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Junctophilin

Junctophilins contribute to the formation of junctional membrane complexes (JMCs) which link the plasma membrane with the endoplasmic or sarcoplasmic reticulum in excitable cells. Provides a structural foundation for functional cross-talk between the cell surface and intracellular calcium release channels.

AlphaFold DB (A0A2K6DT99), UniProt , Accession A0A096NGB3, Species PAPAN (Papio anubis, Olive baboon), Gene JPH1, Length 661 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	51.8	Low	85.5	Confident	163 Å²	163	85.5 Å²	85.5	80%	0.803	48%	0.477	S	S	*	.				0	134.7	0	-68.4	170.8	175	0	0	107.9
2	T	79.3	Confident	86	Confident	109 Å²	109	78.4 Å²	78.4	67%	0.669	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	121.2	167.7	41.3	0	0	0	0	108	W18	T2-W18 WeakPolarHBondContact O-CA 3.46Å; T2-W18 WeakPolarHBondContact O-CB 3.31Å; T2-W18 PolarHBondContact O-N 2.78Å
3	G	84.3	Confident	86.6	Confident	41 Å²	41	73.6 Å²	73.6	42%	0.423	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	155.4	173.1	0	0	0	0	0	111.4	G16	G3-G16 CarbonylContact C-O 3.29Å; G3-G16 WeakPolarHBondContact CA-O 3.4Å
4	G	90.8	Very high	87.2	Confident	19 Å²	19	68.4 Å²	68.4	20%	0.196	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	166.2	172.6	0	0	0	0	0	114.2	G16 W18	G4-G16 PolarHBondContact N-O 3Å; G4-G16 PolarHBondContact O-N 3.2Å; G4-W18 PolarHBondContact O-NE1 3.35Å
5	R	93.3	Very high	87.8	Confident	119 Å²	119	63.8 Å²	63.8	45%	0.449	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.2	168.1	177.5	177.3	163.6	-172.5	-7	110.5	D7 T13 Y14	R5-D7 IonicContact CZ-OD1 2.75Å; R5-D7 IonicContact CZ-OD2 2.7Å; R5-D7 IonicContact NE-OD1 3.6Å; R5-D7 PolarHBondContact NE-OD1 3.45Å; R5-D7 IonicContact NE-OD2 3.62Å; R5-D7 PolarHBondContact NE-OD2 3.23Å; R5-D7 VanDerWaalsContact NE-OD2 3.11Å; R5-D7 IonicContact NH2-OD1 2.65Å; R5-D7 PolarHBondContact NH2-OD1 2.95Å; R5-D7 IonicContact NH2-OD2 3.56Å; R5-D7 PolarHBondContact NH2-OD2 3.34Å; R5-T13 HydrophobicContact CG-CG2 3.72Å; R5-Y14 CarbonylContact C-O 3.1Å; R5-Y14 VanDerWaalsContact CA-O 3.3Å; R5-Y14 WeakPolarHBondContact CA-O 3.06Å
6	F	92.2	Very high	88.3	Confident	73 Å²	73	59.8 Å²	59.8	32%	0.32	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.2	170.9	-175.3	-88.6	0	0	0	108.8	F8 T13 Y14 W18 V555	F6-F8 AromaticContact CD1-CD1 3.74Å; F6-F8 HydrophobicContact CD1-CD1 3.74Å; F6-F8 AromaticContact CD1-CE1 3.58Å; F6-F8 HydrophobicContact CD1-CE1 3.58Å; F6-F8 HydrophobicContact CD1-CG 4.35Å; F6-F8 HydrophobicContact CD1-CZ 4.08Å; F6-F8 AromaticContact CE1-CD1 3.54Å; F6-F8 HydrophobicContact CE1-CD1 3.54Å; F6-F8 AromaticContact CE1-CE1 3.69Å; F6-F8 HydrophobicContact CE1-CE1 3.69Å; F6-F8 HydrophobicContact CE1-CG 4.35Å; F6-T13 CarbonylContact O-C 3.59Å; F6-T13 WeakPolarHBondContact O-CA 3.46Å; F6-Y14 PolarHBondContact N-O 3.26Å; F6-Y14 PolarHBondContact O-N 3.02Å; F6-W18 HydrophobicContact CB-CH2 4.24Å; F6-W18 HydrophobicContact CB-CZ2 3.63Å; F6-W18 HydrophobicContact CG-CH2 4.4Å; F6-W18 HydrophobicContact CG-CZ2 4.25Å; F6-V555 HydrophobicContact CD1-CG2 4.14Å; F6-V555 HydrophobicContact CD2-CG1 4.26Å; F6-V555 HydrophobicContact CD2-CG2 3.71Å; F6-V555 HydrophobicContact CE1-CG2 4.01Å; F6-V555 HydrophobicContact CE2-CB 4.32Å; F6-V555 HydrophobicContact CE2-CG1 3.72Å; F6-V555 HydrophobicContact CE2-CG2 3.56Å; F6-V555 HydrophobicContact CG-CG2 4Å; F6-V555 HydrophobicContact CZ-CG1 4.33Å; F6-V555 HydrophobicContact CZ-CG2 3.72Å
7	D	92.5	Very high	88.7	Confident	80 Å²	80	56.7 Å²	56.7	43%	0.428	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.4	176.2	-62.2	-57	0	0	0	109.8	R5 T13	R5-D7 IonicContact CZ-OD1 2.75Å; R5-D7 IonicContact CZ-OD2 2.7Å; R5-D7 IonicContact NE-OD1 3.6Å; R5-D7 PolarHBondContact NE-OD1 3.45Å; R5-D7 IonicContact NE-OD2 3.62Å; R5-D7 PolarHBondContact NE-OD2 3.23Å; R5-D7 VanDerWaalsContact NE-OD2 3.11Å; R5-D7 IonicContact NH2-OD1 2.65Å; R5-D7 PolarHBondContact NH2-OD1 2.95Å; R5-D7 IonicContact NH2-OD2 3.56Å; R5-D7 PolarHBondContact NH2-OD2 3.34Å; D7-T13 WeakPolarHBondContact OD1-CB 3.48Å; D7-T13 WeakPolarHBondContact OD1-CG2 3.45Å; D7-T13 PolarHBondContact OD1-OG1 3.32Å
8	F	89.8	Confident	89	Confident	46 Å²	46	55.2 Å²	55.2	20%	0.202	31%	0.307	C	S	.	.			trans	-94.5	151.4	-178.3	-59.7	-72.5	0	0	0	111.5	F6 D10 G11 G12 Y553	F6-F8 AromaticContact CD1-CD1 3.74Å; F6-F8 HydrophobicContact CD1-CD1 3.74Å; F6-F8 AromaticContact CD1-CE1 3.58Å; F6-F8 HydrophobicContact CD1-CE1 3.58Å; F6-F8 HydrophobicContact CD1-CG 4.35Å; F6-F8 HydrophobicContact CD1-CZ 4.08Å; F6-F8 AromaticContact CE1-CD1 3.54Å; F6-F8 HydrophobicContact CE1-CD1 3.54Å; F6-F8 AromaticContact CE1-CE1 3.69Å; F6-F8 HydrophobicContact CE1-CE1 3.69Å; F6-F8 HydrophobicContact CE1-CG 4.35Å; F8-D10 WeakPolarHBondContact CB-OD1 3.15Å; F8-D10 PolarHBondContact O-N 2.85Å; F8-G11 PolarHBondContact O-N 2.92Å; F8-G12 PolarHBondContact N-O 3.37Å; F8-Y553 HydrophobicContact CE1-CD1 4.11Å; F8-Y553 HydrophobicContact CE2-CD1 4.31Å; F8-Y553 HydrophobicContact CE2-CE1 4.4Å; F8-Y553 AromaticContact CZ-CD1 3.62Å; F8-Y553 HydrophobicContact CZ-CD1 3.62Å; F8-Y553 HydrophobicContact CZ-CE1 4.15Å
9	D	90.1	Very high	89.3	Confident	184 Å²	184	56.3 Å²	56.3	98%	0.984	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.4	179.7	-62.8	-37.3	0	0	0	114.1	G11	D9-G11 VanDerWaalsContact C-N 3.35Å
10	D	88.4	Confident	89.4	Confident	65 Å²	65	60.4 Å²	60.4	35%	0.348	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-0.6	177.4	73.2	-4.6	0	0	0	113.9	F8 G12 P32 K33	F8-D10 WeakPolarHBondContact CB-OD1 3.15Å; F8-D10 PolarHBondContact O-N 2.85Å; D10-G12 PolarHBondContact OD1-N 2.94Å; D10-P32 HydrophobicContact CB-CB 4.12Å; D10-P32 WeakPolarHBondContact OD2-CB 3.24Å; D10-P32 VanDerWaalsContact OD2-CG 3.28Å; D10-P32 WeakPolarHBondContact OD2-CG 3.47Å; D10-K33 PolarHBondContact O-N 2.85Å
11	G	88	Confident	89.3	Confident	41 Å²	41	58 Å²	58	42%	0.423	32%	0.316	S	S	.	.	S	Bend	trans	81.5	13.9	-177.3	0	0	0	0	0	114.9	F8 D9 K33 G34	F8-G11 PolarHBondContact O-N 2.92Å; D9-G11 VanDerWaalsContact C-N 3.35Å; G11-K33 CarbonylContact O-C 3.53Å; G11-K33 WeakPolarHBondContact O-CA 3.49Å; G11-K33 PolarHBondContact O-N 3.36Å; G11-G34 PolarHBondContact O-N 3.14Å
12	G	91.8	Very high	91.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.01	29%	0.289	C	S	.	.			trans	-79.7	168.4	160.1	0	0	0	0	0	112.2	F8 D10 G31	F8-G12 PolarHBondContact N-O 3.37Å; D10-G12 PolarHBondContact OD1-N 2.94Å; G12-G31 VanDerWaalsContact CA-O 3.29Å; G12-G31 WeakPolarHBondContact CA-O 3.34Å
13	T	93.9	Very high	92	Very high	16 Å²	16	47.6 Å²	47.6	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	134.7	178.5	-58.3	0	0	0	0	110.4	R5 F6 D7 C29 T30 F416	R5-T13 HydrophobicContact CG-CG2 3.72Å; F6-T13 CarbonylContact O-C 3.59Å; F6-T13 WeakPolarHBondContact O-CA 3.46Å; D7-T13 WeakPolarHBondContact OD1-CB 3.48Å; D7-T13 WeakPolarHBondContact OD1-CG2 3.45Å; D7-T13 PolarHBondContact OD1-OG1 3.32Å; T13-C29 CarbonylContact O-C 3.5Å; T13-C29 WeakPolarHBondContact O-CA 3.44Å; T13-T30 PolarHBondContact N-OG1 3.09Å; T13-T30 PolarHBondContact O-N 2.82Å; T13-T30 PolarHBondContact O-OG1 2.83Å; T13-F416 HydrophobicContact CG2-CD2 3.93Å; T13-F416 HydrophobicContact CG2-CE2 3.41Å; T13-F416 VanDerWaalsContact CG2-CE2 3.41Å; T13-F416 HydrophobicContact CG2-CZ 4.17Å
14	Y	95.3	Very high	92.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.3	162.6	-176.9	-94.6	0	0	0	110.6	R5 F6 G17 W18 A23 I28 C29 W42	R5-Y14 CarbonylContact C-O 3.1Å; R5-Y14 VanDerWaalsContact CA-O 3.3Å; R5-Y14 WeakPolarHBondContact CA-O 3.06Å; F6-Y14 PolarHBondContact N-O 3.26Å; F6-Y14 PolarHBondContact O-N 3.02Å; Y14-G17 PolarHBondContact OH-O 3.16Å; Y14-W18 AromaticContact CD1-CE2 3.65Å; Y14-W18 HydrophobicContact CD1-CH2 4.24Å; Y14-W18 AromaticContact CD1-CZ2 3.36Å; Y14-W18 HydrophobicContact CD1-CZ2 3.36Å; Y14-W18 AromaticContact CD1-NE1 3.73Å; Y14-W18 AromaticContact CE1-CE2 3.8Å; Y14-W18 AromaticContact CE1-CZ2 3.94Å; Y14-W18 HydrophobicContact CE1-CZ2 3.94Å; Y14-W18 AromaticContact CE1-NE1 3.71Å; Y14-W18 HydrophobicContact CG-CZ2 4.1Å; Y14-A23 HydrophobicContact CD2-CB 4.31Å; Y14-A23 HydrophobicContact CE1-CB 4.22Å; Y14-A23 HydrophobicContact CE2-CB 3.64Å; Y14-I28 CarbonylContact C-O 3.57Å; Y14-I28 WeakPolarHBondContact CA-O 3.3Å; Y14-I28 WeakPolarHBondContact CD2-O 3.25Å; Y14-C29 HydrophobicContact CD2-CB 4.1Å; Y14-W42 HydrophobicContact CD2-CZ2 4.27Å; Y14-W42 AromaticContact CE2-CD2 3.99Å; Y14-W42 HydrophobicContact CE2-CD2 3.99Å; Y14-W42 AromaticContact CE2-CE2 3.61Å; Y14-W42 HydrophobicContact CE2-CG 4.29Å; Y14-W42 AromaticContact CE2-CZ2 3.91Å; Y14-W42 HydrophobicContact CE2-CZ2 3.91Å; Y14-W42 AromaticContact CE2-NE1 3.7Å
15	C	95.9	Very high	92.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	114.3	167.8	-170	0	0	0	0	109.7	G27 I28 A409 F416	C15-G27 CarbonylContact O-C 3.6Å; C15-G27 VanDerWaalsContact O-CA 3.23Å; C15-G27 WeakPolarHBondContact O-CA 3.29Å; C15-I28 PolarHBondContact N-O 3.12Å; C15-I28 PolarHBondContact O-N 2.89Å; C15-A409 HydrophobicContact CB-CB 4.22Å; C15-F416 HydrophobicContact CB-CD1 3.78Å; C15-F416 HydrophobicContact CB-CE1 3.86Å; C15-F416 HydrophobicContact CB-CG 4.16Å; C15-F416 HydrophobicContact CB-CZ 4.32Å
16	G	96.1	Very high	93	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.3	-162.3	-172.9	0	0	0	0	0	114	G3 G4 H26 L412	G3-G16 CarbonylContact C-O 3.29Å; G3-G16 WeakPolarHBondContact CA-O 3.4Å; G4-G16 PolarHBondContact N-O 3Å; G4-G16 PolarHBondContact O-N 3.2Å; G16-H26 VanDerWaalsContact CA-O 3.32Å; G16-H26 WeakPolarHBondContact CA-O 3.3Å; G16-L412 WeakPolarHBondContact O-CD1 3.41Å
17	G	94.4	Very high	93.2	Very high	7 Å²	7	40.5 Å²	40.5	7%	0.072	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	150.1	178.7	0	0	0	0	0	114.5	Y14 H24 H26	Y14-G17 PolarHBondContact OH-O 3.16Å; G17-H24 CarbonylContact C-O 3.55Å; G17-H24 WeakPolarHBondContact CA-O 3.32Å; G17-H24 PolarHBondContact O-N 3.24Å; G17-H26 PolarHBondContact N-O 2.84Å; G17-H26 VanDerWaalsContact N-O 3.12Å
18	W	94.1	Very high	93.4	Very high	29 Å²	29	36.7 Å²	36.7	11%	0.11	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.8	177	-64.4	85.7	0	0	0	112	T2 G4 F6 Y14 K22 V555	T2-W18 WeakPolarHBondContact O-CA 3.46Å; T2-W18 WeakPolarHBondContact O-CB 3.31Å; T2-W18 PolarHBondContact O-N 2.78Å; G4-W18 PolarHBondContact O-NE1 3.35Å; F6-W18 HydrophobicContact CB-CH2 4.24Å; F6-W18 HydrophobicContact CB-CZ2 3.63Å; F6-W18 HydrophobicContact CG-CH2 4.4Å; F6-W18 HydrophobicContact CG-CZ2 4.25Å; Y14-W18 AromaticContact CD1-CE2 3.65Å; Y14-W18 HydrophobicContact CD1-CH2 4.24Å; Y14-W18 AromaticContact CD1-CZ2 3.36Å; Y14-W18 HydrophobicContact CD1-CZ2 3.36Å; Y14-W18 AromaticContact CD1-NE1 3.73Å; Y14-W18 AromaticContact CE1-CE2 3.8Å; Y14-W18 AromaticContact CE1-CZ2 3.94Å; Y14-W18 HydrophobicContact CE1-CZ2 3.94Å; Y14-W18 AromaticContact CE1-NE1 3.71Å; Y14-W18 HydrophobicContact CG-CZ2 4.1Å; W18-K22 WeakPolarHBondContact CA-O 3.11Å; W18-V555 HydrophobicContact CH2-CB 4.44Å; W18-V555 HydrophobicContact CH2-CG2 3.42Å; W18-V555 VanDerWaalsContact CH2-CG2 3.42Å; W18-V555 HydrophobicContact CZ2-CG2 4.37Å; W18-V555 HydrophobicContact CZ3-CB 4.11Å; W18-V555 HydrophobicContact CZ3-CG2 3.53Å
19	E	94.4	Very high	93.7	Very high	76 Å²	76	34.8 Å²	34.8	36%	0.355	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	133.3	172.9	-170.9	174.2	-105.3	0	0	109.1	G21 K22 H24	E19-G21 PolarHBondContact O-N 2.84Å; E19-K22 PolarHBondContact N-O 2.81Å; E19-K22 WeakPolarHBondContact O-CA 3.46Å; E19-K22 WeakPolarHBondContact O-CB 3.36Å; E19-K22 PolarHBondContact O-N 3.36Å; E19-K22 VanDerWaalsContact O-O 3.11Å; E19-H24 HydrophobicContact CB-CB 3.6Å; E19-H24 IonicContact OE2-CE1 3.83Å; E19-H24 PolarHBondContact OE2-CE1 2.92Å; E19-H24 IonicContact OE2-CG 2.7Å; E19-H24 IonicContact OE2-ND1 2.76Å; E19-H24 PolarHBondContact OE2-ND1 3.05Å; E19-H24 IonicContact OE2-NE2 3.93Å
20	E	90.8	Very high	93.9	Very high	138 Å²	138	26.5 Å²	26.5	65%	0.645	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	29.2	-175.8	-58.7	-172.5	157.7	0	0	115.7	K22	E20-K22 VanDerWaalsContact C-N 3.29Å; E20-K22 HydrophobicContact CB-CD 4.44Å; E20-K22 PolarHBondContact O-N 3.13Å; E20-K22 IonicContact OE2-NZ 3.02Å; E20-K22 PolarHBondContact OE2-NZ 2.78Å
21	G	89.1	Confident	93.9	Very high	10 Å²	10	24.1 Å²	24.1	10%	0.103	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	17.8	-174.5	0	0	0	0	0	114.2	E19 V555	E19-G21 PolarHBondContact O-N 2.84Å; G21-V555 PolarHBondContact O-N 3.28Å
22	K	92.8	Very high	94	Very high	54 Å²	54	24.3 Å²	24.3	24%	0.235	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	152.6	177.8	-52.9	157.6	-164.3	158	0	110.1	W18 E19 E20 H24 H44 Y553 Y554	W18-K22 WeakPolarHBondContact CA-O 3.11Å; E19-K22 PolarHBondContact N-O 2.81Å; E19-K22 WeakPolarHBondContact O-CA 3.46Å; E19-K22 WeakPolarHBondContact O-CB 3.36Å; E19-K22 PolarHBondContact O-N 3.36Å; E19-K22 VanDerWaalsContact O-O 3.11Å; E20-K22 VanDerWaalsContact C-N 3.29Å; E20-K22 HydrophobicContact CB-CD 4.44Å; E20-K22 PolarHBondContact O-N 3.13Å; E20-K22 IonicContact OE2-NZ 3.02Å; E20-K22 PolarHBondContact OE2-NZ 2.78Å; K22-H24 PolarHBondContact O-N 3.14Å; K22-H44 HydrophobicContact CD-CB 4.31Å; K22-Y553 WeakPolarHBondContact CA-O 3.41Å; K22-Y554 HydrophobicContact CG-CD2 4.03Å
23	A	94.1	Very high	93.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	126.8	172.2	0	0	0	0	0	111.2	Y14 W42 H44 G45 Y553	Y14-A23 HydrophobicContact CD2-CB 4.31Å; Y14-A23 HydrophobicContact CE1-CB 4.22Å; Y14-A23 HydrophobicContact CE2-CB 3.64Å; A23-W42 HydrophobicContact CB-CB 4.34Å; A23-W42 HydrophobicContact CB-CD2 4.07Å; A23-W42 HydrophobicContact CB-CE3 3.9Å; A23-W42 HydrophobicContact CB-CG 4.29Å; A23-H44 PolarHBondContact O-N 2.85Å; A23-G45 PolarHBondContact O-N 3Å; A23-Y553 PolarHBondContact N-O 3.42Å
24	H	95.6	Very high	93.2	Very high	33 Å²	33	32.8 Å²	32.8	15%	0.153	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	143.7	-179.6	-168.6	122.3	0	0	0	111.1	G17 E19 K22	G17-H24 CarbonylContact C-O 3.55Å; G17-H24 WeakPolarHBondContact CA-O 3.32Å; G17-H24 PolarHBondContact O-N 3.24Å; E19-H24 HydrophobicContact CB-CB 3.6Å; E19-H24 IonicContact OE2-CE1 3.83Å; E19-H24 PolarHBondContact OE2-CE1 2.92Å; E19-H24 IonicContact OE2-CG 2.7Å; E19-H24 IonicContact OE2-ND1 2.76Å; E19-H24 PolarHBondContact OE2-ND1 3.05Å; E19-H24 IonicContact OE2-NE2 3.93Å; K22-H24 PolarHBondContact O-N 3.14Å
25	G	96.1	Very high	92.8	Very high	12 Å²	12	37.5 Å²	37.5	12%	0.124	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.2	-119.5	173.9	0	0	0	0	0	109.1	S41 W42	G25-S41 CarbonylContact O-C 3.54Å; G25-S41 WeakPolarHBondContact O-CA 3.44Å; G25-S41 WeakPolarHBondContact O-CB 3.27Å; G25-W42 PolarHBondContact N-O 2.88Å; G25-W42 PolarHBondContact O-N 2.85Å
26	H	97.4	Very high	92.7	Very high	59 Å²	59	37.5 Å²	37.5	27%	0.273	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.5	177.5	-51.3	93.7	0	0	0	110.1	G16 G17 E401 I404 A405 V408	G16-H26 VanDerWaalsContact CA-O 3.32Å; G16-H26 WeakPolarHBondContact CA-O 3.3Å; G17-H26 PolarHBondContact N-O 2.84Å; G17-H26 VanDerWaalsContact N-O 3.12Å; H26-E401 IonicContact CD2-OE2 2.69Å; H26-E401 IonicContact NE2-OE2 2.64Å; H26-I404 HydrophobicContact CB-CG2 4.07Å; H26-A405 HydrophobicContact CB-CB 4.17Å; H26-V408 HydrophobicContact CB-CG2 4.4Å
27	G	96.4	Very high	92.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	163.3	-179.5	0	0	0	0	0	114.3	C15 G40 W42	C15-G27 CarbonylContact O-C 3.6Å; C15-G27 VanDerWaalsContact O-CA 3.23Å; C15-G27 WeakPolarHBondContact O-CA 3.29Å; G27-G40 PolarHBondContact N-O 2.55Å; G27-G40 PolarHBondContact O-N 3.3Å; G27-W42 PolarHBondContact O-NE1 2.81Å
28	I	96.8	Very high	92.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.3	174.8	-59.7	179.1	0	0	0	108.4	Y14 C15 E37 Y38 A405 R406 A409 F416 Q418	Y14-I28 CarbonylContact C-O 3.57Å; Y14-I28 WeakPolarHBondContact CA-O 3.3Å; Y14-I28 WeakPolarHBondContact CD2-O 3.25Å; C15-I28 PolarHBondContact N-O 3.12Å; C15-I28 PolarHBondContact O-N 2.89Å; I28-E37 HydrophobicContact CG2-CG 3.75Å; I28-Y38 CarbonylContact C-O 3.48Å; I28-Y38 VanDerWaalsContact CA-O 3.28Å; I28-Y38 WeakPolarHBondContact CA-O 3.32Å; I28-Y38 WeakPolarHBondContact CG2-O 3.13Å; I28-A405 HydrophobicContact CG1-CB 4.48Å; I28-R406 HydrophobicContact CD1-CG 3.84Å; I28-A409 HydrophobicContact CD1-CB 3.68Å; I28-A409 HydrophobicContact CG1-CB 4.05Å; I28-F416 HydrophobicContact CB-CE1 3.93Å; I28-F416 HydrophobicContact CD1-CE1 4.14Å; I28-F416 HydrophobicContact CG2-CE1 3.81Å; I28-F416 HydrophobicContact CG2-CZ 4.08Å; I28-Q418 HydrophobicContact CD1-CG 3.75Å
29	C	95.4	Very high	92.9	Very high	5 Å²	5	36 Å²	36	3%	0.034	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.1	165.4	-165.6	0	0	0	0	109.4	T13 Y14 Y38 W42	T13-C29 CarbonylContact O-C 3.5Å; T13-C29 WeakPolarHBondContact O-CA 3.44Å; Y14-C29 HydrophobicContact CD2-CB 4.1Å; C29-Y38 PolarHBondContact N-O 3.5Å; C29-Y38 PolarHBondContact O-N 2.99Å; C29-W42 HydrophobicContact CB-CH2 3.9Å; C29-W42 HydrophobicContact CB-CZ2 3.64Å
30	T	94.9	Very high	93.1	Very high	11 Å²	11	32.3 Å²	32.3	7%	0.067	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	150.9	165.7	57.1	0	0	0	0	110.5	T13 G36 F416 P419	T13-T30 PolarHBondContact N-OG1 3.09Å; T13-T30 PolarHBondContact O-N 2.82Å; T13-T30 PolarHBondContact O-OG1 2.83Å; T30-G36 VanDerWaalsContact CA-O 3.22Å; T30-G36 WeakPolarHBondContact CA-O 3.15Å; T30-F416 HydrophobicContact CG2-CZ 4.3Å; T30-P419 HydrophobicContact CG2-CG 3.8Å
31	G	89.4	Confident	93.4	Very high	14 Å²	14	26.5 Å²	26.5	14%	0.144	14%	0.142	C	C	.	.			trans	-76	178.5	173.4	0	0	0	0	0	112.9	G12 K33 G34 Q35 G36	G12-G31 VanDerWaalsContact CA-O 3.29Å; G12-G31 WeakPolarHBondContact CA-O 3.34Å; G31-K33 PolarHBondContact O-N 3.21Å; G31-G34 CarbonylContact O-C 3.56Å; G31-G34 VanDerWaalsContact O-CA 3.31Å; G31-G34 WeakPolarHBondContact O-CA 3.43Å; G31-G34 PolarHBondContact O-N 2.8Å; G31-Q35 VanDerWaalsContact CA-O 3.3Å; G31-Q35 WeakPolarHBondContact CA-O 3.5Å; G31-Q35 PolarHBondContact N-O 2.92Å; G31-Q35 PolarHBondContact O-N 3.18Å; G31-G36 PolarHBondContact N-O 3.17Å; G31-G36 VanDerWaalsContact N-O 3.08Å
32	P	88.7	Confident	93.8	Very high	46 Å²	46	26.2 Å²	26.2	30%	0.299	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-49.8	138.8	179.8	-19.8	22.8	0	0	0	112.2	D10 G34 Q35	D10-P32 HydrophobicContact CB-CB 4.12Å; D10-P32 WeakPolarHBondContact OD2-CB 3.24Å; D10-P32 VanDerWaalsContact OD2-CG 3.28Å; D10-P32 WeakPolarHBondContact OD2-CG 3.47Å; P32-G34 PolarHBondContact O-N 3.37Å; P32-Q35 VanDerWaalsContact O-CB 3.31Å; P32-Q35 WeakPolarHBondContact O-CB 3.36Å; P32-Q35 WeakPolarHBondContact O-CG 3.34Å; P32-Q35 PolarHBondContact O-N 2.79Å
33	K	87.1	Confident	93.9	Very high	172 Å²	172	25.8 Å²	25.8	75%	0.748	14%	0.142	S	C	*	.	G	3₁₀ helix	trans	53.8	34.7	-175	-48.1	176.8	-176.7	179.4	0	113.4	D10 G11 G31 Q35	D10-K33 PolarHBondContact O-N 2.85Å; G11-K33 CarbonylContact O-C 3.53Å; G11-K33 WeakPolarHBondContact O-CA 3.49Å; G11-K33 PolarHBondContact O-N 3.36Å; G31-K33 PolarHBondContact O-N 3.21Å; K33-Q35 HydrophobicContact CB-CG 4.4Å; K33-Q35 PolarHBondContact O-N 3.4Å; K33-Q35 PolarHBondContact O-NE2 3.41Å
34	G	81.8	Confident	93.9	Very high	22 Å²	22	30.2 Å²	30.2	23%	0.227	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	63.9	16.6	-175.7	0	0	0	0	0	115.1	G11 G31 P32 G36 Y423	G11-G34 PolarHBondContact O-N 3.14Å; G31-G34 CarbonylContact O-C 3.56Å; G31-G34 VanDerWaalsContact O-CA 3.31Å; G31-G34 WeakPolarHBondContact O-CA 3.43Å; G31-G34 PolarHBondContact O-N 2.8Å; P32-G34 PolarHBondContact O-N 3.37Å; G34-G36 PolarHBondContact O-N 2.89Å; G34-Y423 PolarHBondContact O-OH 2.99Å
35	Q	88.1	Confident	93.8	Very high	99 Å²	99	28.7 Å²	28.7	46%	0.463	16%	0.156	S	C	.	.			trans	-84.7	110.8	-172.5	-64.9	-59.7	-54.1	0	0	112.5	G31 P32 K33 P55	G31-Q35 VanDerWaalsContact CA-O 3.3Å; G31-Q35 WeakPolarHBondContact CA-O 3.5Å; G31-Q35 PolarHBondContact N-O 2.92Å; G31-Q35 PolarHBondContact O-N 3.18Å; P32-Q35 VanDerWaalsContact O-CB 3.31Å; P32-Q35 WeakPolarHBondContact O-CB 3.36Å; P32-Q35 WeakPolarHBondContact O-CG 3.34Å; P32-Q35 PolarHBondContact O-N 2.79Å; K33-Q35 HydrophobicContact CB-CG 4.4Å; K33-Q35 PolarHBondContact O-N 3.4Å; K33-Q35 PolarHBondContact O-NE2 3.41Å; Q35-P55 HydrophobicContact CB-CG 4.12Å
36	G	92.6	Very high	93.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	83	158	-178.9	0	0	0	0	0	112.7	T30 G31 G34 T53 Y423	T30-G36 VanDerWaalsContact CA-O 3.22Å; T30-G36 WeakPolarHBondContact CA-O 3.15Å; G31-G36 PolarHBondContact N-O 3.17Å; G31-G36 VanDerWaalsContact N-O 3.08Å; G34-G36 PolarHBondContact O-N 2.89Å; G36-T53 CarbonylContact C-O 3.58Å; G36-T53 VanDerWaalsContact CA-O 3.23Å; G36-T53 WeakPolarHBondContact CA-O 3.47Å; G36-Y423 PolarHBondContact N-OH 3.47Å
37	E	96	Very high	93.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	120.8	-175.1	-179	-176	105.8	0	0	110.1	I28 Y52 T53 R406 P419 G420	I28-E37 HydrophobicContact CG2-CG 3.75Å; E37-Y52 CarbonylContact O-C 3.54Å; E37-Y52 VanDerWaalsContact O-CA 3.26Å; E37-Y52 WeakPolarHBondContact O-CA 3.36Å; E37-T53 PolarHBondContact N-O 3.07Å; E37-T53 PolarHBondContact O-N 3.05Å; E37-R406 IonicContact OE1-CZ 3.61Å; E37-R406 IonicContact OE1-NE 2.74Å; E37-R406 IonicContact OE1-NH2 3.92Å; E37-R406 PolarHBondContact OE1-NH2 3.04Å; E37-P419 HydrophobicContact CB-CG 4.37Å; E37-P419 WeakPolarHBondContact OE2-CD 3.38Å; E37-G420 WeakPolarHBondContact OE2-CA 3.38Å; E37-G420 PolarHBondContact OE2-N 2.84Å
38	Y	97.1	Very high	93.6	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.4	152.5	-179.7	-88.9	0	0	0	109.3	I28 C29 S41 W42 E47 V49 W64	I28-Y38 CarbonylContact C-O 3.48Å; I28-Y38 VanDerWaalsContact CA-O 3.28Å; I28-Y38 WeakPolarHBondContact CA-O 3.32Å; I28-Y38 WeakPolarHBondContact CG2-O 3.13Å; C29-Y38 PolarHBondContact N-O 3.5Å; C29-Y38 PolarHBondContact O-N 2.99Å; Y38-S41 PolarHBondContact OH-O 2.84Å; Y38-W42 AromaticContact CD1-CE2 3.64Å; Y38-W42 HydrophobicContact CD1-CH2 4.16Å; Y38-W42 AromaticContact CD1-CZ2 3.3Å; Y38-W42 HydrophobicContact CD1-CZ2 3.3Å; Y38-W42 AromaticContact CD1-NE1 3.77Å; Y38-W42 HydrophobicContact CE1-CD2 4.34Å; Y38-W42 AromaticContact CE1-CE2 3.55Å; Y38-W42 AromaticContact CE1-CZ2 3.69Å; Y38-W42 HydrophobicContact CE1-CZ2 3.69Å; Y38-W42 AromaticContact CE1-NE1 3.51Å; Y38-W42 HydrophobicContact CG-CZ2 4.12Å; Y38-E47 HydrophobicContact CD1-CG 4.43Å; Y38-E47 HydrophobicContact CD2-CB 4.42Å; Y38-E47 HydrophobicContact CD2-CG 3.88Å; Y38-E47 HydrophobicContact CE1-CB 4.43Å; Y38-E47 HydrophobicContact CE1-CG 4.21Å; Y38-E47 HydrophobicContact CE2-CB 3.68Å; Y38-E47 HydrophobicContact CE2-CG 3.65Å; Y38-E47 HydrophobicContact CG-CG 4.26Å; Y38-V49 PolarHBondContact OH-O 3.38Å; Y38-W64 HydrophobicContact CD2-CZ2 4.1Å; Y38-W64 AromaticContact CE2-CD1 3.89Å; Y38-W64 HydrophobicContact CE2-CD2 4.1Å; Y38-W64 AromaticContact CE2-CE2 3.73Å; Y38-W64 HydrophobicContact CE2-CG 4.2Å; Y38-W64 HydrophobicContact CE2-CZ2 4.17Å; Y38-W64 AromaticContact CE2-NE1 3.62Å
39	S	97.4	Very high	93.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	132.9	169.8	53	0	0	0	0	108.8	G50 G51 C402 R406	S39-G50 CarbonylContact O-C 3.54Å; S39-G50 VanDerWaalsContact O-CA 3.3Å; S39-G50 WeakPolarHBondContact O-CA 3.21Å; S39-G51 PolarHBondContact N-O 3.08Å; S39-G51 PolarHBondContact O-N 3.12Å; S39-G51 PolarHBondContact OG-O 3.42Å; S39-C402 PolarHBondContact O-SG 3.24Å; S39-C402 WeakPolarHBondContact OG-CB 3.45Å; S39-C402 PolarHBondContact OG-SG 2.85Å; S39-R406 PolarHBondContact OG-NH2 3.06Å
40	G	97.6	Very high	93.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.7	-157.9	-179.3	0	0	0	0	0	113.4	G27 V49	G27-G40 PolarHBondContact N-O 2.55Å; G27-G40 PolarHBondContact O-N 3.3Å; G40-V49 WeakPolarHBondContact CA-O 3.38Å
41	S	97.6	Very high	93.9	Very high	15 Å²	15	32.1 Å²	32.1	11%	0.105	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	153.7	176.5	44.8	0	0	0	0	114.4	G25 Y38 V48 V49 E401	G25-S41 CarbonylContact O-C 3.54Å; G25-S41 WeakPolarHBondContact O-CA 3.44Å; G25-S41 WeakPolarHBondContact O-CB 3.27Å; Y38-S41 PolarHBondContact OH-O 2.84Å; S41-V48 PolarHBondContact O-N 3.44Å; S41-V48 VanDerWaalsContact O-N 3.12Å; S41-V49 PolarHBondContact N-O 3.37Å; S41-V49 PolarHBondContact OG-N 2.94Å; S41-V49 PolarHBondContact OG-O 3.08Å; S41-V49 VanDerWaalsContact OG-O 3.13Å; S41-E401 WeakPolarHBondContact CB-OE2 3.34Å; S41-E401 PolarHBondContact OG-OE2 2.83Å
42	W	96.6	Very high	94.2	Very high	5 Å²	5	33.7 Å²	33.7	2%	0.019	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.5	-172.4	-66.4	88.1	0	0	0	110.3	Y14 A23 G25 G27 C29 Y38 F46 E47 Y553	Y14-W42 HydrophobicContact CD2-CZ2 4.27Å; Y14-W42 AromaticContact CE2-CD2 3.99Å; Y14-W42 HydrophobicContact CE2-CD2 3.99Å; Y14-W42 AromaticContact CE2-CE2 3.61Å; Y14-W42 HydrophobicContact CE2-CG 4.29Å; Y14-W42 AromaticContact CE2-CZ2 3.91Å; Y14-W42 HydrophobicContact CE2-CZ2 3.91Å; Y14-W42 AromaticContact CE2-NE1 3.7Å; A23-W42 HydrophobicContact CB-CB 4.34Å; A23-W42 HydrophobicContact CB-CD2 4.07Å; A23-W42 HydrophobicContact CB-CE3 3.9Å; A23-W42 HydrophobicContact CB-CG 4.29Å; G25-W42 PolarHBondContact N-O 2.88Å; G25-W42 PolarHBondContact O-N 2.85Å; G27-W42 PolarHBondContact O-NE1 2.81Å; C29-W42 HydrophobicContact CB-CH2 3.9Å; C29-W42 HydrophobicContact CB-CZ2 3.64Å; Y38-W42 AromaticContact CD1-CE2 3.64Å; Y38-W42 HydrophobicContact CD1-CH2 4.16Å; Y38-W42 AromaticContact CD1-CZ2 3.3Å; Y38-W42 HydrophobicContact CD1-CZ2 3.3Å; Y38-W42 AromaticContact CD1-NE1 3.77Å; Y38-W42 HydrophobicContact CE1-CD2 4.34Å; Y38-W42 AromaticContact CE1-CE2 3.55Å; Y38-W42 AromaticContact CE1-CZ2 3.69Å; Y38-W42 HydrophobicContact CE1-CZ2 3.69Å; Y38-W42 AromaticContact CE1-NE1 3.51Å; Y38-W42 HydrophobicContact CG-CZ2 4.12Å; W42-F46 CarbonylContact C-O 3.5Å; W42-F46 VanDerWaalsContact CA-O 3.3Å; W42-F46 WeakPolarHBondContact CA-O 3.28Å; W42-E47 HydrophobicContact CE3-CG 4.41Å; W42-E47 HydrophobicContact CH2-CG 3.87Å; W42-E47 HydrophobicContact CZ2-CG 4.47Å; W42-E47 HydrophobicContact CZ3-CG 3.81Å; W42-Y553 HydrophobicContact CE3-CD2 4.45Å; W42-Y553 AromaticContact CH2-CD2 3.97Å; W42-Y553 HydrophobicContact CH2-CD2 3.97Å; W42-Y553 AromaticContact CH2-CE2 3.65Å; W42-Y553 HydrophobicContact CH2-CE2 3.65Å; W42-Y553 AromaticContact CZ3-CD2 3.46Å; W42-Y553 HydrophobicContact CZ3-CD2 3.46Å; W42-Y553 VanDerWaalsContact CZ3-CD2 3.46Å; W42-Y553 AromaticContact CZ3-CE2 3.49Å; W42-Y553 HydrophobicContact CZ3-CE2 3.49Å; W42-Y553 VanDerWaalsContact CZ3-CE2 3.49Å; W42-Y553 HydrophobicContact CZ3-CG 4.37Å
43	S	95.6	Very high	94.6	Very high	45 Å²	45	32 Å²	32	32%	0.315	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	122.9	171.1	-175.2	0	0	0	0	109.9	G45 F46	S43-G45 PolarHBondContact O-N 3.06Å; S43-G45 VanDerWaalsContact O-N 3.08Å; S43-F46 PolarHBondContact N-O 3.28Å; S43-F46 PolarHBondContact O-N 3.25Å
44	H	93.3	Very high	94.9	Very high	92 Å²	92	27.7 Å²	27.7	43%	0.426	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	34.5	174.7	-56.3	74.7	0	0	0	114.7	K22 A23	K22-H44 HydrophobicContact CD-CB 4.31Å; A23-H44 PolarHBondContact O-N 2.85Å
45	G	92.9	Very high	95.5	Very high	2 Å²	2	28.8 Å²	28.8	2%	0.021	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	17.1	179.9	0	0	0	0	0	115.4	A23 S43 Y553	A23-G45 PolarHBondContact O-N 3Å; S43-G45 PolarHBondContact O-N 3.06Å; S43-G45 VanDerWaalsContact O-N 3.08Å; G45-Y553 WeakPolarHBondContact O-CD2 3.41Å; G45-Y553 PolarHBondContact O-N 2.87Å
46	F	94.1	Very high	95.6	Very high	62 Å²	62	27.4 Å²	27.4	27%	0.272	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.1	175.2	-60.6	-72.9	0	0	0	112.9	W42 S43 Y550	W42-F46 CarbonylContact C-O 3.5Å; W42-F46 VanDerWaalsContact CA-O 3.3Å; W42-F46 WeakPolarHBondContact CA-O 3.28Å; S43-F46 PolarHBondContact N-O 3.28Å; S43-F46 PolarHBondContact O-N 3.25Å; F46-Y550 HydrophobicContact CE1-CD1 4.27Å; F46-Y550 AromaticContact CE1-CE1 3.43Å; F46-Y550 HydrophobicContact CE1-CE1 3.43Å; F46-Y550 VanDerWaalsContact CE1-CE1 3.43Å; F46-Y550 AromaticContact CE1-CZ 3.73Å; F46-Y550 AromaticContact CZ-CE1 3.64Å; F46-Y550 HydrophobicContact CZ-CE1 3.64Å
47	E	95.9	Very high	95.5	Very high	18 Å²	18	27.4 Å²	27.4	8%	0.084	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.8	172.4	-52.1	85.7	168.5	0	0	110.9	Y38 W42 W64 G67	Y38-E47 HydrophobicContact CD1-CG 4.43Å; Y38-E47 HydrophobicContact CD2-CB 4.42Å; Y38-E47 HydrophobicContact CD2-CG 3.88Å; Y38-E47 HydrophobicContact CE1-CB 4.43Å; Y38-E47 HydrophobicContact CE1-CG 4.21Å; Y38-E47 HydrophobicContact CE2-CB 3.68Å; Y38-E47 HydrophobicContact CE2-CG 3.65Å; Y38-E47 HydrophobicContact CG-CG 4.26Å; W42-E47 HydrophobicContact CE3-CG 4.41Å; W42-E47 HydrophobicContact CH2-CG 3.87Å; W42-E47 HydrophobicContact CZ2-CG 4.47Å; W42-E47 HydrophobicContact CZ3-CG 3.81Å; E47-W64 HydrophobicContact CB-CB 3.59Å; E47-W64 HydrophobicContact CB-CD2 4.21Å; E47-W64 HydrophobicContact CB-CE3 4.45Å; E47-W64 HydrophobicContact CB-CG 3.85Å; E47-W64 WeakPolarHBondContact O-CB 3.26Å; E47-G67 WeakPolarHBondContact OE2-CA 3.46Å; E47-G67 PolarHBondContact OE2-N 2.91Å
48	V	96.6	Very high	95.5	Very high	57 Å²	57	28.7 Å²	28.7	35%	0.345	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-59	-179.5	-168.2	0	0	0	0	112.1	S41 W64	S41-V48 PolarHBondContact O-N 3.44Å; S41-V48 VanDerWaalsContact O-N 3.12Å; V48-W64 PolarHBondContact O-N 3.34Å
49	V	97.9	Very high	95.5	Very high	19 Å²	19	29.3 Å²	29.3	12%	0.115	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	126.7	174.9	-171	0	0	0	0	108.6	Y38 G40 S41 Y63 A398 E401	Y38-V49 PolarHBondContact OH-O 3.38Å; G40-V49 WeakPolarHBondContact CA-O 3.38Å; S41-V49 PolarHBondContact N-O 3.37Å; S41-V49 PolarHBondContact OG-N 2.94Å; S41-V49 PolarHBondContact OG-O 3.08Å; S41-V49 VanDerWaalsContact OG-O 3.13Å; V49-Y63 HydrophobicContact CG2-CD1 3.64Å; V49-Y63 HydrophobicContact CG2-CE1 3.62Å; V49-A398 HydrophobicContact CG1-CB 3.9Å; V49-E401 HydrophobicContact CB-CG 4.09Å; V49-E401 HydrophobicContact CG1-CG 3.95Å
50	G	97.5	Very high	95.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.4	175.1	-176.5	0	0	0	0	0	115.2	S39 G62 W64	S39-G50 CarbonylContact O-C 3.54Å; S39-G50 VanDerWaalsContact O-CA 3.3Å; S39-G50 WeakPolarHBondContact O-CA 3.21Å; G50-G62 PolarHBondContact N-O 3.35Å; G50-G62 PolarHBondContact O-N 3.25Å; G50-W64 PolarHBondContact O-NE1 3.03Å
51	G	97.5	Very high	95.5	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.9	177.9	0	0	0	0	0	111.7	S39 Y60 C402	S39-G51 PolarHBondContact N-O 3.08Å; S39-G51 PolarHBondContact O-N 3.12Å; S39-G51 PolarHBondContact OG-O 3.42Å; G51-Y60 CarbonylContact C-O 3.53Å; G51-Y60 WeakPolarHBondContact CA-O 3.34Å; G51-C402 VanDerWaalsContact CA-SG 3.53Å; G51-C402 PolarHBondContact N-SG 3.46Å
52	Y	96.8	Very high	95.5	Very high	47 Å²	47	30.2 Å²	30.2	18%	0.184	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.6	166.3	-169.3	-76.9	0	0	0	110.3	E37 W54 T59 Y60 W64	E37-Y52 CarbonylContact O-C 3.54Å; E37-Y52 VanDerWaalsContact O-CA 3.26Å; E37-Y52 WeakPolarHBondContact O-CA 3.36Å; Y52-W54 AromaticContact CD1-CD2 3.66Å; Y52-W54 HydrophobicContact CD1-CD2 3.66Å; Y52-W54 AromaticContact CD1-CE2 3.55Å; Y52-W54 HydrophobicContact CD1-CE3 4.06Å; Y52-W54 HydrophobicContact CD1-CG 4.05Å; Y52-W54 HydrophobicContact CD1-CH2 4.23Å; Y52-W54 AromaticContact CD1-CZ2 3.85Å; Y52-W54 HydrophobicContact CD1-CZ2 3.85Å; Y52-W54 HydrophobicContact CD1-CZ3 4.34Å; Y52-W54 AromaticContact CD1-NE1 3.88Å; Y52-W54 HydrophobicContact CE1-CB 4.39Å; Y52-W54 AromaticContact CE1-CD1 3.47Å; Y52-W54 VanDerWaalsContact CE1-CD1 3.47Å; Y52-W54 AromaticContact CE1-CD2 3.76Å; Y52-W54 HydrophobicContact CE1-CD2 3.76Å; Y52-W54 AromaticContact CE1-CE2 3.59Å; Y52-W54 AromaticContact CE1-CG 3.67Å; Y52-W54 HydrophobicContact CE1-CG 3.67Å; Y52-W54 HydrophobicContact CE1-CZ2 4.26Å; Y52-W54 AromaticContact CE1-NE1 3.4Å; Y52-T59 CarbonylContact O-C 3.55Å; Y52-T59 VanDerWaalsContact O-CA 3.31Å; Y52-T59 WeakPolarHBondContact O-CA 3.31Å; Y52-Y60 PolarHBondContact N-O 2.86Å; Y52-Y60 PolarHBondContact O-N 2.78Å; Y52-W64 VanDerWaalsContact CB-CZ2 3.47Å; Y52-W64 HydrophobicContact CD2-CH2 4.3Å; Y52-W64 HydrophobicContact CG-CH2 4.14Å
53	T	96.6	Very high	95.6	Very high	10 Å²	10	34.8 Å²	34.8	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.1	175	-53.5	0	0	0	0	109.5	G36 E37 N58 T59 Y423 V424	G36-T53 CarbonylContact C-O 3.58Å; G36-T53 VanDerWaalsContact CA-O 3.23Å; G36-T53 WeakPolarHBondContact CA-O 3.47Å; E37-T53 PolarHBondContact N-O 3.07Å; E37-T53 PolarHBondContact O-N 3.05Å; T53-N58 WeakPolarHBondContact CA-O 3.46Å; T53-T59 HydrophobicContact CG2-CG2 4.1Å; T53-Y423 HydrophobicContact CG2-CD2 4.12Å; T53-V424 HydrophobicContact CG2-CG2 3.92Å
54	W	94.3	Very high	95.7	Very high	82 Å²	82	34 Å²	34	31%	0.311	17%	0.168	S	C	.	.			trans	-80.8	154.2	173.5	-70.8	-83.7	0	0	0	110.8	Y52 S56 G57 N58	Y52-W54 AromaticContact CD1-CD2 3.66Å; Y52-W54 HydrophobicContact CD1-CD2 3.66Å; Y52-W54 AromaticContact CD1-CE2 3.55Å; Y52-W54 HydrophobicContact CD1-CE3 4.06Å; Y52-W54 HydrophobicContact CD1-CG 4.05Å; Y52-W54 HydrophobicContact CD1-CH2 4.23Å; Y52-W54 AromaticContact CD1-CZ2 3.85Å; Y52-W54 HydrophobicContact CD1-CZ2 3.85Å; Y52-W54 HydrophobicContact CD1-CZ3 4.34Å; Y52-W54 AromaticContact CD1-NE1 3.88Å; Y52-W54 HydrophobicContact CE1-CB 4.39Å; Y52-W54 AromaticContact CE1-CD1 3.47Å; Y52-W54 VanDerWaalsContact CE1-CD1 3.47Å; Y52-W54 AromaticContact CE1-CD2 3.76Å; Y52-W54 HydrophobicContact CE1-CD2 3.76Å; Y52-W54 AromaticContact CE1-CE2 3.59Å; Y52-W54 AromaticContact CE1-CG 3.67Å; Y52-W54 HydrophobicContact CE1-CG 3.67Å; Y52-W54 HydrophobicContact CE1-CZ2 4.26Å; Y52-W54 AromaticContact CE1-NE1 3.4Å; W54-S56 PolarHBondContact O-N 2.86Å; W54-G57 PolarHBondContact O-N 3.17Å; W54-N58 HydrophobicContact CB-CB 4.28Å; W54-N58 HydrophobicContact CD2-CB 4.47Å; W54-N58 HydrophobicContact CE3-CB 3.8Å; W54-N58 PolarHBondContact N-O 3.14Å
55	P	92.8	Very high	95.8	Very high	44 Å²	44	31.2 Å²	31.2	29%	0.286	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-28.4	177.6	-29.7	35.9	0	0	0	115.2	Q35 G57 Y423	Q35-P55 HydrophobicContact CB-CG 4.12Å; P55-G57 PolarHBondContact O-N 3.31Å; P55-Y423 HydrophobicContact CB-CD1 4.27Å; P55-Y423 HydrophobicContact CB-CE1 3.91Å; P55-Y423 HydrophobicContact CG-CE1 4.42Å; P55-Y423 HydrophobicContact CG-CE2 4.37Å; P55-Y423 WeakPolarHBondContact O-CD1 3.35Å
56	S	90.9	Very high	95.7	Very high	71 Å²	71	36.5 Å²	36.5	50%	0.497	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	21.1	176.8	76.9	0	0	0	0	114.5	W54 N58	W54-S56 PolarHBondContact O-N 2.86Å; S56-N58 PolarHBondContact O-N 2.91Å; S56-N58 PolarHBondContact OG-ND2 2.87Å
57	G	91.4	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	59.1	12.2	-176.1	0	0	0	0	0	116.2	W54 P55 Y423 R427	W54-G57 PolarHBondContact O-N 3.17Å; P55-G57 PolarHBondContact O-N 3.31Å; G57-Y423 WeakPolarHBondContact CA-O 3.36Å; G57-R427 VanDerWaalsContact C-CD 3.45Å; G57-R427 WeakPolarHBondContact O-CD 3.45Å; G57-R427 PolarHBondContact O-NH1 2.98Å
58	N	94.8	Very high	95.4	Very high	27 Å²	27	39.6 Å²	39.6	14%	0.144	21%	0.211	C	C	.	.			trans	-71.9	148.9	168.8	-68.8	-34.2	0	0	0	108.5	T53 W54 S56 T76 K77 G78	T53-N58 WeakPolarHBondContact CA-O 3.46Å; W54-N58 HydrophobicContact CB-CB 4.28Å; W54-N58 HydrophobicContact CD2-CB 4.47Å; W54-N58 HydrophobicContact CE3-CB 3.8Å; W54-N58 PolarHBondContact N-O 3.14Å; S56-N58 PolarHBondContact O-N 2.91Å; S56-N58 PolarHBondContact OG-ND2 2.87Å; N58-T76 WeakPolarHBondContact CA-O 3.42Å; N58-T76 WeakPolarHBondContact CB-O 3.32Å; N58-K77 VanDerWaalsContact OD1-CA 3.32Å; N58-K77 WeakPolarHBondContact OD1-CA 3.48Å; N58-G78 PolarHBondContact OD1-N 3.35Å
59	T	96.6	Very high	95.3	Very high	16 Å²	16	39.1 Å²	39.1	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152.7	-179.4	58.5	0	0	0	0	112.4	Y52 T53 E75 T76 V424	Y52-T59 CarbonylContact O-C 3.55Å; Y52-T59 VanDerWaalsContact O-CA 3.31Å; Y52-T59 WeakPolarHBondContact O-CA 3.31Å; T53-T59 HydrophobicContact CG2-CG2 4.1Å; T59-E75 CarbonylContact O-C 3.58Å; T59-E75 WeakPolarHBondContact O-CA 3.14Å; T59-T76 PolarHBondContact N-O 2.97Å; T59-T76 PolarHBondContact O-N 3.14Å; T59-V424 HydrophobicContact CG2-CG2 4.13Å
60	Y	97.8	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.4	162	172.4	-95.1	0	0	0	109	G51 Y52 Y63 W64 R69 H70 V74 E75 W86	G51-Y60 CarbonylContact C-O 3.53Å; G51-Y60 WeakPolarHBondContact CA-O 3.34Å; Y52-Y60 PolarHBondContact N-O 2.86Å; Y52-Y60 PolarHBondContact O-N 2.78Å; Y60-Y63 PolarHBondContact OH-O 3.44Å; Y60-W64 AromaticContact CD1-CE2 3.68Å; Y60-W64 HydrophobicContact CD1-CH2 4.16Å; Y60-W64 AromaticContact CD1-CZ2 3.41Å; Y60-W64 HydrophobicContact CD1-CZ2 3.41Å; Y60-W64 VanDerWaalsContact CD1-CZ2 3.41Å; Y60-W64 AromaticContact CD1-NE1 3.89Å; Y60-W64 HydrophobicContact CE1-CD2 4.35Å; Y60-W64 AromaticContact CE1-CE2 3.7Å; Y60-W64 AromaticContact CE1-CZ2 3.93Å; Y60-W64 HydrophobicContact CE1-CZ2 3.93Å; Y60-W64 AromaticContact CE1-NE1 3.67Å; Y60-W64 HydrophobicContact CG-CZ2 4.48Å; Y60-R69 HydrophobicContact CD1-CB 4.43Å; Y60-R69 HydrophobicContact CD1-CG 3.74Å; Y60-R69 HydrophobicContact CD2-CG 4.17Å; Y60-R69 HydrophobicContact CE1-CB 3.91Å; Y60-R69 HydrophobicContact CE1-CG 3.71Å; Y60-R69 HydrophobicContact CE2-CB 4.07Å; Y60-R69 HydrophobicContact CE2-CG 4.15Å; Y60-R69 HydrophobicContact CG-CG 3.94Å; Y60-H70 PolarHBondContact OH-O 2.82Å; Y60-V74 CarbonylContact C-O 3.55Å; Y60-V74 VanDerWaalsContact CA-O 3.29Å; Y60-V74 WeakPolarHBondContact CA-O 3.19Å; Y60-E75 HydrophobicContact CD2-CB 4.29Å; Y60-W86 HydrophobicContact CD2-CZ2 4.14Å; Y60-W86 AromaticContact CE2-CD1 3.86Å; Y60-W86 AromaticContact CE2-CD2 3.88Å; Y60-W86 HydrophobicContact CE2-CD2 3.88Å; Y60-W86 AromaticContact CE2-CE2 3.55Å; Y60-W86 HydrophobicContact CE2-CG 4.07Å; Y60-W86 AromaticContact CE2-CZ2 3.98Å; Y60-W86 HydrophobicContact CE2-CZ2 3.98Å; Y60-W86 AromaticContact CE2-NE1 3.56Å
61	Q	98.3	Very high	95.2	Very high	34 Å²	34	43 Å²	43	16%	0.159	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	120.7	-179.1	-69.3	169.6	-16	0	0	109.1	G73 V74 A395 A398 R399	Q61-G73 CarbonylContact O-C 3.55Å; Q61-G73 VanDerWaalsContact O-CA 3.23Å; Q61-G73 WeakPolarHBondContact O-CA 3.4Å; Q61-V74 PolarHBondContact N-O 2.68Å; Q61-V74 PolarHBondContact O-N 3Å; Q61-A395 HydrophobicContact CB-CB 3.82Å; Q61-A398 HydrophobicContact CB-CB 4.34Å; Q61-R399 VanDerWaalsContact OE1-CZ 3.27Å
62	G	98.1	Very high	95.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.4	-151.6	-178.7	0	0	0	0	0	113.2	G50 W64 L72	G50-G62 PolarHBondContact N-O 3.35Å; G50-G62 PolarHBondContact O-N 3.25Å; G62-W64 VanDerWaalsContact O-CD1 3.27Å; G62-L72 WeakPolarHBondContact CA-O 3.41Å
63	Y	98.1	Very high	95.3	Very high	102 Å²	102	42.4 Å²	42.4	40%	0.4	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	150	-178.9	-68.3	-84.5	0	0	0	113.1	V49 Y60 H70 L72 A394	V49-Y63 HydrophobicContact CG2-CD1 3.64Å; V49-Y63 HydrophobicContact CG2-CE1 3.62Å; Y60-Y63 PolarHBondContact OH-O 3.44Å; Y63-H70 WeakPolarHBondContact CB-O 3.38Å; Y63-H70 PolarHBondContact O-N 3.26Å; Y63-L72 HydrophobicContact CD2-CB 4.16Å; Y63-L72 WeakPolarHBondContact CD2-O 3.42Å; Y63-L72 HydrophobicContact CE2-CB 4.44Å; Y63-L72 PolarHBondContact N-O 2.96Å; Y63-A394 HydrophobicContact CD2-CB 3.99Å; Y63-A394 HydrophobicContact CE2-CB 3.63Å
64	W	97.4	Very high	95.4	Very high	27 Å²	27	42 Å²	42	10%	0.102	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	155.3	179.1	-63.9	79.8	0	0	0	110.6	Y38 E47 V48 G50 Y52 Y60 G62 K68 R69	Y38-W64 HydrophobicContact CD2-CZ2 4.1Å; Y38-W64 AromaticContact CE2-CD1 3.89Å; Y38-W64 HydrophobicContact CE2-CD2 4.1Å; Y38-W64 AromaticContact CE2-CE2 3.73Å; Y38-W64 HydrophobicContact CE2-CG 4.2Å; Y38-W64 HydrophobicContact CE2-CZ2 4.17Å; Y38-W64 AromaticContact CE2-NE1 3.62Å; E47-W64 HydrophobicContact CB-CB 3.59Å; E47-W64 HydrophobicContact CB-CD2 4.21Å; E47-W64 HydrophobicContact CB-CE3 4.45Å; E47-W64 HydrophobicContact CB-CG 3.85Å; E47-W64 WeakPolarHBondContact O-CB 3.26Å; V48-W64 PolarHBondContact O-N 3.34Å; G50-W64 PolarHBondContact O-NE1 3.03Å; Y52-W64 VanDerWaalsContact CB-CZ2 3.47Å; Y52-W64 HydrophobicContact CD2-CH2 4.3Å; Y52-W64 HydrophobicContact CG-CH2 4.14Å; Y60-W64 AromaticContact CD1-CE2 3.68Å; Y60-W64 HydrophobicContact CD1-CH2 4.16Å; Y60-W64 AromaticContact CD1-CZ2 3.41Å; Y60-W64 HydrophobicContact CD1-CZ2 3.41Å; Y60-W64 VanDerWaalsContact CD1-CZ2 3.41Å; Y60-W64 AromaticContact CD1-NE1 3.89Å; Y60-W64 HydrophobicContact CE1-CD2 4.35Å; Y60-W64 AromaticContact CE1-CE2 3.7Å; Y60-W64 AromaticContact CE1-CZ2 3.93Å; Y60-W64 HydrophobicContact CE1-CZ2 3.93Å; Y60-W64 AromaticContact CE1-NE1 3.67Å; Y60-W64 HydrophobicContact CG-CZ2 4.48Å; G62-W64 VanDerWaalsContact O-CD1 3.27Å; W64-K68 WeakPolarHBondContact CA-O 3.41Å; W64-R69 HydrophobicContact CE3-CG 4.44Å; W64-R69 HydrophobicContact CH2-CG 4.1Å; W64-R69 HydrophobicContact CZ3-CG 4.05Å
65	A	94.8	Very high	95.6	Very high	34 Å²	34	39 Å²	39	28%	0.281	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	134.7	167.6	0	0	0	0	0	109.2	G67 K68 H70	A65-G67 VanDerWaalsContact C-N 3.35Å; A65-G67 PolarHBondContact O-N 3.26Å; A65-K68 PolarHBondContact N-O 2.9Å; A65-K68 PolarHBondContact O-N 3.47Å; A65-K68 VanDerWaalsContact O-O 3.08Å; A65-H70 HydrophobicContact CB-CB 4.03Å
66	Q	91.3	Very high	95.7	Very high	114 Å²	114	37.5 Å²	37.5	53%	0.533	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	43.9	171.9	-56.7	-177.7	-8.2	0	0	113.4	K68 Y550	Q66-K68 PolarHBondContact O-N 2.88Å; Q66-Y550 HydrophobicContact CB-CE2 3.93Å; Q66-Y550 WeakPolarHBondContact CB-OH 3.24Å; Q66-Y550 WeakPolarHBondContact CG-OH 3.47Å
67	G	89.5	Confident	95.8	Very high	42 Å²	42	38.8 Å²	38.8	43%	0.433	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	12.4	-176.4	0	0	0	0	0	114.9	E47 A65	E47-G67 WeakPolarHBondContact OE2-CA 3.46Å; E47-G67 PolarHBondContact OE2-N 2.91Å; A65-G67 VanDerWaalsContact C-N 3.35Å; A65-G67 PolarHBondContact O-N 3.26Å
68	K	93.9	Very high	95.7	Very high	102 Å²	102	40.5 Å²	40.5	44%	0.443	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144	-172.5	-64.8	173.4	-172.5	173.5	0	112.3	W64 A65 Q66 H70	W64-K68 WeakPolarHBondContact CA-O 3.41Å; A65-K68 PolarHBondContact N-O 2.9Å; A65-K68 PolarHBondContact O-N 3.47Å; A65-K68 VanDerWaalsContact O-O 3.08Å; Q66-K68 PolarHBondContact O-N 2.88Å; K68-H70 PolarHBondContact O-N 3.46Å
69	R	95.8	Very high	95.5	Very high	47 Å²	47	46.2 Å²	46.2	18%	0.177	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	127.1	172.1	-56.2	-180	-68.2	-173.5	3.8	110.3	Y60 W64 E75 W86 G89	Y60-R69 HydrophobicContact CD1-CB 4.43Å; Y60-R69 HydrophobicContact CD1-CG 3.74Å; Y60-R69 HydrophobicContact CD2-CG 4.17Å; Y60-R69 HydrophobicContact CE1-CB 3.91Å; Y60-R69 HydrophobicContact CE1-CG 3.71Å; Y60-R69 HydrophobicContact CE2-CB 4.07Å; Y60-R69 HydrophobicContact CE2-CG 4.15Å; Y60-R69 HydrophobicContact CG-CG 3.94Å; W64-R69 HydrophobicContact CE3-CG 4.44Å; W64-R69 HydrophobicContact CH2-CG 4.1Å; W64-R69 HydrophobicContact CZ3-CG 4.05Å; R69-E75 IonicContact CZ-OE1 3.37Å; R69-E75 IonicContact NH1-OE1 3.03Å; R69-E75 PolarHBondContact NH1-OE1 3.45Å; R69-E75 IonicContact NH2-OE1 3.78Å; R69-W86 HydrophobicContact CB-CD2 4.34Å; R69-W86 HydrophobicContact CB-CE3 4.04Å; R69-G89 PolarHBondContact NE-O 3.48Å; R69-G89 PolarHBondContact NH2-O 3.1Å; R69-G89 PolarHBondContact O-N 3.35Å
70	H	96.3	Very high	95.2	Very high	67 Å²	67	49.4 Å²	49.4	31%	0.31	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	-175.3	-175	-160.2	21.6	0	0	0	112.3	Y60 Y63 A65 K68 L72 W86	Y60-H70 PolarHBondContact OH-O 2.82Å; Y63-H70 WeakPolarHBondContact CB-O 3.38Å; Y63-H70 PolarHBondContact O-N 3.26Å; A65-H70 HydrophobicContact CB-CB 4.03Å; K68-H70 PolarHBondContact O-N 3.46Å; H70-L72 PolarHBondContact O-N 2.77Å; H70-L72 VanDerWaalsContact O-N 3.13Å; H70-W86 CarbonylContact C-O 3.2Å; H70-W86 WeakPolarHBondContact CA-O 3.22Å; H70-W86 PolarHBondContact ND1-O 2.75Å
71	G	97.2	Very high	95.1	Very high	34 Å²	34	51.5 Å²	51.5	35%	0.351	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.9	-115.6	178.6	0	0	0	0	0	113.5	E85 W86	G71-E85 CarbonylContact O-C 3.55Å; G71-E85 WeakPolarHBondContact O-CA 3.3Å; G71-W86 PolarHBondContact N-O 2.74Å; G71-W86 PolarHBondContact O-N 2.85Å
72	L	98.4	Very high	95.1	Very high	38 Å²	38	49.9 Å²	49.9	20%	0.199	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.6	176.1	-67.9	169.6	0	0	0	109.8	G62 Y63 H70 G84 E85 K387 A390 A391 A394	G62-L72 WeakPolarHBondContact CA-O 3.41Å; Y63-L72 HydrophobicContact CD2-CB 4.16Å; Y63-L72 WeakPolarHBondContact CD2-O 3.42Å; Y63-L72 HydrophobicContact CE2-CB 4.44Å; Y63-L72 PolarHBondContact N-O 2.96Å; H70-L72 PolarHBondContact O-N 2.77Å; H70-L72 VanDerWaalsContact O-N 3.13Å; L72-G84 WeakPolarHBondContact CA-O 3.45Å; L72-E85 HydrophobicContact CD2-CG 4.05Å; L72-K387 HydrophobicContact CD2-CD 4.16Å; L72-A390 HydrophobicContact CD1-CB 3.83Å; L72-A391 HydrophobicContact CB-CB 4.29Å; L72-A394 HydrophobicContact CB-CB 3.85Å
73	G	97.9	Very high	95.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.4	169.2	174.1	0	0	0	0	0	115.2	Q61 G84 W86	Q61-G73 CarbonylContact O-C 3.55Å; Q61-G73 VanDerWaalsContact O-CA 3.23Å; Q61-G73 WeakPolarHBondContact O-CA 3.4Å; G73-G84 PolarHBondContact N-O 3.4Å; G73-G84 PolarHBondContact O-N 3.24Å; G73-W86 PolarHBondContact O-NE1 3.42Å
74	V	98.4	Very high	95.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.4	-176.7	179.2	0	0	0	0	110	Y60 Q61 M81 Y82 R83 A391 A395	Y60-V74 CarbonylContact C-O 3.55Å; Y60-V74 VanDerWaalsContact CA-O 3.29Å; Y60-V74 WeakPolarHBondContact CA-O 3.19Å; Q61-V74 PolarHBondContact N-O 2.68Å; Q61-V74 PolarHBondContact O-N 3Å; V74-M81 HydrophobicContact CG1-CE 4.18Å; V74-M81 HydrophobicContact CG1-CG 3.81Å; V74-M81 HydrophobicContact CG1-SD 4.07Å; V74-Y82 CarbonylContact C-O 3.52Å; V74-Y82 VanDerWaalsContact CA-O 3.26Å; V74-Y82 WeakPolarHBondContact CA-O 3.41Å; V74-R83 HydrophobicContact CG1-CG 4.09Å; V74-R83 HydrophobicContact CG2-CB 4.31Å; V74-R83 HydrophobicContact CG2-CG 3.98Å; V74-A391 HydrophobicContact CG2-CB 4.37Å; V74-A395 HydrophobicContact CB-CB 3.95Å; V74-A395 HydrophobicContact CG2-CB 3.65Å
75	E	97.4	Very high	95.1	Very high	18 Å²	18	47.3 Å²	47.3	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.1	168.5	169.6	-174.8	-107.8	0	0	108.9	T59 Y60 R69 K77 M81 Y82 W86 K91	T59-E75 CarbonylContact O-C 3.58Å; T59-E75 WeakPolarHBondContact O-CA 3.14Å; Y60-E75 HydrophobicContact CD2-CB 4.29Å; R69-E75 IonicContact CZ-OE1 3.37Å; R69-E75 IonicContact NH1-OE1 3.03Å; R69-E75 PolarHBondContact NH1-OE1 3.45Å; R69-E75 IonicContact NH2-OE1 3.78Å; E75-K77 HydrophobicContact CG-CB 4.18Å; E75-M81 CarbonylContact O-C 3.52Å; E75-M81 VanDerWaalsContact O-CA 3.27Å; E75-M81 WeakPolarHBondContact O-CA 3.46Å; E75-Y82 PolarHBondContact N-O 3.15Å; E75-Y82 PolarHBondContact O-N 2.92Å; E75-W86 HydrophobicContact CB-CH2 3.72Å; E75-W86 HydrophobicContact CB-CZ2 3.48Å; E75-W86 VanDerWaalsContact CB-CZ2 3.48Å; E75-W86 HydrophobicContact CG-CH2 4.29Å; E75-K91 WeakPolarHBondContact OE2-CE 3.32Å; E75-K91 IonicContact OE2-NZ 3.99Å; E75-K91 PolarHBondContact OE2-NZ 2.84Å
76	T	96.3	Very high	95.2	Very high	14 Å²	14	45.9 Å²	45.9	9%	0.086	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	112.4	164.5	-58.5	0	0	0	0	109.1	N58 T59 W80 L100	N58-T76 WeakPolarHBondContact CA-O 3.42Å; N58-T76 WeakPolarHBondContact CB-O 3.32Å; T59-T76 PolarHBondContact N-O 2.97Å; T59-T76 PolarHBondContact O-N 3.14Å; T76-W80 CarbonylContact C-O 3.59Å; T76-L100 HydrophobicContact CG2-CD1 3.88Å
77	K	91.6	Very high	95.3	Very high	97 Å²	97	43 Å²	43	42%	0.422	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	104.5	-178.2	-167.8	173.2	-176.9	178.2	0	110.5	N58 E75 K79 W80	N58-K77 VanDerWaalsContact OD1-CA 3.32Å; N58-K77 WeakPolarHBondContact OD1-CA 3.48Å; E75-K77 HydrophobicContact CG-CB 4.18Å; K77-K79 PolarHBondContact O-N 2.88Å; K77-K79 VanDerWaalsContact O-N 3.16Å; K77-W80 PolarHBondContact N-O 2.74Å; K77-W80 PolarHBondContact O-N 3.39Å
78	G	90.3	Very high	95.4	Very high	37 Å²	37	47 Å²	47	38%	0.381	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	-111	-178.3	0	0	0	0	0	112.6	N58 R427	N58-G78 PolarHBondContact OD1-N 3.35Å; G78-R427 PolarHBondContact O-NH2 3.31Å
79	K	89.4	Confident	95.3	Very high	147 Å²	147	43 Å²	43	64%	0.639	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	4.9	177.5	-64.4	-179.9	-179.7	177.5	0	113.5	K77 L100	K77-K79 PolarHBondContact O-N 2.88Å; K77-K79 VanDerWaalsContact O-N 3.16Å; K79-L100 PolarHBondContact O-N 2.74Å
80	W	90.8	Very high	95	Very high	83 Å²	83	45.2 Å²	45.2	31%	0.314	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	144.7	-178.5	-62.7	103.2	0	0	0	112	T76 K77 R97 A104 L166	T76-W80 CarbonylContact C-O 3.59Å; K77-W80 PolarHBondContact N-O 2.74Å; K77-W80 PolarHBondContact O-N 3.39Å; W80-R97 HydrophobicContact CE3-CG 4.27Å; W80-A104 HydrophobicContact CH2-CB 4.25Å; W80-A104 HydrophobicContact CZ3-CB 4.45Å; W80-L166 HydrophobicContact CH2-CD2 3.23Å; W80-L166 HydrophobicContact CZ2-CD2 4.23Å; W80-L166 HydrophobicContact CZ3-CD2 3.46Å; W80-L166 VanDerWaalsContact CZ3-CD2 3.46Å
81	M	96.3	Very high	94.9	Very high	44 Å²	44	43.2 Å²	43.2	22%	0.217	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.4	166.2	-179.7	-178.5	-84.1	0	0	108.9	V74 E75 R83 R97 Q98 L100	V74-M81 HydrophobicContact CG1-CE 4.18Å; V74-M81 HydrophobicContact CG1-CG 3.81Å; V74-M81 HydrophobicContact CG1-SD 4.07Å; E75-M81 CarbonylContact O-C 3.52Å; E75-M81 VanDerWaalsContact O-CA 3.27Å; E75-M81 WeakPolarHBondContact O-CA 3.46Å; M81-R83 HydrophobicContact CG-CG 3.91Å; M81-R83 HydrophobicContact SD-CG 3.87Å; M81-R97 CarbonylContact O-C 3.59Å; M81-R97 VanDerWaalsContact O-CA 3.29Å; M81-R97 WeakPolarHBondContact O-CA 3.2Å; M81-R97 WeakPolarHBondContact O-CG 3.32Å; M81-Q98 PolarHBondContact N-O 2.83Å; M81-Q98 PolarHBondContact O-N 3.26Å; M81-L100 HydrophobicContact CB-CD2 4.06Å; M81-L100 HydrophobicContact CE-CD2 4.23Å
82	Y	97.7	Very high	94.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.5	165.8	173.6	-85.5	0	0	0	109.1	V74 E75 E85 W86 K91 Y94 V96 R97 W110	V74-Y82 CarbonylContact C-O 3.52Å; V74-Y82 VanDerWaalsContact CA-O 3.26Å; V74-Y82 WeakPolarHBondContact CA-O 3.41Å; E75-Y82 PolarHBondContact N-O 3.15Å; E75-Y82 PolarHBondContact O-N 2.92Å; Y82-E85 PolarHBondContact OH-O 3.16Å; Y82-W86 AromaticContact CD1-CE2 3.7Å; Y82-W86 HydrophobicContact CD1-CH2 4.27Å; Y82-W86 AromaticContact CD1-CZ2 3.38Å; Y82-W86 HydrophobicContact CD1-CZ2 3.38Å; Y82-W86 AromaticContact CD1-NE1 3.77Å; Y82-W86 AromaticContact CE1-CE2 3.7Å; Y82-W86 AromaticContact CE1-CZ2 3.83Å; Y82-W86 HydrophobicContact CE1-CZ2 3.83Å; Y82-W86 AromaticContact CE1-NE1 3.6Å; Y82-W86 HydrophobicContact CG-CZ2 4.3Å; Y82-K91 HydrophobicContact CD1-CD 4.36Å; Y82-K91 HydrophobicContact CD1-CG 4.13Å; Y82-K91 HydrophobicContact CD2-CD 3.64Å; Y82-K91 HydrophobicContact CD2-CG 4.11Å; Y82-K91 HydrophobicContact CE1-CB 4.33Å; Y82-K91 HydrophobicContact CE1-CD 4.44Å; Y82-K91 HydrophobicContact CE1-CG 3.86Å; Y82-K91 HydrophobicContact CE2-CB 4.08Å; Y82-K91 HydrophobicContact CE2-CD 3.73Å; Y82-K91 HydrophobicContact CE2-CG 3.84Å; Y82-K91 HydrophobicContact CG-CD 3.96Å; Y82-K91 HydrophobicContact CG-CG 4.24Å; Y82-Y94 PolarHBondContact OH-O 3.35Å; Y82-V96 CarbonylContact C-O 3.45Å; Y82-V96 WeakPolarHBondContact CA-O 3.45Å; Y82-R97 HydrophobicContact CD2-CB 4.24Å; Y82-W110 HydrophobicContact CD2-CH2 4.34Å; Y82-W110 AromaticContact CD2-CZ2 3.9Å; Y82-W110 HydrophobicContact CD2-CZ2 3.9Å; Y82-W110 HydrophobicContact CE2-CD2 4.06Å; Y82-W110 AromaticContact CE2-CE2 3.58Å; Y82-W110 HydrophobicContact CE2-CG 4.45Å; Y82-W110 HydrophobicContact CE2-CH2 4.46Å; Y82-W110 AromaticContact CE2-CZ2 3.78Å; Y82-W110 HydrophobicContact CE2-CZ2 3.78Å; Y82-W110 AromaticContact CE2-NE1 3.7Å
83	R	98.4	Very high	94.6	Very high	42 Å²	42	48.1 Å²	48.1	16%	0.158	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.3	178.8	-56.5	-172	-84.8	136.4	-2.4	108.2	V74 M81 G95 V96 A388 D392	V74-R83 HydrophobicContact CG1-CG 4.09Å; V74-R83 HydrophobicContact CG2-CB 4.31Å; V74-R83 HydrophobicContact CG2-CG 3.98Å; M81-R83 HydrophobicContact CG-CG 3.91Å; M81-R83 HydrophobicContact SD-CG 3.87Å; R83-G95 CarbonylContact O-C 3.53Å; R83-G95 VanDerWaalsContact O-CA 3.29Å; R83-G95 WeakPolarHBondContact O-CA 3.36Å; R83-V96 PolarHBondContact N-O 3.14Å; R83-V96 PolarHBondContact O-N 3.3Å; R83-A388 HydrophobicContact CB-CB 3.68Å; R83-A388 WeakPolarHBondContact O-CB 3.24Å; R83-D392 WeakPolarHBondContact CD-OD1 3.39Å; R83-D392 VanDerWaalsContact CD-OD2 3.22Å; R83-D392 WeakPolarHBondContact CD-OD2 3.29Å; R83-D392 IonicContact CZ-OD2 2.65Å; R83-D392 IonicContact NE-OD2 3.66Å; R83-D392 IonicContact NH1-OD2 2.9Å; R83-D392 PolarHBondContact NH1-OD2 3.34Å
84	G	97.8	Very high	94.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.6	-153	179.5	0	0	0	0	0	115.1	L72 G73 A391	L72-G84 WeakPolarHBondContact CA-O 3.45Å; G73-G84 PolarHBondContact N-O 3.4Å; G73-G84 PolarHBondContact O-N 3.24Å; G84-A391 VanDerWaalsContact N-CB 3.3Å
85	E	97.6	Very high	94.5	Very high	33 Å²	33	49.2 Å²	49.2	15%	0.154	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	153.8	-179.4	-62.4	178.1	153	0	0	112.3	G71 L72 Y82 G92 R93 Y94 K387	G71-E85 CarbonylContact O-C 3.55Å; G71-E85 WeakPolarHBondContact O-CA 3.3Å; L72-E85 HydrophobicContact CD2-CG 4.05Å; Y82-E85 PolarHBondContact OH-O 3.16Å; E85-G92 WeakPolarHBondContact O-CA 3.35Å; E85-G92 PolarHBondContact O-N 3.14Å; E85-R93 PolarHBondContact OE2-N 3.02Å; E85-Y94 PolarHBondContact N-O 3.31Å; E85-Y94 WeakPolarHBondContact OE2-CD2 3.42Å; E85-Y94 PolarHBondContact OE2-N 2.88Å; E85-K387 HydrophobicContact CG-CB 4.44Å; E85-K387 HydrophobicContact CG-CD 3.96Å; E85-K387 HydrophobicContact CG-CG 4.37Å; E85-K387 WeakPolarHBondContact OE1-CD 3.31Å; E85-K387 WeakPolarHBondContact OE1-CE 3.2Å; E85-K387 IonicContact OE1-NZ 3.11Å; E85-K387 PolarHBondContact OE1-NZ 3.49Å
86	W	96.4	Very high	94.6	Very high	3 Å²	3	48.4 Å²	48.4	1%	0.011	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.1	176.6	-69.1	84.4	0	0	0	111.5	Y60 R69 H70 G71 G73 E75 Y82 F90 K91	Y60-W86 HydrophobicContact CD2-CZ2 4.14Å; Y60-W86 AromaticContact CE2-CD1 3.86Å; Y60-W86 AromaticContact CE2-CD2 3.88Å; Y60-W86 HydrophobicContact CE2-CD2 3.88Å; Y60-W86 AromaticContact CE2-CE2 3.55Å; Y60-W86 HydrophobicContact CE2-CG 4.07Å; Y60-W86 AromaticContact CE2-CZ2 3.98Å; Y60-W86 HydrophobicContact CE2-CZ2 3.98Å; Y60-W86 AromaticContact CE2-NE1 3.56Å; R69-W86 HydrophobicContact CB-CD2 4.34Å; R69-W86 HydrophobicContact CB-CE3 4.04Å; H70-W86 CarbonylContact C-O 3.2Å; H70-W86 WeakPolarHBondContact CA-O 3.22Å; H70-W86 PolarHBondContact ND1-O 2.75Å; G71-W86 PolarHBondContact N-O 2.74Å; G71-W86 PolarHBondContact O-N 2.85Å; G73-W86 PolarHBondContact O-NE1 3.42Å; E75-W86 HydrophobicContact CB-CH2 3.72Å; E75-W86 HydrophobicContact CB-CZ2 3.48Å; E75-W86 VanDerWaalsContact CB-CZ2 3.48Å; E75-W86 HydrophobicContact CG-CH2 4.29Å; Y82-W86 AromaticContact CD1-CE2 3.7Å; Y82-W86 HydrophobicContact CD1-CH2 4.27Å; Y82-W86 AromaticContact CD1-CZ2 3.38Å; Y82-W86 HydrophobicContact CD1-CZ2 3.38Å; Y82-W86 AromaticContact CD1-NE1 3.77Å; Y82-W86 AromaticContact CE1-CE2 3.7Å; Y82-W86 AromaticContact CE1-CZ2 3.83Å; Y82-W86 HydrophobicContact CE1-CZ2 3.83Å; Y82-W86 AromaticContact CE1-NE1 3.6Å; Y82-W86 HydrophobicContact CG-CZ2 4.3Å; W86-F90 CarbonylContact C-O 3.55Å; W86-F90 WeakPolarHBondContact CA-O 3.4Å; W86-F90 VanDerWaalsContact CE3-O 3.28Å; W86-K91 HydrophobicContact CE3-CG 4.39Å; W86-K91 HydrophobicContact CH2-CG 3.88Å; W86-K91 HydrophobicContact CZ2-CG 4.31Å; W86-K91 HydrophobicContact CZ3-CG 3.9Å
87	S	93.9	Very high	94.6	Very high	55 Å²	55	48.4 Å²	48.4	39%	0.385	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	112.1	-178.8	-59.3	0	0	0	0	110.2	G89 F90	S87-G89 VanDerWaalsContact C-N 3.26Å; S87-G89 PolarHBondContact O-N 3.05Å; S87-F90 PolarHBondContact N-O 2.83Å; S87-F90 PolarHBondContact O-N 2.89Å
88	H	90.8	Very high	94.7	Very high	126 Å²	126	47 Å²	47	58%	0.583	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	39	175.7	-52.1	-18.4	0	0	0	114.1
89	G	91.8	Very high	94.8	Very high	17 Å²	17	45.6 Å²	45.6	18%	0.175	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	-16	-178.5	0	0	0	0	0	115.4	R69 S87	R69-G89 PolarHBondContact NE-O 3.48Å; R69-G89 PolarHBondContact NH2-O 3.1Å; R69-G89 PolarHBondContact O-N 3.35Å; S87-G89 VanDerWaalsContact C-N 3.26Å; S87-G89 PolarHBondContact O-N 3.05Å
90	F	91.1	Very high	94.8	Very high	93 Å²	93	42.9 Å²	42.9	41%	0.408	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	164.1	176	-60.6	-84.5	0	0	0	112.1	W86 S87 G92	W86-F90 CarbonylContact C-O 3.55Å; W86-F90 WeakPolarHBondContact CA-O 3.4Å; W86-F90 VanDerWaalsContact CE3-O 3.28Å; S87-F90 PolarHBondContact N-O 2.83Å; S87-F90 PolarHBondContact O-N 2.89Å; F90-G92 PolarHBondContact O-N 2.81Å
91	K	92.9	Very high	94.7	Very high	25 Å²	25	43.1 Å²	43.1	11%	0.109	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	126.7	173.2	-70.2	166.2	178.1	163.5	0	109.4	E75 Y82 W86 W110	E75-K91 WeakPolarHBondContact OE2-CE 3.32Å; E75-K91 IonicContact OE2-NZ 3.99Å; E75-K91 PolarHBondContact OE2-NZ 2.84Å; Y82-K91 HydrophobicContact CD1-CD 4.36Å; Y82-K91 HydrophobicContact CD1-CG 4.13Å; Y82-K91 HydrophobicContact CD2-CD 3.64Å; Y82-K91 HydrophobicContact CD2-CG 4.11Å; Y82-K91 HydrophobicContact CE1-CB 4.33Å; Y82-K91 HydrophobicContact CE1-CD 4.44Å; Y82-K91 HydrophobicContact CE1-CG 3.86Å; Y82-K91 HydrophobicContact CE2-CB 4.08Å; Y82-K91 HydrophobicContact CE2-CD 3.73Å; Y82-K91 HydrophobicContact CE2-CG 3.84Å; Y82-K91 HydrophobicContact CG-CD 3.96Å; Y82-K91 HydrophobicContact CG-CG 4.24Å; W86-K91 HydrophobicContact CE3-CG 4.39Å; W86-K91 HydrophobicContact CH2-CG 3.88Å; W86-K91 HydrophobicContact CZ2-CG 4.31Å; W86-K91 HydrophobicContact CZ3-CG 3.9Å; K91-W110 HydrophobicContact CD-CE3 4.31Å; K91-W110 HydrophobicContact CD-CZ3 4.33Å
92	G	93.5	Very high	94.3	Very high	4 Å²	4	43.7 Å²	43.7	4%	0.041	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-177.7	178.4	0	0	0	0	0	112.1	E85 F90 Y94 W110	E85-G92 WeakPolarHBondContact O-CA 3.35Å; E85-G92 PolarHBondContact O-N 3.14Å; F90-G92 PolarHBondContact O-N 2.81Å; G92-Y94 VanDerWaalsContact C-N 3.29Å; G92-Y94 PolarHBondContact O-N 2.84Å; G92-W110 WeakPolarHBondContact O-CB 3.35Å
93	R	96.1	Very high	93.8	Very high	171 Å²	171	47.1 Å²	47.1	65%	0.645	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	-34.9	-166.3	-175.9	178.3	-69	172.2	0.7	113.4	E85 T109 W110	E85-R93 PolarHBondContact OE2-N 3.02Å; R93-T109 HydrophobicContact CG-CG2 4.49Å; R93-T109 CarbonylContact O-C 3.55Å; R93-T109 WeakPolarHBondContact O-CA 3.34Å; R93-W110 PolarHBondContact O-N 3.48Å
94	Y	98.1	Very high	93.3	Very high	24 Å²	24	45.1 Å²	45.1	9%	0.094	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.3	-176.8	-65.3	-83.4	0	0	0	113.1	Y82 E85 G92 T109 R380 H383 A384	Y82-Y94 PolarHBondContact OH-O 3.35Å; E85-Y94 PolarHBondContact N-O 3.31Å; E85-Y94 WeakPolarHBondContact OE2-CD2 3.42Å; E85-Y94 PolarHBondContact OE2-N 2.88Å; G92-Y94 VanDerWaalsContact C-N 3.29Å; G92-Y94 PolarHBondContact O-N 2.84Å; Y94-T109 HydrophobicContact CD1-CG2 3.7Å; Y94-T109 HydrophobicContact CE1-CG2 3.44Å; Y94-T109 VanDerWaalsContact CE1-CG2 3.44Å; Y94-R380 PolarHBondContact OH-NH1 2.8Å; Y94-H383 HydrophobicContact CD1-CB 4.35Å; Y94-H383 AromaticContact CD1-ND1 3.2Å; Y94-H383 WeakPolarHBondContact CD1-ND1 3.15Å; Y94-H383 AromaticContact CD2-CE1 3.31Å; Y94-H383 WeakPolarHBondContact CD2-CE1 3.43Å; Y94-H383 AromaticContact CD2-ND1 3.25Å; Y94-H383 WeakPolarHBondContact CD2-ND1 3.45Å; Y94-H383 HydrophobicContact CE1-CB 4.19Å; Y94-H383 AromaticContact CE1-ND1 3.27Å; Y94-H383 VanDerWaalsContact CE1-ND1 3.27Å; Y94-H383 WeakPolarHBondContact CE1-ND1 3.39Å; Y94-H383 AromaticContact CE2-CE1 3.36Å; Y94-H383 WeakPolarHBondContact CE2-CE1 3.46Å; Y94-H383 AromaticContact CE2-ND1 3.31Å; Y94-H383 VanDerWaalsContact CE2-ND1 3.31Å; Y94-H383 WeakPolarHBondContact CE2-ND1 3.41Å; Y94-H383 AromaticContact CG-CE1 3.71Å; Y94-H383 AromaticContact CG-ND1 3.18Å; Y94-H383 AromaticContact CZ-CE1 3.8Å; Y94-H383 AromaticContact CZ-ND1 3.32Å; Y94-H383 VanDerWaalsContact CZ-ND1 3.32Å; Y94-A384 HydrophobicContact CD1-CB 4.45Å
95	G	97.3	Very high	93.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178	170	170.3	0	0	0	0	0	114.3	R83 G108 W110	R83-G95 CarbonylContact O-C 3.53Å; R83-G95 VanDerWaalsContact O-CA 3.29Å; R83-G95 WeakPolarHBondContact O-CA 3.36Å; G95-G108 PolarHBondContact N-O 3.45Å; G95-G108 PolarHBondContact O-N 2.78Å; G95-W110 PolarHBondContact O-NE1 2.88Å
96	V	98.3	Very high	93.2	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.5	177.9	173.2	0	0	0	0	109.2	Y82 R83 Q98 Y106 E107 A388	Y82-V96 CarbonylContact C-O 3.45Å; Y82-V96 WeakPolarHBondContact CA-O 3.45Å; R83-V96 PolarHBondContact N-O 3.14Å; R83-V96 PolarHBondContact O-N 3.3Å; V96-Q98 HydrophobicContact CG1-CB 4.4Å; V96-Y106 CarbonylContact C-O 3.47Å; V96-Y106 VanDerWaalsContact CA-O 3.3Å; V96-Y106 WeakPolarHBondContact CA-O 3.34Å; V96-E107 HydrophobicContact CG1-CG 4.25Å; V96-E107 HydrophobicContact CG2-CB 4.2Å; V96-E107 HydrophobicContact CG2-CG 4.22Å; V96-A388 HydrophobicContact CB-CB 3.95Å; V96-A388 HydrophobicContact CG2-CB 3.77Å
97	R	96.4	Very high	93.2	Very high	13 Å²	13	47.5 Å²	47.5	5%	0.049	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.1	166.7	-169.3	178.3	75.5	-149.4	-0.5	109.5	W80 M81 Y82 R105 Y106 W110 L166 R167 S168	W80-R97 HydrophobicContact CE3-CG 4.27Å; M81-R97 CarbonylContact O-C 3.59Å; M81-R97 VanDerWaalsContact O-CA 3.29Å; M81-R97 WeakPolarHBondContact O-CA 3.2Å; M81-R97 WeakPolarHBondContact O-CG 3.32Å; Y82-R97 HydrophobicContact CD2-CB 4.24Å; R97-R105 CarbonylContact O-C 3.59Å; R97-R105 WeakPolarHBondContact O-CA 3.4Å; R97-Y106 PolarHBondContact N-O 3.49Å; R97-Y106 PolarHBondContact O-N 3.16Å; R97-W110 HydrophobicContact CB-CH2 3.59Å; R97-W110 HydrophobicContact CB-CZ2 3.62Å; R97-W110 HydrophobicContact CG-CH2 4.35Å; R97-L166 VanDerWaalsContact NH2-C 3.3Å; R97-L166 PolarHBondContact NH2-O 2.93Å; R97-R167 PolarHBondContact NH2-O 3.46Å; R97-S168 PolarHBondContact NH1-OG 3.22Å
98	Q	94.9	Very high	93.4	Very high	67 Å²	67	44.9 Å²	44.9	31%	0.313	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.5	-172.1	-179.1	170.1	-2.7	0	0	110.7	M81 V96 R105	M81-Q98 PolarHBondContact N-O 2.83Å; M81-Q98 PolarHBondContact O-N 3.26Å; V96-Q98 HydrophobicContact CG1-CB 4.4Å; Q98-R105 HydrophobicContact CB-CB 4.14Å; Q98-R105 HydrophobicContact CG-CB 4.19Å
99	S	90.7	Very high	93.7	Very high	8 Å²	8	39.5 Å²	39.5	6%	0.056	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	140.5	171.3	173	0	0	0	0	110.4	C101 T102 A104	S99-C101 VanDerWaalsContact C-N 3.34Å; S99-C101 PolarHBondContact OG-N 2.87Å; S99-T102 WeakPolarHBondContact CB-O 3.44Å; S99-T102 WeakPolarHBondContact CB-OG1 3.33Å; S99-T102 PolarHBondContact OG-N 2.87Å; S99-T102 VanDerWaalsContact OG-N 3.07Å; S99-T102 PolarHBondContact OG-OG1 2.73Å; S99-A104 WeakPolarHBondContact CB-O 3.38Å; S99-A104 PolarHBondContact N-O 2.71Å
100	L	90.3	Very high	93.9	Very high	91 Å²	91	39.2 Å²	39.2	48%	0.476	19%	0.193	S	C	.	.	S	Bend	trans	-82.6	-12.1	174.8	-64.4	178.1	0	0	0	113.1	T76 K79 M81	T76-L100 HydrophobicContact CG2-CD1 3.88Å; K79-L100 PolarHBondContact O-N 2.74Å; M81-L100 HydrophobicContact CB-CD2 4.06Å; M81-L100 HydrophobicContact CE-CD2 4.23Å
101	C	88.8	Confident	93.9	Very high	87 Å²	87	37.3 Å²	37.3	59%	0.588	19%	0.192	S	C	*	.	S	Bend	trans	-129.9	4.2	-173.2	67.5	0	0	0	0	114.7	S99	S99-C101 VanDerWaalsContact C-N 3.34Å; S99-C101 PolarHBondContact OG-N 2.87Å
102	T	88.1	Confident	93.6	Very high	56 Å²	56	42.6 Å²	42.6	34%	0.344	22%	0.221	S	C	.	.	S	Bend	trans	-148.9	160.3	176.1	56.6	0	0	0	0	109.4	S99 A104	S99-T102 WeakPolarHBondContact CB-O 3.44Å; S99-T102 WeakPolarHBondContact CB-OG1 3.33Å; S99-T102 PolarHBondContact OG-N 2.87Å; S99-T102 VanDerWaalsContact OG-N 3.07Å; S99-T102 PolarHBondContact OG-OG1 2.73Å; T102-A104 PolarHBondContact O-N 2.84Å; T102-A104 WeakPolarHBondContact OG1-CB 3.44Å
103	P	85.9	Confident	93.3	Very high	72 Å²	72	42.5 Å²	42.5	47%	0.468	22%	0.22	S	C	.	.	S	Bend	trans	-68.1	2.4	175.4	29	-37.4	0	0	0	114.5	R105	P103-R105 PolarHBondContact O-N 3.34Å
104	A	89	Confident	92.9	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.			trans	-64.8	123.1	-175	0	0	0	0	0	111.6	W80 S99 T102 T122 L166	W80-A104 HydrophobicContact CH2-CB 4.25Å; W80-A104 HydrophobicContact CZ3-CB 4.45Å; S99-A104 WeakPolarHBondContact CB-O 3.38Å; S99-A104 PolarHBondContact N-O 2.71Å; T102-A104 PolarHBondContact O-N 2.84Å; T102-A104 WeakPolarHBondContact OG1-CB 3.44Å; A104-T122 CarbonylContact C-O 3.5Å; A104-T122 VanDerWaalsContact CA-O 3.28Å; A104-T122 WeakPolarHBondContact CA-O 3.33Å; A104-L166 HydrophobicContact CB-CD2 4.15Å
105	R	95.3	Very high	92.6	Very high	77 Å²	77	35.9 Å²	35.9	29%	0.291	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	145.2	178.7	63.3	-179.4	-171.6	-80.7	-2.4	112.7	R97 Q98 P103 E107 E121 T122 L166	R97-R105 CarbonylContact O-C 3.59Å; R97-R105 WeakPolarHBondContact O-CA 3.4Å; Q98-R105 HydrophobicContact CB-CB 4.14Å; Q98-R105 HydrophobicContact CG-CB 4.19Å; P103-R105 PolarHBondContact O-N 3.34Å; R105-E107 HydrophobicContact CG-CG 4.25Å; R105-E107 IonicContact CZ-OE1 2.96Å; R105-E107 IonicContact NE-OE1 2.86Å; R105-E107 PolarHBondContact NE-OE1 3.03Å; R105-E107 IonicContact NH2-OE1 3.36Å; R105-E121 CarbonylContact O-C 3.59Å; R105-E121 WeakPolarHBondContact O-CA 3.43Å; R105-T122 PolarHBondContact N-O 2.88Å; R105-T122 PolarHBondContact NH2-OG1 3.29Å; R105-T122 PolarHBondContact O-N 2.87Å; R105-L166 VanDerWaalsContact O-CD1 3.29Å; R105-L166 WeakPolarHBondContact O-CD1 3.27Å
106	Y	97	Very high	92.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.4	167.3	176.2	-95.2	0	0	0	109.1	V96 R97 T109 W110 Q115 V120 E121 W133 L166	V96-Y106 CarbonylContact C-O 3.47Å; V96-Y106 VanDerWaalsContact CA-O 3.3Å; V96-Y106 WeakPolarHBondContact CA-O 3.34Å; R97-Y106 PolarHBondContact N-O 3.49Å; R97-Y106 PolarHBondContact O-N 3.16Å; Y106-T109 PolarHBondContact OH-N 2.9Å; Y106-T109 PolarHBondContact OH-O 3.49Å; Y106-T109 VanDerWaalsContact OH-O 3.1Å; Y106-W110 AromaticContact CD1-CE2 3.71Å; Y106-W110 HydrophobicContact CD1-CH2 4.12Å; Y106-W110 AromaticContact CD1-CZ2 3.43Å; Y106-W110 HydrophobicContact CD1-CZ2 3.43Å; Y106-W110 VanDerWaalsContact CD1-CZ2 3.43Å; Y106-W110 AromaticContact CD1-NE1 3.93Å; Y106-W110 HydrophobicContact CE1-CD2 4.46Å; Y106-W110 AromaticContact CE1-CE2 3.8Å; Y106-W110 HydrophobicContact CE1-CZ2 4.02Å; Y106-W110 AromaticContact CE1-NE1 3.75Å; Y106-W110 HydrophobicContact CG-CZ2 4.42Å; Y106-Q115 HydrophobicContact CD1-CG 3.55Å; Y106-Q115 HydrophobicContact CD2-CG 3.92Å; Y106-Q115 HydrophobicContact CE1-CB 4.01Å; Y106-Q115 HydrophobicContact CE1-CG 3.49Å; Y106-Q115 VanDerWaalsContact CE1-CG 3.49Å; Y106-Q115 HydrophobicContact CE2-CB 4.05Å; Y106-Q115 HydrophobicContact CE2-CG 3.88Å; Y106-Q115 HydrophobicContact CG-CG 3.74Å; Y106-V120 CarbonylContact C-O 3.58Å; Y106-V120 WeakPolarHBondContact CA-O 3.43Å; Y106-E121 HydrophobicContact CD2-CB 4.46Å; Y106-W133 HydrophobicContact CD2-CH2 4.23Å; Y106-W133 AromaticContact CD2-CZ2 3.84Å; Y106-W133 HydrophobicContact CD2-CZ2 3.84Å; Y106-W133 AromaticContact CE2-CD2 3.92Å; Y106-W133 HydrophobicContact CE2-CD2 3.92Å; Y106-W133 AromaticContact CE2-CE2 3.47Å; Y106-W133 VanDerWaalsContact CE2-CE2 3.47Å; Y106-W133 HydrophobicContact CE2-CG 4.29Å; Y106-W133 HydrophobicContact CE2-CH2 4.32Å; Y106-W133 AromaticContact CE2-CZ2 3.68Å; Y106-W133 HydrophobicContact CE2-CZ2 3.68Å; Y106-W133 AromaticContact CE2-NE1 3.61Å; Y106-L166 VanDerWaalsContact N-CD1 3.32Å
107	E	97.9	Very high	92.5	Very high	9 Å²	9	39.8 Å²	39.8	4%	0.042	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	113.3	-177	-44.4	-173.5	-112.4	0	0	107.7	V96 R105 G119 V120 T381 R385	V96-E107 HydrophobicContact CG1-CG 4.25Å; V96-E107 HydrophobicContact CG2-CB 4.2Å; V96-E107 HydrophobicContact CG2-CG 4.22Å; R105-E107 HydrophobicContact CG-CG 4.25Å; R105-E107 IonicContact CZ-OE1 2.96Å; R105-E107 IonicContact NE-OE1 2.86Å; R105-E107 PolarHBondContact NE-OE1 3.03Å; R105-E107 IonicContact NH2-OE1 3.36Å; E107-G119 CarbonylContact O-C 3.5Å; E107-G119 VanDerWaalsContact O-CA 3.25Å; E107-G119 WeakPolarHBondContact O-CA 3.44Å; E107-V120 PolarHBondContact N-O 2.91Å; E107-V120 PolarHBondContact O-N 3.25Å; E107-T381 HydrophobicContact CB-CG2 3.68Å; E107-T381 PolarHBondContact O-OG1 2.84Å; E107-T381 VanDerWaalsContact O-OG1 3.13Å; E107-R385 VanDerWaalsContact CD-NH2 3.26Å; E107-R385 IonicContact OE1-CZ 2.88Å; E107-R385 IonicContact OE1-NE 3.01Å; E107-R385 IonicContact OE1-NH2 2.89Å; E107-R385 PolarHBondContact OE1-NH2 2.76Å; E107-R385 WeakPolarHBondContact OE2-CG 3.41Å; E107-R385 IonicContact OE2-CZ 4Å; E107-R385 VanDerWaalsContact OE2-CZ 3.3Å; E107-R385 IonicContact OE2-NE 2.76Å; E107-R385 PolarHBondContact OE2-NE 3.32Å; E107-R385 IonicContact OE2-NH2 3.32Å; E107-R385 PolarHBondContact OE2-NH2 3.32Å; E107-R385 VanDerWaalsContact OE2-NH2 3.07Å
108	G	97.5	Very high	92.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.4	-151.4	-175.2	0	0	0	0	0	115.2	G95 A384	G95-G108 PolarHBondContact N-O 3.45Å; G95-G108 PolarHBondContact O-N 2.78Å; G108-A384 WeakPolarHBondContact O-CB 3.37Å
109	T	97.4	Very high	92.7	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.086	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	150.3	-177.7	53.4	0	0	0	0	114.2	R93 Y94 Y106 D116 Y118 R380	R93-T109 HydrophobicContact CG-CG2 4.49Å; R93-T109 CarbonylContact O-C 3.55Å; R93-T109 WeakPolarHBondContact O-CA 3.34Å; Y94-T109 HydrophobicContact CD1-CG2 3.7Å; Y94-T109 HydrophobicContact CE1-CG2 3.44Å; Y94-T109 VanDerWaalsContact CE1-CG2 3.44Å; Y106-T109 PolarHBondContact OH-N 2.9Å; Y106-T109 PolarHBondContact OH-O 3.49Å; Y106-T109 VanDerWaalsContact OH-O 3.1Å; T109-D116 CarbonylContact C-O 3.57Å; T109-D116 VanDerWaalsContact C-O 3.29Å; T109-D116 VanDerWaalsContact CB-O 3.3Å; T109-D116 WeakPolarHBondContact CB-O 3.35Å; T109-D116 PolarHBondContact O-N 3.37Å; T109-D116 VanDerWaalsContact O-N 3.12Å; T109-D116 VanDerWaalsContact O-O 3.07Å; T109-D116 PolarHBondContact OG1-O 3.39Å; T109-Y118 PolarHBondContact N-O 2.76Å; T109-Y118 PolarHBondContact OG1-N 3.3Å; T109-Y118 PolarHBondContact OG1-O 3.01Å; T109-Y118 VanDerWaalsContact OG1-O 3.13Å; T109-R380 HydrophobicContact CG2-CB 4.39Å
110	W	95.1	Very high	93	Very high	11 Å²	11	38.2 Å²	38.2	4%	0.042	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.9	-177	-56.6	75	0	0	0	111.3	Y82 K91 G92 R93 G95 R97 Y106 L114 Q115	Y82-W110 HydrophobicContact CD2-CH2 4.34Å; Y82-W110 AromaticContact CD2-CZ2 3.9Å; Y82-W110 HydrophobicContact CD2-CZ2 3.9Å; Y82-W110 HydrophobicContact CE2-CD2 4.06Å; Y82-W110 AromaticContact CE2-CE2 3.58Å; Y82-W110 HydrophobicContact CE2-CG 4.45Å; Y82-W110 HydrophobicContact CE2-CH2 4.46Å; Y82-W110 AromaticContact CE2-CZ2 3.78Å; Y82-W110 HydrophobicContact CE2-CZ2 3.78Å; Y82-W110 AromaticContact CE2-NE1 3.7Å; K91-W110 HydrophobicContact CD-CE3 4.31Å; K91-W110 HydrophobicContact CD-CZ3 4.33Å; G92-W110 WeakPolarHBondContact O-CB 3.35Å; R93-W110 PolarHBondContact O-N 3.48Å; G95-W110 PolarHBondContact O-NE1 2.88Å; R97-W110 HydrophobicContact CB-CH2 3.59Å; R97-W110 HydrophobicContact CB-CZ2 3.62Å; R97-W110 HydrophobicContact CG-CH2 4.35Å; Y106-W110 AromaticContact CD1-CE2 3.71Å; Y106-W110 HydrophobicContact CD1-CH2 4.12Å; Y106-W110 AromaticContact CD1-CZ2 3.43Å; Y106-W110 HydrophobicContact CD1-CZ2 3.43Å; Y106-W110 VanDerWaalsContact CD1-CZ2 3.43Å; Y106-W110 AromaticContact CD1-NE1 3.93Å; Y106-W110 HydrophobicContact CE1-CD2 4.46Å; Y106-W110 AromaticContact CE1-CE2 3.8Å; Y106-W110 HydrophobicContact CE1-CZ2 4.02Å; Y106-W110 AromaticContact CE1-NE1 3.75Å; Y106-W110 HydrophobicContact CG-CZ2 4.42Å; W110-L114 CarbonylContact C-O 3.56Å; W110-L114 WeakPolarHBondContact CA-O 3.35Å; W110-L114 WeakPolarHBondContact CB-O 3.41Å; W110-Q115 HydrophobicContact CD2-CG 4.45Å; W110-Q115 HydrophobicContact CE3-CG 4.11Å; W110-Q115 HydrophobicContact CH2-CG 3.98Å; W110-Q115 HydrophobicContact CZ2-CG 4.36Å; W110-Q115 HydrophobicContact CZ3-CG 3.85Å
111	S	91.9	Very high	93.3	Very high	53 Å²	53	33.9 Å²	33.9	37%	0.371	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	133.5	170.6	-172.3	0	0	0	0	109.1	G113 L114	S111-G113 PolarHBondContact O-N 2.85Å; S111-L114 PolarHBondContact N-O 2.95Å; S111-L114 PolarHBondContact O-N 3.2Å
112	N	86.7	Confident	93.6	Very high	135 Å²	135	30.2 Å²	30.2	72%	0.722	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.4	34.9	179.4	-59.1	-18	0	0	0	114.6	L114	N112-L114 VanDerWaalsContact C-N 3.29Å; N112-L114 PolarHBondContact O-N 3.31Å
113	G	85.6	Confident	93.5	Very high	3 Å²	3	28.5 Å²	28.5	3%	0.031	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-7.9	-177.7	0	0	0	0	0	116	S111	S111-G113 PolarHBondContact O-N 2.85Å
114	L	89.1	Confident	93.4	Very high	56 Å²	56	26 Å²	26	29%	0.293	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	160	178.3	-52.8	-178.2	0	0	0	111.4	W110 S111 N112	W110-L114 CarbonylContact C-O 3.56Å; W110-L114 WeakPolarHBondContact CA-O 3.35Å; W110-L114 WeakPolarHBondContact CB-O 3.41Å; S111-L114 PolarHBondContact N-O 2.95Å; S111-L114 PolarHBondContact O-N 3.2Å; N112-L114 VanDerWaalsContact C-N 3.29Å; N112-L114 PolarHBondContact O-N 3.31Å
115	Q	91.8	Very high	92.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	126.9	170.9	-58.4	103.5	-72.6	0	0	111.1	Y106 W110 W133 G136 L166	Y106-Q115 HydrophobicContact CD1-CG 3.55Å; Y106-Q115 HydrophobicContact CD2-CG 3.92Å; Y106-Q115 HydrophobicContact CE1-CB 4.01Å; Y106-Q115 HydrophobicContact CE1-CG 3.49Å; Y106-Q115 VanDerWaalsContact CE1-CG 3.49Å; Y106-Q115 HydrophobicContact CE2-CB 4.05Å; Y106-Q115 HydrophobicContact CE2-CG 3.88Å; Y106-Q115 HydrophobicContact CG-CG 3.74Å; W110-Q115 HydrophobicContact CD2-CG 4.45Å; W110-Q115 HydrophobicContact CE3-CG 4.11Å; W110-Q115 HydrophobicContact CH2-CG 3.98Å; W110-Q115 HydrophobicContact CZ2-CG 4.36Å; W110-Q115 HydrophobicContact CZ3-CG 3.85Å; Q115-W133 HydrophobicContact CB-CD2 4.19Å; Q115-W133 HydrophobicContact CB-CE3 3.85Å; Q115-W133 HydrophobicContact CB-CG 4.5Å; Q115-W133 HydrophobicContact CB-CZ3 4.41Å; Q115-G136 WeakPolarHBondContact O-CA 3.24Å; Q115-G136 PolarHBondContact O-N 3.42Å; Q115-L166 PolarHBondContact NE2-O 3.32Å
116	D	95.1	Very high	92.4	Very high	60 Å²	60	27.1 Å²	27.1	32%	0.321	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	140.4	-172.7	-157.8	88.2	0	0	0	110.6	T109 A134 G135	T109-D116 CarbonylContact C-O 3.57Å; T109-D116 VanDerWaalsContact C-O 3.29Å; T109-D116 VanDerWaalsContact CB-O 3.3Å; T109-D116 WeakPolarHBondContact CB-O 3.35Å; T109-D116 PolarHBondContact O-N 3.37Å; T109-D116 VanDerWaalsContact O-N 3.12Å; T109-D116 VanDerWaalsContact O-O 3.07Å; T109-D116 PolarHBondContact OG1-O 3.39Å; D116-A134 WeakPolarHBondContact OD1-CA 3.33Å; D116-G135 PolarHBondContact OD1-N 3.49Å
117	G	97.3	Very high	92	Very high	23 Å²	23	27.3 Å²	27.3	24%	0.237	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93.2	-102	-174.5	0	0	0	0	0	113.1	Q132 W133	G117-Q132 WeakPolarHBondContact O-CA 3.23Å; G117-W133 PolarHBondContact N-O 2.94Å; G117-W133 PolarHBondContact O-N 3.35Å
118	Y	98.4	Very high	91.9	Very high	45 Å²	45	28 Å²	28	18%	0.176	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	138.1	-172	-71.2	-92.1	0	0	0	112.3	T109 G131 Q132 K373 I376 A377	T109-Y118 PolarHBondContact N-O 2.76Å; T109-Y118 PolarHBondContact OG1-N 3.3Å; T109-Y118 PolarHBondContact OG1-O 3.01Å; T109-Y118 VanDerWaalsContact OG1-O 3.13Å; Y118-G131 WeakPolarHBondContact CA-O 3.49Å; Y118-Q132 HydrophobicContact CD1-CG 3.82Å; Y118-Q132 HydrophobicContact CE1-CG 3.38Å; Y118-K373 HydrophobicContact CE1-CB 4.21Å; Y118-K373 HydrophobicContact CE1-CD 3.99Å; Y118-K373 HydrophobicContact CE1-CG 4.37Å; Y118-K373 PolarHBondContact OH-NZ 3.01Å; Y118-I376 HydrophobicContact CD1-CB 3.98Å; Y118-I376 HydrophobicContact CD1-CG2 3.6Å; Y118-I376 HydrophobicContact CD2-CG2 3.98Å; Y118-I376 HydrophobicContact CE1-CB 3.88Å; Y118-I376 HydrophobicContact CE1-CD1 4.32Å; Y118-I376 HydrophobicContact CE1-CG2 3.63Å; Y118-I376 HydrophobicContact CE2-CG2 4.02Å; Y118-I376 HydrophobicContact CG-CG2 3.78Å; Y118-A377 HydrophobicContact CD1-CB 4.49Å
119	G	97.6	Very high	91.9	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.6	175.7	176.1	0	0	0	0	0	114.7	E107 G131 W133	E107-G119 CarbonylContact O-C 3.5Å; E107-G119 VanDerWaalsContact O-CA 3.25Å; E107-G119 WeakPolarHBondContact O-CA 3.44Å; G119-G131 PolarHBondContact N-O 2.94Å; G119-G131 PolarHBondContact O-N 3.04Å; G119-W133 PolarHBondContact O-NE1 2.88Å
120	V	98.1	Very high	92	Very high	10 Å²	10	29.6 Å²	29.6	6%	0.061	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.2	-178.1	174.7	0	0	0	0	110.1	Y106 E107 Y129 Q130 T381	Y106-V120 CarbonylContact C-O 3.58Å; Y106-V120 WeakPolarHBondContact CA-O 3.43Å; E107-V120 PolarHBondContact N-O 2.91Å; E107-V120 PolarHBondContact O-N 3.25Å; V120-Y129 CarbonylContact C-O 3.51Å; V120-Y129 VanDerWaalsContact CA-O 3.3Å; V120-Y129 WeakPolarHBondContact CA-O 3.09Å; V120-Q130 HydrophobicContact CG1-CG 4.07Å; V120-Q130 HydrophobicContact CG2-CB 4.13Å; V120-Q130 HydrophobicContact CG2-CG 3.92Å; V120-T381 HydrophobicContact CB-CG2 4.48Å; V120-T381 HydrophobicContact CG2-CG2 4.43Å; V120-T381 WeakPolarHBondContact CG2-OG1 3.3Å
121	E	96	Very high	92.1	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.8	168.2	163.3	171.7	-131.2	0	0	108.3	R105 Y106 Y123 T128 Y129 W133 R138 L166	R105-E121 CarbonylContact O-C 3.59Å; R105-E121 WeakPolarHBondContact O-CA 3.43Å; Y106-E121 HydrophobicContact CD2-CB 4.46Å; E121-Y123 HydrophobicContact CG-CD1 3.83Å; E121-Y123 HydrophobicContact CG-CE1 3.7Å; E121-Y123 HydrophobicContact CG-CG 4.34Å; E121-Y123 WeakPolarHBondContact OE1-CE1 3.29Å; E121-Y123 WeakPolarHBondContact OE2-CE1 3.41Å; E121-Y123 PolarHBondContact OE2-OH 2.98Å; E121-T128 CarbonylContact O-C 3.55Å; E121-T128 VanDerWaalsContact O-CA 3.24Å; E121-T128 WeakPolarHBondContact O-CA 3.24Å; E121-Y129 PolarHBondContact N-O 2.95Å; E121-Y129 PolarHBondContact O-N 3.44Å; E121-W133 HydrophobicContact CB-CH2 3.91Å; E121-W133 HydrophobicContact CB-CZ2 3.65Å; E121-W133 WeakPolarHBondContact OE2-CH2 3.32Å; E121-R138 IonicContact OE2-CZ 2.71Å; E121-R138 IonicContact OE2-NH1 3.34Å; E121-R138 PolarHBondContact OE2-NH1 3.28Å; E121-L166 HydrophobicContact CB-CD1 4.37Å; E121-L166 HydrophobicContact CG-CD1 3.84Å; E121-L166 HydrophobicContact CG-CG 4.22Å; E121-L166 VanDerWaalsContact OE1-CB 3.23Å; E121-L166 WeakPolarHBondContact OE1-CB 2.93Å; E121-L166 WeakPolarHBondContact OE1-CG 3.33Å; E121-L166 PolarHBondContact OE1-N 3.46Å
122	T	94	Very high	92.4	Very high	10 Å²	10	28.6 Å²	28.6	6%	0.061	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.6	158.2	-51.2	0	0	0	0	107.2	A104 R105 G127 T128	A104-T122 CarbonylContact C-O 3.5Å; A104-T122 VanDerWaalsContact CA-O 3.28Å; A104-T122 WeakPolarHBondContact CA-O 3.33Å; R105-T122 PolarHBondContact N-O 2.88Å; R105-T122 PolarHBondContact NH2-OG1 3.29Å; R105-T122 PolarHBondContact O-N 2.87Å; T122-G127 WeakPolarHBondContact CA-O 3.38Å; T122-T128 HydrophobicContact CG2-CG2 4.48Å
123	Y	87.7	Confident	92.9	Very high	20 Å²	20	22.7 Å²	22.7	8%	0.078	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-79	167.2	179.9	-59.2	-74.8	0	0	0	111.6	E121 D125 G126 G127 R138	E121-Y123 HydrophobicContact CG-CD1 3.83Å; E121-Y123 HydrophobicContact CG-CE1 3.7Å; E121-Y123 HydrophobicContact CG-CG 4.34Å; E121-Y123 WeakPolarHBondContact OE1-CE1 3.29Å; E121-Y123 WeakPolarHBondContact OE2-CE1 3.41Å; E121-Y123 PolarHBondContact OE2-OH 2.98Å; Y123-D125 VanDerWaalsContact CB-OD1 3.27Å; Y123-D125 WeakPolarHBondContact CB-OD1 3.49Å; Y123-D125 PolarHBondContact O-N 3.41Å; Y123-G126 PolarHBondContact O-N 3.2Å; Y123-G126 VanDerWaalsContact O-N 3.1Å; Y123-G127 VanDerWaalsContact CD2-C 3.46Å; Y123-G127 WeakPolarHBondContact CD2-O 3.22Å; Y123-G127 PolarHBondContact N-O 3.47Å; Y123-R138 PolarHBondContact OH-NH1 3.36Å; Y123-R138 VanDerWaalsContact OH-NH1 3.12Å
124	G	81.8	Confident	93.4	Very high	19 Å²	19	24.3 Å²	24.3	20%	0.196	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-13.9	177.2	0	0	0	0	0	115.6
125	D	80.6	Confident	93.4	Very high	61 Å²	61	23.3 Å²	23.3	33%	0.326	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-18.7	171.7	64	1.1	0	0	0	113	Y123 G127 V147 I155	Y123-D125 VanDerWaalsContact CB-OD1 3.27Å; Y123-D125 WeakPolarHBondContact CB-OD1 3.49Å; Y123-D125 PolarHBondContact O-N 3.41Å; D125-G127 PolarHBondContact OD1-N 2.83Å; D125-V147 HydrophobicContact CB-CG1 3.98Å; D125-V147 HydrophobicContact CB-CG2 4.41Å; D125-V147 VanDerWaalsContact O-CG1 3.32Å; D125-V147 WeakPolarHBondContact O-CG1 3.16Å; D125-I155 HydrophobicContact CB-CD1 3.72Å
126	G	83.4	Confident	93.4	Very high	40 Å²	40	23.6 Å²	23.6	41%	0.412	16%	0.155	S	C	.	.	S	Bend	trans	106.4	-4	-175	0	0	0	0	0	115.1	Y123	Y123-G126 PolarHBondContact O-N 3.2Å; Y123-G126 VanDerWaalsContact O-N 3.1Å
127	G	89.9	Confident	93.2	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.031	16%	0.156	C	C	.	.			trans	-68.6	169	173.2	0	0	0	0	0	111.8	T122 Y123 D125	T122-G127 WeakPolarHBondContact CA-O 3.38Å; Y123-G127 VanDerWaalsContact CD2-C 3.46Å; Y123-G127 WeakPolarHBondContact CD2-O 3.22Å; Y123-G127 PolarHBondContact N-O 3.47Å; D125-G127 PolarHBondContact OD1-N 2.83Å
128	T	95.4	Very high	93.1	Very high	25 Å²	25	23.2 Å²	23.2	15%	0.153	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	152.7	180	68.6	0	0	0	0	114.2	E121 T122 R144 Q145	E121-T128 CarbonylContact O-C 3.55Å; E121-T128 VanDerWaalsContact O-CA 3.24Å; E121-T128 WeakPolarHBondContact O-CA 3.24Å; T122-T128 HydrophobicContact CG2-CG2 4.48Å; T128-R144 CarbonylContact O-C 3.6Å; T128-R144 VanDerWaalsContact O-CA 3.31Å; T128-R144 WeakPolarHBondContact O-CA 3.15Å; T128-R144 WeakPolarHBondContact O-CG 3.24Å; T128-Q145 PolarHBondContact N-O 3.02Å; T128-Q145 PolarHBondContact O-N 3.21Å
129	Y	97.3	Very high	93	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.5	157.7	173.1	-105	0	0	0	109.8	V120 E121 Q132 W133 R138 V143 R144 W285	V120-Y129 CarbonylContact C-O 3.51Å; V120-Y129 VanDerWaalsContact CA-O 3.3Å; V120-Y129 WeakPolarHBondContact CA-O 3.09Å; E121-Y129 PolarHBondContact N-O 2.95Å; E121-Y129 PolarHBondContact O-N 3.44Å; Y129-Q132 PolarHBondContact OH-N 3.13Å; Y129-Q132 PolarHBondContact OH-O 3.09Å; Y129-Q132 VanDerWaalsContact OH-O 3.04Å; Y129-W133 AromaticContact CD1-CE2 3.81Å; Y129-W133 HydrophobicContact CD1-CH2 4.5Å; Y129-W133 AromaticContact CD1-CZ2 3.6Å; Y129-W133 HydrophobicContact CD1-CZ2 3.6Å; Y129-W133 AromaticContact CD1-NE1 3.83Å; Y129-W133 AromaticContact CE1-CE2 3.81Å; Y129-W133 HydrophobicContact CE1-CZ2 4.07Å; Y129-W133 AromaticContact CE1-NE1 3.61Å; Y129-R138 HydrophobicContact CD1-CB 4.4Å; Y129-R138 HydrophobicContact CD1-CG 3.57Å; Y129-R138 HydrophobicContact CD2-CG 4.48Å; Y129-R138 HydrophobicContact CE1-CB 3.9Å; Y129-R138 HydrophobicContact CE1-CG 3.53Å; Y129-R138 HydrophobicContact CE2-CB 4.44Å; Y129-R138 HydrophobicContact CE2-CG 4.44Å; Y129-R138 HydrophobicContact CG-CG 4.05Å; Y129-V143 CarbonylContact C-O 3.49Å; Y129-V143 WeakPolarHBondContact CA-O 3.17Å; Y129-V143 WeakPolarHBondContact CD2-O 3.4Å; Y129-R144 HydrophobicContact CD2-CB 4.05Å; Y129-W285 HydrophobicContact CD2-CZ2 4.13Å; Y129-W285 AromaticContact CE2-CD1 3.94Å; Y129-W285 HydrophobicContact CE2-CD2 4.07Å; Y129-W285 AromaticContact CE2-CE2 3.64Å; Y129-W285 HydrophobicContact CE2-CG 4.24Å; Y129-W285 HydrophobicContact CE2-CZ2 4.06Å; Y129-W285 AromaticContact CE2-NE1 3.56Å
130	Q	98.4	Very high	93	Very high	47 Å²	47	25.3 Å²	25.3	22%	0.22	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	119.9	-178.4	-54	179.4	35.8	0	0	107.3	V120 G142 V143 V374 N378	V120-Q130 HydrophobicContact CG1-CG 4.07Å; V120-Q130 HydrophobicContact CG2-CB 4.13Å; V120-Q130 HydrophobicContact CG2-CG 3.92Å; Q130-G142 CarbonylContact O-C 3.47Å; Q130-G142 VanDerWaalsContact O-CA 3.29Å; Q130-G142 WeakPolarHBondContact O-CA 3.49Å; Q130-V143 PolarHBondContact N-O 2.91Å; Q130-V143 PolarHBondContact O-N 3.27Å; Q130-V374 HydrophobicContact CB-CB 4.43Å; Q130-V374 HydrophobicContact CB-CG1 4.05Å; Q130-V374 HydrophobicContact CB-CG2 3.74Å; Q130-V374 VanDerWaalsContact O-CG2 3.31Å; Q130-V374 WeakPolarHBondContact O-CG2 3.32Å; Q130-V374 VanDerWaalsContact OE1-CG1 3.22Å; Q130-N378 PolarHBondContact OE1-ND2 2.89Å
131	G	97.9	Very high	93	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.3	-144.3	-179.5	0	0	0	0	0	114.8	Y118 G119	Y118-G131 WeakPolarHBondContact CA-O 3.49Å; G119-G131 PolarHBondContact N-O 2.94Å; G119-G131 PolarHBondContact O-N 3.04Å
132	Q	98.4	Very high	93.1	Very high	43 Å²	43	27.4 Å²	27.4	20%	0.201	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	149.4	-172.7	-72.6	-174.4	-92.8	0	0	114	G117 Y118 Y129 H139 Y141 K373	G117-Q132 WeakPolarHBondContact O-CA 3.23Å; Y118-Q132 HydrophobicContact CD1-CG 3.82Å; Y118-Q132 HydrophobicContact CE1-CG 3.38Å; Y129-Q132 PolarHBondContact OH-N 3.13Å; Y129-Q132 PolarHBondContact OH-O 3.09Å; Y129-Q132 VanDerWaalsContact OH-O 3.04Å; Q132-H139 CarbonylContact C-O 3.52Å; Q132-H139 WeakPolarHBondContact CB-O 3.44Å; Q132-H139 PolarHBondContact O-N 3.36Å; Q132-H139 VanDerWaalsContact O-O 3.06Å; Q132-Y141 PolarHBondContact N-O 2.84Å; Q132-Y141 VanDerWaalsContact N-O 3.13Å; Q132-K373 HydrophobicContact CG-CB 4.44Å; Q132-K373 HydrophobicContact CG-CG 4.33Å
133	W	96.8	Very high	93.3	Very high	10 Å²	10	27.9 Å²	27.9	4%	0.038	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.2	-175.3	-68.4	81.8	0	0	0	110.8	Y106 Q115 G117 G119 E121 Y129 M137 R138	Y106-W133 HydrophobicContact CD2-CH2 4.23Å; Y106-W133 AromaticContact CD2-CZ2 3.84Å; Y106-W133 HydrophobicContact CD2-CZ2 3.84Å; Y106-W133 AromaticContact CE2-CD2 3.92Å; Y106-W133 HydrophobicContact CE2-CD2 3.92Å; Y106-W133 AromaticContact CE2-CE2 3.47Å; Y106-W133 VanDerWaalsContact CE2-CE2 3.47Å; Y106-W133 HydrophobicContact CE2-CG 4.29Å; Y106-W133 HydrophobicContact CE2-CH2 4.32Å; Y106-W133 AromaticContact CE2-CZ2 3.68Å; Y106-W133 HydrophobicContact CE2-CZ2 3.68Å; Y106-W133 AromaticContact CE2-NE1 3.61Å; Q115-W133 HydrophobicContact CB-CD2 4.19Å; Q115-W133 HydrophobicContact CB-CE3 3.85Å; Q115-W133 HydrophobicContact CB-CG 4.5Å; Q115-W133 HydrophobicContact CB-CZ3 4.41Å; G117-W133 PolarHBondContact N-O 2.94Å; G117-W133 PolarHBondContact O-N 3.35Å; G119-W133 PolarHBondContact O-NE1 2.88Å; E121-W133 HydrophobicContact CB-CH2 3.91Å; E121-W133 HydrophobicContact CB-CZ2 3.65Å; E121-W133 WeakPolarHBondContact OE2-CH2 3.32Å; Y129-W133 AromaticContact CD1-CE2 3.81Å; Y129-W133 HydrophobicContact CD1-CH2 4.5Å; Y129-W133 AromaticContact CD1-CZ2 3.6Å; Y129-W133 HydrophobicContact CD1-CZ2 3.6Å; Y129-W133 AromaticContact CD1-NE1 3.83Å; Y129-W133 AromaticContact CE1-CE2 3.81Å; Y129-W133 HydrophobicContact CE1-CZ2 4.07Å; Y129-W133 AromaticContact CE1-NE1 3.61Å; W133-M137 WeakPolarHBondContact CA-O 3.46Å; W133-R138 HydrophobicContact CE3-CG 4.39Å; W133-R138 HydrophobicContact CH2-CG 3.86Å; W133-R138 HydrophobicContact CZ2-CG 4.09Å; W133-R138 HydrophobicContact CZ3-CG 4.01Å
134	A	95.6	Very high	93.7	Very high	37 Å²	37	27.2 Å²	27.2	31%	0.306	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	126.2	170.9	0	0	0	0	0	109.7	D116 G136 M137 H139	D116-A134 WeakPolarHBondContact OD1-CA 3.33Å; A134-G136 VanDerWaalsContact C-N 3.28Å; A134-G136 PolarHBondContact O-N 3.37Å; A134-M137 PolarHBondContact N-O 3.36Å; A134-M137 PolarHBondContact O-N 2.92Å; A134-H139 HydrophobicContact CB-CB 3.78Å
135	G	90.9	Very high	94.3	Very high	36 Å²	36	30.5 Å²	30.5	37%	0.371	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	36.9	174.4	0	0	0	0	0	114.9	D116 M137	D116-G135 PolarHBondContact OD1-N 3.49Å; G135-M137 VanDerWaalsContact C-N 3.34Å; G135-M137 PolarHBondContact O-N 3.03Å
136	G	90.3	Very high	94.7	Very high	6 Å²	6	28.2 Å²	28.2	6%	0.062	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	5.1	-178.8	0	0	0	0	0	115.6	Q115 A134	Q115-G136 WeakPolarHBondContact O-CA 3.24Å; Q115-G136 PolarHBondContact O-N 3.42Å; A134-G136 VanDerWaalsContact C-N 3.28Å; A134-G136 PolarHBondContact O-N 3.37Å
137	M	91.6	Very high	95	Very high	70 Å²	70	26.9 Å²	26.9	35%	0.345	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152.3	179	-68.2	176.6	-106.5	0	0	112	W133 A134 G135 H139 N287 D288	W133-M137 WeakPolarHBondContact CA-O 3.46Å; A134-M137 PolarHBondContact N-O 3.36Å; A134-M137 PolarHBondContact O-N 2.92Å; G135-M137 VanDerWaalsContact C-N 3.34Å; G135-M137 PolarHBondContact O-N 3.03Å; M137-H139 PolarHBondContact O-N 2.87Å; M137-N287 HydrophobicContact SD-CB 3.88Å; M137-D288 WeakPolarHBondContact CA-OD1 3.33Å
138	R	95.4	Very high	94.9	Very high	5 Å²	5	29 Å²	29	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	126	170.5	-57.8	-179.3	-69.5	-79.7	-13.4	109.6	E121 Y123 Y129 W133 W285 N287 D288	E121-R138 IonicContact OE2-CZ 2.71Å; E121-R138 IonicContact OE2-NH1 3.34Å; E121-R138 PolarHBondContact OE2-NH1 3.28Å; Y123-R138 PolarHBondContact OH-NH1 3.36Å; Y123-R138 VanDerWaalsContact OH-NH1 3.12Å; Y129-R138 HydrophobicContact CD1-CB 4.4Å; Y129-R138 HydrophobicContact CD1-CG 3.57Å; Y129-R138 HydrophobicContact CD2-CG 4.48Å; Y129-R138 HydrophobicContact CE1-CB 3.9Å; Y129-R138 HydrophobicContact CE1-CG 3.53Å; Y129-R138 HydrophobicContact CE2-CB 4.44Å; Y129-R138 HydrophobicContact CE2-CG 4.44Å; Y129-R138 HydrophobicContact CG-CG 4.05Å; W133-R138 HydrophobicContact CE3-CG 4.39Å; W133-R138 HydrophobicContact CH2-CG 3.86Å; W133-R138 HydrophobicContact CZ2-CG 4.09Å; W133-R138 HydrophobicContact CZ3-CG 4.01Å; R138-W285 HydrophobicContact CB-CD2 4.42Å; R138-W285 HydrophobicContact CB-CE3 4.15Å; R138-N287 PolarHBondContact O-N 3.39Å; R138-D288 IonicContact CZ-OD1 3.83Å; R138-D288 PolarHBondContact N-OD1 2.86Å; R138-D288 IonicContact NE-OD1 2.8Å; R138-D288 IonicContact NH1-OD1 3.82Å; R138-D288 PolarHBondContact NH2-O 2.96Å; R138-D288 VanDerWaalsContact NH2-O 3.16Å; R138-D288 IonicContact NH2-OD1 3.07Å; R138-D288 PolarHBondContact O-N 3.3Å
139	H	95.3	Very high	94.1	Very high	73 Å²	73	28.7 Å²	28.7	34%	0.338	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	146.8	-170.8	-165.9	108.3	0	0	0	110.4	Q132 A134 M137 W285 N287	Q132-H139 CarbonylContact C-O 3.52Å; Q132-H139 WeakPolarHBondContact CB-O 3.44Å; Q132-H139 PolarHBondContact O-N 3.36Å; Q132-H139 VanDerWaalsContact O-O 3.06Å; A134-H139 HydrophobicContact CB-CB 3.78Å; M137-H139 PolarHBondContact O-N 2.87Å; H139-W285 CarbonylContact C-O 3.49Å; H139-W285 WeakPolarHBondContact CA-O 3.31Å; H139-N287 PolarHBondContact ND1-OD1 3.3Å
140	G	98.1	Very high	92.9	Very high	16 Å²	16	29.3 Å²	29.3	17%	0.165	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.3	-144.1	-176.4	0	0	0	0	0	111.1	E284 W285	G140-E284 CarbonylContact O-C 3.45Å; G140-W285 PolarHBondContact N-O 3.4Å; G140-W285 WeakPolarHBondContact O-CB 3.48Å; G140-W285 PolarHBondContact O-N 2.88Å
141	Y	98.7	Very high	91.7	Very high	54 Å²	54	32.7 Å²	32.7	21%	0.212	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	141.7	-177.2	-60.5	-94.7	0	0	0	112.2	Q132 G283 E284 A366 M369	Q132-Y141 PolarHBondContact N-O 2.84Å; Q132-Y141 VanDerWaalsContact N-O 3.13Å; Y141-G283 WeakPolarHBondContact CA-O 3.27Å; Y141-E284 HydrophobicContact CD1-CG 3.82Å; Y141-E284 HydrophobicContact CE1-CG 3.34Å; Y141-A366 HydrophobicContact CD1-CB 4.49Å; Y141-A366 HydrophobicContact CE1-CB 4.04Å; Y141-M369 HydrophobicContact CD1-CB 3.81Å; Y141-M369 HydrophobicContact CD2-CE 4.17Å; Y141-M369 HydrophobicContact CE1-CB 4.03Å; Y141-M369 HydrophobicContact CE1-CE 4.07Å; Y141-M369 HydrophobicContact CE1-SD 4.06Å; Y141-M369 HydrophobicContact CE2-CE 3.53Å; Y141-M369 HydrophobicContact CG-CB 4.18Å; Y141-M369 VanDerWaalsContact CZ-CE 3.49Å
142	G	98.1	Very high	89.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	164.1	173.7	0	0	0	0	0	114.3	Q130 G283 W285	Q130-G142 CarbonylContact O-C 3.47Å; Q130-G142 VanDerWaalsContact O-CA 3.29Å; Q130-G142 WeakPolarHBondContact O-CA 3.49Å; G142-G283 PolarHBondContact N-O 3.1Å; G142-G283 VanDerWaalsContact N-O 3.09Å; G142-G283 PolarHBondContact O-N 3.24Å; G142-W285 PolarHBondContact O-NE1 2.75Å
143	V	98.4	Very high	87.7	Confident	21 Å²	21	34.2 Å²	34.2	13%	0.127	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.1	179.1	178.8	0	0	0	0	109.7	Y129 Q130 T280 Y281 M282 A370 V374	Y129-V143 CarbonylContact C-O 3.49Å; Y129-V143 WeakPolarHBondContact CA-O 3.17Å; Y129-V143 WeakPolarHBondContact CD2-O 3.4Å; Q130-V143 PolarHBondContact N-O 2.91Å; Q130-V143 PolarHBondContact O-N 3.27Å; V143-T280 HydrophobicContact CG1-CG2 3.82Å; V143-Y281 CarbonylContact C-O 3.57Å; V143-Y281 VanDerWaalsContact CA-O 3.24Å; V143-Y281 WeakPolarHBondContact CA-O 3.48Å; V143-M282 HydrophobicContact CG1-CG 4.1Å; V143-M282 HydrophobicContact CG2-CB 4.13Å; V143-M282 HydrophobicContact CG2-CG 3.98Å; V143-A370 HydrophobicContact CG2-CB 4.07Å; V143-V374 HydrophobicContact CB-CG2 3.75Å; V143-V374 HydrophobicContact CG2-CG2 3.59Å
144	R	96.3	Very high	85.2	Confident	5 Å²	5	39.2 Å²	39.2	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.6	175.2	-177.7	-91.8	168.4	176.4	-2.2	109.6	T128 Y129 F193 E279 T280 Y281 W285	T128-R144 CarbonylContact O-C 3.6Å; T128-R144 VanDerWaalsContact O-CA 3.31Å; T128-R144 WeakPolarHBondContact O-CA 3.15Å; T128-R144 WeakPolarHBondContact O-CG 3.24Å; Y129-R144 HydrophobicContact CD2-CB 4.05Å; R144-F193 HydrophobicContact CG-CE1 4.23Å; R144-F193 HydrophobicContact CG-CZ 4.1Å; R144-F193 VanDerWaalsContact NH2-CG 3.33Å; R144-E279 IonicContact NH1-OE2 2.85Å; R144-E279 PolarHBondContact NH1-OE2 2.84Å; R144-T280 CarbonylContact O-C 3.3Å; R144-T280 VanDerWaalsContact O-CA 3.32Å; R144-T280 WeakPolarHBondContact O-CA 3.45Å; R144-Y281 PolarHBondContact N-O 2.8Å; R144-Y281 PolarHBondContact O-N 3.35Å; R144-W285 HydrophobicContact CB-CH2 3.79Å; R144-W285 HydrophobicContact CB-CZ2 3.47Å; R144-W285 VanDerWaalsContact CB-CZ2 3.47Å; R144-W285 HydrophobicContact CG-CH2 4.07Å; R144-W285 HydrophobicContact CG-CZ2 4.27Å
145	Q	94.6	Very high	82.8	Confident	89 Å²	89	40.1 Å²	40.1	42%	0.416	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.3	175.1	-171.3	178.3	9.8	0	0	110	T128	T128-Q145 PolarHBondContact N-O 3.02Å; T128-Q145 PolarHBondContact O-N 3.21Å
146	S	88.8	Confident	80.2	Confident	12 Å²	12	47.7 Å²	47.7	8%	0.084	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-83.4	158	173.5	83.7	0	0	0	0	112.7	T278 E279	S146-T278 WeakPolarHBondContact OG-CA 3.24Å; S146-E279 PolarHBondContact N-O 3.22Å; S146-E279 PolarHBondContact OG-N 3.17Å
147	V	88.3	Confident	77.3	Confident	13 Å²	13	50 Å²	50	8%	0.079	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-65.2	163.6	152.5	-57.1	0	0	0	0	110.5	D125 M151 A152	D125-V147 HydrophobicContact CB-CG1 3.98Å; D125-V147 HydrophobicContact CB-CG2 4.41Å; D125-V147 VanDerWaalsContact O-CG1 3.32Å; D125-V147 WeakPolarHBondContact O-CG1 3.16Å; V147-M151 HydrophobicContact CB-CB 4.25Å; V147-M151 HydrophobicContact CG2-CB 4.05Å; V147-A152 HydrophobicContact CG2-CB 3.86Å
148	P	87.6	Confident	74.5	Confident	47 Å²	47	52.6 Å²	52.6	31%	0.305	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-53.7	142.5	171.5	-28.9	37.3	0	0	0	112.9	G150 M151 A152 A275 T277 T278	P148-G150 PolarHBondContact O-N 2.8Å; P148-G150 VanDerWaalsContact O-N 3.16Å; P148-M151 HydrophobicContact CB-CG 4.26Å; P148-M151 HydrophobicContact CG-CG 4.44Å; P148-M151 WeakPolarHBondContact O-CA 3.38Å; P148-M151 WeakPolarHBondContact O-CB 3.47Å; P148-M151 PolarHBondContact O-N 2.88Å; P148-A152 PolarHBondContact O-N 3.29Å; P148-A275 CarbonylContact C-O 3.5Å; P148-A275 VanDerWaalsContact CB-O 3.24Å; P148-A275 WeakPolarHBondContact CB-O 3.48Å; P148-T277 CarbonylContact C-O 3.55Å; P148-T277 VanDerWaalsContact CA-O 3.24Å; P148-T277 WeakPolarHBondContact CA-O 3.41Å; P148-T278 HydrophobicContact CG-CG2 4.13Å
149	Y	78.9	Confident	71.4	Confident	19 Å²	19	60.6 Å²	60.6	8%	0.075	33%	0.325	C	S	.	.	H	α-helix	trans	-57.3	-34.2	-175.4	-91.7	-87.8	0	0	0	112.8	A152 T153 V194 V273 A275 T277 E279	Y149-A152 CarbonylContact O-C 3.53Å; Y149-A152 WeakPolarHBondContact O-CA 3.37Å; Y149-A152 WeakPolarHBondContact O-CB 3.41Å; Y149-A152 PolarHBondContact O-N 2.84Å; Y149-A152 VanDerWaalsContact O-N 3.1Å; Y149-T153 WeakPolarHBondContact O-CG2 3.49Å; Y149-T153 PolarHBondContact O-N 2.83Å; Y149-T153 PolarHBondContact O-OG1 3.38Å; Y149-V194 HydrophobicContact CE1-CG1 4.41Å; Y149-V194 HydrophobicContact CE1-CG2 4.27Å; Y149-V273 HydrophobicContact CD1-CG1 4.05Å; Y149-V273 HydrophobicContact CD2-CG1 3.38Å; Y149-V273 HydrophobicContact CE1-CG1 4.35Å; Y149-V273 HydrophobicContact CE2-CG1 3.76Å; Y149-V273 HydrophobicContact CG-CG1 3.56Å; Y149-A275 PolarHBondContact N-O 3.38Å; Y149-T277 HydrophobicContact CD2-CG2 4.01Å; Y149-T277 VanDerWaalsContact CD2-O 3.24Å; Y149-T277 WeakPolarHBondContact CD2-O 3.29Å; Y149-T277 HydrophobicContact CE2-CG2 4.25Å; Y149-T277 PolarHBondContact N-O 3.5Å; Y149-E279 HydrophobicContact CE2-CB 4.28Å
150	G	73.3	Confident	68.4	Low	13 Å²	13	66.1 Å²	66.1	13%	0.134	34%	0.343	C	S	.	.	H	α-helix	trans	-66.5	-34.4	174.7	0	0	0	0	0	113.8	P148 A152 T153 V154 A275	P148-G150 PolarHBondContact O-N 2.8Å; P148-G150 VanDerWaalsContact O-N 3.16Å; G150-A152 VanDerWaalsContact C-N 3.34Å; G150-T153 WeakPolarHBondContact CA-OG1 3.24Å; G150-T153 PolarHBondContact O-OG1 2.87Å; G150-T153 VanDerWaalsContact O-OG1 3.09Å; G150-V154 WeakPolarHBondContact O-CG2 3.49Å; G150-V154 PolarHBondContact O-N 2.92Å; G150-A275 PolarHBondContact N-O 2.78Å
151	M	72.6	Confident	65.1	Low	118 Å²	118	69.4 Å²	69.4	58%	0.581	36%	0.36	S	S	*	.	H	α-helix	trans	-69.2	-37.6	169.2	-61.3	-65.3	100	0	0	110.3	V147 P148 T153	V147-M151 HydrophobicContact CB-CB 4.25Å; V147-M151 HydrophobicContact CG2-CB 4.05Å; P148-M151 HydrophobicContact CB-CG 4.26Å; P148-M151 HydrophobicContact CG-CG 4.44Å; P148-M151 WeakPolarHBondContact O-CA 3.38Å; P148-M151 WeakPolarHBondContact O-CB 3.47Å; P148-M151 PolarHBondContact O-N 2.88Å; M151-T153 VanDerWaalsContact C-N 3.34Å; M151-T153 PolarHBondContact O-N 3.12Å
152	A	61	Low	61.9	Low	8 Å²	8	70.5 Å²	70.5	7%	0.066	38%	0.375	C	S	.	.	H	α-helix	trans	-73.8	-17	-178.7	0	0	0	0	0	115.1	V147 P148 Y149 G150 R190	V147-A152 HydrophobicContact CG2-CB 3.86Å; P148-A152 PolarHBondContact O-N 3.29Å; Y149-A152 CarbonylContact O-C 3.53Å; Y149-A152 WeakPolarHBondContact O-CA 3.37Å; Y149-A152 WeakPolarHBondContact O-CB 3.41Å; Y149-A152 PolarHBondContact O-N 2.84Å; Y149-A152 VanDerWaalsContact O-N 3.1Å; G150-A152 VanDerWaalsContact C-N 3.34Å; A152-R190 PolarHBondContact O-NH1 3Å
153	T	50.8	Low	58.9	Low	67 Å²	67	78.1 Å²	78.1	41%	0.411	42%	0.415	S	S	.	.	H	α-helix	trans	-92.9	-32	176.6	50.1	0	0	0	0	113.3	Y149 G150 M151 I155 R156	Y149-T153 WeakPolarHBondContact O-CG2 3.49Å; Y149-T153 PolarHBondContact O-N 2.83Å; Y149-T153 PolarHBondContact O-OG1 3.38Å; G150-T153 WeakPolarHBondContact CA-OG1 3.24Å; G150-T153 PolarHBondContact O-OG1 2.87Å; G150-T153 VanDerWaalsContact O-OG1 3.09Å; M151-T153 VanDerWaalsContact C-N 3.34Å; M151-T153 PolarHBondContact O-N 3.12Å; T153-I155 PolarHBondContact O-N 2.85Å; T153-R156 VanDerWaalsContact O-CB 3.24Å; T153-R156 WeakPolarHBondContact O-CB 3.41Å; T153-R156 WeakPolarHBondContact O-CG 3.21Å; T153-R156 PolarHBondContact O-N 2.81Å
154	V	45.1	Very low	56.1	Low	114 Å²	114	77.8 Å²	77.8	69%	0.691	42%	0.415	S	S	*	.	H	α-helix	trans	-61.4	-25.6	174.7	170.5	0	0	0	0	111.8	G150 R156	G150-V154 WeakPolarHBondContact O-CG2 3.49Å; G150-V154 PolarHBondContact O-N 2.92Å; V154-R156 PolarHBondContact O-N 3.14Å
155	I	44.9	Very low	53.2	Low	57 Å²	57	79.1 Å²	79.1	29%	0.292	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	44.4	172	-40	172.8	0	0	0	111.4	D125 T153	D125-I155 HydrophobicContact CB-CD1 3.72Å; T153-I155 PolarHBondContact O-N 2.85Å
156	R	35.7	Very low	50.8	Low	195 Å²	195	75 Å²	75	74%	0.736	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	13.7	173.8	-81.7	-175	160.6	-177.2	-4.5	114.1	T153 V154	T153-R156 VanDerWaalsContact O-CB 3.24Å; T153-R156 WeakPolarHBondContact O-CB 3.41Å; T153-R156 WeakPolarHBondContact O-CG 3.21Å; T153-R156 PolarHBondContact O-N 2.81Å; V154-R156 PolarHBondContact O-N 3.14Å
157	S	29	Very low	48.4	Very low	53 Å²	53	78.8 Å²	78.8	37%	0.371	42%	0.418	S	S	.	.			trans	-63.9	128	167.5	46.6	0	0	0	0	109.8	L159 R160	S157-L159 PolarHBondContact O-N 3.14Å; S157-R160 PolarHBondContact O-N 2.95Å; S157-R160 VanDerWaalsContact OG-CB 3.27Å; S157-R160 WeakPolarHBondContact OG-CB 3.41Å
158	P	34.5	Very low	46	Very low	126 Å²	126	79.2 Å²	79.2	82%	0.818	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-4.4	-172	27.1	-35.5	0	0	0	114.1
159	L	30.3	Very low	43.5	Very low	173 Å²	173	84 Å²	84	91%	0.906	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	2.6	176.8	-62.4	172.6	0	0	0	113.1	S157	S157-L159 PolarHBondContact O-N 3.14Å
160	R	32.5	Very low	41.4	Very low	189 Å²	189	88 Å²	88	71%	0.713	46%	0.46	S	S	*	.			trans	-143.3	28.1	-169.9	-140.6	-179.3	-174.4	-177.3	1.5	115.7	S157 S162	S157-R160 PolarHBondContact O-N 2.95Å; S157-R160 VanDerWaalsContact OG-CB 3.27Å; S157-R160 WeakPolarHBondContact OG-CB 3.41Å; R160-S162 PolarHBondContact O-N 2.87Å
161	T	28.5	Very low	39.8	Very low	84 Å²	84	89.9 Å²	89.9	52%	0.515	47%	0.47	S	S	.	.			trans	-65.8	88.2	159.8	50.7	0	0	0	0	108.8	L163	T161-L163 PolarHBondContact O-N 2.81Å
162	S	30.9	Very low	37.9	Very low	77 Å²	77	87.8 Å²	87.8	54%	0.538	46%	0.462	S	S	.	.			trans	-64.5	137.1	-170.7	58.1	0	0	0	0	111.7	R160 A164	R160-S162 PolarHBondContact O-N 2.87Å; S162-A164 PolarHBondContact O-N 3.32Å
163	L	35.3	Very low	36.5	Very low	160 Å²	160	90.3 Å²	90.3	84%	0.838	49%	0.488	S	S	*	.			trans	-71.6	36.3	173.1	-67	164.1	0	0	0	111.8	T161 S165	T161-L163 PolarHBondContact O-N 2.81Å; L163-S165 VanDerWaalsContact C-N 3.32Å; L163-S165 PolarHBondContact O-N 2.82Å
164	A	38.6	Very low	35.5	Very low	15 Å²	15	91.9 Å²	91.9	12%	0.124	50%	0.502	C	S	.	.			trans	-91.9	22.2	-170.3	0	0	0	0	0	113.9	S162	S162-A164 PolarHBondContact O-N 3.32Å
165	S	36	Very low	34.7	Very low	33 Å²	33	91.3 Å²	91.3	23%	0.231	50%	0.499	C	S	.	.	S	Bend	trans	-74.8	134.8	155.4	-167.8	0	0	0	0	107.1	L163 R167	L163-S165 VanDerWaalsContact C-N 3.32Å; L163-S165 PolarHBondContact O-N 2.82Å; S165-R167 PolarHBondContact O-N 2.89Å
166	L	44.9	Very low	33.8	Very low	2 Å²	2	96.8 Å²	96.8	1%	0.01	53%	0.528	C	S	.	.			trans	-79	47.2	-173.2	-61.6	-178.8	0	0	0	113.4	W80 R97 A104 R105 Y106 Q115 E121 S168	W80-L166 HydrophobicContact CH2-CD2 3.23Å; W80-L166 HydrophobicContact CZ2-CD2 4.23Å; W80-L166 HydrophobicContact CZ3-CD2 3.46Å; W80-L166 VanDerWaalsContact CZ3-CD2 3.46Å; R97-L166 VanDerWaalsContact NH2-C 3.3Å; R97-L166 PolarHBondContact NH2-O 2.93Å; A104-L166 HydrophobicContact CB-CD2 4.15Å; R105-L166 VanDerWaalsContact O-CD1 3.29Å; R105-L166 WeakPolarHBondContact O-CD1 3.27Å; Y106-L166 VanDerWaalsContact N-CD1 3.32Å; Q115-L166 PolarHBondContact NE2-O 3.32Å; E121-L166 HydrophobicContact CB-CD1 4.37Å; E121-L166 HydrophobicContact CG-CD1 3.84Å; E121-L166 HydrophobicContact CG-CG 4.22Å; E121-L166 VanDerWaalsContact OE1-CB 3.23Å; E121-L166 WeakPolarHBondContact OE1-CB 2.93Å; E121-L166 WeakPolarHBondContact OE1-CG 3.33Å; E121-L166 PolarHBondContact OE1-N 3.46Å; L166-S168 PolarHBondContact O-N 3.43Å
167	R	37.9	Very low	33.4	Very low	91 Å²	91	95.9 Å²	95.9	34%	0.343	53%	0.531	S	S	.	.			trans	-62.2	135	167.3	-64.7	-156.3	175.3	98.7	12.2	109.2	R97 S165 E169 D288	R97-R167 PolarHBondContact NH2-O 3.46Å; S165-R167 PolarHBondContact O-N 2.89Å; R167-E169 VanDerWaalsContact C-N 3.31Å; R167-E169 PolarHBondContact O-N 2.94Å; R167-D288 IonicContact CZ-OD2 3.99Å; R167-D288 IonicContact NE-OD2 3.87Å; R167-D288 PolarHBondContact NE-OD2 2.96Å; R167-D288 IonicContact NH2-OD2 3.55Å; R167-D288 PolarHBondContact NH2-OD2 3.22Å
168	S	37.1	Very low	33.3	Very low	22 Å²	22	100.4 Å²	100.4	15%	0.154	55%	0.551	C	S	.	*			trans	-80.8	89.6	164.4	-157.5	0	0	0	0	107.2	R97 L166 Q170	R97-S168 PolarHBondContact NH1-OG 3.22Å; L166-S168 PolarHBondContact O-N 3.43Å; S168-Q170 PolarHBondContact O-N 3.09Å
169	E	36.9	Very low	33	Very low	148 Å²	148	98.8 Å²	98.8	69%	0.692	55%	0.549	S	S	*	.			trans	-48.4	134.9	159.6	-61.9	-53.2	134	0	0	108	R167 S171	R167-E169 VanDerWaalsContact C-N 3.31Å; R167-E169 PolarHBondContact O-N 2.94Å; E169-S171 PolarHBondContact O-N 3.1Å
170	Q	33.8	Very low	32.8	Very low	104 Å²	104	95 Å²	95	49%	0.486	54%	0.543	S	S	.	.			trans	-56.2	127.2	-155.2	-57.6	161	-41.7	0	0	111.3	S168 N172 S174	S168-Q170 PolarHBondContact O-N 3.09Å; Q170-N172 VanDerWaalsContact C-N 3.25Å; Q170-N172 WeakPolarHBondContact CB-O 3.43Å; Q170-N172 PolarHBondContact O-N 2.99Å; Q170-S174 PolarHBondContact NE2-O 2.96Å; Q170-S174 PolarHBondContact OE1-O 3.43Å; Q170-S174 VanDerWaalsContact OE1-O 3.14Å
171	S	38.9	Very low	32.6	Very low	51 Å²	51	90.3 Å²	90.3	36%	0.357	54%	0.544	S	S	.	.	S	Bend	trans	-72	-23.1	-175.3	58.8	0	0	0	0	113.4	E169	E169-S171 PolarHBondContact O-N 3.1Å
172	N	34.2	Very low	32.6	Very low	75 Å²	75	91.3 Å²	91.3	40%	0.401	56%	0.561	S	S	.	*	S	Bend	trans	-118.5	140	167.4	-57.6	21.7	0	0	0	106.5	Q170	Q170-N172 VanDerWaalsContact C-N 3.25Å; Q170-N172 WeakPolarHBondContact CB-O 3.43Å; Q170-N172 PolarHBondContact O-N 2.99Å
173	G	31.3	Very low	32.4	Very low	61 Å²	61	92.3 Å²	92.3	63%	0.629	57%	0.574	S	S	*	*			trans	-94.2	132.2	-160.9	0	0	0	0	0	115.5
174	S	28.4	Very low	31.9	Very low	99 Å²	99	92 Å²	92	69%	0.692	57%	0.573	S	S	*	*			trans	-171	114	138.9	56.1	0	0	0	0	110.8	Q170	Q170-S174 PolarHBondContact NE2-O 2.96Å; Q170-S174 PolarHBondContact OE1-O 3.43Å; Q170-S174 VanDerWaalsContact OE1-O 3.14Å
175	V	28.8	Very low	31.3	Very low	103 Å²	103	95.6 Å²	95.6	62%	0.624	60%	0.597	S	S	*	*			trans	-111.8	115.2	170.6	178.1	0	0	0	0	108.8	H177	V175-H177 PolarHBondContact O-N 3.16Å
176	L	26.9	Very low	31	Very low	172 Å²	172	99 Å²	99	90%	0.901	62%	0.619	S	S	*	*			trans	-71.8	117.2	165.2	-81	166.9	0	0	0	108.9	D178	L176-D178 PolarHBondContact O-N 3.13Å; L176-D178 VanDerWaalsContact O-N 3.08Å
177	H	26.9	Very low	30.2	Very low	175 Å²	175	102.7 Å²	102.7	81%	0.81	65%	0.649	S	S	*	*			trans	-75.4	90.1	171.9	-99.1	-89.9	0	0	0	110.3	V175 A179	V175-H177 PolarHBondContact O-N 3.16Å; H177-A179 VanDerWaalsContact C-N 3.28Å; H177-A179 PolarHBondContact O-N 2.84Å
178	D	25.9	Very low	29.6	Very low	149 Å²	149	101.7 Å²	101.7	80%	0.797	67%	0.667	S	S	*	*			trans	-78.7	81	169.8	-138.9	-15.7	0	0	0	109.3	L176 A180	L176-D178 PolarHBondContact O-N 3.13Å; L176-D178 VanDerWaalsContact O-N 3.08Å; D178-A180 PolarHBondContact O-N 2.56Å
179	A	29.6	Very low	29.5	Very low	92 Å²	92	104.5 Å²	104.5	76%	0.76	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	33.6	-165.4	0	0	0	0	0	114.9	H177	H177-A179 VanDerWaalsContact C-N 3.28Å; H177-A179 PolarHBondContact O-N 2.84Å
180	A	26.1	Very low	29.7	Very low	94 Å²	94	102.2 Å²	102.2	78%	0.777	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-1.1	-173	0	0	0	0	0	114.8	D178	D178-A180 PolarHBondContact O-N 2.56Å
181	A	28.3	Very low	29.9	Very low	89 Å²	89	97.8 Å²	97.8	74%	0.736	65%	0.65	S	S	*	*			trans	-105.4	13.2	-177.1	0	0	0	0	0	114.7	A183	A181-A183 PolarHBondContact O-N 2.84Å
182	A	27.5	Very low	29.9	Very low	106 Å²	106	96.8 Å²	96.8	88%	0.876	65%	0.648	S	S	*	*			trans	-79.1	55.9	-174.9	0	0	0	0	0	113.6
183	A	27	Very low	30.4	Very low	98 Å²	98	94 Å²	94	81%	0.81	63%	0.633	S	S	*	*			trans	-147.7	33.4	-179	0	0	0	0	0	113.7	A181	A181-A183 PolarHBondContact O-N 2.84Å
184	D	24.6	Very low	30.8	Very low	154 Å²	154	94.2 Å²	94.2	82%	0.824	62%	0.622	S	S	*	*	S	Bend	trans	-146.6	154	169.9	-145.6	-21.6	0	0	0	111.7
185	S	26.9	Very low	31.2	Very low	90 Å²	90	90.1 Å²	90.1	63%	0.629	59%	0.592	S	S	*	*			trans	-76	145.1	-164.2	-70.9	0	0	0	0	114.2	A187	S185-A187 PolarHBondContact O-N 3.19Å
186	P	28.4	Very low	31.4	Very low	105 Å²	105	89.5 Å²	89.5	68%	0.682	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-69.7	8.1	-171.4	28.3	-36.5	0	0	0	116.1	G188	P186-G188 PolarHBondContact O-N 3.38Å
187	A	27.9	Very low	32.1	Very low	78 Å²	78	83.7 Å²	83.7	65%	0.645	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-68.8	-15.3	174.3	0	0	0	0	0	113.8	S185 T189 R190	S185-A187 PolarHBondContact O-N 3.19Å; A187-T189 VanDerWaalsContact C-N 3.34Å; A187-T189 PolarHBondContact O-N 2.95Å; A187-R190 PolarHBondContact O-N 3.32Å
188	G	26.6	Very low	32.2	Very low	71 Å²	71	81.5 Å²	81.5	73%	0.732	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-69.4	-13	-167.5	0	0	0	0	0	117.6	P186	P186-G188 PolarHBondContact O-N 3.38Å
189	T	34	Very low	32.4	Very low	81 Å²	81	76.9 Å²	76.9	50%	0.497	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-83.8	-22.3	179.8	51	0	0	0	0	113.7	A187	A187-T189 VanDerWaalsContact C-N 3.34Å; A187-T189 PolarHBondContact O-N 2.95Å
190	R	41.4	Very low	32.4	Very low	100 Å²	100	79 Å²	79	38%	0.377	52%	0.524	S	S	.	.	S	Bend	trans	-76.1	124.7	170.9	178.1	171.4	166.7	172.4	-7.7	108.8	A152 A187 G192 F193	A152-R190 PolarHBondContact O-NH1 3Å; A187-R190 PolarHBondContact O-N 3.32Å; R190-G192 PolarHBondContact O-N 3.26Å; R190-F193 HydrophobicContact CG-CD2 4.11Å; R190-F193 PolarHBondContact NH2-O 3.18Å
191	G	39	Very low	33.1	Very low	10 Å²	10	79 Å²	79	10%	0.103	52%	0.524	C	S	.	.			trans	-69.8	52.9	-174.7	0	0	0	0	0	116.3	F193 N311	G191-F193 VanDerWaalsContact O-CD1 3.32Å; G191-F193 WeakPolarHBondContact O-CD1 3.44Å; G191-F193 WeakPolarHBondContact O-CE1 3.35Å; G191-F193 PolarHBondContact O-N 3.04Å; G191-N311 PolarHBondContact O-ND2 2.95Å; G191-N311 PolarHBondContact O-OD1 3.35Å
192	G	37.4	Very low	33.3	Very low	30 Å²	30	82.4 Å²	82.4	31%	0.309	52%	0.524	S	S	.	.			trans	60.1	49.5	170.8	0	0	0	0	0	114.2	R190 R290	R190-G192 PolarHBondContact O-N 3.26Å; G192-R290 PolarHBondContact O-NH2 3.35Å
193	F	46	Very low	33.5	Very low	17 Å²	17	84.8 Å²	84.8	8%	0.075	52%	0.522	C	S	.	.			trans	-100.8	39.6	-179.5	-53.9	-46.1	0	0	0	113.3	R144 R190 G191 W285	R144-F193 HydrophobicContact CG-CE1 4.23Å; R144-F193 HydrophobicContact CG-CZ 4.1Å; R144-F193 VanDerWaalsContact NH2-CG 3.33Å; R190-F193 HydrophobicContact CG-CD2 4.11Å; R190-F193 PolarHBondContact NH2-O 3.18Å; G191-F193 VanDerWaalsContact O-CD1 3.32Å; G191-F193 WeakPolarHBondContact O-CD1 3.44Å; G191-F193 WeakPolarHBondContact O-CE1 3.35Å; G191-F193 PolarHBondContact O-N 3.04Å; F193-W285 HydrophobicContact CE1-CH2 4.21Å; F193-W285 HydrophobicContact CZ-CH2 4.25Å
194	V	38.6	Very low	33.6	Very low	66 Å²	66	84.9 Å²	84.9	40%	0.4	52%	0.522	S	S	.	.	S	Bend	trans	-133.9	121.7	145.2	177.9	0	0	0	0	103.9	Y149 N196	Y149-V194 HydrophobicContact CE1-CG1 4.41Å; Y149-V194 HydrophobicContact CE1-CG2 4.27Å; V194-N196 VanDerWaalsContact C-N 3.31Å; V194-N196 PolarHBondContact O-N 3.37Å
195	L	37.5	Very low	33.9	Very low	13 Å²	13	80.8 Å²	80.8	7%	0.068	52%	0.516	C	S	.	.			trans	-73.8	92.3	168.5	-80.1	171.4	0	0	0	108	F197 E279 W308	L195-F197 HydrophobicContact CB-CZ 4.48Å; L195-F197 WeakPolarHBondContact O-CD2 3.3Å; L195-F197 PolarHBondContact O-N 3.18Å; L195-E279 WeakPolarHBondContact CD1-OE1 3.21Å; L195-E279 WeakPolarHBondContact CG-OE1 3.49Å; L195-W308 HydrophobicContact CD1-CH2 4.4Å; L195-W308 HydrophobicContact CD2-CH2 3.93Å; L195-W308 HydrophobicContact CD2-CZ3 3.93Å
196	N	33.4	Very low	34.2	Very low	89 Å²	89	86.5 Å²	86.5	48%	0.476	53%	0.53	S	S	.	.			trans	-66.7	104.1	171.2	-130.5	73.5	0	0	0	108.4	V194 H198 N334	V194-N196 VanDerWaalsContact C-N 3.31Å; V194-N196 PolarHBondContact O-N 3.37Å; N196-H198 VanDerWaalsContact C-N 3.32Å; N196-H198 PolarHBondContact ND2-O 2.87Å; N196-N334 PolarHBondContact O-ND2 2.99Å
197	F	40	Very low	34.4	Very low	50 Å²	50	91.2 Å²	91.2	22%	0.219	54%	0.539	C	S	.	.			trans	-67.6	-38.6	171.9	-62.4	-72.5	0	0	0	111	L195 A199 D271 M302	L195-F197 HydrophobicContact CB-CZ 4.48Å; L195-F197 WeakPolarHBondContact O-CD2 3.3Å; L195-F197 PolarHBondContact O-N 3.18Å; F197-A199 PolarHBondContact O-N 2.9Å; F197-D271 HydrophobicContact CD2-CB 4.42Å; F197-D271 HydrophobicContact CE2-CB 4.43Å; F197-D271 WeakPolarHBondContact CE2-OD2 3.41Å; F197-M302 HydrophobicContact CE1-SD 4.03Å; F197-M302 HydrophobicContact CE2-CE 4.42Å; F197-M302 HydrophobicContact CE2-SD 4.4Å; F197-M302 HydrophobicContact CZ-CE 3.9Å; F197-M302 HydrophobicContact CZ-SD 3.46Å; F197-M302 WeakPolarHBondContact CZ-SD 3.42Å
198	H	29.3	Very low	34.7	Very low	129 Å²	129	97.6 Å²	97.6	60%	0.597	55%	0.552	S	S	*	*	S	Bend	trans	-66.2	130.1	173.3	-64.3	108.6	0	0	0	111.1	N196	N196-H198 VanDerWaalsContact C-N 3.32Å; N196-H198 PolarHBondContact ND2-O 2.87Å
199	A	31.6	Very low	34.8	Very low	52 Å²	52	98.2 Å²	98.2	43%	0.43	56%	0.559	S	S	.	*			trans	-59.9	138.4	175.4	0	0	0	0	0	110.8	F197 A201 I335	F197-A199 PolarHBondContact O-N 2.9Å; A199-A201 PolarHBondContact O-N 3.33Å; A199-A201 VanDerWaalsContact O-N 3.12Å; A199-I335 HydrophobicContact CB-CD1 3.6Å; A199-I335 HydrophobicContact CB-CG1 4.04Å
200	D	28.7	Very low	34.5	Very low	138 Å²	138	97.9 Å²	97.9	74%	0.738	57%	0.572	S	S	*	*			trans	-74.4	98.7	170.5	-151.8	-10.3	0	0	0	107.7	E202	D200-E202 PolarHBondContact O-N 3.33Å
201	A	41.7	Very low	34	Very low	94 Å²	94	99.9 Å²	99.9	78%	0.777	59%	0.589	S	S	*	*			trans	-97.3	42	-158.6	0	0	0	0	0	114	A199	A199-A201 PolarHBondContact O-N 3.33Å; A199-A201 VanDerWaalsContact O-N 3.12Å
202	E	31.2	Very low	33.6	Very low	159 Å²	159	107.5 Å²	107.5	74%	0.743	62%	0.62	S	S	*	*			trans	-107	158.9	-179.9	-97.6	-74.9	99.8	0	0	113.2	D200 A204	D200-E202 PolarHBondContact O-N 3.33Å; E202-A204 PolarHBondContact O-N 3.06Å
203	L	33.3	Very low	33.3	Very low	157 Å²	157	115.7 Å²	115.7	82%	0.822	64%	0.641	S	S	*	*			trans	62.9	30.2	176.3	-66	171.8	0	0	0	117.9	G205	L203-G205 VanDerWaalsContact C-N 3.25Å; L203-G205 PolarHBondContact O-N 2.85Å
204	A	29.1	Very low	32.7	Very low	100 Å²	100	125.9 Å²	125.9	83%	0.826	68%	0.679	S	S	*	*			trans	-71.1	84.1	147.7	0	0	0	0	0	109.6	E202 K206	E202-A204 PolarHBondContact O-N 3.06Å; A204-K206 PolarHBondContact O-N 2.9Å
205	G	29	Very low	32.2	Very low	67 Å²	67	126.7 Å²	126.7	69%	0.691	70%	0.701	S	S	*	*			trans	-57.8	119.9	-168	0	0	0	0	0	115.2	L203 K207	L203-G205 VanDerWaalsContact C-N 3.25Å; L203-G205 PolarHBondContact O-N 2.85Å; G205-K207 PolarHBondContact O-N 2.89Å
206	K	34.6	Very low	32	Very low	211 Å²	211	131.4 Å²	131.4	92%	0.917	74%	0.735	S	S	*	*			trans	-57.5	116.2	171.8	-70.2	172.1	-179.8	166	0	110.8	A204	A204-K206 PolarHBondContact O-N 2.9Å
207	K	32.3	Very low	32	Very low	203 Å²	203	134.4 Å²	134.4	88%	0.883	75%	0.75	S	S	*	*			trans	-119	122.6	159.4	-82	-170.3	172.4	-178.8	0	110.8	G205	G205-K207 PolarHBondContact O-N 2.89Å
208	K	34.3	Very low	31.9	Very low	212 Å²	212	140.6 Å²	140.6	92%	0.922	78%	0.784	S	S	*	*			trans	-62.2	151.5	165.2	-73.3	-179.7	173.2	179.6	0	109.3
209	G	28.9	Very low	31.9	Very low	84 Å²	84	137.2 Å²	137.2	87%	0.866	79%	0.785	S	S	*	*			trans	-71.4	169.5	-174.5	0	0	0	0	0	115
210	G	27.4	Very low	32	Very low	74 Å²	74	141.1 Å²	141.1	76%	0.763	81%	0.809	S	S	*	*			trans	-148.3	145.6	170.3	0	0	0	0	0	109.5
211	L	31.4	Very low	32.2	Very low	143 Å²	143	143.4 Å²	143.4	75%	0.749	82%	0.817	S	S	*	*			trans	-82.4	141.7	-172.5	-69	65.4	0	0	0	111.1
212	F	30.7	Very low	31.8	Very low	169 Å²	169	148.1 Å²	148.1	74%	0.741	82%	0.82	S	S	*	*				160.4	145.6	105.8	-94.1	-65.1	0	0	0	116.5
213	R	31.1	Very low	32.1	Very low	202 Å²	202	148.3 Å²	148.3	76%	0.762	83%	0.826	S	S	*	*			trans	75.7	118.1	151	-75.9	-170.4	-65.7	-104.1	6.8	121.7
214	R	32	Very low	32.1	Very low	232 Å²	232	152 Å²	152	88%	0.875	83%	0.829	S	S	*	*			trans	69	78.9	137.5	-63.7	-176.8	177.4	178.1	-1.2	118.4
215	G	29.7	Very low	32	Very low	83 Å²	83	156.4 Å²	156.4	86%	0.856	83%	0.829	S	S	*	*				-94.4	145.6	127.9	0	0	0	0	0	109
216	S	32.6	Very low	32.1	Very low	111 Å²	111	158.7 Å²	158.7	78%	0.776	84%	0.835	S	S	*	*			trans	-141.3	164.2	176.8	-167.4	0	0	0	0	110.3
217	L	34.3	Very low	31.7	Very low	152 Å²	152	156.8 Å²	156.8	80%	0.796	83%	0.829	S	S	*	*			trans	77.4	132.3	174.5	-55.1	172.2	0	0	0	117.2
218	L	37.7	Very low	31.6	Very low	180 Å²	180	153.1 Å²	153.1	94%	0.942	83%	0.829	S	S	*	*			trans	65.1	131.8	166.2	-51.7	172.8	0	0	0	117.1
219	G	28.6	Very low	31.3	Very low	59 Å²	59	152 Å²	152	61%	0.608	82%	0.824	S	S	*	*			cis	159.6	129.7	-9.4	0	0	0	0	0	112.1
220	S	32.8	Very low	31.3	Very low	134 Å²	134	153 Å²	153	94%	0.937	82%	0.818	S	S	*	*			trans	56.6	134.3	-178.1	54.7	0	0	0	0	115.7
221	M	34.7	Very low	31.4	Very low	185 Å²	185	154.3 Å²	154.3	91%	0.911	82%	0.815	S	S	*	*			cis	-154.3	159.6	49.3	-176.1	159.7	63.3	0	0	111.8
222	K	33	Very low	31.3	Very low	193 Å²	193	154.4 Å²	154.4	84%	0.839	82%	0.815	S	S	*	*			trans	-88.2	143.6	177.5	-72.1	174.6	174.1	169.4	0	112
223	L	36.7	Very low	31.2	Very low	164 Å²	164	151.2 Å²	151.2	86%	0.859	81%	0.814	S	S	*	*			trans	-175.4	105.6	134.9	-97.9	151.8	0	0	0	108.4
224	R	32.7	Very low	31.1	Very low	233 Å²	233	145.4 Å²	145.4	88%	0.879	80%	0.804	S	S	*	*				31.5	107.8	108.3	-83.5	-174.1	167.2	-176	-4	113.5
225	K	27.3	Very low	30.9	Very low	193 Å²	193	143.1 Å²	143.1	84%	0.839	80%	0.801	S	S	*	*				72.9	101.4	67.7	-173.1	-166.4	173.8	178.3	0	113.4
226	S	31.2	Very low	30.8	Very low	115 Å²	115	150.5 Å²	150.5	80%	0.804	80%	0.802	S	S	*	*			trans	-154.5	134.9	130.7	45.2	0	0	0	0	109.9
227	E	26.7	Very low	30.7	Very low	171 Å²	171	149.7 Å²	149.7	80%	0.799	80%	0.797	S	S	*	*			trans	-88.2	157.1	158.4	-60.2	172.5	105.8	0	0	108
228	S	29.3	Very low	30.5	Very low	126 Å²	126	147.9 Å²	147.9	88%	0.881	80%	0.797	S	S	*	*			trans	-163.7	152.7	139.8	-103.7	0	0	0	0	110.7
229	K	29.5	Very low	30.3	Very low	189 Å²	189	145.7 Å²	145.7	82%	0.822	79%	0.791	S	S	*	*			trans	-119.9	178.2	178.7	-66.3	179.3	178.8	172.2	0	109.7
230	S	29	Very low	30.2	Very low	105 Å²	105	154 Å²	154	73%	0.734	80%	0.804	S	S	*	*			trans	81	128.9	163.8	92.2	0	0	0	0	114
231	S	29	Very low	30.1	Very low	102 Å²	102	152.3 Å²	152.3	71%	0.713	79%	0.792	S	S	*	*				91.2	154.2	67.1	97.4	0	0	0	0	110.7
232	I	28.7	Very low	29.7	Very low	145 Å²	145	150.4 Å²	150.4	74%	0.744	79%	0.786	S	S	*	*			cis	-165.4	167.2	2.5	-174.6	161.8	0	0	0	107.9
233	S	28.6	Very low	29.4	Very low	101 Å²	101	145.4 Å²	145.4	71%	0.706	78%	0.78	S	S	*	*			trans	70.9	159.9	158.5	-91.2	0	0	0	0	118
234	S	30.3	Very low	29	Very low	81 Å²	81	142 Å²	142	57%	0.566	78%	0.775	S	S	*	*			cis	-161.5	145	-16.4	-114.5	0	0	0	0	113.4
235	K	27.4	Very low	28.7	Very low	184 Å²	184	139.2 Å²	139.2	80%	0.8	78%	0.775	S	S	*	*			trans	53.9	129.9	136.8	-64.4	171	179.9	171.5	0	122.9
236	R	27.7	Very low	28.7	Very low	237 Å²	237	134.2 Å²	134.2	89%	0.894	76%	0.764	S	S	*	*			trans	74.5	151.3	139.4	-80.1	-165.2	166.6	-150.9	-1.4	118.4
237	S	30.4	Very low	28.4	Very low	95 Å²	95	140 Å²	140	66%	0.664	77%	0.768	S	S	*	*			cis	-170.1	170.1	-8.5	42.8	0	0	0	0	113.1
238	S	29.2	Very low	28.4	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	77%	0.771	S	S	*	*			trans	78.3	149.7	166.4	-111.6	0	0	0	0	115.9
239	V	32.8	Very low	28.4	Very low	134 Å²	134	138.9 Å²	138.9	81%	0.812	76%	0.764	S	S	*	*			cis	-131.7	168.3	7.6	-168	0	0	0	0	110.1
240	R	27.6	Very low	28.3	Very low	233 Å²	233	135.1 Å²	135.1	88%	0.879	76%	0.762	S	S	*	*			trans	-96.8	164.7	170.1	-64.4	-179.8	173.3	168.6	-3.3	110.6
241	S	31.2	Very low	28.8	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	76%	0.763	S	S	*	*				-171.8	173.2	50.7	-96.8	0	0	0	0	107.6
242	D	25.3	Very low	28.7	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	77%	0.771	S	S	*	*			cis	-153.2	165.2	-12.5	-115.3	-66.4	0	0	0	104.3
243	A	27.8	Very low	29.7	Very low	87 Å²	87	135.9 Å²	135.9	72%	0.719	77%	0.773	S	S	*	*			cis	-159.9	-168.6	35.3	0	0	0	0	0	112.1
244	A	27.3	Very low	29.8	Very low	92 Å²	92	138.6 Å²	138.6	76%	0.76	78%	0.78	S	S	*	*			trans	75.7	90.7	162.1	0	0	0	0	0	119.9
245	M	27.1	Very low	29.7	Very low	176 Å²	176	139.7 Å²	139.7	87%	0.867	79%	0.787	S	S	*	*			trans	63.2	102.5	138.9	-59.4	-56.9	-178.3	0	0	122.3
246	S	26.2	Very low	29.7	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	79%	0.79	S	S	*	*				37.4	118.3	120.8	-59.8	0	0	0	0	120.5
247	R	26.4	Very low	30.2	Very low	235 Å²	235	133.5 Å²	133.5	89%	0.887	78%	0.784	S	S	*	*				63.5	143.7	84.9	-61.7	169	-173	171.5	3.2	113.6
248	I	26.6	Very low	29.9	Very low	168 Å²	168	134.3 Å²	134.3	86%	0.862	79%	0.79	S	S	*	*			cis	-137.9	168.2	30.2	-57.3	164	0	0	0	110.2
249	S	28.3	Very low	30.5	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	80%	0.795	S	S	*	*			trans	-97.5	-176.3	176.7	-165.7	0	0	0	0	113.2
250	S	27.3	Very low	30.2	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	79%	0.794	S	S	*	*			trans	86.5	117.6	171.5	-53.7	0	0	0	0	117
251	S	39	Very low	30.8	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	79%	0.792	S	S	*	*			trans	-38.4	129.2	161.7	49.7	0	0	0	0	115.4
252	D	28.1	Very low	30.7	Very low	164 Å²	164	133.2 Å²	133.2	88%	0.877	79%	0.793	S	S	*	*				-156.8	175.7	109.7	-103.8	-28.8	0	0	0	110.7	N254	D252-N254 PolarHBondContact O-N 2.59Å
253	A	48.3	Very low	31.4	Very low	96 Å²	96	133.7 Å²	133.7	79%	0.793	80%	0.796	S	S	*	*	S	Bend	trans	-70.4	111.9	-159.6	0	0	0	0	0	115.8
254	N	30.9	Very low	31.7	Very low	159 Å²	159	133.9 Å²	133.9	85%	0.85	79%	0.791	S	S	*	*			trans	-168.5	176.4	140.3	-115.8	-22.7	0	0	0	113.6	D252	D252-N254 PolarHBondContact O-N 2.59Å
255	S	28.1	Very low	32.3	Very low	103 Å²	103	137.5 Å²	137.5	72%	0.72	80%	0.798	S	S	*	*			trans	86.8	106.1	160.5	-55.4	0	0	0	0	119.4
256	T	27.5	Very low	32.8	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	80%	0.797	S	S	*	*				28.7	125.5	118.4	-45.2	0	0	0	0	119.9
257	I	39.2	Very low	33.1	Very low	152 Å²	152	138.9 Å²	138.9	78%	0.779	80%	0.8	S	S	*	*			trans	-30.9	130.4	166.3	-56.5	161.6	0	0	0	114.7
258	S	24.5	Very low	33.7	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	79%	0.791	S	S	*	*			trans	-133.2	147	147.1	-176.5	0	0	0	0	109.2
259	F	41.1	Very low	34.3	Very low	203 Å²	203	130.7 Å²	130.7	89%	0.89	79%	0.785	S	S	*	*			trans	-72.6	151.5	168.5	-76.3	-107.7	0	0	0	110.1
260	G	27.3	Very low	34.9	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	78%	0.78	S	S	*	*			trans	-175.4	104.4	178.6	0	0	0	0	0	110.2
261	D	39.5	Very low	36	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	76%	0.759	S	S	*	*			trans	-84.3	129.2	-174.7	176.5	34.5	0	0	0	112
262	V	29.2	Very low	36.8	Very low	119 Å²	119	132.4 Å²	132.4	72%	0.721	76%	0.759	S	S	*	*			trans	-152.9	117.4	166	-175.3	0	0	0	0	109.1	C264	V262-C264 PolarHBondContact O-N 3.12Å
263	D	39.8	Very low	38.7	Very low	156 Å²	156	126.4 Å²	126.4	83%	0.834	73%	0.728	S	S	*	*			trans	-54.1	126.7	172.8	-105.4	-39.1	0	0	0	112.4
264	C	33.2	Very low	40	Very low	91 Å²	91	125.7 Å²	125.7	62%	0.615	71%	0.711	S	S	*	*			trans	-136.3	85	178.9	-72.8	0	0	0	0	109.6	V262 F266	V262-C264 PolarHBondContact O-N 3.12Å; C264-F266 PolarHBondContact O-N 3.1Å
265	D	41.6	Very low	42.4	Very low	169 Å²	169	120.8 Å²	120.8	90%	0.904	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	134.3	178.7	-105.5	-45.6	0	0	0	112.4
266	F	37.8	Very low	45.2	Very low	192 Å²	192	120.7 Å²	120.7	84%	0.842	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.7	48.4	172.5	-148.5	-97	0	0	0	118	C264	C264-F266 PolarHBondContact O-N 3.1Å
267	C	31.1	Very low	48	Very low	101 Å²	101	114.2 Å²	114.2	68%	0.682	65%	0.648	S	S	*	*			trans	-68.6	129.3	144.8	-76.1	0	0	0	0	109.6	V269	C267-V269 PolarHBondContact O-N 3.02Å
268	P	39.6	Very low	50.4	Low	109 Å²	109	108.3 Å²	108.3	71%	0.708	62%	0.619	S	S	*	*			trans	-66.4	123.9	170.1	28.5	-32.3	0	0	0	108.2	E270	P268-E270 PolarHBondContact O-N 3.4Å
269	V	38.9	Very low	53.6	Low	122 Å²	122	103 Å²	103	74%	0.739	58%	0.582	S	S	*	*			trans	-50.4	103.2	-167.9	-178.4	0	0	0	0	111.8	C267 D271	C267-V269 PolarHBondContact O-N 3.02Å; V269-D271 PolarHBondContact O-N 2.95Å
270	E	41.5	Very low	56.2	Low	136 Å²	136	94.6 Å²	94.6	64%	0.636	55%	0.547	S	S	*	.			trans	-61.9	117.8	149.5	-68.1	-158	140.4	0	0	105.9	P268 H272	P268-E270 PolarHBondContact O-N 3.4Å; E270-H272 PolarHBondContact O-N 3.49Å; E270-H272 IonicContact OE2-CE1 3.3Å
271	D	48.9	Very low	59.5	Low	60 Å²	60	91 Å²	91	32%	0.321	51%	0.51	S	S	.	.			trans	-58.8	91.5	165.1	-101	-25.2	0	0	0	106.8	F197 V269 V273 M302	F197-D271 HydrophobicContact CD2-CB 4.42Å; F197-D271 HydrophobicContact CE2-CB 4.43Å; F197-D271 WeakPolarHBondContact CE2-OD2 3.41Å; V269-D271 PolarHBondContact O-N 2.95Å; D271-V273 HydrophobicContact CB-CG2 4.43Å; D271-V273 PolarHBondContact O-N 2.91Å; D271-M302 WeakPolarHBondContact OD2-CE 3.47Å
272	H	57.1	Low	62.3	Low	164 Å²	164	84.4 Å²	84.4	76%	0.759	47%	0.474	S	S	*	.			trans	-67.3	80.4	172.2	-84.7	-47.4	0	0	0	108.1	E270 D274	E270-H272 PolarHBondContact O-N 3.49Å; E270-H272 IonicContact OE2-CE1 3.3Å; H272-D274 VanDerWaalsContact C-N 3.35Å; H272-D274 PolarHBondContact O-N 3.38Å
273	V	67.9	Low	65.6	Low	38 Å²	38	78.8 Å²	78.8	23%	0.23	44%	0.44	C	S	.	.			trans	-65.4	98.3	173.3	-178.4	0	0	0	0	107.1	Y149 D271 T277	Y149-V273 HydrophobicContact CD1-CG1 4.05Å; Y149-V273 HydrophobicContact CD2-CG1 3.38Å; Y149-V273 HydrophobicContact CE1-CG1 4.35Å; Y149-V273 HydrophobicContact CE2-CG1 3.76Å; Y149-V273 HydrophobicContact CG-CG1 3.56Å; D271-V273 HydrophobicContact CB-CG2 4.43Å; D271-V273 PolarHBondContact O-N 2.91Å; V273-T277 HydrophobicContact CG1-CG2 3.92Å
274	D	76.1	Confident	68.4	Low	81 Å²	81	73.8 Å²	73.8	43%	0.433	41%	0.412	S	S	.	.			trans	-50.8	145.9	-177.3	167.6	58.1	0	0	0	111.9	H272 T276 T277	H272-D274 VanDerWaalsContact C-N 3.35Å; H272-D274 PolarHBondContact O-N 3.38Å; D274-T276 PolarHBondContact O-N 3.05Å; D274-T276 VanDerWaalsContact O-N 3.13Å; D274-T276 WeakPolarHBondContact OD2-CA 3.31Å; D274-T276 WeakPolarHBondContact OD2-CB 3.48Å; D274-T276 WeakPolarHBondContact OD2-CG2 3.35Å; D274-T276 PolarHBondContact OD2-N 2.9Å; D274-T276 PolarHBondContact OD2-OG1 3.34Å; D274-T277 PolarHBondContact N-OG1 3.11Å; D274-T277 WeakPolarHBondContact O-CB 3.3Å; D274-T277 PolarHBondContact O-N 3.19Å; D274-T277 PolarHBondContact O-OG1 3.07Å
275	A	80.1	Confident	71.5	Confident	56 Å²	56	69.7 Å²	69.7	46%	0.463	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.3	-177.5	0	0	0	0	0	113.6	P148 Y149 G150	P148-A275 CarbonylContact C-O 3.5Å; P148-A275 VanDerWaalsContact CB-O 3.24Å; P148-A275 WeakPolarHBondContact CB-O 3.48Å; Y149-A275 PolarHBondContact N-O 3.38Å; G150-A275 PolarHBondContact N-O 2.78Å
276	T	86.8	Confident	74.1	Confident	101 Å²	101	67.4 Å²	67.4	62%	0.62	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.1	176.4	77.9	0	0	0	0	113.5	D274 T278	D274-T276 PolarHBondContact O-N 3.05Å; D274-T276 VanDerWaalsContact O-N 3.13Å; D274-T276 WeakPolarHBondContact OD2-CA 3.31Å; D274-T276 WeakPolarHBondContact OD2-CB 3.48Å; D274-T276 WeakPolarHBondContact OD2-CG2 3.35Å; D274-T276 PolarHBondContact OD2-N 2.9Å; D274-T276 PolarHBondContact OD2-OG1 3.34Å; T276-T278 PolarHBondContact O-N 3.12Å
277	T	87.1	Confident	76.7	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.018	35%	0.346	C	S	.	.			trans	-58.4	136.7	-174	-56.6	0	0	0	0	111.4	P148 Y149 V273 D274 R298 S299 N300	P148-T277 CarbonylContact C-O 3.55Å; P148-T277 VanDerWaalsContact CA-O 3.24Å; P148-T277 WeakPolarHBondContact CA-O 3.41Å; Y149-T277 HydrophobicContact CD2-CG2 4.01Å; Y149-T277 VanDerWaalsContact CD2-O 3.24Å; Y149-T277 WeakPolarHBondContact CD2-O 3.29Å; Y149-T277 HydrophobicContact CE2-CG2 4.25Å; Y149-T277 PolarHBondContact N-O 3.5Å; V273-T277 HydrophobicContact CG1-CG2 3.92Å; D274-T277 PolarHBondContact N-OG1 3.11Å; D274-T277 WeakPolarHBondContact O-CB 3.3Å; D274-T277 PolarHBondContact O-N 3.19Å; D274-T277 PolarHBondContact O-OG1 3.07Å; T277-R298 HydrophobicContact CG2-CB 4.11Å; T277-R298 HydrophobicContact CG2-CG 4.46Å; T277-S299 WeakPolarHBondContact CA-OG 3.31Å; T277-N300 HydrophobicContact CG2-CB 4.23Å
278	T	89.6	Confident	79.5	Confident	28 Å²	28	57.8 Å²	57.8	17%	0.172	32%	0.316	C	S	.	.			trans	-115.1	158.1	170	53.6	0	0	0	0	111	S146 P148 T276 R298 S299	S146-T278 WeakPolarHBondContact OG-CA 3.24Å; P148-T278 HydrophobicContact CG-CG2 4.13Å; T276-T278 PolarHBondContact O-N 3.12Å; T278-R298 WeakPolarHBondContact O-CA 3.46Å; T278-R298 WeakPolarHBondContact O-CB 3.24Å; T278-S299 PolarHBondContact N-OG 3.33Å; T278-S299 PolarHBondContact O-N 2.74Å; T278-S299 VanDerWaalsContact O-N 3.14Å; T278-S299 PolarHBondContact OG1-OG 3.03Å
279	E	90.9	Very high	82	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121	173.4	-179.8	-162.5	-140.5	0	0	109.2	R144 S146 Y149 L195 R290 S296 E297	R144-E279 IonicContact NH1-OE2 2.85Å; R144-E279 PolarHBondContact NH1-OE2 2.84Å; S146-E279 PolarHBondContact N-O 3.22Å; S146-E279 PolarHBondContact OG-N 3.17Å; Y149-E279 HydrophobicContact CE2-CB 4.28Å; L195-E279 WeakPolarHBondContact CD1-OE1 3.21Å; L195-E279 WeakPolarHBondContact CG-OE1 3.49Å; E279-R290 IonicContact OE1-CZ 3.55Å; E279-R290 IonicContact OE1-NH1 3.44Å; E279-R290 PolarHBondContact OE1-NH1 2.95Å; E279-R290 IonicContact OE1-NH2 2.73Å; E279-R290 PolarHBondContact OE1-NH2 3.28Å; E279-R290 IonicContact OE2-NH1 2.84Å; E279-R290 IonicContact OE2-NH2 3.92Å; E279-S296 PolarHBondContact OE1-OG 3.38Å; E279-E297 WeakPolarHBondContact CA-O 3.38Å
280	T	96.3	Very high	84.7	Confident	28 Å²	28	51.2 Å²	51.2	17%	0.172	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.8	169.8	-58	0	0	0	0	109.6	V143 R144 M282 S296 E297	V143-T280 HydrophobicContact CG1-CG2 3.82Å; R144-T280 CarbonylContact O-C 3.3Å; R144-T280 VanDerWaalsContact O-CA 3.32Å; R144-T280 WeakPolarHBondContact O-CA 3.45Å; T280-M282 HydrophobicContact CG2-CE 3.74Å; T280-M282 HydrophobicContact CG2-CG 4.21Å; T280-S296 CarbonylContact O-C 3.49Å; T280-S296 WeakPolarHBondContact O-CA 3.38Å; T280-E297 PolarHBondContact N-O 3.5Å; T280-E297 PolarHBondContact O-N 2.84Å
281	Y	97.5	Very high	87.3	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.4	172.5	175.3	-98.6	0	0	0	110.7	V143 R144 E284 W285 R290 N291 V295 W308	V143-Y281 CarbonylContact C-O 3.57Å; V143-Y281 VanDerWaalsContact CA-O 3.24Å; V143-Y281 WeakPolarHBondContact CA-O 3.48Å; R144-Y281 PolarHBondContact N-O 2.8Å; R144-Y281 PolarHBondContact O-N 3.35Å; Y281-E284 PolarHBondContact OH-N 2.89Å; Y281-E284 PolarHBondContact OH-O 3.02Å; Y281-W285 AromaticContact CD1-CE2 3.76Å; Y281-W285 HydrophobicContact CD1-CH2 4.41Å; Y281-W285 AromaticContact CD1-CZ2 3.51Å; Y281-W285 HydrophobicContact CD1-CZ2 3.51Å; Y281-W285 AromaticContact CD1-NE1 3.78Å; Y281-W285 AromaticContact CE1-CE2 3.82Å; Y281-W285 HydrophobicContact CE1-CZ2 4.02Å; Y281-W285 AromaticContact CE1-NE1 3.63Å; Y281-R290 HydrophobicContact CD1-CG 3.87Å; Y281-R290 VanDerWaalsContact CD2-CD 3.45Å; Y281-R290 HydrophobicContact CD2-CG 4.24Å; Y281-R290 HydrophobicContact CE1-CB 4.09Å; Y281-R290 HydrophobicContact CE1-CG 3.75Å; Y281-R290 HydrophobicContact CE2-CB 4.28Å; Y281-R290 HydrophobicContact CE2-CG 4.15Å; Y281-R290 HydrophobicContact CG-CG 4.09Å; Y281-N291 PolarHBondContact OH-O 3.44Å; Y281-V295 CarbonylContact C-O 3.57Å; Y281-V295 WeakPolarHBondContact CA-O 3.4Å; Y281-V295 VanDerWaalsContact CD2-O 3.22Å; Y281-V295 WeakPolarHBondContact CD2-O 3.32Å; Y281-W308 HydrophobicContact CD2-CZ2 4.08Å; Y281-W308 AromaticContact CE2-CD1 3.97Å; Y281-W308 AromaticContact CE2-CD2 3.99Å; Y281-W308 HydrophobicContact CE2-CD2 3.99Å; Y281-W308 AromaticContact CE2-CE2 3.57Å; Y281-W308 HydrophobicContact CE2-CG 4.21Å; Y281-W308 AromaticContact CE2-CZ2 3.94Å; Y281-W308 HydrophobicContact CE2-CZ2 3.94Å; Y281-W308 AromaticContact CE2-NE1 3.59Å
282	M	98.4	Very high	89.6	Confident	18 Å²	18	44.9 Å²	44.9	9%	0.089	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	110.7	-180	-46.8	179.7	-155.9	0	0	108.6	V143 T280 G294 V295 A367 R371	V143-M282 HydrophobicContact CG1-CG 4.1Å; V143-M282 HydrophobicContact CG2-CB 4.13Å; V143-M282 HydrophobicContact CG2-CG 3.98Å; T280-M282 HydrophobicContact CG2-CE 3.74Å; T280-M282 HydrophobicContact CG2-CG 4.21Å; M282-G294 CarbonylContact O-C 3.58Å; M282-G294 WeakPolarHBondContact O-CA 3.34Å; M282-V295 PolarHBondContact N-O 3.23Å; M282-V295 PolarHBondContact O-N 3.18Å; M282-A367 HydrophobicContact CB-CB 3.73Å; M282-R371 PolarHBondContact SD-NE 2.81Å; M282-R371 PolarHBondContact SD-NH2 2.89Å
283	G	98.1	Very high	91.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.9	-152.2	-177.7	0	0	0	0	0	114.4	Y141 G142 W285	Y141-G283 WeakPolarHBondContact CA-O 3.27Å; G142-G283 PolarHBondContact N-O 3.1Å; G142-G283 VanDerWaalsContact N-O 3.09Å; G142-G283 PolarHBondContact O-N 3.24Å; G283-W285 VanDerWaalsContact O-CD1 3.32Å
284	E	98.4	Very high	93	Very high	51 Å²	51	38.7 Å²	38.7	24%	0.238	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	143.5	-176.1	-72	173.6	-107.4	0	0	114	G140 Y141 Y281 N291 F293	G140-E284 CarbonylContact O-C 3.45Å; Y141-E284 HydrophobicContact CD1-CG 3.82Å; Y141-E284 HydrophobicContact CE1-CG 3.34Å; Y281-E284 PolarHBondContact OH-N 2.89Å; Y281-E284 PolarHBondContact OH-O 3.02Å; E284-N291 WeakPolarHBondContact CB-O 3.32Å; E284-N291 PolarHBondContact O-N 3.49Å; E284-F293 PolarHBondContact N-O 2.92Å; E284-F293 PolarHBondContact OE1-N 3.05Å
285	W	97.3	Very high	94.1	Very high	6 Å²	6	35.1 Å²	35.1	2%	0.023	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.9	-179.3	-66.2	80.7	0	0	0	110.1	Y129 R138 H139 G140 G142 R144 F193 Y281 G283 K289 R290	Y129-W285 HydrophobicContact CD2-CZ2 4.13Å; Y129-W285 AromaticContact CE2-CD1 3.94Å; Y129-W285 HydrophobicContact CE2-CD2 4.07Å; Y129-W285 AromaticContact CE2-CE2 3.64Å; Y129-W285 HydrophobicContact CE2-CG 4.24Å; Y129-W285 HydrophobicContact CE2-CZ2 4.06Å; Y129-W285 AromaticContact CE2-NE1 3.56Å; R138-W285 HydrophobicContact CB-CD2 4.42Å; R138-W285 HydrophobicContact CB-CE3 4.15Å; H139-W285 CarbonylContact C-O 3.49Å; H139-W285 WeakPolarHBondContact CA-O 3.31Å; G140-W285 PolarHBondContact N-O 3.4Å; G140-W285 WeakPolarHBondContact O-CB 3.48Å; G140-W285 PolarHBondContact O-N 2.88Å; G142-W285 PolarHBondContact O-NE1 2.75Å; R144-W285 HydrophobicContact CB-CH2 3.79Å; R144-W285 HydrophobicContact CB-CZ2 3.47Å; R144-W285 VanDerWaalsContact CB-CZ2 3.47Å; R144-W285 HydrophobicContact CG-CH2 4.07Å; R144-W285 HydrophobicContact CG-CZ2 4.27Å; F193-W285 HydrophobicContact CE1-CH2 4.21Å; F193-W285 HydrophobicContact CZ-CH2 4.25Å; Y281-W285 AromaticContact CD1-CE2 3.76Å; Y281-W285 HydrophobicContact CD1-CH2 4.41Å; Y281-W285 AromaticContact CD1-CZ2 3.51Å; Y281-W285 HydrophobicContact CD1-CZ2 3.51Å; Y281-W285 AromaticContact CD1-NE1 3.78Å; Y281-W285 AromaticContact CE1-CE2 3.82Å; Y281-W285 HydrophobicContact CE1-CZ2 4.02Å; Y281-W285 AromaticContact CE1-NE1 3.63Å; G283-W285 VanDerWaalsContact O-CD1 3.32Å; W285-K289 WeakPolarHBondContact CA-O 3.28Å; W285-R290 HydrophobicContact CH2-CG 4.17Å; W285-R290 HydrophobicContact CZ2-CG 4.47Å; W285-R290 HydrophobicContact CZ3-CG 4.32Å
286	K	96.3	Very high	94.9	Very high	120 Å²	120	32.6 Å²	32.6	52%	0.522	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	113.8	171.1	-171.8	168.8	-177.4	169.5	0	109.2	K289 N291	K286-K289 PolarHBondContact N-O 3.48Å; K286-K289 PolarHBondContact O-N 3.18Å; K286-N291 HydrophobicContact CB-CB 3.9Å
287	N	91.8	Very high	95.2	Very high	83 Å²	83	31.7 Å²	31.7	44%	0.444	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	62.3	175.3	-55.2	15.3	0	0	0	111	M137 R138 H139 K289	M137-N287 HydrophobicContact SD-CB 3.88Å; R138-N287 PolarHBondContact O-N 3.39Å; H139-N287 PolarHBondContact ND1-OD1 3.3Å; N287-K289 PolarHBondContact O-N 2.88Å; N287-K289 VanDerWaalsContact O-N 3.14Å
288	D	90.7	Very high	95.5	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.043	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	-1	-178.3	-71.1	-28	0	0	0	117.4	M137 R138 R167	M137-D288 WeakPolarHBondContact CA-OD1 3.33Å; R138-D288 IonicContact CZ-OD1 3.83Å; R138-D288 PolarHBondContact N-OD1 2.86Å; R138-D288 IonicContact NE-OD1 2.8Å; R138-D288 IonicContact NH1-OD1 3.82Å; R138-D288 PolarHBondContact NH2-O 2.96Å; R138-D288 VanDerWaalsContact NH2-O 3.16Å; R138-D288 IonicContact NH2-OD1 3.07Å; R138-D288 PolarHBondContact O-N 3.3Å; R167-D288 IonicContact CZ-OD2 3.99Å; R167-D288 IonicContact NE-OD2 3.87Å; R167-D288 PolarHBondContact NE-OD2 2.96Å; R167-D288 IonicContact NH2-OD2 3.55Å; R167-D288 PolarHBondContact NH2-OD2 3.22Å
289	K	92.6	Very high	95.6	Very high	93 Å²	93	34.4 Å²	34.4	40%	0.404	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.7	-175.4	-55.8	173	-172.3	175.5	0	112.3	W285 K286 N287 N291 N310 N311	W285-K289 WeakPolarHBondContact CA-O 3.28Å; K286-K289 PolarHBondContact N-O 3.48Å; K286-K289 PolarHBondContact O-N 3.18Å; N287-K289 PolarHBondContact O-N 2.88Å; N287-K289 VanDerWaalsContact O-N 3.14Å; K289-N291 PolarHBondContact O-N 2.97Å; K289-N310 HydrophobicContact CD-CB 4.22Å; K289-N311 VanDerWaalsContact CA-OD1 3.27Å; K289-N311 WeakPolarHBondContact CA-OD1 3.41Å
290	R	94.9	Very high	95.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	130.9	165.8	-54.2	-174.9	-99.8	-161.2	-9.2	109.3	G192 E279 Y281 W285 S296 W308 N310 N311	G192-R290 PolarHBondContact O-NH2 3.35Å; E279-R290 IonicContact OE1-CZ 3.55Å; E279-R290 IonicContact OE1-NH1 3.44Å; E279-R290 PolarHBondContact OE1-NH1 2.95Å; E279-R290 IonicContact OE1-NH2 2.73Å; E279-R290 PolarHBondContact OE1-NH2 3.28Å; E279-R290 IonicContact OE2-NH1 2.84Å; E279-R290 IonicContact OE2-NH2 3.92Å; Y281-R290 HydrophobicContact CD1-CG 3.87Å; Y281-R290 VanDerWaalsContact CD2-CD 3.45Å; Y281-R290 HydrophobicContact CD2-CG 4.24Å; Y281-R290 HydrophobicContact CE1-CB 4.09Å; Y281-R290 HydrophobicContact CE1-CG 3.75Å; Y281-R290 HydrophobicContact CE2-CB 4.28Å; Y281-R290 HydrophobicContact CE2-CG 4.15Å; Y281-R290 HydrophobicContact CG-CG 4.09Å; W285-R290 HydrophobicContact CH2-CG 4.17Å; W285-R290 HydrophobicContact CZ2-CG 4.47Å; W285-R290 HydrophobicContact CZ3-CG 4.32Å; R290-S296 PolarHBondContact NH1-OG 3.45Å; R290-W308 HydrophobicContact CB-CB 4.4Å; R290-W308 HydrophobicContact CB-CD2 4.29Å; R290-W308 HydrophobicContact CB-CE3 4Å; R290-W308 HydrophobicContact CB-CG 4.48Å; R290-N310 PolarHBondContact O-N 2.69Å; R290-N311 PolarHBondContact N-OD1 2.92Å; R290-N311 PolarHBondContact O-N 3.41Å
291	N	96.1	Very high	95	Very high	42 Å²	42	38 Å²	38	23%	0.225	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-177.3	-176.1	-136.5	-65.8	0	0	0	109.7	Y281 E284 K286 K289 F293 W308	Y281-N291 PolarHBondContact OH-O 3.44Å; E284-N291 WeakPolarHBondContact CB-O 3.32Å; E284-N291 PolarHBondContact O-N 3.49Å; K286-N291 HydrophobicContact CB-CB 3.9Å; K289-N291 PolarHBondContact O-N 2.97Å; N291-F293 PolarHBondContact O-N 2.89Å; N291-W308 CarbonylContact C-O 3.56Å; N291-W308 VanDerWaalsContact C-O 3.3Å; N291-W308 WeakPolarHBondContact CA-O 3.44Å
292	G	97.8	Very high	94.7	Very high	21 Å²	21	38.4 Å²	38.4	22%	0.216	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.2	-133.6	173.3	0	0	0	0	0	113.2	E307 W308	G292-E307 CarbonylContact O-C 3.55Å; G292-E307 WeakPolarHBondContact O-CA 3.46Å; G292-W308 PolarHBondContact N-O 3.36Å; G292-W308 VanDerWaalsContact N-O 3.12Å; G292-W308 PolarHBondContact O-N 3.06Å
293	F	98.6	Very high	94.5	Very high	72 Å²	72	40.4 Å²	40.4	32%	0.316	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	149.9	173.3	-66	-85.1	0	0	0	112.2	E284 N291 E307 A359 A366	E284-F293 PolarHBondContact N-O 2.92Å; E284-F293 PolarHBondContact OE1-N 3.05Å; N291-F293 PolarHBondContact O-N 2.89Å; F293-E307 HydrophobicContact CD1-CG 3.9Å; F293-E307 HydrophobicContact CE1-CG 3.44Å; F293-E307 VanDerWaalsContact CE1-CG 3.44Å; F293-E307 HydrophobicContact CZ-CG 4.02Å; F293-A359 HydrophobicContact CE1-CB 4.26Å; F293-A366 HydrophobicContact CB-CB 3.78Å; F293-A366 VanDerWaalsContact O-CB 3.32Å; F293-A366 WeakPolarHBondContact O-CB 3.29Å
294	G	98.1	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	160	171.9	0	0	0	0	0	115.4	M282 G306 W308	M282-G294 CarbonylContact O-C 3.58Å; M282-G294 WeakPolarHBondContact O-CA 3.34Å; G294-G306 PolarHBondContact N-O 2.96Å; G294-G306 VanDerWaalsContact N-O 3.1Å; G294-G306 PolarHBondContact O-N 3.01Å; G294-W308 PolarHBondContact O-NE1 3.37Å
295	V	98.4	Very high	94.4	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.042	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.6	175.6	178.9	0	0	0	0	109.3	Y281 M282 K303 Y304 E305 A363 A367	Y281-V295 CarbonylContact C-O 3.57Å; Y281-V295 WeakPolarHBondContact CA-O 3.4Å; Y281-V295 VanDerWaalsContact CD2-O 3.22Å; Y281-V295 WeakPolarHBondContact CD2-O 3.32Å; M282-V295 PolarHBondContact N-O 3.23Å; M282-V295 PolarHBondContact O-N 3.18Å; V295-K303 HydrophobicContact CG1-CG 4.2Å; V295-Y304 CarbonylContact C-O 3.58Å; V295-Y304 WeakPolarHBondContact CA-O 3.4Å; V295-E305 HydrophobicContact CG1-CG 4.19Å; V295-E305 HydrophobicContact CG2-CG 4.07Å; V295-A363 HydrophobicContact CG2-CB 4.06Å; V295-A367 HydrophobicContact CB-CB 4.1Å; V295-A367 HydrophobicContact CG2-CB 3.78Å
296	S	96.3	Very high	94.4	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.3	166.8	-161.8	0	0	0	0	108.9	E279 T280 R290 K303 Y304	E279-S296 PolarHBondContact OE1-OG 3.38Å; T280-S296 CarbonylContact O-C 3.49Å; T280-S296 WeakPolarHBondContact O-CA 3.38Å; R290-S296 PolarHBondContact NH1-OG 3.45Å; S296-K303 CarbonylContact O-C 3.54Å; S296-K303 WeakPolarHBondContact O-CA 3.17Å; S296-Y304 PolarHBondContact N-O 3.18Å; S296-Y304 PolarHBondContact O-N 2.84Å
297	E	95.1	Very high	94.5	Very high	81 Å²	81	35.7 Å²	35.7	38%	0.379	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.5	-172	-177.6	168.2	-150.2	0	0	109	E279 T280	E279-E297 WeakPolarHBondContact CA-O 3.38Å; T280-E297 PolarHBondContact N-O 3.5Å; T280-E297 PolarHBondContact O-N 2.84Å
298	R	91.6	Very high	94.7	Very high	12 Å²	12	32 Å²	32	5%	0.045	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	150.2	177.7	-67.1	-173.4	-178	167.9	-2.9	111.3	T277 T278 N300 G301 M302	T277-R298 HydrophobicContact CG2-CB 4.11Å; T277-R298 HydrophobicContact CG2-CG 4.46Å; T278-R298 WeakPolarHBondContact O-CA 3.46Å; T278-R298 WeakPolarHBondContact O-CB 3.24Å; R298-N300 WeakPolarHBondContact CB-OD1 3.33Å; R298-N300 PolarHBondContact O-N 2.9Å; R298-N300 VanDerWaalsContact O-N 3.14Å; R298-G301 PolarHBondContact O-N 3.37Å; R298-M302 HydrophobicContact CB-CB 4.37Å; R298-M302 PolarHBondContact N-O 3.44Å; R298-M302 PolarHBondContact NH1-SD 2.94Å
299	S	92	Very high	95	Very high	77 Å²	77	32.8 Å²	32.8	54%	0.538	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.9	174.5	61.3	0	0	0	0	114.1	T277 T278 G301	T277-S299 WeakPolarHBondContact CA-OG 3.31Å; T278-S299 PolarHBondContact N-OG 3.33Å; T278-S299 PolarHBondContact O-N 2.74Å; T278-S299 VanDerWaalsContact O-N 3.14Å; T278-S299 PolarHBondContact OG1-OG 3.03Å; S299-G301 VanDerWaalsContact C-N 3.27Å
300	N	87.1	Confident	95	Very high	52 Å²	52	33 Å²	33	28%	0.278	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	12.8	168.6	82	-25.2	0	0	0	113.7	T277 R298 M302 P322	T277-N300 HydrophobicContact CG2-CB 4.23Å; R298-N300 WeakPolarHBondContact CB-OD1 3.33Å; R298-N300 PolarHBondContact O-N 2.9Å; R298-N300 VanDerWaalsContact O-N 3.14Å; N300-M302 VanDerWaalsContact C-N 3.29Å; N300-M302 PolarHBondContact O-N 3.09Å; N300-M302 WeakPolarHBondContact OD1-CB 3.39Å; N300-M302 PolarHBondContact OD1-N 2.87Å; N300-P322 WeakPolarHBondContact O-CB 3.34Å; N300-P322 WeakPolarHBondContact O-CG 3.32Å
301	G	87.6	Confident	94.8	Very high	52 Å²	52	34 Å²	34	54%	0.536	20%	0.196	S	C	.	.	S	Bend	trans	83.8	-12.4	177.8	0	0	0	0	0	115.4	R298 S299 K303	R298-G301 PolarHBondContact O-N 3.37Å; S299-G301 VanDerWaalsContact C-N 3.27Å; G301-K303 PolarHBondContact O-N 3.44Å
302	M	90.8	Very high	94.6	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.044	20%	0.202	C	C	.	.			trans	-68.4	132.6	177.2	-172.5	-167.1	-79.6	0	0	111.4	F197 D271 R298 N300 V320 F321 P322	F197-M302 HydrophobicContact CE1-SD 4.03Å; F197-M302 HydrophobicContact CE2-CE 4.42Å; F197-M302 HydrophobicContact CE2-SD 4.4Å; F197-M302 HydrophobicContact CZ-CE 3.9Å; F197-M302 HydrophobicContact CZ-SD 3.46Å; F197-M302 WeakPolarHBondContact CZ-SD 3.42Å; D271-M302 WeakPolarHBondContact OD2-CE 3.47Å; R298-M302 HydrophobicContact CB-CB 4.37Å; R298-M302 PolarHBondContact N-O 3.44Å; R298-M302 PolarHBondContact NH1-SD 2.94Å; N300-M302 VanDerWaalsContact C-N 3.29Å; N300-M302 PolarHBondContact O-N 3.09Å; N300-M302 WeakPolarHBondContact OD1-CB 3.39Å; N300-M302 PolarHBondContact OD1-N 2.87Å; M302-V320 CarbonylContact C-O 3.48Å; M302-V320 WeakPolarHBondContact CA-O 3.29Å; M302-V320 WeakPolarHBondContact CG-O 3.49Å; M302-F321 HydrophobicContact CE-CD1 3.83Å; M302-F321 HydrophobicContact CE-CE1 4.16Å; M302-P322 HydrophobicContact CB-CG 4.13Å
303	K	95.5	Very high	94.4	Very high	60 Å²	60	35.5 Å²	35.5	26%	0.261	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144	-175.9	-165.6	-172.2	-177.6	-158.2	0	111.1	V295 S296 G301 E305 T319 V320	V295-K303 HydrophobicContact CG1-CG 4.2Å; S296-K303 CarbonylContact O-C 3.54Å; S296-K303 WeakPolarHBondContact O-CA 3.17Å; G301-K303 PolarHBondContact O-N 3.44Å; K303-E305 HydrophobicContact CD-CG 4.15Å; K303-E305 WeakPolarHBondContact CE-OE1 3.49Å; K303-E305 WeakPolarHBondContact CE-OE2 3.2Å; K303-E305 HydrophobicContact CG-CG 4.24Å; K303-E305 IonicContact NZ-OE1 3.69Å; K303-E305 PolarHBondContact NZ-OE1 2.91Å; K303-E305 IonicContact NZ-OE2 3.68Å; K303-E305 PolarHBondContact NZ-OE2 3.13Å; K303-T319 CarbonylContact O-C 3.53Å; K303-T319 WeakPolarHBondContact O-CA 3.31Å; K303-V320 HydrophobicContact CB-CB 4.35Å; K303-V320 PolarHBondContact N-O 2.79Å; K303-V320 PolarHBondContact O-N 3.41Å
304	Y	96.3	Very high	94.2	Very high	6 Å²	6	35.2 Å²	35.2	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.9	166.9	175.2	-99.1	0	0	0	110.7	V295 S296 E307 W308 R313 H314 C318 T319 Y331	V295-Y304 CarbonylContact C-O 3.58Å; V295-Y304 WeakPolarHBondContact CA-O 3.4Å; S296-Y304 PolarHBondContact N-O 3.18Å; S296-Y304 PolarHBondContact O-N 2.84Å; Y304-E307 PolarHBondContact OH-O 3.27Å; Y304-W308 AromaticContact CD1-CE2 3.69Å; Y304-W308 HydrophobicContact CD1-CH2 4.29Å; Y304-W308 AromaticContact CD1-CZ2 3.42Å; Y304-W308 HydrophobicContact CD1-CZ2 3.42Å; Y304-W308 VanDerWaalsContact CD1-CZ2 3.42Å; Y304-W308 AromaticContact CD1-NE1 3.75Å; Y304-W308 HydrophobicContact CE1-CD2 4.48Å; Y304-W308 AromaticContact CE1-CE2 3.72Å; Y304-W308 AromaticContact CE1-CZ2 3.91Å; Y304-W308 HydrophobicContact CE1-CZ2 3.91Å; Y304-W308 AromaticContact CE1-NE1 3.59Å; Y304-W308 HydrophobicContact CG-CZ2 4.45Å; Y304-R313 HydrophobicContact CD1-CG 4.14Å; Y304-R313 HydrophobicContact CD2-CG 4.35Å; Y304-R313 HydrophobicContact CE1-CB 4.17Å; Y304-R313 HydrophobicContact CE1-CG 3.93Å; Y304-R313 HydrophobicContact CE2-CB 4.31Å; Y304-R313 HydrophobicContact CE2-CG 4.18Å; Y304-R313 HydrophobicContact CG-CG 4.31Å; Y304-H314 PolarHBondContact OH-O 3.02Å; Y304-C318 WeakPolarHBondContact CA-O 3.4Å; Y304-C318 WeakPolarHBondContact CD2-O 3.31Å; Y304-T319 WeakPolarHBondContact CD2-OG1 3.3Å; Y304-Y331 AromaticContact CE2-CD2 3.92Å; Y304-Y331 HydrophobicContact CE2-CD2 3.92Å; Y304-Y331 AromaticContact CE2-CE2 3.64Å; Y304-Y331 HydrophobicContact CE2-CE2 3.64Å
305	E	97.9	Very high	94.1	Very high	17 Å²	17	35.4 Å²	35.4	8%	0.079	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	114.8	178.6	-54.5	-172.9	89.6	0	0	108.7	V295 K303 G317 C318 I360 A363 Q364	V295-E305 HydrophobicContact CG1-CG 4.19Å; V295-E305 HydrophobicContact CG2-CG 4.07Å; K303-E305 HydrophobicContact CD-CG 4.15Å; K303-E305 WeakPolarHBondContact CE-OE1 3.49Å; K303-E305 WeakPolarHBondContact CE-OE2 3.2Å; K303-E305 HydrophobicContact CG-CG 4.24Å; K303-E305 IonicContact NZ-OE1 3.69Å; K303-E305 PolarHBondContact NZ-OE1 2.91Å; K303-E305 IonicContact NZ-OE2 3.68Å; K303-E305 PolarHBondContact NZ-OE2 3.13Å; E305-G317 CarbonylContact O-C 3.59Å; E305-G317 WeakPolarHBondContact O-CA 3.25Å; E305-C318 PolarHBondContact N-O 3.39Å; E305-C318 PolarHBondContact O-N 3.17Å; E305-I360 HydrophobicContact CB-CG1 4.2Å; E305-I360 HydrophobicContact CB-CG2 4.2Å; E305-A363 HydrophobicContact CB-CB 4.22Å; E305-Q364 VanDerWaalsContact OE1-CG 3.24Å; E305-Q364 WeakPolarHBondContact OE1-CG 3.47Å; E305-Q364 PolarHBondContact OE1-NE2 2.97Å
306	G	97.3	Very high	94.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-156.9	179.4	0	0	0	0	0	115.1	G294 Y316 A363	G294-G306 PolarHBondContact N-O 2.96Å; G294-G306 VanDerWaalsContact N-O 3.1Å; G294-G306 PolarHBondContact O-N 3.01Å; G306-Y316 VanDerWaalsContact CA-O 3.32Å; G306-Y316 WeakPolarHBondContact CA-O 3.38Å; G306-A363 VanDerWaalsContact N-CB 3.35Å
307	E	98.1	Very high	94.1	Very high	54 Å²	54	37 Å²	37	25%	0.252	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	145.8	179	-69.7	171.3	-108.5	0	0	113	G292 F293 Y304 H314 G315 Y316	G292-E307 CarbonylContact O-C 3.55Å; G292-E307 WeakPolarHBondContact O-CA 3.46Å; F293-E307 HydrophobicContact CD1-CG 3.9Å; F293-E307 HydrophobicContact CE1-CG 3.44Å; F293-E307 VanDerWaalsContact CE1-CG 3.44Å; F293-E307 HydrophobicContact CZ-CG 4.02Å; Y304-E307 PolarHBondContact OH-O 3.27Å; E307-H314 PolarHBondContact O-N 2.97Å; E307-G315 VanDerWaalsContact CD-CA 3.46Å; E307-G315 WeakPolarHBondContact OE1-CA 3.41Å; E307-G315 WeakPolarHBondContact OE2-CA 3.28Å; E307-Y316 PolarHBondContact N-O 2.73Å; E307-Y316 PolarHBondContact OE1-N 3.47Å
308	W	96.9	Very high	94.1	Very high	6 Å²	6	33.2 Å²	33.2	2%	0.023	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.4	-178.6	-68.9	83	0	0	0	111.3	L195 Y281 R290 N291 G292 G294 Y304 R313	L195-W308 HydrophobicContact CD1-CH2 4.4Å; L195-W308 HydrophobicContact CD2-CH2 3.93Å; L195-W308 HydrophobicContact CD2-CZ3 3.93Å; Y281-W308 HydrophobicContact CD2-CZ2 4.08Å; Y281-W308 AromaticContact CE2-CD1 3.97Å; Y281-W308 AromaticContact CE2-CD2 3.99Å; Y281-W308 HydrophobicContact CE2-CD2 3.99Å; Y281-W308 AromaticContact CE2-CE2 3.57Å; Y281-W308 HydrophobicContact CE2-CG 4.21Å; Y281-W308 AromaticContact CE2-CZ2 3.94Å; Y281-W308 HydrophobicContact CE2-CZ2 3.94Å; Y281-W308 AromaticContact CE2-NE1 3.59Å; R290-W308 HydrophobicContact CB-CB 4.4Å; R290-W308 HydrophobicContact CB-CD2 4.29Å; R290-W308 HydrophobicContact CB-CE3 4Å; R290-W308 HydrophobicContact CB-CG 4.48Å; N291-W308 CarbonylContact C-O 3.56Å; N291-W308 VanDerWaalsContact C-O 3.3Å; N291-W308 WeakPolarHBondContact CA-O 3.44Å; G292-W308 PolarHBondContact N-O 3.36Å; G292-W308 VanDerWaalsContact N-O 3.12Å; G292-W308 PolarHBondContact O-N 3.06Å; G294-W308 PolarHBondContact O-NE1 3.37Å; Y304-W308 AromaticContact CD1-CE2 3.69Å; Y304-W308 HydrophobicContact CD1-CH2 4.29Å; Y304-W308 AromaticContact CD1-CZ2 3.42Å; Y304-W308 HydrophobicContact CD1-CZ2 3.42Å; Y304-W308 VanDerWaalsContact CD1-CZ2 3.42Å; Y304-W308 AromaticContact CD1-NE1 3.75Å; Y304-W308 HydrophobicContact CE1-CD2 4.48Å; Y304-W308 AromaticContact CE1-CE2 3.72Å; Y304-W308 AromaticContact CE1-CZ2 3.91Å; Y304-W308 HydrophobicContact CE1-CZ2 3.91Å; Y304-W308 AromaticContact CE1-NE1 3.59Å; Y304-W308 HydrophobicContact CG-CZ2 4.45Å; W308-R313 HydrophobicContact CH2-CG 4.38Å; W308-R313 HydrophobicContact CZ3-CG 4.42Å
309	A	96.3	Very high	94.2	Very high	25 Å²	25	32.8 Å²	32.8	21%	0.207	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	119.1	171.4	0	0	0	0	0	110.1	N311 K312 H314	A309-N311 PolarHBondContact O-N 3.43Å; A309-K312 PolarHBondContact N-O 2.79Å; A309-K312 PolarHBondContact O-N 2.82Å; A309-H314 HydrophobicContact CB-CB 3.8Å
310	N	92.6	Very high	94.3	Very high	97 Å²	97	30.5 Å²	30.5	52%	0.519	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	53.1	175.1	-64.3	-57.1	0	0	0	113.7	K289 R290 K312	K289-N310 HydrophobicContact CD-CB 4.22Å; R290-N310 PolarHBondContact O-N 2.69Å; N310-K312 PolarHBondContact O-N 3.13Å
311	N	91.6	Very high	94.5	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	67	1.7	-174.8	-60.4	-39.2	0	0	0	116.7	G191 K289 R290 A309	G191-N311 PolarHBondContact O-ND2 2.95Å; G191-N311 PolarHBondContact O-OD1 3.35Å; K289-N311 VanDerWaalsContact CA-OD1 3.27Å; K289-N311 WeakPolarHBondContact CA-OD1 3.41Å; R290-N311 PolarHBondContact N-OD1 2.92Å; R290-N311 PolarHBondContact O-N 3.41Å; A309-N311 PolarHBondContact O-N 3.43Å
312	K	91.6	Very high	94.6	Very high	80 Å²	80	31.1 Å²	31.1	35%	0.348	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.5	179.8	-57	-170.5	-178.7	-169	0	111.6	A309 N310 H314 N333 N334	A309-K312 PolarHBondContact N-O 2.79Å; A309-K312 PolarHBondContact O-N 2.82Å; N310-K312 PolarHBondContact O-N 3.13Å; K312-H314 PolarHBondContact O-N 3.4Å; K312-N333 HydrophobicContact CD-CB 4.15Å; K312-N334 WeakPolarHBondContact CA-OD1 3.35Å; K312-N334 WeakPolarHBondContact CB-OD1 3.18Å
313	R	94	Very high	94.5	Very high	14 Å²	14	36.6 Å²	36.6	5%	0.053	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.2	170	-53.4	-175.5	-69.5	-169.1	0.8	108.8	Y304 W308 T319 Y331 N333 N334	Y304-R313 HydrophobicContact CD1-CG 4.14Å; Y304-R313 HydrophobicContact CD2-CG 4.35Å; Y304-R313 HydrophobicContact CE1-CB 4.17Å; Y304-R313 HydrophobicContact CE1-CG 3.93Å; Y304-R313 HydrophobicContact CE2-CB 4.31Å; Y304-R313 HydrophobicContact CE2-CG 4.18Å; Y304-R313 HydrophobicContact CG-CG 4.31Å; W308-R313 HydrophobicContact CH2-CG 4.38Å; W308-R313 HydrophobicContact CZ3-CG 4.42Å; R313-T319 PolarHBondContact NH1-OG1 2.9Å; R313-Y331 HydrophobicContact CB-CD1 4.14Å; R313-Y331 HydrophobicContact CB-CG 4.2Å; R313-N333 PolarHBondContact O-N 3.23Å; R313-N334 PolarHBondContact N-OD1 2.96Å; R313-N334 PolarHBondContact NE-O 3.4Å; R313-N334 PolarHBondContact NH2-O 2.9Å; R313-N334 PolarHBondContact O-N 3.42Å
314	H	94.3	Very high	94.1	Very high	66 Å²	66	36.1 Å²	36.1	31%	0.306	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	-178.9	-174.7	-159	78.9	0	0	0	110.6	Y304 E307 A309 K312 Y316 Y331	Y304-H314 PolarHBondContact OH-O 3.02Å; E307-H314 PolarHBondContact O-N 2.97Å; A309-H314 HydrophobicContact CB-CB 3.8Å; K312-H314 PolarHBondContact O-N 3.4Å; H314-Y316 PolarHBondContact O-N 2.85Å; H314-Y331 CarbonylContact C-O 3.46Å
315	G	95.8	Very high	93.8	Very high	4 Å²	4	37.8 Å²	37.8	4%	0.041	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.8	-131.3	165.6	0	0	0	0	0	112.9	E307 K330 Y331	E307-G315 VanDerWaalsContact CD-CA 3.46Å; E307-G315 WeakPolarHBondContact OE1-CA 3.41Å; E307-G315 WeakPolarHBondContact OE2-CA 3.28Å; G315-K330 CarbonylContact O-C 3.54Å; G315-K330 VanDerWaalsContact O-CA 3.25Å; G315-K330 WeakPolarHBondContact O-CA 3.29Å; G315-K330 WeakPolarHBondContact O-CG 3.47Å; G315-Y331 PolarHBondContact N-O 2.79Å; G315-Y331 VanDerWaalsContact N-O 3.16Å; G315-Y331 PolarHBondContact O-N 2.85Å
316	Y	97.1	Very high	93.5	Very high	44 Å²	44	42.4 Å²	42.4	17%	0.173	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	154	171.6	-65	-91.1	0	0	0	112	G306 E307 H314 G329 K330 T352 K355 V356 A359	G306-Y316 VanDerWaalsContact CA-O 3.32Å; G306-Y316 WeakPolarHBondContact CA-O 3.38Å; E307-Y316 PolarHBondContact N-O 2.73Å; E307-Y316 PolarHBondContact OE1-N 3.47Å; H314-Y316 PolarHBondContact O-N 2.85Å; Y316-G329 WeakPolarHBondContact CA-O 3.35Å; Y316-K330 HydrophobicContact CD1-CB 4.09Å; Y316-K330 HydrophobicContact CD1-CG 4.32Å; Y316-K330 HydrophobicContact CE1-CB 3.86Å; Y316-K330 HydrophobicContact CE1-CD 4.47Å; Y316-K330 HydrophobicContact CE1-CG 4.06Å; Y316-K330 HydrophobicContact CE2-CD 4.47Å; Y316-K330 HydrophobicContact CE2-CG 4.41Å; Y316-T352 HydrophobicContact CE1-CG2 4.46Å; Y316-K355 WeakPolarHBondContact CB-O 3.46Å; Y316-K355 HydrophobicContact CD1-CB 3.72Å; Y316-K355 HydrophobicContact CD2-CB 3.99Å; Y316-K355 HydrophobicContact CD2-CD 4.49Å; Y316-K355 HydrophobicContact CE1-CB 3.81Å; Y316-K355 HydrophobicContact CE1-CD 4.01Å; Y316-K355 HydrophobicContact CE2-CB 4.08Å; Y316-K355 HydrophobicContact CE2-CD 3.77Å; Y316-K355 HydrophobicContact CG-CB 3.81Å; Y316-K355 VanDerWaalsContact CZ-CD 3.49Å; Y316-K355 WeakPolarHBondContact OH-CD 3.36Å; Y316-V356 HydrophobicContact CD1-CG2 4.17Å; Y316-A359 WeakPolarHBondContact O-CB 3.25Å
317	G	96.3	Very high	93.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.3	-177.4	174.6	0	0	0	0	0	114.3	E305 G329	E305-G317 CarbonylContact O-C 3.59Å; E305-G317 WeakPolarHBondContact O-CA 3.25Å; G317-G329 PolarHBondContact N-O 2.99Å; G317-G329 VanDerWaalsContact N-O 3.07Å; G317-G329 PolarHBondContact O-N 3.22Å
318	C	95.6	Very high	93	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.014	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.7	176.5	178.9	0	0	0	0	109.8	Y304 E305 E327 E328 V356 I360	Y304-C318 WeakPolarHBondContact CA-O 3.4Å; Y304-C318 WeakPolarHBondContact CD2-O 3.31Å; E305-C318 PolarHBondContact N-O 3.39Å; E305-C318 PolarHBondContact O-N 3.17Å; C318-E327 CarbonylContact C-O 3.6Å; C318-E327 WeakPolarHBondContact CA-O 3.36Å; C318-E328 HydrophobicContact CB-CG 3.74Å; C318-E328 WeakPolarHBondContact SG-CG 3.19Å; C318-E328 PolarHBondContact SG-OE1 2.76Å; C318-V356 HydrophobicContact CB-CG1 4.41Å; C318-I360 HydrophobicContact CB-CD1 3.76Å; C318-I360 HydrophobicContact CB-CG1 4.13Å
319	T	93.9	Very high	92.8	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.5	161.1	-48.1	0	0	0	0	108.7	K303 Y304 R313 F321 K326 E327 Y331	K303-T319 CarbonylContact O-C 3.53Å; K303-T319 WeakPolarHBondContact O-CA 3.31Å; Y304-T319 WeakPolarHBondContact CD2-OG1 3.3Å; R313-T319 PolarHBondContact NH1-OG1 2.9Å; T319-F321 HydrophobicContact CG2-CD2 4.34Å; T319-F321 HydrophobicContact CG2-CE2 3.95Å; T319-F321 HydrophobicContact CG2-CZ 4.06Å; T319-K326 CarbonylContact O-C 3.48Å; T319-K326 VanDerWaalsContact O-CA 3.31Å; T319-K326 WeakPolarHBondContact O-CA 3.29Å; T319-E327 PolarHBondContact N-O 3.28Å; T319-E327 PolarHBondContact O-N 3.07Å; T319-Y331 PolarHBondContact OG1-OH 3.37Å
320	V	93.9	Very high	92.7	Very high	29 Å²	29	47.2 Å²	47.2	18%	0.176	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.3	168	-168	0	0	0	0	107.9	M302 K303 S325 K326	M302-V320 CarbonylContact C-O 3.48Å; M302-V320 WeakPolarHBondContact CA-O 3.29Å; M302-V320 WeakPolarHBondContact CG-O 3.49Å; K303-V320 HydrophobicContact CB-CB 4.35Å; K303-V320 PolarHBondContact N-O 2.79Å; K303-V320 PolarHBondContact O-N 3.41Å; V320-S325 WeakPolarHBondContact CA-O 3.48Å; V320-K326 HydrophobicContact CG1-CG 4.34Å; V320-K326 HydrophobicContact CG2-CD 4.35Å; V320-K326 HydrophobicContact CG2-CG 4.26Å
321	F	91.7	Very high	92.7	Very high	44 Å²	44	42.6 Å²	42.6	19%	0.193	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-95.3	165	-179.9	-69.5	-95.4	0	0	0	111.3	M302 T319 D323 G324 S325 E327	M302-F321 HydrophobicContact CE-CD1 3.83Å; M302-F321 HydrophobicContact CE-CE1 4.16Å; T319-F321 HydrophobicContact CG2-CD2 4.34Å; T319-F321 HydrophobicContact CG2-CE2 3.95Å; T319-F321 HydrophobicContact CG2-CZ 4.06Å; F321-D323 WeakPolarHBondContact CB-OD1 3.2Å; F321-D323 PolarHBondContact O-N 3.13Å; F321-G324 PolarHBondContact O-N 2.86Å; F321-S325 WeakPolarHBondContact CB-OG 3.45Å; F321-S325 PolarHBondContact N-O 3.41Å; F321-E327 HydrophobicContact CE2-CB 3.77Å
322	P	89.8	Confident	92.8	Very high	73 Å²	73	47.6 Å²	47.6	47%	0.474	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.9	179.9	-25.7	36.8	0	0	0	114.6	N300 M302 G324	N300-P322 WeakPolarHBondContact O-CB 3.34Å; N300-P322 WeakPolarHBondContact O-CG 3.32Å; M302-P322 HydrophobicContact CB-CG 4.13Å; P322-G324 PolarHBondContact O-N 2.81Å
323	D	88.6	Confident	92.7	Very high	124 Å²	124	47.9 Å²	47.9	66%	0.663	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	0.3	174.6	72.9	-25.6	0	0	0	113.6	F321 S325	F321-D323 WeakPolarHBondContact CB-OD1 3.2Å; F321-D323 PolarHBondContact O-N 3.13Å; D323-S325 VanDerWaalsContact CG-OG 3.31Å; D323-S325 PolarHBondContact O-N 3.45Å; D323-S325 WeakPolarHBondContact OD1-CB 3.42Å; D323-S325 PolarHBondContact OD1-N 2.88Å; D323-S325 PolarHBondContact OD1-OG 3.47Å; D323-S325 VanDerWaalsContact OD2-CB 3.26Å; D323-S325 WeakPolarHBondContact OD2-CB 3.37Å; D323-S325 PolarHBondContact OD2-OG 2.93Å
324	G	87.5	Confident	92.5	Very high	50 Å²	50	48 Å²	48	52%	0.515	25%	0.252	S	S	.	.	S	Bend	trans	76.5	2.9	-174.2	0	0	0	0	0	114.5	F321 P322	F321-G324 PolarHBondContact O-N 2.86Å; P322-G324 PolarHBondContact O-N 2.81Å
325	S	90	Very high	92.2	Very high	42 Å²	42	48.8 Å²	48.8	29%	0.294	26%	0.258	S	S	.	.			trans	-68.2	158.8	171.4	75	0	0	0	0	111.1	V320 F321 D323	V320-S325 WeakPolarHBondContact CA-O 3.48Å; F321-S325 WeakPolarHBondContact CB-OG 3.45Å; F321-S325 PolarHBondContact N-O 3.41Å; D323-S325 VanDerWaalsContact CG-OG 3.31Å; D323-S325 PolarHBondContact O-N 3.45Å; D323-S325 WeakPolarHBondContact OD1-CB 3.42Å; D323-S325 PolarHBondContact OD1-N 2.88Å; D323-S325 PolarHBondContact OD1-OG 3.47Å; D323-S325 VanDerWaalsContact OD2-CB 3.26Å; D323-S325 WeakPolarHBondContact OD2-CB 3.37Å; D323-S325 PolarHBondContact OD2-OG 2.93Å
326	K	90.9	Very high	91.9	Very high	113 Å²	113	50.9 Å²	50.9	49%	0.491	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.5	-175	-63.7	-164.9	178.7	-169.9	0	112.1	T319 V320 E328	T319-K326 CarbonylContact O-C 3.48Å; T319-K326 VanDerWaalsContact O-CA 3.31Å; T319-K326 WeakPolarHBondContact O-CA 3.29Å; V320-K326 HydrophobicContact CG1-CG 4.34Å; V320-K326 HydrophobicContact CG2-CD 4.35Å; V320-K326 HydrophobicContact CG2-CG 4.26Å; K326-E328 HydrophobicContact CB-CG 4.46Å; K326-E328 VanDerWaalsContact CD-OE1 3.28Å; K326-E328 WeakPolarHBondContact CD-OE1 3.44Å
327	E	90.9	Very high	91.5	Very high	56 Å²	56	53.3 Å²	53.3	26%	0.262	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	104.6	171.2	-176.3	-171.2	92.4	0	0	108.7	C318 T319 F321 Y331 L336	C318-E327 CarbonylContact C-O 3.6Å; C318-E327 WeakPolarHBondContact CA-O 3.36Å; T319-E327 PolarHBondContact N-O 3.28Å; T319-E327 PolarHBondContact O-N 3.07Å; F321-E327 HydrophobicContact CE2-CB 3.77Å; E327-Y331 WeakPolarHBondContact CG-OH 3.26Å; E327-Y331 PolarHBondContact O-OH 3.38Å; E327-Y331 VanDerWaalsContact O-OH 3.08Å; E327-Y331 WeakPolarHBondContact OE1-CE1 3.47Å; E327-Y331 PolarHBondContact OE1-OH 3.25Å; E327-L336 HydrophobicContact CG-CB 4.4Å; E327-L336 HydrophobicContact CG-CD1 4.17Å; E327-L336 HydrophobicContact CG-CD2 3.5Å; E327-L336 HydrophobicContact CG-CG 4.22Å
328	E	93.1	Very high	90.9	Very high	44 Å²	44	60.2 Å²	60.2	21%	0.206	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136	-174.5	-74.3	170.7	-170.8	0	0	110.5	C318 K326 G339 I340 V356	C318-E328 HydrophobicContact CB-CG 3.74Å; C318-E328 WeakPolarHBondContact SG-CG 3.19Å; C318-E328 PolarHBondContact SG-OE1 2.76Å; K326-E328 HydrophobicContact CB-CG 4.46Å; K326-E328 VanDerWaalsContact CD-OE1 3.28Å; K326-E328 WeakPolarHBondContact CD-OE1 3.44Å; E328-G339 CarbonylContact O-C 3.46Å; E328-G339 VanDerWaalsContact O-CA 3.29Å; E328-G339 WeakPolarHBondContact O-CA 3.18Å; E328-I340 HydrophobicContact CB-CB 4.43Å; E328-I340 HydrophobicContact CB-CD1 4.22Å; E328-I340 PolarHBondContact O-N 3.16Å; E328-V356 HydrophobicContact CB-CG1 4.22Å; E328-V356 HydrophobicContact CG-CG1 4.25Å
329	G	92.5	Very high	90.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.2	-148.4	174.2	0	0	0	0	0	114.8	Y316 G317 R338	Y316-G329 WeakPolarHBondContact CA-O 3.35Å; G317-G329 PolarHBondContact N-O 2.99Å; G317-G329 VanDerWaalsContact N-O 3.07Å; G317-G329 PolarHBondContact O-N 3.22Å; G329-R338 CarbonylContact C-O 3.52Å; G329-R338 VanDerWaalsContact CA-O 3.3Å; G329-R338 WeakPolarHBondContact CA-O 3.45Å
330	K	94.6	Very high	89.4	Confident	87 Å²	87	63.1 Å²	63.1	38%	0.378	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.7	-179.7	-160.6	-175	179.8	173.2	0	111.8	G315 Y316 V337 R338	G315-K330 CarbonylContact O-C 3.54Å; G315-K330 VanDerWaalsContact O-CA 3.25Å; G315-K330 WeakPolarHBondContact O-CA 3.29Å; G315-K330 WeakPolarHBondContact O-CG 3.47Å; Y316-K330 HydrophobicContact CD1-CB 4.09Å; Y316-K330 HydrophobicContact CD1-CG 4.32Å; Y316-K330 HydrophobicContact CE1-CB 3.86Å; Y316-K330 HydrophobicContact CE1-CD 4.47Å; Y316-K330 HydrophobicContact CE1-CG 4.06Å; Y316-K330 HydrophobicContact CE2-CD 4.47Å; Y316-K330 HydrophobicContact CE2-CG 4.41Å; K330-V337 PolarHBondContact O-N 2.8Å; K330-R338 HydrophobicContact CB-CB 4.28Å; K330-R338 PolarHBondContact N-O 3.4Å; K330-R338 PolarHBondContact O-N 2.81Å
331	Y	92.6	Very high	87.9	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	151.9	175.5	-70.6	-88.3	0	0	0	112.7	Y304 R313 H314 G315 T319 E327 I335 L336	Y304-Y331 AromaticContact CE2-CD2 3.92Å; Y304-Y331 HydrophobicContact CE2-CD2 3.92Å; Y304-Y331 AromaticContact CE2-CE2 3.64Å; Y304-Y331 HydrophobicContact CE2-CE2 3.64Å; R313-Y331 HydrophobicContact CB-CD1 4.14Å; R313-Y331 HydrophobicContact CB-CG 4.2Å; H314-Y331 CarbonylContact C-O 3.46Å; G315-Y331 PolarHBondContact N-O 2.79Å; G315-Y331 VanDerWaalsContact N-O 3.16Å; G315-Y331 PolarHBondContact O-N 2.85Å; T319-Y331 PolarHBondContact OG1-OH 3.37Å; E327-Y331 WeakPolarHBondContact CG-OH 3.26Å; E327-Y331 PolarHBondContact O-OH 3.38Å; E327-Y331 VanDerWaalsContact O-OH 3.08Å; E327-Y331 WeakPolarHBondContact OE1-CE1 3.47Å; E327-Y331 PolarHBondContact OE1-OH 3.25Å; Y331-I335 CarbonylContact C-O 3.53Å; Y331-I335 VanDerWaalsContact CA-O 3.3Å; Y331-I335 WeakPolarHBondContact CA-O 3.39Å; Y331-L336 HydrophobicContact CD1-CB 4.24Å; Y331-L336 HydrophobicContact CD1-CD1 4.35Å; Y331-L336 HydrophobicContact CD2-CD1 4.16Å; Y331-L336 HydrophobicContact CE1-CB 3.91Å; Y331-L336 HydrophobicContact CE1-CD1 3.96Å; Y331-L336 HydrophobicContact CE2-CD1 3.75Å; Y331-L336 HydrophobicContact CG-CD1 4.44Å
332	K	94.5	Very high	86.3	Confident	125 Å²	125	79 Å²	79	54%	0.543	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	119	166.3	-174	-174.6	178.9	-172.3	0	108.6	I335 V337	K332-I335 PolarHBondContact N-O 2.96Å; K332-I335 PolarHBondContact O-N 2.99Å; K332-I335 VanDerWaalsContact O-N 3.13Å; K332-V337 HydrophobicContact CB-CG2 3.47Å; K332-V337 VanDerWaalsContact CB-CG2 3.47Å
333	N	90.3	Very high	84.3	Confident	86 Å²	86	82.9 Å²	82.9	46%	0.46	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	53.2	176.5	-57.3	-4.8	0	0	0	112.5	K312 R313 I335	K312-N333 HydrophobicContact CD-CB 4.15Å; R313-N333 PolarHBondContact O-N 3.23Å; N333-I335 PolarHBondContact O-N 2.81Å; N333-I335 VanDerWaalsContact O-N 3.14Å
334	N	89.4	Confident	82.2	Confident	17 Å²	17	83.9 Å²	83.9	9%	0.091	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	-21.9	-172.3	-63	-8.5	0	0	0	116.6	N196 K312 R313	N196-N334 PolarHBondContact O-ND2 2.99Å; K312-N334 WeakPolarHBondContact CA-OD1 3.35Å; K312-N334 WeakPolarHBondContact CB-OD1 3.18Å; R313-N334 PolarHBondContact N-OD1 2.96Å; R313-N334 PolarHBondContact NE-O 3.4Å; R313-N334 PolarHBondContact NH2-O 2.9Å; R313-N334 PolarHBondContact O-N 3.42Å
335	I	87.2	Confident	80.4	Confident	83 Å²	83	86.9 Å²	86.9	43%	0.426	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.7	-175.4	-51.2	167.8	0	0	0	110.7	A199 Y331 K332 N333 V337	A199-I335 HydrophobicContact CB-CD1 3.6Å; A199-I335 HydrophobicContact CB-CG1 4.04Å; Y331-I335 CarbonylContact C-O 3.53Å; Y331-I335 VanDerWaalsContact CA-O 3.3Å; Y331-I335 WeakPolarHBondContact CA-O 3.39Å; K332-I335 PolarHBondContact N-O 2.96Å; K332-I335 PolarHBondContact O-N 2.99Å; K332-I335 VanDerWaalsContact O-N 3.13Å; N333-I335 PolarHBondContact O-N 2.81Å; N333-I335 VanDerWaalsContact O-N 3.14Å; I335-V337 PolarHBondContact O-N 2.82Å
336	L	89.1	Confident	78.5	Confident	48 Å²	48	90.7 Å²	90.7	25%	0.251	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	111.8	167.9	-173.8	81.8	0	0	0	110	E327 Y331 G339	E327-L336 HydrophobicContact CG-CB 4.4Å; E327-L336 HydrophobicContact CG-CD1 4.17Å; E327-L336 HydrophobicContact CG-CD2 3.5Å; E327-L336 HydrophobicContact CG-CG 4.22Å; Y331-L336 HydrophobicContact CD1-CB 4.24Å; Y331-L336 HydrophobicContact CD1-CD1 4.35Å; Y331-L336 HydrophobicContact CD2-CD1 4.16Å; Y331-L336 HydrophobicContact CE1-CB 3.91Å; Y331-L336 HydrophobicContact CE1-CD1 3.96Å; Y331-L336 HydrophobicContact CE2-CD1 3.75Å; Y331-L336 HydrophobicContact CG-CD1 4.44Å; L336-G339 VanDerWaalsContact CD2-CA 3.47Å
337	V	89.2	Confident	76.8	Confident	95 Å²	95	91.9 Å²	91.9	58%	0.576	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	-22.1	-177.9	-146.7	0	0	0	0	112.6	K330 K332 I335	K330-V337 PolarHBondContact O-N 2.8Å; K332-V337 HydrophobicContact CB-CG2 3.47Å; K332-V337 VanDerWaalsContact CB-CG2 3.47Å; I335-V337 PolarHBondContact O-N 2.82Å
338	R	82.8	Confident	75	Confident	145 Å²	145	99.6 Å²	99.6	55%	0.547	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	95.4	177.9	-178.5	177.7	174.6	154.7	1	110.2	G329 K330	G329-R338 CarbonylContact C-O 3.52Å; G329-R338 VanDerWaalsContact CA-O 3.3Å; G329-R338 WeakPolarHBondContact CA-O 3.45Å; K330-R338 HydrophobicContact CB-CB 4.28Å; K330-R338 PolarHBondContact N-O 3.4Å; K330-R338 PolarHBondContact O-N 2.81Å
339	G	81.1	Confident	73.4	Confident	28 Å²	28	100.8 Å²	100.8	29%	0.289	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	161.8	176.4	0	0	0	0	0	114.5	E328 L336	E328-G339 CarbonylContact O-C 3.46Å; E328-G339 VanDerWaalsContact O-CA 3.29Å; E328-G339 WeakPolarHBondContact O-CA 3.18Å; L336-G339 VanDerWaalsContact CD2-CA 3.47Å
340	I	77.9	Confident	72.2	Confident	37 Å²	37	103.4 Å²	103.4	19%	0.19	50%	0.496	C	S	.	.			trans	-96.4	99.4	167.2	-55.8	177.2	0	0	0	107.2	E328 T352 R353 V356	E328-I340 HydrophobicContact CB-CB 4.43Å; E328-I340 HydrophobicContact CB-CD1 4.22Å; E328-I340 PolarHBondContact O-N 3.16Å; I340-T352 HydrophobicContact CD1-CG2 4.21Å; I340-T352 HydrophobicContact CG1-CG2 3.99Å; I340-R353 HydrophobicContact CD1-CB 4.01Å; I340-R353 HydrophobicContact CD1-CG 4.24Å; I340-V356 HydrophobicContact CD1-CG2 4.12Å
341	R	61.9	Low	71.7	Confident	221 Å²	221	106.6 Å²	106.6	83%	0.834	51%	0.511	S	S	*	.			trans	-75.7	139.2	174.1	-76	-174.2	170	-176	-4	109.9	Q343	R341-Q343 PolarHBondContact O-N 3Å
342	K	57.7	Low	71.3	Confident	185 Å²	185	107 Å²	107	80%	0.804	51%	0.513	S	S	*	.	S	Bend	trans	-69	5.3	179	-68.4	-175.7	177.5	178.2	0	114.9
343	Q	49.4	Very low	71	Confident	155 Å²	155	107.6 Å²	107.6	72%	0.724	51%	0.512	S	S	*	.	S	Bend	trans	-132	143.8	-171.3	-70.5	-67.9	1.9	0	0	112.5	R341	R341-Q343 PolarHBondContact O-N 3Å
344	L	44.4	Very low	71.1	Confident	144 Å²	144	107.5 Å²	107.5	75%	0.754	51%	0.509	S	S	*	.	S	Bend	trans	71.5	107.9	-175	-67.4	97.2	0	0	0	118
345	I	48	Very low	71.3	Confident	113 Å²	113	110.8 Å²	110.8	58%	0.579	52%	0.522	S	S	*	.			trans	66.5	105.6	156.1	-49.1	176.7	0	0	0	116.1	I347	I345-I347 HydrophobicContact CG2-CB 4.25Å; I345-I347 HydrophobicContact CG2-CD1 4.43Å; I345-I347 HydrophobicContact CG2-CG1 4.31Å; I345-I347 PolarHBondContact O-N 2.84Å
346	P	51.3	Low	71.7	Confident	122 Å²	122	106.9 Å²	106.9	79%	0.792	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.6	-176.8	-27.6	35.6	0	0	0	117.3
347	I	54.9	Low	72	Confident	138 Å²	138	107.2 Å²	107.2	71%	0.708	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-22.9	-158.5	-56.5	172.5	0	0	0	113.4	I345	I345-I347 HydrophobicContact CG2-CB 4.25Å; I345-I347 HydrophobicContact CG2-CD1 4.43Å; I345-I347 HydrophobicContact CG2-CG1 4.31Å; I345-I347 PolarHBondContact O-N 2.84Å
348	R	53.9	Low	72.3	Confident	219 Å²	219	109.4 Å²	109.4	83%	0.826	50%	0.502	S	S	*	.	S	Bend	trans	-104.5	-6.1	-169.2	-70.7	-173.8	175.6	-178.8	-0.3	116.4
349	H	59.2	Low	73	Confident	68 Å²	68	102.6 Å²	102.6	32%	0.315	48%	0.477	S	S	.	.	S	Bend	trans	-101.9	-7.4	-173.7	-81.7	-94.8	0	0	0	115.7	K351 T352 R353	H349-K351 PolarHBondContact O-N 3.01Å; H349-T352 PolarHBondContact O-N 3.2Å; H349-R353 PolarHBondContact O-N 3.23Å; H349-R353 VanDerWaalsContact O-N 3.09Å
350	T	67.6	Low	73.8	Confident	55 Å²	55	102.6 Å²	102.6	34%	0.337	47%	0.47	S	S	.	.	H	α-helix	trans	-48.9	-58.8	-175.7	62.4	0	0	0	0	112.7	T352 R353 E354	T350-T352 PolarHBondContact O-N 2.87Å; T350-R353 WeakPolarHBondContact O-CA 3.49Å; T350-R353 PolarHBondContact O-N 2.85Å; T350-E354 VanDerWaalsContact C-CD 3.48Å; T350-E354 WeakPolarHBondContact CB-OE1 3.41Å; T350-E354 WeakPolarHBondContact O-CB 3.33Å; T350-E354 VanDerWaalsContact O-CG 3.24Å; T350-E354 WeakPolarHBondContact O-CG 3.45Å; T350-E354 PolarHBondContact O-N 3.36Å; T350-E354 PolarHBondContact OG1-OE1 3.07Å
351	K	83.4	Confident	74.7	Confident	155 Å²	155	105.7 Å²	105.7	67%	0.674	48%	0.484	S	S	*	.	H	α-helix	trans	-61.8	-7.4	179.8	-63.9	-174.6	178.3	-177.5	0	116	H349 E354 K355	H349-K351 PolarHBondContact O-N 3.01Å; K351-E354 WeakPolarHBondContact CA-OE2 3.47Å; K351-E354 PolarHBondContact N-OE1 3.08Å; K351-K355 WeakPolarHBondContact O-CG 3.37Å
352	T	85	Confident	76.5	Confident	9 Å²	9	95.4 Å²	95.4	6%	0.055	45%	0.446	C	S	.	.	H	α-helix	trans	-97.2	-43.6	170.2	-51.4	0	0	0	0	110.3	Y316 I340 H349 T350 K355 V356	Y316-T352 HydrophobicContact CE1-CG2 4.46Å; I340-T352 HydrophobicContact CD1-CG2 4.21Å; I340-T352 HydrophobicContact CG1-CG2 3.99Å; H349-T352 PolarHBondContact O-N 3.2Å; T350-T352 PolarHBondContact O-N 2.87Å; T352-K355 PolarHBondContact O-N 3.27Å; T352-K355 VanDerWaalsContact O-N 3.17Å; T352-V356 PolarHBondContact O-N 2.84Å; T352-V356 VanDerWaalsContact O-N 3.14Å
353	R	87.8	Confident	78.4	Confident	136 Å²	136	86.6 Å²	86.6	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-59.7	-50.5	174.1	-158.5	-179.6	66.1	-157.8	-1.2	110.9	I340 H349 T350 K355 V356 D357	I340-R353 HydrophobicContact CD1-CB 4.01Å; I340-R353 HydrophobicContact CD1-CG 4.24Å; H349-R353 PolarHBondContact O-N 3.23Å; H349-R353 VanDerWaalsContact O-N 3.09Å; T350-R353 WeakPolarHBondContact O-CA 3.49Å; T350-R353 PolarHBondContact O-N 2.85Å; R353-K355 PolarHBondContact O-N 2.98Å; R353-V356 CarbonylContact O-C 3.59Å; R353-V356 WeakPolarHBondContact O-CA 3.31Å; R353-V356 WeakPolarHBondContact O-CB 3.31Å; R353-V356 PolarHBondContact O-N 3.04Å; R353-D357 PolarHBondContact O-N 2.77Å; R353-D357 VanDerWaalsContact O-OD2 3.08Å
354	E	91.6	Very high	80.7	Confident	84 Å²	84	83.7 Å²	83.7	39%	0.393	39%	0.394	S	S	.	.	H	α-helix	trans	-52.3	-16.1	173.4	-67.5	157.8	-144.6	0	0	115.5	T350 K351 D357 R358	T350-E354 VanDerWaalsContact C-CD 3.48Å; T350-E354 WeakPolarHBondContact CB-OE1 3.41Å; T350-E354 WeakPolarHBondContact O-CB 3.33Å; T350-E354 VanDerWaalsContact O-CG 3.24Å; T350-E354 WeakPolarHBondContact O-CG 3.45Å; T350-E354 PolarHBondContact O-N 3.36Å; T350-E354 PolarHBondContact OG1-OE1 3.07Å; K351-E354 WeakPolarHBondContact CA-OE2 3.47Å; K351-E354 PolarHBondContact N-OE1 3.08Å; E354-D357 PolarHBondContact N-OD2 2.87Å; E354-R358 PolarHBondContact O-NE 2.91Å
355	K	94.5	Very high	83.3	Confident	87 Å²	87	84.2 Å²	84.2	38%	0.378	39%	0.386	S	S	.	.	H	α-helix	trans	-99.6	-33.3	175.1	-67	-175.2	-179.4	-167.7	0	112.4	Y316 K351 T352 R353 A359	Y316-K355 WeakPolarHBondContact CB-O 3.46Å; Y316-K355 HydrophobicContact CD1-CB 3.72Å; Y316-K355 HydrophobicContact CD2-CB 3.99Å; Y316-K355 HydrophobicContact CD2-CD 4.49Å; Y316-K355 HydrophobicContact CE1-CB 3.81Å; Y316-K355 HydrophobicContact CE1-CD 4.01Å; Y316-K355 HydrophobicContact CE2-CB 4.08Å; Y316-K355 HydrophobicContact CE2-CD 3.77Å; Y316-K355 HydrophobicContact CG-CB 3.81Å; Y316-K355 VanDerWaalsContact CZ-CD 3.49Å; Y316-K355 WeakPolarHBondContact OH-CD 3.36Å; K351-K355 WeakPolarHBondContact O-CG 3.37Å; T352-K355 PolarHBondContact O-N 3.27Å; T352-K355 VanDerWaalsContact O-N 3.17Å; R353-K355 PolarHBondContact O-N 2.98Å; K355-A359 VanDerWaalsContact O-CB 3.31Å; K355-A359 WeakPolarHBondContact O-CB 3.22Å; K355-A359 PolarHBondContact O-N 3.24Å
356	V	94.8	Very high	85.7	Confident	0 Å²	0	79 Å²	79	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-50	168.3	173.5	0	0	0	0	109.7	Y316 C318 E328 I340 T352 R353 R358 A359 I360	Y316-V356 HydrophobicContact CD1-CG2 4.17Å; C318-V356 HydrophobicContact CB-CG1 4.41Å; E328-V356 HydrophobicContact CB-CG1 4.22Å; E328-V356 HydrophobicContact CG-CG1 4.25Å; I340-V356 HydrophobicContact CD1-CG2 4.12Å; T352-V356 PolarHBondContact O-N 2.84Å; T352-V356 VanDerWaalsContact O-N 3.14Å; R353-V356 CarbonylContact O-C 3.59Å; R353-V356 WeakPolarHBondContact O-CA 3.31Å; R353-V356 WeakPolarHBondContact O-CB 3.31Å; R353-V356 PolarHBondContact O-N 3.04Å; V356-R358 PolarHBondContact O-N 2.89Å; V356-A359 CarbonylContact O-C 3.58Å; V356-A359 WeakPolarHBondContact O-CA 3.27Å; V356-A359 WeakPolarHBondContact O-CB 3.2Å; V356-A359 PolarHBondContact O-N 3.44Å; V356-I360 HydrophobicContact CG1-CD1 3.74Å; V356-I360 HydrophobicContact CG1-CG1 4.29Å; V356-I360 WeakPolarHBondContact O-CG1 3.35Å; V356-I360 PolarHBondContact O-N 2.96Å
357	D	94.9	Very high	88	Confident	56 Å²	56	73.4 Å²	73.4	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-51.8	-54.1	179.1	-55.4	-27.2	0	0	0	110.9	R353 E354 A359 I360 E361	R353-D357 PolarHBondContact O-N 2.77Å; R353-D357 VanDerWaalsContact O-OD2 3.08Å; E354-D357 PolarHBondContact N-OD2 2.87Å; D357-A359 VanDerWaalsContact C-N 3.3Å; D357-A359 PolarHBondContact O-N 2.93Å; D357-I360 WeakPolarHBondContact O-CB 3.34Å; D357-I360 PolarHBondContact O-N 2.93Å; D357-E361 WeakPolarHBondContact O-CG 3.45Å; D357-E361 PolarHBondContact O-N 2.97Å
358	R	96.7	Very high	90	Very high	141 Å²	141	69.4 Å²	69.4	53%	0.532	31%	0.312	S	S	.	.	H	α-helix	trans	-65.3	-26.5	176.8	-74.2	-174.8	-66.8	153.7	-8.8	114.8	E354 V356 G362	E354-R358 PolarHBondContact O-NE 2.91Å; V356-R358 PolarHBondContact O-N 2.89Å; R358-G362 PolarHBondContact O-N 3.29Å
359	A	97.2	Very high	92.1	Very high	2 Å²	2	63 Å²	63	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-78.5	-31.9	174.9	0	0	0	0	0	112	F293 Y316 K355 V356 D357 G362 A363	F293-A359 HydrophobicContact CE1-CB 4.26Å; Y316-A359 WeakPolarHBondContact O-CB 3.25Å; K355-A359 VanDerWaalsContact O-CB 3.31Å; K355-A359 WeakPolarHBondContact O-CB 3.22Å; K355-A359 PolarHBondContact O-N 3.24Å; V356-A359 CarbonylContact O-C 3.58Å; V356-A359 WeakPolarHBondContact O-CA 3.27Å; V356-A359 WeakPolarHBondContact O-CB 3.2Å; V356-A359 PolarHBondContact O-N 3.44Å; D357-A359 VanDerWaalsContact C-N 3.3Å; D357-A359 PolarHBondContact O-N 2.93Å; A359-G362 PolarHBondContact O-N 3.49Å; A359-A363 WeakPolarHBondContact O-CB 3.38Å; A359-A363 PolarHBondContact O-N 3.3Å
360	I	97.3	Very high	94	Very high	28 Å²	28	59.8 Å²	59.8	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-48.6	168.6	-63.3	164.7	0	0	0	109.5	E305 C318 V356 D357 G362 A363 Q364	E305-I360 HydrophobicContact CB-CG1 4.2Å; E305-I360 HydrophobicContact CB-CG2 4.2Å; C318-I360 HydrophobicContact CB-CD1 3.76Å; C318-I360 HydrophobicContact CB-CG1 4.13Å; V356-I360 HydrophobicContact CG1-CD1 3.74Å; V356-I360 HydrophobicContact CG1-CG1 4.29Å; V356-I360 WeakPolarHBondContact O-CG1 3.35Å; V356-I360 PolarHBondContact O-N 2.96Å; D357-I360 WeakPolarHBondContact O-CB 3.34Å; D357-I360 PolarHBondContact O-N 2.93Å; I360-G362 PolarHBondContact O-N 3.45Å; I360-A363 PolarHBondContact O-N 2.97Å; I360-A363 VanDerWaalsContact O-N 3.14Å; I360-Q364 HydrophobicContact CG2-CG 4.31Å; I360-Q364 WeakPolarHBondContact O-CB 3.37Å; I360-Q364 WeakPolarHBondContact O-CG 3.39Å; I360-Q364 PolarHBondContact O-N 3.28Å
361	E	98	Very high	95.5	Very high	102 Å²	102	63.8 Å²	63.8	48%	0.477	29%	0.286	S	S	.	.	H	α-helix	trans	-57.7	-36.4	173.1	-69.6	169.3	-178.5	0	0	112.5	D357 R365	D357-E361 WeakPolarHBondContact O-CG 3.45Å; D357-E361 PolarHBondContact O-N 2.97Å; E361-R365 WeakPolarHBondContact O-CB 3.48Å; E361-R365 VanDerWaalsContact O-CG 3.3Å; E361-R365 WeakPolarHBondContact O-CG 3.5Å; E361-R365 PolarHBondContact O-N 3.33Å; E361-R365 VanDerWaalsContact O-N 3.16Å; E361-R365 PolarHBondContact O-NE 2.89Å
362	G	98.4	Very high	96.2	Very high	4 Å²	4	59.9 Å²	59.9	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-50.8	172.3	0	0	0	0	0	112	R358 A359 I360 Q364 R365 A366	R358-G362 PolarHBondContact O-N 3.29Å; A359-G362 PolarHBondContact O-N 3.49Å; I360-G362 PolarHBondContact O-N 3.45Å; G362-Q364 PolarHBondContact O-N 3.44Å; G362-R365 PolarHBondContact O-N 2.89Å; G362-A366 WeakPolarHBondContact O-CB 3.44Å; G362-A366 PolarHBondContact O-N 2.7Å
363	A	98.3	Very high	96.8	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.2	-42.8	178.6	0	0	0	0	0	112.8	V295 E305 G306 A359 I360 A366 A367	V295-A363 HydrophobicContact CG2-CB 4.06Å; E305-A363 HydrophobicContact CB-CB 4.22Å; G306-A363 VanDerWaalsContact N-CB 3.35Å; A359-A363 WeakPolarHBondContact O-CB 3.38Å; A359-A363 PolarHBondContact O-N 3.3Å; I360-A363 PolarHBondContact O-N 2.97Å; I360-A363 VanDerWaalsContact O-N 3.14Å; A363-A366 PolarHBondContact O-N 2.92Å; A363-A367 VanDerWaalsContact O-CB 3.31Å; A363-A367 WeakPolarHBondContact O-CB 3.5Å; A363-A367 PolarHBondContact O-N 2.85Å
364	Q	98.3	Very high	97.3	Very high	94 Å²	94	56.3 Å²	56.3	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-66.9	-40.7	178.3	-71.1	176.6	-0.3	0	0	111.9	E305 I360 G362 A367 A368	E305-Q364 VanDerWaalsContact OE1-CG 3.24Å; E305-Q364 WeakPolarHBondContact OE1-CG 3.47Å; E305-Q364 PolarHBondContact OE1-NE2 2.97Å; I360-Q364 HydrophobicContact CG2-CG 4.31Å; I360-Q364 WeakPolarHBondContact O-CB 3.37Å; I360-Q364 WeakPolarHBondContact O-CG 3.39Å; I360-Q364 PolarHBondContact O-N 3.28Å; G362-Q364 PolarHBondContact O-N 3.44Å; Q364-A367 PolarHBondContact O-N 3.37Å; Q364-A368 WeakPolarHBondContact O-CB 3.46Å; Q364-A368 PolarHBondContact O-N 3.39Å
365	R	98.5	Very high	97.6	Very high	155 Å²	155	58.2 Å²	58.2	59%	0.585	27%	0.273	S	S	*	.	H	α-helix	trans	-64.3	-43.6	171.9	-75.3	178.1	-67.3	153.2	-3.5	112.2	E361 G362 A367 A368 M369	E361-R365 WeakPolarHBondContact O-CB 3.48Å; E361-R365 VanDerWaalsContact O-CG 3.3Å; E361-R365 WeakPolarHBondContact O-CG 3.5Å; E361-R365 PolarHBondContact O-N 3.33Å; E361-R365 VanDerWaalsContact O-N 3.16Å; E361-R365 PolarHBondContact O-NE 2.89Å; G362-R365 PolarHBondContact O-N 2.89Å; R365-A367 VanDerWaalsContact C-N 3.34Å; R365-A367 PolarHBondContact O-N 2.8Å; R365-A368 PolarHBondContact O-N 3.23Å; R365-M369 WeakPolarHBondContact O-CB 3.49Å; R365-M369 WeakPolarHBondContact O-CG 3.46Å; R365-M369 PolarHBondContact O-N 3.27Å
366	A	98.4	Very high	97.8	Very high	3 Å²	3	56.6 Å²	56.6	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-37.3	176.5	0	0	0	0	0	112.5	Y141 F293 G362 A363 A370	Y141-A366 HydrophobicContact CD1-CB 4.49Å; Y141-A366 HydrophobicContact CE1-CB 4.04Å; F293-A366 HydrophobicContact CB-CB 3.78Å; F293-A366 VanDerWaalsContact O-CB 3.32Å; F293-A366 WeakPolarHBondContact O-CB 3.29Å; G362-A366 WeakPolarHBondContact O-CB 3.44Å; G362-A366 PolarHBondContact O-N 2.7Å; A363-A366 PolarHBondContact O-N 2.92Å; A366-A370 WeakPolarHBondContact O-CB 3.22Å; A366-A370 PolarHBondContact O-N 2.88Å
367	A	98.4	Very high	97.9	Very high	6 Å²	6	56.6 Å²	56.6	5%	0.05	27%	0.268	C	S	.	.	H	α-helix	trans	-67.5	-40.2	173.6	0	0	0	0	0	112.4	M282 V295 A363 Q364 R365 A370 R371	M282-A367 HydrophobicContact CB-CB 3.73Å; V295-A367 HydrophobicContact CB-CB 4.1Å; V295-A367 HydrophobicContact CG2-CB 3.78Å; A363-A367 VanDerWaalsContact O-CB 3.31Å; A363-A367 WeakPolarHBondContact O-CB 3.5Å; A363-A367 PolarHBondContact O-N 2.85Å; Q364-A367 PolarHBondContact O-N 3.37Å; R365-A367 VanDerWaalsContact C-N 3.34Å; R365-A367 PolarHBondContact O-N 2.8Å; A367-A370 PolarHBondContact O-N 2.95Å; A367-R371 WeakPolarHBondContact O-CG 3.3Å; A367-R371 PolarHBondContact O-N 3.45Å
368	A	98.3	Very high	98.1	Very high	54 Å²	54	57.3 Å²	57.3	45%	0.446	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-47.7	173.1	0	0	0	0	0	111.4	Q364 R365 A370 R371 T372	Q364-A368 WeakPolarHBondContact O-CB 3.46Å; Q364-A368 PolarHBondContact O-N 3.39Å; R365-A368 PolarHBondContact O-N 3.23Å; A368-A370 VanDerWaalsContact C-N 3.29Å; A368-A370 PolarHBondContact O-N 2.99Å; A368-R371 WeakPolarHBondContact O-CB 3.31Å; A368-R371 PolarHBondContact O-N 2.9Å; A368-R371 VanDerWaalsContact O-N 3.12Å; A368-T372 PolarHBondContact O-N 3.47Å; A368-T372 PolarHBondContact O-OG1 3.35Å
369	M	98.4	Very high	98.1	Very high	84 Å²	84	54 Å²	54	41%	0.414	27%	0.27	S	S	.	.	H	α-helix	trans	-58.6	-40.4	174.2	-71.4	176.4	70.8	0	0	111.9	Y141 R365 T372 K373	Y141-M369 HydrophobicContact CD1-CB 3.81Å; Y141-M369 HydrophobicContact CD2-CE 4.17Å; Y141-M369 HydrophobicContact CE1-CB 4.03Å; Y141-M369 HydrophobicContact CE1-CE 4.07Å; Y141-M369 HydrophobicContact CE1-SD 4.06Å; Y141-M369 HydrophobicContact CE2-CE 3.53Å; Y141-M369 HydrophobicContact CG-CB 4.18Å; Y141-M369 VanDerWaalsContact CZ-CE 3.49Å; R365-M369 WeakPolarHBondContact O-CB 3.49Å; R365-M369 WeakPolarHBondContact O-CG 3.46Å; R365-M369 PolarHBondContact O-N 3.27Å; M369-T372 PolarHBondContact O-N 3.13Å; M369-K373 WeakPolarHBondContact O-CG 3.27Å; M369-K373 PolarHBondContact O-N 2.94Å
370	A	98.4	Very high	98.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-42.4	174.5	0	0	0	0	0	112.3	V143 A366 A367 A368 K373 V374	V143-A370 HydrophobicContact CG2-CB 4.07Å; A366-A370 WeakPolarHBondContact O-CB 3.22Å; A366-A370 PolarHBondContact O-N 2.88Å; A367-A370 PolarHBondContact O-N 2.95Å; A368-A370 VanDerWaalsContact C-N 3.29Å; A368-A370 PolarHBondContact O-N 2.99Å; A370-K373 PolarHBondContact O-N 2.9Å; A370-V374 WeakPolarHBondContact O-CG2 3.26Å; A370-V374 PolarHBondContact O-N 2.89Å
371	R	97.9	Very high	98.1	Very high	139 Å²	139	57.4 Å²	57.4	53%	0.525	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-45.7	174.3	-67.6	171.1	-173.9	-170.5	0.3	111.8	M282 A367 A368 K373 V374 E375	M282-R371 PolarHBondContact SD-NE 2.81Å; M282-R371 PolarHBondContact SD-NH2 2.89Å; A367-R371 WeakPolarHBondContact O-CG 3.3Å; A367-R371 PolarHBondContact O-N 3.45Å; A368-R371 WeakPolarHBondContact O-CB 3.31Å; A368-R371 PolarHBondContact O-N 2.9Å; A368-R371 VanDerWaalsContact O-N 3.12Å; R371-K373 VanDerWaalsContact C-N 3.3Å; R371-K373 PolarHBondContact O-N 3.48Å; R371-V374 WeakPolarHBondContact O-CA 3.29Å; R371-V374 VanDerWaalsContact O-CB 3.31Å; R371-V374 WeakPolarHBondContact O-CB 3.26Å; R371-V374 PolarHBondContact O-N 3.27Å; R371-E375 PolarHBondContact O-N 3.15Å; R371-E375 VanDerWaalsContact O-N 3.11Å
372	T	98.2	Very high	98.1	Very high	74 Å²	74	55.3 Å²	55.3	45%	0.454	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-32.7	174.4	-49.3	0	0	0	0	112.8	A368 M369 E375 I376	A368-T372 PolarHBondContact O-N 3.47Å; A368-T372 PolarHBondContact O-OG1 3.35Å; M369-T372 PolarHBondContact O-N 3.13Å; T372-E375 PolarHBondContact O-N 3.43Å; T372-I376 PolarHBondContact O-N 3.19Å
373	K	98.2	Very high	98.1	Very high	51 Å²	51	58.6 Å²	58.6	22%	0.222	30%	0.295	C	S	.	.	H	α-helix	trans	-73.4	-26.8	172.6	-65	-33.9	-168.2	168.7	0	113.2	Y118 Q132 M369 A370 R371 I376 A377	Y118-K373 HydrophobicContact CE1-CB 4.21Å; Y118-K373 HydrophobicContact CE1-CD 3.99Å; Y118-K373 HydrophobicContact CE1-CG 4.37Å; Y118-K373 PolarHBondContact OH-NZ 3.01Å; Q132-K373 HydrophobicContact CG-CB 4.44Å; Q132-K373 HydrophobicContact CG-CG 4.33Å; M369-K373 WeakPolarHBondContact O-CG 3.27Å; M369-K373 PolarHBondContact O-N 2.94Å; A370-K373 PolarHBondContact O-N 2.9Å; R371-K373 VanDerWaalsContact C-N 3.3Å; R371-K373 PolarHBondContact O-N 3.48Å; K373-I376 HydrophobicContact CD-CD1 4.01Å; K373-I376 PolarHBondContact O-N 3.36Å; K373-A377 WeakPolarHBondContact O-CB 3.44Å; K373-A377 PolarHBondContact O-N 2.85Å
374	V	98.4	Very high	98.1	Very high	18 Å²	18	58.6 Å²	58.6	11%	0.109	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-41.6	170.5	167.2	0	0	0	0	111.4	Q130 V143 A370 R371 I376 A377 N378	Q130-V374 HydrophobicContact CB-CB 4.43Å; Q130-V374 HydrophobicContact CB-CG1 4.05Å; Q130-V374 HydrophobicContact CB-CG2 3.74Å; Q130-V374 VanDerWaalsContact O-CG2 3.31Å; Q130-V374 WeakPolarHBondContact O-CG2 3.32Å; Q130-V374 VanDerWaalsContact OE1-CG1 3.22Å; V143-V374 HydrophobicContact CB-CG2 3.75Å; V143-V374 HydrophobicContact CG2-CG2 3.59Å; A370-V374 WeakPolarHBondContact O-CG2 3.26Å; A370-V374 PolarHBondContact O-N 2.89Å; R371-V374 WeakPolarHBondContact O-CA 3.29Å; R371-V374 VanDerWaalsContact O-CB 3.31Å; R371-V374 WeakPolarHBondContact O-CB 3.26Å; R371-V374 PolarHBondContact O-N 3.27Å; V374-I376 VanDerWaalsContact C-N 3.32Å; V374-I376 PolarHBondContact O-N 2.69Å; V374-A377 CarbonylContact O-C 3.57Å; V374-A377 PolarHBondContact O-N 2.89Å; V374-A377 VanDerWaalsContact O-N 3.13Å; V374-N378 WeakPolarHBondContact CG1-ND2 3.49Å; V374-N378 WeakPolarHBondContact O-CB 3.33Å; V374-N378 PolarHBondContact O-N 2.83Å; V374-N378 PolarHBondContact O-ND2 2.83Å
375	E	97.8	Very high	98.1	Very high	125 Å²	125	59.3 Å²	59.3	58%	0.584	29%	0.294	S	S	*	.	H	α-helix	trans	-58	-44.7	174.8	-67.7	157.5	-168.6	0	0	111.4	R371 T372 N378 S379	R371-E375 PolarHBondContact O-N 3.15Å; R371-E375 VanDerWaalsContact O-N 3.11Å; T372-E375 PolarHBondContact O-N 3.43Å; E375-N378 PolarHBondContact O-N 2.8Å; E375-S379 PolarHBondContact O-N 2.94Å
376	I	98	Very high	98.1	Very high	53 Å²	53	54.6 Å²	54.6	27%	0.272	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-42.8	174.3	-59.9	169.7	0	0	0	111	Y118 T372 K373 V374 N378 S379 R380	Y118-I376 HydrophobicContact CD1-CB 3.98Å; Y118-I376 HydrophobicContact CD1-CG2 3.6Å; Y118-I376 HydrophobicContact CD2-CG2 3.98Å; Y118-I376 HydrophobicContact CE1-CB 3.88Å; Y118-I376 HydrophobicContact CE1-CD1 4.32Å; Y118-I376 HydrophobicContact CE1-CG2 3.63Å; Y118-I376 HydrophobicContact CE2-CG2 4.02Å; Y118-I376 HydrophobicContact CG-CG2 3.78Å; T372-I376 PolarHBondContact O-N 3.19Å; K373-I376 HydrophobicContact CD-CD1 4.01Å; K373-I376 PolarHBondContact O-N 3.36Å; V374-I376 VanDerWaalsContact C-N 3.32Å; V374-I376 PolarHBondContact O-N 2.69Å; I376-N378 VanDerWaalsContact C-N 3.34Å; I376-N378 PolarHBondContact O-N 2.95Å; I376-S379 PolarHBondContact O-N 2.86Å; I376-R380 HydrophobicContact CG2-CG 4.41Å; I376-R380 WeakPolarHBondContact O-CG 3.07Å; I376-R380 PolarHBondContact O-N 2.88Å
377	A	98	Very high	98.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-38.9	176.7	0	0	0	0	0	112.5	Y118 K373 V374 R380 T381	Y118-A377 HydrophobicContact CD1-CB 4.49Å; K373-A377 WeakPolarHBondContact O-CB 3.44Å; K373-A377 PolarHBondContact O-N 2.85Å; V374-A377 CarbonylContact O-C 3.57Å; V374-A377 PolarHBondContact O-N 2.89Å; V374-A377 VanDerWaalsContact O-N 3.13Å; A377-R380 PolarHBondContact O-N 3.08Å; A377-T381 WeakPolarHBondContact O-CB 3.37Å; A377-T381 PolarHBondContact O-N 3.37Å; A377-T381 PolarHBondContact O-OG1 2.87Å
378	N	97.9	Very high	98.1	Very high	70 Å²	70	57.2 Å²	57.2	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-69.7	-39	177	-72.6	-24.8	0	0	0	111.7	Q130 V374 E375 I376 T381 A382	Q130-N378 PolarHBondContact OE1-ND2 2.89Å; V374-N378 WeakPolarHBondContact CG1-ND2 3.49Å; V374-N378 WeakPolarHBondContact O-CB 3.33Å; V374-N378 PolarHBondContact O-N 2.83Å; V374-N378 PolarHBondContact O-ND2 2.83Å; E375-N378 PolarHBondContact O-N 2.8Å; I376-N378 VanDerWaalsContact C-N 3.34Å; I376-N378 PolarHBondContact O-N 2.95Å; N378-T381 WeakPolarHBondContact O-CB 3.23Å; N378-T381 PolarHBondContact O-N 2.88Å; N378-A382 PolarHBondContact O-N 3.07Å
379	S	97.9	Very high	98.1	Very high	72 Å²	72	58.6 Å²	58.6	50%	0.503	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-47.2	170.9	176.6	0	0	0	0	112.3	E375 I376 T381 A382 H383	E375-S379 PolarHBondContact O-N 2.94Å; I376-S379 PolarHBondContact O-N 2.86Å; S379-T381 VanDerWaalsContact C-N 3.33Å; S379-T381 PolarHBondContact O-N 2.92Å; S379-A382 PolarHBondContact O-N 2.8Å; S379-H383 PolarHBondContact O-N 2.94Å
380	R	97.7	Very high	98.1	Very high	100 Å²	100	56 Å²	56	38%	0.377	29%	0.289	S	S	.	.	H	α-helix	trans	-68.8	-31.8	177.5	-62.7	-66.7	168.8	-152.2	-11	112.5	Y94 T109 I376 A377 H383 A384	Y94-R380 PolarHBondContact OH-NH1 2.8Å; T109-R380 HydrophobicContact CG2-CB 4.39Å; I376-R380 HydrophobicContact CG2-CG 4.41Å; I376-R380 WeakPolarHBondContact O-CG 3.07Å; I376-R380 PolarHBondContact O-N 2.88Å; A377-R380 PolarHBondContact O-N 3.08Å; R380-H383 PolarHBondContact O-N 2.92Å; R380-A384 WeakPolarHBondContact O-CB 3.3Å; R380-A384 PolarHBondContact O-N 3.34Å
381	T	97.3	Very high	98.1	Very high	2 Å²	2	56 Å²	56	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-44.8	172.4	-65.8	0	0	0	0	111.8	E107 V120 A377 N378 S379 H383 A384 R385	E107-T381 HydrophobicContact CB-CG2 3.68Å; E107-T381 PolarHBondContact O-OG1 2.84Å; E107-T381 VanDerWaalsContact O-OG1 3.13Å; V120-T381 HydrophobicContact CB-CG2 4.48Å; V120-T381 HydrophobicContact CG2-CG2 4.43Å; V120-T381 WeakPolarHBondContact CG2-OG1 3.3Å; A377-T381 WeakPolarHBondContact O-CB 3.37Å; A377-T381 PolarHBondContact O-N 3.37Å; A377-T381 PolarHBondContact O-OG1 2.87Å; N378-T381 WeakPolarHBondContact O-CB 3.23Å; N378-T381 PolarHBondContact O-N 2.88Å; S379-T381 VanDerWaalsContact C-N 3.33Å; S379-T381 PolarHBondContact O-N 2.92Å; T381-H383 VanDerWaalsContact C-N 3.32Å; T381-H383 PolarHBondContact O-N 3.07Å; T381-A384 PolarHBondContact O-N 3.07Å; T381-A384 VanDerWaalsContact O-N 3.15Å; T381-R385 WeakPolarHBondContact O-CG 3.43Å; T381-R385 PolarHBondContact O-N 3.22Å
382	A	98.1	Very high	98.1	Very high	57 Å²	57	51.7 Å²	51.7	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-60.6	-41.5	175.9	0	0	0	0	0	111.9	N378 S379 R385 A386	N378-A382 PolarHBondContact O-N 3.07Å; S379-A382 PolarHBondContact O-N 2.8Å; A382-R385 PolarHBondContact O-N 2.85Å; A382-A386 PolarHBondContact O-N 3.14Å; A382-A386 VanDerWaalsContact O-N 3.08Å
383	H	98	Very high	98.1	Very high	74 Å²	74	54.7 Å²	54.7	34%	0.343	29%	0.286	S	S	.	.	H	α-helix	trans	-67.2	-37.4	173.3	-172.4	-94.7	0	0	0	112.7	Y94 S379 R380 T381 R385 A386 K387	Y94-H383 HydrophobicContact CD1-CB 4.35Å; Y94-H383 AromaticContact CD1-ND1 3.2Å; Y94-H383 WeakPolarHBondContact CD1-ND1 3.15Å; Y94-H383 AromaticContact CD2-CE1 3.31Å; Y94-H383 WeakPolarHBondContact CD2-CE1 3.43Å; Y94-H383 AromaticContact CD2-ND1 3.25Å; Y94-H383 WeakPolarHBondContact CD2-ND1 3.45Å; Y94-H383 HydrophobicContact CE1-CB 4.19Å; Y94-H383 AromaticContact CE1-ND1 3.27Å; Y94-H383 VanDerWaalsContact CE1-ND1 3.27Å; Y94-H383 WeakPolarHBondContact CE1-ND1 3.39Å; Y94-H383 AromaticContact CE2-CE1 3.36Å; Y94-H383 WeakPolarHBondContact CE2-CE1 3.46Å; Y94-H383 AromaticContact CE2-ND1 3.31Å; Y94-H383 VanDerWaalsContact CE2-ND1 3.31Å; Y94-H383 WeakPolarHBondContact CE2-ND1 3.41Å; Y94-H383 AromaticContact CG-CE1 3.71Å; Y94-H383 AromaticContact CG-ND1 3.18Å; Y94-H383 AromaticContact CZ-CE1 3.8Å; Y94-H383 AromaticContact CZ-ND1 3.32Å; Y94-H383 VanDerWaalsContact CZ-ND1 3.32Å; S379-H383 PolarHBondContact O-N 2.94Å; R380-H383 PolarHBondContact O-N 2.92Å; T381-H383 VanDerWaalsContact C-N 3.32Å; T381-H383 PolarHBondContact O-N 3.07Å; H383-R385 VanDerWaalsContact C-N 3.35Å; H383-A386 PolarHBondContact O-N 3.08Å; H383-K387 WeakPolarHBondContact O-CB 3.47Å; H383-K387 WeakPolarHBondContact O-CG 3.33Å; H383-K387 PolarHBondContact O-N 3.45Å
384	A	98.2	Very high	98.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-34.4	174.5	0	0	0	0	0	113.1	Y94 G108 R380 T381 A388	Y94-A384 HydrophobicContact CD1-CB 4.45Å; G108-A384 WeakPolarHBondContact O-CB 3.37Å; R380-A384 WeakPolarHBondContact O-CB 3.3Å; R380-A384 PolarHBondContact O-N 3.34Å; T381-A384 PolarHBondContact O-N 3.07Å; T381-A384 VanDerWaalsContact O-N 3.15Å; A384-A388 WeakPolarHBondContact O-CB 3.44Å; A384-A388 PolarHBondContact O-N 3.14Å
385	R	98.1	Very high	98.1	Very high	109 Å²	109	51.7 Å²	51.7	41%	0.411	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-55.3	170.4	-72.9	175	-177.8	149.5	9.2	111.2	E107 T381 A382 H383 K387 A388 D389	E107-R385 VanDerWaalsContact CD-NH2 3.26Å; E107-R385 IonicContact OE1-CZ 2.88Å; E107-R385 IonicContact OE1-NE 3.01Å; E107-R385 IonicContact OE1-NH2 2.89Å; E107-R385 PolarHBondContact OE1-NH2 2.76Å; E107-R385 WeakPolarHBondContact OE2-CG 3.41Å; E107-R385 IonicContact OE2-CZ 4Å; E107-R385 VanDerWaalsContact OE2-CZ 3.3Å; E107-R385 IonicContact OE2-NE 2.76Å; E107-R385 PolarHBondContact OE2-NE 3.32Å; E107-R385 IonicContact OE2-NH2 3.32Å; E107-R385 PolarHBondContact OE2-NH2 3.32Å; E107-R385 VanDerWaalsContact OE2-NH2 3.07Å; T381-R385 WeakPolarHBondContact O-CG 3.43Å; T381-R385 PolarHBondContact O-N 3.22Å; A382-R385 PolarHBondContact O-N 2.85Å; H383-R385 VanDerWaalsContact C-N 3.35Å; R385-K387 PolarHBondContact O-N 2.93Å; R385-K387 VanDerWaalsContact O-N 3.07Å; R385-A388 CarbonylContact O-C 3.57Å; R385-A388 WeakPolarHBondContact O-CA 3.34Å; R385-A388 WeakPolarHBondContact O-CB 3.44Å; R385-A388 PolarHBondContact O-N 3.3Å; R385-D389 PolarHBondContact O-N 2.97Å; R385-D389 VanDerWaalsContact O-OD2 3.08Å
386	A	98.3	Very high	98.1	Very high	56 Å²	56	50.5 Å²	50.5	46%	0.463	27%	0.27	S	S	.	.	H	α-helix	trans	-55.3	-33.3	178	0	0	0	0	0	113.1	A382 H383 A390	A382-A386 PolarHBondContact O-N 3.14Å; A382-A386 VanDerWaalsContact O-N 3.08Å; H383-A386 PolarHBondContact O-N 3.08Å; A386-A390 WeakPolarHBondContact O-CB 3.32Å; A386-A390 PolarHBondContact O-N 3.15Å
387	K	98.2	Very high	98.1	Very high	62 Å²	62	49.5 Å²	49.5	27%	0.27	27%	0.269	S	S	.	.	H	α-helix	trans	-76.8	-29.2	173.6	-70.4	-72.8	179.8	143.1	0	114.1	L72 E85 H383 R385 A391	L72-K387 HydrophobicContact CD2-CD 4.16Å; E85-K387 HydrophobicContact CG-CB 4.44Å; E85-K387 HydrophobicContact CG-CD 3.96Å; E85-K387 HydrophobicContact CG-CG 4.37Å; E85-K387 WeakPolarHBondContact OE1-CD 3.31Å; E85-K387 WeakPolarHBondContact OE1-CE 3.2Å; E85-K387 IonicContact OE1-NZ 3.11Å; E85-K387 PolarHBondContact OE1-NZ 3.49Å; H383-K387 WeakPolarHBondContact O-CB 3.47Å; H383-K387 WeakPolarHBondContact O-CG 3.33Å; H383-K387 PolarHBondContact O-N 3.45Å; R385-K387 PolarHBondContact O-N 2.93Å; R385-K387 VanDerWaalsContact O-N 3.07Å; K387-A391 VanDerWaalsContact O-CB 3.29Å; K387-A391 WeakPolarHBondContact O-CB 3.3Å; K387-A391 PolarHBondContact O-N 3.41Å
388	A	98.3	Very high	98.1	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-70	-43.7	169.2	0	0	0	0	0	111.5	R83 V96 A384 R385 A390 A391 D392	R83-A388 HydrophobicContact CB-CB 3.68Å; R83-A388 WeakPolarHBondContact O-CB 3.24Å; V96-A388 HydrophobicContact CB-CB 3.95Å; V96-A388 HydrophobicContact CG2-CB 3.77Å; A384-A388 WeakPolarHBondContact O-CB 3.44Å; A384-A388 PolarHBondContact O-N 3.14Å; R385-A388 CarbonylContact O-C 3.57Å; R385-A388 WeakPolarHBondContact O-CA 3.34Å; R385-A388 WeakPolarHBondContact O-CB 3.44Å; R385-A388 PolarHBondContact O-N 3.3Å; A388-A390 PolarHBondContact O-N 3.11Å; A388-A391 CarbonylContact O-C 3.55Å; A388-A391 WeakPolarHBondContact O-CA 3.43Å; A388-A391 WeakPolarHBondContact O-CB 3.38Å; A388-A391 PolarHBondContact O-N 3.48Å; A388-D392 PolarHBondContact O-N 2.93Å
389	D	98.4	Very high	98	Very high	84 Å²	84	51.1 Å²	51.1	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-65.2	-40.2	179	-52.8	-36.5	0	0	0	111	R385 A391 D392 Q393	R385-D389 PolarHBondContact O-N 2.97Å; R385-D389 VanDerWaalsContact O-OD2 3.08Å; D389-A391 VanDerWaalsContact C-N 3.32Å; D389-A391 PolarHBondContact O-N 3.31Å; D389-D392 PolarHBondContact O-N 2.95Å; D389-Q393 PolarHBondContact O-N 2.99Å; D389-Q393 VanDerWaalsContact O-N 3.11Å
390	A	98.4	Very high	98	Very high	28 Å²	28	53.9 Å²	53.9	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-29.4	170.7	0	0	0	0	0	113.1	L72 A386 A388 A394	L72-A390 HydrophobicContact CD1-CB 3.83Å; A386-A390 WeakPolarHBondContact O-CB 3.32Å; A386-A390 PolarHBondContact O-N 3.15Å; A388-A390 PolarHBondContact O-N 3.11Å; A390-A394 PolarHBondContact O-N 3.49Å
391	A	98.5	Very high	98.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-74	-31.8	172.9	0	0	0	0	0	112.7	L72 V74 G84 K387 A388 D389 A394 A395	L72-A391 HydrophobicContact CB-CB 4.29Å; V74-A391 HydrophobicContact CG2-CB 4.37Å; G84-A391 VanDerWaalsContact N-CB 3.3Å; K387-A391 VanDerWaalsContact O-CB 3.29Å; K387-A391 WeakPolarHBondContact O-CB 3.3Å; K387-A391 PolarHBondContact O-N 3.41Å; A388-A391 CarbonylContact O-C 3.55Å; A388-A391 WeakPolarHBondContact O-CA 3.43Å; A388-A391 WeakPolarHBondContact O-CB 3.38Å; A388-A391 PolarHBondContact O-N 3.48Å; D389-A391 VanDerWaalsContact C-N 3.32Å; D389-A391 PolarHBondContact O-N 3.31Å; A391-A394 PolarHBondContact O-N 3.02Å; A391-A395 WeakPolarHBondContact O-CB 3.23Å; A391-A395 PolarHBondContact O-N 3.45Å
392	D	98.4	Very high	98.1	Very high	49 Å²	49	51.4 Å²	51.4	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-66.1	-39.7	170.4	-72	-41.1	0	0	0	111.1	R83 A388 D389 A395 L396	R83-D392 WeakPolarHBondContact CD-OD1 3.39Å; R83-D392 VanDerWaalsContact CD-OD2 3.22Å; R83-D392 WeakPolarHBondContact CD-OD2 3.29Å; R83-D392 IonicContact CZ-OD2 2.65Å; R83-D392 IonicContact NE-OD2 3.66Å; R83-D392 IonicContact NH1-OD2 2.9Å; R83-D392 PolarHBondContact NH1-OD2 3.34Å; A388-D392 PolarHBondContact O-N 2.93Å; D389-D392 PolarHBondContact O-N 2.95Å; D392-A395 PolarHBondContact O-N 2.98Å; D392-L396 WeakPolarHBondContact O-CG 3.43Å; D392-L396 PolarHBondContact O-N 3.01Å
393	Q	98.3	Very high	98	Very high	138 Å²	138	53.1 Å²	53.1	65%	0.645	27%	0.269	S	S	*	.	H	α-helix	trans	-60.9	-44.9	170.5	-67.8	175	12.8	0	0	111.9	D389 A395 L396 A397	D389-Q393 PolarHBondContact O-N 2.99Å; D389-Q393 VanDerWaalsContact O-N 3.11Å; Q393-A395 VanDerWaalsContact C-N 3.31Å; Q393-A395 PolarHBondContact O-N 3.25Å; Q393-L396 PolarHBondContact O-N 3.38Å; Q393-A397 PolarHBondContact O-N 2.81Å
394	A	98.1	Very high	98	Very high	5 Å²	5	53 Å²	53	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-36.2	175.1	0	0	0	0	0	112.7	Y63 L72 A390 A391 A398	Y63-A394 HydrophobicContact CD2-CB 3.99Å; Y63-A394 HydrophobicContact CE2-CB 3.63Å; L72-A394 HydrophobicContact CB-CB 3.85Å; A390-A394 PolarHBondContact O-N 3.49Å; A391-A394 PolarHBondContact O-N 3.02Å; A394-A398 VanDerWaalsContact O-CB 3.3Å; A394-A398 WeakPolarHBondContact O-CB 3.12Å; A394-A398 PolarHBondContact O-N 3.01Å
395	A	98.1	Very high	97.9	Very high	1 Å²	1	53 Å²	53	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-73.3	-30.3	175.5	0	0	0	0	0	113	Q61 V74 A391 D392 Q393 R399	Q61-A395 HydrophobicContact CB-CB 3.82Å; V74-A395 HydrophobicContact CB-CB 3.95Å; V74-A395 HydrophobicContact CG2-CB 3.65Å; A391-A395 WeakPolarHBondContact O-CB 3.23Å; A391-A395 PolarHBondContact O-N 3.45Å; D392-A395 PolarHBondContact O-N 2.98Å; Q393-A395 VanDerWaalsContact C-N 3.31Å; Q393-A395 PolarHBondContact O-N 3.25Å; A395-R399 VanDerWaalsContact O-CG 3.29Å; A395-R399 WeakPolarHBondContact O-CG 3.39Å; A395-R399 PolarHBondContact O-N 3.46Å; A395-R399 VanDerWaalsContact O-N 3.07Å
396	L	98.1	Very high	97.8	Very high	99 Å²	99	49.3 Å²	49.3	52%	0.518	26%	0.257	S	S	.	.	H	α-helix	trans	-68.3	-46	171.1	-73.9	172.8	0	0	0	111.5	D392 Q393 R399 Q400	D392-L396 WeakPolarHBondContact O-CG 3.43Å; D392-L396 PolarHBondContact O-N 3.01Å; Q393-L396 PolarHBondContact O-N 3.38Å; L396-R399 PolarHBondContact O-N 2.88Å; L396-Q400 PolarHBondContact O-N 3.04Å
397	A	97.5	Very high	97.6	Very high	32 Å²	32	48.5 Å²	48.5	26%	0.264	25%	0.25	S	C	.	.	H	α-helix	trans	-57.9	-49.2	171.7	0	0	0	0	0	110.6	Q393 R399 Q400 E401	Q393-A397 PolarHBondContact O-N 2.81Å; A397-R399 PolarHBondContact O-N 3.36Å; A397-R399 VanDerWaalsContact O-N 3.15Å; A397-Q400 WeakPolarHBondContact O-CA 3.33Å; A397-Q400 WeakPolarHBondContact O-CB 3.36Å; A397-Q400 PolarHBondContact O-N 2.86Å; A397-E401 WeakPolarHBondContact O-CG 3.3Å; A397-E401 PolarHBondContact O-N 3.08Å
398	A	98.1	Very high	97.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-30.4	177.5	0	0	0	0	0	114	V49 Q61 A394 C402	V49-A398 HydrophobicContact CG1-CB 3.9Å; Q61-A398 HydrophobicContact CB-CB 4.34Å; A394-A398 VanDerWaalsContact O-CB 3.3Å; A394-A398 WeakPolarHBondContact O-CB 3.12Å; A394-A398 PolarHBondContact O-N 3.01Å; A398-C402 PolarHBondContact O-N 3.07Å; A398-C402 PolarHBondContact O-SG 2.81Å
399	R	97.2	Very high	97.3	Very high	105 Å²	105	47.1 Å²	47.1	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-68.6	-41.3	172.2	-72.3	164.9	-163.9	176.7	7.7	112.3	Q61 A395 L396 A397 E401 C402 D403	Q61-R399 VanDerWaalsContact OE1-CZ 3.27Å; A395-R399 VanDerWaalsContact O-CG 3.29Å; A395-R399 WeakPolarHBondContact O-CG 3.39Å; A395-R399 PolarHBondContact O-N 3.46Å; A395-R399 VanDerWaalsContact O-N 3.07Å; L396-R399 PolarHBondContact O-N 2.88Å; A397-R399 PolarHBondContact O-N 3.36Å; A397-R399 VanDerWaalsContact O-N 3.15Å; R399-E401 VanDerWaalsContact C-N 3.31Å; R399-E401 PolarHBondContact O-N 2.85Å; R399-C402 WeakPolarHBondContact O-CB 3.36Å; R399-C402 PolarHBondContact O-N 3.06Å; R399-D403 VanDerWaalsContact O-CG 3.3Å; R399-D403 PolarHBondContact O-N 3.12Å
400	Q	97.8	Very high	97.1	Very high	130 Å²	130	49.5 Å²	49.5	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-60.1	-44.7	175.1	-64.7	169.1	-21.7	0	0	110.4	L396 A397 C402 D403 I404	L396-Q400 PolarHBondContact O-N 3.04Å; A397-Q400 WeakPolarHBondContact O-CA 3.33Å; A397-Q400 WeakPolarHBondContact O-CB 3.36Å; A397-Q400 PolarHBondContact O-N 2.86Å; Q400-C402 PolarHBondContact O-N 3.45Å; Q400-D403 PolarHBondContact O-N 2.83Å; Q400-I404 VanDerWaalsContact O-CG1 3.29Å; Q400-I404 WeakPolarHBondContact O-CG1 3.28Å; Q400-I404 PolarHBondContact O-N 3.03Å
401	E	97.9	Very high	96.9	Very high	46 Å²	46	55.5 Å²	55.5	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-43.5	173.7	-58	-72.1	121.4	0	0	112.1	H26 S41 V49 A397 R399 D403 A405	H26-E401 IonicContact CD2-OE2 2.69Å; H26-E401 IonicContact NE2-OE2 2.64Å; S41-E401 WeakPolarHBondContact CB-OE2 3.34Å; S41-E401 PolarHBondContact OG-OE2 2.83Å; V49-E401 HydrophobicContact CB-CG 4.09Å; V49-E401 HydrophobicContact CG1-CG 3.95Å; A397-E401 WeakPolarHBondContact O-CG 3.3Å; A397-E401 PolarHBondContact O-N 3.08Å; R399-E401 VanDerWaalsContact C-N 3.31Å; R399-E401 PolarHBondContact O-N 2.85Å; E401-D403 VanDerWaalsContact C-N 3.33Å; E401-D403 PolarHBondContact O-N 3.01Å; E401-A405 VanDerWaalsContact O-CB 3.32Å; E401-A405 WeakPolarHBondContact O-CB 3.21Å; E401-A405 PolarHBondContact O-N 3.03Å
402	C	97.4	Very high	96.6	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.027	29%	0.289	C	S	.	.	H	α-helix	trans	-59	-43.2	174.5	-63.8	0	0	0	0	112.3	S39 G51 A398 R399 Q400 A405 R406	S39-C402 PolarHBondContact O-SG 3.24Å; S39-C402 WeakPolarHBondContact OG-CB 3.45Å; S39-C402 PolarHBondContact OG-SG 2.85Å; G51-C402 VanDerWaalsContact CA-SG 3.53Å; G51-C402 PolarHBondContact N-SG 3.46Å; A398-C402 PolarHBondContact O-N 3.07Å; A398-C402 PolarHBondContact O-SG 2.81Å; R399-C402 WeakPolarHBondContact O-CB 3.36Å; R399-C402 PolarHBondContact O-N 3.06Å; Q400-C402 PolarHBondContact O-N 3.45Å; C402-A405 WeakPolarHBondContact O-CB 3.45Å; C402-A405 PolarHBondContact O-N 3.39Å; C402-R406 WeakPolarHBondContact O-CG 3.41Å; C402-R406 PolarHBondContact O-N 3.08Å
403	D	97.1	Very high	96.3	Very high	92 Å²	92	57.2 Å²	57.2	49%	0.492	28%	0.283	S	S	.	.	H	α-helix	trans	-79.2	-31.3	-171.8	-66.2	-24.6	0	0	0	111.6	R399 Q400 E401 R406 A407	R399-D403 VanDerWaalsContact O-CG 3.3Å; R399-D403 PolarHBondContact O-N 3.12Å; Q400-D403 PolarHBondContact O-N 2.83Å; E401-D403 VanDerWaalsContact C-N 3.33Å; E401-D403 PolarHBondContact O-N 3.01Å; D403-R406 PolarHBondContact O-N 3.19Å; D403-R406 IonicContact OD1-NH1 2.73Å; D403-R406 PolarHBondContact OD1-NH1 3.34Å; D403-A407 PolarHBondContact O-N 3.01Å
404	I	97.1	Very high	96	Very high	71 Å²	71	55.6 Å²	55.6	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-48.1	164.1	-64.4	163.9	0	0	0	110	H26 Q400 R406 A407 V408	H26-I404 HydrophobicContact CB-CG2 4.07Å; Q400-I404 VanDerWaalsContact O-CG1 3.29Å; Q400-I404 WeakPolarHBondContact O-CG1 3.28Å; Q400-I404 PolarHBondContact O-N 3.03Å; I404-R406 VanDerWaalsContact C-N 3.26Å; I404-R406 PolarHBondContact O-N 2.85Å; I404-A407 PolarHBondContact O-N 3.19Å; I404-A407 VanDerWaalsContact O-N 3.13Å; I404-V408 HydrophobicContact CG2-CG2 4.37Å; I404-V408 WeakPolarHBondContact O-CG2 3.22Å; I404-V408 PolarHBondContact O-N 2.83Å
405	A	97.1	Very high	95.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-35	176.2	0	0	0	0	0	112.8	H26 I28 E401 C402 A409	H26-A405 HydrophobicContact CB-CB 4.17Å; I28-A405 HydrophobicContact CG1-CB 4.48Å; E401-A405 VanDerWaalsContact O-CB 3.32Å; E401-A405 WeakPolarHBondContact O-CB 3.21Å; E401-A405 PolarHBondContact O-N 3.03Å; C402-A405 WeakPolarHBondContact O-CB 3.45Å; C402-A405 PolarHBondContact O-N 3.39Å; A405-A409 VanDerWaalsContact O-CB 3.24Å; A405-A409 WeakPolarHBondContact O-CB 3.05Å; A405-A409 PolarHBondContact O-N 3.04Å
406	R	95.4	Very high	95.1	Very high	33 Å²	33	63.4 Å²	63.4	13%	0.125	32%	0.324	C	S	.	.	H	α-helix	trans	-72	-32.5	174.4	-75.8	-179	-171.7	100.5	18.8	114	I28 E37 S39 C402 D403 I404 R410 Q418	I28-R406 HydrophobicContact CD1-CG 3.84Å; E37-R406 IonicContact OE1-CZ 3.61Å; E37-R406 IonicContact OE1-NE 2.74Å; E37-R406 IonicContact OE1-NH2 3.92Å; E37-R406 PolarHBondContact OE1-NH2 3.04Å; S39-R406 PolarHBondContact OG-NH2 3.06Å; C402-R406 WeakPolarHBondContact O-CG 3.41Å; C402-R406 PolarHBondContact O-N 3.08Å; D403-R406 PolarHBondContact O-N 3.19Å; D403-R406 IonicContact OD1-NH1 2.73Å; D403-R406 PolarHBondContact OD1-NH1 3.34Å; I404-R406 VanDerWaalsContact C-N 3.26Å; I404-R406 PolarHBondContact O-N 2.85Å; R406-R410 WeakPolarHBondContact O-CD 3.4Å; R406-R410 VanDerWaalsContact O-CG 3.28Å; R406-R410 WeakPolarHBondContact O-CG 3.42Å; R406-R410 PolarHBondContact O-N 3.5Å; R406-R410 PolarHBondContact O-NE 2.83Å; R406-Q418 PolarHBondContact O-NE2 2.86Å
407	A	95.1	Very high	94.6	Very high	39 Å²	39	65.5 Å²	65.5	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-54.6	171.3	0	0	0	0	0	110.4	D403 I404 A409 R410 E411	D403-A407 PolarHBondContact O-N 3.01Å; I404-A407 PolarHBondContact O-N 3.19Å; I404-A407 VanDerWaalsContact O-N 3.13Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 3.06Å; A407-R410 WeakPolarHBondContact O-CB 3.42Å; A407-R410 PolarHBondContact O-N 3.49Å; A407-E411 PolarHBondContact O-N 2.84Å
408	V	94.9	Very high	94.2	Very high	34 Å²	34	65 Å²	65	21%	0.206	32%	0.318	C	S	.	.	H	α-helix	trans	-54.3	-43.8	177.6	170.1	0	0	0	0	111.8	H26 I404 R410 E411 L412	H26-V408 HydrophobicContact CB-CG2 4.4Å; I404-V408 HydrophobicContact CG2-CG2 4.37Å; I404-V408 WeakPolarHBondContact O-CG2 3.22Å; I404-V408 PolarHBondContact O-N 2.83Å; V408-R410 VanDerWaalsContact C-N 3.31Å; V408-R410 PolarHBondContact O-N 2.86Å; V408-E411 PolarHBondContact O-N 3.33Å; V408-L412 HydrophobicContact CG1-CD1 3.6Å; V408-L412 HydrophobicContact CG1-CG 4.3Å; V408-L412 WeakPolarHBondContact O-CB 3.49Å; V408-L412 VanDerWaalsContact O-CG 3.25Å; V408-L412 WeakPolarHBondContact O-CG 3.44Å; V408-L412 PolarHBondContact O-N 3.11Å
409	A	94.5	Very high	93.7	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-31.8	178.1	0	0	0	0	0	113.6	C15 I28 A405 A407 S413 F416	C15-A409 HydrophobicContact CB-CB 4.22Å; I28-A409 HydrophobicContact CD1-CB 3.68Å; I28-A409 HydrophobicContact CG1-CB 4.05Å; A405-A409 VanDerWaalsContact O-CB 3.24Å; A405-A409 WeakPolarHBondContact O-CB 3.05Å; A405-A409 PolarHBondContact O-N 3.04Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 3.06Å; A409-S413 CarbonylContact O-C 3.52Å; A409-S413 PolarHBondContact O-N 2.86Å; A409-F416 HydrophobicContact CB-CD1 4.24Å
410	R	93.8	Very high	93.2	Very high	133 Å²	133	60.2 Å²	60.2	50%	0.502	30%	0.301	S	S	.	.	H	α-helix	trans	-76.7	-35.8	175.7	-69.3	166.5	-162.9	147	8.7	112.3	R406 A407 V408 P414	R406-R410 WeakPolarHBondContact O-CD 3.4Å; R406-R410 VanDerWaalsContact O-CG 3.28Å; R406-R410 WeakPolarHBondContact O-CG 3.42Å; R406-R410 PolarHBondContact O-N 3.5Å; R406-R410 PolarHBondContact O-NE 2.83Å; A407-R410 WeakPolarHBondContact O-CB 3.42Å; A407-R410 PolarHBondContact O-N 3.49Å; V408-R410 VanDerWaalsContact C-N 3.31Å; V408-R410 PolarHBondContact O-N 2.86Å; R410-P414 WeakPolarHBondContact O-CA 3.46Å; R410-P414 WeakPolarHBondContact O-CD 3.32Å; R410-P414 WeakPolarHBondContact O-CG 3.34Å
411	E	93.9	Very high	92.7	Very high	155 Å²	155	56.1 Å²	56.1	72%	0.724	29%	0.286	S	S	*	.	H	α-helix	trans	-66.8	-37.9	174.8	-70	170.6	-169.5	0	0	111.6	A407 V408	A407-E411 PolarHBondContact O-N 2.84Å; V408-E411 PolarHBondContact O-N 3.33Å
412	L	93.4	Very high	92.3	Very high	67 Å²	67	56 Å²	56	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-84.4	-28.3	-179.7	-65	173.9	0	0	0	114.1	G16 V408	G16-L412 WeakPolarHBondContact O-CD1 3.41Å; V408-L412 HydrophobicContact CG1-CD1 3.6Å; V408-L412 HydrophobicContact CG1-CG 4.3Å; V408-L412 WeakPolarHBondContact O-CB 3.49Å; V408-L412 VanDerWaalsContact O-CG 3.25Å; V408-L412 WeakPolarHBondContact O-CG 3.44Å; V408-L412 PolarHBondContact O-N 3.11Å
413	S	92.4	Very high	92	Very high	18 Å²	18	56.9 Å²	56.9	13%	0.126	29%	0.289	C	S	.	.			trans	-154.8	88.8	179	-165.3	0	0	0	0	110.5	A409 D415 F416	A409-S413 CarbonylContact O-C 3.52Å; A409-S413 PolarHBondContact O-N 2.86Å; S413-D415 PolarHBondContact O-N 2.96Å; S413-F416 VanDerWaalsContact O-CB 3.24Å; S413-F416 WeakPolarHBondContact O-CB 3.39Å; S413-F416 PolarHBondContact O-N 2.89Å
414	P	90.6	Very high	91.4	Very high	104 Å²	104	54.8 Å²	54.8	68%	0.675	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-35.4	-177.1	-28.3	35.4	0	0	0	114.2	R410 F416	R410-P414 WeakPolarHBondContact O-CA 3.46Å; R410-P414 WeakPolarHBondContact O-CD 3.32Å; R410-P414 WeakPolarHBondContact O-CG 3.34Å; P414-F416 VanDerWaalsContact C-N 3.26Å; P414-F416 PolarHBondContact O-N 2.66Å
415	D	89.4	Confident	91	Very high	151 Å²	151	57.5 Å²	57.5	81%	0.807	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	2.2	179.8	-52.2	-60.3	0	0	0	113.8	S413 Y417	S413-D415 PolarHBondContact O-N 2.96Å; D415-Y417 PolarHBondContact O-N 2.87Å
416	F	87.6	Confident	90.3	Very high	19 Å²	19	62.4 Å²	62.4	8%	0.083	31%	0.312	C	S	.	.			trans	-75.1	108.2	-179.6	177.2	-116.3	0	0	0	111.8	T13 C15 I28 T30 A409 S413 P414 Q418	T13-F416 HydrophobicContact CG2-CD2 3.93Å; T13-F416 HydrophobicContact CG2-CE2 3.41Å; T13-F416 VanDerWaalsContact CG2-CE2 3.41Å; T13-F416 HydrophobicContact CG2-CZ 4.17Å; C15-F416 HydrophobicContact CB-CD1 3.78Å; C15-F416 HydrophobicContact CB-CE1 3.86Å; C15-F416 HydrophobicContact CB-CG 4.16Å; C15-F416 HydrophobicContact CB-CZ 4.32Å; I28-F416 HydrophobicContact CB-CE1 3.93Å; I28-F416 HydrophobicContact CD1-CE1 4.14Å; I28-F416 HydrophobicContact CG2-CE1 3.81Å; I28-F416 HydrophobicContact CG2-CZ 4.08Å; T30-F416 HydrophobicContact CG2-CZ 4.3Å; A409-F416 HydrophobicContact CB-CD1 4.24Å; S413-F416 VanDerWaalsContact O-CB 3.24Å; S413-F416 WeakPolarHBondContact O-CB 3.39Å; S413-F416 PolarHBondContact O-N 2.89Å; P414-F416 VanDerWaalsContact C-N 3.26Å; P414-F416 PolarHBondContact O-N 2.66Å; F416-Q418 HydrophobicContact CD1-CG 4.16Å; F416-Q418 HydrophobicContact CE1-CG 4.25Å; F416-Q418 PolarHBondContact O-N 2.92Å
417	Y	87.9	Confident	89.6	Confident	142 Å²	142	63.1 Å²	63.1	56%	0.557	32%	0.315	S	S	*	.			trans	-65.9	128.3	175.5	176.7	-118.7	0	0	0	112	D415 P419 D422	D415-Y417 PolarHBondContact O-N 2.87Å; Y417-P419 HydrophobicContact CD1-CB 4.34Å; Y417-P419 HydrophobicContact CE1-CB 3.7Å; Y417-P419 WeakPolarHBondContact O-CD 3.37Å; Y417-D422 WeakPolarHBondContact CE2-OD2 3.46Å; Y417-D422 PolarHBondContact OH-OD2 2.9Å; Y417-D422 VanDerWaalsContact OH-OD2 3.07Å
418	Q	89.4	Confident	88.4	Confident	21 Å²	21	67.9 Å²	67.9	10%	0.098	33%	0.328	C	S	.	.			trans	-107.6	98.2	-178.6	-60.3	177	-4.4	0	0	108.5	I28 R406 F416 P421	I28-Q418 HydrophobicContact CD1-CG 3.75Å; R406-Q418 PolarHBondContact O-NE2 2.86Å; F416-Q418 HydrophobicContact CD1-CG 4.16Å; F416-Q418 HydrophobicContact CE1-CG 4.25Å; F416-Q418 PolarHBondContact O-N 2.92Å; Q418-P421 WeakPolarHBondContact O-CD 3.48Å
419	P	88.3	Confident	87	Confident	5 Å²	5	71.5 Å²	71.5	3%	0.032	34%	0.343	C	S	.	.			trans	-78.8	-19.3	-169.9	30.5	-35.7	0	0	0	114.6	T30 E37 Y417 D422 Y423	T30-P419 HydrophobicContact CG2-CG 3.8Å; E37-P419 HydrophobicContact CB-CG 4.37Å; E37-P419 WeakPolarHBondContact OE2-CD 3.38Å; Y417-P419 HydrophobicContact CD1-CB 4.34Å; Y417-P419 HydrophobicContact CE1-CB 3.7Å; Y417-P419 WeakPolarHBondContact O-CD 3.37Å; P419-D422 PolarHBondContact O-N 3.26Å; P419-Y423 HydrophobicContact CB-CD2 4.42Å; P419-Y423 HydrophobicContact CB-CE2 3.76Å; P419-Y423 HydrophobicContact CG-CE2 4.11Å; P419-Y423 WeakPolarHBondContact O-CD2 3.37Å; P419-Y423 PolarHBondContact O-N 2.9Å; P419-Y423 VanDerWaalsContact O-N 3.08Å
420	G	86.4	Confident	85.3	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-55.1	-51.1	-177.4	0	0	0	0	0	114.1	E37 D422 Y423 V424	E37-G420 WeakPolarHBondContact OE2-CA 3.38Å; E37-G420 PolarHBondContact OE2-N 2.84Å; G420-D422 PolarHBondContact O-N 3.19Å; G420-Y423 PolarHBondContact O-N 3.21Å; G420-V424 WeakPolarHBondContact O-CG2 3.4Å; G420-V424 PolarHBondContact O-N 3.2Å; G420-V424 VanDerWaalsContact O-N 3.15Å
421	P	87.9	Confident	83.4	Confident	44 Å²	44	74.6 Å²	74.6	29%	0.286	38%	0.378	S	S	.	.	H	α-helix	trans	-52.9	-33.9	173.4	-29.8	36.3	0	0	0	114.5	Q418 K425	Q418-P421 WeakPolarHBondContact O-CD 3.48Å; P421-K425 WeakPolarHBondContact O-CG 3.48Å; P421-K425 PolarHBondContact O-N 2.75Å
422	D	89	Confident	81.1	Confident	42 Å²	42	71 Å²	71	23%	0.225	37%	0.367	C	S	.	.	H	α-helix	trans	-81.9	-37.4	-177.6	-70.5	-24.4	0	0	0	112.5	Y417 P419 G420 V424 K425 Q426	Y417-D422 WeakPolarHBondContact CE2-OD2 3.46Å; Y417-D422 PolarHBondContact OH-OD2 2.9Å; Y417-D422 VanDerWaalsContact OH-OD2 3.07Å; P419-D422 PolarHBondContact O-N 3.26Å; G420-D422 PolarHBondContact O-N 3.19Å; D422-V424 PolarHBondContact O-N 2.8Å; D422-K425 PolarHBondContact O-N 3.2Å; D422-K425 VanDerWaalsContact O-N 3.14Å; D422-K425 WeakPolarHBondContact OD1-CD 3.46Å; D422-K425 VanDerWaalsContact OD1-CE 3.32Å; D422-K425 WeakPolarHBondContact OD1-CE 3.37Å; D422-K425 IonicContact OD1-NZ 3.79Å; D422-K425 PolarHBondContact OD1-NZ 2.91Å; D422-Q426 VanDerWaalsContact O-CG 3.3Å; D422-Q426 WeakPolarHBondContact O-CG 3.39Å; D422-Q426 PolarHBondContact O-N 3.26Å
423	Y	89.8	Confident	78.6	Confident	23 Å²	23	71.8 Å²	71.8	9%	0.09	37%	0.372	C	S	.	.	H	α-helix	trans	-58.3	-36.4	168.5	-58.3	-42.1	0	0	0	112.2	G34 G36 T53 P55 G57 P419 G420 R427	G34-Y423 PolarHBondContact O-OH 2.99Å; G36-Y423 PolarHBondContact N-OH 3.47Å; T53-Y423 HydrophobicContact CG2-CD2 4.12Å; P55-Y423 HydrophobicContact CB-CD1 4.27Å; P55-Y423 HydrophobicContact CB-CE1 3.91Å; P55-Y423 HydrophobicContact CG-CE1 4.42Å; P55-Y423 HydrophobicContact CG-CE2 4.37Å; P55-Y423 WeakPolarHBondContact O-CD1 3.35Å; G57-Y423 WeakPolarHBondContact CA-O 3.36Å; P419-Y423 HydrophobicContact CB-CD2 4.42Å; P419-Y423 HydrophobicContact CB-CE2 3.76Å; P419-Y423 HydrophobicContact CG-CE2 4.11Å; P419-Y423 WeakPolarHBondContact O-CD2 3.37Å; P419-Y423 PolarHBondContact O-N 2.9Å; P419-Y423 VanDerWaalsContact O-N 3.08Å; G420-Y423 PolarHBondContact O-N 3.21Å; Y423-R427 PolarHBondContact O-N 2.7Å
424	V	86.1	Confident	76.2	Confident	48 Å²	48	75.3 Å²	75.3	29%	0.291	40%	0.401	S	S	.	.	H	α-helix	trans	-65.9	-44.3	174.9	173.7	0	0	0	0	111.1	T53 T59 G420 D422 F428	T53-V424 HydrophobicContact CG2-CG2 3.92Å; T59-V424 HydrophobicContact CG2-CG2 4.13Å; G420-V424 WeakPolarHBondContact O-CG2 3.4Å; G420-V424 PolarHBondContact O-N 3.2Å; G420-V424 VanDerWaalsContact O-N 3.15Å; D422-V424 PolarHBondContact O-N 2.8Å; V424-F428 HydrophobicContact CG1-CD2 4.22Å; V424-F428 HydrophobicContact CG1-CE2 3.79Å; V424-F428 WeakPolarHBondContact O-CD2 3.01Å
425	K	87.5	Confident	74.1	Confident	129 Å²	129	79.4 Å²	79.4	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-61.7	-49	176.9	-67.2	166.4	-160.2	167.8	0	112.1	P421 D422 R427 F428 Q429	P421-K425 WeakPolarHBondContact O-CG 3.48Å; P421-K425 PolarHBondContact O-N 2.75Å; D422-K425 PolarHBondContact O-N 3.2Å; D422-K425 VanDerWaalsContact O-N 3.14Å; D422-K425 WeakPolarHBondContact OD1-CD 3.46Å; D422-K425 VanDerWaalsContact OD1-CE 3.32Å; D422-K425 WeakPolarHBondContact OD1-CE 3.37Å; D422-K425 IonicContact OD1-NZ 3.79Å; D422-K425 PolarHBondContact OD1-NZ 2.91Å; K425-R427 VanDerWaalsContact C-N 3.32Å; K425-R427 PolarHBondContact O-N 3.38Å; K425-F428 PolarHBondContact O-N 2.65Å; K425-Q429 PolarHBondContact O-N 3.34Å; K425-Q429 VanDerWaalsContact O-N 3.11Å
426	Q	83.5	Confident	71.6	Confident	102 Å²	102	79.5 Å²	79.5	48%	0.477	40%	0.404	S	S	.	.	H	α-helix	trans	-53.5	-47.3	-176.6	-74.3	166.4	2.5	0	0	111.8	D422 F428 Q429 E430	D422-Q426 VanDerWaalsContact O-CG 3.3Å; D422-Q426 WeakPolarHBondContact O-CG 3.39Å; D422-Q426 PolarHBondContact O-N 3.26Å; Q426-F428 VanDerWaalsContact C-N 3.27Å; Q426-F428 PolarHBondContact O-N 3.16Å; Q426-Q429 PolarHBondContact O-N 3.2Å; Q426-Q429 VanDerWaalsContact O-N 3.08Å; Q426-E430 PolarHBondContact O-N 3.18Å
427	R	79.5	Confident	68.8	Low	48 Å²	48	86 Å²	86	18%	0.181	44%	0.44	C	S	.	.	H	α-helix	trans	-62	-28.6	177.4	173.5	179.9	162.6	-125.7	-11.6	114.2	G57 G78 Y423 K425	G57-R427 VanDerWaalsContact C-CD 3.45Å; G57-R427 WeakPolarHBondContact O-CD 3.45Å; G57-R427 PolarHBondContact O-NH1 2.98Å; G78-R427 PolarHBondContact O-NH2 3.31Å; Y423-R427 PolarHBondContact O-N 2.7Å; K425-R427 VanDerWaalsContact C-N 3.32Å; K425-R427 PolarHBondContact O-N 3.38Å
428	F	70.3	Confident	66.5	Low	139 Å²	139	84.7 Å²	84.7	61%	0.61	45%	0.449	S	S	*	.	H	α-helix	trans	-75.6	-38.9	173.1	-74.6	-66	0	0	0	111.5	V424 K425 Q426 G431 V432	V424-F428 HydrophobicContact CG1-CD2 4.22Å; V424-F428 HydrophobicContact CG1-CE2 3.79Å; V424-F428 WeakPolarHBondContact O-CD2 3.01Å; K425-F428 PolarHBondContact O-N 2.65Å; Q426-F428 VanDerWaalsContact C-N 3.27Å; Q426-F428 PolarHBondContact O-N 3.16Å; F428-G431 PolarHBondContact O-N 3.28Å; F428-V432 PolarHBondContact O-N 2.89Å
429	Q	66.6	Low	64.1	Low	110 Å²	110	92.6 Å²	92.6	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-49.7	178.6	-165.5	61.3	51.2	0	0	112	K425 Q426 G431 V432 D433	K425-Q429 PolarHBondContact O-N 3.34Å; K425-Q429 VanDerWaalsContact O-N 3.11Å; Q426-Q429 PolarHBondContact O-N 3.2Å; Q426-Q429 VanDerWaalsContact O-N 3.08Å; Q429-G431 PolarHBondContact O-N 3.47Å; Q429-V432 PolarHBondContact O-N 2.65Å; Q429-D433 PolarHBondContact NE2-OD1 2.95Å; Q429-D433 VanDerWaalsContact O-CG 3.24Å; Q429-D433 PolarHBondContact O-N 3.06Å
430	E	58.6	Low	61.6	Low	141 Å²	141	101.3 Å²	101.3	66%	0.659	53%	0.526	S	S	*	.	H	α-helix	trans	-55.7	-27.5	174	-68.6	-179.1	162	0	0	113	Q426 A434	Q426-E430 PolarHBondContact O-N 3.18Å; E430-A434 WeakPolarHBondContact O-CB 3.46Å; E430-A434 PolarHBondContact O-N 3.18Å
431	G	52.7	Low	59.1	Low	57 Å²	57	110.6 Å²	110.6	59%	0.588	57%	0.566	S	S	*	*	H	α-helix	trans	-76.5	-17.6	176.3	0	0	0	0	0	114.9	F428 Q429	F428-G431 PolarHBondContact O-N 3.28Å; Q429-G431 PolarHBondContact O-N 3.47Å
432	V	45.6	Very low	56.7	Low	79 Å²	79	114.4 Å²	114.4	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-96.8	-46.9	175.5	176.9	0	0	0	0	110.4	F428 Q429 A434 K435	F428-V432 PolarHBondContact O-N 2.89Å; Q429-V432 PolarHBondContact O-N 2.65Å; V432-A434 PolarHBondContact O-N 2.87Å; V432-K435 WeakPolarHBondContact O-CA 3.23Å; V432-K435 VanDerWaalsContact O-CB 3.29Å; V432-K435 WeakPolarHBondContact O-CB 3.32Å; V432-K435 PolarHBondContact O-N 2.83Å
433	D	42.3	Very low	54.1	Low	85 Å²	85	118 Å²	118	46%	0.455	61%	0.614	S	S	.	*	H	α-helix	trans	-60.3	-30.7	-177.3	-56	-15.2	0	0	0	112	Q429 K435 E436	Q429-D433 PolarHBondContact NE2-OD1 2.95Å; Q429-D433 VanDerWaalsContact O-CG 3.24Å; Q429-D433 PolarHBondContact O-N 3.06Å; D433-K435 PolarHBondContact O-N 3.39Å; D433-E436 PolarHBondContact O-N 3.37Å
434	A	40.6	Very low	51.4	Low	91 Å²	91	126 Å²	126	75%	0.752	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	11.6	170.7	0	0	0	0	0	114.8	E430 V432	E430-A434 WeakPolarHBondContact O-CB 3.46Å; E430-A434 PolarHBondContact O-N 3.18Å; V432-A434 PolarHBondContact O-N 2.87Å
435	K	47	Very low	49	Very low	191 Å²	191	133.1 Å²	133.1	83%	0.83	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	-15.6	-178.8	-141.9	-173.1	178.2	-160.4	0	114.4	V432 D433	V432-K435 WeakPolarHBondContact O-CA 3.23Å; V432-K435 VanDerWaalsContact O-CB 3.29Å; V432-K435 WeakPolarHBondContact O-CB 3.32Å; V432-K435 PolarHBondContact O-N 2.83Å; D433-K435 PolarHBondContact O-N 3.39Å
436	E	36.5	Very low	46.6	Very low	153 Å²	153	132.6 Å²	132.6	72%	0.715	69%	0.689	S	S	*	*			trans	-97.6	91.8	167.5	-71.9	-160.6	138.3	0	0	109.9	D433 P438	D433-E436 PolarHBondContact O-N 3.37Å; E436-P438 WeakPolarHBondContact O-CD 3.3Å
437	N	29.8	Very low	44.3	Very low	156 Å²	156	133.7 Å²	133.7	83%	0.834	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-73.4	116.1	157.9	-144.8	43.7	0	0	0	105.9	E439	N437-E439 PolarHBondContact O-N 2.81Å
438	P	38.6	Very low	42	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-63.3	128.6	-179.9	-20.2	33	0	0	0	109.7	E436 E440	E436-P438 WeakPolarHBondContact O-CD 3.3Å; P438-E440 PolarHBondContact O-N 3.47Å
439	E	39.9	Very low	40.4	Very low	186 Å²	186	136.8 Å²	136.8	87%	0.869	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-63.8	127	172.9	-74.4	-172	123.3	0	0	109.8	N437 K441	N437-E439 PolarHBondContact O-N 2.81Å; E439-K441 PolarHBondContact O-N 2.83Å
440	E	34.8	Very low	38.7	Very low	188 Å²	188	140.8 Å²	140.8	88%	0.879	76%	0.758	S	S	*	*			trans	-68.9	89.9	-177.8	-171.5	177.1	-178.9	0	0	110.1	P438 V442	P438-E440 PolarHBondContact O-N 3.47Å; E440-V442 PolarHBondContact O-N 2.58Å
441	K	34.8	Very low	37.3	Very low	196 Å²	196	143 Å²	143	85%	0.852	77%	0.769	S	S	*	*			trans	-63.4	100.5	173.9	-85.1	-171.6	173.2	-179.6	0	110.2	E439	E439-K441 PolarHBondContact O-N 2.83Å
442	V	36.4	Very low	36.1	Very low	124 Å²	124	145.6 Å²	145.6	75%	0.752	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-51.7	125.2	170.2	-179.7	0	0	0	0	109.5	E440 E444	E440-V442 PolarHBondContact O-N 2.58Å; V442-E444 PolarHBondContact O-N 3.13Å
443	P	34.6	Very low	36	Very low	117 Å²	117	146.9 Å²	146.9	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.8	120.5	178.4	29	-33.2	0	0	0	110.9
444	E	33.3	Very low	35.5	Very low	193 Å²	193	150.8 Å²	150.8	90%	0.902	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65.5	143.2	171.1	-66.1	-173	120.7	0	0	111.3	V442	V442-E444 PolarHBondContact O-N 3.13Å
445	K	36.2	Very low	34.9	Very low	197 Å²	197	154.5 Å²	154.5	86%	0.857	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-98.6	147.3	168.9	-91.5	-172.7	173.3	-178.1	0	110.7
446	P	36.4	Very low	34	Very low	117 Å²	117	154.5 Å²	154.5	76%	0.76	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.8	155.4	179.8	29.8	-36	0	0	0	112.5
447	P	35.3	Very low	33.5	Very low	125 Å²	125	158.1 Å²	158.1	81%	0.812	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-86.8	145	-170.6	33.6	-36	0	0	0	114.4
448	T	32.3	Very low	33.3	Very low	137 Å²	137	160.7 Å²	160.7	84%	0.84	81%	0.809	S	S	*	*			trans	-137.1	128	162.3	52.2	0	0	0	0	109.4
449	P	36.2	Very low	32.8	Very low	115 Å²	115	158.2 Å²	158.2	75%	0.747	81%	0.805	S	S	*	*			trans	-98.8	154.4	-165	37.3	-36.4	0	0	0	115.5
450	K	31.4	Very low	32.2	Very low	195 Å²	195	156.2 Å²	156.2	85%	0.848	81%	0.805	S	S	*	*			trans	58.6	114.2	159	-62.1	172	-178.8	-177.9	0	117.7
451	E	28.1	Very low	32.3	Very low	187 Å²	187	153.4 Å²	153.4	87%	0.874	80%	0.801	S	S	*	*				-166.8	-162.2	81.1	-131.7	165.1	-146.4	0	0	111.5
452	S	28.3	Very low	32.5	Very low	111 Å²	111	149.8 Å²	149.8	78%	0.776	80%	0.798	S	S	*	*			trans	-99.6	-156.8	-155.2	-50.9	0	0	0	0	115.1
453	P	43.4	Very low	33.2	Very low	106 Å²	106	149.2 Å²	149.2	69%	0.688	80%	0.797	S	S	*	*				-106.6	170.8	-126.7	39.5	-24.8	0	0	0	115.2
454	H	30.8	Very low	32.9	Very low	168 Å²	168	155.4 Å²	155.4	78%	0.778	81%	0.805	S	S	*	*				175.9	143	128.3	-104.7	-85.5	0	0	0	115.6
455	F	28	Very low	33	Very low	169 Å²	169	151.3 Å²	151.3	74%	0.741	80%	0.798	S	S	*	*			trans	39.8	115.4	142.3	-93.2	-120.5	0	0	0	124.5
456	Y	28.1	Very low	33.5	Very low	190 Å²	190	147.2 Å²	147.2	75%	0.745	79%	0.791	S	S	*	*				69.7	128.5	119.4	-113.6	-74.4	0	0	0	124.5
457	R	26.4	Very low	33.2	Very low	229 Å²	229	149.7 Å²	149.7	86%	0.864	79%	0.793	S	S	*	*			trans	97.9	145.4	139.9	-131.9	167.5	-176.9	158	1.3	121.2
458	K	25.6	Very low	33	Very low	210 Å²	210	147.4 Å²	147.4	91%	0.913	78%	0.784	S	S	*	*			trans	-71.8	151.5	175.9	-53.8	174.8	176.4	-177.3	0	112.5
459	G	27.9	Very low	33.1	Very low	63 Å²	63	145.9 Å²	145.9	65%	0.649	78%	0.779	S	S	*	*			trans	169.2	138.1	151.2	0	0	0	0	0	117.3
460	T	27.1	Very low	33.6	Very low	143 Å²	143	146.2 Å²	146.2	88%	0.877	78%	0.781	S	S	*	*			trans	54.2	110.9	145.2	54.8	0	0	0	0	121.7
461	T	36.9	Very low	33.7	Very low	129 Å²	129	145.7 Å²	145.7	79%	0.791	78%	0.779	S	S	*	*			trans	-57.4	164.2	135.9	42	0	0	0	0	110.7
462	P	39.8	Very low	33.9	Very low	121 Å²	121	144.9 Å²	144.9	79%	0.786	78%	0.775	S	S	*	*			cis	-142.6	-125.4	44	30.7	-1.2	0	0	0	116.4
463	P	51.8	Low	34.1	Very low	112 Å²	112	143.4 Å²	143.4	73%	0.727	76%	0.764	S	S	*	*				-131.6	164.5	-104.6	41.3	-24.9	0	0	0	117.1
464	R	28.7	Very low	33.6	Very low	246 Å²	246	146.6 Å²	146.6	93%	0.928	77%	0.77	S	S	*	*			trans	-174.7	153	140.9	-113.8	175	170.9	175.7	-4.4	116.1
465	S	34.7	Very low	33.6	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	77%	0.77	S	S	*	*			trans	-110.2	177.1	151.2	-39.8	0	0	0	0	107.4
466	P	46.1	Very low	34.5	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	77%	0.773	S	S	*	*			cis	-124.9	-165.6	36.7	40.6	-21.8	0	0	0	112.4
467	E	30.1	Very low	34.5	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.794	78%	0.779	S	S	*	*			cis	-148.7	-163.2	12.7	-153	33.8	-79.7	0	0	106.9
468	A	30.9	Very low	34.6	Very low	76 Å²	76	134.1 Å²	134.1	63%	0.628	78%	0.777	S	S	*	*			cis	-158.2	-166.4	9.4	0	0	0	0	0	111.8
469	S	35.1	Very low	35	Very low	106 Å²	106	129.3 Å²	129.3	74%	0.741	77%	0.769	S	S	*	*			trans	-158.1	160.3	169.3	-68.6	0	0	0	0	111.7
470	P	46.9	Very low	35.7	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	78%	0.777	S	S	*	*				-138.7	147	102.1	34.6	-21	0	0	0	112.8
471	K	32.6	Very low	36.1	Very low	185 Å²	185	134.4 Å²	134.4	80%	0.804	77%	0.774	S	S	*	*			cis	86.6	115.4	43.2	-80.7	-170.3	174.5	178.2	0	115.7
472	H	33.3	Very low	36.4	Very low	170 Å²	170	134.4 Å²	134.4	79%	0.787	78%	0.777	S	S	*	*			trans	157.2	107.7	137.3	-89.4	-70.4	0	0	0	108.6
473	S	32.9	Very low	35.9	Very low	79 Å²	79	135.5 Å²	135.5	55%	0.552	78%	0.775	S	S	*	*				77.2	143.4	75.9	73.6	0	0	0	0	113.4
474	H	31.2	Very low	34.9	Very low	174 Å²	174	139 Å²	139	81%	0.806	78%	0.778	S	S	*	*			cis	-141	174.8	22	-69.9	-97.9	0	0	0	114.3
475	S	31.5	Very low	34.9	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	77%	0.771	S	S	*	*			trans	-137.2	170.2	160.6	61.4	0	0	0	0	110.1
476	P	46	Very low	34.6	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	77%	0.771	S	S	*	*			trans	-128.1	150.2	154.6	36.1	-24.7	0	0	0	114.8
477	T	28.5	Very low	33.8	Very low	142 Å²	142	140.2 Å²	140.2	87%	0.871	78%	0.775	S	S	*	*			trans	-75.6	175.5	171	3	0	0	0	0	111
478	S	29.8	Very low	34.6	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	78%	0.777	S	S	*	*			cis	-160	-171.7	32.4	58.2	0	0	0	0	112.9
479	S	33.9	Very low	34.6	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	78%	0.783	S	S	*	*			trans	-129.4	169.4	179.2	61	0	0	0	0	112.4
480	P	42.4	Very low	34.4	Very low	125 Å²	125	140.7 Å²	140.7	81%	0.812	79%	0.79	S	S	*	*			trans	-140.9	171.2	136.2	37.9	-24.7	0	0	0	115.3
481	K	34.9	Very low	33.5	Very low	189 Å²	189	138.2 Å²	138.2	82%	0.822	79%	0.786	S	S	*	*			trans	-115.8	163.8	168.6	-69.7	177.8	178.1	175.9	0	110.4
482	P	43.4	Very low	33.3	Very low	129 Å²	129	134.2 Å²	134.2	84%	0.838	79%	0.788	S	S	*	*			trans	-127.4	-165	134.4	36.6	-27.2	0	0	0	113.5
483	L	29.7	Very low	33.1	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	79%	0.793	S	S	*	*			trans	-152.3	136.2	-148.1	-109.4	148.5	0	0	0	116.4
484	K	30.8	Very low	32.9	Very low	184 Å²	184	142.3 Å²	142.3	80%	0.8	81%	0.812	S	S	*	*			trans	73.6	157.1	142.3	-112	176.5	-174	174.8	0	122
485	K	28.3	Very low	32.7	Very low	178 Å²	178	140.6 Å²	140.6	77%	0.774	81%	0.809	S	S	*	*			trans	76.9	150.7	167.1	-66.4	172.2	161.1	-167.6	0	116.3
486	Q	29	Very low	32.7	Very low	161 Å²	161	143 Å²	143	75%	0.752	81%	0.808	S	S	*	*			cis	-154.4	165.4	-8.7	-125.6	164.5	-67.7	0	0	112.1
487	N	29.7	Very low	31.9	Very low	151 Å²	151	142.1 Å²	142.1	81%	0.807	80%	0.796	S	S	*	*			trans	-88.4	157.1	168.4	-111	10	0	0	0	110.4
488	P	46	Very low	32	Very low	126 Å²	126	142 Å²	142	82%	0.818	78%	0.784	S	S	*	*				-153.7	179.7	85.6	41.9	-21.9	0	0	0	118.8
489	S	30.6	Very low	32	Very low	110 Å²	110	147.2 Å²	147.2	77%	0.769	79%	0.785	S	S	*	*			trans	-60.7	151.5	-173.2	53.9	0	0	0	0	121.9
490	S	31.6	Very low	31.8	Very low	126 Å²	126	146.4 Å²	146.4	88%	0.881	78%	0.78	S	S	*	*				-176.8	161.8	127.1	44.9	0	0	0	0	109.7
491	G	27.3	Very low	31.2	Very low	69 Å²	69	146.4 Å²	146.4	71%	0.711	78%	0.777	S	S	*	*			cis	171.4	136	-9.5	0	0	0	0	0	111.6
492	A	28.7	Very low	31	Very low	101 Å²	101	141.6 Å²	141.6	84%	0.835	77%	0.773	S	S	*	*			trans	62.2	148	-178.8	0	0	0	0	0	116.1
493	R	28.2	Very low	30.4	Very low	240 Å²	240	142 Å²	142	91%	0.906	77%	0.767	S	S	*	*			cis	72.5	104.1	23.8	-71.3	-167.4	176.6	-171.2	1.2	117.2
494	L	28.3	Very low	30.5	Very low	179 Å²	179	142.2 Å²	142.2	94%	0.937	77%	0.765	S	S	*	*				-149.1	178.9	113.6	-146.6	58	0	0	0	111.1
495	N	27.6	Very low	30.5	Very low	139 Å²	139	140.6 Å²	140.6	74%	0.743	76%	0.76	S	S	*	*			trans	-147.6	-179.7	-173.9	-172.4	7.3	0	0	0	107.1
496	Q	31.8	Very low	30.6	Very low	160 Å²	160	137.5 Å²	137.5	75%	0.748	76%	0.756	S	S	*	*			trans	77.7	148.5	177.4	-55.3	178.7	-18.1	0	0	114.6
497	D	28.9	Very low	30.5	Very low	105 Å²	105	136.7 Å²	136.7	56%	0.561	76%	0.762	S	S	*	*			cis	-152.9	151.8	-7	-126.4	-4.6	0	0	0	115.2
498	K	31.3	Very low	30.5	Very low	140 Å²	140	133.5 Å²	133.5	61%	0.609	76%	0.757	S	S	*	*			trans	34.6	139.5	136.8	-74.3	175.5	-161.8	82.1	0	123.3
499	R	29.1	Very low	29.7	Very low	227 Å²	227	135.3 Å²	135.3	86%	0.857	76%	0.758	S	S	*	*			trans	75.7	154.2	135	-77.5	-177.6	168.4	-179.7	-6.1	118.7
500	S	29.6	Very low	29.6	Very low	91 Å²	91	135.5 Å²	135.5	64%	0.636	75%	0.754	S	S	*	*			cis	-171.5	148.2	-21	48	0	0	0	0	113.8
501	V	30.1	Very low	29.6	Very low	126 Å²	126	136 Å²	136	76%	0.764	75%	0.747	S	S	*	*			trans	35.2	110.2	133.6	-173.4	0	0	0	0	119
502	A	30.7	Very low	29.6	Very low	88 Å²	88	141.9 Å²	141.9	73%	0.727	75%	0.753	S	S	*	*				-161.5	144.6	119	0	0	0	0	0	106.1
503	D	31.4	Very low	30.3	Very low	136 Å²	136	142 Å²	142	73%	0.727	75%	0.745	S	S	*	*			cis	63.9	133.4	46.5	-63.9	-46	0	0	0	112.2
504	E	32.2	Very low	30.3	Very low	150 Å²	150	137.5 Å²	137.5	70%	0.701	74%	0.738	S	S	*	*			cis	-149.6	171	15.4	-134.5	-178.7	159.7	0	0	114.3
505	Q	30.3	Very low	30.2	Very low	150 Å²	150	136.9 Å²	136.9	70%	0.701	73%	0.733	S	S	*	*			trans	-7	164.7	144.8	-67.8	-177.9	71.9	0	0	120.5
506	V	29.3	Very low	30.2	Very low	112 Å²	112	134.7 Å²	134.7	68%	0.679	73%	0.728	S	S	*	*			cis	-169.8	148.7	-14.1	134.8	0	0	0	0	107
507	T	28.7	Very low	30.1	Very low	144 Å²	144	136.8 Å²	136.8	88%	0.883	74%	0.735	S	S	*	*			trans	-163.3	161.5	141.5	3.2	0	0	0	0	110.9
508	A	28.7	Very low	30	Very low	84 Å²	84	136.1 Å²	136.1	69%	0.694	74%	0.743	S	S	*	*			trans	-144.9	-170.9	-173.5	0	0	0	0	0	110.9
509	I	29.4	Very low	30.7	Very low	164 Å²	164	135.5 Å²	135.5	84%	0.841	75%	0.754	S	S	*	*			trans	80.7	136.8	168.9	-55.3	167.8	0	0	0	114.6
510	V	29.3	Very low	30.6	Very low	114 Å²	114	129 Å²	129	69%	0.691	75%	0.749	S	S	*	*			cis	-170	162	-33.2	105.3	0	0	0	0	110.4
511	N	29.6	Very low	30.6	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	76%	0.756	S	S	*	*			trans	66	123.1	171.6	-67.7	-23.9	0	0	0	119
512	K	29.1	Very low	30.5	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.835	75%	0.754	S	S	*	*				62.9	146.9	68.5	-89.4	-174.2	178.4	179.7	0	115
513	P	43	Very low	30.4	Very low	104 Å²	104	135.2 Å²	135.2	68%	0.675	76%	0.759	S	S	*	*			cis	-145.8	-180	2.7	40.3	-19.5	0	0	0	119
514	L	26.9	Very low	30.2	Very low	145 Å²	145	132.6 Å²	132.6	76%	0.759	76%	0.764	S	S	*	*			trans	84.4	138.5	138.4	-119.3	71.2	0	0	0	124.1
515	M	28	Very low	29.9	Very low	167 Å²	167	130.2 Å²	130.2	82%	0.823	77%	0.77	S	S	*	*			trans	71.9	152	154.6	-59.9	-138.3	149.8	0	0	119.8
516	S	27.1	Very low	29.7	Very low	92 Å²	92	129.8 Å²	129.8	64%	0.643	78%	0.777	S	S	*	*			cis	-169.2	175.5	-24.7	62	0	0	0	0	111.3
517	K	28.6	Very low	29.6	Very low	205 Å²	205	130.6 Å²	130.6	89%	0.891	78%	0.782	S	S	*	*			trans	82.6	140.6	166.3	-70.1	-176.9	174	179.2	0	120.8
518	A	27.1	Very low	29.8	Very low	90 Å²	90	129.5 Å²	129.5	74%	0.744	78%	0.777	S	S	*	*			trans	-110.8	-158.6	160.1	0	0	0	0	0	107.6
519	P	45.6	Very low	29.5	Very low	128 Å²	128	134.5 Å²	134.5	83%	0.831	79%	0.786	S	S	*	*			cis	-143.5	174.9	1.7	44.3	-25.5	0	0	0	118.1
520	A	28.9	Very low	29.5	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	78%	0.781	S	S	*	*			trans	-158.9	136.2	148	0	0	0	0	0	106.9
521	K	29	Very low	29.3	Very low	181 Å²	181	136.3 Å²	136.3	79%	0.787	79%	0.792	S	S	*	*				56.5	133	70.9	-78.8	-174.2	161.3	-131.7	0	113.1
522	E	28.4	Very low	29.1	Very low	154 Å²	154	140.8 Å²	140.8	72%	0.72	80%	0.8	S	S	*	*			cis	-153.3	176.6	16.8	-146.7	151.1	-126.7	0	0	115.2
523	A	27.6	Very low	28.9	Very low	101 Å²	101	137.5 Å²	137.5	84%	0.835	80%	0.802	S	S	*	*			trans	-26.7	158.4	179.4	0	0	0	0	0	122.7
524	G	26.9	Very low	28	Very low	81 Å²	81	135.9 Å²	135.9	84%	0.835	80%	0.804	S	S	*	*			trans	163.1	120	159.6	0	0	0	0	0	113.4
525	A	25.9	Very low	28	Very low	99 Å²	99	138.9 Å²	138.9	82%	0.818	81%	0.805	S	S	*	*			trans	-130	147.4	176.4	0	0	0	0	0	111.2
526	V	26.9	Very low	28	Very low	142 Å²	142	137.1 Å²	137.1	86%	0.861	79%	0.794	S	S	*	*			trans	174.5	151.9	148.4	143.1	0	0	0	0	109.8
527	V	27.7	Very low	28	Very low	128 Å²	128	141.6 Å²	141.6	78%	0.776	81%	0.805	S	S	*	*			trans	-116.1	144.1	178.9	175.5	0	0	0	0	109.9
528	P	31.3	Very low	28.1	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	79%	0.79	S	S	*	*			trans	-136.4	167.3	135.1	28.5	-11	0	0	0	114.3
529	Q	23.4	Very low	28.2	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	79%	0.794	S	S	*	*			trans	-92.8	172.3	-172.8	-64.5	179.3	-52.3	0	0	114.7
530	S	29.1	Very low	27.4	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	80%	0.795	S	S	*	*			trans	-75.2	160.8	177.2	55.1	0	0	0	0	115.2
531	K	24.8	Very low	27.7	Very low	211 Å²	211	141.6 Å²	141.6	92%	0.917	80%	0.795	S	S	*	*			trans	-142.6	178.6	155.8	-73.7	-159.3	175.7	177.7	0	111.8
532	Y	25.1	Very low	27.4	Very low	230 Å²	230	138.3 Å²	138.3	90%	0.902	80%	0.795	S	S	*	*			trans	-115	174.1	-146.3	-96.6	-106.9	0	0	0	117.5
533	S	25.7	Very low	27.4	Very low	124 Å²	124	139 Å²	139	87%	0.867	80%	0.804	S	S	*	*			trans	89.6	147.1	159.4	-151.4	0	0	0	0	116.9
534	G	24.5	Very low	28	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	80%	0.804	S	S	*	*			cis	168.8	176.8	-1.4	0	0	0	0	0	110.4
535	R	26	Very low	28.2	Very low	208 Å²	208	140.2 Å²	140.2	79%	0.785	79%	0.792	S	S	*	*			cis	-170.7	127.2	-13.2	175.6	178	-179.2	-149.3	-8	112.3
536	H	29.4	Very low	28.4	Very low	129 Å²	129	140.9 Å²	140.9	60%	0.597	78%	0.781	S	S	*	*			trans	60.2	138.2	161.6	-59.3	-36	0	0	0	123.7
537	H	26.2	Very low	28.8	Very low	186 Å²	186	140.3 Å²	140.3	86%	0.861	77%	0.769	S	S	*	*				-155.4	169	103.8	-130.2	-89.6	0	0	0	113.7
538	I	31.4	Very low	28.9	Very low	112 Å²	112	138.7 Å²	138.7	57%	0.574	76%	0.763	S	S	*	*			trans	-135.7	151.2	-159.7	-62.1	160.6	0	0	0	111.8
539	P	28.7	Very low	28.8	Very low	127 Å²	127	139.8 Å²	139.8	83%	0.825	76%	0.758	S	S	*	*			trans	-119.9	164.9	140.4	36.7	-29.1	0	0	0	114
540	N	29.4	Very low	29.3	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	74%	0.741	S	S	*	*			trans	-81.8	167.3	-154	-112	8.1	0	0	0	117.7
541	P	34.9	Very low	30.1	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	72%	0.721	S	S	*	*			trans	-101.8	169.6	-164.5	40.1	-37.7	0	0	0	116
542	S	22.8	Very low	30.8	Very low	112 Å²	112	127.1 Å²	127.1	78%	0.783	70%	0.696	S	S	*	*			trans	-142.9	124	157.6	63.9	0	0	0	0	111.6
543	N	28.7	Very low	32.2	Very low	169 Å²	169	118.1 Å²	118.1	90%	0.904	66%	0.66	S	S	*	*	S	Bend	trans	42.1	119.8	164.9	-69.9	-2.8	0	0	0	120.7
544	G	38.5	Very low	33	Very low	82 Å²	82	118.9 Å²	118.9	85%	0.845	65%	0.645	S	S	*	*				103.1	32.3	115.5	0	0	0	0	0	119.3
545	E	31.1	Very low	34.2	Very low	125 Å²	125	116.9 Å²	116.9	58%	0.584	62%	0.619	S	S	*	*			trans	-131.9	148.1	166.9	-120	-163.9	161.9	0	0	115.2
546	L	31.1	Very low	34.9	Very low	112 Å²	112	114.9 Å²	114.9	59%	0.586	62%	0.616	S	S	*	*			trans	54.9	101	155.1	-70.9	159.4	0	0	0	118.7	S548	L546-S548 PolarHBondContact O-N 3.27Å
547	H	34.5	Very low	35.4	Very low	130 Å²	130	114.9 Å²	114.9	60%	0.602	62%	0.62	S	S	*	*			trans	-69.1	69.9	146.5	-136	98.4	0	0	0	109.4	Q549 H551	H547-Q549 VanDerWaalsContact C-N 3.35Å; H547-H551 AromaticContact CD2-NE2 3.79Å; H547-H551 AromaticContact CE1-NE2 3.9Å; H547-H551 AromaticContact NE2-CD2 3.37Å; H547-H551 PolarHBondContact NE2-CD2 3.31Å; H547-H551 AromaticContact NE2-CE1 3.9Å; H547-H551 AromaticContact NE2-NE2 2.9Å; H547-H551 PolarHBondContact NE2-NE2 2.85Å
548	S	30.1	Very low	35.9	Very low	95 Å²	95	113.4 Å²	113.4	66%	0.664	62%	0.618	S	S	*	*			trans	-90	-1.7	175.5	58.7	0	0	0	0	112.9	L546 Y550	L546-S548 PolarHBondContact O-N 3.27Å; S548-Y550 PolarHBondContact O-N 3.23Å
549	Q	29.3	Very low	35.9	Very low	145 Å²	145	112.1 Å²	112.1	68%	0.678	62%	0.624	S	S	*	*	S	Bend	trans	-71.8	118.9	169.1	-69.4	-168.6	-6.1	0	0	109.3	H547 H551	H547-Q549 VanDerWaalsContact C-N 3.35Å; Q549-H551 PolarHBondContact O-N 3.04Å; Q549-H551 VanDerWaalsContact O-N 3.09Å
550	Y	34.1	Very low	36.2	Very low	133 Å²	133	111.7 Å²	111.7	52%	0.522	62%	0.621	S	S	.	*			trans	-79	89.9	-176.5	-161	-94.1	0	0	0	109.4	F46 Q66 S548 G552	F46-Y550 HydrophobicContact CE1-CD1 4.27Å; F46-Y550 AromaticContact CE1-CE1 3.43Å; F46-Y550 HydrophobicContact CE1-CE1 3.43Å; F46-Y550 VanDerWaalsContact CE1-CE1 3.43Å; F46-Y550 AromaticContact CE1-CZ 3.73Å; F46-Y550 AromaticContact CZ-CE1 3.64Å; F46-Y550 HydrophobicContact CZ-CE1 3.64Å; Q66-Y550 HydrophobicContact CB-CE2 3.93Å; Q66-Y550 WeakPolarHBondContact CB-OH 3.24Å; Q66-Y550 WeakPolarHBondContact CG-OH 3.47Å; S548-Y550 PolarHBondContact O-N 3.23Å; Y550-G552 PolarHBondContact O-N 2.93Å
551	H	45	Very low	36.3	Very low	67 Å²	67	113.3 Å²	113.3	31%	0.31	62%	0.624	S	S	.	*			trans	-78	86.4	176.1	-62.2	-21.5	0	0	0	110.2	H547 Q549 Y553	H547-H551 AromaticContact CD2-NE2 3.79Å; H547-H551 AromaticContact CE1-NE2 3.9Å; H547-H551 AromaticContact NE2-CD2 3.37Å; H547-H551 PolarHBondContact NE2-CD2 3.31Å; H547-H551 AromaticContact NE2-CE1 3.9Å; H547-H551 AromaticContact NE2-NE2 2.9Å; H547-H551 PolarHBondContact NE2-NE2 2.85Å; Q549-H551 PolarHBondContact O-N 3.04Å; Q549-H551 VanDerWaalsContact O-N 3.09Å; H551-Y553 HydrophobicContact CB-CE1 4.2Å; H551-Y553 HydrophobicContact CB-CE2 4.4Å; H551-Y553 WeakPolarHBondContact O-CD2 3.32Å; H551-Y553 WeakPolarHBondContact O-CE2 3.37Å; H551-Y553 PolarHBondContact O-N 2.98Å
552	G	40.5	Very low	36.2	Very low	38 Å²	38	116 Å²	116	39%	0.392	63%	0.626	S	S	.	*			trans	-72.8	110.8	157.3	0	0	0	0	0	107.9	Y550 Y554	Y550-G552 PolarHBondContact O-N 2.93Å; G552-Y554 VanDerWaalsContact C-N 3.3Å; G552-Y554 PolarHBondContact O-N 2.91Å
553	Y	53.5	Low	37.1	Very low	41 Å²	41	115.5 Å²	115.5	16%	0.161	62%	0.62	C	S	.	*			trans	-74.6	82.6	-174.1	-59.3	-86.6	0	0	0	110.8	F8 K22 A23 W42 G45 H551	F8-Y553 HydrophobicContact CE1-CD1 4.11Å; F8-Y553 HydrophobicContact CE2-CD1 4.31Å; F8-Y553 HydrophobicContact CE2-CE1 4.4Å; F8-Y553 AromaticContact CZ-CD1 3.62Å; F8-Y553 HydrophobicContact CZ-CD1 3.62Å; F8-Y553 HydrophobicContact CZ-CE1 4.15Å; K22-Y553 WeakPolarHBondContact CA-O 3.41Å; A23-Y553 PolarHBondContact N-O 3.42Å; W42-Y553 HydrophobicContact CE3-CD2 4.45Å; W42-Y553 AromaticContact CH2-CD2 3.97Å; W42-Y553 HydrophobicContact CH2-CD2 3.97Å; W42-Y553 AromaticContact CH2-CE2 3.65Å; W42-Y553 HydrophobicContact CH2-CE2 3.65Å; W42-Y553 AromaticContact CZ3-CD2 3.46Å; W42-Y553 HydrophobicContact CZ3-CD2 3.46Å; W42-Y553 VanDerWaalsContact CZ3-CD2 3.46Å; W42-Y553 AromaticContact CZ3-CE2 3.49Å; W42-Y553 HydrophobicContact CZ3-CE2 3.49Å; W42-Y553 VanDerWaalsContact CZ3-CE2 3.49Å; W42-Y553 HydrophobicContact CZ3-CG 4.37Å; G45-Y553 WeakPolarHBondContact O-CD2 3.41Å; G45-Y553 PolarHBondContact O-N 2.87Å; H551-Y553 HydrophobicContact CB-CE1 4.2Å; H551-Y553 HydrophobicContact CB-CE2 4.4Å; H551-Y553 WeakPolarHBondContact O-CD2 3.32Å; H551-Y553 WeakPolarHBondContact O-CE2 3.37Å; H551-Y553 PolarHBondContact O-N 2.98Å
554	Y	44	Very low	37.5	Very low	140 Å²	140	113.3 Å²	113.3	55%	0.549	62%	0.615	S	S	.	*	B	Isolated β-bridge	trans	-116.6	119.3	-179	172.2	-105.2	0	0	0	110.9	K22 G552 K556	K22-Y554 HydrophobicContact CG-CD2 4.03Å; G552-Y554 VanDerWaalsContact C-N 3.3Å; G552-Y554 PolarHBondContact O-N 2.91Å; Y554-K556 HydrophobicContact CE1-CB 3.82Å; Y554-K556 HydrophobicContact CE1-CG 4.03Å
555	V	49.2	Very low	37.2	Very low	29 Å²	29	115.2 Å²	115.2	18%	0.176	61%	0.61	C	S	.	*			trans	-95.8	119.3	172.3	176	0	0	0	0	108.6	F6 W18 G21 L557	F6-V555 HydrophobicContact CD1-CG2 4.14Å; F6-V555 HydrophobicContact CD2-CG1 4.26Å; F6-V555 HydrophobicContact CD2-CG2 3.71Å; F6-V555 HydrophobicContact CE1-CG2 4.01Å; F6-V555 HydrophobicContact CE2-CB 4.32Å; F6-V555 HydrophobicContact CE2-CG1 3.72Å; F6-V555 HydrophobicContact CE2-CG2 3.56Å; F6-V555 HydrophobicContact CG-CG2 4Å; F6-V555 HydrophobicContact CZ-CG1 4.33Å; F6-V555 HydrophobicContact CZ-CG2 3.72Å; W18-V555 HydrophobicContact CH2-CB 4.44Å; W18-V555 HydrophobicContact CH2-CG2 3.42Å; W18-V555 VanDerWaalsContact CH2-CG2 3.42Å; W18-V555 HydrophobicContact CZ2-CG2 4.37Å; W18-V555 HydrophobicContact CZ3-CB 4.11Å; W18-V555 HydrophobicContact CZ3-CG2 3.53Å; G21-V555 PolarHBondContact O-N 3.28Å; V555-L557 PolarHBondContact O-N 2.99Å
556	K	39.7	Very low	37.2	Very low	166 Å²	166	116.9 Å²	116.9	72%	0.722	62%	0.623	S	S	*	*			trans	-78.6	88.1	-179.3	-163.3	175.6	-172.6	-178.7	0	110.1	Y554 N558	Y554-K556 HydrophobicContact CE1-CB 3.82Å; Y554-K556 HydrophobicContact CE1-CG 4.03Å; K556-N558 PolarHBondContact O-N 3.22Å
557	L	40.1	Very low	37.4	Very low	129 Å²	129	116.9 Å²	116.9	68%	0.675	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.7	122.2	174.7	-65	173.6	0	0	0	110.1	V555	V555-L557 PolarHBondContact O-N 2.99Å
558	N	36.4	Very low	37.4	Very low	155 Å²	155	120 Å²	120	83%	0.829	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-68.1	135.2	165.7	-74.3	-28.7	0	0	0	108.5	K556	K556-N558 PolarHBondContact O-N 3.22Å
559	A	32.4	Very low	37.7	Very low	85 Å²	85	123 Å²	123	70%	0.702	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-62.1	142.3	179.8	0	0	0	0	0	110.8	Q561	A559-Q561 PolarHBondContact O-N 3.11Å
560	P	35.7	Very low	37.7	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-56.7	127.5	172.5	-23.2	33.6	0	0	0	110.5	H562	P560-H562 PolarHBondContact O-N 2.86Å
561	Q	31.3	Very low	37.6	Very low	193 Å²	193	122 Å²	122	90%	0.902	68%	0.678	S	S	*	*			trans	-71.1	112.4	168.2	-73.5	-174.3	-23.6	0	0	108.3	A559	A559-Q561 PolarHBondContact O-N 3.11Å
562	H	32.8	Very low	36.9	Very low	172 Å²	172	122.2 Å²	122.2	80%	0.796	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.2	134.1	165.8	-93.7	-102	0	0	0	109.5	P560	P560-H562 PolarHBondContact O-N 2.86Å
563	P	41	Very low	36.4	Very low	103 Å²	103	125.7 Å²	125.7	67%	0.669	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-58	159.9	157.4	-19.2	32.9	0	0	0	110.6
564	P	36.9	Very low	35.4	Very low	123 Å²	123	128.3 Å²	128.3	80%	0.799	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.8	155.6	179.6	27.8	-35.4	0	0	0	112.1
565	V	32.1	Very low	34.7	Very low	121 Å²	121	130.5 Å²	130.5	73%	0.733	76%	0.756	S	S	*	*			trans	-90.4	114	177.8	-175.1	0	0	0	0	108.7	V567	V565-V567 HydrophobicContact CG1-CG2 4.09Å
566	D	32.3	Very low	33.9	Very low	160 Å²	160	134.4 Å²	134.4	86%	0.856	79%	0.785	S	S	*	*			trans	-81.8	142.6	158.9	-72	-47.3	0	0	0	109.2
567	V	34.9	Very low	33.6	Very low	112 Å²	112	131 Å²	131	68%	0.679	78%	0.782	S	S	*	*			trans	-122.8	123.8	-171.2	179.8	0	0	0	0	109.3	V565	V565-V567 HydrophobicContact CG1-CG2 4.09Å
568	E	34.9	Very low	33.2	Very low	196 Å²	196	130.6 Å²	130.6	92%	0.916	79%	0.79	S	S	*	*			trans	-135.6	144.8	156.4	-74	-155.5	139.6	0	0	110.2
569	D	34.7	Very low	32.9	Very low	158 Å²	158	127 Å²	127	85%	0.845	78%	0.782	S	S	*	*			trans	-86.9	157.4	-174.4	-63.7	-74.3	0	0	0	113
570	G	30.9	Very low	32.8	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	79%	0.79	S	S	*	*			trans	-175.1	75.5	178.1	0	0	0	0	0	114.4
571	D	31.8	Very low	32.5	Very low	177 Å²	177	130.4 Å²	130.4	95%	0.947	79%	0.785	S	S	*	*			trans	-84.8	143.3	171.1	-166.1	9.4	0	0	0	111
572	G	29.9	Very low	32.4	Very low	72 Å²	72	129.5 Å²	129.5	74%	0.742	78%	0.78	S	S	*	*			trans	168.5	132	-175.9	0	0	0	0	0	115.5
573	S	29.7	Very low	32.4	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	78%	0.782	S	S	*	*			trans	-119.5	155.3	-166.1	67.8	0	0	0	0	116.2
574	S	32.4	Very low	32.1	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	79%	0.791	S	S	*	*			trans	102.9	138.7	137	84.3	0	0	0	0	120.8
575	Q	30.3	Very low	31.6	Very low	187 Å²	187	131.3 Å²	131.3	87%	0.874	79%	0.79	S	S	*	*			trans	60.5	151.2	153.5	-66.6	179.3	30.1	0	0	118
576	S	31.9	Very low	31.5	Very low	110 Å²	110	130 Å²	130	77%	0.769	79%	0.792	S	S	*	*			cis	177.8	161.7	-11.3	-162.7	0	0	0	0	103.6
577	S	33.3	Very low	31.3	Very low	94 Å²	94	130 Å²	130	66%	0.657	79%	0.792	S	S	*	*			cis	-171.7	158.8	29	64.4	0	0	0	0	111.4
578	S	31.2	Very low	30.9	Very low	122 Å²	122	133.6 Å²	133.6	85%	0.853	80%	0.799	S	S	*	*			trans	63.1	150	148.1	-57.2	0	0	0	0	120.6
579	A	29.6	Very low	30.3	Very low	80 Å²	80	135.7 Å²	135.7	66%	0.661	80%	0.798	S	S	*	*			cis	-147.1	148.4	-1.6	0	0	0	0	0	110.1
580	L	30.6	Very low	29.9	Very low	164 Å²	164	132.5 Å²	132.5	86%	0.859	79%	0.788	S	S	*	*				55.3	139.3	100.3	-51.3	177.4	0	0	0	116
581	V	30.2	Very low	30.2	Very low	109 Å²	109	133.8 Å²	133.8	66%	0.661	78%	0.782	S	S	*	*			cis	-161.6	161.5	16.8	87.7	0	0	0	0	115.7
582	H	29.8	Very low	30	Very low	173 Å²	173	129.8 Å²	129.8	80%	0.801	77%	0.768	S	S	*	*			trans	59.6	135.3	158.1	-73.7	-59.8	0	0	0	125.9
583	K	31.8	Very low	29.9	Very low	191 Å²	191	136.2 Å²	136.2	83%	0.83	78%	0.776	S	S	*	*			trans	-94	166.5	145.8	-64.2	179.2	178.4	177.7	0	110.4
584	P	34.7	Very low	29.8	Very low	133 Å²	133	136.1 Å²	136.1	86%	0.864	78%	0.775	S	S	*	*				-129.7	-174.7	125.9	38.8	-31.6	0	0	0	112.9
585	S	27.4	Very low	29.6	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	78%	0.778	S	S	*	*			trans	-141.6	150.2	-177.3	60.8	0	0	0	0	114.2
586	A	30.3	Very low	29.5	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	78%	0.776	S	S	*	*			trans	57.4	120.9	153.6	0	0	0	0	0	120.7
587	N	26.6	Very low	29.4	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	78%	0.78	S	S	*	*				-159.7	174.3	117.1	-127.6	-37.6	0	0	0	114.3
588	K	26.5	Very low	30.1	Very low	188 Å²	188	139.9 Å²	139.9	82%	0.817	78%	0.784	S	S	*	*			trans	-93.8	153.3	-178.9	-49.1	164.9	-177.5	172	0	112.2
589	W	22.3	Very low	30.1	Very low	239 Å²	239	140.8 Å²	140.8	91%	0.905	78%	0.784	S	S	*	*			trans	-172.3	156.5	134.1	-161.6	-110.9	0	0	0	114.8
590	S	27.6	Very low	30.3	Very low	91 Å²	91	141 Å²	141	64%	0.636	79%	0.786	S	S	*	*			trans	-160.3	161.3	160.5	64.5	0	0	0	0	107.4
591	P	37.3	Very low	30.4	Very low	107 Å²	107	140.7 Å²	140.7	70%	0.695	78%	0.778	S	S	*	*			cis	-135.3	-135.6	29.5	34.4	-7	0	0	0	111.8
592	S	26.7	Very low	30.3	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	78%	0.78	S	S	*	*			cis	-169.8	147.2	1.5	38	0	0	0	0	115.5
593	K	28.7	Very low	30.5	Very low	206 Å²	206	139.3 Å²	139.3	90%	0.896	78%	0.776	S	S	*	*			trans	66.8	133.4	139.1	-73.6	-177.4	177.6	179.4	0	125.1
594	S	26.3	Very low	30.3	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	78%	0.776	S	S	*	*			trans	-145.4	163.4	142.4	66.1	0	0	0	0	108.7
595	V	29	Very low	30	Very low	122 Å²	122	137.9 Å²	137.9	74%	0.739	78%	0.775	S	S	*	*			cis	86.3	132.6	7.4	-166.9	0	0	0	0	113
596	T	28.3	Very low	30	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	78%	0.775	S	S	*	*			cis	-138	176	25.3	-26.1	0	0	0	0	115
597	K	29.8	Very low	30.7	Very low	193 Å²	193	141.1 Å²	141.1	84%	0.839	77%	0.771	S	S	*	*			trans	-113.7	-163.9	173.8	-98.6	-169.8	-179.6	-173.8	0	109.8
598	P	47.7	Very low	30.8	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	77%	0.769	S	S	*	*			cis	-150.4	-155.6	18.2	41.3	-15.4	0	0	0	118.6
599	V	30.7	Very low	31.2	Very low	141 Å²	141	137.5 Å²	137.5	86%	0.855	76%	0.764	S	S	*	*			trans	91.5	168.5	174.1	-170.5	0	0	0	0	114.8
600	A	34.5	Very low	31.4	Very low	86 Å²	86	136.4 Å²	136.4	71%	0.711	77%	0.765	S	S	*	*				-159.7	-169.2	-79.6	0	0	0	0	0	108.7
601	K	32.4	Very low	31.4	Very low	157 Å²	157	140 Å²	140	68%	0.683	77%	0.77	S	S	*	*			cis	-163.6	143.8	-0.6	-158.9	179.7	174.8	-116	0	110.3
602	E	28.9	Very low	30.9	Very low	149 Å²	149	140.1 Å²	140.1	70%	0.696	77%	0.773	S	S	*	*			trans	58.1	155.7	160.5	-77.1	154.6	171.2	0	0	120.2
603	S	32.9	Very low	31.2	Very low	103 Å²	103	142 Å²	142	72%	0.72	77%	0.771	S	S	*	*			cis	-166.1	-169.2	-17.4	56.1	0	0	0	0	108.1
604	K	28.7	Very low	31.4	Very low	193 Å²	193	139.1 Å²	139.1	84%	0.839	77%	0.765	S	S	*	*			cis	-168.4	168.5	7.8	-149.6	174.3	-179.8	178.3	0	111.5
605	A	28.1	Very low	31.3	Very low	102 Å²	102	138 Å²	138	84%	0.843	76%	0.762	S	S	*	*			trans	83.5	152.8	148.1	0	0	0	0	0	123.2
606	E	27.2	Very low	31.5	Very low	166 Å²	166	139.7 Å²	139.7	78%	0.776	77%	0.765	S	S	*	*			trans	-150.4	159.6	-176	-172.1	-141.5	-101.3	0	0	107.8	K608	E606-K608 PolarHBondContact OE2-N 2.99Å
607	P	44.1	Very low	32.2	Very low	106 Å²	106	138.7 Å²	138.7	69%	0.688	76%	0.761	S	S	*	*				-158.9	140.9	122	36.4	-16.1	0	0	0	119.9
608	K	29.9	Very low	32.2	Very low	189 Å²	189	138.9 Å²	138.9	82%	0.822	76%	0.762	S	S	*	*				56.2	160	128.4	-63.3	178.4	179.8	175.4	0	123.1	E606	E606-K608 PolarHBondContact OE2-N 2.99Å
609	A	34.5	Very low	31.4	Very low	85 Å²	85	140.7 Å²	140.7	70%	0.702	77%	0.765	S	S	*	*			cis	178.2	159.7	-25.5	0	0	0	0	0	111.7
610	K	25.3	Very low	32	Very low	216 Å²	216	139.7 Å²	139.7	94%	0.939	76%	0.762	S	S	*	*			trans	-179.9	171.7	138.1	-101.3	170.2	-177.2	-178.2	0	114.2
611	K	28.6	Very low	31.9	Very low	167 Å²	167	140 Å²	140	73%	0.726	76%	0.764	S	S	*	*			trans	-159.6	146.1	-153.4	-178.5	-146.6	179.8	-152.9	0	114.9	E613	K611-E613 VanDerWaalsContact CE-OE2 3.31Å; K611-E613 WeakPolarHBondContact CE-OE2 3.35Å; K611-E613 IonicContact NZ-OE2 3.94Å; K611-E613 PolarHBondContact NZ-OE2 2.87Å
612	S	27.5	Very low	31.7	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	77%	0.772	S	S	*	*			trans	-172	131.6	151.7	42.8	0	0	0	0	108.7
613	E	31.3	Very low	31.8	Very low	134 Å²	134	138.3 Å²	138.3	63%	0.626	78%	0.777	S	S	*	*				78.5	138.2	52.6	-70.2	-178	82.7	0	0	114.2	K611	K611-E613 VanDerWaalsContact CE-OE2 3.31Å; K611-E613 WeakPolarHBondContact CE-OE2 3.35Å; K611-E613 IonicContact NZ-OE2 3.94Å; K611-E613 PolarHBondContact NZ-OE2 2.87Å
614	L	33.3	Very low	31.6	Very low	145 Å²	145	140.3 Å²	140.3	76%	0.759	78%	0.78	S	S	*	*			cis	-147.9	167.7	5.6	-151.2	93	0	0	0	109.1
615	A	25.4	Very low	31.6	Very low	85 Å²	85	136.6 Å²	136.6	70%	0.702	78%	0.778	S	S	*	*				178	158.3	73	0	0	0	0	0	113.5
616	I	31.8	Very low	31.8	Very low	158 Å²	158	137.7 Å²	137.7	81%	0.81	78%	0.778	S	S	*	*			trans	-148.6	147.4	174.1	-33.1	174	0	0	0	109.2
617	P	44.2	Very low	32.3	Very low	114 Å²	114	135.9 Å²	135.9	74%	0.74	78%	0.781	S	S	*	*				-152.6	173.5	118.5	37.9	-21	0	0	0	115.1
618	K	29.8	Very low	31.8	Very low	198 Å²	198	135.6 Å²	135.6	86%	0.861	79%	0.787	S	S	*	*			cis	-165	149.6	-30.3	-101.7	175.1	-177.8	178.1	0	109.4
619	N	30.9	Very low	32	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	79%	0.791	S	S	*	*			trans	-20.3	164.9	158.7	-75.3	17.4	0	0	0	119.9
620	P	43.4	Very low	32.2	Very low	120 Å²	120	139.3 Å²	139.3	78%	0.779	80%	0.798	S	S	*	*			cis	-152.7	159.3	37.7	43.1	-21.7	0	0	0	123.1
621	A	31.5	Very low	32.6	Very low	92 Å²	92	139 Å²	139	76%	0.76	80%	0.796	S	S	*	*			trans	53.7	127	134.5	0	0	0	0	0	125
622	S	29.4	Very low	33	Very low	122 Å²	122	140 Å²	140	85%	0.853	80%	0.804	S	S	*	*				-159.7	162.1	123.1	-6.3	0	0	0	0	110.1
623	N	30	Very low	33.6	Very low	149 Å²	149	139 Å²	139	80%	0.797	80%	0.801	S	S	*	*			trans	-98	158.2	180	-63.3	-21.4	0	0	0	111.8
624	D	29.4	Very low	33.7	Very low	145 Å²	145	140.4 Å²	140.4	78%	0.775	81%	0.813	S	S	*	*				176.5	143.8	105.2	-92.9	-17.7	0	0	0	115.6
625	S	28.9	Very low	34.5	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	82%	0.817	S	S	*	*			trans	59.7	137.1	156.6	70.1	0	0	0	0	121.6
626	C	32.1	Very low	35.9	Very low	126 Å²	126	137.4 Å²	137.4	85%	0.851	81%	0.807	S	S	*	*			trans	-122.7	152	157.4	-69.4	0	0	0	0	107.4
627	P	37.6	Very low	37.1	Very low	128 Å²	128	135.2 Å²	135.2	83%	0.831	80%	0.803	S	S	*	*				-140.2	173.6	88.7	38.4	-24.7	0	0	0	114.3
628	A	33.9	Very low	38.3	Very low	100 Å²	100	135.6 Å²	135.6	83%	0.826	80%	0.798	S	S	*	*			trans	-76.1	153.6	176.7	0	0	0	0	0	113
629	L	33.9	Very low	40.4	Very low	170 Å²	170	129.9 Å²	129.9	89%	0.89	78%	0.784	S	S	*	*			trans	-142.5	132.1	164.7	-122	174.4	0	0	0	109.3
630	E	38.4	Very low	42.5	Very low	182 Å²	182	128.6 Å²	128.6	85%	0.85	78%	0.776	S	S	*	*			trans	-75.7	150.8	-178.6	-60	174.2	143	0	0	111.4
631	K	34.2	Very low	44	Very low	210 Å²	210	128.3 Å²	128.3	91%	0.913	77%	0.765	S	S	*	*			trans	-140.8	103	163.1	-81.1	-166	173	179.3	0	110.8
632	E	35.8	Very low	46.3	Very low	188 Å²	188	128.5 Å²	128.5	88%	0.879	75%	0.752	S	S	*	*			trans	-71	161.4	164	-71.4	-157.9	117.5	0	0	112.4
633	A	40.4	Very low	48.6	Very low	85 Å²	85	126.5 Å²	126.5	70%	0.702	74%	0.735	S	S	*	*			trans	10.6	133.8	157.8	0	0	0	0	0	120.5
634	N	34.3	Very low	51.1	Low	165 Å²	165	124.2 Å²	124.2	88%	0.882	72%	0.722	S	S	*	*				-150.6	108	113.9	-115.3	-49.5	0	0	0	112.6	G636	N634-G636 PolarHBondContact O-N 3.34Å
635	S	49	Very low	53.9	Low	119 Å²	119	120.9 Å²	120.9	83%	0.832	71%	0.707	S	S	*	*			trans	-85.5	83.9	172.2	174.2	0	0	0	0	109.5
636	G	54.6	Low	56.6	Low	48 Å²	48	121.3 Å²	121.3	50%	0.495	70%	0.698	S	S	.	*			trans	-59.9	146.2	173	0	0	0	0	0	111.8	N634	N634-G636 PolarHBondContact O-N 3.34Å
637	P	58.2	Low	59.3	Low	112 Å²	112	120.5 Å²	120.5	73%	0.727	68%	0.684	S	S	*	*			trans	-61.5	140.1	173.7	26.9	-34.1	0	0	0	110	S639	P637-S639 VanDerWaalsContact C-N 3.32Å; P637-S639 PolarHBondContact O-N 3.47Å
638	N	69	Low	61.8	Low	121 Å²	121	119.8 Å²	119.8	65%	0.647	67%	0.673	S	S	*	*			trans	-65.6	84.9	-176.5	-73.3	-62.9	0	0	0	111.8	I640 M641 I642	N638-I640 PolarHBondContact O-N 2.97Å; N638-M641 HydrophobicContact CB-CB 4Å; N638-M641 HydrophobicContact CB-CG 3.78Å; N638-M641 WeakPolarHBondContact O-CA 3.29Å; N638-M641 WeakPolarHBondContact O-CB 3.36Å; N638-M641 PolarHBondContact O-N 3.45Å; N638-I642 PolarHBondContact O-N 2.96Å
639	S	74.4	Confident	64.2	Low	79 Å²	79	119.4 Å²	119.4	55%	0.552	66%	0.657	S	S	*	*	H	α-helix	trans	-53.6	-36.9	179.3	55.9	0	0	0	0	112.5	P637 M641 I642 V643	P637-S639 VanDerWaalsContact C-N 3.32Å; P637-S639 PolarHBondContact O-N 3.47Å; S639-M641 VanDerWaalsContact C-N 3.31Å; S639-M641 PolarHBondContact O-N 3.2Å; S639-I642 PolarHBondContact O-N 2.95Å; S639-I642 VanDerWaalsContact O-N 3.16Å; S639-V643 WeakPolarHBondContact O-CG2 3.24Å; S639-V643 PolarHBondContact O-N 3.21Å
640	I	75	Confident	66.9	Low	126 Å²	126	116 Å²	116	65%	0.646	64%	0.638	S	S	*	*	H	α-helix	trans	-56.9	-41.7	173.9	-60.5	171.4	0	0	0	111.5	N638 L644	N638-I640 PolarHBondContact O-N 2.97Å; I640-L644 HydrophobicContact CG2-CD1 4.19Å; I640-L644 WeakPolarHBondContact O-CB 3.49Å; I640-L644 WeakPolarHBondContact O-CG 3.18Å; I640-L644 PolarHBondContact O-N 2.89Å
641	M	74.1	Confident	69.2	Low	113 Å²	113	108.8 Å²	108.8	56%	0.557	61%	0.613	S	S	*	*	H	α-helix	trans	-70.8	-37.6	177.2	-67.1	-66.2	-69	0	0	111.8	N638 S639 L644 V645	N638-M641 HydrophobicContact CB-CB 4Å; N638-M641 HydrophobicContact CB-CG 3.78Å; N638-M641 WeakPolarHBondContact O-CA 3.29Å; N638-M641 WeakPolarHBondContact O-CB 3.36Å; N638-M641 PolarHBondContact O-N 3.45Å; S639-M641 VanDerWaalsContact C-N 3.31Å; S639-M641 PolarHBondContact O-N 3.2Å; M641-L644 PolarHBondContact O-N 3.02Å; M641-L644 HydrophobicContact SD-CD1 4.4Å; M641-V645 WeakPolarHBondContact O-CG2 3.13Å; M641-V645 PolarHBondContact O-N 3.39Å
642	I	79	Confident	71.7	Confident	96 Å²	96	103.5 Å²	103.5	49%	0.492	60%	0.595	S	S	.	*	H	α-helix	trans	-64.2	-45.3	176.8	-60.2	172.8	0	0	0	110.1	N638 S639 V645 M646	N638-I642 PolarHBondContact O-N 2.96Å; S639-I642 PolarHBondContact O-N 2.95Å; S639-I642 VanDerWaalsContact O-N 3.16Å; I642-V645 PolarHBondContact O-N 3.47Å; I642-M646 WeakPolarHBondContact O-CG 3.33Å; I642-M646 PolarHBondContact O-N 3.21Å
643	V	79.1	Confident	74.1	Confident	80 Å²	80	97.1 Å²	97.1	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-62.7	-42.6	175.6	172.4	0	0	0	0	111.4	S639 V645 M646 L647	S639-V643 WeakPolarHBondContact O-CG2 3.24Å; S639-V643 PolarHBondContact O-N 3.21Å; V643-V645 PolarHBondContact O-N 3.07Å; V643-M646 PolarHBondContact O-N 3.36Å; V643-L647 HydrophobicContact CG1-CD1 3.9Å; V643-L647 HydrophobicContact CG1-CG 4.37Å; V643-L647 WeakPolarHBondContact O-CB 3.43Å; V643-L647 WeakPolarHBondContact O-CG 3.39Å; V643-L647 PolarHBondContact O-N 3.47Å
644	L	82.4	Confident	76.3	Confident	101 Å²	101	98.3 Å²	98.3	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-60.2	-43.9	175.2	-84.7	164.2	0	0	0	112.7	I640 M641 L647 L648	I640-L644 HydrophobicContact CG2-CD1 4.19Å; I640-L644 WeakPolarHBondContact O-CB 3.49Å; I640-L644 WeakPolarHBondContact O-CG 3.18Å; I640-L644 PolarHBondContact O-N 2.89Å; M641-L644 PolarHBondContact O-N 3.02Å; M641-L644 HydrophobicContact SD-CD1 4.4Å; L644-L647 PolarHBondContact O-N 2.9Å; L644-L648 WeakPolarHBondContact O-CB 3.37Å; L644-L648 PolarHBondContact O-N 2.76Å
645	V	87.5	Confident	78.6	Confident	76 Å²	76	95.3 Å²	95.3	46%	0.461	55%	0.551	S	S	.	*	H	α-helix	trans	-67.1	-39.8	177.4	171.4	0	0	0	0	111.4	M641 I642 V643 L648 N649	M641-V645 WeakPolarHBondContact O-CG2 3.13Å; M641-V645 PolarHBondContact O-N 3.39Å; I642-V645 PolarHBondContact O-N 3.47Å; V643-V645 PolarHBondContact O-N 3.07Å; V645-L648 PolarHBondContact O-N 3.21Å; V645-N649 WeakPolarHBondContact O-CB 3.25Å; V645-N649 VanDerWaalsContact O-CG 3.31Å; V645-N649 PolarHBondContact O-N 2.74Å; V645-N649 PolarHBondContact O-ND2 2.84Å
646	M	86	Confident	80.2	Confident	122 Å²	122	96.6 Å²	96.6	60%	0.601	54%	0.542	S	S	*	.	H	α-helix	trans	-61.4	-47.7	173.8	-76.8	-175.7	136.5	0	0	112	I642 V643 L648 N649 I650	I642-M646 WeakPolarHBondContact O-CG 3.33Å; I642-M646 PolarHBondContact O-N 3.21Å; V643-M646 PolarHBondContact O-N 3.36Å; M646-L648 VanDerWaalsContact C-N 3.34Å; M646-L648 PolarHBondContact O-N 2.96Å; M646-N649 PolarHBondContact O-N 3.02Å; M646-I650 WeakPolarHBondContact O-CD1 3.41Å; M646-I650 VanDerWaalsContact O-CG1 3.26Å; M646-I650 WeakPolarHBondContact O-CG1 3.41Å; M646-I650 PolarHBondContact O-N 2.93Å
647	L	89.1	Confident	81.7	Confident	109 Å²	109	98.6 Å²	98.6	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-63.5	-38.6	178.5	-70.6	171.6	0	0	0	112.3	V643 L644 I650 G651	V643-L647 HydrophobicContact CG1-CD1 3.9Å; V643-L647 HydrophobicContact CG1-CG 4.37Å; V643-L647 WeakPolarHBondContact O-CB 3.43Å; V643-L647 WeakPolarHBondContact O-CG 3.39Å; V643-L647 PolarHBondContact O-N 3.47Å; L644-L647 PolarHBondContact O-N 2.9Å; L647-I650 PolarHBondContact O-N 3.12Å; L647-G651 PolarHBondContact O-N 3.15Å
648	L	89.7	Confident	82.5	Confident	114 Å²	114	100 Å²	100	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-62.4	-46.3	175.1	-171.1	70.8	0	0	0	111.7	L644 V645 M646 G651 L652	L644-L648 WeakPolarHBondContact O-CB 3.37Å; L644-L648 PolarHBondContact O-N 2.76Å; V645-L648 PolarHBondContact O-N 3.21Å; M646-L648 VanDerWaalsContact C-N 3.34Å; M646-L648 PolarHBondContact O-N 2.96Å; L648-G651 PolarHBondContact O-N 3.02Å; L648-L652 HydrophobicContact CG-CD1 4.37Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 2.98Å
649	N	84.5	Confident	82.8	Confident	92 Å²	92	102.8 Å²	102.8	49%	0.492	55%	0.547	S	S	.	.	H	α-helix	trans	-67.8	-36.9	179.7	-72.1	-14.8	0	0	0	112.3	V645 M646 L652 A653	V645-N649 WeakPolarHBondContact O-CB 3.25Å; V645-N649 VanDerWaalsContact O-CG 3.31Å; V645-N649 PolarHBondContact O-N 2.74Å; V645-N649 PolarHBondContact O-ND2 2.84Å; M646-N649 PolarHBondContact O-N 3.02Å; N649-L652 PolarHBondContact O-N 3.27Å; N649-A653 WeakPolarHBondContact O-CB 3.29Å; N649-A653 PolarHBondContact O-N 3.32Å
650	I	90.8	Very high	82.6	Confident	97 Å²	97	105 Å²	105	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-64.4	-43.4	172.8	-69	163.4	0	0	0	110.5	M646 L647 A653 I654	M646-I650 WeakPolarHBondContact O-CD1 3.41Å; M646-I650 VanDerWaalsContact O-CG1 3.26Å; M646-I650 WeakPolarHBondContact O-CG1 3.41Å; M646-I650 PolarHBondContact O-N 2.93Å; L647-I650 PolarHBondContact O-N 3.12Å; I650-A653 PolarHBondContact O-N 2.96Å; I650-I654 HydrophobicContact CG2-CD1 3.86Å; I650-I654 VanDerWaalsContact O-CG1 3.32Å; I650-I654 WeakPolarHBondContact O-CG1 3.48Å; I650-I654 PolarHBondContact O-N 2.93Å
651	G	85.8	Confident	81.9	Confident	31 Å²	31	106.3 Å²	106.3	32%	0.32	57%	0.566	S	S	.	*	H	α-helix	trans	-61	-43.5	175.2	0	0	0	0	0	113	L647 L648 I654 L655	L647-G651 PolarHBondContact O-N 3.15Å; L648-G651 PolarHBondContact O-N 3.02Å; G651-I654 PolarHBondContact O-N 3.3Å; G651-L655 WeakPolarHBondContact O-CG 3.43Å; G651-L655 PolarHBondContact O-N 3.13Å
652	L	86.6	Confident	82.3	Confident	100 Å²	100	106 Å²	106	52%	0.524	57%	0.567	S	S	.	*	H	α-helix	trans	-63.6	-41.6	174.3	-75.6	167.3	0	0	0	112.2	L648 N649 L655 F656	L648-L652 HydrophobicContact CG-CD1 4.37Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 2.98Å; N649-L652 PolarHBondContact O-N 3.27Å; L652-L655 PolarHBondContact O-N 2.94Å; L652-F656 WeakPolarHBondContact O-CB 3.45Å; L652-F656 PolarHBondContact O-N 2.99Å
653	A	86.1	Confident	82.4	Confident	54 Å²	54	106.5 Å²	106.5	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-63.8	-41.9	176.8	0	0	0	0	0	112.4	N649 I650 F656 V657	N649-A653 WeakPolarHBondContact O-CB 3.29Å; N649-A653 PolarHBondContact O-N 3.32Å; I650-A653 PolarHBondContact O-N 2.96Å; A653-F656 PolarHBondContact O-N 3.36Å; A653-V657 WeakPolarHBondContact O-CG2 3.38Å; A653-V657 PolarHBondContact O-N 3.2Å
654	I	86.8	Confident	82.6	Confident	109 Å²	109	108 Å²	108	56%	0.559	58%	0.576	S	S	*	*	H	α-helix	trans	-62.3	-44.8	175.6	-68.8	163.7	0	0	0	110.5	I650 G651 F656 V657 H658	I650-I654 HydrophobicContact CG2-CD1 3.86Å; I650-I654 VanDerWaalsContact O-CG1 3.32Å; I650-I654 WeakPolarHBondContact O-CG1 3.48Å; I650-I654 PolarHBondContact O-N 2.93Å; G651-I654 PolarHBondContact O-N 3.3Å; I654-F656 VanDerWaalsContact C-N 3.34Å; I654-F656 PolarHBondContact O-N 3.36Å; I654-V657 PolarHBondContact O-N 3.24Å; I654-H658 WeakPolarHBondContact O-CB 3.28Å; I654-H658 PolarHBondContact O-N 3Å
655	L	83.4	Confident	82.6	Confident	103 Å²	103	108.4 Å²	108.4	54%	0.539	58%	0.578	S	S	.	*	H	α-helix	trans	-61.6	-42.3	175.3	-72.9	168.3	0	0	0	111.7	G651 L652 H658 F659	G651-L655 WeakPolarHBondContact O-CG 3.43Å; G651-L655 PolarHBondContact O-N 3.13Å; L652-L655 PolarHBondContact O-N 2.94Å; L655-H658 PolarHBondContact O-N 2.98Å; L655-F659 WeakPolarHBondContact O-CD2 3.5Å; L655-F659 PolarHBondContact O-N 3.39Å
656	F	83	Confident	82.3	Confident	145 Å²	145	110.4 Å²	110.4	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-66.4	-39.3	-179.5	-157.1	-104.5	0	0	0	112.3	L652 A653 I654 F659 L660	L652-F656 WeakPolarHBondContact O-CB 3.45Å; L652-F656 PolarHBondContact O-N 2.99Å; A653-F656 PolarHBondContact O-N 3.36Å; I654-F656 VanDerWaalsContact C-N 3.34Å; I654-F656 PolarHBondContact O-N 3.36Å; F656-F659 PolarHBondContact O-N 2.95Å; F656-L660 HydrophobicContact CD1-CD1 3.69Å; F656-L660 HydrophobicContact CE1-CD1 3.53Å; F656-L660 HydrophobicContact CZ-CD1 4.27Å; F656-L660 WeakPolarHBondContact O-CG 3.31Å; F656-L660 PolarHBondContact O-N 3.44Å
657	V	84.2	Confident	82.1	Confident	90 Å²	90	109.7 Å²	109.7	55%	0.545	59%	0.585	S	S	.	*	H	α-helix	trans	-62.8	-45.9	171.3	172.1	0	0	0	0	110.8	A653 I654 F659 L660 T661	A653-V657 WeakPolarHBondContact O-CG2 3.38Å; A653-V657 PolarHBondContact O-N 3.2Å; I654-V657 PolarHBondContact O-N 3.24Å; V657-F659 PolarHBondContact O-N 2.98Å; V657-L660 CarbonylContact O-C 3.55Å; V657-L660 PolarHBondContact O-N 3.24Å; V657-T661 HydrophobicContact CG1-CG2 4.25Å; V657-T661 PolarHBondContact O-N 2.64Å; V657-T661 PolarHBondContact O-OG1 3.44Å
658	H	75.4	Confident	81.6	Confident	142 Å²	142	109.7 Å²	109.7	66%	0.657	59%	0.586	S	S	*	*	H	α-helix	trans	-70.3	-9.4	-179.6	-154.5	-38.3	0	0	0	113.9	I654 L655	I654-H658 WeakPolarHBondContact O-CB 3.28Å; I654-H658 PolarHBondContact O-N 3Å; L655-H658 PolarHBondContact O-N 2.98Å
659	F	75.1	Confident	81	Confident	179 Å²	179	109.4 Å²	109.4	79%	0.785	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-3.1	169	-94.6	-77.2	0	0	0	113.7	L655 F656 V657	L655-F659 WeakPolarHBondContact O-CD2 3.5Å; L655-F659 PolarHBondContact O-N 3.39Å; F656-F659 PolarHBondContact O-N 2.95Å; V657-F659 PolarHBondContact O-N 2.98Å
660	L	70.9	Confident	80.7	Confident	127 Å²	127	110.8 Å²	110.8	67%	0.665	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	4.2	-179.5	-68.8	174.6	0	0	0	113.4	F656 V657	F656-L660 HydrophobicContact CD1-CD1 3.69Å; F656-L660 HydrophobicContact CE1-CD1 3.53Å; F656-L660 HydrophobicContact CZ-CD1 4.27Å; F656-L660 WeakPolarHBondContact O-CG 3.31Å; F656-L660 PolarHBondContact O-N 3.44Å; V657-L660 CarbonylContact O-C 3.55Å; V657-L660 PolarHBondContact O-N 3.24Å
661	T	59.9	Low	79.7	Confident	153 Å²	153	112.1 Å²	112.1	94%	0.939	60%	0.601	S	S	*	*			trans	-122	0	173.1	60.7	0	0	0	0	110.9	V657	V657-T661 HydrophobicContact CG1-CG2 4.25Å; V657-T661 PolarHBondContact O-N 2.64Å; V657-T661 PolarHBondContact O-OG1 3.44Å

Retrieved 661 of 661 residues in 1215.6 ms (Link to these results)

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