-I329 HydrophobicContact CB-CG1 4.13Å
319	V	97.3	Very high	94.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.3	-178.8	-173.6	0	0	0	0	109.1	Y65 V66 L68 F216 V276 V326	Y65-V319 CarbonylContact C-O 3.46Å; Y65-V319 VanDerWaalsContact CA-O 3.26Å; Y65-V319 WeakPolarHBondContact CA-O 3.42Å; V66-V319 PolarHBondContact N-O 2.7Å; V66-V319 PolarHBondContact O-N 2.85Å; L68-V319 HydrophobicContact CD1-CG2 3.81Å; L68-V319 HydrophobicContact CG-CG2 4.25Å; F216-V319 HydrophobicContact CE1-CG1 4.4Å; F216-V319 HydrophobicContact CZ-CG1 4.37Å; V276-V319 HydrophobicContact CG2-CG1 4.3Å; V319-V326 HydrophobicContact CG1-CG2 4.49Å; V319-V326 HydrophobicContact CG2-CG1 4.43Å; V319-V326 HydrophobicContact CG2-CG2 4.18Å
320	N	95	Very high	94.5	Very high	17 Å²	17	36 Å²	36	9%	0.091	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.6	172.1	-177.8	-34.4	0	0	0	109.7	Y65 Q322 N323 L324 A325	Y65-N320 HydrophobicContact CD1-CB 3.96Å; Y65-N320 HydrophobicContact CE1-CB 3.76Å; N320-Q322 VanDerWaalsContact C-N 3.34Å; N320-Q322 PolarHBondContact O-N 3.42Å; N320-Q322 WeakPolarHBondContact OD1-CB 3.5Å; N320-Q322 PolarHBondContact OD1-N 2.89Å; N320-N323 VanDerWaalsContact CB-OD1 3.27Å; N320-N323 WeakPolarHBondContact CB-OD1 3.45Å; N320-N323 VanDerWaalsContact CG-OD1 3.27Å; N320-L324 WeakPolarHBondContact O-CA 3.14Å; N320-L324 PolarHBondContact O-N 2.85Å; N320-A325 PolarHBondContact N-O 2.98Å
321	L	93.3	Very high	94.4	Very high	12 Å²	12	37 Å²	37	6%	0.063	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-18.4	-175.4	-63.8	-176.4	0	0	0	114.3	C64 V66 V112 V211 C212 I214 F216	C64-L321 HydrophobicContact CB-CB 4.5Å; C64-L321 HydrophobicContact CB-CD1 3.97Å; C64-L321 WeakPolarHBondContact O-CB 3.4Å; C64-L321 WeakPolarHBondContact O-CG 3.08Å; C64-L321 PolarHBondContact O-N 3.49Å; V66-L321 HydrophobicContact CB-CD2 4.41Å; V66-L321 HydrophobicContact CG2-CD1 4.05Å; V66-L321 HydrophobicContact CG2-CD2 3.76Å; V66-L321 HydrophobicContact CG2-CG 4.21Å; V112-L321 HydrophobicContact CG2-CD1 3.77Å; V211-L321 HydrophobicContact CG1-CD1 4.3Å; C212-L321 HydrophobicContact CB-CD1 3.93Å; I214-L321 HydrophobicContact CB-CD2 4.26Å; I214-L321 HydrophobicContact CG1-CB 4.34Å; I214-L321 HydrophobicContact CG1-CD2 4.17Å; I214-L321 HydrophobicContact CG2-CD2 4.47Å; F216-L321 HydrophobicContact CE2-CD2 3.79Å; F216-L321 HydrophobicContact CZ-CD2 3.66Å
322	Q	89.1	Confident	94.3	Very high	70 Å²	70	42.5 Å²	42.5	33%	0.327	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-43.2	-179.9	-65.3	177.7	-26.3	0	0	112.1	A57 D61 E62 N320	A57-Q322 HydrophobicContact CB-CG 4.24Å; D61-Q322 PolarHBondContact O-NE2 3.35Å; E62-Q322 PolarHBondContact O-NE2 3.25Å; N320-Q322 VanDerWaalsContact C-N 3.34Å; N320-Q322 PolarHBondContact O-N 3.42Å; N320-Q322 WeakPolarHBondContact OD1-CB 3.5Å; N320-Q322 PolarHBondContact OD1-N 2.89Å
323	N	89.7	Confident	94.1	Very high	92 Å²	92	36.5 Å²	36.5	49%	0.492	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	1.5	-173.1	65.4	13	0	0	0	114.1	N320 A325	N320-N323 VanDerWaalsContact CB-OD1 3.27Å; N320-N323 WeakPolarHBondContact CB-OD1 3.45Å; N320-N323 VanDerWaalsContact CG-OD1 3.27Å; N323-A325 PolarHBondContact O-N 3.02Å; N323-A325 WeakPolarHBondContact OD1-CB 3.45Å; N323-A325 PolarHBondContact OD1-N 2.76Å
324	L	92.9	Very high	93.2	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.016	22%	0.215	C	C	.	.			trans	55.4	20	-176.3	-51.2	-179.4	0	0	0	113.7	L54 I214 H275 V276 F289 R303 N320	L54-L324 HydrophobicContact CD2-CD1 4.03Å; L54-L324 HydrophobicContact CD2-CG 4.4Å; I214-L324 HydrophobicContact CD1-CD2 4.37Å; I214-L324 HydrophobicContact CG2-CD2 3.88Å; H275-L324 HydrophobicContact CB-CD1 4.09Å; V276-L324 HydrophobicContact CG2-CD2 3.99Å; F289-L324 HydrophobicContact CE2-CD1 4.04Å; R303-L324 HydrophobicContact CB-CB 4.32Å; R303-L324 PolarHBondContact NE-O 3.1Å; R303-L324 PolarHBondContact NH2-O 3.45Å; N320-L324 WeakPolarHBondContact O-CA 3.14Å; N320-L324 PolarHBondContact O-N 2.85Å
325	A	95	Very high	91.6	Very high	41 Å²	41	43.3 Å²	43.3	34%	0.339	24%	0.242	S	C	.	.			trans	-68.6	142.7	171.7	0	0	0	0	0	109.2	N320 N323	N320-A325 PolarHBondContact N-O 2.98Å; N323-A325 PolarHBondContact O-N 3.02Å; N323-A325 WeakPolarHBondContact OD1-CB 3.45Å; N323-A325 PolarHBondContact OD1-N 2.76Å
326	V	96.8	Very high	89.6	Confident	27 Å²	27	43 Å²	43	16%	0.164	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.4	-179.6	-173.2	0	0	0	0	108.9	F285 R303 L305 A317 L318 V319	F285-V326 HydrophobicContact CE2-CG1 4.41Å; F285-V326 HydrophobicContact CZ-CG1 3.94Å; R303-V326 HydrophobicContact CG-CG2 3.9Å; L305-V326 HydrophobicContact CD1-CB 4.49Å; L305-V326 HydrophobicContact CD1-CG1 3.81Å; L305-V326 HydrophobicContact CD1-CG2 4.41Å; A317-V326 HydrophobicContact CB-CG1 3.83Å; L318-V326 WeakPolarHBondContact O-CA 3.47Å; V319-V326 HydrophobicContact CG1-CG2 4.49Å; V319-V326 HydrophobicContact CG2-CG1 4.43Å; V319-V326 HydrophobicContact CG2-CG2 4.18Å
327	E	96	Very high	87	Confident	80 Å²	80	52 Å²	52	37%	0.374	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.9	174.6	-176.6	179.6	143.6	0	0	110.1	K107 L318 I329	K107-E327 WeakPolarHBondContact CE-OE2 3.34Å; K107-E327 IonicContact NZ-OE1 2.73Å; K107-E327 PolarHBondContact NZ-OE1 3.33Å; K107-E327 IonicContact NZ-OE2 3.2Å; K107-E327 PolarHBondContact NZ-OE2 2.83Å; L318-E327 HydrophobicContact CB-CB 4.39Å; L318-E327 PolarHBondContact N-O 2.81Å; L318-E327 PolarHBondContact O-N 3.07Å; E327-I329 HydrophobicContact CG-CD1 4.16Å; E327-I329 WeakPolarHBondContact OE1-CD1 3.07Å
328	P	96.5	Very high	86.4	Confident	54 Å²	54	54.6 Å²	54.6	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.8	172.6	29.5	-30.8	0	0	0	110.3	F285 Y315 A316	F285-P328 HydrophobicContact CD1-CB 4.28Å; F285-P328 HydrophobicContact CE1-CB 3.9Å; F285-P328 HydrophobicContact CE1-CG 4.14Å; F285-P328 HydrophobicContact CE2-CB 4.27Å; F285-P328 HydrophobicContact CZ-CB 3.89Å; F285-P328 HydrophobicContact CZ-CG 4.42Å; Y315-P328 HydrophobicContact CD1-CB 3.89Å; Y315-P328 HydrophobicContact CE1-CB 4.01Å; A316-P328 WeakPolarHBondContact O-CA 3.17Å
329	I	95.5	Very high	85.9	Confident	20 Å²	20	57.4 Å²	57.4	10%	0.103	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.6	169.6	-51	-58.9	0	0	0	107.5	W94 Y315 A316 L318 E327 F331	W94-I329 HydrophobicContact CH2-CB 4.49Å; W94-I329 HydrophobicContact CH2-CG1 3.92Å; W94-I329 HydrophobicContact CH2-CG2 4.17Å; W94-I329 HydrophobicContact CZ2-CD1 4.25Å; W94-I329 HydrophobicContact CZ2-CG1 4.07Å; W94-I329 HydrophobicContact CZ2-CG2 3.97Å; Y315-I329 WeakPolarHBondContact CA-O 3.37Å; A316-I329 HydrophobicContact CB-CB 4.38Å; A316-I329 PolarHBondContact N-O 2.79Å; A316-I329 PolarHBondContact O-N 2.9Å; L318-I329 HydrophobicContact CB-CD1 4.49Å; L318-I329 HydrophobicContact CB-CG1 4.13Å; E327-I329 HydrophobicContact CG-CD1 4.16Å; E327-I329 WeakPolarHBondContact OE1-CD1 3.07Å; I329-F331 HydrophobicContact CB-CE2 4.35Å; I329-F331 HydrophobicContact CG2-CD2 4.44Å; I329-F331 HydrophobicContact CG2-CE1 4.48Å; I329-F331 HydrophobicContact CG2-CE2 3.63Å; I329-F331 HydrophobicContact CG2-CZ 3.66Å
330	I	94.9	Very high	85.2	Confident	74 Å²	74	60.6 Å²	60.6	38%	0.379	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.5	-171.2	-51.8	170.8	0	0	0	109.3	G314 Y315 K332	G314-I330 WeakPolarHBondContact O-CA 3.43Å; Y315-I330 HydrophobicContact CD1-CD1 4.33Å; Y315-I330 HydrophobicContact CD1-CG1 3.81Å; Y315-I330 HydrophobicContact CD2-CG1 4.49Å; Y315-I330 HydrophobicContact CD2-CG2 4.45Å; Y315-I330 HydrophobicContact CE1-CD1 3.51Å; Y315-I330 HydrophobicContact CE1-CG1 3.5Å; Y315-I330 VanDerWaalsContact CE1-CG1 3.5Å; Y315-I330 HydrophobicContact CE2-CD1 4.35Å; Y315-I330 HydrophobicContact CE2-CG1 4.23Å; Y315-I330 HydrophobicContact CE2-CG2 4.14Å; Y315-I330 HydrophobicContact CG-CG1 4.3Å; Y315-I330 WeakPolarHBondContact OH-CD1 3.46Å; I330-K332 HydrophobicContact CG2-CG 4.14Å
331	F	93.8	Very high	84.6	Confident	20 Å²	20	63.1 Å²	63.1	9%	0.088	36%	0.36	C	S	.	.			trans	-99.4	131	173.7	-58.1	-89.5	0	0	0	109.1	L87 H90 L91 W94 F310 G314 A316 I329	L87-F331 HydrophobicContact CD2-CB 3.87Å; L87-F331 WeakPolarHBondContact CD2-O 3.47Å; H90-F331 HydrophobicContact CB-CD1 3.92Å; L91-F331 HydrophobicContact CB-CE2 4.46Å; L91-F331 HydrophobicContact CB-CZ 4.36Å; L91-F331 HydrophobicContact CD1-CE2 3.76Å; L91-F331 HydrophobicContact CD1-CZ 3.79Å; W94-F331 HydrophobicContact CB-CE1 3.74Å; W94-F331 HydrophobicContact CB-CZ 4.11Å; W94-F331 HydrophobicContact CD2-CE1 4.25Å; W94-F331 AromaticContact CD2-CZ 3.82Å; W94-F331 HydrophobicContact CD2-CZ 3.82Å; W94-F331 HydrophobicContact CE3-CE1 4.49Å; W94-F331 AromaticContact CE3-CZ 3.71Å; W94-F331 HydrophobicContact CE3-CZ 3.71Å; W94-F331 AromaticContact CG-CE1 3.92Å; W94-F331 HydrophobicContact CG-CE1 3.92Å; W94-F331 HydrophobicContact CG-CZ 4Å; W94-F331 HydrophobicContact CZ3-CZ 4.4Å; F310-F331 AromaticContact CE2-CD2 3.51Å; F310-F331 HydrophobicContact CE2-CD2 3.51Å; F310-F331 AromaticContact CE2-CE2 4Å; F310-F331 HydrophobicContact CE2-CE2 4Å; F310-F331 HydrophobicContact CE2-CG 4.28Å; F310-F331 HydrophobicContact CZ-CB 4.33Å; F310-F331 AromaticContact CZ-CD2 3.88Å; F310-F331 HydrophobicContact CZ-CD2 3.88Å; F310-F331 HydrophobicContact CZ-CG 4.21Å; G314-F331 WeakPolarHBondContact O-CD2 3.36Å; G314-F331 PolarHBondContact O-N 2.92Å; A316-F331 HydrophobicContact CB-CE2 4.3Å; I329-F331 HydrophobicContact CB-CE2 4.35Å; I329-F331 HydrophobicContact CG2-CD2 4.44Å; I329-F331 HydrophobicContact CG2-CE1 4.48Å; I329-F331 HydrophobicContact CG2-CE2 3.63Å; I329-F331 HydrophobicContact CG2-CZ 3.66Å
332	K	90.4	Very high	84.1	Confident	133 Å²	133	66.3 Å²	66.3	58%	0.578	38%	0.379	S	S	*	.			trans	-127.6	150.2	177	-63.7	-168.9	178.3	-174.3	0	110.5	I330	I330-K332 HydrophobicContact CG2-CG 4.14Å
333	T	84.7	Confident	83.8	Confident	10 Å²	10	66.1 Å²	66.1	6%	0.061	38%	0.382	C	S	.	.			trans	-102.2	151	169.3	49.4	0	0	0	0	109.7	I86 L87 A335 S336	I86-T333 HydrophobicContact CB-CG2 4.03Å; I86-T333 HydrophobicContact CG2-CG2 3.72Å; L87-T333 HydrophobicContact CD2-CG2 3.87Å; L87-T333 HydrophobicContact CG-CG2 3.9Å; T333-A335 PolarHBondContact O-N 2.83Å; T333-S336 PolarHBondContact N-OG 3.06Å; T333-S336 PolarHBondContact O-N 2.89Å; T333-S336 PolarHBondContact O-OG 3.12Å; T333-S336 PolarHBondContact OG1-OG 3.43Å
334	S	74.5	Confident	83.4	Confident	113 Å²	113	64.2 Å²	64.2	79%	0.79	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-59.3	-19.7	-178.7	54.6	0	0	0	0	114.6	S336	S334-S336 PolarHBondContact O-N 2.75Å
335	A	60.4	Low	82.6	Confident	68 Å²	68	68.9 Å²	68.9	56%	0.562	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-73.2	-11.8	173.1	0	0	0	0	0	114.1	E83 T333	E83-A335 WeakPolarHBondContact OE1-CB 3.38Å; T333-A335 PolarHBondContact O-N 2.83Å
336	S	53.7	Low	81.6	Confident	66 Å²	66	71.3 Å²	71.3	46%	0.462	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-108.7	14.4	-175.6	60.6	0	0	0	0	114.1	T333 S334	T333-S336 PolarHBondContact N-OG 3.06Å; T333-S336 PolarHBondContact O-N 2.89Å; T333-S336 PolarHBondContact O-OG 3.12Å; T333-S336 PolarHBondContact OG1-OG 3.43Å; S334-S336 PolarHBondContact O-N 2.75Å
337	I	41.9	Very low	80.2	Confident	190 Å²	190	75.3 Å²	75.3	97%	0.974	43%	0.429	S	S	*	.			trans	-107.2	0	173.3	-57.4	175.4	0	0	0	108.3

Retrieved 337 of 337 residues in 556.7 ms (Link to these results)

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