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Synaptotagmin-like protein 2

Isoform 11 acts as a RAB27A effector protein and plays a role in cytotoxic granule exocytosis in lymphocytes. Required for cytotoxic granule docking at the immunologic synapse. Isoform 1 may play a role in melanosome transport and vesicle trafficking. It controls melanosome distribution in the cell periphery and regulates melanocyte morphology. Isoform 1 acts as a positive mediator of mucus secretion by the surface mucus cells of the stomach. Mediates basal mucus secretion by gastric surface cells by promoting the proper granule biognesis and docking of mucus granules with the apical plasma membrane.

AlphaFold DB , UniProt , Accession Q99N50, Species MOUSE (Mus musculus, Mouse), Gene Sytl2, Length 950 aa.

						>SYTL2_MOUSE|Q99N50|Sytl2
MIDLSFLTEEEQDAILKVLQRDAALKRAEEERVRHLPEKIKDDQQLKNMSGQWFYEAKAKRHRDKIHGADIIRASMRRKKLPAAAEQNKDTAMRAKESWVNNVNKDAVLPPEIAVVEEPEDDTDPAGPSSSLVDPASSVIDMSQESTRTPAVSLPKQRKNPFNSPKLPEDHSLQQTKPEQSKTGKAGLFQISKEGELSESKEKSSIPDMPRQQLEKPKQTVSTEPENASHTKAPIPKARKLIYKSNDLEKDDNQSFPRQRRDSLNARGAPRGILKRNSSSSSTDSETLRLNYNLDPKSKILSPGLTIHERISEKEFSLEDDSSTSSLEPLKHVRFSAVKNELPQSPRPVLGQEVGEFTVLESDQLQNGTEDAGDIEEFQNHPELSHKTPLSHYQLVSSPSDSGREREQLMSSGSAPRDEIPCHSDILPTGPQCVESSSVINGQQEKSSHFTKLPSELSKSPSDELTQCGEPEPSQTADHSFRDHRQGSEEEHSPVLKTLERRAARKLPSKSLEDIPSDSSNQAKVDNLPEELVRSAEDDQKADQEPDTNECIPGISTVPSLPDNQFSHPDKLKRMSKSVPAFLQDESDDRETDTASESSYQLRRYKKSPSSLTNLSSSSGMTSLSSASGSVMSVYSGDFGNLEVKGSVQFALDYVESLKELHVFVAQCKDLAAADVKKQRSDPYVKTYLLPDKGKMGKKKTLVVKKTLNPVYNEILRYKIERQFLKTQKLNLSVWHRDTFKRNSFLGEVELDLETWDWDSKQNKQLKWYPLKRKTAPVALETENRGEMKLALQYVPEPSPGKKLPTTGEVHIWVKECLDLPLLRGSHLNSFVKCTILPDTSRKSRQKTRAVGKTTNPVFNHTMVYDGFRPEDLMEACVELTVWDHYKLTNQFLGGLRIGFGTGKSYGTEVDWMDSTSEEVALWEKMVNSPNTWVEATLPLRMLLIAKLSK
					

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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	71.5	Confident	84.3	Confident	152 Å²	152	99.5 Å²	99.5	75%	0.749	50%	0.501	S	S	*	.				0	132.9	0	-171.8	172.6	72.9	0	0	106.7	S75	M1-S75 WeakPolarHBondContact CG-OG 3.33Å
2	I	81	Confident	84.8	Confident	86 Å²	86	94.7 Å²	94.7	44%	0.441	48%	0.475	S	S	.	.			trans	-86	138.8	-176.3	-59.4	165.9	0	0	0	108.1	L4 I71 I72 S75	I2-L4 HydrophobicContact CB-CD2 4.4Å; I2-L4 HydrophobicContact CG2-CD2 3.7Å; I2-L4 HydrophobicContact CG2-CG 4.26Å; I2-I71 HydrophobicContact CD1-CG2 3.91Å; I2-I71 HydrophobicContact CG1-CG2 3.88Å; I2-I72 HydrophobicContact CD1-CG1 4.24Å; I2-S75 PolarHBondContact N-OG 2.97Å; I2-S75 VanDerWaalsContact O-CB 3.29Å; I2-S75 WeakPolarHBondContact O-CB 3.44Å; I2-S75 PolarHBondContact O-OG 2.89Å
3	D	83.5	Confident	85.2	Confident	105 Å²	105	92.6 Å²	92.6	56%	0.561	47%	0.467	S	S	*	.			trans	-75.6	127.9	167.2	-170.7	3.8	0	0	0	109.1	S5 F6	D3-S5 VanDerWaalsContact CG-OG 3.24Å; D3-S5 WeakPolarHBondContact OD1-CB 3.23Å; D3-S5 PolarHBondContact OD1-N 3.44Å; D3-S5 PolarHBondContact OD1-OG 3.33Å; D3-S5 PolarHBondContact OD2-OG 3.08Å; D3-F6 WeakPolarHBondContact O-CE1 3.49Å; D3-F6 WeakPolarHBondContact O-CZ 3.4Å
4	L	84	Confident	85.7	Confident	20 Å²	20	89.8 Å²	89.8	11%	0.105	46%	0.464	C	S	.	.			trans	-125.6	17.7	-179.2	-62.1	-177.9	0	0	0	110.6	I2 F6 L7 I72 S75 M76 K79	I2-L4 HydrophobicContact CB-CD2 4.4Å; I2-L4 HydrophobicContact CG2-CD2 3.7Å; I2-L4 HydrophobicContact CG2-CG 4.26Å; L4-F6 VanDerWaalsContact C-N 3.32Å; L4-F6 PolarHBondContact O-N 3.31Å; L4-L7 HydrophobicContact CB-CD1 3.88Å; L4-L7 HydrophobicContact CD2-CD1 3.68Å; L4-L7 HydrophobicContact CG-CD1 4.25Å; L4-I72 HydrophobicContact CD1-CG2 4.06Å; L4-S75 VanDerWaalsContact CD1-CB 3.42Å; L4-M76 HydrophobicContact CD1-CG 3.65Å; L4-K79 PolarHBondContact O-NZ 2.77Å
5	S	80.3	Confident	86.1	Confident	73 Å²	73	87.1 Å²	87.1	51%	0.51	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-36.6	-178	58	0	0	0	0	113.1	D3 L7 K79	D3-S5 VanDerWaalsContact CG-OG 3.24Å; D3-S5 WeakPolarHBondContact OD1-CB 3.23Å; D3-S5 PolarHBondContact OD1-N 3.44Å; D3-S5 PolarHBondContact OD1-OG 3.33Å; D3-S5 PolarHBondContact OD2-OG 3.08Å; S5-L7 PolarHBondContact O-N 3.49Å; S5-K79 WeakPolarHBondContact O-CE 3.41Å; S5-K79 PolarHBondContact O-NZ 2.82Å
6	F	86.5	Confident	86.4	Confident	151 Å²	151	87.3 Å²	87.3	66%	0.662	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-24	-176.9	50.1	-95.7	0	0	0	115.5	D3 L4	D3-F6 WeakPolarHBondContact O-CE1 3.49Å; D3-F6 WeakPolarHBondContact O-CZ 3.4Å; L4-F6 VanDerWaalsContact C-N 3.32Å; L4-F6 PolarHBondContact O-N 3.31Å
7	L	84.4	Confident	86.8	Confident	26 Å²	26	87.7 Å²	87.7	14%	0.136	45%	0.449	C	S	.	.			trans	-65	139.4	-177.2	-72.5	151	0	0	0	112.4	L4 S5 E11 Q12 I15 K79	L4-L7 HydrophobicContact CB-CD1 3.88Å; L4-L7 HydrophobicContact CD2-CD1 3.68Å; L4-L7 HydrophobicContact CG-CD1 4.25Å; S5-L7 PolarHBondContact O-N 3.49Å; L7-E11 VanDerWaalsContact CA-OE2 3.24Å; L7-E11 WeakPolarHBondContact CA-OE2 3.16Å; L7-E11 HydrophobicContact CB-CB 4.32Å; L7-E11 HydrophobicContact CD2-CB 3.66Å; L7-E11 HydrophobicContact CD2-CG 4.34Å; L7-Q12 HydrophobicContact CB-CG 4Å; L7-Q12 PolarHBondContact O-NE2 2.98Å; L7-Q12 VanDerWaalsContact O-NE2 3.11Å; L7-I15 HydrophobicContact CD1-CD1 3.82Å; L7-I15 HydrophobicContact CD2-CD1 3.86Å; L7-I15 HydrophobicContact CG-CD1 4.5Å; L7-K79 PolarHBondContact O-NZ 3.22Å
8	T	88.6	Confident	87.2	Confident	63 Å²	63	87 Å²	87	39%	0.387	45%	0.45	S	S	.	.			trans	-66.3	172.7	171.5	77.3	0	0	0	0	111.5	E10 E11 Q12	T8-E10 VanDerWaalsContact C-N 3.35Å; T8-E10 PolarHBondContact OG1-N 2.84Å; T8-E11 PolarHBondContact N-OE2 2.85Å; T8-E11 WeakPolarHBondContact OG1-CG 3.44Å; T8-E11 PolarHBondContact OG1-N 3.11Å; T8-E11 VanDerWaalsContact OG1-N 3.08Å; T8-Q12 WeakPolarHBondContact O-CB 3.19Å; T8-Q12 VanDerWaalsContact O-CG 3.22Å; T8-Q12 WeakPolarHBondContact O-CG 3.28Å; T8-Q12 PolarHBondContact O-N 2.71Å; T8-Q12 VanDerWaalsContact O-N 3.14Å; T8-Q12 PolarHBondContact O-NE2 2.98Å
9	E	86.9	Confident	87.5	Confident	167 Å²	167	82.9 Å²	82.9	78%	0.78	43%	0.429	S	S	*	.	H	α-helix	trans	-68.9	-35.9	173.7	-172.6	160.1	-154.7	0	0	111.8	Q12 D13	E9-Q12 PolarHBondContact O-N 3.25Å; E9-D13 WeakPolarHBondContact O-CB 3.14Å; E9-D13 PolarHBondContact O-N 3Å
10	E	90	Very high	87.6	Confident	160 Å²	160	85.8 Å²	85.8	75%	0.748	44%	0.44	S	S	*	.	H	α-helix	trans	-65	-45.2	177.3	-61	160.8	164.2	0	0	111.5	T8 D13 A14	T8-E10 VanDerWaalsContact C-N 3.35Å; T8-E10 PolarHBondContact OG1-N 2.84Å; E10-D13 PolarHBondContact O-N 3.34Å; E10-A14 WeakPolarHBondContact O-CB 3.38Å; E10-A14 PolarHBondContact O-N 2.91Å
11	E	91.2	Very high	87.9	Confident	92 Å²	92	89.3 Å²	89.3	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-65.7	-38.1	175.3	-66.2	172.1	140.8	0	0	111.6	L7 T8 A14 I15	L7-E11 VanDerWaalsContact CA-OE2 3.24Å; L7-E11 WeakPolarHBondContact CA-OE2 3.16Å; L7-E11 HydrophobicContact CB-CB 4.32Å; L7-E11 HydrophobicContact CD2-CB 3.66Å; L7-E11 HydrophobicContact CD2-CG 4.34Å; T8-E11 PolarHBondContact N-OE2 2.85Å; T8-E11 WeakPolarHBondContact OG1-CG 3.44Å; T8-E11 PolarHBondContact OG1-N 3.11Å; T8-E11 VanDerWaalsContact OG1-N 3.08Å; E11-A14 PolarHBondContact O-N 3.33Å; E11-I15 WeakPolarHBondContact O-CB 3.19Å; E11-I15 WeakPolarHBondContact O-CD1 3.22Å; E11-I15 VanDerWaalsContact O-CG1 3.25Å; E11-I15 WeakPolarHBondContact O-CG1 3.43Å; E11-I15 PolarHBondContact O-N 2.83Å
12	Q	89.3	Confident	88.8	Confident	41 Å²	41	85.8 Å²	85.8	19%	0.192	43%	0.432	C	S	.	.	H	α-helix	trans	-64.7	-44.3	175.2	-78.2	169.9	81.8	0	0	112.1	L7 T8 E9 I15 L16 M76	L7-Q12 HydrophobicContact CB-CG 4Å; L7-Q12 PolarHBondContact O-NE2 2.98Å; L7-Q12 VanDerWaalsContact O-NE2 3.11Å; T8-Q12 WeakPolarHBondContact O-CB 3.19Å; T8-Q12 VanDerWaalsContact O-CG 3.22Å; T8-Q12 WeakPolarHBondContact O-CG 3.28Å; T8-Q12 PolarHBondContact O-N 2.71Å; T8-Q12 VanDerWaalsContact O-N 3.14Å; T8-Q12 PolarHBondContact O-NE2 2.98Å; E9-Q12 PolarHBondContact O-N 3.25Å; Q12-I15 PolarHBondContact O-N 3.5Å; Q12-L16 WeakPolarHBondContact O-CB 3.4Å; Q12-L16 PolarHBondContact O-N 3.33Å; Q12-M76 HydrophobicContact CB-CE 3.98Å; Q12-M76 HydrophobicContact CG-CE 4.32Å; Q12-M76 WeakPolarHBondContact O-CE 3.43Å
13	D	90.1	Very high	89.2	Confident	68 Å²	68	83.2 Å²	83.2	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-38.3	176.4	174	57.1	0	0	0	111.7	E9 E10 L16 K17	E9-D13 WeakPolarHBondContact O-CB 3.14Å; E9-D13 PolarHBondContact O-N 3Å; E10-D13 PolarHBondContact O-N 3.34Å; D13-L16 PolarHBondContact O-N 3.39Å; D13-K17 WeakPolarHBondContact O-CB 3.35Å; D13-K17 VanDerWaalsContact O-CG 3.28Å; D13-K17 WeakPolarHBondContact O-CG 3.48Å; D13-K17 PolarHBondContact O-N 2.86Å; D13-K17 WeakPolarHBondContact OD1-CE 3.36Å; D13-K17 IonicContact OD1-NZ 3.55Å; D13-K17 WeakPolarHBondContact OD2-CE 3.22Å; D13-K17 IonicContact OD2-NZ 2.6Å; D13-K17 PolarHBondContact OD2-NZ 3Å
14	A	93.2	Very high	89.7	Confident	53 Å²	53	80.2 Å²	80.2	44%	0.438	41%	0.414	S	S	.	.	H	α-helix	trans	-58.3	-48.9	171.1	0	0	0	0	0	111.9	E10 E11 L16 K17 V18	E10-A14 WeakPolarHBondContact O-CB 3.38Å; E10-A14 PolarHBondContact O-N 2.91Å; E11-A14 PolarHBondContact O-N 3.33Å; A14-L16 PolarHBondContact O-N 3.28Å; A14-K17 PolarHBondContact O-N 3.36Å; A14-V18 WeakPolarHBondContact O-CG2 3.49Å; A14-V18 PolarHBondContact O-N 2.6Å
15	I	91.3	Very high	90	Very high	50 Å²	50	85 Å²	85	26%	0.256	44%	0.439	S	S	.	.	H	α-helix	trans	-61.1	-42.4	175.6	-69.8	165.2	0	0	0	111	L7 E11 Q12 K17 V18 L19 I72 M76	L7-I15 HydrophobicContact CD1-CD1 3.82Å; L7-I15 HydrophobicContact CD2-CD1 3.86Å; L7-I15 HydrophobicContact CG-CD1 4.5Å; E11-I15 WeakPolarHBondContact O-CB 3.19Å; E11-I15 WeakPolarHBondContact O-CD1 3.22Å; E11-I15 VanDerWaalsContact O-CG1 3.25Å; E11-I15 WeakPolarHBondContact O-CG1 3.43Å; E11-I15 PolarHBondContact O-N 2.83Å; Q12-I15 PolarHBondContact O-N 3.5Å; I15-K17 PolarHBondContact O-N 3.42Å; I15-V18 PolarHBondContact O-N 3.14Å; I15-L19 HydrophobicContact CG2-CD1 3.79Å; I15-L19 HydrophobicContact CG2-CG 4.39Å; I15-L19 VanDerWaalsContact O-CG 3.3Å; I15-L19 WeakPolarHBondContact O-CG 3.25Å; I15-L19 PolarHBondContact O-N 3.17Å; I15-I72 HydrophobicContact CG2-CG2 3.8Å; I15-M76 HydrophobicContact CB-CE 4.49Å; I15-M76 HydrophobicContact CG2-CE 4.3Å; I15-M76 HydrophobicContact CG2-SD 3.72Å
16	L	90.9	Very high	90.4	Very high	89 Å²	89	86.2 Å²	86.2	47%	0.466	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-40.8	179.2	-170	61	0	0	0	111.9	Q12 D13 A14 V18 L19 Q20 M76	Q12-L16 WeakPolarHBondContact O-CB 3.4Å; Q12-L16 PolarHBondContact O-N 3.33Å; D13-L16 PolarHBondContact O-N 3.39Å; A14-L16 PolarHBondContact O-N 3.28Å; L16-V18 VanDerWaalsContact C-N 3.34Å; L16-V18 PolarHBondContact O-N 2.88Å; L16-L19 PolarHBondContact O-N 2.87Å; L16-Q20 WeakPolarHBondContact O-CB 3.18Å; L16-Q20 PolarHBondContact O-N 2.87Å; L16-M76 HydrophobicContact CB-CE 4.14Å
17	K	92.5	Very high	90.6	Very high	95 Å²	95	86 Å²	86	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-65.1	-33.3	174.9	-75.8	167.2	173.9	167.9	0	112.6	D13 A14 I15 R21	D13-K17 WeakPolarHBondContact O-CB 3.35Å; D13-K17 VanDerWaalsContact O-CG 3.28Å; D13-K17 WeakPolarHBondContact O-CG 3.48Å; D13-K17 PolarHBondContact O-N 2.86Å; D13-K17 WeakPolarHBondContact OD1-CE 3.36Å; D13-K17 IonicContact OD1-NZ 3.55Å; D13-K17 WeakPolarHBondContact OD2-CE 3.22Å; D13-K17 IonicContact OD2-NZ 2.6Å; D13-K17 PolarHBondContact OD2-NZ 3Å; A14-K17 PolarHBondContact O-N 3.36Å; I15-K17 PolarHBondContact O-N 3.42Å; K17-R21 WeakPolarHBondContact O-CG 3.24Å; K17-R21 PolarHBondContact O-N 3.41Å
18	V	94.3	Very high	90.9	Very high	75 Å²	75	87.7 Å²	87.7	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-67	-52.4	169.8	173.2	0	0	0	0	110.2	A14 I15 L16 Q20 R21 D22	A14-V18 WeakPolarHBondContact O-CG2 3.49Å; A14-V18 PolarHBondContact O-N 2.6Å; I15-V18 PolarHBondContact O-N 3.14Å; L16-V18 VanDerWaalsContact C-N 3.34Å; L16-V18 PolarHBondContact O-N 2.88Å; V18-Q20 PolarHBondContact O-N 3.46Å; V18-Q20 VanDerWaalsContact O-N 3.12Å; V18-R21 PolarHBondContact O-N 2.95Å; V18-D22 PolarHBondContact O-N 2.76Å
19	L	92.6	Very high	90.9	Very high	10 Å²	10	88.8 Å²	88.8	5%	0.052	45%	0.448	C	S	.	.	H	α-helix	trans	-58.7	-28.5	179.4	-69.1	165.2	0	0	0	113.8	I15 L16 A23 A69 I72 R73 M76	I15-L19 HydrophobicContact CG2-CD1 3.79Å; I15-L19 HydrophobicContact CG2-CG 4.39Å; I15-L19 VanDerWaalsContact O-CG 3.3Å; I15-L19 WeakPolarHBondContact O-CG 3.25Å; I15-L19 PolarHBondContact O-N 3.17Å; L16-L19 PolarHBondContact O-N 2.87Å; L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.86Å; L19-A69 HydrophobicContact CD2-CB 3.69Å; L19-I72 HydrophobicContact CD1-CB 4.39Å; L19-I72 HydrophobicContact CD1-CG2 3.8Å; L19-R73 HydrophobicContact CD1-CG 3.94Å; L19-R73 HydrophobicContact CD2-CG 4.41Å; L19-M76 HydrophobicContact CD1-SD 3.93Å
20	Q	90.7	Very high	91	Very high	140 Å²	140	85.3 Å²	85.3	65%	0.654	43%	0.431	S	S	*	.	H	α-helix	trans	-76.6	-40.1	174.1	-171.5	177	5	0	0	112.4	L16 V18 A23 A24	L16-Q20 WeakPolarHBondContact O-CB 3.18Å; L16-Q20 PolarHBondContact O-N 2.87Å; V18-Q20 PolarHBondContact O-N 3.46Å; V18-Q20 VanDerWaalsContact O-N 3.12Å; Q20-A23 PolarHBondContact O-N 2.92Å; Q20-A24 PolarHBondContact O-N 3.3Å; Q20-A24 VanDerWaalsContact O-N 3.11Å
21	R	93	Very high	91	Very high	159 Å²	159	82.3 Å²	82.3	60%	0.6	42%	0.417	S	S	*	.	H	α-helix	trans	-65.3	-45.7	173.5	-73.4	179.7	-174.4	109.3	-6.8	111.3	K17 V18 A23 A24 L25	K17-R21 WeakPolarHBondContact O-CG 3.24Å; K17-R21 PolarHBondContact O-N 3.41Å; V18-R21 PolarHBondContact O-N 2.95Å; R21-A23 VanDerWaalsContact C-N 3.27Å; R21-A23 PolarHBondContact O-N 3.08Å; R21-A24 WeakPolarHBondContact O-CA 3.5Å; R21-A24 WeakPolarHBondContact O-CB 3.29Å; R21-A24 PolarHBondContact O-N 3.39Å; R21-L25 WeakPolarHBondContact O-CG 3.22Å; R21-L25 PolarHBondContact O-N 3.14Å
22	D	90.7	Very high	91.1	Very high	78 Å²	78	82.5 Å²	82.5	42%	0.417	41%	0.414	S	S	.	.	H	α-helix	trans	-57.3	-41.3	174.7	-70.7	-3.4	0	0	0	111.5	V18 A24 K26	V18-D22 PolarHBondContact O-N 2.76Å; D22-A24 VanDerWaalsContact C-N 3.28Å; D22-A24 PolarHBondContact O-N 3.16Å; D22-K26 WeakPolarHBondContact O-CB 3.37Å; D22-K26 PolarHBondContact O-N 2.94Å
23	A	90.1	Very high	91	Very high	32 Å²	32	82.6 Å²	82.6	26%	0.264	42%	0.417	S	S	.	.	H	α-helix	trans	-71.9	-16.6	176.6	0	0	0	0	0	114.3	L19 Q20 R21 R27	L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.32Å; L19-A23 PolarHBondContact O-N 2.86Å; Q20-A23 PolarHBondContact O-N 2.92Å; R21-A23 VanDerWaalsContact C-N 3.27Å; R21-A23 PolarHBondContact O-N 3.08Å; A23-R27 PolarHBondContact O-NE 3.49Å; A23-R27 PolarHBondContact O-NH2 2.9Å
24	A	92.5	Very high	91	Very high	43 Å²	43	86 Å²	86	36%	0.355	43%	0.425	S	S	.	.	H	α-helix	trans	-86.9	-47	171.2	0	0	0	0	0	111.1	Q20 R21 D22 K26 R27 A28	Q20-A24 PolarHBondContact O-N 3.3Å; Q20-A24 VanDerWaalsContact O-N 3.11Å; R21-A24 WeakPolarHBondContact O-CA 3.5Å; R21-A24 WeakPolarHBondContact O-CB 3.29Å; R21-A24 PolarHBondContact O-N 3.39Å; D22-A24 VanDerWaalsContact C-N 3.28Å; D22-A24 PolarHBondContact O-N 3.16Å; A24-K26 VanDerWaalsContact C-N 3.34Å; A24-K26 PolarHBondContact O-N 2.92Å; A24-R27 PolarHBondContact O-N 2.61Å; A24-A28 PolarHBondContact O-N 3.3Å
25	L	91.4	Very high	90.7	Very high	121 Å²	121	86.7 Å²	86.7	63%	0.634	42%	0.419	S	S	*	.	H	α-helix	trans	-58.3	-44.5	174.4	-71.3	170.6	0	0	0	111.6	R21 R27 A28 E29	R21-L25 WeakPolarHBondContact O-CG 3.22Å; R21-L25 PolarHBondContact O-N 3.14Å; L25-R27 VanDerWaalsContact C-N 3.34Å; L25-R27 PolarHBondContact O-N 3.03Å; L25-A28 PolarHBondContact O-N 3.49Å; L25-E29 WeakPolarHBondContact O-CB 3.3Å; L25-E29 PolarHBondContact O-N 3.46Å
26	K	89.2	Confident	90.4	Very high	97 Å²	97	84.9 Å²	84.9	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-39.2	177.9	-172.9	168.3	-174.6	-71.4	0	112.5	D22 A24 E30	D22-K26 WeakPolarHBondContact O-CB 3.37Å; D22-K26 PolarHBondContact O-N 2.94Å; A24-K26 VanDerWaalsContact C-N 3.34Å; A24-K26 PolarHBondContact O-N 2.92Å; K26-E30 IonicContact NZ-OE1 3.41Å; K26-E30 PolarHBondContact NZ-OE1 3.33Å; K26-E30 IonicContact NZ-OE2 3.08Å; K26-E30 WeakPolarHBondContact O-CB 3.47Å; K26-E30 WeakPolarHBondContact O-CG 3.49Å; K26-E30 PolarHBondContact O-N 2.94Å
27	R	90.5	Very high	90.2	Very high	148 Å²	148	84 Å²	84	56%	0.558	41%	0.41	S	S	*	.	H	α-helix	trans	-66.9	-48.3	173.9	-83	179.2	-67.5	120.1	-2.5	111.8	A23 A24 L25 E29 E30 E31	A23-R27 PolarHBondContact O-NE 3.49Å; A23-R27 PolarHBondContact O-NH2 2.9Å; A24-R27 PolarHBondContact O-N 2.61Å; L25-R27 VanDerWaalsContact C-N 3.34Å; L25-R27 PolarHBondContact O-N 3.03Å; R27-E29 PolarHBondContact O-N 2.87Å; R27-E30 PolarHBondContact O-N 3.34Å; R27-E30 VanDerWaalsContact O-N 3.11Å; R27-E31 WeakPolarHBondContact O-CG 3.28Å; R27-E31 PolarHBondContact O-N 3.41Å
28	A	91.1	Very high	89.9	Confident	61 Å²	61	86.2 Å²	86.2	50%	0.504	42%	0.421	S	S	.	.	H	α-helix	trans	-58	-37.6	177.8	0	0	0	0	0	112.3	A24 L25 R32	A24-A28 PolarHBondContact O-N 3.3Å; L25-A28 PolarHBondContact O-N 3.49Å; A28-R32 WeakPolarHBondContact O-CB 3.43Å; A28-R32 PolarHBondContact O-N 3.5Å
29	E	88.4	Confident	89.3	Confident	85 Å²	85	90.7 Å²	90.7	40%	0.397	44%	0.435	S	S	.	.	H	α-helix	trans	-71.2	-41.4	174.2	-178.6	65	177.4	0	0	112.5	L25 R27 E31 R32 V33	L25-E29 WeakPolarHBondContact O-CB 3.3Å; L25-E29 PolarHBondContact O-N 3.46Å; R27-E29 PolarHBondContact O-N 2.87Å; E29-E31 VanDerWaalsContact C-N 3.3Å; E29-E31 PolarHBondContact O-N 2.69Å; E29-R32 WeakPolarHBondContact O-CB 3.43Å; E29-R32 PolarHBondContact O-N 2.88Å; E29-R32 IonicContact OE1-CZ 2.66Å; E29-R32 IonicContact OE1-NE 2.75Å; E29-R32 IonicContact OE1-NH2 3.37Å; E29-R32 PolarHBondContact OE1-NH2 3.21Å; E29-R32 IonicContact OE2-CZ 3.53Å; E29-R32 IonicContact OE2-NE 3.71Å; E29-R32 PolarHBondContact OE2-NE 3.28Å; E29-R32 IonicContact OE2-NH2 3.76Å; E29-R32 PolarHBondContact OE2-NH2 2.95Å; E29-V33 WeakPolarHBondContact O-CB 3.14Å; E29-V33 VanDerWaalsContact O-CG2 3.31Å; E29-V33 WeakPolarHBondContact O-CG2 3.35Å; E29-V33 PolarHBondContact O-N 3.27Å
30	E	88	Confident	88.8	Confident	94 Å²	94	91.4 Å²	91.4	44%	0.439	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-38.5	173.8	-77.5	166.2	161.1	0	0	111.9	K26 R27 V33 R34	K26-E30 IonicContact NZ-OE1 3.41Å; K26-E30 PolarHBondContact NZ-OE1 3.33Å; K26-E30 IonicContact NZ-OE2 3.08Å; K26-E30 WeakPolarHBondContact O-CB 3.47Å; K26-E30 WeakPolarHBondContact O-CG 3.49Å; K26-E30 PolarHBondContact O-N 2.94Å; R27-E30 PolarHBondContact O-N 3.34Å; R27-E30 VanDerWaalsContact O-N 3.11Å; E30-V33 PolarHBondContact O-N 3.26Å; E30-R34 WeakPolarHBondContact O-CB 3.43Å; E30-R34 PolarHBondContact O-N 3.04Å
31	E	90.7	Very high	88.5	Confident	97 Å²	97	94.7 Å²	94.7	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-70.5	-40.9	173.5	-61.6	-158.8	109.1	0	0	112.1	R27 E29 V33 R34 H35	R27-E31 WeakPolarHBondContact O-CG 3.28Å; R27-E31 PolarHBondContact O-N 3.41Å; E29-E31 VanDerWaalsContact C-N 3.3Å; E29-E31 PolarHBondContact O-N 2.69Å; E31-V33 VanDerWaalsContact C-N 3.26Å; E31-V33 PolarHBondContact O-N 3.12Å; E31-R34 WeakPolarHBondContact O-CB 3.46Å; E31-R34 PolarHBondContact O-N 2.66Å; E31-R34 IonicContact OE1-CZ 2.65Å; E31-R34 IonicContact OE1-NH1 2.95Å; E31-R34 PolarHBondContact OE1-NH1 3.35Å; E31-R34 IonicContact OE1-NH2 3.28Å; E31-R34 PolarHBondContact OE1-NH2 2.92Å; E31-H35 PolarHBondContact O-CD2 2.86Å; E31-H35 VanDerWaalsContact O-CD2 3.23Å; E31-H35 PolarHBondContact O-N 3.11Å; E31-H35 VanDerWaalsContact O-N 3.14Å
32	R	92.8	Very high	88.1	Confident	97 Å²	97	91 Å²	91	37%	0.366	44%	0.443	S	S	.	.	H	α-helix	trans	-58.5	-39.4	172.7	-170	-163.6	65.9	75.7	-4.2	111.8	A28 E29 L36 M49	A28-R32 WeakPolarHBondContact O-CB 3.43Å; A28-R32 PolarHBondContact O-N 3.5Å; E29-R32 WeakPolarHBondContact O-CB 3.43Å; E29-R32 PolarHBondContact O-N 2.88Å; E29-R32 IonicContact OE1-CZ 2.66Å; E29-R32 IonicContact OE1-NE 2.75Å; E29-R32 IonicContact OE1-NH2 3.37Å; E29-R32 PolarHBondContact OE1-NH2 3.21Å; E29-R32 IonicContact OE2-CZ 3.53Å; E29-R32 IonicContact OE2-NE 3.71Å; E29-R32 PolarHBondContact OE2-NE 3.28Å; E29-R32 IonicContact OE2-NH2 3.76Å; E29-R32 PolarHBondContact OE2-NH2 2.95Å; R32-L36 PolarHBondContact O-N 3.33Å; R32-M49 PolarHBondContact NH1-O 3Å; R32-M49 PolarHBondContact NH2-O 3.41Å
33	V	88.2	Confident	87.9	Confident	42 Å²	42	93.4 Å²	93.4	26%	0.255	46%	0.456	S	S	.	.	H	α-helix	trans	-74.2	-36.1	177.9	173.1	0	0	0	0	111.7	E29 E30 E31 H35 L36 P37	E29-V33 WeakPolarHBondContact O-CB 3.14Å; E29-V33 VanDerWaalsContact O-CG2 3.31Å; E29-V33 WeakPolarHBondContact O-CG2 3.35Å; E29-V33 PolarHBondContact O-N 3.27Å; E30-V33 PolarHBondContact O-N 3.26Å; E31-V33 VanDerWaalsContact C-N 3.26Å; E31-V33 PolarHBondContact O-N 3.12Å; V33-H35 VanDerWaalsContact C-N 3.31Å; V33-H35 PolarHBondContact O-N 3.4Å; V33-L36 WeakPolarHBondContact O-CB 3.48Å; V33-L36 PolarHBondContact O-N 3.22Å; V33-L36 VanDerWaalsContact O-N 3.15Å; V33-P37 WeakPolarHBondContact O-CD 3.41Å
34	R	88.9	Confident	87.5	Confident	139 Å²	139	97.1 Å²	97.1	53%	0.525	47%	0.467	S	S	.	.	H	α-helix	trans	-58.4	-40.2	173.9	-174.5	179.9	67	-142.3	-4.7	112.4	E30 E31 L36 P37	E30-R34 WeakPolarHBondContact O-CB 3.43Å; E30-R34 PolarHBondContact O-N 3.04Å; E31-R34 WeakPolarHBondContact O-CB 3.46Å; E31-R34 PolarHBondContact O-N 2.66Å; E31-R34 IonicContact OE1-CZ 2.65Å; E31-R34 IonicContact OE1-NH1 2.95Å; E31-R34 PolarHBondContact OE1-NH1 3.35Å; E31-R34 IonicContact OE1-NH2 3.28Å; E31-R34 PolarHBondContact OE1-NH2 2.92Å; R34-L36 VanDerWaalsContact C-N 3.32Å; R34-L36 PolarHBondContact O-N 2.99Å; R34-P37 WeakPolarHBondContact O-CD 3.49Å
35	H	87.6	Confident	87	Confident	69 Å²	69	99.7 Å²	99.7	32%	0.319	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	17.2	178.1	-64.9	-67.9	0	0	0	114.1	E31 V33 E38	E31-H35 PolarHBondContact O-CD2 2.86Å; E31-H35 VanDerWaalsContact O-CD2 3.23Å; E31-H35 PolarHBondContact O-N 3.11Å; E31-H35 VanDerWaalsContact O-N 3.14Å; V33-H35 VanDerWaalsContact C-N 3.31Å; V33-H35 PolarHBondContact O-N 3.4Å; H35-E38 WeakPolarHBondContact CA-OE2 3.44Å; H35-E38 WeakPolarHBondContact CB-OE2 2.91Å; H35-E38 IonicContact CE1-OE1 2.98Å; H35-E38 IonicContact CG-OE2 2.68Å; H35-E38 IonicContact ND1-OE1 3.79Å; H35-E38 PolarHBondContact ND1-OE1 3.4Å; H35-E38 IonicContact ND1-OE2 3.81Å; H35-E38 PolarHBondContact ND1-OE2 3.2Å
36	L	85.6	Confident	86.8	Confident	11 Å²	11	95.5 Å²	95.5	6%	0.058	45%	0.45	C	S	.	.	S	Bend	trans	-88.6	-40	-178.8	-160.9	66.3	0	0	0	114.1	R32 V33 R34 E38 K39 I40 L46 M49	R32-L36 PolarHBondContact O-N 3.33Å; V33-L36 WeakPolarHBondContact O-CB 3.48Å; V33-L36 PolarHBondContact O-N 3.22Å; V33-L36 VanDerWaalsContact O-N 3.15Å; R34-L36 VanDerWaalsContact C-N 3.32Å; R34-L36 PolarHBondContact O-N 2.99Å; L36-E38 PolarHBondContact O-N 2.99Å; L36-K39 PolarHBondContact O-N 2.87Å; L36-I40 HydrophobicContact CD1-CD1 3.7Å; L36-I40 HydrophobicContact CD1-CG1 4.37Å; L36-I40 HydrophobicContact CG-CD1 3.98Å; L36-I40 PolarHBondContact O-N 3.2Å; L36-L46 HydrophobicContact CB-CD1 3.95Å; L36-L46 HydrophobicContact CD2-CD1 3.87Å; L36-L46 HydrophobicContact CG-CD1 3.7Å; L36-M49 HydrophobicContact CD1-CB 4.45Å; L36-M49 HydrophobicContact CD2-CB 3.81Å; L36-M49 WeakPolarHBondContact CD2-O 3.47Å
37	P	85	Confident	86.8	Confident	72 Å²	72	93.9 Å²	93.9	47%	0.468	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-31.5	174.1	-22.2	33.5	0	0	0	113	V33 R34 K39 L46	V33-P37 WeakPolarHBondContact O-CD 3.41Å; R34-P37 WeakPolarHBondContact O-CD 3.49Å; P37-K39 PolarHBondContact O-N 3.12Å; P37-L46 HydrophobicContact CB-CD1 4.49Å; P37-L46 HydrophobicContact CB-CD2 4.22Å; P37-L46 HydrophobicContact CG-CD1 4.11Å; P37-L46 HydrophobicContact CG-CD2 4.22Å
38	E	86.7	Confident	86.5	Confident	140 Å²	140	90.7 Å²	90.7	65%	0.654	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.3	174.5	-61.8	170.7	164.8	0	0	112.6	H35 L36	H35-E38 WeakPolarHBondContact CA-OE2 3.44Å; H35-E38 WeakPolarHBondContact CB-OE2 2.91Å; H35-E38 IonicContact CE1-OE1 2.98Å; H35-E38 IonicContact CG-OE2 2.68Å; H35-E38 IonicContact ND1-OE1 3.79Å; H35-E38 PolarHBondContact ND1-OE1 3.4Å; H35-E38 IonicContact ND1-OE2 3.81Å; H35-E38 PolarHBondContact ND1-OE2 3.2Å; L36-E38 PolarHBondContact O-N 2.99Å
39	K	82.4	Confident	86.2	Confident	169 Å²	169	92 Å²	92	74%	0.735	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-19.1	-173.8	-64.1	178.8	-176.9	176.8	0	113.8	L36 P37	L36-K39 PolarHBondContact O-N 2.87Å; P37-K39 PolarHBondContact O-N 3.12Å
40	I	82	Confident	86.2	Confident	26 Å²	26	88.5 Å²	88.5	13%	0.133	42%	0.419	C	S	.	.			trans	-133.4	109.3	-171.8	-55.4	-176.8	0	0	0	109.7	L36 Q45 L46 M49	L36-I40 HydrophobicContact CD1-CD1 3.7Å; L36-I40 HydrophobicContact CD1-CG1 4.37Å; L36-I40 HydrophobicContact CG-CD1 3.98Å; L36-I40 PolarHBondContact O-N 3.2Å; I40-Q45 HydrophobicContact CG2-CB 3.48Å; I40-Q45 VanDerWaalsContact CG2-CB 3.48Å; I40-L46 HydrophobicContact CB-CB 4.47Å; I40-L46 HydrophobicContact CB-CD1 4.47Å; I40-L46 HydrophobicContact CG2-CB 4.04Å; I40-M49 HydrophobicContact CD1-CB 4.09Å; I40-M49 HydrophobicContact CD1-CE 4.44Å; I40-M49 HydrophobicContact CD1-CG 4.25Å; I40-M49 HydrophobicContact CD1-SD 3.5Å; I40-M49 VanDerWaalsContact CD1-SD 3.5Å
41	K	83.3	Confident	86.2	Confident	209 Å²	209	85 Å²	85	91%	0.909	41%	0.407	S	S	*	.			trans	-89.4	-7.4	178.4	-63.1	-172.1	177.4	-174.5	0	114.9
42	D	85.8	Confident	85.9	Confident	80 Å²	80	85.6 Å²	85.6	43%	0.428	41%	0.411	S	S	.	.			trans	-92.4	115.9	173.2	164.6	33.9	0	0	0	109.6	Q44 Q45 L46	D42-Q44 PolarHBondContact O-N 2.94Å; D42-Q44 PolarHBondContact OD1-N 2.7Å; D42-Q45 HydrophobicContact CB-CB 4.07Å; D42-Q45 HydrophobicContact CB-CG 4.26Å; D42-Q45 PolarHBondContact O-N 2.75Å; D42-Q45 VanDerWaalsContact OD2-CB 3.29Å; D42-Q45 WeakPolarHBondContact OD2-CB 3.16Å; D42-Q45 WeakPolarHBondContact OD2-CG 3.46Å; D42-Q45 PolarHBondContact OD2-N 3.37Å; D42-L46 VanDerWaalsContact O-CB 3.32Å; D42-L46 WeakPolarHBondContact O-CB 3.37Å; D42-L46 PolarHBondContact O-N 3.21Å
43	D	85.2	Confident	85.7	Confident	130 Å²	130	87.6 Å²	87.6	70%	0.695	42%	0.418	S	S	*	.	H	α-helix	trans	-54.5	-33.4	177.3	-81.2	-18.7	0	0	0	113.1	L46 K47	D43-L46 PolarHBondContact O-N 3.17Å; D43-K47 WeakPolarHBondContact O-CB 3.44Å; D43-K47 PolarHBondContact O-N 3.29Å
44	Q	82.4	Confident	85.5	Confident	109 Å²	109	90.6 Å²	90.6	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-76	-41.8	-177.9	-170.6	57.4	73.6	0	0	111.6	D42 N48	D42-Q44 PolarHBondContact O-N 2.94Å; D42-Q44 PolarHBondContact OD1-N 2.7Å; Q44-N48 PolarHBondContact NE2-OD1 2.57Å; Q44-N48 WeakPolarHBondContact O-CB 3.43Å; Q44-N48 PolarHBondContact O-N 3.22Å; Q44-N48 PolarHBondContact O-ND2 3.49Å; Q44-N48 PolarHBondContact O-OD1 3.46Å
45	Q	82.2	Confident	85.2	Confident	98 Å²	98	89.7 Å²	89.7	46%	0.458	43%	0.425	S	S	.	.	H	α-helix	trans	-59.3	-47.1	165.7	-79	-87.4	-35.8	0	0	111.6	I40 D42 K47 N48 M49	I40-Q45 HydrophobicContact CG2-CB 3.48Å; I40-Q45 VanDerWaalsContact CG2-CB 3.48Å; D42-Q45 HydrophobicContact CB-CB 4.07Å; D42-Q45 HydrophobicContact CB-CG 4.26Å; D42-Q45 PolarHBondContact O-N 2.75Å; D42-Q45 VanDerWaalsContact OD2-CB 3.29Å; D42-Q45 WeakPolarHBondContact OD2-CB 3.16Å; D42-Q45 WeakPolarHBondContact OD2-CG 3.46Å; D42-Q45 PolarHBondContact OD2-N 3.37Å; Q45-K47 PolarHBondContact O-N 2.93Å; Q45-N48 WeakPolarHBondContact O-CB 3.09Å; Q45-N48 PolarHBondContact O-N 2.75Å; Q45-M49 WeakPolarHBondContact O-CB 3.42Å; Q45-M49 PolarHBondContact O-N 3.43Å
46	L	87.9	Confident	85	Confident	32 Å²	32	89.4 Å²	89.4	17%	0.168	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-45.5	-178.1	-179.6	60.5	0	0	0	111.2	L36 P37 I40 D42 D43 N48 M49 S50	L36-L46 HydrophobicContact CB-CD1 3.95Å; L36-L46 HydrophobicContact CD2-CD1 3.87Å; L36-L46 HydrophobicContact CG-CD1 3.7Å; P37-L46 HydrophobicContact CB-CD1 4.49Å; P37-L46 HydrophobicContact CB-CD2 4.22Å; P37-L46 HydrophobicContact CG-CD1 4.11Å; P37-L46 HydrophobicContact CG-CD2 4.22Å; I40-L46 HydrophobicContact CB-CB 4.47Å; I40-L46 HydrophobicContact CB-CD1 4.47Å; I40-L46 HydrophobicContact CG2-CB 4.04Å; D42-L46 VanDerWaalsContact O-CB 3.32Å; D42-L46 WeakPolarHBondContact O-CB 3.37Å; D42-L46 PolarHBondContact O-N 3.21Å; D43-L46 PolarHBondContact O-N 3.17Å; L46-N48 VanDerWaalsContact C-N 3.33Å; L46-N48 PolarHBondContact O-N 3.34Å; L46-M49 PolarHBondContact O-N 3.29Å; L46-S50 WeakPolarHBondContact O-CB 3.39Å; L46-S50 PolarHBondContact O-N 3.24Å; L46-S50 PolarHBondContact O-OG 2.85Å
47	K	87.4	Confident	85	Confident	63 Å²	63	90.9 Å²	90.9	27%	0.274	44%	0.438	S	S	.	.	H	α-helix	trans	-65	-33.1	175.4	-179.7	160.2	177.7	154.1	0	113.2	D43 Q45 S50 Q52 W53 E56	D43-K47 WeakPolarHBondContact O-CB 3.44Å; D43-K47 PolarHBondContact O-N 3.29Å; Q45-K47 PolarHBondContact O-N 2.93Å; K47-S50 WeakPolarHBondContact CA-OG 3.47Å; K47-S50 PolarHBondContact O-OG 3.29Å; K47-Q52 HydrophobicContact CG-CB 4.43Å; K47-Q52 PolarHBondContact O-N 2.76Å; K47-W53 HydrophobicContact CG-CB 4.2Å; K47-E56 VanDerWaalsContact CE-OE1 3.26Å; K47-E56 WeakPolarHBondContact CE-OE1 3.31Å; K47-E56 WeakPolarHBondContact CE-OE2 3.48Å; K47-E56 IonicContact NZ-OE1 3.24Å; K47-E56 PolarHBondContact NZ-OE1 3.42Å; K47-E56 IonicContact NZ-OE2 3.17Å; K47-E56 PolarHBondContact NZ-OE2 2.86Å
48	N	85.8	Confident	84.8	Confident	81 Å²	81	91 Å²	91	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-70.9	-48.4	173.5	-72	-14.9	0	0	0	111.5	Q44 Q45 L46 G51	Q44-N48 PolarHBondContact NE2-OD1 2.57Å; Q44-N48 WeakPolarHBondContact O-CB 3.43Å; Q44-N48 PolarHBondContact O-N 3.22Å; Q44-N48 PolarHBondContact O-ND2 3.49Å; Q44-N48 PolarHBondContact O-OD1 3.46Å; Q45-N48 WeakPolarHBondContact O-CB 3.09Å; Q45-N48 PolarHBondContact O-N 2.75Å; L46-N48 VanDerWaalsContact C-N 3.33Å; L46-N48 PolarHBondContact O-N 3.34Å; N48-G51 PolarHBondContact O-N 3.07Å
49	M	84.9	Confident	84.5	Confident	89 Å²	89	87.9 Å²	87.9	44%	0.438	43%	0.429	S	S	.	.	H	α-helix	trans	-82.6	-15.3	-174.4	-70.5	-164.4	68.5	0	0	114.8	R32 L36 I40 Q45 L46	R32-M49 PolarHBondContact NH1-O 3Å; R32-M49 PolarHBondContact NH2-O 3.41Å; L36-M49 HydrophobicContact CD1-CB 4.45Å; L36-M49 HydrophobicContact CD2-CB 3.81Å; L36-M49 WeakPolarHBondContact CD2-O 3.47Å; I40-M49 HydrophobicContact CD1-CB 4.09Å; I40-M49 HydrophobicContact CD1-CE 4.44Å; I40-M49 HydrophobicContact CD1-CG 4.25Å; I40-M49 HydrophobicContact CD1-SD 3.5Å; I40-M49 VanDerWaalsContact CD1-SD 3.5Å; Q45-M49 WeakPolarHBondContact O-CB 3.42Å; Q45-M49 PolarHBondContact O-N 3.43Å; L46-M49 PolarHBondContact O-N 3.29Å
50	S	88.3	Confident	84.6	Confident	12 Å²	12	88.1 Å²	88.1	8%	0.084	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-13.4	166.9	57.8	0	0	0	0	113.1	L46 K47 Q52	L46-S50 WeakPolarHBondContact O-CB 3.39Å; L46-S50 PolarHBondContact O-N 3.24Å; L46-S50 PolarHBondContact O-OG 2.85Å; K47-S50 WeakPolarHBondContact CA-OG 3.47Å; K47-S50 PolarHBondContact O-OG 3.29Å; S50-Q52 PolarHBondContact O-N 3.45Å; S50-Q52 WeakPolarHBondContact OG-CB 3.36Å; S50-Q52 PolarHBondContact OG-N 2.81Å
51	G	86.8	Confident	84.6	Confident	19 Å²	19	97.1 Å²	97.1	20%	0.196	46%	0.462	C	S	.	.			trans	67.4	11.4	-169.9	0	0	0	0	0	114.1	N48 W53 F54 Y55	N48-G51 PolarHBondContact O-N 3.07Å; G51-W53 PolarHBondContact O-N 2.84Å; G51-F54 VanDerWaalsContact O-CB 3.31Å; G51-F54 WeakPolarHBondContact O-CB 3.3Å; G51-F54 PolarHBondContact O-N 3.16Å; G51-Y55 WeakPolarHBondContact O-CD2 3.35Å; G51-Y55 PolarHBondContact O-N 2.81Å
52	Q	85.9	Confident	84.2	Confident	111 Å²	111	92.4 Å²	92.4	52%	0.519	44%	0.443	S	S	.	.	H	α-helix	trans	-60.4	-31.4	-175.5	-175.9	163.6	-28.3	0	0	112.9	K47 S50 F54 Y55 E56	K47-Q52 HydrophobicContact CG-CB 4.43Å; K47-Q52 PolarHBondContact O-N 2.76Å; S50-Q52 PolarHBondContact O-N 3.45Å; S50-Q52 WeakPolarHBondContact OG-CB 3.36Å; S50-Q52 PolarHBondContact OG-N 2.81Å; Q52-F54 VanDerWaalsContact C-N 3.25Å; Q52-F54 PolarHBondContact O-N 3.45Å; Q52-Y55 PolarHBondContact O-N 2.87Å; Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 2.82Å
53	W	87	Confident	83.6	Confident	138 Å²	138	100.2 Å²	100.2	52%	0.523	47%	0.467	S	S	.	.	H	α-helix	trans	-57.9	-34.3	171.2	74.7	-90.7	0	0	0	113.4	K47 G51 A57	K47-W53 HydrophobicContact CG-CB 4.2Å; G51-W53 PolarHBondContact O-N 2.84Å; W53-A57 VanDerWaalsContact O-CB 3.31Å; W53-A57 WeakPolarHBondContact O-CB 3.38Å; W53-A57 PolarHBondContact O-N 2.95Å
54	F	85.5	Confident	82.9	Confident	106 Å²	106	100.2 Å²	100.2	47%	0.465	47%	0.467	S	S	.	.	H	α-helix	trans	-72.9	-40.8	179	170.5	-94.7	0	0	0	110.9	G51 Q52 A57 K58	G51-F54 VanDerWaalsContact O-CB 3.31Å; G51-F54 WeakPolarHBondContact O-CB 3.3Å; G51-F54 PolarHBondContact O-N 3.16Å; Q52-F54 VanDerWaalsContact C-N 3.25Å; Q52-F54 PolarHBondContact O-N 3.45Å; F54-A57 PolarHBondContact O-N 2.77Å; F54-K58 HydrophobicContact CE1-CD 4.43Å; F54-K58 VanDerWaalsContact O-CB 3.28Å; F54-K58 WeakPolarHBondContact O-CB 3.47Å; F54-K58 PolarHBondContact O-N 3.23Å
55	Y	82.1	Confident	82.5	Confident	119 Å²	119	104.7 Å²	104.7	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-39.9	175.1	-70.6	-74.2	0	0	0	112.1	G51 Q52 K58 A59	G51-Y55 WeakPolarHBondContact O-CD2 3.35Å; G51-Y55 PolarHBondContact O-N 2.81Å; Q52-Y55 PolarHBondContact O-N 2.87Å; Y55-K58 PolarHBondContact O-N 2.97Å; Y55-A59 WeakPolarHBondContact O-CB 3.19Å; Y55-A59 PolarHBondContact O-N 2.91Å
56	E	84	Confident	82.1	Confident	64 Å²	64	105.4 Å²	105.4	30%	0.299	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-45.6	170.5	-74	173.9	-148.9	0	0	112.4	K47 Q52 A59 K60	K47-E56 VanDerWaalsContact CE-OE1 3.26Å; K47-E56 WeakPolarHBondContact CE-OE1 3.31Å; K47-E56 WeakPolarHBondContact CE-OE2 3.48Å; K47-E56 IonicContact NZ-OE1 3.24Å; K47-E56 PolarHBondContact NZ-OE1 3.42Å; K47-E56 IonicContact NZ-OE2 3.17Å; K47-E56 PolarHBondContact NZ-OE2 2.86Å; Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 2.82Å; E56-A59 PolarHBondContact O-N 2.97Å; E56-K60 WeakPolarHBondContact O-CG 3.49Å; E56-K60 PolarHBondContact O-N 3.23Å
57	A	83.9	Confident	81.6	Confident	42 Å²	42	107.3 Å²	107.3	35%	0.347	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-37.5	178.3	0	0	0	0	0	112.4	W53 F54 K60 R61	W53-A57 VanDerWaalsContact O-CB 3.31Å; W53-A57 WeakPolarHBondContact O-CB 3.38Å; W53-A57 PolarHBondContact O-N 2.95Å; F54-A57 PolarHBondContact O-N 2.77Å; A57-K60 PolarHBondContact O-N 2.88Å; A57-R61 PolarHBondContact O-N 3.42Å
58	K	81.3	Confident	81.4	Confident	75 Å²	75	106.3 Å²	106.3	33%	0.326	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-47.9	174.1	-175.7	178.3	178.5	178.9	0	111.1	F54 Y55 K60 R61 H62 H67	F54-K58 HydrophobicContact CE1-CD 4.43Å; F54-K58 VanDerWaalsContact O-CB 3.28Å; F54-K58 WeakPolarHBondContact O-CB 3.47Å; F54-K58 PolarHBondContact O-N 3.23Å; Y55-K58 PolarHBondContact O-N 2.97Å; K58-K60 VanDerWaalsContact C-N 3.28Å; K58-K60 PolarHBondContact O-N 3.32Å; K58-R61 PolarHBondContact O-N 2.88Å; K58-R61 VanDerWaalsContact O-N 3.07Å; K58-H62 PolarHBondContact O-CD2 3.47Å; K58-H62 PolarHBondContact O-N 3.45Å; K58-H67 PolarHBondContact NZ-NE2 2.86Å
59	A	81.5	Confident	81.4	Confident	73 Å²	73	103.9 Å²	103.9	60%	0.603	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-30.8	177.5	0	0	0	0	0	113.3	Y55 E56 R61	Y55-A59 WeakPolarHBondContact O-CB 3.19Å; Y55-A59 PolarHBondContact O-N 2.91Å; E56-A59 PolarHBondContact O-N 2.97Å; A59-R61 VanDerWaalsContact C-N 3.34Å
60	K	84.5	Confident	81.5	Confident	174 Å²	174	102.9 Å²	102.9	76%	0.757	49%	0.493	S	S	*	.	H	α-helix	trans	-73.3	-19.8	173.7	-74.2	172.2	-179.8	173.7	0	114	E56 A57 K58	E56-K60 WeakPolarHBondContact O-CG 3.49Å; E56-K60 PolarHBondContact O-N 3.23Å; A57-K60 PolarHBondContact O-N 2.88Å; K58-K60 VanDerWaalsContact C-N 3.28Å; K58-K60 PolarHBondContact O-N 3.32Å
61	R	80.5	Confident	81.4	Confident	216 Å²	216	104.9 Å²	104.9	82%	0.815	50%	0.503	S	S	*	.	H	α-helix	trans	-99.9	-34.6	178.2	-72.9	-174.9	177.9	-171.3	0.4	114.1	A57 K58 A59	A57-R61 PolarHBondContact O-N 3.42Å; K58-R61 PolarHBondContact O-N 2.88Å; K58-R61 VanDerWaalsContact O-N 3.07Å; A59-R61 VanDerWaalsContact C-N 3.34Å
62	H	75	Confident	81.5	Confident	110 Å²	110	106.3 Å²	106.3	51%	0.509	51%	0.506	S	S	.	.			trans	-120.5	118.6	-172.7	-56.7	-82	0	0	0	110.1	K58 D64	K58-H62 PolarHBondContact O-CD2 3.47Å; K58-H62 PolarHBondContact O-N 3.45Å; H62-D64 PolarHBondContact O-N 3.11Å
63	R	74	Confident	81.5	Confident	244 Å²	244	104.5 Å²	104.5	92%	0.921	49%	0.494	S	S	*	.			trans	-68.6	-25.8	173.4	-73.9	-176.5	172	177.8	-2.9	112.3	K65	R63-K65 PolarHBondContact O-N 3.26Å
64	D	70.1	Confident	81.5	Confident	129 Å²	129	100 Å²	100	69%	0.69	49%	0.486	S	S	*	.			trans	-76.6	111	-176.7	-54.7	-55.7	0	0	0	111.5	H62 I66	H62-D64 PolarHBondContact O-N 3.11Å; D64-I66 VanDerWaalsContact C-N 3.26Å; D64-I66 PolarHBondContact O-N 2.88Å
65	K	73.2	Confident	81.5	Confident	203 Å²	203	95.4 Å²	95.4	88%	0.883	47%	0.467	S	S	*	.			trans	-77	-8.7	177.7	-63.5	-175.2	178.6	-178	0	113.9	R63	R63-K65 PolarHBondContact O-N 3.26Å
66	I	74.4	Confident	81.5	Confident	114 Å²	114	91 Å²	91	59%	0.585	45%	0.451	S	S	*	.			trans	-78.7	123.9	-173.6	-46.7	177.7	0	0	0	109.7	D64 D70 I71	D64-I66 VanDerWaalsContact C-N 3.26Å; D64-I66 PolarHBondContact O-N 2.88Å; I66-D70 HydrophobicContact CG2-CB 4.28Å; I66-I71 HydrophobicContact CG2-CD1 4.27Å; I66-I71 HydrophobicContact CG2-CG1 3.67Å
67	H	77.8	Confident	81.3	Confident	71 Å²	71	96.6 Å²	96.6	33%	0.329	47%	0.469	S	S	.	.			trans	-73.3	143.5	174.2	-90.9	81.4	0	0	0	111.4	K58 A69 D70 I71	K58-H67 PolarHBondContact NZ-NE2 2.86Å; H67-A69 PolarHBondContact O-N 2.91Å; H67-D70 WeakPolarHBondContact O-CA 3.5Å; H67-D70 WeakPolarHBondContact O-CB 3.4Å; H67-D70 PolarHBondContact O-N 3Å; H67-I71 PolarHBondContact O-N 3.21Å
68	G	83.5	Confident	80.5	Confident	43 Å²	43	103.4 Å²	103.4	44%	0.443	49%	0.486	S	S	.	.	H	α-helix	trans	-55	-38.1	178.2	0	0	0	0	0	113.1	D70 I71 I72	G68-D70 VanDerWaalsContact C-N 3.26Å; G68-D70 PolarHBondContact O-N 3.02Å; G68-I71 WeakPolarHBondContact O-CB 3.42Å; G68-I71 PolarHBondContact O-N 2.76Å; G68-I71 VanDerWaalsContact O-N 3.12Å; G68-I72 WeakPolarHBondContact O-CG1 3.39Å; G68-I72 PolarHBondContact O-N 3.08Å
69	A	86.2	Confident	79.4	Confident	29 Å²	29	103.4 Å²	103.4	24%	0.24	49%	0.486	C	S	.	.	H	α-helix	trans	-57.2	-34.9	173.1	0	0	0	0	0	113.2	L19 H67 R73	L19-A69 HydrophobicContact CD2-CB 3.69Å; H67-A69 PolarHBondContact O-N 2.91Å; A69-R73 VanDerWaalsContact O-CB 3.32Å; A69-R73 WeakPolarHBondContact O-CB 3.24Å; A69-R73 VanDerWaalsContact O-CG 3.22Å; A69-R73 WeakPolarHBondContact O-CG 3.39Å; A69-R73 PolarHBondContact O-N 3.32Å; A69-R73 PolarHBondContact O-NE 3.1Å
70	D	85.5	Confident	78.1	Confident	68 Å²	68	108.8 Å²	108.8	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-76.5	-33.7	177.1	-60.8	-44.4	0	0	0	112.2	I66 H67 G68 R73 A74	I66-D70 HydrophobicContact CG2-CB 4.28Å; H67-D70 WeakPolarHBondContact O-CA 3.5Å; H67-D70 WeakPolarHBondContact O-CB 3.4Å; H67-D70 PolarHBondContact O-N 3Å; G68-D70 VanDerWaalsContact C-N 3.26Å; G68-D70 PolarHBondContact O-N 3.02Å; D70-R73 IonicContact OD1-CZ 3.96Å; D70-R73 IonicContact OD1-NE 3.5Å; D70-R73 PolarHBondContact OD1-NE 3.24Å; D70-R73 IonicContact OD1-NH2 3.47Å; D70-R73 PolarHBondContact OD1-NH2 3.18Å; D70-A74 WeakPolarHBondContact O-CB 3.18Å; D70-A74 PolarHBondContact O-N 2.98Å
71	I	87	Confident	75.7	Confident	55 Å²	55	107.5 Å²	107.5	28%	0.282	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-46	172.4	-55.9	176.8	0	0	0	110	I2 I66 H67 G68 A74 S75	I2-I71 HydrophobicContact CD1-CG2 3.91Å; I2-I71 HydrophobicContact CG1-CG2 3.88Å; I66-I71 HydrophobicContact CG2-CD1 4.27Å; I66-I71 HydrophobicContact CG2-CG1 3.67Å; H67-I71 PolarHBondContact O-N 3.21Å; G68-I71 WeakPolarHBondContact O-CB 3.42Å; G68-I71 PolarHBondContact O-N 2.76Å; G68-I71 VanDerWaalsContact O-N 3.12Å; I71-A74 PolarHBondContact O-N 2.89Å; I71-S75 WeakPolarHBondContact O-CB 3.4Å; I71-S75 PolarHBondContact O-N 3.35Å; I71-S75 PolarHBondContact O-OG 2.87Å
72	I	87.8	Confident	73.5	Confident	49 Å²	49	102.3 Å²	102.3	25%	0.251	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-47.4	177.7	-60.3	168.4	0	0	0	110.2	I2 L4 I15 L19 G68 A74 S75 M76	I2-I72 HydrophobicContact CD1-CG1 4.24Å; L4-I72 HydrophobicContact CD1-CG2 4.06Å; I15-I72 HydrophobicContact CG2-CG2 3.8Å; L19-I72 HydrophobicContact CD1-CB 4.39Å; L19-I72 HydrophobicContact CD1-CG2 3.8Å; G68-I72 WeakPolarHBondContact O-CG1 3.39Å; G68-I72 PolarHBondContact O-N 3.08Å; I72-A74 VanDerWaalsContact C-N 3.28Å; I72-A74 PolarHBondContact O-N 2.86Å; I72-S75 PolarHBondContact O-N 3.18Å; I72-S75 VanDerWaalsContact O-N 3.16Å; I72-M76 HydrophobicContact CG2-CG 4.19Å; I72-M76 HydrophobicContact CG2-SD 3.89Å; I72-M76 WeakPolarHBondContact O-CG 3.09Å; I72-M76 PolarHBondContact O-N 2.83Å
73	R	87.1	Confident	71.4	Confident	73 Å²	73	102.2 Å²	102.2	28%	0.275	51%	0.509	S	S	.	.	H	α-helix	trans	-58.2	-37.3	175.5	-75.5	-173	-72	-142.3	8.5	112.7	L19 A69 D70 R77	L19-R73 HydrophobicContact CD1-CG 3.94Å; L19-R73 HydrophobicContact CD2-CG 4.41Å; A69-R73 VanDerWaalsContact O-CB 3.32Å; A69-R73 WeakPolarHBondContact O-CB 3.24Å; A69-R73 VanDerWaalsContact O-CG 3.22Å; A69-R73 WeakPolarHBondContact O-CG 3.39Å; A69-R73 PolarHBondContact O-N 3.32Å; A69-R73 PolarHBondContact O-NE 3.1Å; D70-R73 IonicContact OD1-CZ 3.96Å; D70-R73 IonicContact OD1-NE 3.5Å; D70-R73 PolarHBondContact OD1-NE 3.24Å; D70-R73 IonicContact OD1-NH2 3.47Å; D70-R73 PolarHBondContact OD1-NH2 3.18Å; R73-R77 WeakPolarHBondContact O-CD 3.38Å; R73-R77 VanDerWaalsContact O-CG 3.23Å; R73-R77 WeakPolarHBondContact O-CG 3.32Å; R73-R77 PolarHBondContact O-N 2.99Å
74	A	85.7	Confident	69.4	Low	43 Å²	43	95.3 Å²	95.3	36%	0.355	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-42	175.3	0	0	0	0	0	112.5	D70 I71 I72	D70-A74 WeakPolarHBondContact O-CB 3.18Å; D70-A74 PolarHBondContact O-N 2.98Å; I71-A74 PolarHBondContact O-N 2.89Å; I72-A74 VanDerWaalsContact C-N 3.28Å; I72-A74 PolarHBondContact O-N 2.86Å
75	S	86.1	Confident	67.7	Low	9 Å²	9	94 Å²	94	6%	0.063	51%	0.511	C	S	.	.	H	α-helix	trans	-62.5	-48.7	175.2	-76.6	0	0	0	0	112.2	M1 I2 L4 I71 I72 R77 R78	M1-S75 WeakPolarHBondContact CG-OG 3.33Å; I2-S75 PolarHBondContact N-OG 2.97Å; I2-S75 VanDerWaalsContact O-CB 3.29Å; I2-S75 WeakPolarHBondContact O-CB 3.44Å; I2-S75 PolarHBondContact O-OG 2.89Å; L4-S75 VanDerWaalsContact CD1-CB 3.42Å; I71-S75 WeakPolarHBondContact O-CB 3.4Å; I71-S75 PolarHBondContact O-N 3.35Å; I71-S75 PolarHBondContact O-OG 2.87Å; I72-S75 PolarHBondContact O-N 3.18Å; I72-S75 VanDerWaalsContact O-N 3.16Å; S75-R77 VanDerWaalsContact C-N 3.35Å; S75-R77 PolarHBondContact O-N 2.85Å; S75-R78 PolarHBondContact O-N 2.79Å; S75-R78 VanDerWaalsContact O-N 3.17Å
76	M	82.5	Confident	66	Low	27 Å²	27	92.8 Å²	92.8	13%	0.133	51%	0.509	C	S	.	.	H	α-helix	trans	-61.9	-39.9	-178.9	-68.2	179.5	79.7	0	0	112.6	L4 Q12 I15 L16 L19 I72 R78 K79	L4-M76 HydrophobicContact CD1-CG 3.65Å; Q12-M76 HydrophobicContact CB-CE 3.98Å; Q12-M76 HydrophobicContact CG-CE 4.32Å; Q12-M76 WeakPolarHBondContact O-CE 3.43Å; I15-M76 HydrophobicContact CB-CE 4.49Å; I15-M76 HydrophobicContact CG2-CE 4.3Å; I15-M76 HydrophobicContact CG2-SD 3.72Å; L16-M76 HydrophobicContact CB-CE 4.14Å; L19-M76 HydrophobicContact CD1-SD 3.93Å; I72-M76 HydrophobicContact CG2-CG 4.19Å; I72-M76 HydrophobicContact CG2-SD 3.89Å; I72-M76 WeakPolarHBondContact O-CG 3.09Å; I72-M76 PolarHBondContact O-N 2.83Å; M76-R78 PolarHBondContact O-N 3.02Å; M76-R78 VanDerWaalsContact O-N 3.14Å; M76-K79 PolarHBondContact O-N 2.84Å
77	R	79.1	Confident	64.3	Low	182 Å²	182	95.6 Å²	95.6	69%	0.687	52%	0.519	S	S	*	.	H	α-helix	trans	-56.4	-29.7	177	-79	169.2	-179.7	150.3	-2.4	113.4	R73 S75	R73-R77 WeakPolarHBondContact O-CD 3.38Å; R73-R77 VanDerWaalsContact O-CG 3.23Å; R73-R77 WeakPolarHBondContact O-CG 3.32Å; R73-R77 PolarHBondContact O-N 2.99Å; S75-R77 VanDerWaalsContact C-N 3.35Å; S75-R77 PolarHBondContact O-N 2.85Å
78	R	66.9	Low	62.3	Low	184 Å²	184	98.5 Å²	98.5	69%	0.694	54%	0.537	S	S	*	.	H	α-helix	trans	-75.7	-18.8	177.4	-71.5	-163.1	175.2	-148	-3.1	114.3	S75 M76 K80	S75-R78 PolarHBondContact O-N 2.79Å; S75-R78 VanDerWaalsContact O-N 3.17Å; M76-R78 PolarHBondContact O-N 3.02Å; M76-R78 VanDerWaalsContact O-N 3.14Å; R78-K80 VanDerWaalsContact C-N 3.32Å
79	K	59.1	Low	60.1	Low	75 Å²	75	104.8 Å²	104.8	33%	0.326	55%	0.552	S	S	.	*	H	α-helix	trans	-77.4	-18.6	-179.2	-158.7	164.2	174.9	-173	0	112.8	L4 S5 L7 M76 L81	L4-K79 PolarHBondContact O-NZ 2.77Å; S5-K79 WeakPolarHBondContact O-CE 3.41Å; S5-K79 PolarHBondContact O-NZ 2.82Å; L7-K79 PolarHBondContact O-NZ 3.22Å; M76-K79 PolarHBondContact O-N 2.84Å; K79-L81 VanDerWaalsContact C-N 3.33Å; K79-L81 PolarHBondContact O-N 3.41Å
80	K	53.9	Low	57.9	Low	187 Å²	187	109.9 Å²	109.9	81%	0.813	58%	0.575	S	S	*	*	S	Bend	trans	-91.5	38.1	179.2	-155.4	172.3	-177.4	170.3	0	114	R78	R78-K80 VanDerWaalsContact C-N 3.32Å
81	L	33.4	Very low	55.6	Low	146 Å²	146	113.6 Å²	113.6	76%	0.764	60%	0.601	S	S	*	*			trans	-132.5	76.2	176.2	-97.9	169.6	0	0	0	113.9	K79	K79-L81 VanDerWaalsContact C-N 3.33Å; K79-L81 PolarHBondContact O-N 3.41Å
82	P	35.5	Very low	53	Low	108 Å²	108	115.4 Å²	115.4	70%	0.701	62%	0.624	S	S	*	*			trans	-96.1	117.8	154.5	32	-22.8	0	0	0	111.1
83	A	30.2	Very low	50.7	Low	108 Å²	108	121.1 Å²	121.1	89%	0.893	65%	0.652	S	S	*	*	S	Bend	trans	37.7	85.7	156.8	0	0	0	0	0	119.5
84	A	33.1	Very low	48.3	Very low	98 Å²	98	128.4 Å²	128.4	81%	0.81	68%	0.679	S	S	*	*			trans	-156.2	70.8	160.2	0	0	0	0	0	111.5
85	A	34.6	Very low	45.9	Very low	102 Å²	102	130.7 Å²	130.7	84%	0.843	70%	0.698	S	S	*	*			trans	-152.8	24.6	-174.8	0	0	0	0	0	116.4
86	E	37.3	Very low	43.6	Very low	178 Å²	178	140 Å²	140	83%	0.832	74%	0.737	S	S	*	*	S	Bend	trans	-140.9	131.4	164.4	-73.3	-162.9	130.2	0	0	109.9
87	Q	38.2	Very low	41.4	Very low	173 Å²	173	148 Å²	148	81%	0.808	77%	0.774	S	S	*	*			trans	63.3	140.4	172.3	-56.3	177.4	16.1	0	0	115.4
88	N	35.9	Very low	39.1	Very low	131 Å²	131	144.5 Å²	144.5	70%	0.701	78%	0.778	S	S	*	*			cis	-131.3	142.4	-10	-85.6	-45.6	0	0	0	107
89	K	37.8	Very low	37.5	Very low	175 Å²	175	147.4 Å²	147.4	76%	0.761	79%	0.789	S	S	*	*				51.4	130.7	90.3	-92.1	-167.3	176.8	-168.3	0	116.3
90	D	39.7	Very low	36.3	Very low	136 Å²	136	148.7 Å²	148.7	73%	0.727	80%	0.803	S	S	*	*			trans	66.4	95.2	154.5	-47.8	-29.5	0	0	0	119.7
91	T	36.6	Very low	35.4	Very low	147 Å²	147	146.5 Å²	146.5	90%	0.902	80%	0.8	S	S	*	*				175.3	140.3	114.1	-70.6	0	0	0	0	110.4
92	A	33.4	Very low	35.4	Very low	93 Å²	93	145.9 Å²	145.9	77%	0.769	80%	0.798	S	S	*	*			trans	-119.9	126.7	-179.7	0	0	0	0	0	112.8
93	M	38.9	Very low	35.4	Very low	168 Å²	168	146.7 Å²	146.7	83%	0.828	80%	0.8	S	S	*	*			trans	-167.2	149.8	152.9	-132.6	-170.7	-72.5	0	0	113.2
94	R	35.7	Very low	35.6	Very low	227 Å²	227	148 Å²	148	86%	0.857	79%	0.792	S	S	*	*			trans	59.6	111.7	170.3	-60.1	-178.5	178.8	-172.9	-1.8	115.4
95	A	35.4	Very low	35.6	Very low	90 Å²	90	152.1 Å²	152.1	74%	0.744	79%	0.792	S	S	*	*			cis	83.7	121.4	34.4	0	0	0	0	0	115.1
96	K	37.9	Very low	35.6	Very low	206 Å²	206	154.4 Å²	154.4	90%	0.896	79%	0.79	S	S	*	*			trans	69.1	142	-175.6	-49.5	178.7	-176.2	-178.5	0	112.3
97	E	37.3	Very low	35.4	Very low	194 Å²	194	150.3 Å²	150.3	91%	0.907	79%	0.786	S	S	*	*			cis	-124.3	160	14.5	-66.9	170.6	160.7	0	0	112.6
98	S	29.7	Very low	35	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	79%	0.787	S	S	*	*			trans	-143.4	125.4	179.5	59.1	0	0	0	0	111
99	W	34.8	Very low	34.9	Very low	245 Å²	245	150.2 Å²	150.2	93%	0.928	80%	0.795	S	S	*	*			trans	-133.4	144.6	164.1	-147.5	54.4	0	0	0	110.6
100	V	33.5	Very low	34.7	Very low	101 Å²	101	147 Å²	147	61%	0.612	79%	0.792	S	S	*	*			trans	-141.7	140.7	-158.7	178.3	0	0	0	0	109.5	N102	V100-N102 HydrophobicContact CG1-CB 4.36Å
101	N	35.1	Very low	34.5	Very low	142 Å²	142	146.2 Å²	146.2	76%	0.759	79%	0.794	S	S	*	*			trans	-161.5	114.1	149.6	-84.7	-43.2	0	0	0	105.5
102	N	32.5	Very low	34.2	Very low	133 Å²	133	147.6 Å²	147.6	71%	0.711	79%	0.79	S	S	*	*			cis	76.9	159.3	41.3	-154.2	18.2	0	0	0	113.4	V100	V100-N102 HydrophobicContact CG1-CB 4.36Å
103	V	36.1	Very low	34.2	Very low	124 Å²	124	150 Å²	150	75%	0.752	79%	0.789	S	S	*	*			trans	77	113.6	-160	-173	0	0	0	0	112.5
104	N	35.2	Very low	33.7	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	79%	0.786	S	S	*	*			cis	-140.2	154.4	-9	-124.9	35.9	0	0	0	110.9
105	K	33.5	Very low	33.5	Very low	184 Å²	184	141.7 Å²	141.7	80%	0.8	78%	0.782	S	S	*	*			trans	-100.3	-168.8	164.9	-105.3	-174.5	178.3	-177.4	0	109.3
106	D	34.5	Very low	33.5	Very low	150 Å²	150	143.5 Å²	143.5	80%	0.802	78%	0.784	S	S	*	*			trans	94.9	120.1	166.7	-49.7	-21.9	0	0	0	114.7
107	A	32.2	Very low	33.5	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	78%	0.784	S	S	*	*			cis	-142	155.4	-9.5	0	0	0	0	0	111.5
108	V	29.7	Very low	33.5	Very low	138 Å²	138	142.3 Å²	142.3	84%	0.836	78%	0.781	S	S	*	*			trans	-112.3	117.9	169.3	175.6	0	0	0	0	107.3
109	L	33	Very low	34.1	Very low	165 Å²	165	141.9 Å²	141.9	86%	0.864	78%	0.776	S	S	*	*			trans	-99.9	124.8	167	-72.1	173.3	0	0	0	109.2
110	P	35.2	Very low	34.5	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	77%	0.771	S	S	*	*			trans	-80.3	168.8	170.5	35.4	-34.6	0	0	0	111.3
111	P	35.2	Very low	34.8	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	78%	0.782	S	S	*	*			trans	-87.5	176.4	179.8	36.5	-37	0	0	0	114.4
112	E	30.3	Very low	35	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	78%	0.781	S	S	*	*			trans	93.7	136.2	156.5	-101.4	-178.6	153.7	0	0	121.7
113	I	33.1	Very low	35.4	Very low	144 Å²	144	140.3 Å²	140.3	74%	0.738	78%	0.781	S	S	*	*			trans	79.6	86.3	154.9	-55.2	156.6	0	0	0	119.8
114	A	28.4	Very low	35.4	Very low	92 Å²	92	141.9 Å²	141.9	76%	0.76	79%	0.785	S	S	*	*				58	159	116.8	0	0	0	0	0	125.4
115	V	31	Very low	35.8	Very low	129 Å²	129	141.2 Å²	141.2	78%	0.782	79%	0.788	S	S	*	*			trans	108.2	96	155.5	-173	0	0	0	0	118.9
116	V	34.6	Very low	36.1	Very low	128 Å²	128	137.6 Å²	137.6	78%	0.776	79%	0.793	S	S	*	*				50	118.2	129.3	-174	0	0	0	0	121.2
117	E	38.4	Very low	36.2	Very low	192 Å²	192	134.1 Å²	134.1	90%	0.897	79%	0.792	S	S	*	*				-157.7	168.9	101.5	-96.7	-167.8	162.1	0	0	111.1
118	E	37.2	Very low	36.8	Very low	182 Å²	182	135.5 Å²	135.5	85%	0.85	79%	0.793	S	S	*	*			trans	-129.3	-167.6	-166.6	-111.8	-172.3	-176	0	0	110.2
119	P	42.4	Very low	37.1	Very low	101 Å²	101	134.5 Å²	134.5	66%	0.656	79%	0.793	S	S	*	*			cis	-100.4	-144.3	-9.9	16.4	8	0	0	0	110.4
120	E	43.5	Very low	37.4	Very low	177 Å²	177	131.1 Å²	131.1	83%	0.827	78%	0.783	S	S	*	*			cis	-151.9	154.7	11.1	-66.4	170.9	153.1	0	0	108
121	D	40.5	Very low	37.4	Very low	156 Å²	156	130.8 Å²	130.8	83%	0.834	78%	0.783	S	S	*	*			cis	-166.8	-160.1	-27.7	-155.3	-26.9	0	0	0	107.4
122	D	39.1	Very low	37.6	Very low	140 Å²	140	131.8 Å²	131.8	75%	0.749	78%	0.781	S	S	*	*			trans	82.2	98.5	160.5	-112.1	-32.8	0	0	0	121
123	T	40.2	Very low	38.1	Very low	114 Å²	114	128.9 Å²	128.9	70%	0.699	78%	0.775	S	S	*	*			trans	83.8	76.4	145.1	-52.6	0	0	0	0	121.2
124	D	36.8	Very low	38.4	Very low	158 Å²	158	129 Å²	129	85%	0.845	78%	0.777	S	S	*	*				54.7	131.6	125.1	-74.6	-31.8	0	0	0	125.9
125	P	43.3	Very low	39.2	Very low	123 Å²	123	130 Å²	130	80%	0.799	78%	0.776	S	S	*	*			trans	-119	169.4	169.8	42.6	-32.9	0	0	0	115.6
126	A	39	Very low	39.5	Very low	108 Å²	108	128.9 Å²	128.9	89%	0.893	78%	0.78	S	S	*	*			trans	-159	146	162.7	0	0	0	0	0	116
127	G	36.5	Very low	39.7	Very low	76 Å²	76	127.6 Å²	127.6	78%	0.784	78%	0.777	S	S	*	*			trans	105.8	93.3	145.3	0	0	0	0	0	121
128	P	45	Very low	39.8	Very low	120 Å²	120	123.1 Å²	123.1	78%	0.779	77%	0.767	S	S	*	*			trans	-120	-175.6	165.7	40.9	-30.9	0	0	0	114.5
129	S	37.2	Very low	40.1	Very low	118 Å²	118	119.8 Å²	119.8	83%	0.825	76%	0.759	S	S	*	*			trans	101.5	171.9	153.5	85.5	0	0	0	0	120.9
130	S	38.2	Very low	40.2	Very low	94 Å²	94	122 Å²	122	66%	0.657	76%	0.763	S	S	*	*			trans	68.5	123.8	-173.5	-153.4	0	0	0	0	117.1
131	S	35.3	Very low	39.9	Very low	101 Å²	101	119.5 Å²	119.5	71%	0.706	76%	0.756	S	S	*	*			cis	100.9	165.7	16.3	91.7	0	0	0	0	116.3
132	L	40.3	Very low	40	Very low	139 Å²	139	119.7 Å²	119.7	73%	0.728	75%	0.754	S	S	*	*			trans	88.3	107.8	-174.9	-65.7	121.4	0	0	0	116.4
133	V	41	Very low	40	Very low	115 Å²	115	117.7 Å²	117.7	70%	0.697	75%	0.751	S	S	*	*				78.7	150.9	79.2	-48.2	0	0	0	0	114.5
134	D	38	Very low	39.9	Very low	145 Å²	145	120.1 Å²	120.1	78%	0.775	75%	0.754	S	S	*	*			cis	-157.1	170.5	-16.3	-114.3	-22.1	0	0	0	111
135	P	46.2	Very low	39.8	Very low	115 Å²	115	119.8 Å²	119.8	75%	0.747	75%	0.747	S	S	*	*			trans	-111.8	159.2	-179	40.3	-32.2	0	0	0	116
136	A	36.8	Very low	39.3	Very low	104 Å²	104	119.2 Å²	119.2	86%	0.86	75%	0.747	S	S	*	*			trans	-155.4	158.6	163.9	0	0	0	0	0	108.8
137	S	39.4	Very low	38.8	Very low	102 Å²	102	120.3 Å²	120.3	71%	0.713	74%	0.742	S	S	*	*			cis	-150.2	150.2	3.5	57.3	0	0	0	0	111.8
138	S	39.8	Very low	38.6	Very low	97 Å²	97	128.6 Å²	128.6	68%	0.678	75%	0.75	S	S	*	*				47.7	156.7	129.9	79	0	0	0	0	122.3
139	V	44	Very low	37.8	Very low	113 Å²	113	129.3 Å²	129.3	69%	0.685	75%	0.752	S	S	*	*			cis	-158.3	150.9	25.7	-103.5	0	0	0	0	111.5
140	I	44.3	Very low	37.5	Very low	146 Å²	146	129.4 Å²	129.4	75%	0.749	75%	0.75	S	S	*	*			trans	65.7	135.6	138.4	-65.8	169.5	0	0	0	118.6
141	D	36.8	Very low	37.2	Very low	125 Å²	125	129.4 Å²	129.4	67%	0.668	76%	0.756	S	S	*	*			cis	-151.1	174.8	2.4	-137.9	-17.8	0	0	0	116.3
142	M	41.9	Very low	37.2	Very low	160 Å²	160	132.1 Å²	132.1	79%	0.788	77%	0.768	S	S	*	*			trans	5.9	146.6	148.3	-79.2	160.5	63.3	0	0	121.3
143	S	40.1	Very low	37	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	77%	0.768	S	S	*	*			cis	-156.1	151.4	8.7	57.2	0	0	0	0	115.4
144	Q	38.7	Very low	36.6	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	78%	0.776	S	S	*	*			trans	-1	160.1	138.7	-72.8	178.3	-75	0	0	120.9
145	E	33.2	Very low	36.6	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	78%	0.78	S	S	*	*			cis	-175.1	140.2	-12.1	175.6	172.4	153.7	0	0	108.1
146	S	34.5	Very low	36.1	Very low	112 Å²	112	136.1 Å²	136.1	78%	0.783	79%	0.785	S	S	*	*				170.3	168.3	99.6	51.4	0	0	0	0	111.2
147	T	27.4	Very low	35.9	Very low	130 Å²	130	140.2 Å²	140.2	80%	0.798	79%	0.786	S	S	*	*			trans	-106.7	148.2	-167.4	52.9	0	0	0	0	114.6
148	R	32.9	Very low	35.7	Very low	251 Å²	251	146.9 Å²	146.9	95%	0.947	80%	0.795	S	S	*	*			trans	-173.1	126.2	141.8	-103	154.5	-169.2	-169.2	3.3	112
149	T	27	Very low	35.8	Very low	135 Å²	135	151.8 Å²	151.8	83%	0.828	81%	0.805	S	S	*	*			trans	-88.3	159.2	161.8	51.9	0	0	0	0	109.4
150	P	32.1	Very low	35.3	Very low	119 Å²	119	151.6 Å²	151.6	77%	0.773	80%	0.8	S	S	*	*				-151.7	178.3	96.1	39.8	-22.1	0	0	0	115.9
151	A	32.5	Very low	35.4	Very low	95 Å²	95	150 Å²	150	79%	0.785	80%	0.799	S	S	*	*			trans	56.5	95.5	154.1	0	0	0	0	0	119.5	S153	A151-S153 PolarHBondContact O-N 2.92Å
152	V	34.7	Very low	35.4	Very low	158 Å²	158	153 Å²	153	96%	0.958	81%	0.806	S	S	*	*			trans	-78.1	116.5	160.7	176.6	0	0	0	0	109.7
153	S	35.6	Very low	35.1	Very low	104 Å²	104	152 Å²	152	73%	0.727	80%	0.804	S	S	*	*			trans	-99.9	155.6	176.3	60.8	0	0	0	0	113.2	A151	A151-S153 PolarHBondContact O-N 2.92Å
154	L	33.5	Very low	35.2	Very low	165 Å²	165	152.4 Å²	152.4	86%	0.864	81%	0.807	S	S	*	*			trans	-44.7	133.1	-175.8	-70	147.9	0	0	0	114.8	K156	L154-K156 PolarHBondContact O-N 2.83Å; L154-K156 VanDerWaalsContact O-N 3.08Å
155	P	36.2	Very low	35.4	Very low	132 Å²	132	150.4 Å²	150.4	86%	0.857	81%	0.808	S	S	*	*			trans	-69	107.6	176.2	28.1	-33.7	0	0	0	111
156	K	37.2	Very low	35.5	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.6	141	-178.2	-151.1	167.2	-172	171.5	0	111.2	L154 R158	L154-K156 PolarHBondContact O-N 2.83Å; L154-K156 VanDerWaalsContact O-N 3.08Å; K156-R158 PolarHBondContact O-N 2.84Å
157	Q	32.7	Very low	35.6	Very low	191 Å²	191	153 Å²	153	89%	0.893	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-49.7	116.6	-176.4	-165.8	178.7	23.6	0	0	112.9
158	R	34.4	Very low	36.1	Very low	241 Å²	241	152.6 Å²	152.6	91%	0.909	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-83.5	139.1	174.1	-66.5	-177.8	76.6	154.9	1.2	110.2	K156	K156-R158 PolarHBondContact O-N 2.84Å
159	K	41.9	Very low	36.2	Very low	201 Å²	201	148 Å²	148	87%	0.874	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.4	154	-178.8	-71.9	-175.4	175.2	-177.1	0	112.5
160	N	33.8	Very low	36.5	Very low	108 Å²	108	149.5 Å²	149.5	58%	0.578	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-61.2	131.1	171.4	-179.5	-12	0	0	0	111	F162	N160-F162 VanDerWaalsContact C-N 3.28Å; N160-F162 PolarHBondContact O-N 2.84Å; N160-F162 WeakPolarHBondContact OD1-CD2 3.22Å; N160-F162 PolarHBondContact OD1-N 3.49Å
161	P	45.7	Very low	36.7	Very low	112 Å²	112	151.7 Å²	151.7	73%	0.727	80%	0.8	S	S	*	*	S	Bend	trans	-62.2	-25.1	177.3	-24.7	35.2	0	0	0	115.6	N163	P161-N163 PolarHBondContact O-N 3.49Å
162	F	38.5	Very low	36.5	Very low	188 Å²	188	152.3 Å²	152.3	83%	0.825	80%	0.798	S	S	*	*	S	Bend	trans	-82.2	41	-173.8	-66.6	-77.4	0	0	0	113.8	N160	N160-F162 VanDerWaalsContact C-N 3.28Å; N160-F162 PolarHBondContact O-N 2.84Å; N160-F162 WeakPolarHBondContact OD1-CD2 3.22Å; N160-F162 PolarHBondContact OD1-N 3.49Å
163	N	35	Very low	36.5	Very low	141 Å²	141	151.8 Å²	151.8	75%	0.754	79%	0.79	S	S	*	*			trans	-146.7	73.3	-176	-147.8	-14.3	0	0	0	113.1	P161	P161-N163 PolarHBondContact O-N 3.49Å
164	S	42.1	Very low	36.5	Very low	105 Å²	105	154.6 Å²	154.6	73%	0.734	79%	0.791	S	S	*	*			trans	-144.2	107.7	174.3	44.6	0	0	0	0	111.3	K166	S164-K166 PolarHBondContact O-N 3.04Å
165	P	42.5	Very low	36.7	Very low	124 Å²	124	154.9 Å²	154.9	81%	0.805	79%	0.788	S	S	*	*			trans	-80.9	115.4	175.2	30.5	-31.7	0	0	0	111.9
166	K	35	Very low	36.6	Very low	189 Å²	189	154.9 Å²	154.9	82%	0.822	79%	0.786	S	S	*	*			trans	24.5	150.4	138.2	-91.7	-167.8	174.7	-167.4	0	122.4	S164	S164-K166 PolarHBondContact O-N 3.04Å
167	L	37.1	Very low	36.5	Very low	129 Å²	129	153.8 Å²	153.8	68%	0.675	78%	0.781	S	S	*	*			trans	77.7	161.6	150.3	-73.8	165.9	0	0	0	116.9	E169	L167-E169 HydrophobicContact CD2-CG 4.49Å
168	P	38.7	Very low	36.6	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	77%	0.772	S	S	*	*			cis	-118.2	173.9	9	30.2	-9.9	0	0	0	117.2
169	E	34.2	Very low	36.7	Very low	155 Å²	155	145.5 Å²	145.5	72%	0.724	76%	0.762	S	S	*	*			trans	-74	166.2	166	-62.7	143.5	130.5	0	0	111	L167	L167-E169 HydrophobicContact CD2-CG 4.49Å
170	D	34.1	Very low	36.7	Very low	165 Å²	165	143.1 Å²	143.1	88%	0.882	75%	0.754	S	S	*	*			trans	-119.1	138.7	171.9	-146.9	-14.5	0	0	0	110.1
171	H	34.7	Very low	37	Very low	166 Å²	166	142.5 Å²	142.5	77%	0.769	76%	0.759	S	S	*	*			trans	-110.6	141.5	-170.9	-75.3	-79.6	0	0	0	112.1
172	S	29.4	Very low	36.7	Very low	107 Å²	107	145.8 Å²	145.8	75%	0.748	76%	0.761	S	S	*	*			trans	-165.9	156.8	141.7	42.2	0	0	0	0	113.8
173	L	33.9	Very low	36.3	Very low	148 Å²	148	143.5 Å²	143.5	78%	0.775	76%	0.763	S	S	*	*			trans	76.4	125.9	176.7	-46.7	179.1	0	0	0	114.6
174	Q	36.4	Very low	36.3	Very low	163 Å²	163	140.3 Å²	140.3	76%	0.762	76%	0.764	S	S	*	*			cis	-150.5	178.8	6.2	-119.2	165.3	33	0	0	113.6
175	Q	37.3	Very low	36.1	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	77%	0.773	S	S	*	*			trans	-57.8	166.3	175.1	-52.4	149.9	-24.6	0	0	111.8
176	T	33.3	Very low	35.8	Very low	133 Å²	133	144.7 Å²	144.7	82%	0.816	78%	0.776	S	S	*	*			cis	-164.7	-179.8	4.5	-5.7	0	0	0	0	107.4
177	K	35.3	Very low	35.7	Very low	172 Å²	172	139.1 Å²	139.1	75%	0.748	77%	0.772	S	S	*	*			cis	-155.8	150.5	-5.7	177.5	-174.5	172.3	-168.5	0	107.1
178	P	36.2	Very low	35.6	Very low	110 Å²	110	140.4 Å²	140.4	71%	0.714	78%	0.779	S	S	*	*			trans	-102.1	165.8	179.8	39.6	-35.7	0	0	0	115.4
179	E	35.9	Very low	35.3	Very low	149 Å²	149	142.9 Å²	142.9	70%	0.696	78%	0.778	S	S	*	*			trans	-169.4	132.7	135.6	-101.3	-168.4	121.2	0	0	110.2
180	Q	41.4	Very low	35.1	Very low	150 Å²	150	143.6 Å²	143.6	70%	0.701	78%	0.782	S	S	*	*				65.1	138.6	97.1	-66.8	-158	89.1	0	0	115.6
181	S	39.3	Very low	35.2	Very low	96 Å²	96	143.7 Å²	143.7	67%	0.671	78%	0.78	S	S	*	*			cis	-155.3	159.1	12	72.6	0	0	0	0	115.2
182	K	39.7	Very low	35.3	Very low	180 Å²	180	140.8 Å²	140.8	78%	0.783	78%	0.778	S	S	*	*			trans	28.6	160.2	138.9	-62.2	167.5	-174.4	166.8	0	122.4
183	T	31.4	Very low	35.6	Very low	140 Å²	140	145.1 Å²	145.1	86%	0.859	78%	0.784	S	S	*	*			cis	168.1	132.4	-29.8	-81.7	0	0	0	0	107.1
184	G	33.7	Very low	35.8	Very low	75 Å²	75	147.3 Å²	147.3	77%	0.773	79%	0.79	S	S	*	*			trans	115.1	152.4	170.2	0	0	0	0	0	113.7
185	K	39.4	Very low	35.8	Very low	215 Å²	215	142.7 Å²	142.7	94%	0.935	79%	0.786	S	S	*	*			cis	-148	156.4	-0.5	-170	178.4	179.2	-175.4	0	108.7
186	A	36.4	Very low	35.8	Very low	105 Å²	105	143.2 Å²	143.2	87%	0.868	79%	0.789	S	S	*	*			trans	-87.6	156.2	-173.7	0	0	0	0	0	114.3
187	G	32.6	Very low	36.1	Very low	72 Å²	72	143.6 Å²	143.6	74%	0.742	79%	0.785	S	S	*	*			trans	156.2	108.4	156.3	0	0	0	0	0	118.8
188	L	34.1	Very low	36.2	Very low	157 Å²	157	139.1 Å²	139.1	82%	0.822	78%	0.775	S	S	*	*			trans	71.5	105.5	133.2	-139.4	75.1	0	0	0	122.3
189	F	32.3	Very low	36.2	Very low	172 Å²	172	142 Å²	142	75%	0.754	78%	0.779	S	S	*	*			trans	47.3	126	142.4	-70.7	-102.4	0	0	0	124.3
190	Q	31.2	Very low	36.4	Very low	171 Å²	171	139.3 Å²	139.3	80%	0.799	78%	0.777	S	S	*	*			trans	26.1	129.6	139.8	-65.8	-179.9	-60.1	0	0	122.3
191	I	34.4	Very low	36.1	Very low	166 Å²	166	140 Å²	140	85%	0.851	78%	0.777	S	S	*	*			trans	-161.3	149.8	142.4	-104.5	151.7	0	0	0	109.6
192	S	37	Very low	36	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	77%	0.774	S	S	*	*			trans	26.6	139.2	166.9	-58.3	0	0	0	0	122.7
193	K	36	Very low	35.8	Very low	199 Å²	199	140.6 Å²	140.6	87%	0.865	77%	0.77	S	S	*	*			cis	87.9	155.6	44.6	-98	-162.9	171.9	-166.5	0	115.7
194	E	38.6	Very low	36.1	Very low	193 Å²	193	138.6 Å²	138.6	90%	0.902	76%	0.761	S	S	*	*			trans	79.6	139.6	-178.1	-62.1	163.6	-159.2	0	0	115
195	G	36.7	Very low	36.1	Very low	66 Å²	66	139.7 Å²	139.7	68%	0.68	76%	0.757	S	S	*	*			cis	-123.1	162.4	-6.1	0	0	0	0	0	112.5
196	E	37.2	Very low	36.3	Very low	181 Å²	181	137 Å²	137	85%	0.846	75%	0.751	S	S	*	*				67	131.8	68.7	-94.5	-172.1	145.9	0	0	113.3
197	L	39.8	Very low	36.3	Very low	142 Å²	142	137.4 Å²	137.4	74%	0.743	75%	0.746	S	S	*	*			cis	-146.7	164.2	12.6	-86.4	172.1	0	0	0	109.4
198	S	36.2	Very low	36.4	Very low	77 Å²	77	141.8 Å²	141.8	54%	0.538	75%	0.752	S	S	.	*			cis	-163	172.5	-22	-150.2	0	0	0	0	111.4
199	E	36.1	Very low	36.6	Very low	172 Å²	172	142.2 Å²	142.2	80%	0.804	75%	0.752	S	S	*	*			trans	21	152.4	138.6	-69.8	172	132.5	0	0	124.4
200	S	40.2	Very low	36.9	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	74%	0.743	S	S	*	*			cis	-170.5	166.5	-13.5	59.3	0	0	0	0	114
201	K	36.7	Very low	37.1	Very low	164 Å²	164	140.2 Å²	140.2	71%	0.713	74%	0.743	S	S	*	*			trans	66.2	123.6	148.6	-85.1	175	173.8	-90.2	0	119.4
202	E	36	Very low	37.2	Very low	126 Å²	126	139.3 Å²	139.3	59%	0.589	74%	0.735	S	S	*	*				66.5	135.4	98.3	-72.9	-167	96.6	0	0	114.4
203	K	36.6	Very low	37.2	Very low	163 Å²	163	141.6 Å²	141.6	71%	0.709	74%	0.735	S	S	*	*			cis	-161	163	10.9	-141.9	-172	-170.7	94.4	0	109.5
204	S	36.3	Very low	37	Very low	97 Å²	97	138.3 Å²	138.3	68%	0.678	73%	0.726	S	S	*	*			trans	36.2	142.7	147.2	57.2	0	0	0	0	122
205	S	35.1	Very low	37	Very low	98 Å²	98	137.6 Å²	137.6	69%	0.685	72%	0.722	S	S	*	*			cis	176.1	173.5	-2	48	0	0	0	0	110.1
206	I	42.3	Very low	36.9	Very low	158 Å²	158	143.8 Å²	143.8	81%	0.81	73%	0.731	S	S	*	*			trans	79.1	131.8	166.7	-55.6	176.8	0	0	0	115.2
207	P	37.3	Very low	36.8	Very low	115 Å²	115	140.5 Å²	140.5	75%	0.747	73%	0.725	S	S	*	*			trans	-103.8	171.7	178.1	41.1	-35.1	0	0	0	113.1
208	D	35.3	Very low	36.6	Very low	164 Å²	164	143.7 Å²	143.7	88%	0.877	73%	0.733	S	S	*	*			trans	-154	169.9	144.1	-137.3	-37	0	0	0	111.7
209	M	36.5	Very low	36.3	Very low	166 Å²	166	148.9 Å²	148.9	82%	0.818	75%	0.748	S	S	*	*			trans	-116.6	-125.1	-175.7	-157.2	-153.5	169.7	0	0	114.9
210	P	40.3	Very low	36.1	Very low	88 Å²	88	147 Å²	147	57%	0.571	75%	0.748	S	S	*	*				-75.4	-179.2	-115.2	-3.5	23.7	0	0	0	115.2
211	R	34.2	Very low	35.8	Very low	212 Å²	212	148.4 Å²	148.4	80%	0.8	75%	0.753	S	S	*	*			cis	-175.2	-178.2	27.6	-134.8	162.5	-169	172.2	2.5	111.5
212	Q	37.2	Very low	35.3	Very low	147 Å²	147	145.7 Å²	145.7	69%	0.687	76%	0.755	S	S	*	*			trans	71.5	113.5	149.1	-77.4	169.5	-6.1	0	0	117.8
213	Q	36.6	Very low	35.2	Very low	154 Å²	154	146.4 Å²	146.4	72%	0.72	77%	0.768	S	S	*	*				94.8	151.6	91.6	-88.9	-159.1	77.3	0	0	112.3
214	L	33.1	Very low	34.9	Very low	130 Å²	130	147 Å²	147	68%	0.681	77%	0.774	S	S	*	*			cis	-156.7	139.2	-14	-165.3	74.4	0	0	0	104.8
215	E	37.3	Very low	34.8	Very low	177 Å²	177	147.3 Å²	147.3	83%	0.827	77%	0.773	S	S	*	*				173.1	177.9	97.1	-92.9	-154.3	147.7	0	0	112.7
216	K	34.8	Very low	34.6	Very low	197 Å²	197	150.2 Å²	150.2	86%	0.857	78%	0.776	S	S	*	*			trans	-113.4	-170.9	-174	-77.6	-179.5	176.1	176.1	0	110.6
217	P	35.2	Very low	34.1	Very low	111 Å²	111	149.4 Å²	149.4	72%	0.721	77%	0.773	S	S	*	*				-132.3	175.4	-55.6	37.6	-23.5	0	0	0	112.7
218	K	35.4	Very low	33.7	Very low	210 Å²	210	148 Å²	148	91%	0.913	77%	0.771	S	S	*	*			trans	-164.9	159.6	136.3	-109.4	154.7	-172.8	174	0	112.7
219	Q	30	Very low	33.5	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	77%	0.767	S	S	*	*			trans	-88.5	152	-172.6	-59.9	151.9	-69.2	0	0	112
220	T	31.1	Very low	33.5	Very low	131 Å²	131	146.8 Å²	146.8	80%	0.804	77%	0.77	S	S	*	*				-169.5	112.7	126.7	-74.7	0	0	0	0	111.4
221	V	34.2	Very low	33.6	Very low	123 Å²	123	148 Å²	148	75%	0.745	78%	0.776	S	S	*	*			trans	34.7	121.7	141.2	-173	0	0	0	0	121.1
222	S	26.8	Very low	34.6	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	78%	0.777	S	S	*	*			trans	63.2	114.8	151.8	-61.9	0	0	0	0	121.3
223	T	33.4	Very low	35.3	Very low	140 Å²	140	141.1 Å²	141.1	86%	0.859	76%	0.755	S	S	*	*				-173.4	131.2	113.2	-74	0	0	0	0	109.7
224	E	30.8	Very low	36	Very low	177 Å²	177	136.3 Å²	136.3	83%	0.827	74%	0.737	S	S	*	*			trans	-84.6	168.1	169.1	-105.5	-160.5	162.9	0	0	110.8
225	P	35.3	Very low	36.9	Very low	102 Å²	102	137.4 Å²	137.4	66%	0.662	74%	0.742	S	S	*	*			cis	-135.3	-177.2	19.7	37	-16.4	0	0	0	115.2
226	E	30.3	Very low	37.5	Very low	159 Å²	159	131 Å²	131	74%	0.743	72%	0.716	S	S	*	*				170.9	143.7	111.9	-90.5	-150.3	162.3	0	0	115.3
227	N	30.4	Very low	38.1	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	72%	0.718	S	S	*	*			trans	56.5	70.6	146.7	-69	-46.6	0	0	0	120.4
228	A	30.6	Very low	38.4	Very low	86 Å²	86	130.1 Å²	130.1	71%	0.711	72%	0.716	S	S	*	*			trans	-103.3	134	146	0	0	0	0	0	110.1	H230	A228-H230 PolarHBondContact O-N 3.09Å
229	S	30.3	Very low	38.9	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	70%	0.704	S	S	*	*			trans	-78	107.4	-169.2	51.1	0	0	0	0	113.6	T231	S229-T231 PolarHBondContact O-N 2.78Å
230	H	36.5	Very low	39.7	Very low	191 Å²	191	127.8 Å²	127.8	88%	0.884	70%	0.698	S	S	*	*			trans	-65	90.3	173.3	-74.2	-87.3	0	0	0	112.2	A228 K232	A228-H230 PolarHBondContact O-N 3.09Å; H230-K232 PolarHBondContact O-N 2.99Å
231	T	42.8	Very low	40.4	Very low	113 Å²	113	126.1 Å²	126.1	69%	0.693	68%	0.684	S	S	*	*			trans	-68.1	91.8	167.1	30.6	0	0	0	0	109.8	S229 A233	S229-T231 PolarHBondContact O-N 2.78Å; T231-A233 PolarHBondContact O-N 3.33Å
232	K	53.9	Low	40.3	Very low	188 Å²	188	127.3 Å²	127.3	82%	0.817	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-55.7	123.4	-178.2	-170.7	172.2	-175	171.9	0	111.2	H230	H230-K232 PolarHBondContact O-N 2.99Å
233	A	53.4	Low	40.8	Very low	27 Å²	27	131.7 Å²	131.7	22%	0.223	69%	0.686	C	S	.	*	P	Polyproline II helix	trans	-56.6	136.4	-176.8	0	0	0	0	0	112	T231 I235 W813 W933	T231-A233 PolarHBondContact O-N 3.33Å; A233-I235 PolarHBondContact O-N 2.64Å; A233-W813 HydrophobicContact CB-CE3 4.01Å; A233-W813 HydrophobicContact CB-CH2 4.29Å; A233-W813 HydrophobicContact CB-CZ3 3.71Å; A233-W933 HydrophobicContact CB-CZ2 4.48Å
234	P	49.7	Very low	40.8	Very low	54 Å²	54	131.7 Å²	131.7	35%	0.351	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-71.7	123.3	-178.7	27.4	-32.2	0	0	0	111	P236 T862	P234-P236 WeakPolarHBondContact O-CD 3.4Å; P234-T862 PolarHBondContact O-OG1 3.05Å
235	I	52.1	Low	41.3	Very low	153 Å²	153	128.5 Å²	128.5	79%	0.785	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-69.7	120.9	-175.9	-57.4	174.1	0	0	0	110	A233	A233-I235 PolarHBondContact O-N 2.64Å
236	P	50.5	Low	41.2	Very low	42 Å²	42	130.6 Å²	130.6	27%	0.273	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-73.7	155.8	-179.3	28.9	-33.4	0	0	0	112.7	P234 A238 T862 V864	P234-P236 WeakPolarHBondContact O-CD 3.4Å; P236-A238 PolarHBondContact O-N 2.75Å; P236-T862 HydrophobicContact CB-CG2 4.17Å; P236-T862 HydrophobicContact CG-CG2 4.16Å; P236-V864 HydrophobicContact CB-CG2 3.53Å; P236-V864 HydrophobicContact CG-CG2 3.49Å; P236-V864 VanDerWaalsContact CG-CG2 3.49Å
237	K	47.2	Very low	41.7	Very low	207 Å²	207	131.1 Å²	131.1	90%	0.9	69%	0.685	S	S	*	*			trans	-86.2	104.9	170	-74.3	-178.7	179.2	179.5	0	109.5
238	A	41.8	Very low	42	Very low	82 Å²	82	131.9 Å²	131.9	68%	0.678	69%	0.688	S	S	*	*			trans	-56.6	141.6	179.8	0	0	0	0	0	113	P236	P236-A238 PolarHBondContact O-N 2.75Å
239	R	45	Very low	42.4	Very low	176 Å²	176	133.9 Å²	133.9	66%	0.664	68%	0.683	S	S	*	*			trans	-144.3	80.1	-175.4	-171.9	179.6	-179.9	154.6	2.8	111.2	D593	R239-D593 IonicContact CZ-OD1 3.75Å; R239-D593 IonicContact CZ-OD2 2.75Å; R239-D593 IonicContact NH1-OD1 3.88Å; R239-D593 IonicContact NH1-OD2 3.22Å; R239-D593 PolarHBondContact NH1-OD2 2.92Å; R239-D593 IonicContact NH2-OD1 2.81Å; R239-D593 PolarHBondContact NH2-OD1 3.5Å; R239-D593 IonicContact NH2-OD2 3.55Å; R239-D593 PolarHBondContact NH2-OD2 3.36Å; R239-D593 VanDerWaalsContact NH2-OD2 3.17Å
240	K	46.8	Very low	42.7	Very low	171 Å²	171	135.8 Å²	135.8	74%	0.743	68%	0.677	S	S	*	*			trans	-59.8	131.6	-174	-59.3	-162.4	172.8	-150.2	0	113.8	D866	K240-D866 WeakPolarHBondContact CA-OD2 3.39Å
241	L	46.4	Very low	42.8	Very low	96 Å²	96	133.3 Å²	133.3	50%	0.503	67%	0.67	S	S	.	*			trans	-83.8	106.2	167.8	-77.4	174.9	0	0	0	111.2	Y243 D866	L241-Y243 PolarHBondContact O-N 3.03Å; L241-D866 WeakPolarHBondContact CD1-OD1 3.41Å; L241-D866 PolarHBondContact N-OD2 2.91Å
242	I	33.3	Very low	42.6	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	67%	0.668	S	S	*	*			trans	-84.2	100.8	174.6	-55.5	176.5	0	0	0	109.9	K244	I242-K244 HydrophobicContact CG2-CG 4.45Å
243	Y	36.2	Very low	41.9	Very low	199 Å²	199	129.6 Å²	129.6	78%	0.78	66%	0.655	S	S	*	*			trans	-77.2	124.4	161	-80	-88.9	0	0	0	109.9	L241	L241-Y243 PolarHBondContact O-N 3.03Å
244	K	34.5	Very low	41.4	Very low	140 Å²	140	136.7 Å²	136.7	61%	0.609	68%	0.683	S	S	*	*			trans	-97.5	104.1	168.7	-69	-177	-176.6	176.5	0	109.1	I242 E597	I242-K244 HydrophobicContact CG2-CG 4.45Å; K244-E597 IonicContact NZ-OE1 3.25Å; K244-E597 PolarHBondContact NZ-OE1 3.29Å; K244-E597 IonicContact NZ-OE2 3.83Å
245	S	39.7	Very low	40.8	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	70%	0.704	S	S	*	*			trans	-78.5	139.9	157.7	39.7	0	0	0	0	109.4
246	N	33.7	Very low	40.1	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	71%	0.709	S	S	*	*			trans	-123.7	111.5	173.4	-76.8	-14.5	0	0	0	107.7
247	D	40.3	Very low	39.7	Very low	171 Å²	171	144.4 Å²	144.4	91%	0.914	73%	0.726	S	S	*	*			trans	-137.2	162.8	163.5	-86.9	-58.7	0	0	0	109.3
248	L	37.3	Very low	39.2	Very low	156 Å²	156	145 Å²	145	82%	0.817	72%	0.722	S	S	*	*			trans	-122.3	-176.5	-160.7	-154.5	67.2	0	0	0	112.1
249	E	38.3	Very low	39.1	Very low	129 Å²	129	148.1 Å²	148.1	60%	0.603	72%	0.723	S	S	*	*			trans	79.9	117.7	-174	-54.8	-63.5	98	0	0	113.1
250	K	37.6	Very low	38.6	Very low	153 Å²	153	149.9 Å²	149.9	67%	0.665	73%	0.729	S	S	*	*				68.3	138.7	83.2	-66.5	-157.8	-161.1	75.3	0	113.3
251	D	38.1	Very low	38.2	Very low	138 Å²	138	151.4 Å²	151.4	74%	0.738	73%	0.73	S	S	*	*			cis	-150.5	158.5	9.8	-134.6	-17.9	0	0	0	116.1
252	D	39.1	Very low	37.6	Very low	124 Å²	124	153.4 Å²	153.4	66%	0.663	74%	0.742	S	S	*	*			trans	56.1	150.4	144.3	-133.7	4.3	0	0	0	127.7
253	N	39.1	Very low	37.9	Very low	100 Å²	100	151.8 Å²	151.8	54%	0.535	74%	0.743	S	S	.	*			trans	81.8	102.6	153.9	-71.9	-60.1	0	0	0	125.5
254	Q	43.3	Very low	38.3	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	74%	0.743	S	S	*	*			trans	67.1	142.6	130.7	-58.8	179.4	46.2	0	0	120
255	S	36.4	Very low	38.5	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	75%	0.752	S	S	*	*			cis	-146.5	-170.7	12.8	59.7	0	0	0	0	113.8
256	F	36.9	Very low	38.4	Very low	204 Å²	204	148.7 Å²	148.7	90%	0.895	75%	0.75	S	S	*	*			trans	-130.6	-165	-160.2	-81.8	-74.4	0	0	0	112.1
257	P	43.3	Very low	38.5	Very low	96 Å²	96	153.9 Å²	153.9	62%	0.623	76%	0.759	S	S	*	*				-139.1	-162.5	-62	41.4	-24	0	0	0	115
258	R	37	Very low	38.2	Very low	219 Å²	219	149.6 Å²	149.6	83%	0.826	76%	0.755	S	S	*	*			trans	87.5	153.6	157.6	-71	161	-178.2	-167.4	1.3	117.2
259	Q	39	Very low	38.2	Very low	147 Å²	147	146.8 Å²	146.8	69%	0.687	75%	0.754	S	S	*	*			cis	-147.5	167.9	11.6	-140.7	170.9	91	0	0	116.1
260	R	34.3	Very low	38.4	Very low	213 Å²	213	145.9 Å²	145.9	80%	0.804	76%	0.759	S	S	*	*			trans	-49.4	172.2	175.9	-55.5	173.1	177.4	160.2	-4.3	115.4
261	R	38.4	Very low	38.4	Very low	203 Å²	203	150.4 Å²	150.4	77%	0.766	77%	0.772	S	S	*	*			cis	-166.6	173.2	38.8	-151.9	172.9	-55.6	175.4	6.7	115.5
262	D	34.5	Very low	38.1	Very low	138 Å²	138	146.9 Å²	146.9	74%	0.738	77%	0.768	S	S	*	*			trans	-86.3	160.1	-165	-32.5	-100.7	0	0	0	117.1
263	S	39.3	Very low	37.8	Very low	114 Å²	114	149.1 Å²	149.1	80%	0.797	78%	0.778	S	S	*	*			trans	157.2	169.5	137.4	51.4	0	0	0	0	111.7
264	L	44.7	Very low	37.6	Very low	146 Å²	146	151 Å²	151	76%	0.764	79%	0.788	S	S	*	*				-162.3	156.8	-60.7	-114.5	172.7	0	0	0	107.8
265	N	37.7	Very low	37.3	Very low	150 Å²	150	151 Å²	151	80%	0.802	79%	0.785	S	S	*	*			trans	67.9	164.1	169.8	-52.9	-38.1	0	0	0	118.2
266	A	37.5	Very low	37.4	Very low	88 Å²	88	156.3 Å²	156.3	73%	0.727	79%	0.788	S	S	*	*				-178.5	163.3	-52.4	0	0	0	0	0	110.4
267	R	37	Very low	36.9	Very low	256 Å²	256	153.9 Å²	153.9	97%	0.966	78%	0.784	S	S	*	*			trans	72.8	113.8	155.9	-170.5	-174.5	-112.2	-113.4	2.5	117.9
268	G	34.3	Very low	36.4	Very low	81 Å²	81	154.7 Å²	154.7	84%	0.835	79%	0.793	S	S	*	*			trans	165.6	99.1	165.2	0	0	0	0	0	115.5
269	A	35.6	Very low	36.3	Very low	96 Å²	96	149.7 Å²	149.7	79%	0.793	79%	0.791	S	S	*	*			trans	-163.9	175.7	171.3	0	0	0	0	0	108.2
270	P	43.4	Very low	35.9	Very low	110 Å²	110	148.3 Å²	148.3	71%	0.714	80%	0.798	S	S	*	*			cis	-131.6	-152.5	-5	36.9	-15.3	0	0	0	112.1
271	R	37.6	Very low	35.9	Very low	248 Å²	248	143.6 Å²	143.6	94%	0.936	80%	0.797	S	S	*	*			trans	76.1	138.8	174.4	-43.9	165.8	93.7	150.8	4	113
272	G	30.9	Very low	36	Very low	64 Å²	64	139.1 Å²	139.1	66%	0.66	80%	0.797	S	S	*	*			cis	171.3	177.4	-5.1	0	0	0	0	0	110.3
273	I	33.5	Very low	36.2	Very low	171 Å²	171	139.2 Å²	139.2	88%	0.877	80%	0.803	S	S	*	*			trans	74.7	125.5	178.5	-45.7	159.7	0	0	0	114.7
274	L	35.5	Very low	36.2	Very low	140 Å²	140	140.3 Å²	140.3	73%	0.733	80%	0.8	S	S	*	*				158.7	140.6	117.4	-162.1	66.2	0	0	0	114.3
275	K	35.4	Very low	35.9	Very low	175 Å²	175	139.1 Å²	139.1	76%	0.761	80%	0.803	S	S	*	*			trans	-39.8	145.1	175.3	-51.7	163.6	178.8	178.7	0	118
276	R	39.5	Very low	35.8	Very low	224 Å²	224	139.6 Å²	139.6	85%	0.845	80%	0.801	S	S	*	*			trans	168.6	143.3	131	-89.8	149.6	172	149.5	-5.5	108.6
277	N	26.5	Very low	35.8	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	80%	0.801	S	S	*	*			cis	70	151.3	45.3	-74.8	58.8	0	0	0	114.5
278	S	32	Very low	35.8	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	80%	0.797	S	S	*	*			trans	80.2	137.7	-178.1	-61.6	0	0	0	0	116
279	S	34.6	Very low	35.7	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	80%	0.798	S	S	*	*			cis	-157.8	160	-10	-89.4	0	0	0	0	111.3
280	S	30.7	Very low	35.7	Very low	119 Å²	119	146.8 Å²	146.8	83%	0.832	80%	0.799	S	S	*	*			trans	-107.1	151.2	166.4	-59.6	0	0	0	0	111.2
281	S	35.6	Very low	35.1	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	80%	0.797	S	S	*	*			trans	-161.7	117.4	154.4	55	0	0	0	0	107.6
282	S	39.1	Very low	35.2	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	79%	0.793	S	S	*	*			cis	75.7	117.8	31.2	87.4	0	0	0	0	115.2
283	T	40.5	Very low	35.2	Very low	140 Å²	140	150 Å²	150	86%	0.859	80%	0.8	S	S	*	*			trans	-127.3	147.5	154.3	49.8	0	0	0	0	107.2
284	D	38.3	Very low	35.4	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	80%	0.8	S	S	*	*			trans	-58.4	164.1	-172.4	-80.4	-70.3	0	0	0	115.8
285	S	39.6	Very low	35.2	Very low	120 Å²	120	149.5 Å²	149.5	84%	0.839	80%	0.798	S	S	*	*			cis	-138.7	161.1	36.9	-51.4	0	0	0	0	119
286	E	35.2	Very low	35.3	Very low	161 Å²	161	146.2 Å²	146.2	75%	0.752	80%	0.795	S	S	*	*			trans	-57.7	159.1	171.4	-50.7	-170.5	106.2	0	0	113
287	T	36.5	Very low	35.1	Very low	119 Å²	119	144.4 Å²	144.4	73%	0.73	79%	0.793	S	S	*	*				-163	155.5	66	7.8	0	0	0	0	115.9
288	L	37.8	Very low	35.7	Very low	166 Å²	166	142.9 Å²	142.9	87%	0.869	80%	0.795	S	S	*	*			trans	56.5	109	158.7	-58.5	-177.9	0	0	0	119.8
289	R	31.7	Very low	35.9	Very low	227 Å²	227	146.8 Å²	146.8	86%	0.857	80%	0.797	S	S	*	*			trans	-118.4	143	147.7	-93.4	-170	169.1	106.4	-2.1	109.5
290	L	35.5	Very low	36.1	Very low	159 Å²	159	148.6 Å²	148.6	83%	0.832	80%	0.797	S	S	*	*			trans	-126.9	119.6	157.5	-102.2	165.3	0	0	0	108.1	Y292	L290-Y292 HydrophobicContact CD2-CE2 4.42Å
291	N	31.4	Very low	36.2	Very low	123 Å²	123	151 Å²	151	66%	0.658	80%	0.799	S	S	*	*			trans	-116.3	131.8	173.7	-90.7	2.6	0	0	0	108.2
292	Y	39.7	Very low	36.2	Very low	216 Å²	216	150.8 Å²	150.8	85%	0.847	80%	0.798	S	S	*	*			trans	-137.7	125.5	155.8	-90.4	-80	0	0	0	109.4	L290	L290-Y292 HydrophobicContact CD2-CE2 4.42Å
293	N	30.2	Very low	36.4	Very low	151 Å²	151	151.7 Å²	151.7	81%	0.807	80%	0.801	S	S	*	*			trans	-94.2	132	167.9	-68.9	-60.7	0	0	0	108.4
294	L	38.5	Very low	36.3	Very low	168 Å²	168	147.3 Å²	147.3	88%	0.88	78%	0.783	S	S	*	*			trans	-164.7	133.4	158	-108.1	145.2	0	0	0	110.3
295	D	31.1	Very low	36.4	Very low	132 Å²	132	148.8 Å²	148.8	71%	0.706	79%	0.791	S	S	*	*			trans	-122.8	132.6	172.2	166.1	34.2	0	0	0	106.6	K297	D295-K297 PolarHBondContact OD1-N 2.74Å
296	P	38.5	Very low	36.4	Very low	107 Å²	107	148.4 Å²	148.4	70%	0.695	78%	0.783	S	S	*	*				-150.6	134.1	118.5	35	-16.8	0	0	0	116.7
297	K	33.8	Very low	36.7	Very low	185 Å²	185	147.7 Å²	147.7	80%	0.804	78%	0.783	S	S	*	*			trans	16.6	125.1	134.6	-58.5	170.1	-177.6	169.9	0	119.2	D295	D295-K297 PolarHBondContact OD1-N 2.74Å
298	S	38.9	Very low	36.9	Very low	120 Å²	120	149.2 Å²	149.2	84%	0.839	78%	0.782	S	S	*	*				178.3	151.6	107.4	51.9	0	0	0	0	116.9
299	K	37.6	Very low	37.1	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	77%	0.769	S	S	*	*			trans	-20.9	151.6	165.2	-47.7	171	-176.3	179.8	0	117.5
300	I	37.6	Very low	37.5	Very low	152 Å²	152	147.4 Å²	147.4	78%	0.779	77%	0.769	S	S	*	*				-174.9	118.3	71.9	-80.5	-179.2	0	0	0	107.9
301	L	34.5	Very low	37.7	Very low	169 Å²	169	146.4 Å²	146.4	89%	0.885	76%	0.763	S	S	*	*				93.6	142.4	99.2	-156.5	76.9	0	0	0	117.2
302	S	33.9	Very low	38.2	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	77%	0.772	S	S	*	*			trans	-112	-151.2	-174.2	-44.8	0	0	0	0	111.7
303	P	44.4	Very low	38.1	Very low	129 Å²	129	145.1 Å²	145.1	84%	0.838	77%	0.774	S	S	*	*			cis	-145.1	-175	-9.5	44.1	-25.3	0	0	0	117.9
304	G	38.5	Very low	38.9	Very low	47 Å²	47	147.2 Å²	147.2	49%	0.485	78%	0.776	S	S	.	*				132.7	134.7	119.5	0	0	0	0	0	125.7
305	L	40.1	Very low	38.8	Very low	169 Å²	169	147 Å²	147	89%	0.885	77%	0.77	S	S	*	*			trans	83.2	157.2	151.2	-67.5	91.2	0	0	0	123
306	T	39	Very low	39.1	Very low	112 Å²	112	150.8 Å²	150.8	69%	0.687	78%	0.781	S	S	*	*			cis	-178	157.6	-37.2	-62.1	0	0	0	0	110.4
307	I	42.2	Very low	38.8	Very low	145 Å²	145	150 Å²	150	74%	0.744	78%	0.778	S	S	*	*			trans	138.9	119.4	138	-71.1	177.6	0	0	0	119.6
308	H	40	Very low	39	Very low	152 Å²	152	148.8 Å²	148.8	70%	0.704	78%	0.78	S	S	*	*			trans	45.6	165.6	143.4	-73.4	-112.6	0	0	0	124.9
309	E	41.6	Very low	39.1	Very low	130 Å²	130	150 Å²	150	61%	0.607	77%	0.772	S	S	*	*			cis	177.5	164.9	-28.2	179.7	178.3	-129.8	0	0	111.8	I311	E309-I311 HydrophobicContact CG-CD1 4.09Å
310	R	41.7	Very low	39.1	Very low	224 Å²	224	147.4 Å²	147.4	85%	0.845	77%	0.768	S	S	*	*			trans	114.9	125.5	159.3	-63.4	176.9	-171.7	169.4	4.1	113.8
311	I	38.2	Very low	39.1	Very low	139 Å²	139	146.2 Å²	146.2	71%	0.713	76%	0.762	S	S	*	*			cis	86.9	108	28.7	-54	164.1	0	0	0	114.8	E309	E309-I311 HydrophobicContact CG-CD1 4.09Å
312	S	42	Very low	39.3	Very low	120 Å²	120	140.3 Å²	140.3	84%	0.839	74%	0.736	S	S	*	*			trans	-166.3	147.8	137.7	51.2	0	0	0	0	111.4
313	E	38.7	Very low	39.5	Very low	192 Å²	192	138.2 Å²	138.2	90%	0.897	72%	0.721	S	S	*	*			trans	-124.3	147.6	-179.9	-58.5	169.3	137.8	0	0	109.3
314	K	45.7	Very low	39.1	Very low	195 Å²	195	137.1 Å²	137.1	85%	0.848	71%	0.712	S	S	*	*			trans	-159.3	144	150.8	-160.8	135.2	-169.9	170.9	0	113.1
315	E	37.6	Very low	38.9	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	72%	0.723	S	S	*	*			trans	-80.5	157.2	177.7	-49.1	129.7	120.7	0	0	112.6
316	F	37.4	Very low	38.7	Very low	211 Å²	211	137.2 Å²	137.2	93%	0.925	72%	0.719	S	S	*	*			trans	-152.3	137.2	132.2	-113.3	-76.3	0	0	0	108.7
317	S	31.6	Very low	38.6	Very low	92 Å²	92	139.2 Å²	139.2	64%	0.643	73%	0.725	S	S	*	*			trans	-119.9	146.7	175.9	67	0	0	0	0	111.4
318	L	38.5	Very low	38.4	Very low	159 Å²	159	141.1 Å²	141.1	83%	0.832	73%	0.731	S	S	*	*			trans	-160.2	128.6	136.3	-138.2	72.3	0	0	0	109.3
319	E	39.6	Very low	38.3	Very low	145 Å²	145	138.4 Å²	138.4	68%	0.678	73%	0.726	S	S	*	*			trans	2.5	153.3	135.3	-26.2	-55.7	85.1	0	0	117.7
320	D	38.1	Very low	38	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	73%	0.732	S	S	*	*			cis	-156.6	167.7	24.7	-144.8	-11.6	0	0	0	115.5
321	D	38.7	Very low	37.8	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	73%	0.727	S	S	*	*			trans	-9.2	162.3	167.4	-112.9	-1.7	0	0	0	122.3
322	S	37.2	Very low	37.9	Very low	46 Å²	46	138.9 Å²	138.9	32%	0.322	74%	0.736	S	S	.	*			cis	-162.1	161.4	16.9	35.5	0	0	0	0	115.5	P516	S322-P516 VanDerWaalsContact OG-CB 3.24Å; S322-P516 WeakPolarHBondContact OG-CB 3.36Å
323	S	38.1	Very low	37.5	Very low	64 Å²	64	139.1 Å²	139.1	45%	0.448	73%	0.732	S	S	.	*			trans	72	152.7	138.6	63.5	0	0	0	0	122	I515	S323-I515 VanDerWaalsContact OG-CB 3.29Å; S323-I515 WeakPolarHBondContact OG-CB 3.45Å; S323-I515 WeakPolarHBondContact OG-CD1 3.41Å; S323-I515 WeakPolarHBondContact OG-CG1 3.29Å
324	T	37.6	Very low	37.5	Very low	106 Å²	106	140.5 Å²	140.5	65%	0.65	73%	0.729	S	S	*	*			cis	-143.6	171.9	-9.3	0.6	0	0	0	0	113.4	I515	T324-I515 WeakPolarHBondContact OG1-CD1 3.43Å; T324-I515 WeakPolarHBondContact OG1-CG1 3.34Å
325	S	34	Very low	37	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	73%	0.731	S	S	*	*			trans	-100.8	148.7	-169.9	57.7	0	0	0	0	116.7
326	S	35.8	Very low	37.1	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	73%	0.727	S	S	*	*			trans	-179	97.9	140.5	-171.7	0	0	0	0	109.6
327	L	37	Very low	37.2	Very low	153 Å²	153	132.7 Å²	132.7	80%	0.801	73%	0.725	S	S	*	*				47.3	99.8	73.8	-67.9	-175.9	0	0	0	116.4
328	E	37.1	Very low	37.5	Very low	186 Å²	186	134.1 Å²	134.1	87%	0.869	73%	0.73	S	S	*	*				-171.1	160.8	120	-93.2	-116.3	102.3	0	0	110.9
329	P	37.8	Very low	37.5	Very low	94 Å²	94	135.8 Å²	135.8	61%	0.61	73%	0.73	S	S	*	*			trans	-118.3	-158.8	-160.2	30.9	-10.7	0	0	0	114
330	L	35.4	Very low	37.4	Very low	139 Å²	139	134.2 Å²	134.2	73%	0.728	73%	0.726	S	S	*	*			trans	78.6	135.5	166	-50.5	170.5	0	0	0	115.7
331	K	37.2	Very low	37.4	Very low	171 Å²	171	135.8 Å²	135.8	74%	0.743	73%	0.729	S	S	*	*			cis	-141.1	135.5	-3.2	-95.5	134.2	-176.9	172.4	0	109.6
332	H	40.2	Very low	37.4	Very low	193 Å²	193	137.6 Å²	137.6	89%	0.894	74%	0.738	S	S	*	*			trans	-73.5	125.7	158.6	-87.6	79.6	0	0	0	109.3
333	V	35.2	Very low	37.4	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	75%	0.753	S	S	*	*			trans	-99.6	87	166	-178.1	0	0	0	0	108.3
334	R	38.1	Very low	37.4	Very low	222 Å²	222	146.1 Å²	146.1	84%	0.838	77%	0.774	S	S	*	*			trans	-94.5	115.1	174	-172.8	176.3	-171.1	154.7	1.4	108.2	S336	R334-S336 PolarHBondContact O-N 2.85Å; R334-S336 VanDerWaalsContact O-N 3.16Å
335	F	34.4	Very low	37.2	Very low	200 Å²	200	146.2 Å²	146.2	88%	0.877	78%	0.779	S	S	*	*			trans	-66.3	113.2	170.8	-70.9	-82.4	0	0	0	109.2
336	S	39.1	Very low	37.3	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	78%	0.781	S	S	*	*			trans	-105.2	134.3	172.1	46.7	0	0	0	0	110.2	R334	R334-S336 PolarHBondContact O-N 2.85Å; R334-S336 VanDerWaalsContact O-N 3.16Å
337	A	41.1	Very low	37.2	Very low	106 Å²	106	152.3 Å²	152.3	88%	0.876	78%	0.783	S	S	*	*			trans	-81.1	142.4	167.1	0	0	0	0	0	109.5
338	V	37.4	Very low	37.2	Very low	122 Å²	122	150.2 Å²	150.2	74%	0.739	78%	0.779	S	S	*	*			trans	-109.8	117.3	-175.9	176	0	0	0	0	110.4
339	K	38.9	Very low	37.1	Very low	194 Å²	194	148 Å²	148	84%	0.843	78%	0.777	S	S	*	*			trans	167.3	152.6	152	-99.3	-174.2	174.1	-171.5	0	109.3
340	N	37.9	Very low	36.8	Very low	111 Å²	111	151.1 Å²	151.1	59%	0.594	79%	0.788	S	S	*	*			cis	-162.7	145.7	-38.2	-124.3	48	0	0	0	106.8
341	E	37.5	Very low	36.7	Very low	175 Å²	175	148.1 Å²	148.1	82%	0.818	79%	0.791	S	S	*	*			trans	70.8	168.6	156.9	-72	163.9	-128.4	0	0	119.9
342	L	37.5	Very low	36.7	Very low	165 Å²	165	148 Å²	148	86%	0.864	79%	0.793	S	S	*	*			trans	-124.5	-172.2	-153.4	-131.4	65.3	0	0	0	106.8
343	P	39.1	Very low	36.4	Very low	98 Å²	98	147.2 Å²	147.2	64%	0.636	79%	0.79	S	S	*	*			cis	-142.2	-172.5	-0.3	28.9	-2.4	0	0	0	117.1
344	Q	36.5	Very low	36.5	Very low	191 Å²	191	147.2 Å²	147.2	89%	0.893	79%	0.79	S	S	*	*			trans	91.6	149.4	155.1	-49.8	-161.2	-16.5	0	0	119.2
345	S	33.1	Very low	36.2	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	78%	0.779	S	S	*	*			trans	-118.8	176.8	-167.5	59.2	0	0	0	0	109.4
346	P	36.1	Very low	36.1	Very low	115 Å²	115	138 Å²	138	75%	0.747	78%	0.775	S	S	*	*			cis	-141.9	174.2	17.5	40.2	-19.2	0	0	0	118.9
347	R	35	Very low	35.9	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	79%	0.786	S	S	*	*			trans	-24.4	169.2	142.8	-84.7	180	179.4	176.3	-1.1	116.7
348	P	36.6	Very low	35.7	Very low	109 Å²	109	144.2 Å²	144.2	71%	0.708	78%	0.78	S	S	*	*			cis	-140.2	-164.1	0.3	22.9	4.5	0	0	0	115.4
349	V	34.1	Very low	35.9	Very low	139 Å²	139	143.5 Å²	143.5	84%	0.842	78%	0.776	S	S	*	*			trans	103.1	139.9	148.9	-167.9	0	0	0	0	117.4
350	L	32	Very low	35.9	Very low	160 Å²	160	141 Å²	141	84%	0.838	77%	0.771	S	S	*	*			trans	-107.6	145.4	-175.5	177.5	73.1	0	0	0	109.3
351	G	32.8	Very low	36.2	Very low	76 Å²	76	143.1 Å²	143.1	78%	0.784	78%	0.777	S	S	*	*			trans	-154.2	133	172	0	0	0	0	0	110.5
352	Q	38.5	Very low	36.4	Very low	168 Å²	168	139 Å²	139	79%	0.785	77%	0.768	S	S	*	*			trans	-137.7	136.6	-174.9	170.9	-177.6	-24.7	0	0	108.4	V354	Q352-V354 HydrophobicContact CG-CG2 4.45Å
353	E	33.6	Very low	36.7	Very low	177 Å²	177	136.5 Å²	136.5	83%	0.827	76%	0.756	S	S	*	*			trans	-143.4	151.9	171.5	-149.6	158.7	-121.7	0	0	108.8
354	V	37.2	Very low	36.8	Very low	125 Å²	125	138.5 Å²	138.5	76%	0.758	76%	0.757	S	S	*	*			trans	-137.8	145.4	-166	177.4	0	0	0	0	109.1	Q352	Q352-V354 HydrophobicContact CG-CG2 4.45Å
355	G	31.2	Very low	36.9	Very low	59 Å²	59	135.5 Å²	135.5	61%	0.608	75%	0.746	S	S	*	*			trans	158.5	92	-179.8	0	0	0	0	0	108.3
356	E	33.1	Very low	37.4	Very low	171 Å²	171	137.7 Å²	137.7	80%	0.799	74%	0.744	S	S	*	*				66.5	116	91.6	-72.7	-166.8	140.2	0	0	113.6
357	F	34.8	Very low	37.5	Very low	212 Å²	212	138.8 Å²	138.8	93%	0.93	74%	0.744	S	S	*	*				-153.6	138.3	129.9	-107	-71.6	0	0	0	109.2
358	T	36.4	Very low	37.7	Very low	122 Å²	122	131 Å²	131	75%	0.748	74%	0.736	S	S	*	*			trans	-108.8	-143.8	-165.5	-31.4	0	0	0	0	110.6
359	V	41.4	Very low	38	Very low	107 Å²	107	131.1 Å²	131.1	65%	0.648	73%	0.734	S	S	*	*			trans	65.7	142.1	170.7	-106.2	0	0	0	0	114.7	E361	V359-E361 HydrophobicContact CG1-CG 4.35Å
360	L	39.6	Very low	38.3	Very low	142 Å²	142	133.2 Å²	133.2	74%	0.743	74%	0.735	S	S	*	*			cis	-129.8	136.3	22.9	-72.6	160.5	0	0	0	109.9
361	E	43.3	Very low	38.7	Very low	155 Å²	155	133.2 Å²	133.2	72%	0.724	74%	0.736	S	S	*	*				68.6	143.1	77.5	-77.6	-172.5	161.4	0	0	113.8	V359	V359-E361 HydrophobicContact CG1-CG 4.35Å
362	S	42.7	Very low	39.1	Very low	88 Å²	88	134.1 Å²	134.1	62%	0.615	74%	0.736	S	S	*	*			cis	-159.7	-173	2.7	-127.9	0	0	0	0	109.9
363	D	42.9	Very low	39	Very low	114 Å²	114	129.6 Å²	129.6	61%	0.61	74%	0.735	S	S	*	*			cis	-164.1	159	17.2	-138.7	15.1	0	0	0	113.5
364	Q	41.1	Very low	39.3	Very low	140 Å²	140	128.7 Å²	128.7	65%	0.654	74%	0.735	S	S	*	*			trans	56.4	144.7	153.7	-52.2	-46.6	-22.1	0	0	120.9
365	L	40.5	Very low	39.5	Very low	127 Å²	127	129 Å²	129	67%	0.665	73%	0.732	S	S	*	*			cis	-154.7	143.6	-1.2	-110.4	163.1	0	0	0	111.9
366	Q	41.6	Very low	39.7	Very low	154 Å²	154	134.9 Å²	134.9	72%	0.72	74%	0.743	S	S	*	*			trans	6.7	152.9	142.9	-66.3	-175.9	-5.4	0	0	121.7
367	N	38.8	Very low	39.9	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	74%	0.742	S	S	*	*			cis	-166.2	140.7	-2	-109.7	-12.6	0	0	0	112.4
368	G	39.7	Very low	39.8	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	74%	0.736	S	S	*	*			trans	67.7	162.9	135.8	0	0	0	0	0	122.7
369	T	41.7	Very low	39.8	Very low	111 Å²	111	135 Å²	135	68%	0.681	74%	0.735	S	S	*	*			cis	-167.4	126.8	-13.5	-76.4	0	0	0	0	110.1
370	E	42	Very low	39.4	Very low	182 Å²	182	135.9 Å²	135.9	85%	0.85	74%	0.736	S	S	*	*			trans	53.4	167.5	157.3	-65.9	148.3	-169.2	0	0	118.6
371	D	39.7	Very low	39.2	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	74%	0.74	S	S	*	*			cis	-142.7	-171.7	10	-164	7.4	0	0	0	112
372	A	41.1	Very low	38.9	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	74%	0.738	S	S	*	*			trans	-107.3	-177.3	-157	0	0	0	0	0	118.7
373	G	37.6	Very low	38.4	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	75%	0.749	S	S	*	*			trans	118.4	107.5	176	0	0	0	0	0	112.3
374	D	38.5	Very low	37.9	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	76%	0.762	S	S	*	*			cis	105.5	147.2	30.5	-163.7	23.7	0	0	0	112.9
375	I	42.4	Very low	37.5	Very low	133 Å²	133	140 Å²	140	68%	0.682	76%	0.762	S	S	*	*			trans	79.4	107.8	174	-54	-178.2	0	0	0	120
376	E	35.7	Very low	37.2	Very low	182 Å²	182	142.1 Å²	142.1	85%	0.85	77%	0.768	S	S	*	*			trans	51.8	153.9	134.9	-57.9	-167.7	122	0	0	127.5
377	E	36.6	Very low	36.9	Very low	167 Å²	167	144 Å²	144	78%	0.78	78%	0.775	S	S	*	*			trans	74	95.8	150.9	-102.2	-170.2	158.6	0	0	125.1
378	F	33.5	Very low	36.6	Very low	183 Å²	183	143.1 Å²	143.1	80%	0.803	77%	0.774	S	S	*	*				65.5	149.1	127	-88.5	-111.4	0	0	0	124.2
379	Q	35.8	Very low	36.3	Very low	157 Å²	157	146 Å²	146	73%	0.734	78%	0.78	S	S	*	*			trans	75.3	100.2	158.1	-69.3	-177.7	49.8	0	0	122.4
380	N	31.6	Very low	35.9	Very low	125 Å²	125	147.7 Å²	147.7	67%	0.668	79%	0.785	S	S	*	*				71.7	153.9	125.6	-63.7	-31.3	0	0	0	122.9
381	H	37.1	Very low	35.3	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.815	78%	0.776	S	S	*	*			trans	80.1	150.1	162.2	-66.1	-48.6	0	0	0	117.6
382	P	36.4	Very low	35	Very low	107 Å²	107	143.2 Å²	143.2	70%	0.695	77%	0.769	S	S	*	*				-131	-170.6	-120.7	45.3	-32.5	0	0	0	115.9
383	E	31.7	Very low	34.5	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	78%	0.777	S	S	*	*			trans	62	110.6	166.8	-62.3	-165.5	130.7	0	0	118.1
384	L	33.9	Very low	34.2	Very low	170 Å²	170	153.9 Å²	153.9	89%	0.89	77%	0.774	S	S	*	*				-151.6	158.3	106.2	-133.8	76.9	0	0	0	111.8
385	S	31.1	Very low	34	Very low	94 Å²	94	154 Å²	154	66%	0.657	77%	0.774	S	S	*	*			trans	-84.2	155.2	-179	-69.2	0	0	0	0	112.9
386	H	35.6	Very low	33.7	Very low	171 Å²	171	154.2 Å²	154.2	79%	0.792	78%	0.781	S	S	*	*				179.6	138.4	111.5	-89.4	-48.9	0	0	0	115.2
387	K	34.3	Very low	33.8	Very low	195 Å²	195	150.5 Å²	150.5	85%	0.848	78%	0.775	S	S	*	*			trans	68.2	82.8	152.8	-65.7	176	-179.5	176.2	0	119.7
388	T	32	Very low	33.7	Very low	120 Å²	120	147.9 Å²	147.9	74%	0.736	78%	0.775	S	S	*	*			trans	-80.2	149.1	146.8	-18	0	0	0	0	111.1
389	P	34	Very low	34.1	Very low	127 Å²	127	145.1 Å²	145.1	83%	0.825	78%	0.776	S	S	*	*			trans	-94.3	124.2	145.8	32.5	-25.6	0	0	0	109.4
390	L	32.6	Very low	34	Very low	148 Å²	148	143.6 Å²	143.6	78%	0.775	78%	0.782	S	S	*	*			trans	-116.9	147.4	-174	-127.8	170.9	0	0	0	111.4
391	S	30.5	Very low	34.9	Very low	97 Å²	97	145.5 Å²	145.5	68%	0.678	79%	0.793	S	S	*	*			trans	-76.3	135.3	179.7	53.7	0	0	0	0	113.4
392	H	33.9	Very low	34.7	Very low	152 Å²	152	142.5 Å²	142.5	70%	0.704	79%	0.791	S	S	*	*			trans	-157.2	143.7	155.8	-124.5	66.5	0	0	0	114.2
393	Y	29.7	Very low	35.1	Very low	244 Å²	244	141.2 Å²	141.2	96%	0.957	80%	0.798	S	S	*	*			trans	-152.4	92.6	158	-98.8	-68.7	0	0	0	108.4
394	Q	32.4	Very low	35.2	Very low	148 Å²	148	143.1 Å²	143.1	69%	0.692	80%	0.797	S	S	*	*			trans	-157.6	124.8	174.3	-161.4	172.5	15.4	0	0	112.6
395	L	33.2	Very low	35	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	78%	0.782	S	S	*	*			trans	55.5	162.6	163.6	-95.5	78.1	0	0	0	120.8
396	V	37	Very low	35	Very low	137 Å²	137	145.1 Å²	145.1	83%	0.83	78%	0.784	S	S	*	*			trans	140.4	140.4	160.8	158.4	0	0	0	0	109.8
397	S	38.1	Very low	34.7	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	78%	0.777	S	S	*	*			cis	-164	166.8	-28.6	-86.3	0	0	0	0	109
398	S	33.2	Very low	34.5	Very low	111 Å²	111	142.4 Å²	142.4	78%	0.776	77%	0.774	S	S	*	*			trans	-66.7	153.6	170.2	-50.4	0	0	0	0	113.2
399	P	41.7	Very low	34.4	Very low	125 Å²	125	143.5 Å²	143.5	81%	0.812	78%	0.775	S	S	*	*			trans	-82	138.9	172.2	33.3	-33.7	0	0	0	112
400	S	34.3	Very low	34.2	Very low	125 Å²	125	145.1 Å²	145.1	87%	0.874	77%	0.773	S	S	*	*			trans	-156.7	108.6	165.8	-69.3	0	0	0	0	107.8
401	D	50.6	Low	34.1	Very low	166 Å²	166	143.2 Å²	143.2	89%	0.888	77%	0.772	S	S	*	*			trans	-101.3	153.5	179.2	-166.2	10	0	0	0	110.6
402	S	33.6	Very low	34.1	Very low	113 Å²	113	143.4 Å²	143.4	79%	0.79	77%	0.774	S	S	*	*			trans	-126.3	101.7	-167.1	60.9	0	0	0	0	112
403	G	44.2	Very low	33.8	Very low	80 Å²	80	139.3 Å²	139.3	83%	0.825	77%	0.773	S	S	*	*			trans	-127.2	111.2	-175	0	0	0	0	0	114
404	R	34.6	Very low	33.8	Very low	218 Å²	218	133.8 Å²	133.8	82%	0.823	77%	0.77	S	S	*	*			trans	-29.1	140	175.3	-73.4	173.1	175.1	-105.4	5.4	119.9
405	E	29.5	Very low	33.9	Very low	122 Å²	122	131.3 Å²	131.3	57%	0.57	78%	0.775	S	S	*	*				65.8	134	129	-64.8	177.1	80.4	0	0	123.3
406	R	29.8	Very low	34.2	Very low	185 Å²	185	129.1 Å²	129.1	70%	0.698	77%	0.77	S	S	*	*			trans	89.1	128.3	142.4	-88.8	-174.1	154.7	89.8	4.7	122.1
407	E	30.1	Very low	34	Very low	138 Å²	138	132.3 Å²	132.3	65%	0.645	77%	0.767	S	S	*	*			trans	58.1	103.5	140.9	-69.7	150.9	-156.9	0	0	117.5
408	Q	29.3	Very low	33.8	Very low	170 Å²	170	132.6 Å²	132.6	79%	0.794	76%	0.761	S	S	*	*				91	146.8	63	-174.4	-178.6	39.7	0	0	112.3
409	L	29.9	Very low	33.8	Very low	143 Å²	143	134.2 Å²	134.2	75%	0.749	76%	0.756	S	S	*	*			trans	88.4	102.4	177.3	-67.5	115.7	0	0	0	118.9
410	M	30	Very low	33.7	Very low	161 Å²	161	134.3 Å²	134.3	79%	0.793	75%	0.748	S	S	*	*				57	144.8	115	-59.7	-61.8	-82.3	0	0	121.8
411	S	30.7	Very low	33.9	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	74%	0.738	S	S	*	*			trans	70.7	159.3	156.9	-103.9	0	0	0	0	117.4
412	S	29.4	Very low	33.2	Very low	102 Å²	102	130.4 Å²	130.4	71%	0.713	73%	0.73	S	S	*	*			cis	179.1	139.9	-35.8	49.6	0	0	0	0	108.3
413	G	28.8	Very low	33.3	Very low	66 Å²	66	133.7 Å²	133.7	68%	0.68	73%	0.733	S	S	*	*			trans	86.4	138.8	176.4	0	0	0	0	0	113.1
414	S	30.1	Very low	32.7	Very low	127 Å²	127	134.3 Å²	134.3	89%	0.888	72%	0.724	S	S	*	*			cis	82.9	86.6	43.5	79.4	0	0	0	0	113.5
415	A	33.6	Very low	32.7	Very low	97 Å²	97	130.7 Å²	130.7	80%	0.802	72%	0.721	S	S	*	*			trans	-134	152.3	159.8	0	0	0	0	0	108.6
416	P	39.6	Very low	33	Very low	112 Å²	112	133.1 Å²	133.1	73%	0.727	74%	0.736	S	S	*	*			trans	-127.2	-170.1	-146.7	42.2	-26.4	0	0	0	114.7
417	R	33	Very low	33.2	Very low	204 Å²	204	131.8 Å²	131.8	77%	0.77	74%	0.742	S	S	*	*			trans	29.3	138.5	134.6	-74.1	-177.8	169.4	-94	3.5	118.4
418	D	33.9	Very low	33.9	Very low	112 Å²	112	130.1 Å²	130.1	60%	0.599	74%	0.743	S	S	*	*			cis	-172.1	-179.7	18.2	-110.7	-22.1	0	0	0	108.3
419	E	34	Very low	34.1	Very low	144 Å²	144	128.5 Å²	128.5	67%	0.673	75%	0.745	S	S	*	*			cis	-142.7	156.2	0.2	-113.3	-156.3	149.9	0	0	106.3
420	I	38.1	Very low	34.5	Very low	128 Å²	128	125 Å²	125	66%	0.656	74%	0.743	S	S	*	*				66.3	146	78	-103.9	166.7	0	0	0	115.5
421	P	38.7	Very low	35	Very low	100 Å²	100	123.2 Å²	123.2	65%	0.649	74%	0.744	S	S	*	*			cis	-139.4	-167.9	-9.3	38.6	-18.7	0	0	0	116.9
422	C	37	Very low	35.3	Very low	108 Å²	108	126.7 Å²	126.7	73%	0.73	75%	0.748	S	S	*	*			trans	83.7	125.5	149.9	-72	0	0	0	0	119.1
423	H	34.2	Very low	35.7	Very low	183 Å²	183	127.5 Å²	127.5	85%	0.847	75%	0.753	S	S	*	*			cis	57.8	142	5.9	-70.9	-91.4	0	0	0	115.7
424	S	33.2	Very low	36.3	Very low	93 Å²	93	129.6 Å²	129.6	65%	0.65	75%	0.752	S	S	*	*			cis	-159.7	160.2	23.5	49.1	0	0	0	0	112.2
425	D	33.1	Very low	36.7	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	75%	0.746	S	S	*	*			trans	28	141.7	143.3	-50	-46.4	0	0	0	123.1
426	I	36.1	Very low	37	Very low	174 Å²	174	130.4 Å²	130.4	89%	0.892	73%	0.733	S	S	*	*				-179.8	151.8	127.8	-94.2	155.8	0	0	0	113
427	L	35.4	Very low	37	Very low	156 Å²	156	129.9 Å²	129.9	82%	0.817	73%	0.732	S	S	*	*			trans	-91.5	-165.2	178.7	-124.7	66.7	0	0	0	111
428	P	44	Very low	37.2	Very low	103 Å²	103	125 Å²	125	67%	0.669	73%	0.729	S	S	*	*			cis	-136.8	-168.9	-24	30	-6.6	0	0	0	115
429	T	34.3	Very low	37.5	Very low	137 Å²	137	125.6 Å²	125.6	84%	0.84	74%	0.737	S	S	*	*			trans	100.4	143.9	148.8	-31.8	0	0	0	0	118.9
430	G	37.7	Very low	37.9	Very low	68 Å²	68	125.2 Å²	125.2	70%	0.701	74%	0.738	S	S	*	*			trans	-102.5	-133.2	-177.9	0	0	0	0	0	114.6
431	P	41.3	Very low	37.8	Very low	124 Å²	124	126.5 Å²	126.5	81%	0.805	75%	0.747	S	S	*	*			cis	-139.8	169.5	25.3	43.1	-25.1	0	0	0	118.7
432	Q	36.5	Very low	37.8	Very low	181 Å²	181	124.9 Å²	124.9	85%	0.846	75%	0.747	S	S	*	*			trans	24.6	141	149	-73.5	-176.2	-22.2	0	0	124.9
433	C	37.8	Very low	37.8	Very low	120 Å²	120	128.3 Å²	128.3	81%	0.811	75%	0.753	S	S	*	*			trans	-129.8	-168.6	132.4	-153.1	0	0	0	0	109.8
434	V	41.5	Very low	38	Very low	109 Å²	109	126 Å²	126	66%	0.661	74%	0.743	S	S	*	*			trans	-138.3	166.1	-166.1	-58	0	0	0	0	110.4
435	E	38.1	Very low	38.3	Very low	165 Å²	165	127.4 Å²	127.4	77%	0.771	74%	0.739	S	S	*	*			cis	-162.4	-173	3.4	-133.7	-176.9	-96.1	0	0	107.8
436	S	39.4	Very low	38.5	Very low	76 Å²	76	128.5 Å²	128.5	53%	0.531	74%	0.737	S	S	.	*			cis	-158.5	158.6	2.9	-152.8	0	0	0	0	114.8
437	S	39.1	Very low	38.7	Very low	101 Å²	101	124.9 Å²	124.9	71%	0.706	73%	0.727	S	S	*	*			trans	23	152.2	138	70.4	0	0	0	0	124.8
438	S	38.4	Very low	38.8	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	72%	0.721	S	S	*	*			cis	-174.5	-178.4	-16.9	56	0	0	0	0	113.2
439	V	39.9	Very low	38.4	Very low	125 Å²	125	124.8 Å²	124.8	76%	0.758	72%	0.724	S	S	*	*			trans	77.4	135.7	154.7	164.3	0	0	0	0	117.9
440	I	42.3	Very low	38.4	Very low	137 Å²	137	126 Å²	126	70%	0.703	72%	0.718	S	S	*	*			cis	-159.3	156.8	-10.9	-113.2	175.1	0	0	0	111.1
441	N	37.1	Very low	38	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	72%	0.721	S	S	*	*			trans	20.8	151.8	160.5	-58.5	-6.2	0	0	0	123.9
442	G	37.7	Very low	37.6	Very low	65 Å²	65	131.8 Å²	131.8	67%	0.67	72%	0.722	S	S	*	*			cis	159.8	172.7	-4.9	0	0	0	0	0	114.9
443	Q	37.5	Very low	37.2	Very low	181 Å²	181	130.7 Å²	130.7	85%	0.846	72%	0.721	S	S	*	*			trans	65.1	155.1	175.9	-66.7	-174.7	-85.1	0	0	116.8
444	Q	38.2	Very low	37.3	Very low	135 Å²	135	129.9 Å²	129.9	63%	0.631	71%	0.714	S	S	*	*			cis	-175.2	141.5	-22.5	-171.6	154.4	7.1	0	0	105.2
445	E	38.5	Very low	36.8	Very low	122 Å²	122	129.7 Å²	129.7	57%	0.57	72%	0.717	S	S	*	*			cis	-159.7	-168.3	12.6	-140.5	169.5	-147	0	0	113.6
446	K	38.8	Very low	36.5	Very low	164 Å²	164	129.8 Å²	129.8	71%	0.713	72%	0.718	S	S	*	*			trans	14	140.1	150.7	-75	158.8	-154.6	152.2	0	121
447	S	38.6	Very low	36.1	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	73%	0.726	S	S	*	*			cis	-168.3	132.3	2.5	50.1	0	0	0	0	114.6
448	S	38.5	Very low	35.6	Very low	100 Å²	100	132.2 Å²	132.2	70%	0.699	72%	0.724	S	S	*	*			trans	37.3	146.6	130.7	73	0	0	0	0	122.9
449	H	35.7	Very low	35.5	Very low	156 Å²	156	137.2 Å²	137.2	72%	0.722	73%	0.733	S	S	*	*			cis	-166.4	148.6	-2.5	-130.5	-137	0	0	0	112.3
450	F	34.6	Very low	35.3	Very low	164 Å²	164	136.5 Å²	136.5	72%	0.719	73%	0.734	S	S	*	*			trans	53.4	99.6	138	-80.4	-127.8	0	0	0	123.2
451	T	29.5	Very low	35.3	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	74%	0.737	S	S	*	*				35	135	108.6	-29.6	0	0	0	0	123.4
452	K	32.5	Very low	35.3	Very low	189 Å²	189	132.6 Å²	132.6	82%	0.822	73%	0.728	S	S	*	*			trans	95	111	142.8	-112.9	176	-179.4	-176.2	0	121.9
453	L	28.7	Very low	35.4	Very low	158 Å²	158	136.6 Å²	136.6	83%	0.827	73%	0.734	S	S	*	*				8.4	158.1	125.9	-70.1	164.1	0	0	0	120.5
454	P	38.4	Very low	35.6	Very low	103 Å²	103	135.2 Å²	135.2	67%	0.669	73%	0.727	S	S	*	*			cis	-142.5	-168.6	-10.3	36.5	-13.8	0	0	0	116.3
455	S	31	Very low	35.6	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	73%	0.73	S	S	*	*			trans	87.7	121.6	144.2	-62.7	0	0	0	0	123.9
456	E	33	Very low	35.5	Very low	167 Å²	167	134 Å²	134	78%	0.78	73%	0.732	S	S	*	*			trans	78.4	131.7	130.8	-64.3	-80.8	78.3	0	0	124.1
457	L	30.2	Very low	35.4	Very low	135 Å²	135	134.4 Å²	134.4	71%	0.707	74%	0.736	S	S	*	*			trans	64.7	102.4	149.1	-92.4	77.9	0	0	0	124.7
458	S	29.3	Very low	35.1	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	75%	0.745	S	S	*	*				100.6	150.4	108	80.7	0	0	0	0	123.4
459	K	35.9	Very low	35.1	Very low	206 Å²	206	134.9 Å²	134.9	90%	0.896	75%	0.751	S	S	*	*			trans	86.6	129.4	160.3	-65	179.1	179.8	177.1	0	120.8
460	S	35.2	Very low	34.8	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	76%	0.757	S	S	*	*			trans	-106.8	162.3	169.3	52.2	0	0	0	0	111.8
461	P	42.2	Very low	35.1	Very low	118 Å²	118	133 Å²	133	77%	0.766	75%	0.753	S	S	*	*				-137.1	-177.2	110.3	16.3	6.6	0	0	0	112.1
462	S	37	Very low	35.3	Very low	92 Å²	92	135.1 Å²	135.1	64%	0.643	75%	0.754	S	S	*	*			cis	-172.9	-176.7	-31.1	-83.3	0	0	0	0	108.9
463	D	40.3	Very low	35.8	Very low	149 Å²	149	130.5 Å²	130.5	80%	0.797	74%	0.743	S	S	*	*			trans	70	138.7	156.3	-48.3	-30	0	0	0	119.1
464	E	41.6	Very low	35.9	Very low	151 Å²	151	127.2 Å²	127.2	71%	0.706	73%	0.734	S	S	*	*			cis	-160.4	161.1	-6.3	-125.6	-164.3	130	0	0	112.3
465	L	37.9	Very low	35.7	Very low	133 Å²	133	130.4 Å²	130.4	70%	0.696	74%	0.74	S	S	*	*			trans	61.5	137	149.8	-66.9	172.3	0	0	0	121.4
466	T	37.3	Very low	35.9	Very low	98 Å²	98	131.2 Å²	131.2	60%	0.601	74%	0.74	S	S	*	*			cis	-162	150.1	-9.6	-20.4	0	0	0	0	112.1
467	Q	36.3	Very low	36.1	Very low	174 Å²	174	127.3 Å²	127.3	81%	0.813	74%	0.736	S	S	*	*			trans	51	153.4	144.1	-83.2	164.7	-10.1	0	0	122.5
468	C	32.1	Very low	36.2	Very low	127 Å²	127	127.3 Å²	127.3	86%	0.858	74%	0.737	S	S	*	*			cis	-173.9	155.2	-26.9	-118.8	0	0	0	0	109.8
469	G	37.9	Very low	36.7	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	74%	0.743	S	S	*	*			trans	135	123.3	157.8	0	0	0	0	0	118
470	E	30.2	Very low	36.6	Very low	185 Å²	185	124.5 Å²	124.5	86%	0.864	73%	0.725	S	S	*	*			trans	-133	-177.9	170.7	-127.9	-161.4	139.3	0	0	107.1
471	P	40.2	Very low	36.7	Very low	96 Å²	96	128.7 Å²	128.7	62%	0.623	73%	0.73	S	S	*	*			cis	-138	172.9	-16.6	40.6	-23.9	0	0	0	115.7
472	E	33.1	Very low	36.4	Very low	168 Å²	168	133.8 Å²	133.8	79%	0.785	73%	0.733	S	S	*	*			trans	54.6	-174.5	146.6	-75.2	-76.8	93.8	0	0	119
473	P	43.1	Very low	36.4	Very low	91 Å²	91	135 Å²	135	59%	0.591	73%	0.733	S	S	*	*				-137.7	-180	-88.9	42.2	-22.9	0	0	0	117.8
474	S	31.7	Very low	36.3	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	73%	0.729	S	S	*	*			trans	88.4	137.9	147.2	88.5	0	0	0	0	121.7
475	Q	33.4	Very low	36.1	Very low	171 Å²	171	137.8 Å²	137.8	80%	0.799	73%	0.732	S	S	*	*			trans	66.2	150.6	153.7	-63.4	167.5	103.1	0	0	117.1
476	T	35.3	Very low	35.9	Very low	121 Å²	121	138.9 Å²	138.9	74%	0.742	73%	0.734	S	S	*	*			cis	-154.9	166.6	14.5	-21.3	0	0	0	0	110.6
477	A	37.4	Very low	35.7	Very low	85 Å²	85	137.7 Å²	137.7	70%	0.702	74%	0.741	S	S	*	*			trans	43.5	148.4	139.9	0	0	0	0	0	122.3
478	D	33.8	Very low	35.6	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	74%	0.735	S	S	*	*			cis	-171	-176	-20	-140.4	-51.1	0	0	0	108.5
479	H	39.6	Very low	35.8	Very low	167 Å²	167	136.8 Å²	136.8	77%	0.773	74%	0.735	S	S	*	*			trans	73.8	157.5	165.8	-48.3	-57.6	0	0	0	119.4
480	S	32.5	Very low	35.7	Very low	74 Å²	74	141.7 Å²	141.7	52%	0.517	74%	0.736	S	S	.	*				-176.4	140.8	-70.2	51.8	0	0	0	0	112
481	F	37.1	Very low	36	Very low	199 Å²	199	142.1 Å²	142.1	87%	0.873	74%	0.738	S	S	*	*			trans	67.7	155.3	173.6	-44.4	-70.7	0	0	0	115
482	R	36.5	Very low	35.8	Very low	224 Å²	224	145.5 Å²	145.5	85%	0.845	75%	0.745	S	S	*	*			cis	-151.9	158.2	13.2	-154.5	176.7	-177.4	171.1	3.1	112.2
483	D	36.9	Very low	35.9	Very low	118 Å²	118	141.1 Å²	141.1	63%	0.631	73%	0.734	S	S	*	*			trans	-8.4	152.1	158.9	-67.2	-71.6	0	0	0	121
484	H	38.2	Very low	35.8	Very low	153 Å²	153	141.7 Å²	141.7	71%	0.708	74%	0.737	S	S	*	*			cis	-166.7	155.6	28.7	-125.1	8.6	0	0	0	113.2
485	R	36.8	Very low	36	Very low	206 Å²	206	142.5 Å²	142.5	78%	0.777	74%	0.738	S	S	*	*			trans	64.8	149.9	155.5	-71.9	-168	-179.9	-130.5	10.5	119.8
486	Q	35.3	Very low	36.4	Very low	156 Å²	156	140.3 Å²	140.3	73%	0.729	73%	0.731	S	S	*	*			cis	-166.1	140.7	-14.6	168.3	172.6	-7.6	0	0	110.8
487	G	32.1	Very low	36.9	Very low	73 Å²	73	140 Å²	140	75%	0.753	72%	0.719	S	S	*	*			trans	98	147	-179.3	0	0	0	0	0	112.5
488	S	33.8	Very low	37	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	72%	0.715	S	S	*	*			cis	-165.7	136.2	3.3	57.1	0	0	0	0	110.8
489	E	38	Very low	37.2	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	71%	0.714	S	S	*	*			trans	53	152.6	150.9	11.7	-172.7	137.9	0	0	120.2
490	E	34.9	Very low	37.3	Very low	184 Å²	184	140 Å²	140	86%	0.86	71%	0.711	S	S	*	*			cis	-162.7	120.9	-25	-128.5	-166	174.1	0	0	108.6
491	E	35.7	Very low	37.8	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	72%	0.722	S	S	*	*			trans	-174.4	117.7	147.4	-110	-157.2	112.9	0	0	111.1
492	H	36.6	Very low	38.1	Very low	166 Å²	166	147.3 Å²	147.3	77%	0.769	72%	0.722	S	S	*	*			trans	-124.8	122.1	173.6	-88.6	-74.9	0	0	0	110.9
493	S	35.3	Very low	38.5	Very low	77 Å²	77	141 Å²	141	54%	0.538	72%	0.718	S	S	.	*			trans	-60.9	144.1	-171.2	72.6	0	0	0	0	113.7	V495	S493-V495 PolarHBondContact O-N 3.29Å; S493-V495 VanDerWaalsContact O-N 3.12Å
494	P	40.4	Very low	38.5	Very low	103 Å²	103	138.9 Å²	138.9	67%	0.669	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-4.4	-169.6	28.6	-36.3	0	0	0	115	T498	P494-T498 PolarHBondContact O-OG1 3.14Å
495	V	35.9	Very low	38.5	Very low	105 Å²	105	143.7 Å²	143.7	64%	0.636	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-48.2	-170	-176.3	0	0	0	0	111.9	S493 T498	S493-V495 PolarHBondContact O-N 3.29Å; S493-V495 VanDerWaalsContact O-N 3.12Å; V495-T498 PolarHBondContact O-N 3.23Å
496	L	42.6	Very low	38.6	Very low	125 Å²	125	143.1 Å²	143.1	65%	0.654	73%	0.731	S	S	*	*	H	α-helix	trans	-72.3	-40.4	-173.5	-62.7	178.7	0	0	0	112.8	T498 L499 E500	L496-T498 PolarHBondContact O-N 3.39Å; L496-L499 PolarHBondContact O-N 3.48Å; L496-L499 VanDerWaalsContact O-N 3.11Å; L496-E500 PolarHBondContact O-N 3.24Å
497	K	45.2	Very low	39.1	Very low	115 Å²	115	142.5 Å²	142.5	50%	0.5	73%	0.733	S	S	.	*	H	α-helix	trans	-62.1	-6.2	175.5	-72.7	178.7	178.3	171.1	0	114.2	R501	K497-R501 PolarHBondContact O-NH1 3.41Å
498	T	40.9	Very low	39.3	Very low	98 Å²	98	144.3 Å²	144.3	60%	0.601	73%	0.731	S	S	*	*	H	α-helix	trans	-99.1	-29.6	177.8	-57	0	0	0	0	112.7	P494 V495 L496	P494-T498 PolarHBondContact O-OG1 3.14Å; V495-T498 PolarHBondContact O-N 3.23Å; L496-T498 PolarHBondContact O-N 3.39Å
499	L	37.8	Very low	39.6	Very low	135 Å²	135	143.9 Å²	143.9	71%	0.707	73%	0.728	S	S	*	*	H	α-helix	trans	-77.5	-44.8	179.1	-174.3	59.6	0	0	0	111.5	L496 R501 R502	L496-L499 PolarHBondContact O-N 3.48Å; L496-L499 VanDerWaalsContact O-N 3.11Å; L499-R501 VanDerWaalsContact C-N 3.33Å; L499-R501 PolarHBondContact O-N 3.15Å; L499-R502 PolarHBondContact O-N 2.93Å
500	E	41.5	Very low	39.6	Very low	153 Å²	153	144.8 Å²	144.8	72%	0.715	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-64.9	-32.9	-174	-162.3	167.8	-139.6	0	0	113.3	L496 R502 A503	L496-E500 PolarHBondContact O-N 3.24Å; E500-R502 PolarHBondContact O-N 3.41Å; E500-R502 VanDerWaalsContact O-N 3.17Å; E500-A503 PolarHBondContact O-N 3.35Å
501	R	43.4	Very low	39.7	Very low	196 Å²	196	140.9 Å²	140.9	74%	0.74	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-70.6	-7.1	178.6	-70.3	-171	178.1	111.7	-14	114.9	K497 L499	K497-R501 PolarHBondContact O-NH1 3.41Å; L499-R501 VanDerWaalsContact C-N 3.33Å; L499-R501 PolarHBondContact O-N 3.15Å
502	R	43.4	Very low	40.1	Very low	232 Å²	232	138.4 Å²	138.4	88%	0.875	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-89.2	-10.8	173.5	-89.7	-176.5	166.7	179.4	-3	114.2	L499 E500	L499-R502 PolarHBondContact O-N 2.93Å; E500-R502 PolarHBondContact O-N 3.41Å; E500-R502 VanDerWaalsContact O-N 3.17Å
503	A	43.1	Very low	40.2	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	71%	0.71	S	S	*	*	S	Bend	trans	-82	-10.1	-174.2	0	0	0	0	0	115	E500	E500-A503 PolarHBondContact O-N 3.35Å
504	A	37.7	Very low	40.5	Very low	73 Å²	73	141 Å²	141	60%	0.603	72%	0.723	S	S	*	*			trans	-141.5	95.6	-170.5	0	0	0	0	0	114.5
505	R	38.5	Very low	40.8	Very low	254 Å²	254	139.8 Å²	139.8	96%	0.958	71%	0.71	S	S	*	*			trans	-169	106	143.5	-100.4	145.6	-157	-151	2.8	113.2
506	K	38.7	Very low	41	Very low	193 Å²	193	139.7 Å²	139.7	84%	0.839	71%	0.712	S	S	*	*			trans	-49.6	163.2	152.4	-79.7	179.3	179.1	-177.4	0	111.1
507	L	44.7	Very low	40.7	Very low	144 Å²	144	137.7 Å²	137.7	75%	0.754	71%	0.708	S	S	*	*			cis	-163.1	-154.7	9	-114.9	160.6	0	0	0	106.3
508	P	37.7	Very low	40.4	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	72%	0.723	S	S	*	*				-91.9	-166.4	-83.8	41.9	-27.3	0	0	0	111.5
509	S	39.8	Very low	40.4	Very low	91 Å²	91	139.3 Å²	139.3	64%	0.636	73%	0.726	S	S	*	*			cis	-164.5	142.5	22.1	52.1	0	0	0	0	114.2
510	K	37.6	Very low	40.5	Very low	199 Å²	199	137.5 Å²	137.5	87%	0.865	73%	0.725	S	S	*	*			trans	57.8	144.5	142.7	-63.2	177.7	-178.1	-172.7	0	119.8
511	S	37.9	Very low	40.4	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	73%	0.727	S	S	*	*			cis	-173	-169.4	-16.9	49	0	0	0	0	108
512	L	42.9	Very low	40.2	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	73%	0.732	S	S	*	*			trans	76.7	129.1	176.1	-128.4	70.4	0	0	0	113.4
513	E	38.7	Very low	40	Very low	145 Å²	145	129.5 Å²	129.5	68%	0.678	73%	0.726	S	S	*	*			cis	-148.2	154.8	-3.8	-139.1	146.6	-151.4	0	0	108.4
514	D	43.1	Very low	39.9	Very low	151 Å²	151	134.2 Å²	134.2	81%	0.807	73%	0.729	S	S	*	*			trans	176.5	132.6	141.9	-87.7	-20.3	0	0	0	110.6
515	I	46.7	Very low	40.2	Very low	78 Å²	78	136.5 Å²	136.5	40%	0.4	74%	0.736	S	S	.	*			trans	-74.9	174.3	-163.9	-14.1	73.2	0	0	0	113.5	S323 T324	S323-I515 VanDerWaalsContact OG-CB 3.29Å; S323-I515 WeakPolarHBondContact OG-CB 3.45Å; S323-I515 WeakPolarHBondContact OG-CD1 3.41Å; S323-I515 WeakPolarHBondContact OG-CG1 3.29Å; T324-I515 WeakPolarHBondContact OG1-CD1 3.43Å; T324-I515 WeakPolarHBondContact OG1-CG1 3.34Å
516	P	39.8	Very low	40.3	Very low	104 Å²	104	130.7 Å²	130.7	68%	0.675	72%	0.724	S	S	*	*				-138	178	58.1	35.8	-14.7	0	0	0	117.2	S322	S322-P516 VanDerWaalsContact OG-CB 3.24Å; S322-P516 WeakPolarHBondContact OG-CB 3.36Å
517	S	35.9	Very low	40.3	Very low	83 Å²	83	128.3 Å²	128.3	58%	0.58	72%	0.72	S	S	*	*			trans	-64.6	162.3	179.2	-46.2	0	0	0	0	114
518	D	37.9	Very low	40	Very low	150 Å²	150	129.1 Å²	129.1	80%	0.802	72%	0.724	S	S	*	*				-173.3	161.8	73.2	-177.3	32.3	0	0	0	114.5
519	S	40.7	Very low	40.3	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	72%	0.724	S	S	*	*			trans	81.4	119.2	152.9	80.5	0	0	0	0	123
520	S	39.8	Very low	40.3	Very low	98 Å²	98	134 Å²	134	69%	0.685	74%	0.737	S	S	*	*				74.3	90.8	126.7	-149.1	0	0	0	0	123.6
521	N	39.4	Very low	40.3	Very low	139 Å²	139	131.9 Å²	131.9	74%	0.743	73%	0.731	S	S	*	*				78.5	140.1	117.9	-72.4	-58.2	0	0	0	125.3
522	Q	40.6	Very low	40.4	Very low	181 Å²	181	133.7 Å²	133.7	85%	0.846	73%	0.731	S	S	*	*			trans	73.2	105.8	148.5	-73.9	178.5	56	0	0	122.3
523	A	38.8	Very low	40.3	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	72%	0.721	S	S	*	*				140.5	136.3	100.4	0	0	0	0	0	117
524	K	41.2	Very low	40.4	Very low	191 Å²	191	134.2 Å²	134.2	83%	0.83	73%	0.727	S	S	*	*			trans	58.9	130.1	167.6	-68.1	-175.4	171.7	-175.2	0	118.4
525	V	44.3	Very low	40	Very low	122 Å²	122	132.6 Å²	132.6	74%	0.739	73%	0.728	S	S	*	*			cis	91.2	143.5	30.7	-178.7	0	0	0	0	113.3
526	D	40.2	Very low	39.8	Very low	131 Å²	131	132.6 Å²	132.6	70%	0.701	74%	0.739	S	S	*	*			trans	79.7	138	-177.7	-55.7	-46.5	0	0	0	116
527	N	38.4	Very low	40.1	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	75%	0.749	S	S	*	*			cis	-153	-178.2	-1.6	-130.8	-47.5	0	0	0	114.5
528	L	38.8	Very low	40.3	Very low	160 Å²	160	139.6 Å²	139.6	84%	0.838	76%	0.758	S	S	*	*			trans	-96.3	173.8	-166.6	-85.1	158.5	0	0	0	117
529	P	44.4	Very low	40.5	Very low	111 Å²	111	138 Å²	138	72%	0.721	75%	0.749	S	S	*	*			trans	-108.9	175.2	-177	42.3	-35.4	0	0	0	115.6
530	E	39.8	Very low	40.5	Very low	195 Å²	195	140.3 Å²	140.3	91%	0.911	75%	0.75	S	S	*	*			trans	-146.3	-169.6	171.2	-100.9	175.5	-171.2	0	0	112.8
531	E	37.7	Very low	40.5	Very low	154 Å²	154	143.9 Å²	143.9	72%	0.72	75%	0.753	S	S	*	*				-152.3	169.5	-115.2	-152.6	-157.7	146.7	0	0	112.7
532	L	39.7	Very low	40.6	Very low	140 Å²	140	141 Å²	141	73%	0.733	75%	0.749	S	S	*	*			trans	68.6	164	162.5	-52.2	171.6	0	0	0	116
533	V	40.2	Very low	40.7	Very low	88 Å²	88	138.2 Å²	138.2	53%	0.533	74%	0.74	S	S	.	*			cis	-163.4	152.4	-3.5	101	0	0	0	0	113.9
534	R	40.2	Very low	40.7	Very low	210 Å²	210	143 Å²	143	79%	0.792	75%	0.747	S	S	*	*			trans	63.5	145.5	159.7	-67.7	163.7	-159.4	140	4.4	118.4
535	S	35.7	Very low	40.4	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	75%	0.748	S	S	*	*			cis	82.9	134.7	36	-53.4	0	0	0	0	113.6
536	A	41.7	Very low	40.3	Very low	78 Å²	78	141.6 Å²	141.6	65%	0.645	74%	0.743	S	S	*	*			cis	-161.5	-168.6	-3	0	0	0	0	0	111.2
537	E	46	Very low	40.2	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	75%	0.745	S	S	*	*			trans	68.2	163.5	158.3	-64.7	156.3	144.3	0	0	118.7
538	D	40.5	Very low	40.3	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	74%	0.738	S	S	*	*			cis	-160.7	167.7	-46.8	-155.4	-2.7	0	0	0	110.8
539	D	42.3	Very low	40.4	Very low	115 Å²	115	139.1 Å²	139.1	62%	0.615	74%	0.735	S	S	*	*			trans	70.7	123.4	148	-116.9	-15.2	0	0	0	126.3
540	Q	41.1	Very low	40	Very low	146 Å²	146	142.8 Å²	142.8	68%	0.682	74%	0.742	S	S	*	*			trans	78.5	139	134.4	-94.6	169.3	76.4	0	0	128
541	K	40.7	Very low	39.7	Very low	172 Å²	172	139.5 Å²	139.5	75%	0.748	74%	0.74	S	S	*	*			trans	68.3	150.2	158.8	-85	-179.9	175	176.6	0	118.6
542	A	40.6	Very low	39.7	Very low	80 Å²	80	139.7 Å²	139.7	66%	0.661	74%	0.744	S	S	*	*			cis	-163.4	168.5	4.1	0	0	0	0	0	109.5
543	D	42.9	Very low	39.8	Very low	122 Å²	122	139 Å²	139	65%	0.652	75%	0.748	S	S	*	*			cis	-168.7	174.3	-20.2	-86.7	-22.8	0	0	0	107.7
544	Q	39.4	Very low	39.6	Very low	193 Å²	193	137.9 Å²	137.9	90%	0.902	75%	0.754	S	S	*	*			trans	82.7	119.4	165.6	-76.2	165.8	76.3	0	0	122.4
545	E	34.1	Very low	39.8	Very low	184 Å²	184	136.1 Å²	136.1	86%	0.86	76%	0.759	S	S	*	*			trans	-89.3	-163	157.8	-60.9	-156.3	116.6	0	0	110.5
546	P	42.1	Very low	39.9	Very low	99 Å²	99	135.2 Å²	135.2	64%	0.643	75%	0.752	S	S	*	*			cis	-140.4	-170.2	-3.1	37.2	-13.5	0	0	0	117.5
547	D	38.3	Very low	39.9	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	76%	0.756	S	S	*	*			trans	99.6	130.4	133.8	-93.5	-32.4	0	0	0	124.5
548	T	39.8	Very low	39.8	Very low	103 Å²	103	134.7 Å²	134.7	63%	0.632	75%	0.754	S	S	*	*			trans	73.3	116.5	145.4	55.6	0	0	0	0	124.1
549	N	41.3	Very low	39.7	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	75%	0.752	S	S	*	*				76.9	118.3	121.7	-56.8	-6.8	0	0	0	123.3
550	E	34.9	Very low	39.6	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	76%	0.763	S	S	*	*			trans	18.8	139.6	135.1	-53.6	-165.9	124.8	0	0	123.2
551	C	35.2	Very low	39.4	Very low	127 Å²	127	133.6 Å²	133.6	86%	0.858	77%	0.768	S	S	*	*				137.9	153.2	117.9	-157	0	0	0	0	114.8
552	I	37.2	Very low	39.5	Very low	157 Å²	157	131.1 Å²	131.1	81%	0.805	77%	0.769	S	S	*	*			trans	-122.2	124.2	-169.5	-64.8	162.1	0	0	0	108.6
553	P	41	Very low	39.3	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	78%	0.776	S	S	*	*				-151.1	174.8	102.1	36.1	-16.9	0	0	0	114.1
554	G	36.7	Very low	38.7	Very low	65 Å²	65	134.8 Å²	134.8	67%	0.67	78%	0.777	S	S	*	*			cis	126.4	110	-4.9	0	0	0	0	0	114.3
555	I	43.9	Very low	38.4	Very low	173 Å²	173	133.6 Å²	133.6	89%	0.887	77%	0.772	S	S	*	*			trans	-159.7	135.6	160.7	33.2	171.5	0	0	0	113.8
556	S	38.3	Very low	38.2	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	77%	0.771	S	S	*	*			trans	38.5	133.9	138.1	-149.1	0	0	0	0	120.6
557	T	42.1	Very low	37.7	Very low	119 Å²	119	134.1 Å²	134.1	73%	0.73	78%	0.775	S	S	*	*				-164.4	113.2	52.3	-58	0	0	0	0	114.6
558	V	44.4	Very low	37.5	Very low	136 Å²	136	136.6 Å²	136.6	82%	0.824	78%	0.782	S	S	*	*			trans	61.7	144.4	136.8	178.5	0	0	0	0	120.7
559	P	38.5	Very low	37.2	Very low	114 Å²	114	137 Å²	137	74%	0.74	79%	0.786	S	S	*	*			trans	-127.2	175.2	-148.5	44.2	-30.4	0	0	0	117.1
560	S	38.3	Very low	37	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	79%	0.789	S	S	*	*			trans	-160.8	149.4	140.1	35	0	0	0	0	114.3
561	L	37.5	Very low	37.1	Very low	149 Å²	149	138.1 Å²	138.1	78%	0.78	79%	0.788	S	S	*	*			trans	-25.7	132.3	176.5	-166.8	75	0	0	0	119.6
562	P	43.4	Very low	37.4	Very low	120 Å²	120	140.5 Å²	140.5	78%	0.779	79%	0.792	S	S	*	*			trans	-98.6	138	151.5	35.2	-28.5	0	0	0	111.8
563	D	36.1	Very low	37.4	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	80%	0.797	S	S	*	*			trans	-89.5	163.5	-173.3	-140.2	-33.9	0	0	0	114
564	N	31.3	Very low	37.5	Very low	129 Å²	129	148.2 Å²	148.2	69%	0.69	80%	0.8	S	S	*	*			trans	-96.9	115.8	-168.4	177	5.6	0	0	0	113.4
565	Q	33.1	Very low	37.4	Very low	169 Å²	169	153.6 Å²	153.6	79%	0.79	81%	0.81	S	S	*	*			trans	-166.6	127.5	152.5	-111.3	146.4	113.5	0	0	116.2
566	F	29.7	Very low	37.1	Very low	189 Å²	189	150.5 Å²	150.5	83%	0.829	80%	0.804	S	S	*	*			trans	24.8	122.2	141.1	-69.7	-101.1	0	0	0	118.2
567	S	31.7	Very low	37.2	Very low	104 Å²	104	155.5 Å²	155.5	73%	0.727	81%	0.813	S	S	*	*				171.9	134.6	63.9	38.4	0	0	0	0	113
568	H	32.9	Very low	36.9	Very low	189 Å²	189	155 Å²	155	88%	0.875	81%	0.814	S	S	*	*			trans	-167.2	99.3	150.7	-121.4	-71.3	0	0	0	111.2
569	P	34.7	Very low	36.9	Very low	111 Å²	111	155.3 Å²	155.3	72%	0.721	82%	0.816	S	S	*	*				-135.2	-168.1	124.8	39.8	-31	0	0	0	112.4
570	D	37	Very low	36.8	Very low	157 Å²	157	155.8 Å²	155.8	84%	0.84	82%	0.82	S	S	*	*			trans	100.5	59.6	178.8	-62.6	-1.9	0	0	0	117
571	K	36	Very low	36.5	Very low	197 Å²	197	154.3 Å²	154.3	86%	0.857	82%	0.815	S	S	*	*			trans	-83.3	164.5	144.6	-74.3	-178.3	177.9	175.9	0	109.6
572	L	41.3	Very low	36.4	Very low	178 Å²	178	156.8 Å²	156.8	93%	0.932	82%	0.819	S	S	*	*			trans	85.4	95.4	177.3	-56.6	166.3	0	0	0	116.5
573	K	37.3	Very low	36.2	Very low	211 Å²	211	157.9 Å²	157.9	92%	0.917	82%	0.818	S	S	*	*			trans	-150.8	70.9	159.4	-155.6	176	-173.6	-178.7	0	112.7
574	R	44.6	Very low	36	Very low	234 Å²	234	158.1 Å²	158.1	88%	0.883	81%	0.814	S	S	*	*			trans	-141.1	139.4	167.7	-82.5	-175	173.6	153.5	-1.8	109.5
575	M	33.8	Very low	36.2	Very low	177 Å²	177	157.6 Å²	157.6	87%	0.872	81%	0.811	S	S	*	*			trans	66.1	152.1	165.9	-61.3	160.4	78.2	0	0	115.4
576	S	36.8	Very low	36.1	Very low	109 Å²	109	157.3 Å²	157.3	76%	0.762	81%	0.81	S	S	*	*			cis	-152	175.5	-17.4	-112	0	0	0	0	111.6
577	K	40.2	Very low	36.4	Very low	204 Å²	204	154 Å²	154	89%	0.887	81%	0.81	S	S	*	*			trans	-84.8	129.2	-175.4	-45.5	158.7	-173.7	168.1	0	111.3
578	S	37.6	Very low	36.7	Very low	107 Å²	107	156 Å²	156	75%	0.748	81%	0.813	S	S	*	*			trans	174.2	115.8	143.3	53.8	0	0	0	0	113.7
579	V	43	Very low	37.2	Very low	144 Å²	144	151.5 Å²	151.5	87%	0.873	80%	0.795	S	S	*	*			trans	-144.9	104.5	152.4	-178.9	0	0	0	0	108
580	P	37.3	Very low	37.7	Very low	124 Å²	124	155.1 Å²	155.1	81%	0.805	79%	0.794	S	S	*	*			trans	-73.8	169.6	172.9	-17.9	33.3	0	0	0	112.9
581	A	32.4	Very low	37.7	Very low	90 Å²	90	154 Å²	154	74%	0.744	78%	0.784	S	S	*	*			trans	-107.6	148.1	177.6	0	0	0	0	0	112.7
582	F	34.6	Very low	37.8	Very low	201 Å²	201	151.1 Å²	151.1	88%	0.882	78%	0.783	S	S	*	*			trans	-149.2	112.8	166.1	-129.8	-102.8	0	0	0	103.5
583	L	38.4	Very low	37.4	Very low	142 Å²	142	147.6 Å²	147.6	74%	0.743	77%	0.765	S	S	*	*			cis	62.9	127.7	46.7	-76.9	-179.5	0	0	0	115
584	Q	32.2	Very low	37.3	Very low	155 Å²	155	143.9 Å²	143.9	72%	0.724	76%	0.761	S	S	*	*			trans	74.2	141.4	150.3	-145.1	143.1	4.4	0	0	116.3
585	D	36.2	Very low	36.8	Very low	117 Å²	117	136.9 Å²	136.9	63%	0.626	75%	0.753	S	S	*	*			cis	-123.8	152.6	0.4	-102.7	-38.2	0	0	0	109.6
586	E	30.4	Very low	36.9	Very low	164 Å²	164	133.3 Å²	133.3	77%	0.766	75%	0.745	S	S	*	*				65.8	151.1	80.7	-68.1	-153.4	52.6	0	0	116.9
587	S	36.2	Very low	36.7	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	74%	0.739	S	S	*	*			trans	69	144.1	-178.4	80.5	0	0	0	0	116.6
588	D	39	Very low	36.2	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	73%	0.728	S	S	*	*			cis	-156.1	162.3	-20.8	-146.7	-10.9	0	0	0	113
589	D	43.5	Very low	36.1	Very low	95 Å²	95	128.1 Å²	128.1	51%	0.508	72%	0.719	S	S	.	*			trans	57.4	160.8	140.2	-127.5	-18.4	0	0	0	125.9
590	R	43.3	Very low	35.8	Very low	188 Å²	188	131.4 Å²	131.4	71%	0.709	72%	0.718	S	S	*	*			trans	48.2	118.7	162.7	-52.7	-56.8	148	98.9	19.6	118.4
591	E	37.5	Very low	35.8	Very low	134 Å²	134	133.1 Å²	133.1	63%	0.626	72%	0.715	S	S	*	*				47.9	105.7	65.9	-63.2	-165	158.7	0	0	114.6	R849	E591-R849 IonicContact OE1-NH1 3.38Å; E591-R849 PolarHBondContact OE1-NH1 3.07Å; E591-R849 IonicContact OE1-NH2 2.85Å
592	T	38.8	Very low	36	Very low	136 Å²	136	134.9 Å²	134.9	83%	0.834	71%	0.711	S	S	*	*			trans	-172.5	131.3	136.2	-79.8	0	0	0	0	110.8
593	D	32.6	Very low	36.1	Very low	104 Å²	104	135.9 Å²	135.9	56%	0.556	71%	0.709	S	S	*	*			trans	-85	134.1	167.2	-119.8	-54.3	0	0	0	110.2	R239	R239-D593 IonicContact CZ-OD1 3.75Å; R239-D593 IonicContact CZ-OD2 2.75Å; R239-D593 IonicContact NH1-OD1 3.88Å; R239-D593 IonicContact NH1-OD2 3.22Å; R239-D593 PolarHBondContact NH1-OD2 2.92Å; R239-D593 IonicContact NH2-OD1 2.81Å; R239-D593 PolarHBondContact NH2-OD1 3.5Å; R239-D593 IonicContact NH2-OD2 3.55Å; R239-D593 PolarHBondContact NH2-OD2 3.36Å; R239-D593 VanDerWaalsContact NH2-OD2 3.17Å
594	T	35.6	Very low	36	Very low	133 Å²	133	138.8 Å²	138.8	82%	0.816	71%	0.71	S	S	*	*			trans	-169.6	146.7	141.3	7.2	0	0	0	0	111.9
595	A	33.8	Very low	36.4	Very low	87 Å²	87	141.9 Å²	141.9	72%	0.719	72%	0.717	S	S	*	*			trans	-115.3	154.3	166.8	0	0	0	0	0	109.2
596	S	35.6	Very low	36.5	Very low	102 Å²	102	145.5 Å²	145.5	71%	0.713	73%	0.727	S	S	*	*				178.6	158.7	114.3	-97.1	0	0	0	0	113.2
597	E	33.5	Very low	37	Very low	135 Å²	135	147.4 Å²	147.4	63%	0.631	73%	0.733	S	S	*	*			trans	13.6	155.9	143.2	-63.2	-179.5	115.3	0	0	121.3	K244	K244-E597 IonicContact NZ-OE1 3.25Å; K244-E597 PolarHBondContact NZ-OE1 3.29Å; K244-E597 IonicContact NZ-OE2 3.83Å
598	S	29.6	Very low	37.1	Very low	93 Å²	93	146.9 Å²	146.9	65%	0.65	73%	0.729	S	S	*	*			cis	174.7	168.7	-22.6	62.2	0	0	0	0	106.1
599	S	34.1	Very low	37	Very low	82 Å²	82	146.1 Å²	146.1	57%	0.573	73%	0.732	S	S	*	*			trans	66.4	150.9	-175.6	-143	0	0	0	0	113.1
600	Y	37.9	Very low	36.7	Very low	214 Å²	214	146.7 Å²	146.7	84%	0.839	74%	0.743	S	S	*	*			cis	-119.9	128.9	12.1	-65.8	-95.2	0	0	0	108.9
601	Q	37.1	Very low	36.5	Very low	159 Å²	159	142.6 Å²	142.6	74%	0.743	74%	0.744	S	S	*	*				63.7	124.2	80.6	-81.4	-82.3	11.1	0	0	114.4
602	L	36.2	Very low	36.6	Very low	128 Å²	128	143.4 Å²	143.4	67%	0.67	75%	0.752	S	S	*	*			trans	72.7	96.5	149.9	-155.1	75.6	0	0	0	120.5
603	R	36.2	Very low	36.5	Very low	221 Å²	221	143.2 Å²	143.2	83%	0.834	75%	0.75	S	S	*	*				-154.5	144.2	103.9	-81.3	-138.8	175.2	-171.7	-0.6	111.4
604	R	37.6	Very low	36.6	Very low	203 Å²	203	145.9 Å²	145.9	77%	0.766	76%	0.764	S	S	*	*			trans	-101.1	151.6	177.5	-37.7	170.8	-165	128.4	-0.7	109.5
605	Y	40.2	Very low	36.5	Very low	220 Å²	220	147.2 Å²	147.2	86%	0.863	77%	0.766	S	S	*	*			trans	-138.8	151.1	136.3	-84.4	-72.9	0	0	0	109.6
606	K	38.8	Very low	36.3	Very low	194 Å²	194	147.7 Å²	147.7	84%	0.843	76%	0.764	S	S	*	*			trans	-101.8	172.1	-169.6	-80.5	-172.8	172.8	-174.6	0	112.4
607	K	41	Very low	36.1	Very low	203 Å²	203	148.2 Å²	148.2	88%	0.883	77%	0.768	S	S	*	*			trans	104.1	128.2	167.4	-61.7	172.1	179.5	-175.7	0	113.1
608	S	37.9	Very low	36.2	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	78%	0.776	S	S	*	*			cis	-152.9	155.1	-12.2	-76.3	0	0	0	0	109.7
609	P	35.7	Very low	36.5	Very low	130 Å²	130	148.8 Å²	148.8	84%	0.844	79%	0.787	S	S	*	*			trans	-98	134.6	178.4	35.6	-30.3	0	0	0	113.1
610	S	38.3	Very low	36.5	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	80%	0.798	S	S	*	*			trans	-157.5	102.2	167.1	57.7	0	0	0	0	112.9
611	S	38.2	Very low	36.7	Very low	102 Å²	102	146 Å²	146	71%	0.713	80%	0.795	S	S	*	*			trans	46.5	134.3	136.4	64.4	0	0	0	0	122.8
612	L	39.1	Very low	36.4	Very low	152 Å²	152	144.7 Å²	144.7	80%	0.796	80%	0.798	S	S	*	*			trans	105.6	132.6	149.6	-56.1	-171.9	0	0	0	120
613	T	37.8	Very low	36.1	Very low	132 Å²	132	143.9 Å²	143.9	81%	0.81	80%	0.803	S	S	*	*			trans	64.7	123.3	155	48.1	0	0	0	0	120.5
614	N	35.2	Very low	36.1	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	80%	0.804	S	S	*	*			trans	-58.5	137.2	158.8	-56.9	-65.2	0	0	0	110.8
615	L	33.4	Very low	36.2	Very low	162 Å²	162	135 Å²	135	85%	0.848	79%	0.793	S	S	*	*			trans	-174.3	136.5	137.9	-102.5	169.6	0	0	0	112
616	S	29.5	Very low	36	Very low	96 Å²	96	130.4 Å²	130.4	67%	0.671	79%	0.792	S	S	*	*			trans	49.2	112.5	146.3	-63.2	0	0	0	0	122.8
617	S	30.4	Very low	36	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	79%	0.793	S	S	*	*				80.6	145.7	119.8	-57.7	0	0	0	0	121.9
618	S	36.9	Very low	35.9	Very low	115 Å²	115	120.6 Å²	120.6	80%	0.804	78%	0.78	S	S	*	*			trans	74.1	94.7	158.1	-176.3	0	0	0	0	119.1
619	S	35.2	Very low	36	Very low	125 Å²	125	117.5 Å²	117.5	87%	0.874	77%	0.765	S	S	*	*				-178.3	146.9	98.5	46.9	0	0	0	0	111.4
620	G	33.5	Very low	36.4	Very low	78 Å²	78	112.3 Å²	112.3	80%	0.804	73%	0.732	S	S	*	*	S	Bend	trans	171.3	-57.4	176.2	0	0	0	0	0	116.6
621	M	42.3	Very low	37	Very low	160 Å²	160	109.7 Å²	109.7	79%	0.788	71%	0.711	S	S	*	*			trans	-126	100.2	-169.4	-63.7	-168.1	74.2	0	0	113.7
622	T	30.5	Very low	37.4	Very low	131 Å²	131	110.7 Å²	110.7	80%	0.804	71%	0.706	S	S	*	*			trans	-113.2	163.9	159.1	54.8	0	0	0	0	109.7
623	S	31.3	Very low	38	Very low	111 Å²	111	105 Å²	105	78%	0.776	68%	0.678	S	S	*	*	S	Bend	trans	81.6	18.6	166.7	-52.7	0	0	0	0	120.9
624	L	35.7	Very low	38.4	Very low	163 Å²	163	99.4 Å²	99.4	85%	0.853	65%	0.645	S	S	*	*	S	Bend	trans	-133.5	66.7	169.8	-71.4	177.3	0	0	0	114
625	S	39.2	Very low	39.2	Very low	75 Å²	75	97.1 Å²	97.1	52%	0.524	63%	0.625	S	S	.	*	S	Bend	trans	-170.6	-43.1	165.1	168.4	0	0	0	0	112.1	A627 S628	S625-A627 PolarHBondContact O-N 2.74Å; S625-S628 PolarHBondContact O-N 3.48Å
626	S	35.8	Very low	40.1	Very low	123 Å²	123	91.4 Å²	91.4	86%	0.86	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	4.8	-163.7	-45.4	0	0	0	0	117.1
627	A	38.8	Very low	40.9	Very low	104 Å²	104	89.3 Å²	89.3	86%	0.86	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-12.2	176.7	0	0	0	0	0	113.7	S625	S625-A627 PolarHBondContact O-N 2.74Å
628	S	39.6	Very low	41.9	Very low	87 Å²	87	88 Å²	88	61%	0.608	58%	0.576	S	S	*	*	S	Bend	trans	-79.9	150.5	175.8	-166.5	0	0	0	0	112.3	S625 S630	S625-S628 PolarHBondContact O-N 3.48Å; S628-S630 VanDerWaalsContact C-N 3.27Å; S628-S630 PolarHBondContact O-N 2.7Å
629	G	39.2	Very low	42.7	Very low	41 Å²	41	84.6 Å²	84.6	42%	0.423	55%	0.547	S	S	.	.			trans	-68.6	68.9	-175.8	0	0	0	0	0	114.8	V631	G629-V631 PolarHBondContact O-N 2.91Å
630	S	45.6	Very low	43.5	Very low	22 Å²	22	81 Å²	81	15%	0.154	53%	0.53	C	S	.	.	S	Bend	trans	60.4	25.9	136.3	-161.4	0	0	0	0	120.6	S628 Y688 K698	S628-S630 VanDerWaalsContact C-N 3.27Å; S628-S630 PolarHBondContact O-N 2.7Å; S630-Y688 WeakPolarHBondContact O-CE1 3.24Å; S630-K698 WeakPolarHBondContact OG-CD 3.28Å; S630-K698 VanDerWaalsContact OG-CG 3.23Å; S630-K698 WeakPolarHBondContact OG-CG 3.47Å; S630-K698 PolarHBondContact OG-NZ 2.89Å
631	V	49.4	Very low	44.7	Very low	52 Å²	52	85.7 Å²	85.7	32%	0.315	54%	0.537	S	S	.	.			trans	-98.9	-15.1	166.9	-64.8	0	0	0	0	114.4	G629 S633 V634 Y635	G629-V631 PolarHBondContact O-N 2.91Å; V631-S633 VanDerWaalsContact C-N 3.26Å; V631-S633 PolarHBondContact O-N 2.91Å; V631-V634 WeakPolarHBondContact O-CB 3.15Å; V631-V634 PolarHBondContact O-N 2.78Å; V631-Y635 HydrophobicContact CB-CD2 4.36Å; V631-Y635 HydrophobicContact CB-CE2 4.08Å; V631-Y635 HydrophobicContact CG2-CD2 4.5Å; V631-Y635 HydrophobicContact CG2-CE2 4.27Å; V631-Y635 WeakPolarHBondContact O-CD2 3.5Å
632	M	47.1	Very low	46.1	Very low	123 Å²	123	80.2 Å²	80.2	61%	0.606	51%	0.51	S	S	*	.	H	α-helix	trans	-58.3	-30.1	-171.6	-64.5	-162.9	79	0	0	115	V634 Y635 S636	M632-V634 PolarHBondContact O-N 3.22Å; M632-Y635 CarbonylContact O-C 3.52Å; M632-Y635 PolarHBondContact O-N 2.74Å; M632-S636 WeakPolarHBondContact O-CB 3.23Å; M632-S636 PolarHBondContact O-N 3.07Å; M632-S636 PolarHBondContact O-OG 3.25Å
633	S	51.3	Low	48.6	Very low	31 Å²	31	78 Å²	78	22%	0.217	49%	0.491	C	S	.	.	H	α-helix	trans	-74.2	-9.3	176.1	56.9	0	0	0	0	114.4	V631 Y688	V631-S633 VanDerWaalsContact C-N 3.26Å; V631-S633 PolarHBondContact O-N 2.91Å; S633-Y688 PolarHBondContact OG-OH 3.01Å
634	V	46.3	Very low	51.2	Low	16 Å²	16	73.5 Å²	73.5	10%	0.097	46%	0.459	C	S	.	.	H	α-helix	trans	-84	-25.3	170.7	-168.2	0	0	0	0	110.5	V631 M632 Y688 L690 K774	V631-V634 WeakPolarHBondContact O-CB 3.15Å; V631-V634 PolarHBondContact O-N 2.78Å; M632-V634 PolarHBondContact O-N 3.22Å; V634-Y688 HydrophobicContact CG2-CD1 4.3Å; V634-Y688 HydrophobicContact CG2-CD2 4.14Å; V634-Y688 HydrophobicContact CG2-CE1 4.32Å; V634-Y688 HydrophobicContact CG2-CE2 4.18Å; V634-Y688 HydrophobicContact CG2-CG 4.22Å; V634-L690 HydrophobicContact CG1-CD1 4.37Å; V634-K774 WeakPolarHBondContact O-CE 3.41Å
635	Y	52.4	Low	53.8	Low	110 Å²	110	71.2 Å²	71.2	43%	0.431	44%	0.442	S	S	.	.	H	α-helix	trans	-111.3	4.3	-177.1	-59	-80.9	0	0	0	114.5	V631 M632 G637	V631-Y635 HydrophobicContact CB-CD2 4.36Å; V631-Y635 HydrophobicContact CB-CE2 4.08Å; V631-Y635 HydrophobicContact CG2-CD2 4.5Å; V631-Y635 HydrophobicContact CG2-CE2 4.27Å; V631-Y635 WeakPolarHBondContact O-CD2 3.5Å; M632-Y635 CarbonylContact O-C 3.52Å; M632-Y635 PolarHBondContact O-N 2.74Å; Y635-G637 PolarHBondContact O-N 3.09Å; Y635-G637 VanDerWaalsContact O-N 3.15Å
636	S	52	Low	56.4	Low	43 Å²	43	68.8 Å²	68.8	30%	0.301	43%	0.429	S	S	.	.			trans	-84	86.6	-178.7	-65.1	0	0	0	0	111.1	M632 D638 F639	M632-S636 WeakPolarHBondContact O-CB 3.23Å; M632-S636 PolarHBondContact O-N 3.07Å; M632-S636 PolarHBondContact O-OG 3.25Å; S636-D638 PolarHBondContact O-N 2.8Å; S636-F639 WeakPolarHBondContact O-CE1 3.49Å; S636-F639 WeakPolarHBondContact O-CE2 3.29Å; S636-F639 WeakPolarHBondContact O-CZ 3.38Å
637	G	46.7	Very low	59.3	Low	52 Å²	52	64.1 Å²	64.1	54%	0.536	40%	0.396	S	S	.	.			trans	-55.2	-9.8	-173.6	0	0	0	0	0	117.5	Y635 F639	Y635-G637 PolarHBondContact O-N 3.09Å; Y635-G637 VanDerWaalsContact O-N 3.15Å; G637-F639 PolarHBondContact O-N 2.75Å
638	D	50.4	Low	62.1	Low	87 Å²	87	59.2 Å²	59.2	47%	0.465	36%	0.355	S	S	.	.			trans	-77.1	45	174.8	66.9	-55.2	0	0	0	113.7	S636 G640 R742	S636-D638 PolarHBondContact O-N 2.8Å; D638-G640 PolarHBondContact O-N 3.49Å; D638-R742 IonicContact OD2-CZ 2.74Å; D638-R742 IonicContact OD2-NH1 3.54Å; D638-R742 PolarHBondContact OD2-NH1 3.36Å
639	F	54.5	Low	64.9	Low	42 Å²	42	56.3 Å²	56.3	18%	0.184	33%	0.332	C	S	.	.			trans	-72.7	68.5	170.2	-49.8	-67.5	0	0	0	110	S636 G637 W735 F745 K774	S636-F639 WeakPolarHBondContact O-CE1 3.49Å; S636-F639 WeakPolarHBondContact O-CE2 3.29Å; S636-F639 WeakPolarHBondContact O-CZ 3.38Å; G637-F639 PolarHBondContact O-N 2.75Å; F639-W735 HydrophobicContact CD1-CH2 4.36Å; F639-W735 AromaticContact CE1-CH2 4Å; F639-W735 HydrophobicContact CE1-CH2 4Å; F639-F745 HydrophobicContact CB-CB 4.21Å; F639-F745 HydrophobicContact CD1-CB 3.92Å; F639-F745 HydrophobicContact CD1-CD2 4.24Å; F639-F745 HydrophobicContact CD1-CG 4.07Å; F639-F745 HydrophobicContact CG-CB 4.46Å; F639-K774 HydrophobicContact CD1-CD 4.35Å; F639-K774 HydrophobicContact CD2-CB 4.03Å; F639-K774 HydrophobicContact CD2-CD 4.06Å; F639-K774 HydrophobicContact CD2-CG 3.87Å; F639-K774 HydrophobicContact CE1-CD 3.82Å; F639-K774 HydrophobicContact CE2-CB 4.24Å; F639-K774 HydrophobicContact CE2-CD 3.49Å; F639-K774 VanDerWaalsContact CE2-CD 3.49Å; F639-K774 HydrophobicContact CE2-CG 3.57Å; F639-K774 HydrophobicContact CG-CB 4.39Å; F639-K774 HydrophobicContact CG-CD 4.47Å; F639-K774 HydrophobicContact CZ-CD 3.36Å; F639-K774 HydrophobicContact CZ-CG 4.02Å
640	G	52.7	Low	67.6	Low	51 Å²	51	54.5 Å²	54.5	53%	0.526	31%	0.312	S	S	.	.			trans	-50.6	145.8	-166	0	0	0	0	0	115.3	D638 L642	D638-G640 PolarHBondContact O-N 3.49Å; G640-L642 PolarHBondContact O-N 2.93Å
641	N	57.8	Low	69.9	Low	176 Å²	176	53.9 Å²	53.9	94%	0.941	31%	0.309	S	S	*	.	S	Bend	trans	-48	41.9	-154.4	-51.1	13.7	0	0	0	119.7
642	L	72.3	Confident	72	Confident	44 Å²	44	51.5 Å²	51.5	23%	0.23	29%	0.294	C	S	.	.			trans	-84	134.1	172.6	-170.9	67.4	0	0	0	110	G640 V644 A672 A674 L746	G640-L642 PolarHBondContact O-N 2.93Å; L642-V644 PolarHBondContact O-N 3.22Å; L642-A672 HydrophobicContact CD2-CB 3.81Å; L642-A672 HydrophobicContact CG-CB 4.02Å; L642-A674 HydrophobicContact CD2-CB 4.36Å; L642-L746 HydrophobicContact CD2-CD2 3.54Å
643	E	81.6	Confident	74.2	Confident	86 Å²	86	48.4 Å²	48.4	40%	0.402	28%	0.28	S	S	.	.			trans	-71.9	110.7	170.8	172.6	149.6	-99	0	0	110.6	K645 A672 R773	E643-K645 HydrophobicContact CG-CD 4.08Å; E643-K645 HydrophobicContact CG-CG 4.18Å; E643-K645 PolarHBondContact O-N 2.93Å; E643-K645 WeakPolarHBondContact OE2-CE 3.37Å; E643-K645 IonicContact OE2-NZ 2.64Å; E643-K645 PolarHBondContact OE2-NZ 3.35Å; E643-A672 WeakPolarHBondContact O-CB 2.9Å; E643-R773 IonicContact OE1-CZ 3.45Å; E643-R773 IonicContact OE1-NH1 3.26Å; E643-R773 PolarHBondContact OE1-NH1 2.86Å; E643-R773 IonicContact OE1-NH2 2.93Å; E643-R773 PolarHBondContact OE1-NH2 3.07Å
644	V	87.3	Confident	76.1	Confident	16 Å²	16	47.4 Å²	47.4	10%	0.097	27%	0.272	C	S	.	.			trans	-62.6	127.6	171.6	168.5	0	0	0	0	110.2	L642 F745 L746 L771 R773	L642-V644 PolarHBondContact O-N 3.22Å; V644-F745 HydrophobicContact CG2-CD1 4.05Å; V644-F745 HydrophobicContact CG2-CE1 3.94Å; V644-L746 WeakPolarHBondContact CG1-O 3.24Å; V644-L771 HydrophobicContact CG1-CB 3.92Å; V644-R773 HydrophobicContact CB-CG 3.78Å; V644-R773 HydrophobicContact CG2-CG 4.03Å
645	K	90	Very high	78.3	Confident	115 Å²	115	48.2 Å²	48.2	50%	0.5	28%	0.277	S	S	.	.			trans	-144.8	157	179.4	-88.3	166.4	171	158.5	0	109.4	E643 D670 L671 A672	E643-K645 HydrophobicContact CG-CD 4.08Å; E643-K645 HydrophobicContact CG-CG 4.18Å; E643-K645 PolarHBondContact O-N 2.93Å; E643-K645 WeakPolarHBondContact OE2-CE 3.37Å; E643-K645 IonicContact OE2-NZ 2.64Å; E643-K645 PolarHBondContact OE2-NZ 3.35Å; K645-D670 CarbonylContact C-O 3.58Å; K645-L671 WeakPolarHBondContact O-CA 3.06Å; K645-A672 PolarHBondContact O-N 2.97Å
646	G	94.5	Very high	80.1	Confident	24 Å²	24	47 Å²	47	25%	0.247	28%	0.275	C	S	.	.			trans	100.3	-175.6	175.3	0	0	0	0	0	114.9	K669 D670 L771	G646-K669 CarbonylContact C-O 3.49Å; G646-K669 WeakPolarHBondContact CA-O 3.48Å; G646-D670 WeakPolarHBondContact CA-O 3.28Å; G646-D670 PolarHBondContact N-O 3.45Å; G646-L771 WeakPolarHBondContact O-CB 3.13Å; G646-L771 PolarHBondContact O-N 2.94Å
647	S	97	Very high	82.1	Confident	25 Å²	25	50.3 Å²	50.3	18%	0.175	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	161.5	-177.9	60.7	0	0	0	0	111.2	C668 K669 W768 Y769	S647-C668 CarbonylContact O-C 3.5Å; S647-C668 WeakPolarHBondContact O-CA 3.19Å; S647-C668 VanDerWaalsContact O-CB 3.28Å; S647-C668 WeakPolarHBondContact O-CB 3.38Å; S647-K669 PolarHBondContact N-O 3.3Å; S647-K669 PolarHBondContact O-N 3.25Å; S647-W768 WeakPolarHBondContact OG-CZ3 3.43Å; S647-Y769 CarbonylContact C-O 3.53Å; S647-Y769 WeakPolarHBondContact CA-O 3.32Å; S647-Y769 VanDerWaalsContact CB-O 3.29Å; S647-Y769 WeakPolarHBondContact CB-O 3.24Å
648	V	97.5	Very high	84.2	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.6	176.1	58.4	0	0	0	0	110.1	F650 L732 V749 Y769 L771	V648-F650 HydrophobicContact CG1-CD1 4.09Å; V648-F650 HydrophobicContact CG1-CE1 4.09Å; V648-F650 HydrophobicContact CG2-CD1 4.22Å; V648-L732 HydrophobicContact CG1-CD2 3.99Å; V648-L732 HydrophobicContact CG2-CD2 4.14Å; V648-V749 HydrophobicContact CG1-CG2 3.63Å; V648-Y769 PolarHBondContact N-O 2.87Å; V648-Y769 PolarHBondContact O-N 2.91Å; V648-L771 HydrophobicContact CB-CD2 4.21Å; V648-L771 HydrophobicContact CG1-CD2 3.72Å
649	Q	97.2	Very high	86.2	Confident	27 Å²	27	52.8 Å²	52.8	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.7	176.3	-157.3	-178.8	13	0	0	109.6	A666 Q667 L766 K767 W768	Q649-A666 PolarHBondContact O-N 3.47Å; Q649-Q667 HydrophobicContact CB-CG 4Å; Q649-Q667 PolarHBondContact N-O 2.98Å; Q649-Q667 PolarHBondContact O-N 2.66Å; Q649-L766 HydrophobicContact CG-CB 4.03Å; Q649-L766 HydrophobicContact CG-CD2 4.45Å; Q649-L766 PolarHBondContact NE2-O 2.86Å; Q649-K767 WeakPolarHBondContact CA-O 3.3Å; Q649-W768 HydrophobicContact CB-CD2 3.72Å; Q649-W768 HydrophobicContact CB-CE3 3.69Å; Q649-W768 HydrophobicContact CB-CG 4.39Å; Q649-W768 HydrophobicContact CB-CH2 3.96Å; Q649-W768 HydrophobicContact CB-CZ2 3.98Å; Q649-W768 HydrophobicContact CB-CZ3 3.82Å; Q649-W768 VanDerWaalsContact CD-CE2 3.48Å; Q649-W768 HydrophobicContact CG-CD2 3.84Å; Q649-W768 HydrophobicContact CG-CE3 4.34Å; Q649-W768 HydrophobicContact CG-CG 4.09Å; Q649-W768 HydrophobicContact CG-CZ2 4.24Å
650	F	96.4	Very high	88	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.009	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165.9	176.3	67.5	-86.6	0	0	0	111.8	V648 L652 V663 F664 L730 L732 V749 L751 K767 Y769	V648-F650 HydrophobicContact CG1-CD1 4.09Å; V648-F650 HydrophobicContact CG1-CE1 4.09Å; V648-F650 HydrophobicContact CG2-CD1 4.22Å; F650-L652 HydrophobicContact CD2-CD2 4.04Å; F650-L652 HydrophobicContact CD2-CG 4.36Å; F650-L652 HydrophobicContact CE2-CD2 4.03Å; F650-L652 HydrophobicContact CE2-CG 4.19Å; F650-V663 HydrophobicContact CD2-CG1 4.35Å; F650-F664 CarbonylContact C-O 3.48Å; F650-F664 WeakPolarHBondContact CA-O 3.5Å; F650-F664 WeakPolarHBondContact CB-O 3.42Å; F650-L730 HydrophobicContact CE2-CD2 4.27Å; F650-L732 HydrophobicContact CD1-CD1 3.78Å; F650-L732 HydrophobicContact CD2-CD1 4.2Å; F650-L732 HydrophobicContact CE1-CD1 3.85Å; F650-L732 HydrophobicContact CE2-CD1 4.27Å; F650-L732 HydrophobicContact CG-CD1 3.95Å; F650-L732 HydrophobicContact CZ-CD1 4.09Å; F650-V749 HydrophobicContact CE1-CG1 4.34Å; F650-V749 HydrophobicContact CZ-CG1 4.31Å; F650-L751 HydrophobicContact CE2-CD1 3.62Å; F650-L751 HydrophobicContact CZ-CD1 3.54Å; F650-L751 HydrophobicContact CZ-CG 4.31Å; F650-K767 PolarHBondContact N-O 2.8Å; F650-K767 VanDerWaalsContact N-O 3.12Å; F650-K767 PolarHBondContact O-N 2.86Å; F650-K767 VanDerWaalsContact O-N 3.08Å; F650-Y769 AromaticContact CD1-CD2 3.66Å; F650-Y769 HydrophobicContact CD1-CD2 3.66Å; F650-Y769 HydrophobicContact CD1-CE2 4.09Å; F650-Y769 AromaticContact CE1-CD2 3.21Å; F650-Y769 HydrophobicContact CE1-CD2 3.21Å; F650-Y769 AromaticContact CE1-CE2 3.7Å; F650-Y769 HydrophobicContact CE1-CE2 3.7Å; F650-Y769 AromaticContact CE1-CG 3.74Å; F650-Y769 HydrophobicContact CE1-CG 3.74Å; F650-Y769 HydrophobicContact CE2-CD2 4.49Å; F650-Y769 HydrophobicContact CE2-CE2 4.16Å; F650-Y769 HydrophobicContact CG-CD2 4.47Å; F650-Y769 HydrophobicContact CG-CE2 4.5Å; F650-Y769 AromaticContact CZ-CD2 3.7Å; F650-Y769 HydrophobicContact CZ-CD2 3.7Å; F650-Y769 AromaticContact CZ-CE2 3.74Å; F650-Y769 HydrophobicContact CZ-CE2 3.74Å; F650-Y769 HydrophobicContact CZ-CG 4.19Å
651	A	94	Very high	89.9	Confident	10 Å²	10	49.1 Å²	49.1	8%	0.083	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.5	172.6	0	0	0	0	0	109.9	F664 Q765 L766	A651-F664 PolarHBondContact N-O 3.32Å; A651-F664 PolarHBondContact O-N 3.04Å; A651-Q765 WeakPolarHBondContact CB-O 3.47Å; A651-L766 HydrophobicContact CB-CD2 4.12Å
652	L	94	Very high	91.7	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.9	173.2	-57.7	-176.8	0	0	0	109	F650 V663 L730 L751 L753 W756	F650-L652 HydrophobicContact CD2-CD2 4.04Å; F650-L652 HydrophobicContact CD2-CG 4.36Å; F650-L652 HydrophobicContact CE2-CD2 4.03Å; F650-L652 HydrophobicContact CE2-CG 4.19Å; L652-V663 HydrophobicContact CD2-CB 4.1Å; L652-V663 HydrophobicContact CD2-CG1 3.79Å; L652-V663 HydrophobicContact CD2-CG2 3.79Å; L652-L730 HydrophobicContact CD1-CD2 4Å; L652-L730 HydrophobicContact CD2-CD2 3.51Å; L652-L730 HydrophobicContact CG-CD2 4.4Å; L652-L751 HydrophobicContact CD1-CD1 4Å; L652-L753 HydrophobicContact CD1-CD2 3.99Å; L652-W756 HydrophobicContact CB-CZ2 3.8Å; L652-W756 HydrophobicContact CD1-CD2 4.01Å; L652-W756 HydrophobicContact CD1-CE3 4.21Å; L652-W756 HydrophobicContact CD1-CH2 4.03Å; L652-W756 HydrophobicContact CD1-CZ2 3.8Å; L652-W756 HydrophobicContact CD1-CZ3 4.23Å; L652-W756 HydrophobicContact CG-CH2 4.32Å; L652-W756 HydrophobicContact CG-CZ2 3.96Å
653	D	91.5	Very high	92.8	Very high	58 Å²	58	39.9 Å²	39.9	31%	0.31	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.6	168.1	-171.6	34.2	0	0	0	110.1	H662 K764	D653-H662 PolarHBondContact N-O 2.75Å; D653-H662 VanDerWaalsContact N-O 3.11Å; D653-H662 PolarHBondContact O-N 3.1Å; D653-K764 WeakPolarHBondContact OD1-CE 3.47Å; D653-K764 IonicContact OD1-NZ 2.72Å; D653-K764 PolarHBondContact OD1-NZ 2.87Å
654	Y	92.2	Very high	93.5	Very high	10 Å²	10	38.7 Å²	38.7	4%	0.039	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.9	-179.7	176.1	-99.5	0	0	0	110.3	E656 E660 L661 I720 R722 L725	Y654-E656 HydrophobicContact CE1-CB 4.37Å; Y654-E656 VanDerWaalsContact CE1-CD 3.48Å; Y654-E656 VanDerWaalsContact CE1-OE1 3.24Å; Y654-E656 WeakPolarHBondContact CE1-OE1 3.02Å; Y654-E656 WeakPolarHBondContact CE1-OE2 3.25Å; Y654-E656 PolarHBondContact O-N 3.47Å; Y654-E656 PolarHBondContact OH-OE1 2.99Å; Y654-E656 VanDerWaalsContact OH-OE1 3.09Å; Y654-E660 VanDerWaalsContact CD2-C 3.5Å; Y654-E660 WeakPolarHBondContact CD2-O 3.42Å; Y654-L661 HydrophobicContact CD2-CB 4.26Å; Y654-I720 VanDerWaalsContact CE2-O 3.29Å; Y654-I720 WeakPolarHBondContact CE2-O 3.33Å; Y654-R722 HydrophobicContact CD1-CB 4.33Å; Y654-R722 HydrophobicContact CD1-CG 4.2Å; Y654-R722 HydrophobicContact CE1-CB 3.61Å; Y654-R722 HydrophobicContact CE1-CG 3.96Å; Y654-R722 PolarHBondContact OH-N 3.27Å; Y654-L725 HydrophobicContact CD2-CD1 3.64Å; Y654-L725 HydrophobicContact CE2-CD1 4.06Å; Y654-L725 HydrophobicContact CG-CD1 3.96Å
655	V	91.8	Very high	94	Very high	33 Å²	33	37.9 Å²	37.9	20%	0.2	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	91.6	-172.3	-174.1	0	0	0	0	108.8	S657 L658 K659 E660	V655-S657 VanDerWaalsContact C-N 3.31Å; V655-S657 PolarHBondContact O-N 3.09Å; V655-L658 HydrophobicContact CB-CB 4.48Å; V655-L658 HydrophobicContact CG1-CB 4.11Å; V655-L658 HydrophobicContact CG1-CD1 3.94Å; V655-L658 HydrophobicContact CG1-CG 3.83Å; V655-L658 PolarHBondContact O-N 2.73Å; V655-K659 PolarHBondContact O-N 3.36Å; V655-K659 VanDerWaalsContact O-N 3.08Å; V655-E660 PolarHBondContact N-O 3.02Å; V655-E660 PolarHBondContact O-N 2.88Å
656	E	90.9	Very high	94.3	Very high	86 Å²	86	32.5 Å²	32.5	40%	0.402	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-53.4	-44.6	-174.9	-162	69.4	-101.3	0	0	112.8	Y654 L658 K659 R722	Y654-E656 HydrophobicContact CE1-CB 4.37Å; Y654-E656 VanDerWaalsContact CE1-CD 3.48Å; Y654-E656 VanDerWaalsContact CE1-OE1 3.24Å; Y654-E656 WeakPolarHBondContact CE1-OE1 3.02Å; Y654-E656 WeakPolarHBondContact CE1-OE2 3.25Å; Y654-E656 PolarHBondContact O-N 3.47Å; Y654-E656 PolarHBondContact OH-OE1 2.99Å; Y654-E656 VanDerWaalsContact OH-OE1 3.09Å; E656-L658 PolarHBondContact O-N 2.88Å; E656-L658 VanDerWaalsContact O-N 3.09Å; E656-K659 PolarHBondContact O-N 3.12Å; E656-R722 IonicContact OE2-CZ 2.7Å; E656-R722 VanDerWaalsContact OE2-CZ 3.24Å; E656-R722 IonicContact OE2-NE 2.7Å; E656-R722 PolarHBondContact OE2-NE 3.18Å; E656-R722 IonicContact OE2-NH2 3.4Å; E656-R722 PolarHBondContact OE2-NH2 3.44Å
657	S	93.1	Very high	94.5	Very high	111 Å²	111	34.4 Å²	34.4	78%	0.776	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-62.2	-18.1	-179.7	56.5	0	0	0	0	114.4	V655	V655-S657 VanDerWaalsContact C-N 3.31Å; V655-S657 PolarHBondContact O-N 3.09Å
658	L	92.4	Very high	94.5	Very high	88 Å²	88	33.4 Å²	33.4	46%	0.461	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-110.5	-7.6	177	-59	-176.5	0	0	0	113.1	V655 E656 E660	V655-L658 HydrophobicContact CB-CB 4.48Å; V655-L658 HydrophobicContact CG1-CB 4.11Å; V655-L658 HydrophobicContact CG1-CD1 3.94Å; V655-L658 HydrophobicContact CG1-CG 3.83Å; V655-L658 PolarHBondContact O-N 2.73Å; E656-L658 PolarHBondContact O-N 2.88Å; E656-L658 VanDerWaalsContact O-N 3.09Å; L658-E660 VanDerWaalsContact C-N 3.32Å; L658-E660 HydrophobicContact CB-CB 4.22Å; L658-E660 HydrophobicContact CB-CG 4.24Å; L658-E660 PolarHBondContact O-N 2.93Å
659	K	92	Very high	94.5	Very high	104 Å²	104	38 Å²	38	45%	0.452	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	55.1	-166.5	-60.5	-174	176.9	-172.3	0	111.2	V655 E656 I720 E721	V655-K659 PolarHBondContact O-N 3.36Å; V655-K659 VanDerWaalsContact O-N 3.08Å; E656-K659 PolarHBondContact O-N 3.12Å; K659-I720 CarbonylContact C-O 3.3Å; K659-I720 VanDerWaalsContact C-O 3.26Å; K659-I720 PolarHBondContact O-N 3.18Å; K659-I720 VanDerWaalsContact O-N 3.14Å; K659-E721 HydrophobicContact CD-CG 4.15Å; K659-E721 WeakPolarHBondContact CE-OE1 3.36Å; K659-E721 IonicContact NZ-OE1 3.53Å; K659-E721 PolarHBondContact NZ-OE1 3.09Å
660	E	93	Very high	94.4	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.1	-177.4	-79.3	-176.7	173	0	0	113.9	Y654 V655 L658 H662 R717 Y718 K719	Y654-E660 VanDerWaalsContact CD2-C 3.5Å; Y654-E660 WeakPolarHBondContact CD2-O 3.42Å; V655-E660 PolarHBondContact N-O 3.02Å; V655-E660 PolarHBondContact O-N 2.88Å; L658-E660 VanDerWaalsContact C-N 3.32Å; L658-E660 HydrophobicContact CB-CB 4.22Å; L658-E660 HydrophobicContact CB-CG 4.24Å; L658-E660 PolarHBondContact O-N 2.93Å; E660-H662 PolarHBondContact O-CD2 3.19Å; E660-H662 IonicContact OE2-CD2 2.66Å; E660-H662 IonicContact OE2-CE1 2.76Å; E660-H662 IonicContact OE2-NE2 2.78Å; E660-H662 PolarHBondContact OE2-NE2 2.89Å; E660-R717 IonicContact OE1-NH2 3.48Å; E660-R717 IonicContact OE2-CZ 3.66Å; E660-R717 IonicContact OE2-NE 2.66Å; E660-R717 PolarHBondContact OE2-NE 2.82Å; E660-R717 IonicContact OE2-NH2 2.7Å; E660-R717 PolarHBondContact OE2-NH2 3.48Å; E660-Y718 CarbonylContact C-O 3.49Å; E660-Y718 WeakPolarHBondContact CA-O 3.3Å; E660-K719 HydrophobicContact CG-CB 4.47Å; E660-K719 HydrophobicContact CG-CG 3.7Å; E660-K719 WeakPolarHBondContact OE1-CE 3.16Å; E660-K719 WeakPolarHBondContact OE1-CG 3.46Å
661	L	92.6	Very high	94.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	128.7	161.5	174.6	69.9	0	0	0	109.6	Y654 V663 L689 Y718 I720 L725 L753 W758	Y654-L661 HydrophobicContact CD2-CB 4.26Å; L661-V663 HydrophobicContact CD2-CG2 4.34Å; L661-V663 HydrophobicContact CG-CG2 4.31Å; L661-L689 HydrophobicContact CD2-CD1 4.19Å; L661-L689 HydrophobicContact CD2-CD2 3.91Å; L661-Y718 HydrophobicContact CD2-CD2 4.34Å; L661-Y718 PolarHBondContact N-O 3.19Å; L661-Y718 PolarHBondContact O-N 2.73Å; L661-I720 HydrophobicContact CB-CG2 3.92Å; L661-L725 HydrophobicContact CB-CD2 4.23Å; L661-L725 HydrophobicContact CD2-CD2 4.01Å; L661-L753 HydrophobicContact CD2-CD1 4.06Å; L661-W758 HydrophobicContact CD1-CH2 3.54Å; L661-W758 HydrophobicContact CD1-CZ3 3.56Å
662	H	94.6	Very high	94.2	Very high	25 Å²	25	40.4 Å²	40.4	12%	0.116	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	113.5	178.9	-75.4	-135.2	0	0	0	108.7	D653 E660 I715 R717	D653-H662 PolarHBondContact N-O 2.75Å; D653-H662 VanDerWaalsContact N-O 3.11Å; D653-H662 PolarHBondContact O-N 3.1Å; E660-H662 PolarHBondContact O-CD2 3.19Å; E660-H662 IonicContact OE2-CD2 2.66Å; E660-H662 IonicContact OE2-CE1 2.76Å; E660-H662 IonicContact OE2-NE2 2.78Å; E660-H662 PolarHBondContact OE2-NE2 2.89Å; H662-I715 HydrophobicContact CB-CG2 3.75Å; H662-R717 PolarHBondContact CE1-NE 2.82Å; H662-R717 VanDerWaalsContact CE1-NE 3.31Å; H662-R717 PolarHBondContact NE2-NE 3.47Å
663	V	95.2	Very high	94.1	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	101.9	174.9	-174.1	0	0	0	0	108.3	F650 L652 L661 V665 T687 L716 Y718 L730 L732	F650-V663 HydrophobicContact CD2-CG1 4.35Å; L652-V663 HydrophobicContact CD2-CB 4.1Å; L652-V663 HydrophobicContact CD2-CG1 3.79Å; L652-V663 HydrophobicContact CD2-CG2 3.79Å; L661-V663 HydrophobicContact CD2-CG2 4.34Å; L661-V663 HydrophobicContact CG-CG2 4.31Å; V663-V665 HydrophobicContact CG1-CG2 4.27Å; V663-V665 PolarHBondContact O-N 3.06Å; V663-T687 HydrophobicContact CG1-CG2 4.27Å; V663-L716 HydrophobicContact CB-CB 4.33Å; V663-L716 PolarHBondContact N-O 3.19Å; V663-L716 PolarHBondContact O-N 2.9Å; V663-Y718 HydrophobicContact CG2-CD2 3.99Å; V663-Y718 HydrophobicContact CG2-CE2 3.95Å; V663-L730 HydrophobicContact CG1-CD2 4.23Å; V663-L730 HydrophobicContact CG2-CD1 4.13Å; V663-L730 HydrophobicContact CG2-CD2 4.09Å; V663-L732 HydrophobicContact CG1-CD1 4.4Å
664	F	96.5	Very high	93.9	Very high	61 Å²	61	39.5 Å²	39.5	27%	0.268	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	105.2	-179.8	176.9	-130.7	0	0	0	110.6	F650 A651 A666 N713 I715 L766	F650-F664 CarbonylContact C-O 3.48Å; F650-F664 WeakPolarHBondContact CA-O 3.5Å; F650-F664 WeakPolarHBondContact CB-O 3.42Å; A651-F664 PolarHBondContact N-O 3.32Å; A651-F664 PolarHBondContact O-N 3.04Å; F664-A666 HydrophobicContact CE1-CB 4.39Å; F664-A666 HydrophobicContact CZ-CB 4.49Å; F664-N713 HydrophobicContact CE2-CB 4.2Å; F664-N713 HydrophobicContact CZ-CB 4.36Å; F664-I715 HydrophobicContact CB-CG1 4.26Å; F664-I715 HydrophobicContact CD2-CG1 3.62Å; F664-I715 HydrophobicContact CE2-CG1 4.41Å; F664-I715 HydrophobicContact CG-CG1 4.28Å; F664-L766 HydrophobicContact CD1-CD2 3.7Å; F664-L766 HydrophobicContact CD1-CG 4.41Å; F664-L766 HydrophobicContact CE1-CD1 4.11Å; F664-L766 HydrophobicContact CE1-CD2 3.8Å; F664-L766 HydrophobicContact CE1-CG 4.26Å
665	V	97.3	Very high	93.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	106.2	178.4	-175.8	0	0	0	0	108.6	V663 V685 T701 Y712 N713 E714 L716 L732	V663-V665 HydrophobicContact CG1-CG2 4.27Å; V663-V665 PolarHBondContact O-N 3.06Å; V665-V685 HydrophobicContact CG1-CB 4.3Å; V665-V685 HydrophobicContact CG1-CG1 4.46Å; V665-V685 HydrophobicContact CG1-CG2 3.92Å; V665-V685 HydrophobicContact CG2-CG1 4.43Å; V665-T701 HydrophobicContact CB-CG2 4.15Å; V665-T701 HydrophobicContact CG1-CG2 4.16Å; V665-T701 HydrophobicContact CG2-CG2 4.42Å; V665-Y712 HydrophobicContact CG1-CD2 3.86Å; V665-Y712 HydrophobicContact CG1-CE2 4.4Å; V665-Y712 HydrophobicContact CG1-CG 4.47Å; V665-N713 WeakPolarHBondContact O-CA 3.29Å; V665-N713 PolarHBondContact O-N 3.33Å; V665-N713 VanDerWaalsContact O-N 3.12Å; V665-E714 PolarHBondContact N-O 3.31Å; V665-E714 PolarHBondContact O-N 3.12Å; V665-L716 HydrophobicContact CG2-CD1 4.1Å; V665-L716 HydrophobicContact CG2-CG 4.45Å; V665-L732 HydrophobicContact CG2-CD1 4.35Å
666	A	97.2	Very high	92.9	Very high	2 Å²	2	44.4 Å²	44.4	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-65.7	179.5	0	0	0	0	0	111.1	Q649 F664 Y712 N713 L766	Q649-A666 PolarHBondContact O-N 3.47Å; F664-A666 HydrophobicContact CE1-CB 4.39Å; F664-A666 HydrophobicContact CZ-CB 4.49Å; A666-Y712 PolarHBondContact O-N 2.84Å; A666-N713 WeakPolarHBondContact CA-OD1 3.1Å; A666-N713 PolarHBondContact O-N 2.85Å; A666-N713 PolarHBondContact O-OD1 3.38Å; A666-L766 HydrophobicContact CB-CD1 4.13Å; A666-L766 HydrophobicContact CB-CD2 3.64Å
667	Q	97.7	Very high	92.5	Very high	64 Å²	64	49.9 Å²	49.9	30%	0.299	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	166.8	-170.4	57	-177.2	-3	0	0	112.9	Q649 P710 V711 W768	Q649-Q667 HydrophobicContact CB-CG 4Å; Q649-Q667 PolarHBondContact N-O 2.98Å; Q649-Q667 PolarHBondContact O-N 2.66Å; Q667-P710 CarbonylContact C-O 3.26Å; Q667-P710 WeakPolarHBondContact CA-O 3.3Å; Q667-P710 VanDerWaalsContact CB-O 3.3Å; Q667-P710 WeakPolarHBondContact CB-O 3.17Å; Q667-V711 HydrophobicContact CB-CB 4.42Å; Q667-V711 HydrophobicContact CB-CG1 4.5Å; Q667-V711 HydrophobicContact CB-CG2 4.09Å; Q667-W768 HydrophobicContact CG-CH2 3.84Å; Q667-W768 HydrophobicContact CG-CZ2 4.3Å
668	C	97.9	Very high	92.1	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.02	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	157.1	163.2	-51.5	0	0	0	0	110.5	S647 L671 N709 P710	S647-C668 CarbonylContact O-C 3.5Å; S647-C668 WeakPolarHBondContact O-CA 3.19Å; S647-C668 VanDerWaalsContact O-CB 3.28Å; S647-C668 WeakPolarHBondContact O-CB 3.38Å; C668-L671 HydrophobicContact CB-CD1 3.84Å; C668-L671 HydrophobicContact CB-CD2 3.76Å; C668-L671 HydrophobicContact CB-CG 3.81Å; C668-N709 CarbonylContact O-C 3.48Å; C668-N709 WeakPolarHBondContact O-CA 3.44Å; C668-P710 HydrophobicContact CB-CG 3.75Å; C668-P710 PolarHBondContact N-O 3.07Å
669	K	96.5	Very high	91.9	Very high	96 Å²	96	52.1 Å²	52.1	42%	0.417	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.1	176.2	-159.6	-168.9	176	-68.9	0	110.8	G646 S647 L671 N709 W768	G646-K669 CarbonylContact C-O 3.49Å; G646-K669 WeakPolarHBondContact CA-O 3.48Å; S647-K669 PolarHBondContact N-O 3.3Å; S647-K669 PolarHBondContact O-N 3.25Å; K669-L671 VanDerWaalsContact C-N 3.26Å; K669-L671 PolarHBondContact O-N 3.32Å; K669-N709 VanDerWaalsContact CA-OD1 3.26Å; K669-N709 WeakPolarHBondContact CA-OD1 3.31Å; K669-N709 WeakPolarHBondContact CG-OD1 3.31Å; K669-W768 HydrophobicContact CB-CH2 3.79Å; K669-W768 HydrophobicContact CB-CZ3 3.73Å
670	D	95.2	Very high	91.7	Very high	81 Å²	81	53.4 Å²	53.4	43%	0.433	26%	0.256	S	S	.	.	S	Bend	trans	51.8	36.6	171.5	-46.7	-41	0	0	0	114.7	K645 G646 N709	K645-D670 CarbonylContact C-O 3.58Å; G646-D670 WeakPolarHBondContact CA-O 3.28Å; G646-D670 PolarHBondContact N-O 3.45Å; D670-N709 PolarHBondContact N-OD1 3.03Å
671	L	95.7	Very high	91.8	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	25%	0.252	C	S	.	.			trans	-60.7	150.1	-179.6	-66.4	-177.9	0	0	0	112.6	K645 C668 K669 A673 P683 L708 P710 V734 L746 L771	K645-L671 WeakPolarHBondContact O-CA 3.06Å; C668-L671 HydrophobicContact CB-CD1 3.84Å; C668-L671 HydrophobicContact CB-CD2 3.76Å; C668-L671 HydrophobicContact CB-CG 3.81Å; K669-L671 VanDerWaalsContact C-N 3.26Å; K669-L671 PolarHBondContact O-N 3.32Å; L671-A673 PolarHBondContact O-N 3.34Å; L671-P683 HydrophobicContact CD1-CB 3.59Å; L671-P683 HydrophobicContact CD1-CG 3.96Å; L671-L708 HydrophobicContact CB-CB 4.4Å; L671-L708 VanDerWaalsContact CB-O 3.29Å; L671-L708 WeakPolarHBondContact CB-O 3.2Å; L671-L708 VanDerWaalsContact CG-O 3.3Å; L671-L708 WeakPolarHBondContact CG-O 3.4Å; L671-L708 PolarHBondContact N-O 3.24Å; L671-P710 HydrophobicContact CD1-CG 3.72Å; L671-V734 HydrophobicContact CD1-CG1 3.98Å; L671-V734 HydrophobicContact CD2-CG1 4.15Å; L671-L746 HydrophobicContact CD1-CD1 4.32Å; L671-L771 HydrophobicContact CD2-CD1 3.27Å
672	A	92.2	Very high	91.9	Very high	6 Å²	6	54.1 Å²	54.1	5%	0.05	26%	0.26	C	S	.	.			trans	-57.3	136.3	171.1	0	0	0	0	0	112.8	L642 E643 K645 A674 S681 L746	L642-A672 HydrophobicContact CD2-CB 3.81Å; L642-A672 HydrophobicContact CG-CB 4.02Å; E643-A672 WeakPolarHBondContact O-CB 2.9Å; K645-A672 PolarHBondContact O-N 2.97Å; A672-A674 PolarHBondContact O-N 2.69Å; A672-S681 PolarHBondContact O-OG 2.89Å; A672-L746 HydrophobicContact CB-CD2 4.31Å
673	A	91.5	Very high	92	Very high	12 Å²	12	52.9 Å²	52.9	10%	0.099	25%	0.254	C	S	.	.			trans	-86	107.2	178.2	0	0	0	0	0	111.6	L671 L708	L671-A673 PolarHBondContact O-N 3.34Å; A673-L708 HydrophobicContact CB-CD1 4.19Å; A673-L708 HydrophobicContact CB-CD2 3.91Å
674	A	86.1	Confident	92.1	Very high	28 Å²	28	53.5 Å²	53.5	23%	0.231	26%	0.257	C	S	.	.	S	Bend	trans	-73.4	-32.9	-179.8	0	0	0	0	0	113	L642 A672 V676 R680 S681 H736 L746	L642-A674 HydrophobicContact CD2-CB 4.36Å; A672-A674 PolarHBondContact O-N 2.69Å; A674-V676 PolarHBondContact O-N 3.29Å; A674-R680 PolarHBondContact N-O 3.28Å; A674-S681 PolarHBondContact N-OG 2.84Å; A674-H736 HydrophobicContact CB-CB 3.87Å; A674-H736 WeakPolarHBondContact CB-CD2 3.09Å; A674-L746 HydrophobicContact CB-CD2 4.43Å
675	D	84.3	Confident	92.1	Very high	48 Å²	48	50.6 Å²	50.6	26%	0.257	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-92.5	87.7	163	-172.1	-16.4	0	0	0	109.1	K677 K678 Q679 R680	D675-K677 PolarHBondContact O-N 2.85Å; D675-K677 WeakPolarHBondContact OD1-CB 3.48Å; D675-K677 PolarHBondContact OD1-N 2.81Å; D675-K677 VanDerWaalsContact OD1-N 3.08Å; D675-K678 HydrophobicContact CB-CB 4.37Å; D675-K678 PolarHBondContact O-N 3.39Å; D675-K678 PolarHBondContact OD1-N 2.83Å; D675-K678 WeakPolarHBondContact OD2-CD 3.42Å; D675-K678 VanDerWaalsContact OD2-CG 3.29Å; D675-K678 WeakPolarHBondContact OD2-CG 3.33Å; D675-K678 IonicContact OD2-NZ 2.83Å; D675-K678 PolarHBondContact OD2-NZ 3.31Å; D675-Q679 PolarHBondContact O-N 3.45Å; D675-R680 PolarHBondContact N-O 3.35Å; D675-R680 PolarHBondContact O-N 3.19Å
676	V	80.3	Confident	92	Very high	97 Å²	97	51.6 Å²	51.6	59%	0.588	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.5	178.2	-177.2	0	0	0	0	112.1	A674 Q679	A674-V676 PolarHBondContact O-N 3.29Å; V676-Q679 PolarHBondContact O-NE2 3.19Å
677	K	81.2	Confident	91.9	Very high	202 Å²	202	51.5 Å²	51.5	88%	0.878	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.8	179	-63.8	-169	175.9	-168.9	0	112.7	D675	D675-K677 PolarHBondContact O-N 2.85Å; D675-K677 WeakPolarHBondContact OD1-CB 3.48Å; D675-K677 PolarHBondContact OD1-N 2.81Å; D675-K677 VanDerWaalsContact OD1-N 3.08Å
678	K	85.7	Confident	91.6	Very high	136 Å²	136	48.7 Å²	48.7	59%	0.591	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-10.1	-179.7	-58.4	-166.1	-166.7	92.3	0	114	D675 R680	D675-K678 HydrophobicContact CB-CB 4.37Å; D675-K678 PolarHBondContact O-N 3.39Å; D675-K678 PolarHBondContact OD1-N 2.83Å; D675-K678 WeakPolarHBondContact OD2-CD 3.42Å; D675-K678 VanDerWaalsContact OD2-CG 3.29Å; D675-K678 WeakPolarHBondContact OD2-CG 3.33Å; D675-K678 IonicContact OD2-NZ 2.83Å; D675-K678 PolarHBondContact OD2-NZ 3.31Å; K678-R680 VanDerWaalsContact C-N 3.33Å; K678-R680 HydrophobicContact CB-CG 4.26Å; K678-R680 VanDerWaalsContact O-CG 3.27Å; K678-R680 WeakPolarHBondContact O-CG 3.41Å
679	Q	86.5	Confident	91.2	Very high	109 Å²	109	48.7 Å²	48.7	51%	0.509	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	44.2	-171.5	-66.1	-62.8	-43.1	0	0	112.8	D675 V676	D675-Q679 PolarHBondContact O-N 3.45Å; V676-Q679 PolarHBondContact O-NE2 3.19Å
680	R	89.6	Confident	90.7	Very high	132 Å²	132	45.3 Å²	45.3	50%	0.498	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-137	157	-179.7	-45.1	-165.2	-173.9	-76.6	-7.7	112.3	A674 D675 K678	A674-R680 PolarHBondContact N-O 3.28Å; D675-R680 PolarHBondContact N-O 3.35Å; D675-R680 PolarHBondContact O-N 3.19Å; K678-R680 VanDerWaalsContact C-N 3.33Å; K678-R680 HydrophobicContact CB-CG 4.26Å; K678-R680 VanDerWaalsContact O-CG 3.27Å; K678-R680 WeakPolarHBondContact O-CG 3.41Å
681	S	93.3	Very high	89.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.007	23%	0.226	C	C	.	.			trans	-131.8	157.9	169.1	-71.3	0	0	0	0	109.1	A672 A674 P683 K706 T707	A672-S681 PolarHBondContact O-OG 2.89Å; A674-S681 PolarHBondContact N-OG 2.84Å; S681-P683 WeakPolarHBondContact O-CD 3.42Å; S681-K706 CarbonylContact O-C 3.38Å; S681-K706 WeakPolarHBondContact O-CA 3.47Å; S681-K706 PolarHBondContact O-N 3.49Å; S681-T707 PolarHBondContact O-N 3.4Å; S681-T707 VanDerWaalsContact O-O 3.06Å
682	D	94.9	Very high	88.5	Confident	29 Å²	29	47.5 Å²	47.5	16%	0.155	24%	0.237	C	C	.	.			trans	-105	76.4	162.4	-78.1	13.5	0	0	0	108.3	V703 V704 K705 K706 H736 R737	D682-V703 HydrophobicContact CB-CG1 4.04Å; D682-V704 CarbonylContact C-O 3.39Å; D682-V704 VanDerWaalsContact C-O 3.3Å; D682-V704 VanDerWaalsContact CA-O 3.3Å; D682-V704 WeakPolarHBondContact CA-O 3.26Å; D682-K705 VanDerWaalsContact OD1-CA 3.31Å; D682-K705 WeakPolarHBondContact OD1-CA 3.37Å; D682-K705 WeakPolarHBondContact OD2-CG 3.43Å; D682-K706 PolarHBondContact OD1-N 3.11Å; D682-H736 PolarHBondContact N-CE1 2.75Å; D682-H736 PolarHBondContact N-ND1 2.81Å; D682-H736 CarbonylContact O-C 3.52Å; D682-H736 WeakPolarHBondContact O-CA 3.31Å; D682-H736 PolarHBondContact O-ND1 2.8Å; D682-R737 PolarHBondContact O-N 3.07Å
683	P	96.6	Very high	87	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	150.4	-173.7	31.8	-40.3	0	0	0	114.6	L671 S681 V704 T707 P710 V734 W735 L746	L671-P683 HydrophobicContact CD1-CB 3.59Å; L671-P683 HydrophobicContact CD1-CG 3.96Å; S681-P683 WeakPolarHBondContact O-CD 3.42Å; P683-V704 WeakPolarHBondContact CD-O 3.49Å; P683-V704 PolarHBondContact O-N 3.01Å; P683-T707 VanDerWaalsContact CD-O 3.31Å; P683-T707 WeakPolarHBondContact CD-O 3.3Å; P683-T707 HydrophobicContact CG-CG2 4.05Å; P683-P710 HydrophobicContact CB-CG 4.1Å; P683-P710 HydrophobicContact CG-CB 3.68Å; P683-P710 HydrophobicContact CG-CG 3.58Å; P683-V734 HydrophobicContact CB-CG1 4.44Å; P683-W735 CarbonylContact C-O 3.6Å; P683-W735 VanDerWaalsContact CA-O 3.29Å; P683-W735 WeakPolarHBondContact CA-O 3.29Å; P683-L746 HydrophobicContact CB-CD1 4Å
684	Y	97.3	Very high	85.2	Confident	13 Å²	13	55.4 Å²	55.4	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	154.9	163.6	68	-78.7	0	0	0	110.3	K686 L702 V703 Y712 W735 R737 N743	Y684-K686 HydrophobicContact CD2-CG 4.47Å; Y684-K686 HydrophobicContact CE2-CD 3.75Å; Y684-K686 HydrophobicContact CE2-CG 3.94Å; Y684-K686 WeakPolarHBondContact OH-CE 3.25Å; Y684-K686 PolarHBondContact OH-NZ 2.94Å; Y684-L702 WeakPolarHBondContact CB-O 3.39Å; Y684-V703 HydrophobicContact CD1-CG2 4.07Å; Y684-V703 HydrophobicContact CG-CG2 4.1Å; Y684-Y712 WeakPolarHBondContact CA-OH 3.49Å; Y684-W735 HydrophobicContact CD1-CB 4.11Å; Y684-W735 WeakPolarHBondContact CD1-O 3.32Å; Y684-W735 HydrophobicContact CE1-CB 3.51Å; Y684-W735 WeakPolarHBondContact CE1-O 3.26Å; Y684-W735 HydrophobicContact CE2-CB 4.07Å; Y684-W735 HydrophobicContact CE2-CG 4.48Å; Y684-W735 VanDerWaalsContact CZ-CB 3.47Å; Y684-W735 PolarHBondContact N-O 3.5Å; Y684-W735 PolarHBondContact O-N 2.8Å; Y684-R737 HydrophobicContact CD1-CB 4.04Å; Y684-R737 HydrophobicContact CE1-CB 3.94Å; Y684-N743 PolarHBondContact OH-ND2 2.84Å; Y684-N743 VanDerWaalsContact OH-ND2 3.08Å
685	V	97.1	Very high	83.8	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.8	176.2	-176.9	0	0	0	0	109.9	V665 K700 T701 Y712 L732 S733 V734	V665-V685 HydrophobicContact CG1-CB 4.3Å; V665-V685 HydrophobicContact CG1-CG1 4.46Å; V665-V685 HydrophobicContact CG1-CG2 3.92Å; V665-V685 HydrophobicContact CG2-CG1 4.43Å; V685-K700 CarbonylContact O-C 3.45Å; V685-K700 WeakPolarHBondContact O-CA 3.33Å; V685-K700 VanDerWaalsContact O-CB 3.3Å; V685-K700 WeakPolarHBondContact O-CB 3.13Å; V685-T701 HydrophobicContact CB-CG2 3.94Å; V685-T701 PolarHBondContact N-OG1 3.09Å; V685-T701 PolarHBondContact O-N 3.38Å; V685-Y712 HydrophobicContact CG2-CD2 4.42Å; V685-Y712 HydrophobicContact CG2-CE2 3.72Å; V685-L732 HydrophobicContact CG1-CD1 4.22Å; V685-L732 HydrophobicContact CG1-CD2 3.57Å; V685-L732 HydrophobicContact CG1-CG 3.63Å; V685-S733 WeakPolarHBondContact CA-O 3.45Å; V685-V734 HydrophobicContact CG2-CG1 4.49Å; V685-V734 HydrophobicContact CG2-CG2 4.24Å
686	K	94.9	Very high	83.1	Confident	20 Å²	20	63.1 Å²	63.1	9%	0.087	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	149.6	161.6	-79.4	138.3	158.5	170.3	0	108.7	Y684 Y688 K699 K700 L732 S733 W735	Y684-K686 HydrophobicContact CD2-CG 4.47Å; Y684-K686 HydrophobicContact CE2-CD 3.75Å; Y684-K686 HydrophobicContact CE2-CG 3.94Å; Y684-K686 WeakPolarHBondContact OH-CE 3.25Å; Y684-K686 PolarHBondContact OH-NZ 2.94Å; K686-Y688 HydrophobicContact CB-CE2 3.73Å; K686-Y688 HydrophobicContact CG-CE2 4.43Å; K686-K699 WeakPolarHBondContact CA-O 3.24Å; K686-K700 HydrophobicContact CG-CB 4.23Å; K686-L732 WeakPolarHBondContact O-CA 3.44Å; K686-S733 PolarHBondContact N-O 2.69Å; K686-S733 PolarHBondContact O-N 3.16Å; K686-W735 HydrophobicContact CD-CD2 4.25Å; K686-W735 HydrophobicContact CD-CG 3.96Å; K686-W735 VanDerWaalsContact CD-NE1 3.3Å
687	T	94.6	Very high	82.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	154.6	163	50.8	0	0	0	0	110.8	V663 K698 K699 L716 Y718 L730 N731 L732	V663-T687 HydrophobicContact CG1-CG2 4.27Å; T687-K698 WeakPolarHBondContact O-CA 3.35Å; T687-K699 PolarHBondContact N-O 3.35Å; T687-K699 PolarHBondContact O-N 2.91Å; T687-K699 VanDerWaalsContact O-N 3.14Å; T687-L716 HydrophobicContact CG2-CD1 4.08Å; T687-L716 WeakPolarHBondContact OG1-CD1 3.47Å; T687-Y718 WeakPolarHBondContact CB-OH 3.25Å; T687-Y718 PolarHBondContact O-OH 3.3Å; T687-Y718 PolarHBondContact OG1-OH 3.07Å; T687-L730 HydrophobicContact CG2-CD1 4.23Å; T687-N731 CarbonylContact C-O 3.44Å; T687-N731 VanDerWaalsContact CA-O 3.29Å; T687-N731 WeakPolarHBondContact CA-O 3.41Å; T687-L732 HydrophobicContact CG2-CB 3.88Å; T687-L732 HydrophobicContact CG2-CD1 3.82Å; T687-L732 HydrophobicContact CG2-CG 3.67Å
688	Y	91.4	Very high	83	Confident	5 Å²	5	54.8 Å²	54.8	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.7	174.9	-54.7	-93.1	0	0	0	108.5	S630 S633 V634 K686 K698 Y718 N731	S630-Y688 WeakPolarHBondContact O-CE1 3.24Å; S633-Y688 PolarHBondContact OG-OH 3.01Å; V634-Y688 HydrophobicContact CG2-CD1 4.3Å; V634-Y688 HydrophobicContact CG2-CD2 4.14Å; V634-Y688 HydrophobicContact CG2-CE1 4.32Å; V634-Y688 HydrophobicContact CG2-CE2 4.18Å; V634-Y688 HydrophobicContact CG2-CG 4.22Å; K686-Y688 HydrophobicContact CB-CE2 3.73Å; K686-Y688 HydrophobicContact CG-CE2 4.43Å; Y688-K698 HydrophobicContact CD1-CB 3.97Å; Y688-K698 HydrophobicContact CE1-CB 3.57Å; Y688-Y718 PolarHBondContact N-OH 3.45Å; Y688-N731 PolarHBondContact N-O 2.83Å; Y688-N731 PolarHBondContact O-N 3.13Å
689	L	90.2	Very high	83.4	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.8	161.5	-66.5	175.9	0	0	0	107.6	L661 D692 M696 Y718 I720 K729 L730 L753	L661-L689 HydrophobicContact CD2-CD1 4.19Å; L661-L689 HydrophobicContact CD2-CD2 3.91Å; L689-D692 VanDerWaalsContact O-CA 3.3Å; L689-D692 WeakPolarHBondContact O-CA 3.31Å; L689-D692 PolarHBondContact O-N 3.21Å; L689-M696 HydrophobicContact CD1-CE 4.1Å; L689-M696 HydrophobicContact CD1-CG 4.31Å; L689-Y718 HydrophobicContact CD1-CD1 3.91Å; L689-Y718 HydrophobicContact CD1-CD2 4.04Å; L689-Y718 HydrophobicContact CD1-CE1 4.33Å; L689-Y718 HydrophobicContact CD1-CG 3.7Å; L689-Y718 HydrophobicContact CG-CD1 4.33Å; L689-Y718 HydrophobicContact CG-CD2 4.27Å; L689-Y718 HydrophobicContact CG-CE1 4.25Å; L689-Y718 HydrophobicContact CG-CE2 4.28Å; L689-Y718 HydrophobicContact CG-CG 4.3Å; L689-I720 HydrophobicContact CD1-CG2 4.34Å; L689-K729 WeakPolarHBondContact CA-O 3.16Å; L689-L730 HydrophobicContact CD2-CB 4.2Å; L689-L730 HydrophobicContact CD2-CD1 3.88Å; L689-L753 HydrophobicContact CD2-CD1 3.69Å
690	L	85.7	Confident	83.9	Confident	26 Å²	26	52.1 Å²	52.1	14%	0.136	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.6	-171.9	-59.1	179	0	0	0	109.9	V634 Q728 K729 N731	V634-L690 HydrophobicContact CG1-CD1 4.37Å; L690-Q728 CarbonylContact O-C 3.42Å; L690-Q728 VanDerWaalsContact O-CA 3.29Å; L690-Q728 WeakPolarHBondContact O-CA 3.43Å; L690-K729 PolarHBondContact N-O 2.89Å; L690-K729 PolarHBondContact O-N 2.99Å; L690-N731 HydrophobicContact CD1-CB 3.71Å; L690-N731 HydrophobicContact CG-CB 4.38Å
691	P	78.4	Confident	84.2	Confident	86 Å²	86	46 Å²	46	56%	0.558	24%	0.235	S	C	*	.	S	Bend	cis	-69.3	131.1	-9.3	28.1	-35.4	0	0	0	112.2	K693 Q728	P691-K693 PolarHBondContact O-N 2.82Å; P691-Q728 PolarHBondContact O-NE2 2.8Å; P691-Q728 PolarHBondContact O-OE1 3.2Å
692	D	66.6	Low	84.4	Confident	44 Å²	44	51.9 Å²	51.9	24%	0.235	27%	0.266	C	S	.	.			trans	-62.4	103.8	-178.6	-177.1	-7.3	0	0	0	110.6	L689 G694 M696 G697	L689-D692 VanDerWaalsContact O-CA 3.3Å; L689-D692 WeakPolarHBondContact O-CA 3.31Å; L689-D692 PolarHBondContact O-N 3.21Å; D692-G694 PolarHBondContact O-N 3.43Å; D692-M696 WeakPolarHBondContact OD1-CB 3.12Å; D692-M696 PolarHBondContact OD1-N 2.83Å; D692-G697 PolarHBondContact OD1-N 2.85Å; D692-G697 VanDerWaalsContact OD2-CA 3.28Å; D692-G697 WeakPolarHBondContact OD2-CA 3.39Å; D692-G697 PolarHBondContact OD2-N 2.79Å; D692-G697 VanDerWaalsContact OD2-N 3.11Å
693	K	60.3	Low	84.5	Confident	134 Å²	134	52.6 Å²	52.6	58%	0.583	27%	0.271	S	S	*	.			trans	-70.9	66.9	179.4	-65.9	-76.9	-174.3	173.6	0	111.7	P691 K695	P691-K693 PolarHBondContact O-N 2.82Å; K693-K695 PolarHBondContact O-N 2.91Å
694	G	54	Low	84.5	Confident	51 Å²	51	54.6 Å²	54.6	53%	0.526	28%	0.283	S	S	.	.	S	Bend	trans	71.7	-21.2	155	0	0	0	0	0	118.8	D692	D692-G694 PolarHBondContact O-N 3.43Å
695	K	56.9	Low	84.4	Confident	208 Å²	208	60.6 Å²	60.6	90%	0.904	31%	0.31	S	S	*	.	S	Bend	trans	-140.5	-4	-177.5	-69.4	-175.4	-179.2	174.7	0	114.6	K693	K693-K695 PolarHBondContact O-N 2.91Å
696	M	69.6	Low	84.2	Confident	30 Å²	30	68 Å²	68	15%	0.148	34%	0.342	C	S	.	.			trans	-80.6	-52.4	-168	-170.1	65.5	87.9	0	0	112.4	L689 D692 K699 Y718 K719 I720	L689-M696 HydrophobicContact CD1-CE 4.1Å; L689-M696 HydrophobicContact CD1-CG 4.31Å; D692-M696 WeakPolarHBondContact OD1-CB 3.12Å; D692-M696 PolarHBondContact OD1-N 2.83Å; M696-K699 WeakPolarHBondContact O-CE 3.28Å; M696-Y718 HydrophobicContact CE-CD1 4.32Å; M696-Y718 HydrophobicContact CG-CD1 3.35Å; M696-Y718 HydrophobicContact CG-CE1 3.81Å; M696-Y718 HydrophobicContact CG-CG 4.37Å; M696-Y718 HydrophobicContact SD-CD1 3.49Å; M696-Y718 WeakPolarHBondContact SD-CD1 3.15Å; M696-Y718 HydrophobicContact SD-CE1 4.47Å; M696-Y718 HydrophobicContact SD-CG 4.16Å; M696-K719 WeakPolarHBondContact CE-O 3.38Å; M696-K719 PolarHBondContact SD-N 2.94Å; M696-K719 VanDerWaalsContact SD-N 3.4Å; M696-I720 HydrophobicContact CE-CB 3.47Å; M696-I720 VanDerWaalsContact CE-CB 3.47Å; M696-I720 HydrophobicContact CE-CG2 3.88Å
697	G	71.9	Confident	84.2	Confident	21 Å²	21	68.7 Å²	68.7	22%	0.216	35%	0.347	C	S	.	.			trans	65.7	167.2	176.4	0	0	0	0	0	115	D692	D692-G697 PolarHBondContact OD1-N 2.85Å; D692-G697 VanDerWaalsContact OD2-CA 3.28Å; D692-G697 WeakPolarHBondContact OD2-CA 3.39Å; D692-G697 PolarHBondContact OD2-N 2.79Å; D692-G697 VanDerWaalsContact OD2-N 3.11Å
698	K	88.7	Confident	84.3	Confident	103 Å²	103	70.6 Å²	70.6	45%	0.448	36%	0.357	S	S	.	.			trans	-58.8	145.4	177	64.7	172.5	165.1	-66.5	0	112.9	S630 T687 Y688	S630-K698 WeakPolarHBondContact OG-CD 3.28Å; S630-K698 VanDerWaalsContact OG-CG 3.23Å; S630-K698 WeakPolarHBondContact OG-CG 3.47Å; S630-K698 PolarHBondContact OG-NZ 2.89Å; T687-K698 WeakPolarHBondContact O-CA 3.35Å; Y688-K698 HydrophobicContact CD1-CB 3.97Å; Y688-K698 HydrophobicContact CE1-CB 3.57Å
699	K	93.9	Very high	84.5	Confident	61 Å²	61	74.3 Å²	74.3	27%	0.265	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	162.1	158.2	-47.6	-65.5	155.8	129.2	0	108.7	K686 T687 M696 L716 R717 Y718	K686-K699 WeakPolarHBondContact CA-O 3.24Å; T687-K699 PolarHBondContact N-O 3.35Å; T687-K699 PolarHBondContact O-N 2.91Å; T687-K699 VanDerWaalsContact O-N 3.14Å; M696-K699 WeakPolarHBondContact O-CE 3.28Å; K699-L716 HydrophobicContact CB-CB 3.84Å; K699-L716 HydrophobicContact CB-CD1 4.15Å; K699-L716 HydrophobicContact CB-CD2 4.26Å; K699-L716 HydrophobicContact CB-CG 4.3Å; K699-L716 HydrophobicContact CG-CB 4.43Å; K699-R717 WeakPolarHBondContact CE-O 3.36Å; K699-R717 PolarHBondContact NZ-O 3.26Å; K699-Y718 HydrophobicContact CB-CE1 4.41Å; K699-Y718 HydrophobicContact CD-CD1 4.4Å; K699-Y718 HydrophobicContact CD-CE1 4.16Å; K699-Y718 HydrophobicContact CG-CD1 3.87Å; K699-Y718 HydrophobicContact CG-CE1 3.33Å; K699-Y718 HydrophobicContact CG-CE2 4.03Å; K699-Y718 HydrophobicContact CG-CG 4.49Å; K699-Y718 WeakPolarHBondContact CG-OH 3.3Å
700	K	95.3	Very high	84.8	Confident	127 Å²	127	74.1 Å²	74.1	55%	0.552	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.1	153	177.3	58.7	162.7	-171.2	166.5	0	110.8	V685 K686 L716	V685-K700 CarbonylContact O-C 3.45Å; V685-K700 WeakPolarHBondContact O-CA 3.33Å; V685-K700 VanDerWaalsContact O-CB 3.3Å; V685-K700 WeakPolarHBondContact O-CB 3.13Å; K686-K700 HydrophobicContact CG-CB 4.23Å; K700-L716 VanDerWaalsContact O-CD2 3.32Å; K700-L716 WeakPolarHBondContact O-CD2 3.48Å
701	T	97.5	Very high	85.4	Confident	5 Å²	5	76.5 Å²	76.5	3%	0.031	39%	0.392	C	S	.	.			trans	-76.5	175.9	168.6	63.4	0	0	0	0	111.2	V665 V685 Y712 E714 L716	V665-T701 HydrophobicContact CB-CG2 4.15Å; V665-T701 HydrophobicContact CG1-CG2 4.16Å; V665-T701 HydrophobicContact CG2-CG2 4.42Å; V685-T701 HydrophobicContact CB-CG2 3.94Å; V685-T701 PolarHBondContact N-OG1 3.09Å; V685-T701 PolarHBondContact O-N 3.38Å; T701-Y712 HydrophobicContact CG2-CD1 4.04Å; T701-Y712 HydrophobicContact CG2-CG 4.05Å; T701-Y712 WeakPolarHBondContact OG1-CD1 3.47Å; T701-Y712 WeakPolarHBondContact OG1-CE1 3.45Å; T701-E714 VanDerWaalsContact CA-OE2 3.3Å; T701-E714 WeakPolarHBondContact CA-OE2 3.31Å; T701-E714 WeakPolarHBondContact CB-OE1 3.49Å; T701-E714 HydrophobicContact CG2-CB 4.19Å; T701-L716 HydrophobicContact CG2-CD1 4.33Å; T701-L716 HydrophobicContact CG2-CD2 4.49Å
702	L	96.5	Very high	86.3	Confident	124 Å²	124	73.5 Å²	73.5	65%	0.649	37%	0.37	S	S	*	.			trans	-64	165.3	158.1	-60.7	177.7	0	0	0	111.2	Y684 Y712 E714	Y684-L702 WeakPolarHBondContact CB-O 3.39Å; L702-Y712 WeakPolarHBondContact O-CE1 3.37Å; L702-E714 WeakPolarHBondContact CB-OE1 3.02Å; L702-E714 PolarHBondContact N-OE1 2.94Å; L702-E714 PolarHBondContact N-OE2 2.87Å; L702-E714 VanDerWaalsContact N-OE2 3.14Å
703	V	96.9	Very high	87.8	Confident	43 Å²	43	76 Å²	76	26%	0.261	38%	0.384	S	S	.	.			trans	-96.7	114.3	176.1	-173.5	0	0	0	0	108.4	D682 Y684 R737	D682-V703 HydrophobicContact CB-CG1 4.04Å; Y684-V703 HydrophobicContact CD1-CG2 4.07Å; Y684-V703 HydrophobicContact CG-CG2 4.1Å; V703-R737 HydrophobicContact CG1-CB 3.86Å; V703-R737 HydrophobicContact CG2-CB 4.33Å
704	V	96.9	Very high	89.5	Confident	43 Å²	43	71.8 Å²	71.8	26%	0.261	37%	0.366	S	S	.	.			trans	-85.7	132.7	170.6	-171.3	0	0	0	0	107.1	D682 P683 T707 P710 Y712	D682-V704 CarbonylContact C-O 3.39Å; D682-V704 VanDerWaalsContact C-O 3.3Å; D682-V704 VanDerWaalsContact CA-O 3.3Å; D682-V704 WeakPolarHBondContact CA-O 3.26Å; P683-V704 WeakPolarHBondContact CD-O 3.49Å; P683-V704 PolarHBondContact O-N 3.01Å; V704-T707 HydrophobicContact CB-CG2 4.18Å; V704-T707 HydrophobicContact CG1-CG2 3.59Å; V704-P710 HydrophobicContact CB-CB 3.89Å; V704-P710 HydrophobicContact CG1-CB 4.25Å; V704-P710 HydrophobicContact CG2-CB 4.01Å; V704-Y712 HydrophobicContact CG2-CD1 3.76Å; V704-Y712 HydrophobicContact CG2-CE1 3.72Å
705	K	94.8	Very high	91.5	Very high	139 Å²	139	73.8 Å²	73.8	60%	0.604	36%	0.363	S	S	*	.			trans	-97.1	153.2	-174.4	-60.9	-169.8	-179.8	174.8	0	112.6	D682 T707	D682-K705 VanDerWaalsContact OD1-CA 3.31Å; D682-K705 WeakPolarHBondContact OD1-CA 3.37Å; D682-K705 WeakPolarHBondContact OD2-CG 3.43Å; K705-T707 VanDerWaalsContact C-N 3.28Å; K705-T707 PolarHBondContact O-N 2.91Å
706	K	93.2	Very high	93.4	Very high	155 Å²	155	64.4 Å²	64.4	67%	0.674	32%	0.323	S	S	*	.	S	Bend	trans	56.1	29	167.4	-60	-179.8	179.9	179.8	0	115.5	S681 D682	S681-K706 CarbonylContact O-C 3.38Å; S681-K706 WeakPolarHBondContact O-CA 3.47Å; S681-K706 PolarHBondContact O-N 3.49Å; D682-K706 PolarHBondContact OD1-N 3.11Å
707	T	95.3	Very high	94.6	Very high	34 Å²	34	68.4 Å²	68.4	21%	0.209	34%	0.337	C	S	.	.			trans	-132.9	150.8	-176.9	-171.7	0	0	0	0	113	S681 P683 V704 K705 N709 P710	S681-T707 PolarHBondContact O-N 3.4Å; S681-T707 VanDerWaalsContact O-O 3.06Å; P683-T707 VanDerWaalsContact CD-O 3.31Å; P683-T707 WeakPolarHBondContact CD-O 3.3Å; P683-T707 HydrophobicContact CG-CG2 4.05Å; V704-T707 HydrophobicContact CB-CG2 4.18Å; V704-T707 HydrophobicContact CG1-CG2 3.59Å; K705-T707 VanDerWaalsContact C-N 3.28Å; K705-T707 PolarHBondContact O-N 2.91Å; T707-N709 PolarHBondContact OG1-N 2.99Å; T707-N709 PolarHBondContact OG1-O 3.22Å; T707-P710 HydrophobicContact CG2-CB 3.84Å
708	L	95.6	Very high	95.5	Very high	40 Å²	40	67.4 Å²	67.4	21%	0.209	33%	0.326	C	S	.	.	S	Bend	trans	-102.1	-8.6	166.6	-51.7	-176.7	0	0	0	112	L671 A673 P710	L671-L708 HydrophobicContact CB-CB 4.4Å; L671-L708 VanDerWaalsContact CB-O 3.29Å; L671-L708 WeakPolarHBondContact CB-O 3.2Å; L671-L708 VanDerWaalsContact CG-O 3.3Å; L671-L708 WeakPolarHBondContact CG-O 3.4Å; L671-L708 PolarHBondContact N-O 3.24Å; A673-L708 HydrophobicContact CB-CD1 4.19Å; A673-L708 HydrophobicContact CB-CD2 3.91Å; L708-P710 VanDerWaalsContact C-CD 3.45Å; L708-P710 WeakPolarHBondContact O-CD 3.45Å
709	N	96.7	Very high	95.7	Very high	83 Å²	83	70 Å²	70	44%	0.444	34%	0.338	S	S	.	.	S	Bend	trans	-124	71.7	178.6	-61	-55.5	0	0	0	109.1	C668 K669 D670 T707	C668-N709 CarbonylContact O-C 3.48Å; C668-N709 WeakPolarHBondContact O-CA 3.44Å; K669-N709 VanDerWaalsContact CA-OD1 3.26Å; K669-N709 WeakPolarHBondContact CA-OD1 3.31Å; K669-N709 WeakPolarHBondContact CG-OD1 3.31Å; D670-N709 PolarHBondContact N-OD1 3.03Å; T707-N709 PolarHBondContact OG1-N 2.99Å; T707-N709 PolarHBondContact OG1-O 3.22Å
710	P	97	Very high	95.4	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.329	C	S	.	.			trans	-76.5	137.1	179.4	31.8	-36.7	0	0	0	112	Q667 C668 L671 P683 V704 T707 L708 Y712	Q667-P710 CarbonylContact C-O 3.26Å; Q667-P710 WeakPolarHBondContact CA-O 3.3Å; Q667-P710 VanDerWaalsContact CB-O 3.3Å; Q667-P710 WeakPolarHBondContact CB-O 3.17Å; C668-P710 HydrophobicContact CB-CG 3.75Å; C668-P710 PolarHBondContact N-O 3.07Å; L671-P710 HydrophobicContact CD1-CG 3.72Å; P683-P710 HydrophobicContact CB-CG 4.1Å; P683-P710 HydrophobicContact CG-CB 3.68Å; P683-P710 HydrophobicContact CG-CG 3.58Å; V704-P710 HydrophobicContact CB-CB 3.89Å; V704-P710 HydrophobicContact CG1-CB 4.25Å; V704-P710 HydrophobicContact CG2-CB 4.01Å; T707-P710 HydrophobicContact CG2-CB 3.84Å; L708-P710 VanDerWaalsContact C-CD 3.45Å; L708-P710 WeakPolarHBondContact O-CD 3.45Å; P710-Y712 HydrophobicContact CB-CE1 4.2Å; P710-Y712 HydrophobicContact CB-CE2 3.86Å; P710-Y712 HydrophobicContact CG-CE2 3.74Å; P710-Y712 WeakPolarHBondContact CG-OH 3.48Å
711	V	97.8	Very high	95.1	Very high	76 Å²	76	64.8 Å²	64.8	46%	0.461	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.9	166	-175.6	0	0	0	0	107.8	Q667 N713	Q667-V711 HydrophobicContact CB-CB 4.42Å; Q667-V711 HydrophobicContact CB-CG1 4.5Å; Q667-V711 HydrophobicContact CB-CG2 4.09Å; V711-N713 WeakPolarHBondContact CG1-ND2 3.36Å
712	Y	97.6	Very high	94.6	Very high	22 Å²	22	68.5 Å²	68.5	9%	0.086	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-52.5	-179.9	-52.2	-84.1	0	0	0	110.8	V665 A666 Y684 V685 T701 L702 V704 P710 E714	V665-Y712 HydrophobicContact CG1-CD2 3.86Å; V665-Y712 HydrophobicContact CG1-CE2 4.4Å; V665-Y712 HydrophobicContact CG1-CG 4.47Å; A666-Y712 PolarHBondContact O-N 2.84Å; Y684-Y712 WeakPolarHBondContact CA-OH 3.49Å; V685-Y712 HydrophobicContact CG2-CD2 4.42Å; V685-Y712 HydrophobicContact CG2-CE2 3.72Å; T701-Y712 HydrophobicContact CG2-CD1 4.04Å; T701-Y712 HydrophobicContact CG2-CG 4.05Å; T701-Y712 WeakPolarHBondContact OG1-CD1 3.47Å; T701-Y712 WeakPolarHBondContact OG1-CE1 3.45Å; L702-Y712 WeakPolarHBondContact O-CE1 3.37Å; V704-Y712 HydrophobicContact CG2-CD1 3.76Å; V704-Y712 HydrophobicContact CG2-CE1 3.72Å; P710-Y712 HydrophobicContact CB-CE1 4.2Å; P710-Y712 HydrophobicContact CB-CE2 3.86Å; P710-Y712 HydrophobicContact CG-CE2 3.74Å; P710-Y712 WeakPolarHBondContact CG-OH 3.48Å; Y712-E714 VanDerWaalsContact C-N 3.29Å; Y712-E714 PolarHBondContact O-N 3.06Å
713	N	96.6	Very high	94.2	Very high	98 Å²	98	68.5 Å²	68.5	52%	0.524	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.2	47.1	-169.8	-61.6	-30.4	0	0	0	112.6	F664 V665 A666 V711	F664-N713 HydrophobicContact CE2-CB 4.2Å; F664-N713 HydrophobicContact CZ-CB 4.36Å; V665-N713 WeakPolarHBondContact O-CA 3.29Å; V665-N713 PolarHBondContact O-N 3.33Å; V665-N713 VanDerWaalsContact O-N 3.12Å; A666-N713 WeakPolarHBondContact CA-OD1 3.1Å; A666-N713 PolarHBondContact O-N 2.85Å; A666-N713 PolarHBondContact O-OD1 3.38Å; V711-N713 WeakPolarHBondContact CG1-ND2 3.36Å
714	E	97.2	Very high	93.7	Very high	44 Å²	44	70.9 Å²	70.9	21%	0.206	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.6	-176.6	-73.9	-178.9	-114.7	0	0	112	V665 T701 L702 Y712	V665-E714 PolarHBondContact N-O 3.31Å; V665-E714 PolarHBondContact O-N 3.12Å; T701-E714 VanDerWaalsContact CA-OE2 3.3Å; T701-E714 WeakPolarHBondContact CA-OE2 3.31Å; T701-E714 WeakPolarHBondContact CB-OE1 3.49Å; T701-E714 HydrophobicContact CG2-CB 4.19Å; L702-E714 WeakPolarHBondContact CB-OE1 3.02Å; L702-E714 PolarHBondContact N-OE1 2.94Å; L702-E714 PolarHBondContact N-OE2 2.87Å; L702-E714 VanDerWaalsContact N-OE2 3.14Å; Y712-E714 VanDerWaalsContact C-N 3.29Å; Y712-E714 PolarHBondContact O-N 3.06Å
715	I	96.2	Very high	93.2	Very high	93 Å²	93	68.9 Å²	68.9	48%	0.477	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.4	174.3	-53.7	174.1	0	0	0	109.9	H662 F664 R717	H662-I715 HydrophobicContact CB-CG2 3.75Å; F664-I715 HydrophobicContact CB-CG1 4.26Å; F664-I715 HydrophobicContact CD2-CG1 3.62Å; F664-I715 HydrophobicContact CE2-CG1 4.41Å; F664-I715 HydrophobicContact CG-CG1 4.28Å; I715-R717 HydrophobicContact CG2-CG 3.89Å
716	L	95.8	Very high	92.7	Very high	11 Å²	11	68.8 Å²	68.8	6%	0.058	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	111.5	176	-54.5	-176.9	0	0	0	109.5	V663 V665 T687 K699 K700 T701	V663-L716 HydrophobicContact CB-CB 4.33Å; V663-L716 PolarHBondContact N-O 3.19Å; V663-L716 PolarHBondContact O-N 2.9Å; V665-L716 HydrophobicContact CG2-CD1 4.1Å; V665-L716 HydrophobicContact CG2-CG 4.45Å; T687-L716 HydrophobicContact CG2-CD1 4.08Å; T687-L716 WeakPolarHBondContact OG1-CD1 3.47Å; K699-L716 HydrophobicContact CB-CB 3.84Å; K699-L716 HydrophobicContact CB-CD1 4.15Å; K699-L716 HydrophobicContact CB-CD2 4.26Å; K699-L716 HydrophobicContact CB-CG 4.3Å; K699-L716 HydrophobicContact CG-CB 4.43Å; K700-L716 VanDerWaalsContact O-CD2 3.32Å; K700-L716 WeakPolarHBondContact O-CD2 3.48Å; T701-L716 HydrophobicContact CG2-CD1 4.33Å; T701-L716 HydrophobicContact CG2-CD2 4.49Å
717	R	94.5	Very high	92.3	Very high	115 Å²	115	65 Å²	65	43%	0.434	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.9	-169.6	-64.4	169.9	65.2	159.6	1.6	113.2	E660 H662 K699 I715	E660-R717 IonicContact OE1-NH2 3.48Å; E660-R717 IonicContact OE2-CZ 3.66Å; E660-R717 IonicContact OE2-NE 2.66Å; E660-R717 PolarHBondContact OE2-NE 2.82Å; E660-R717 IonicContact OE2-NH2 2.7Å; E660-R717 PolarHBondContact OE2-NH2 3.48Å; H662-R717 PolarHBondContact CE1-NE 2.82Å; H662-R717 VanDerWaalsContact CE1-NE 3.31Å; H662-R717 PolarHBondContact NE2-NE 3.47Å; K699-R717 WeakPolarHBondContact CE-O 3.36Å; K699-R717 PolarHBondContact NZ-O 3.26Å; I715-R717 HydrophobicContact CG2-CG 3.89Å
718	Y	92.6	Very high	91.9	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120	-175.3	-74.6	-65	0	0	0	110.8	E660 L661 V663 T687 Y688 L689 M696 K699 I720 L730	E660-Y718 CarbonylContact C-O 3.49Å; E660-Y718 WeakPolarHBondContact CA-O 3.3Å; L661-Y718 HydrophobicContact CD2-CD2 4.34Å; L661-Y718 PolarHBondContact N-O 3.19Å; L661-Y718 PolarHBondContact O-N 2.73Å; V663-Y718 HydrophobicContact CG2-CD2 3.99Å; V663-Y718 HydrophobicContact CG2-CE2 3.95Å; T687-Y718 WeakPolarHBondContact CB-OH 3.25Å; T687-Y718 PolarHBondContact O-OH 3.3Å; T687-Y718 PolarHBondContact OG1-OH 3.07Å; Y688-Y718 PolarHBondContact N-OH 3.45Å; L689-Y718 HydrophobicContact CD1-CD1 3.91Å; L689-Y718 HydrophobicContact CD1-CD2 4.04Å; L689-Y718 HydrophobicContact CD1-CE1 4.33Å; L689-Y718 HydrophobicContact CD1-CG 3.7Å; L689-Y718 HydrophobicContact CG-CD1 4.33Å; L689-Y718 HydrophobicContact CG-CD2 4.27Å; L689-Y718 HydrophobicContact CG-CE1 4.25Å; L689-Y718 HydrophobicContact CG-CE2 4.28Å; L689-Y718 HydrophobicContact CG-CG 4.3Å; M696-Y718 HydrophobicContact CE-CD1 4.32Å; M696-Y718 HydrophobicContact CG-CD1 3.35Å; M696-Y718 HydrophobicContact CG-CE1 3.81Å; M696-Y718 HydrophobicContact CG-CG 4.37Å; M696-Y718 HydrophobicContact SD-CD1 3.49Å; M696-Y718 WeakPolarHBondContact SD-CD1 3.15Å; M696-Y718 HydrophobicContact SD-CE1 4.47Å; M696-Y718 HydrophobicContact SD-CG 4.16Å; K699-Y718 HydrophobicContact CB-CE1 4.41Å; K699-Y718 HydrophobicContact CD-CD1 4.4Å; K699-Y718 HydrophobicContact CD-CE1 4.16Å; K699-Y718 HydrophobicContact CG-CD1 3.87Å; K699-Y718 HydrophobicContact CG-CE1 3.33Å; K699-Y718 HydrophobicContact CG-CE2 4.03Å; K699-Y718 HydrophobicContact CG-CG 4.49Å; K699-Y718 WeakPolarHBondContact CG-OH 3.3Å; Y718-I720 PolarHBondContact O-N 3.2Å; Y718-L730 HydrophobicContact CE2-CD1 4.39Å
719	K	90.9	Very high	91.7	Very high	158 Å²	158	65.9 Å²	65.9	69%	0.687	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	90	179.3	-72.1	-167.6	170	-155.8	0	111.5	E660 M696	E660-K719 HydrophobicContact CG-CB 4.47Å; E660-K719 HydrophobicContact CG-CG 3.7Å; E660-K719 WeakPolarHBondContact OE1-CE 3.16Å; E660-K719 WeakPolarHBondContact OE1-CG 3.46Å; M696-K719 WeakPolarHBondContact CE-O 3.38Å; M696-K719 PolarHBondContact SD-N 2.94Å; M696-K719 VanDerWaalsContact SD-N 3.4Å
720	I	89	Confident	91.5	Very high	16 Å²	16	62 Å²	62	8%	0.082	29%	0.289	C	S	.	.			trans	-140.2	143	-176.7	178.5	156.7	0	0	0	108	Y654 K659 L661 L689 M696 Y718 F724 L725 Q728	Y654-I720 VanDerWaalsContact CE2-O 3.29Å; Y654-I720 WeakPolarHBondContact CE2-O 3.33Å; K659-I720 CarbonylContact C-O 3.3Å; K659-I720 VanDerWaalsContact C-O 3.26Å; K659-I720 PolarHBondContact O-N 3.18Å; K659-I720 VanDerWaalsContact O-N 3.14Å; L661-I720 HydrophobicContact CB-CG2 3.92Å; L689-I720 HydrophobicContact CD1-CG2 4.34Å; M696-I720 HydrophobicContact CE-CB 3.47Å; M696-I720 VanDerWaalsContact CE-CB 3.47Å; M696-I720 HydrophobicContact CE-CG2 3.88Å; Y718-I720 PolarHBondContact O-N 3.2Å; I720-F724 HydrophobicContact CD1-CB 3.79Å; I720-F724 HydrophobicContact CG1-CB 3.84Å; I720-L725 HydrophobicContact CD1-CD2 4.02Å; I720-L725 HydrophobicContact CG1-CD2 4.18Å; I720-L725 HydrophobicContact CG1-CG 4.45Å; I720-L725 HydrophobicContact CG2-CD2 3.68Å; I720-L725 HydrophobicContact CG2-CG 4.46Å; I720-Q728 HydrophobicContact CD1-CG 3.94Å
721	E	88.4	Confident	91.3	Very high	61 Å²	61	62 Å²	62	29%	0.285	29%	0.29	S	S	.	.			trans	-89.4	143.9	177.3	-170.8	169.6	-122.1	0	0	110.6	K659 Q723 F724	K659-E721 HydrophobicContact CD-CG 4.15Å; K659-E721 WeakPolarHBondContact CE-OE1 3.36Å; K659-E721 IonicContact NZ-OE1 3.53Å; K659-E721 PolarHBondContact NZ-OE1 3.09Å; E721-Q723 HydrophobicContact CB-CG 4.45Å; E721-Q723 HydrophobicContact CG-CG 4.18Å; E721-Q723 PolarHBondContact O-N 3.33Å; E721-Q723 PolarHBondContact OE2-NE2 3.12Å; E721-F724 HydrophobicContact CB-CD2 4.03Å; E721-F724 HydrophobicContact CB-CE2 4.34Å; E721-F724 PolarHBondContact O-N 2.75Å
722	R	87.7	Confident	91.1	Very high	83 Å²	83	58.4 Å²	58.4	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-48.8	-39.3	-170.6	-161.3	-171.6	-76.5	-125.7	7	113.5	Y654 E656 F724 L725 D759	Y654-R722 HydrophobicContact CD1-CB 4.33Å; Y654-R722 HydrophobicContact CD1-CG 4.2Å; Y654-R722 HydrophobicContact CE1-CB 3.61Å; Y654-R722 HydrophobicContact CE1-CG 3.96Å; Y654-R722 PolarHBondContact OH-N 3.27Å; E656-R722 IonicContact OE2-CZ 2.7Å; E656-R722 VanDerWaalsContact OE2-CZ 3.24Å; E656-R722 IonicContact OE2-NE 2.7Å; E656-R722 PolarHBondContact OE2-NE 3.18Å; E656-R722 IonicContact OE2-NH2 3.4Å; E656-R722 PolarHBondContact OE2-NH2 3.44Å; R722-F724 PolarHBondContact O-N 2.93Å; R722-L725 HydrophobicContact CG-CD1 4.35Å; R722-L725 WeakPolarHBondContact O-CB 3.17Å; R722-L725 PolarHBondContact O-N 3.03Å; R722-L725 VanDerWaalsContact O-N 3.09Å; R722-D759 IonicContact NH1-OD1 3.31Å; R722-D759 PolarHBondContact NH1-OD1 3.1Å
723	Q	86.9	Confident	91	Very high	125 Å²	125	57.5 Å²	57.5	58%	0.584	26%	0.264	S	S	*	.	H	α-helix	trans	-56.3	-34.3	178.9	61.6	176.3	-22	0	0	113.9	E721	E721-Q723 HydrophobicContact CB-CG 4.45Å; E721-Q723 HydrophobicContact CG-CG 4.18Å; E721-Q723 PolarHBondContact O-N 3.33Å; E721-Q723 PolarHBondContact OE2-NE2 3.12Å
724	F	86.3	Confident	90.9	Very high	93 Å²	93	52.8 Å²	52.8	41%	0.408	24%	0.239	S	C	.	.	H	α-helix	trans	-82.7	-19.6	179.8	-61.2	-66.4	0	0	0	113.3	I720 E721 R722 K726 T727 Q728	I720-F724 HydrophobicContact CD1-CB 3.79Å; I720-F724 HydrophobicContact CG1-CB 3.84Å; E721-F724 HydrophobicContact CB-CD2 4.03Å; E721-F724 HydrophobicContact CB-CE2 4.34Å; E721-F724 PolarHBondContact O-N 2.75Å; R722-F724 PolarHBondContact O-N 2.93Å; F724-K726 PolarHBondContact O-N 3.31Å; F724-T727 PolarHBondContact O-N 2.85Å; F724-T727 PolarHBondContact O-OG1 3.31Å; F724-Q728 WeakPolarHBondContact O-CG 3.49Å
725	L	87.6	Confident	90.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-37.7	178.2	-67.6	174.4	0	0	0	111.6	Y654 L661 I720 R722 T727 Q728 L753 W758	Y654-L725 HydrophobicContact CD2-CD1 3.64Å; Y654-L725 HydrophobicContact CE2-CD1 4.06Å; Y654-L725 HydrophobicContact CG-CD1 3.96Å; L661-L725 HydrophobicContact CB-CD2 4.23Å; L661-L725 HydrophobicContact CD2-CD2 4.01Å; I720-L725 HydrophobicContact CD1-CD2 4.02Å; I720-L725 HydrophobicContact CG1-CD2 4.18Å; I720-L725 HydrophobicContact CG1-CG 4.45Å; I720-L725 HydrophobicContact CG2-CD2 3.68Å; I720-L725 HydrophobicContact CG2-CG 4.46Å; R722-L725 HydrophobicContact CG-CD1 4.35Å; R722-L725 WeakPolarHBondContact O-CB 3.17Å; R722-L725 PolarHBondContact O-N 3.03Å; R722-L725 VanDerWaalsContact O-N 3.09Å; L725-T727 PolarHBondContact O-N 2.79Å; L725-Q728 PolarHBondContact O-N 2.83Å; L725-Q728 VanDerWaalsContact O-N 3.1Å; L725-L753 HydrophobicContact CD2-CD1 4.13Å; L725-L753 VanDerWaalsContact O-CB 3.28Å; L725-L753 WeakPolarHBondContact O-CB 3.5Å; L725-W758 HydrophobicContact CB-CZ2 4.22Å; L725-W758 HydrophobicContact CD1-CH2 3.98Å; L725-W758 HydrophobicContact CD1-CZ2 3.86Å; L725-W758 HydrophobicContact CD1-CZ3 4.37Å; L725-W758 HydrophobicContact CG-CZ2 4.49Å
726	K	84.5	Confident	90.6	Very high	137 Å²	137	48.1 Å²	48.1	60%	0.596	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-4.4	174.1	-61.6	-170.1	175.8	-168.6	0	114.9	F724	F724-K726 PolarHBondContact O-N 3.31Å
727	T	84.4	Confident	90.5	Very high	75 Å²	75	53 Å²	53	46%	0.46	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120	22.4	179.1	69.1	0	0	0	0	112.1	F724 L725	F724-T727 PolarHBondContact O-N 2.85Å; F724-T727 PolarHBondContact O-OG1 3.31Å; L725-T727 PolarHBondContact O-N 2.79Å
728	Q	87.3	Confident	90.1	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.023	22%	0.22	C	C	.	.			trans	-136.3	149.1	-171.9	-62.7	-74.2	-88.4	0	0	111.9	L690 P691 I720 F724 L725 L753	L690-Q728 CarbonylContact O-C 3.42Å; L690-Q728 VanDerWaalsContact O-CA 3.29Å; L690-Q728 WeakPolarHBondContact O-CA 3.43Å; P691-Q728 PolarHBondContact O-NE2 2.8Å; P691-Q728 PolarHBondContact O-OE1 3.2Å; I720-Q728 HydrophobicContact CD1-CG 3.94Å; F724-Q728 WeakPolarHBondContact O-CG 3.49Å; L725-Q728 PolarHBondContact O-N 2.83Å; L725-Q728 VanDerWaalsContact O-N 3.1Å; Q728-L753 HydrophobicContact CB-CD1 4.24Å; Q728-L753 VanDerWaalsContact O-CB 3.23Å; Q728-L753 WeakPolarHBondContact O-CB 3.46Å; Q728-L753 PolarHBondContact O-N 2.94Å
729	K	90.3	Very high	89.8	Confident	89 Å²	89	53.3 Å²	53.3	39%	0.387	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138	165.8	-51.4	-166.9	-169.1	-127.6	0	109.4	L689 L690 E750 L751 D752	L689-K729 WeakPolarHBondContact CA-O 3.16Å; L690-K729 PolarHBondContact N-O 2.89Å; L690-K729 PolarHBondContact O-N 2.99Å; K729-E750 HydrophobicContact CB-CG 4.29Å; K729-L751 CarbonylContact C-O 3.48Å; K729-L751 VanDerWaalsContact CA-O 3.32Å; K729-L751 WeakPolarHBondContact CA-O 3.41Å; K729-D752 WeakPolarHBondContact CE-OD2 3.24Å; K729-D752 IonicContact NZ-OD2 2.73Å; K729-D752 PolarHBondContact NZ-OD2 2.82Å
730	L	92.4	Very high	89.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	107.5	171.7	177.4	68.2	0	0	0	109	F650 L652 V663 T687 L689 Y718 E750 L751 L753	F650-L730 HydrophobicContact CE2-CD2 4.27Å; L652-L730 HydrophobicContact CD1-CD2 4Å; L652-L730 HydrophobicContact CD2-CD2 3.51Å; L652-L730 HydrophobicContact CG-CD2 4.4Å; V663-L730 HydrophobicContact CG1-CD2 4.23Å; V663-L730 HydrophobicContact CG2-CD1 4.13Å; V663-L730 HydrophobicContact CG2-CD2 4.09Å; T687-L730 HydrophobicContact CG2-CD1 4.23Å; L689-L730 HydrophobicContact CD2-CB 4.2Å; L689-L730 HydrophobicContact CD2-CD1 3.88Å; Y718-L730 HydrophobicContact CE2-CD1 4.39Å; L730-E750 WeakPolarHBondContact O-CA 2.9Å; L730-L751 PolarHBondContact N-O 2.82Å; L730-L751 PolarHBondContact O-N 2.85Å; L730-L753 HydrophobicContact CB-CD1 4.24Å; L730-L753 HydrophobicContact CB-CD2 4.11Å; L730-L753 HydrophobicContact CB-CG 4.29Å
731	N	92.7	Very high	88.8	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.2	166.9	179.9	-81	0	0	0	109	T687 Y688 L690 E748 E750	T687-N731 CarbonylContact C-O 3.44Å; T687-N731 VanDerWaalsContact CA-O 3.29Å; T687-N731 WeakPolarHBondContact CA-O 3.41Å; Y688-N731 PolarHBondContact N-O 2.83Å; Y688-N731 PolarHBondContact O-N 3.13Å; L690-N731 HydrophobicContact CD1-CB 3.71Å; L690-N731 HydrophobicContact CG-CB 4.38Å; N731-E748 PolarHBondContact ND2-OE2 3.23Å; N731-E750 PolarHBondContact ND2-OE2 3.11Å; N731-E750 VanDerWaalsContact ND2-OE2 3.12Å
732	L	95.1	Very high	88.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113.6	176.3	-175.4	157	0	0	0	108.5	V648 F650 V663 V665 V685 K686 T687 V734 E748 V749	V648-L732 HydrophobicContact CG1-CD2 3.99Å; V648-L732 HydrophobicContact CG2-CD2 4.14Å; F650-L732 HydrophobicContact CD1-CD1 3.78Å; F650-L732 HydrophobicContact CD2-CD1 4.2Å; F650-L732 HydrophobicContact CE1-CD1 3.85Å; F650-L732 HydrophobicContact CE2-CD1 4.27Å; F650-L732 HydrophobicContact CG-CD1 3.95Å; F650-L732 HydrophobicContact CZ-CD1 4.09Å; V663-L732 HydrophobicContact CG1-CD1 4.4Å; V665-L732 HydrophobicContact CG2-CD1 4.35Å; V685-L732 HydrophobicContact CG1-CD1 4.22Å; V685-L732 HydrophobicContact CG1-CD2 3.57Å; V685-L732 HydrophobicContact CG1-CG 3.63Å; K686-L732 WeakPolarHBondContact O-CA 3.44Å; T687-L732 HydrophobicContact CG2-CB 3.88Å; T687-L732 HydrophobicContact CG2-CD1 3.82Å; T687-L732 HydrophobicContact CG2-CG 3.67Å; L732-V734 HydrophobicContact CD2-CG2 4.45Å; L732-E748 CarbonylContact O-C 3.56Å; L732-E748 VanDerWaalsContact O-CA 3.25Å; L732-E748 WeakPolarHBondContact O-CA 3.46Å; L732-E748 WeakPolarHBondContact O-CB 2.92Å; L732-V749 PolarHBondContact N-O 2.93Å; L732-V749 PolarHBondContact O-N 2.95Å
733	S	94.2	Very high	88.2	Confident	2 Å²	2	67 Å²	67	1%	0.014	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.7	-176.6	49.2	0	0	0	0	112.3	V685 K686 W735	V685-S733 WeakPolarHBondContact CA-O 3.45Å; K686-S733 PolarHBondContact N-O 2.69Å; K686-S733 PolarHBondContact O-N 3.16Å; S733-W735 VanDerWaalsContact CB-NE1 3.32Å; S733-W735 VanDerWaalsContact O-CD1 3.3Å; S733-W735 PolarHBondContact OG-NE1 3.07Å
734	V	95.8	Very high	88.3	Confident	0 Å²	0	63 Å²	63	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.6	180	-165.8	0	0	0	0	109.2	L671 P683 V685 L732 L746 G747 L771	L671-V734 HydrophobicContact CD1-CG1 3.98Å; L671-V734 HydrophobicContact CD2-CG1 4.15Å; P683-V734 HydrophobicContact CB-CG1 4.44Å; V685-V734 HydrophobicContact CG2-CG1 4.49Å; V685-V734 HydrophobicContact CG2-CG2 4.24Å; L732-V734 HydrophobicContact CD2-CG2 4.45Å; V734-L746 HydrophobicContact CB-CB 4.21Å; V734-L746 HydrophobicContact CG1-CB 4.19Å; V734-L746 HydrophobicContact CG1-CD1 4.25Å; V734-L746 WeakPolarHBondContact O-CA 3.14Å; V734-L746 WeakPolarHBondContact O-CB 3.32Å; V734-L746 PolarHBondContact O-N 2.65Å; V734-G747 PolarHBondContact N-O 3.28Å; V734-L771 HydrophobicContact CB-CD1 4.35Å; V734-L771 HydrophobicContact CG2-CD1 3.95Å; V734-L771 HydrophobicContact CG2-CD2 3.67Å
735	W	94.3	Very high	88.4	Confident	18 Å²	18	59.1 Å²	59.1	7%	0.068	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.3	-170.7	-65.7	75.6	0	0	0	111.2	F639 P683 Y684 K686 S733 N743 S744 F745	F639-W735 HydrophobicContact CD1-CH2 4.36Å; F639-W735 AromaticContact CE1-CH2 4Å; F639-W735 HydrophobicContact CE1-CH2 4Å; P683-W735 CarbonylContact C-O 3.6Å; P683-W735 VanDerWaalsContact CA-O 3.29Å; P683-W735 WeakPolarHBondContact CA-O 3.29Å; Y684-W735 HydrophobicContact CD1-CB 4.11Å; Y684-W735 WeakPolarHBondContact CD1-O 3.32Å; Y684-W735 HydrophobicContact CE1-CB 3.51Å; Y684-W735 WeakPolarHBondContact CE1-O 3.26Å; Y684-W735 HydrophobicContact CE2-CB 4.07Å; Y684-W735 HydrophobicContact CE2-CG 4.48Å; Y684-W735 VanDerWaalsContact CZ-CB 3.47Å; Y684-W735 PolarHBondContact N-O 3.5Å; Y684-W735 PolarHBondContact O-N 2.8Å; K686-W735 HydrophobicContact CD-CD2 4.25Å; K686-W735 HydrophobicContact CD-CG 3.96Å; K686-W735 VanDerWaalsContact CD-NE1 3.3Å; S733-W735 VanDerWaalsContact CB-NE1 3.32Å; S733-W735 VanDerWaalsContact O-CD1 3.3Å; S733-W735 PolarHBondContact OG-NE1 3.07Å; W735-N743 HydrophobicContact CE3-CB 4.2Å; W735-S744 CarbonylContact C-O 3.43Å; W735-S744 WeakPolarHBondContact CA-O 3.23Å; W735-F745 HydrophobicContact CD2-CD2 4.33Å; W735-F745 AromaticContact CE2-CD2 3.95Å; W735-F745 HydrophobicContact CE3-CB 4.37Å; W735-F745 HydrophobicContact CH2-CD2 4.31Å; W735-F745 AromaticContact CZ2-CD2 3.96Å; W735-F745 HydrophobicContact CZ2-CD2 3.96Å; W735-F745 HydrophobicContact CZ3-CB 4.34Å
736	H	92.6	Very high	88.6	Confident	21 Å²	21	59.1 Å²	59.1	10%	0.097	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.1	163.6	172.4	37.7	0	0	0	109.3	A674 D682 N743 S744 L746	A674-H736 HydrophobicContact CB-CB 3.87Å; A674-H736 WeakPolarHBondContact CB-CD2 3.09Å; D682-H736 PolarHBondContact N-CE1 2.75Å; D682-H736 PolarHBondContact N-ND1 2.81Å; D682-H736 CarbonylContact O-C 3.52Å; D682-H736 WeakPolarHBondContact O-CA 3.31Å; D682-H736 PolarHBondContact O-ND1 2.8Å; H736-N743 CarbonylContact O-C 3.57Å; H736-N743 WeakPolarHBondContact O-CA 3.34Å; H736-N743 WeakPolarHBondContact O-CB 3.35Å; H736-S744 PolarHBondContact N-O 2.8Å; H736-S744 PolarHBondContact O-N 2.77Å; H736-L746 HydrophobicContact CB-CD1 4.15Å; H736-L746 HydrophobicContact CB-CD2 4.14Å; H736-L746 HydrophobicContact CB-CG 4.22Å
737	R	92.8	Very high	89	Confident	114 Å²	114	52.6 Å²	52.6	43%	0.43	25%	0.245	S	C	.	.			trans	-83.7	105.9	162.2	-179.6	-177.9	167.9	-162.5	-3.2	110.5	D682 Y684 V703 N743	D682-R737 PolarHBondContact O-N 3.07Å; Y684-R737 HydrophobicContact CD1-CB 4.04Å; Y684-R737 HydrophobicContact CE1-CB 3.94Å; V703-R737 HydrophobicContact CG1-CB 3.86Å; V703-R737 HydrophobicContact CG2-CB 4.33Å; R737-N743 WeakPolarHBondContact CA-OD1 3.38Å
738	D	87	Confident	89.5	Confident	32 Å²	32	50.1 Å²	50.1	17%	0.171	23%	0.228	C	C	.	.			trans	-78.9	156.1	160.8	-160.3	-52.4	0	0	0	108.8	F740 K741 N743	D738-F740 PolarHBondContact OD1-N 2.85Å; D738-K741 HydrophobicContact CB-CB 4.08Å; D738-K741 PolarHBondContact OD1-N 2.67Å; D738-K741 WeakPolarHBondContact OD2-CB 3.45Å; D738-K741 VanDerWaalsContact OD2-CD 3.31Å; D738-K741 WeakPolarHBondContact OD2-CD 3.49Å; D738-K741 VanDerWaalsContact OD2-CG 3.3Å; D738-K741 WeakPolarHBondContact OD2-CG 3.29Å; D738-N743 PolarHBondContact N-OD1 3.22Å
739	T	86	Confident	89.8	Confident	89 Å²	89	50.4 Å²	50.4	55%	0.546	23%	0.23	S	C	.	.	S	Bend	trans	-102	-22.5	176.9	-61.8	0	0	0	0	112.3
740	F	79.7	Confident	89.9	Confident	198 Å²	198	50.8 Å²	50.8	87%	0.868	23%	0.233	S	C	*	.	S	Bend	trans	-123.3	-13.1	-175.5	-56.8	-73.9	0	0	0	113.5	D738	D738-F740 PolarHBondContact OD1-N 2.85Å
741	K	78.3	Confident	89.9	Confident	165 Å²	165	51.9 Å²	51.9	72%	0.717	24%	0.239	S	C	*	.	S	Bend	trans	-118.3	-174.3	176	-47.4	-179.9	-168.3	166.3	0	112.2	D738	D738-K741 HydrophobicContact CB-CB 4.08Å; D738-K741 PolarHBondContact OD1-N 2.67Å; D738-K741 WeakPolarHBondContact OD2-CB 3.45Å; D738-K741 VanDerWaalsContact OD2-CD 3.31Å; D738-K741 WeakPolarHBondContact OD2-CD 3.49Å; D738-K741 VanDerWaalsContact OD2-CG 3.3Å; D738-K741 WeakPolarHBondContact OD2-CG 3.29Å
742	R	78.7	Confident	89.8	Confident	182 Å²	182	54 Å²	54	69%	0.687	25%	0.25	S	C	*	.	P	Polyproline II helix	trans	-67.4	146.4	165.1	-62.3	-177.5	-170.4	157.3	12.9	109.6	D638 S744	D638-R742 IonicContact OD2-CZ 2.74Å; D638-R742 IonicContact OD2-NH1 3.54Å; D638-R742 PolarHBondContact OD2-NH1 3.36Å; R742-S744 PolarHBondContact O-N 3.36Å
743	N	86.1	Confident	89.5	Confident	61 Å²	61	54 Å²	54	33%	0.326	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-64.4	117.4	174.6	-69.5	-23.8	0	0	0	110.7	Y684 W735 H736 R737 D738	Y684-N743 PolarHBondContact OH-ND2 2.84Å; Y684-N743 VanDerWaalsContact OH-ND2 3.08Å; W735-N743 HydrophobicContact CE3-CB 4.2Å; H736-N743 CarbonylContact O-C 3.57Å; H736-N743 WeakPolarHBondContact O-CA 3.34Å; H736-N743 WeakPolarHBondContact O-CB 3.35Å; R737-N743 WeakPolarHBondContact CA-OD1 3.38Å; D738-N743 PolarHBondContact N-OD1 3.22Å
744	S	87.3	Confident	89.1	Confident	40 Å²	40	60 Å²	60	28%	0.28	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-67.7	142.4	176.5	-40.8	0	0	0	0	111.1	W735 H736 R742	W735-S744 CarbonylContact C-O 3.43Å; W735-S744 WeakPolarHBondContact CA-O 3.23Å; H736-S744 PolarHBondContact N-O 2.8Å; H736-S744 PolarHBondContact O-N 2.77Å; R742-S744 PolarHBondContact O-N 3.36Å
745	F	90	Very high	88.6	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.053	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.7	170.6	179.1	-97.8	0	0	0	109.8	F639 V644 W735 G747 E748 K774	F639-F745 HydrophobicContact CB-CB 4.21Å; F639-F745 HydrophobicContact CD1-CB 3.92Å; F639-F745 HydrophobicContact CD1-CD2 4.24Å; F639-F745 HydrophobicContact CD1-CG 4.07Å; F639-F745 HydrophobicContact CG-CB 4.46Å; V644-F745 HydrophobicContact CG2-CD1 4.05Å; V644-F745 HydrophobicContact CG2-CE1 3.94Å; W735-F745 HydrophobicContact CD2-CD2 4.33Å; W735-F745 AromaticContact CE2-CD2 3.95Å; W735-F745 HydrophobicContact CE3-CB 4.37Å; W735-F745 HydrophobicContact CH2-CD2 4.31Å; W735-F745 AromaticContact CZ2-CD2 3.96Å; W735-F745 HydrophobicContact CZ2-CD2 3.96Å; W735-F745 HydrophobicContact CZ3-CB 4.34Å; F745-G747 VanDerWaalsContact CZ-CA 3.45Å; F745-E748 HydrophobicContact CE2-CB 4.03Å; F745-E748 HydrophobicContact CE2-CG 4.47Å; F745-E748 HydrophobicContact CZ-CB 3.73Å; F745-E748 HydrophobicContact CZ-CG 3.88Å; F745-K774 HydrophobicContact CD1-CB 4.24Å; F745-K774 HydrophobicContact CE1-CB 3.55Å; F745-K774 HydrophobicContact CE2-CB 4.27Å; F745-K774 HydrophobicContact CE2-CD 3.98Å; F745-K774 HydrophobicContact CZ-CB 3.56Å; F745-K774 HydrophobicContact CZ-CD 4.04Å; F745-K774 HydrophobicContact CZ-CG 4.44Å
746	L	91.6	Very high	88.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-8.2	-179.5	-59.3	-178.6	0	0	0	113.4	L642 V644 L671 A672 A674 P683 V734 H736	L642-L746 HydrophobicContact CD2-CD2 3.54Å; V644-L746 WeakPolarHBondContact CG1-O 3.24Å; L671-L746 HydrophobicContact CD1-CD1 4.32Å; A672-L746 HydrophobicContact CB-CD2 4.31Å; A674-L746 HydrophobicContact CB-CD2 4.43Å; P683-L746 HydrophobicContact CB-CD1 4Å; V734-L746 HydrophobicContact CB-CB 4.21Å; V734-L746 HydrophobicContact CG1-CB 4.19Å; V734-L746 HydrophobicContact CG1-CD1 4.25Å; V734-L746 WeakPolarHBondContact O-CA 3.14Å; V734-L746 WeakPolarHBondContact O-CB 3.32Å; V734-L746 PolarHBondContact O-N 2.65Å; H736-L746 HydrophobicContact CB-CD1 4.15Å; H736-L746 HydrophobicContact CB-CD2 4.14Å; H736-L746 HydrophobicContact CB-CG 4.22Å
747	G	92.5	Very high	87.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.1	162.9	179.2	0	0	0	0	0	113.3	V734 F745 K772	V734-G747 PolarHBondContact N-O 3.28Å; F745-G747 VanDerWaalsContact CZ-CA 3.45Å; G747-K772 WeakPolarHBondContact CA-O 3.44Å
748	E	94	Very high	87.2	Confident	22 Å²	22	64.9 Å²	64.9	10%	0.103	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	163.9	174	73.3	-169.5	160.1	0	0	113.7	N731 L732 F745 K772 K774	N731-E748 PolarHBondContact ND2-OE2 3.23Å; L732-E748 CarbonylContact O-C 3.56Å; L732-E748 VanDerWaalsContact O-CA 3.25Å; L732-E748 WeakPolarHBondContact O-CA 3.46Å; L732-E748 WeakPolarHBondContact O-CB 2.92Å; F745-E748 HydrophobicContact CE2-CB 4.03Å; F745-E748 HydrophobicContact CE2-CG 4.47Å; F745-E748 HydrophobicContact CZ-CB 3.73Å; F745-E748 HydrophobicContact CZ-CG 3.88Å; E748-K772 PolarHBondContact N-O 2.89Å; E748-K772 PolarHBondContact O-N 3.5Å; E748-K774 WeakPolarHBondContact OE1-CD 3.31Å; E748-K774 WeakPolarHBondContact OE1-CE 3.02Å; E748-K774 WeakPolarHBondContact OE1-CG 3.22Å; E748-K774 IonicContact OE1-NZ 2.85Å; E748-K774 PolarHBondContact OE1-NZ 3.03Å; E748-K774 IonicContact OE2-NZ 2.73Å; E748-K774 PolarHBondContact OE2-NZ 3.11Å
749	V	94.1	Very high	86.6	Confident	11 Å²	11	69.1 Å²	69.1	7%	0.067	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.3	169.8	-174.9	0	0	0	0	106.4	V648 F650 L732 L751 Y769 L771	V648-V749 HydrophobicContact CG1-CG2 3.63Å; F650-V749 HydrophobicContact CE1-CG1 4.34Å; F650-V749 HydrophobicContact CZ-CG1 4.31Å; L732-V749 PolarHBondContact N-O 2.93Å; L732-V749 PolarHBondContact O-N 2.95Å; V749-L751 HydrophobicContact CG1-CD2 4.32Å; V749-L751 HydrophobicContact CG1-CG 4.31Å; V749-Y769 HydrophobicContact CG1-CD1 3.94Å; V749-Y769 HydrophobicContact CG1-CG 4.04Å; V749-L771 HydrophobicContact CG2-CD2 3.96Å
750	E	92.7	Very high	86.2	Confident	97 Å²	97	66.4 Å²	66.4	45%	0.453	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.9	169.5	-167.3	157.6	114.3	0	0	109	K729 L730 N731	K729-E750 HydrophobicContact CB-CG 4.29Å; L730-E750 WeakPolarHBondContact O-CA 2.9Å; N731-E750 PolarHBondContact ND2-OE2 3.11Å; N731-E750 VanDerWaalsContact ND2-OE2 3.12Å
751	L	91.4	Very high	85.9	Confident	25 Å²	25	65.5 Å²	65.5	13%	0.131	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.2	175.7	-63.8	179.9	0	0	0	109.2	F650 L652 K729 L730 V749 W756 Y769	F650-L751 HydrophobicContact CE2-CD1 3.62Å; F650-L751 HydrophobicContact CZ-CD1 3.54Å; F650-L751 HydrophobicContact CZ-CG 4.31Å; L652-L751 HydrophobicContact CD1-CD1 4Å; K729-L751 CarbonylContact C-O 3.48Å; K729-L751 VanDerWaalsContact CA-O 3.32Å; K729-L751 WeakPolarHBondContact CA-O 3.41Å; L730-L751 PolarHBondContact N-O 2.82Å; L730-L751 PolarHBondContact O-N 2.85Å; V749-L751 HydrophobicContact CG1-CD2 4.32Å; V749-L751 HydrophobicContact CG1-CG 4.31Å; L751-W756 HydrophobicContact CD1-CE3 4.22Å; L751-W756 HydrophobicContact CD1-CH2 4.3Å; L751-W756 HydrophobicContact CD1-CZ3 3.69Å; L751-Y769 HydrophobicContact CD1-CE1 4.24Å; L751-Y769 HydrophobicContact CD2-CD1 4.21Å; L751-Y769 HydrophobicContact CD2-CE1 3.69Å
752	D	90.6	Very high	85.4	Confident	44 Å²	44	64.7 Å²	64.7	24%	0.235	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	134.4	167.9	-148.6	-52.8	0	0	0	109.6	K729 E754	K729-D752 WeakPolarHBondContact CE-OD2 3.24Å; K729-D752 IonicContact NZ-OD2 2.73Å; K729-D752 PolarHBondContact NZ-OD2 2.82Å; D752-E754 WeakPolarHBondContact OD1-CB 3.34Å; D752-E754 PolarHBondContact OD1-N 3.08Å; D752-E754 VanDerWaalsContact OD1-N 3.1Å
753	L	89.6	Confident	85.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-97.9	-4.1	-178.8	-57.9	-176.8	0	0	0	112.4	L652 L661 L689 L725 Q728 L730 W758	L652-L753 HydrophobicContact CD1-CD2 3.99Å; L661-L753 HydrophobicContact CD2-CD1 4.06Å; L689-L753 HydrophobicContact CD2-CD1 3.69Å; L725-L753 HydrophobicContact CD2-CD1 4.13Å; L725-L753 VanDerWaalsContact O-CB 3.28Å; L725-L753 WeakPolarHBondContact O-CB 3.5Å; Q728-L753 HydrophobicContact CB-CD1 4.24Å; Q728-L753 VanDerWaalsContact O-CB 3.23Å; Q728-L753 WeakPolarHBondContact O-CB 3.46Å; Q728-L753 PolarHBondContact O-N 2.94Å; L730-L753 HydrophobicContact CB-CD1 4.24Å; L730-L753 HydrophobicContact CB-CD2 4.11Å; L730-L753 HydrophobicContact CB-CG 4.29Å; L753-W758 HydrophobicContact CB-CZ2 4.11Å; L753-W758 HydrophobicContact CD2-CH2 4.17Å; L753-W758 HydrophobicContact CD2-CZ2 4.13Å
754	E	86.2	Confident	84.6	Confident	130 Å²	130	59.2 Å²	59.2	61%	0.607	30%	0.296	S	S	*	.	S	Bend	trans	-72.1	-47.9	166.5	-172.7	176.2	-165.9	0	0	111.6	D752 W756	D752-E754 WeakPolarHBondContact OD1-CB 3.34Å; D752-E754 PolarHBondContact OD1-N 3.08Å; D752-E754 VanDerWaalsContact OD1-N 3.1Å; E754-W756 VanDerWaalsContact C-N 3.28Å; E754-W756 PolarHBondContact O-N 3.24Å
755	T	84.6	Confident	84.4	Confident	121 Å²	121	63.1 Å²	63.1	74%	0.742	31%	0.31	S	S	*	.	S	Bend	trans	-85.9	2.6	-179.1	59.1	0	0	0	0	113.6	D757	T755-D757 PolarHBondContact O-N 3.17Å
756	W	85.4	Confident	84.4	Confident	27 Å²	27	65.9 Å²	65.9	10%	0.102	33%	0.325	C	S	.	.			trans	-78.3	115.7	177	-170.6	-89.8	0	0	0	111	L652 L751 E754 W758 N763 Y769	L652-W756 HydrophobicContact CB-CZ2 3.8Å; L652-W756 HydrophobicContact CD1-CD2 4.01Å; L652-W756 HydrophobicContact CD1-CE3 4.21Å; L652-W756 HydrophobicContact CD1-CH2 4.03Å; L652-W756 HydrophobicContact CD1-CZ2 3.8Å; L652-W756 HydrophobicContact CD1-CZ3 4.23Å; L652-W756 HydrophobicContact CG-CH2 4.32Å; L652-W756 HydrophobicContact CG-CZ2 3.96Å; L751-W756 HydrophobicContact CD1-CE3 4.22Å; L751-W756 HydrophobicContact CD1-CH2 4.3Å; L751-W756 HydrophobicContact CD1-CZ3 3.69Å; E754-W756 VanDerWaalsContact C-N 3.28Å; E754-W756 PolarHBondContact O-N 3.24Å; W756-W758 HydrophobicContact CB-CZ2 4.14Å; W756-W758 AromaticContact CD1-CD2 3.62Å; W756-W758 AromaticContact CD1-CE2 3.59Å; W756-W758 AromaticContact CD1-CE3 3.78Å; W756-W758 AromaticContact CD1-CH2 3.86Å; W756-W758 AromaticContact CD1-CZ2 3.72Å; W756-W758 AromaticContact CD1-CZ3 3.9Å; W756-W758 HydrophobicContact CG-CH2 4.46Å; W756-W758 HydrophobicContact CG-CZ2 4.14Å; W756-W758 PolarHBondContact O-N 3.11Å; W756-W758 PolarHBondContact O-NE1 2.95Å; W756-W758 VanDerWaalsContact O-NE1 3.12Å; W756-N763 HydrophobicContact CH2-CB 4.36Å; W756-N763 HydrophobicContact CZ2-CB 3.59Å; W756-Y769 VanDerWaalsContact CH2-OH 3.25Å; W756-Y769 WeakPolarHBondContact CH2-OH 3.29Å; W756-Y769 WeakPolarHBondContact CZ3-OH 3.23Å
757	D	82.6	Confident	84.4	Confident	81 Å²	81	71.1 Å²	71.1	43%	0.433	35%	0.348	S	S	.	.			trans	-71.5	111	170.4	173.5	-3.3	0	0	0	109.8	T755 D759 S760 N763	T755-D757 PolarHBondContact O-N 3.17Å; D757-D759 PolarHBondContact OD1-N 2.89Å; D757-S760 VanDerWaalsContact CG-CB 3.43Å; D757-S760 PolarHBondContact OD1-N 2.99Å; D757-S760 WeakPolarHBondContact OD2-CB 3.48Å; D757-N763 WeakPolarHBondContact O-CB 3.44Å; D757-N763 PolarHBondContact O-ND2 2.84Å
758	W	81.9	Confident	84.6	Confident	25 Å²	25	76 Å²	76	10%	0.095	37%	0.367	C	S	.	.	S	Bend	trans	-82.4	-17	-176.8	-66.5	94.9	0	0	0	114	L661 L725 L753 W756 K764	L661-W758 HydrophobicContact CD1-CH2 3.54Å; L661-W758 HydrophobicContact CD1-CZ3 3.56Å; L725-W758 HydrophobicContact CB-CZ2 4.22Å; L725-W758 HydrophobicContact CD1-CH2 3.98Å; L725-W758 HydrophobicContact CD1-CZ2 3.86Å; L725-W758 HydrophobicContact CD1-CZ3 4.37Å; L725-W758 HydrophobicContact CG-CZ2 4.49Å; L753-W758 HydrophobicContact CB-CZ2 4.11Å; L753-W758 HydrophobicContact CD2-CH2 4.17Å; L753-W758 HydrophobicContact CD2-CZ2 4.13Å; W756-W758 HydrophobicContact CB-CZ2 4.14Å; W756-W758 AromaticContact CD1-CD2 3.62Å; W756-W758 AromaticContact CD1-CE2 3.59Å; W756-W758 AromaticContact CD1-CE3 3.78Å; W756-W758 AromaticContact CD1-CH2 3.86Å; W756-W758 AromaticContact CD1-CZ2 3.72Å; W756-W758 AromaticContact CD1-CZ3 3.9Å; W756-W758 HydrophobicContact CG-CH2 4.46Å; W756-W758 HydrophobicContact CG-CZ2 4.14Å; W756-W758 PolarHBondContact O-N 3.11Å; W756-W758 PolarHBondContact O-NE1 2.95Å; W756-W758 VanDerWaalsContact O-NE1 3.12Å; W758-K764 VanDerWaalsContact O-CE 3.23Å; W758-K764 WeakPolarHBondContact O-CE 3.45Å
759	D	76.1	Confident	84.6	Confident	122 Å²	122	76.2 Å²	76.2	65%	0.652	37%	0.367	S	S	*	.	S	Bend	trans	-109.6	-20.1	-166.7	-55.5	-45.5	0	0	0	111.3	R722 D757 K761	R722-D759 IonicContact NH1-OD1 3.31Å; R722-D759 PolarHBondContact NH1-OD1 3.1Å; D757-D759 PolarHBondContact OD1-N 2.89Å; D759-K761 PolarHBondContact O-N 2.75Å
760	S	75.9	Confident	84.7	Confident	31 Å²	31	80 Å²	80	22%	0.217	39%	0.392	C	S	.	.			trans	-59.7	121.1	166.2	169.2	0	0	0	0	112.9	D757 Q762 N763	D757-S760 VanDerWaalsContact CG-CB 3.43Å; D757-S760 PolarHBondContact OD1-N 2.99Å; D757-S760 WeakPolarHBondContact OD2-CB 3.48Å; S760-Q762 PolarHBondContact O-N 2.94Å; S760-Q762 PolarHBondContact OG-N 2.93Å; S760-Q762 VanDerWaalsContact OG-N 3.17Å; S760-N763 PolarHBondContact O-N 2.98Å; S760-N763 VanDerWaalsContact O-N 3.13Å
761	K	73.4	Confident	84.8	Confident	179 Å²	179	76.2 Å²	76.2	78%	0.778	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-12.6	172.6	-62.9	180	-178.4	175.9	0	113.9	D759 Q765	D759-K761 PolarHBondContact O-N 2.75Å; K761-Q765 WeakPolarHBondContact O-CG 3.06Å; K761-Q765 PolarHBondContact O-NE2 3.18Å
762	Q	69.6	Low	84.8	Confident	148 Å²	148	81.9 Å²	81.9	69%	0.692	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-37.4	176	-59.2	-174.4	9.3	0	0	112.1	S760 K764 Q765	S760-Q762 PolarHBondContact O-N 2.94Å; S760-Q762 PolarHBondContact OG-N 2.93Å; S760-Q762 VanDerWaalsContact OG-N 3.17Å; Q762-K764 VanDerWaalsContact C-N 3.25Å; Q762-K764 PolarHBondContact O-N 2.76Å; Q762-Q765 WeakPolarHBondContact O-CB 3.3Å; Q762-Q765 PolarHBondContact O-N 3.33Å
763	N	70.8	Confident	84.5	Confident	28 Å²	28	86.2 Å²	86.2	15%	0.15	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.1	-177.3	-77.4	-13	0	0	0	113.1	W756 D757 S760 Q765	W756-N763 HydrophobicContact CH2-CB 4.36Å; W756-N763 HydrophobicContact CZ2-CB 3.59Å; D757-N763 WeakPolarHBondContact O-CB 3.44Å; D757-N763 PolarHBondContact O-ND2 2.84Å; S760-N763 PolarHBondContact O-N 2.98Å; S760-N763 VanDerWaalsContact O-N 3.13Å; N763-Q765 VanDerWaalsContact C-N 3.25Å; N763-Q765 PolarHBondContact O-N 3Å
764	K	76.8	Confident	83.6	Confident	100 Å²	100	88 Å²	88	44%	0.435	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.4	170.1	-54.4	-164.7	-178.9	-138.8	0	113.7	D653 W758 Q762	D653-K764 WeakPolarHBondContact OD1-CE 3.47Å; D653-K764 IonicContact OD1-NZ 2.72Å; D653-K764 PolarHBondContact OD1-NZ 2.87Å; W758-K764 VanDerWaalsContact O-CE 3.23Å; W758-K764 WeakPolarHBondContact O-CE 3.45Å; Q762-K764 VanDerWaalsContact C-N 3.25Å; Q762-K764 PolarHBondContact O-N 2.76Å
765	Q	82.5	Confident	81.9	Confident	122 Å²	122	86.7 Å²	86.7	57%	0.57	42%	0.42	S	S	*	.	S	Bend	trans	-93.3	162.2	178.7	-61.6	175.4	44.2	0	0	112.1	A651 K761 Q762 N763 K767	A651-Q765 WeakPolarHBondContact CB-O 3.47Å; K761-Q765 WeakPolarHBondContact O-CG 3.06Å; K761-Q765 PolarHBondContact O-NE2 3.18Å; Q762-Q765 WeakPolarHBondContact O-CB 3.3Å; Q762-Q765 PolarHBondContact O-N 3.33Å; N763-Q765 VanDerWaalsContact C-N 3.25Å; N763-Q765 PolarHBondContact O-N 3Å; Q765-K767 PolarHBondContact O-N 3.18Å
766	L	90.9	Very high	80.1	Confident	70 Å²	70	83.6 Å²	83.6	37%	0.366	41%	0.407	S	S	.	.			trans	-73.8	89.4	-176.6	-80.3	174.5	0	0	0	112.8	Q649 A651 F664 A666	Q649-L766 HydrophobicContact CG-CB 4.03Å; Q649-L766 HydrophobicContact CG-CD2 4.45Å; Q649-L766 PolarHBondContact NE2-O 2.86Å; A651-L766 HydrophobicContact CB-CD2 4.12Å; F664-L766 HydrophobicContact CD1-CD2 3.7Å; F664-L766 HydrophobicContact CD1-CG 4.41Å; F664-L766 HydrophobicContact CE1-CD1 4.11Å; F664-L766 HydrophobicContact CE1-CD2 3.8Å; F664-L766 HydrophobicContact CE1-CG 4.26Å; A666-L766 HydrophobicContact CB-CD1 4.13Å; A666-L766 HydrophobicContact CB-CD2 3.64Å
767	K	91.4	Very high	77.9	Confident	111 Å²	111	88.2 Å²	88.2	48%	0.483	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143	-179.9	-171.5	161.5	177.4	174.2	0	111.8	Q649 F650 Q765 Y769	Q649-K767 WeakPolarHBondContact CA-O 3.3Å; F650-K767 PolarHBondContact N-O 2.8Å; F650-K767 VanDerWaalsContact N-O 3.12Å; F650-K767 PolarHBondContact O-N 2.86Å; F650-K767 VanDerWaalsContact O-N 3.08Å; Q765-K767 PolarHBondContact O-N 3.18Å; K767-Y769 HydrophobicContact CB-CE2 3.76Å; K767-Y769 HydrophobicContact CD-CE2 4.47Å; K767-Y769 HydrophobicContact CG-CE2 3.9Å; K767-Y769 WeakPolarHBondContact O-CD2 3.26Å
768	W	94.9	Very high	75.4	Confident	103 Å²	103	89.1 Å²	89.1	39%	0.39	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	137.3	174.2	-74.5	99.9	0	0	0	111.1	S647 Q649 Q667 K669	S647-W768 WeakPolarHBondContact OG-CZ3 3.43Å; Q649-W768 HydrophobicContact CB-CD2 3.72Å; Q649-W768 HydrophobicContact CB-CE3 3.69Å; Q649-W768 HydrophobicContact CB-CG 4.39Å; Q649-W768 HydrophobicContact CB-CH2 3.96Å; Q649-W768 HydrophobicContact CB-CZ2 3.98Å; Q649-W768 HydrophobicContact CB-CZ3 3.82Å; Q649-W768 VanDerWaalsContact CD-CE2 3.48Å; Q649-W768 HydrophobicContact CG-CD2 3.84Å; Q649-W768 HydrophobicContact CG-CE3 4.34Å; Q649-W768 HydrophobicContact CG-CG 4.09Å; Q649-W768 HydrophobicContact CG-CZ2 4.24Å; Q667-W768 HydrophobicContact CG-CH2 3.84Å; Q667-W768 HydrophobicContact CG-CZ2 4.3Å; K669-W768 HydrophobicContact CB-CH2 3.79Å; K669-W768 HydrophobicContact CB-CZ3 3.73Å
769	Y	95.4	Very high	73.1	Confident	25 Å²	25	92.7 Å²	92.7	10%	0.098	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.7	176.6	-65.2	-91.3	0	0	0	110.1	S647 V648 F650 V749 L751 W756 K767	S647-Y769 CarbonylContact C-O 3.53Å; S647-Y769 WeakPolarHBondContact CA-O 3.32Å; S647-Y769 VanDerWaalsContact CB-O 3.29Å; S647-Y769 WeakPolarHBondContact CB-O 3.24Å; V648-Y769 PolarHBondContact N-O 2.87Å; V648-Y769 PolarHBondContact O-N 2.91Å; F650-Y769 AromaticContact CD1-CD2 3.66Å; F650-Y769 HydrophobicContact CD1-CD2 3.66Å; F650-Y769 HydrophobicContact CD1-CE2 4.09Å; F650-Y769 AromaticContact CE1-CD2 3.21Å; F650-Y769 HydrophobicContact CE1-CD2 3.21Å; F650-Y769 AromaticContact CE1-CE2 3.7Å; F650-Y769 HydrophobicContact CE1-CE2 3.7Å; F650-Y769 AromaticContact CE1-CG 3.74Å; F650-Y769 HydrophobicContact CE1-CG 3.74Å; F650-Y769 HydrophobicContact CE2-CD2 4.49Å; F650-Y769 HydrophobicContact CE2-CE2 4.16Å; F650-Y769 HydrophobicContact CG-CD2 4.47Å; F650-Y769 HydrophobicContact CG-CE2 4.5Å; F650-Y769 AromaticContact CZ-CD2 3.7Å; F650-Y769 HydrophobicContact CZ-CD2 3.7Å; F650-Y769 AromaticContact CZ-CE2 3.74Å; F650-Y769 HydrophobicContact CZ-CE2 3.74Å; F650-Y769 HydrophobicContact CZ-CG 4.19Å; V749-Y769 HydrophobicContact CG1-CD1 3.94Å; V749-Y769 HydrophobicContact CG1-CG 4.04Å; L751-Y769 HydrophobicContact CD1-CE1 4.24Å; L751-Y769 HydrophobicContact CD2-CD1 4.21Å; L751-Y769 HydrophobicContact CD2-CE1 3.69Å; W756-Y769 VanDerWaalsContact CH2-OH 3.25Å; W756-Y769 WeakPolarHBondContact CH2-OH 3.29Å; W756-Y769 WeakPolarHBondContact CZ3-OH 3.23Å; K767-Y769 HydrophobicContact CB-CE2 3.76Å; K767-Y769 HydrophobicContact CD-CE2 4.47Å; K767-Y769 HydrophobicContact CG-CE2 3.9Å; K767-Y769 WeakPolarHBondContact O-CD2 3.26Å
770	P	96.1	Very high	71.2	Confident	92 Å²	92	93.6 Å²	93.6	60%	0.597	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	137	174.4	29.4	-33.8	0	0	0	110.1
771	L	95.1	Very high	69.2	Low	16 Å²	16	99.3 Å²	99.3	8%	0.084	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-76.9	129.3	177.5	-66.8	178	0	0	0	110.6	V644 G646 V648 L671 V734 V749	V644-L771 HydrophobicContact CG1-CB 3.92Å; G646-L771 WeakPolarHBondContact O-CB 3.13Å; G646-L771 PolarHBondContact O-N 2.94Å; V648-L771 HydrophobicContact CB-CD2 4.21Å; V648-L771 HydrophobicContact CG1-CD2 3.72Å; L671-L771 HydrophobicContact CD2-CD1 3.27Å; V734-L771 HydrophobicContact CB-CD1 4.35Å; V734-L771 HydrophobicContact CG2-CD1 3.95Å; V734-L771 HydrophobicContact CG2-CD2 3.67Å; V749-L771 HydrophobicContact CG2-CD2 3.96Å
772	K	91.6	Very high	67.8	Low	144 Å²	144	95.8 Å²	95.8	63%	0.626	50%	0.504	S	S	*	.	B	Isolated β-bridge	trans	-96.1	146.2	177.6	-62.9	-178	-179.9	179.5	0	110.8	G747 E748	G747-K772 WeakPolarHBondContact CA-O 3.44Å; E748-K772 PolarHBondContact N-O 2.89Å; E748-K772 PolarHBondContact O-N 3.5Å
773	R	84.4	Confident	67	Low	135 Å²	135	94.3 Å²	94.3	51%	0.509	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-56.8	142.3	161.8	-81.8	-175.5	168.8	94.8	-10.4	108.3	E643 V644 T775	E643-R773 IonicContact OE1-CZ 3.45Å; E643-R773 IonicContact OE1-NH1 3.26Å; E643-R773 PolarHBondContact OE1-NH1 2.86Å; E643-R773 IonicContact OE1-NH2 2.93Å; E643-R773 PolarHBondContact OE1-NH2 3.07Å; V644-R773 HydrophobicContact CB-CG 3.78Å; V644-R773 HydrophobicContact CG2-CG 4.03Å; R773-T775 PolarHBondContact O-N 3.15Å
774	K	69.4	Low	66.5	Low	37 Å²	37	98.6 Å²	98.6	16%	0.161	52%	0.52	C	S	.	.			trans	-78.1	93.7	170.9	-169.3	147	-170.5	79	0	108.6	V634 F639 F745 E748 A776	V634-K774 WeakPolarHBondContact O-CE 3.41Å; F639-K774 HydrophobicContact CD1-CD 4.35Å; F639-K774 HydrophobicContact CD2-CB 4.03Å; F639-K774 HydrophobicContact CD2-CD 4.06Å; F639-K774 HydrophobicContact CD2-CG 3.87Å; F639-K774 HydrophobicContact CE1-CD 3.82Å; F639-K774 HydrophobicContact CE2-CB 4.24Å; F639-K774 HydrophobicContact CE2-CD 3.49Å; F639-K774 VanDerWaalsContact CE2-CD 3.49Å; F639-K774 HydrophobicContact CE2-CG 3.57Å; F639-K774 HydrophobicContact CG-CB 4.39Å; F639-K774 HydrophobicContact CG-CD 4.47Å; F639-K774 HydrophobicContact CZ-CD 3.36Å; F639-K774 HydrophobicContact CZ-CG 4.02Å; F745-K774 HydrophobicContact CD1-CB 4.24Å; F745-K774 HydrophobicContact CE1-CB 3.55Å; F745-K774 HydrophobicContact CE2-CB 4.27Å; F745-K774 HydrophobicContact CE2-CD 3.98Å; F745-K774 HydrophobicContact CZ-CB 3.56Å; F745-K774 HydrophobicContact CZ-CD 4.04Å; F745-K774 HydrophobicContact CZ-CG 4.44Å; E748-K774 WeakPolarHBondContact OE1-CD 3.31Å; E748-K774 WeakPolarHBondContact OE1-CE 3.02Å; E748-K774 WeakPolarHBondContact OE1-CG 3.22Å; E748-K774 IonicContact OE1-NZ 2.85Å; E748-K774 PolarHBondContact OE1-NZ 3.03Å; E748-K774 IonicContact OE2-NZ 2.73Å; E748-K774 PolarHBondContact OE2-NZ 3.11Å; K774-A776 PolarHBondContact O-N 3.33Å
775	T	51.3	Low	66.7	Low	104 Å²	104	95 Å²	95	64%	0.638	50%	0.504	S	S	*	.			trans	-59.1	106.6	165.3	-52.4	0	0	0	0	106.7	R773 V778	R773-T775 PolarHBondContact O-N 3.15Å; T775-V778 HydrophobicContact CG2-CG2 3.92Å
776	A	45.8	Very low	67	Low	56 Å²	56	89.7 Å²	89.7	46%	0.463	48%	0.481	S	S	.	.			trans	-53.5	134.3	162.4	0	0	0	0	0	106.6	K774 V778	K774-A776 PolarHBondContact O-N 3.33Å; A776-V778 PolarHBondContact O-N 3.4Å
777	P	39.9	Very low	67.2	Low	123 Å²	123	90.7 Å²	90.7	80%	0.799	48%	0.484	S	S	*	.			trans	-55.6	108.9	-164.7	20.3	-32.4	0	0	0	110.3
778	V	30.8	Very low	67.5	Low	101 Å²	101	85.4 Å²	85.4	61%	0.612	46%	0.461	S	S	*	.			trans	-52.2	139.8	158.9	173.2	0	0	0	0	105.8	T775 A776 L780	T775-V778 HydrophobicContact CG2-CG2 3.92Å; A776-V778 PolarHBondContact O-N 3.4Å; V778-L780 VanDerWaalsContact C-N 3.28Å; V778-L780 WeakPolarHBondContact O-CB 3.2Å; V778-L780 PolarHBondContact O-N 3.29Å
779	A	32.4	Very low	67.6	Low	100 Å²	100	83.4 Å²	83.4	83%	0.826	46%	0.455	S	S	*	.	S	Bend	trans	-59.7	94.8	178.8	0	0	0	0	0	109.1
780	L	36.1	Very low	67.8	Low	141 Å²	141	82.2 Å²	82.2	74%	0.738	45%	0.45	S	S	*	.			trans	-138.8	84.7	-174.4	-167	151	0	0	0	105.7	V778	V778-L780 VanDerWaalsContact C-N 3.28Å; V778-L780 WeakPolarHBondContact O-CB 3.2Å; V778-L780 PolarHBondContact O-N 3.29Å
781	E	34.9	Very low	67.9	Low	151 Å²	151	77.9 Å²	77.9	71%	0.706	42%	0.422	S	S	*	.	S	Bend	trans	52.7	95.5	154.9	-44.8	-42.1	96	0	0	116.7	E783	E781-E783 PolarHBondContact O-N 3.24Å
782	T	44.5	Very low	68	Low	104 Å²	104	77.1 Å²	77.1	64%	0.638	42%	0.418	S	S	*	.			trans	51.8	69	136.1	14.2	0	0	0	0	116.9	N784	T782-N784 VanDerWaalsContact CB-OD1 3.31Å; T782-N784 WeakPolarHBondContact CB-OD1 3.41Å; T782-N784 WeakPolarHBondContact CG2-OD1 3.48Å; T782-N784 PolarHBondContact O-N 3.14Å
783	E	52.2	Low	68.2	Low	117 Å²	117	71.6 Å²	71.6	55%	0.547	40%	0.395	S	S	.	.			trans	-59.4	99.8	134.6	-90.9	-167.8	177.9	0	0	106.7	E781 R785	E781-E783 PolarHBondContact O-N 3.24Å; E783-R785 VanDerWaalsContact O-CG 3.29Å; E783-R785 WeakPolarHBondContact O-CG 3.15Å; E783-R785 PolarHBondContact O-N 3.23Å; E783-R785 IonicContact OE2-CZ 2.85Å; E783-R785 IonicContact OE2-NE 3.96Å; E783-R785 PolarHBondContact OE2-NE 2.9Å; E783-R785 IonicContact OE2-NH2 3.47Å; E783-R785 PolarHBondContact OE2-NH2 2.96Å
784	N	59.9	Low	68.8	Low	119 Å²	119	65.8 Å²	65.8	64%	0.636	37%	0.373	S	S	*	.			trans	-61	102.8	177	-79.9	18.3	0	0	0	109.9	T782 G786	T782-N784 VanDerWaalsContact CB-OD1 3.31Å; T782-N784 WeakPolarHBondContact CB-OD1 3.41Å; T782-N784 WeakPolarHBondContact CG2-OD1 3.48Å; T782-N784 PolarHBondContact O-N 3.14Å; N784-G786 VanDerWaalsContact C-N 3.25Å
785	R	80.2	Confident	69.9	Low	25 Å²	25	65.6 Å²	65.6	9%	0.094	38%	0.375	C	S	.	.			trans	-90	6.6	178.8	-66.7	-95.6	162.6	-178.6	-7	112.3	E783 P821 L893 L940 M942	E783-R785 VanDerWaalsContact O-CG 3.29Å; E783-R785 WeakPolarHBondContact O-CG 3.15Å; E783-R785 PolarHBondContact O-N 3.23Å; E783-R785 IonicContact OE2-CZ 2.85Å; E783-R785 IonicContact OE2-NE 3.96Å; E783-R785 PolarHBondContact OE2-NE 2.9Å; E783-R785 IonicContact OE2-NH2 3.47Å; E783-R785 PolarHBondContact OE2-NH2 2.96Å; R785-P821 VanDerWaalsContact C-CD 3.47Å; R785-P821 WeakPolarHBondContact O-CD 3.24Å; R785-L893 WeakPolarHBondContact CD-O 3.16Å; R785-L893 PolarHBondContact NH1-O 3.45Å; R785-L940 HydrophobicContact CB-CB 3.77Å; R785-L940 VanDerWaalsContact CB-O 3.23Å; R785-L940 WeakPolarHBondContact CB-O 3.28Å; R785-L940 WeakPolarHBondContact O-CD1 3.23Å; R785-M942 VanDerWaalsContact NH2-CE 3.31Å
786	G	89.6	Confident	71.8	Confident	9 Å²	9	62.8 Å²	62.8	9%	0.093	36%	0.359	C	S	.	.			trans	80.3	178.3	-162.9	0	0	0	0	0	112.7	N784 L818 D819 L940	N784-G786 VanDerWaalsContact C-N 3.25Å; G786-L818 CarbonylContact C-O 3.51Å; G786-L818 WeakPolarHBondContact CA-O 3.45Å; G786-D819 VanDerWaalsContact CA-O 3.24Å; G786-D819 WeakPolarHBondContact CA-O 3.01Å; G786-D819 PolarHBondContact N-O 3.44Å; G786-L940 VanDerWaalsContact O-CB 3.3Å; G786-L940 WeakPolarHBondContact O-CB 3.26Å; G786-L940 PolarHBondContact O-N 2.64Å
787	E	95.5	Very high	73.3	Confident	91 Å²	91	64.3 Å²	64.3	43%	0.425	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	158.8	175.8	-61.6	176.9	175.9	0	0	109.7	C817 L818 T937 L938	E787-C817 CarbonylContact O-C 3.49Å; E787-C817 WeakPolarHBondContact O-CA 3.19Å; E787-C817 VanDerWaalsContact O-CB 3.3Å; E787-C817 WeakPolarHBondContact O-CB 3.42Å; E787-L818 HydrophobicContact CB-CB 4.45Å; E787-L818 PolarHBondContact N-O 2.9Å; E787-L818 PolarHBondContact O-N 3.02Å; E787-T937 HydrophobicContact CB-CG2 3.71Å; E787-T937 HydrophobicContact CG-CG2 4.35Å; E787-T937 WeakPolarHBondContact OE2-CG2 3.46Å; E787-L938 WeakPolarHBondContact CA-O 3.49Å
788	M	97.2	Very high	74.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.4	168.5	-178.7	-176.6	-66.1	0	0	110.3	L790 V814 V832 L880 V882 L896 T937 L938 L940	M788-L790 HydrophobicContact CG-CD2 3.99Å; M788-L790 HydrophobicContact SD-CD2 3.86Å; M788-V814 HydrophobicContact SD-CG1 4.17Å; M788-V832 HydrophobicContact CE-CB 4.45Å; M788-V832 HydrophobicContact CE-CG1 3.78Å; M788-V832 HydrophobicContact CE-CG2 3.75Å; M788-L880 HydrophobicContact SD-CB 4.47Å; M788-L880 HydrophobicContact SD-CD1 4.05Å; M788-V882 HydrophobicContact CE-CG2 3.39Å; M788-L896 HydrophobicContact CB-CD1 4.11Å; M788-L896 HydrophobicContact SD-CD1 4.23Å; M788-T937 WeakPolarHBondContact O-CA 3.39Å; M788-L938 PolarHBondContact N-O 2.77Å; M788-L938 PolarHBondContact O-N 2.95Å; M788-L940 HydrophobicContact CB-CD2 4.06Å; M788-L940 HydrophobicContact CB-CG 4.38Å; M788-L940 HydrophobicContact CE-CD2 4.26Å
789	K	98	Very high	75.8	Confident	61 Å²	61	64.1 Å²	64.1	27%	0.265	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.2	173	-171.7	-170.5	-170.4	176.1	0	109.5	K815 E816 E935 A936 T937	K789-K815 WeakPolarHBondContact O-CB 2.89Å; K789-K815 PolarHBondContact O-N 2.87Å; K789-E816 HydrophobicContact CB-CG 3.87Å; K789-E816 HydrophobicContact CD-CG 3.82Å; K789-E816 WeakPolarHBondContact CD-OE1 3.09Å; K789-E816 WeakPolarHBondContact CE-OE1 3.14Å; K789-E816 PolarHBondContact N-O 2.7Å; K789-E816 IonicContact NZ-OE1 2.64Å; K789-E816 PolarHBondContact NZ-OE1 3.39Å; K789-E816 PolarHBondContact O-N 2.79Å; K789-E935 VanDerWaalsContact CE-OE1 3.25Å; K789-E935 WeakPolarHBondContact CE-OE1 3.37Å; K789-A936 WeakPolarHBondContact CA-O 3.49Å; K789-T937 HydrophobicContact CB-CG2 4.48Å
790	L	98.2	Very high	76.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.8	-175.3	69	109.8	0	0	0	111.2	M788 L792 W813 L880 L896 I898 L922 E935 A936 L938	M788-L790 HydrophobicContact CG-CD2 3.99Å; M788-L790 HydrophobicContact SD-CD2 3.86Å; L790-L792 HydrophobicContact CD1-CD2 3.65Å; L790-L792 HydrophobicContact CD1-CG 3.89Å; L790-W813 CarbonylContact C-O 3.52Å; L790-W813 VanDerWaalsContact CA-O 3.24Å; L790-W813 WeakPolarHBondContact CA-O 3.47Å; L790-W813 WeakPolarHBondContact CB-O 3.48Å; L790-L880 HydrophobicContact CD2-CD1 4.06Å; L790-L896 HydrophobicContact CD2-CD1 3.6Å; L790-I898 HydrophobicContact CD1-CD1 3.8Å; L790-I898 HydrophobicContact CD2-CD1 3.86Å; L790-I898 HydrophobicContact CG-CD1 4.47Å; L790-L922 HydrophobicContact CD1-CD2 3.83Å; L790-L922 HydrophobicContact CG-CD2 4.38Å; L790-E935 WeakPolarHBondContact O-CA 3.17Å; L790-A936 PolarHBondContact N-O 3.3Å; L790-A936 PolarHBondContact O-N 3.23Å; L790-A936 VanDerWaalsContact O-N 3.1Å; L790-A936 VanDerWaalsContact O-O 3.12Å; L790-L938 HydrophobicContact CD2-CD1 4.42Å
791	A	98.1	Very high	77.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.008	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146.1	170.4	0	0	0	0	0	111	W813 W933 V934 E935	A791-W813 HydrophobicContact CB-CB 4.46Å; A791-W813 HydrophobicContact CB-CE3 4.19Å; A791-W813 PolarHBondContact N-O 2.88Å; A791-W813 PolarHBondContact O-N 3.15Å; A791-W933 HydrophobicContact CB-CE3 3.66Å; A791-W933 HydrophobicContact CB-CZ3 4.2Å; A791-W933 WeakPolarHBondContact O-CZ3 3.04Å; A791-V934 CarbonylContact C-O 3.53Å; A791-V934 WeakPolarHBondContact CA-O 3.3Å; A791-E935 HydrophobicContact CB-CB 4.06Å
792	L	97.8	Very high	78.4	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151.4	175.7	-57	-175	0	0	0	110.4	L790 H811 I812 I898 L922 W923 M926 W933 V934	L790-L792 HydrophobicContact CD1-CD2 3.65Å; L790-L792 HydrophobicContact CD1-CG 3.89Å; L792-H811 WeakPolarHBondContact CA-O 3.16Å; L792-I812 HydrophobicContact CD2-CB 4.18Å; L792-I812 HydrophobicContact CD2-CG1 3.91Å; L792-I812 HydrophobicContact CD2-CG2 3.94Å; L792-I898 HydrophobicContact CD1-CG2 3.98Å; L792-L922 HydrophobicContact CD1-CD2 4.12Å; L792-L922 HydrophobicContact CD1-CG 4.04Å; L792-L922 HydrophobicContact CG-CD2 4.26Å; L792-L922 HydrophobicContact CG-CG 4.41Å; L792-W923 HydrophobicContact CD1-CE3 3.8Å; L792-W923 HydrophobicContact CD1-CZ3 4.09Å; L792-M926 HydrophobicContact CB-CB 4.25Å; L792-M926 HydrophobicContact CB-CG 3.96Å; L792-M926 HydrophobicContact CB-SD 3.71Å; L792-M926 HydrophobicContact CD1-SD 4.16Å; L792-W933 CarbonylContact O-C 3.56Å; L792-W933 WeakPolarHBondContact O-CA 3.42Å; L792-V934 HydrophobicContact CB-CG2 4.05Å; L792-V934 PolarHBondContact N-O 2.66Å; L792-V934 WeakPolarHBondContact O-CG2 3.06Å; L792-V934 PolarHBondContact O-N 3.22Å
793	Q	96.7	Very high	78.8	Confident	28 Å²	28	69 Å²	69	13%	0.131	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	127	170.4	179	-172.2	42.2	0	0	108.8	V795 H811 N931 W933	Q793-V795 HydrophobicContact CG-CG2 3.89Å; Q793-H811 HydrophobicContact CB-CB 4.25Å; Q793-H811 PolarHBondContact N-O 3.35Å; Q793-H811 PolarHBondContact O-N 3.19Å; Q793-N931 PolarHBondContact NE2-O 2.88Å; Q793-W933 HydrophobicContact CB-CD2 3.72Å; Q793-W933 HydrophobicContact CB-CE3 3.76Å; Q793-W933 HydrophobicContact CB-CG 4.19Å; Q793-W933 HydrophobicContact CB-CH2 4.31Å; Q793-W933 HydrophobicContact CB-CZ2 4.25Å; Q793-W933 HydrophobicContact CB-CZ3 4.07Å; Q793-W933 HydrophobicContact CG-CD2 4.49Å; Q793-W933 VanDerWaalsContact OE1-CE2 3.27Å; Q793-W933 VanDerWaalsContact OE1-NE1 3.16Å
794	Y	95.3	Very high	78.7	Confident	13 Å²	13	70.5 Å²	70.5	5%	0.051	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129	166.6	175.8	-125.5	0	0	0	109.4	P796 E809 V810 F868 L873 N931	Y794-P796 HydrophobicContact CD1-CG 4.07Å; Y794-P796 HydrophobicContact CE1-CB 4.33Å; Y794-P796 HydrophobicContact CE1-CG 3.69Å; Y794-E809 WeakPolarHBondContact CD2-O 2.98Å; Y794-V810 HydrophobicContact CD2-CG2 3.93Å; Y794-F868 HydrophobicContact CE2-CB 4.32Å; Y794-L873 HydrophobicContact CD1-CD1 3.68Å; Y794-L873 HydrophobicContact CD2-CD1 4.04Å; Y794-L873 HydrophobicContact CD2-CD2 4.26Å; Y794-L873 HydrophobicContact CE1-CD1 3.59Å; Y794-L873 HydrophobicContact CE2-CD1 3.97Å; Y794-L873 HydrophobicContact CE2-CD2 4.44Å; Y794-L873 HydrophobicContact CG-CD1 3.91Å; Y794-N931 PolarHBondContact O-N 3.5Å
795	V	94	Very high	78.4	Confident	34 Å²	34	68.3 Å²	68.3	21%	0.206	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	97.9	179.7	-179.3	0	0	0	0	108.2	Q793 G808 E809	Q793-V795 HydrophobicContact CG-CG2 3.89Å; V795-G808 CarbonylContact O-C 3.49Å; V795-G808 WeakPolarHBondContact O-CA 3.32Å; V795-E809 PolarHBondContact N-O 3.06Å; V795-E809 PolarHBondContact O-N 2.64Å
796	P	89.6	Confident	77.9	Confident	45 Å²	45	70.6 Å²	70.6	29%	0.292	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-60.2	140	171.6	-17.6	28.8	0	0	0	110.8	Y794 P798 P930	Y794-P796 HydrophobicContact CD1-CG 4.07Å; Y794-P796 HydrophobicContact CE1-CB 4.33Å; Y794-P796 HydrophobicContact CE1-CG 3.69Å; P796-P798 WeakPolarHBondContact O-CD 3.43Å; P796-P930 HydrophobicContact CG-CB 3.91Å
797	E	79.4	Confident	77.6	Confident	88 Å²	88	72.2 Å²	72.2	41%	0.411	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-65.9	121.3	174	-177.9	171.1	-146.2	0	0	110.1	P805 T807	E797-P805 WeakPolarHBondContact OE2-CB 3.19Å; E797-T807 WeakPolarHBondContact CB-O 3.47Å
798	P	64.9	Low	77.4	Confident	106 Å²	106	68 Å²	68	69%	0.688	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-68.9	137.7	172.3	29.7	-33.6	0	0	0	109.1	P796 P800	P796-P798 WeakPolarHBondContact O-CD 3.43Å; P798-P800 WeakPolarHBondContact O-CD 3.35Å
799	S	56.5	Low	77.2	Confident	114 Å²	114	71 Å²	71	80%	0.797	40%	0.398	S	S	*	.			trans	-110.8	73.9	-164.4	50.7	0	0	0	0	115.8	G801	S799-G801 PolarHBondContact O-N 2.64Å
800	P	51.4	Low	77.1	Confident	125 Å²	125	68 Å²	68	81%	0.812	39%	0.386	S	S	*	.			trans	-85.9	84.7	173.7	35.9	-35	0	0	0	112.6	P798	P798-P800 WeakPolarHBondContact O-CD 3.35Å
801	G	55	Low	77	Confident	61 Å²	61	68.9 Å²	68.9	63%	0.629	39%	0.39	S	S	*	.	S	Bend	trans	101.6	103.6	150.1	0	0	0	0	0	119.2	S799 K803	S799-G801 PolarHBondContact O-N 2.64Å; G801-K803 VanDerWaalsContact C-N 3.32Å; G801-K803 PolarHBondContact O-N 2.88Å
802	K	51.3	Low	77	Confident	221 Å²	221	68.9 Å²	68.9	96%	0.961	39%	0.389	S	S	*	.	S	Bend	trans	58.9	6.2	147.1	-73.7	-168.1	173.9	-175.4	0	120.5
803	K	54.7	Low	77	Confident	192 Å²	192	69.7 Å²	69.7	84%	0.835	39%	0.392	S	S	*	.	S	Bend	trans	-136.6	132.6	161.6	-66.9	-167.9	177.9	-172	0	110.8	G801	G801-K803 VanDerWaalsContact C-N 3.32Å; G801-K803 PolarHBondContact O-N 2.88Å
804	L	49.6	Very low	77	Confident	147 Å²	147	68.4 Å²	68.4	77%	0.77	39%	0.386	S	S	*	.			trans	-64.8	123.8	176.9	-143	74.7	0	0	0	108.7	T806	L804-T806 HydrophobicContact CD1-CG2 3.55Å; L804-T806 HydrophobicContact CG-CG2 3.96Å
805	P	54.4	Low	77.1	Confident	74 Å²	74	68.7 Å²	68.7	48%	0.481	39%	0.388	S	S	.	.				-114.3	171.5	90.7	-2	22	0	0	0	113.1	E797	E797-P805 WeakPolarHBondContact OE2-CB 3.19Å
806	T	69.2	Low	77.3	Confident	72 Å²	72	69.2 Å²	69.2	44%	0.442	39%	0.388	S	S	.	.			trans	-140.1	40.5	178.5	52.5	0	0	0	0	110.2	L804	L804-T806 HydrophobicContact CD1-CG2 3.55Å; L804-T806 HydrophobicContact CG-CG2 3.96Å
807	T	83.3	Confident	77.6	Confident	43 Å²	43	67.1 Å²	67.1	26%	0.264	37%	0.374	S	S	.	.			trans	-125.7	113.9	-167	48.4	0	0	0	0	111.4	E797 G867 F868 R869	E797-T807 WeakPolarHBondContact CB-O 3.47Å; T807-G867 WeakPolarHBondContact CG2-O 3.2Å; T807-F868 CarbonylContact C-O 3.6Å; T807-F868 VanDerWaalsContact CA-O 3.24Å; T807-F868 WeakPolarHBondContact CA-O 3.36Å; T807-R869 HydrophobicContact CG2-CG 4.02Å
808	G	90.3	Very high	78.4	Confident	3 Å²	3	65.5 Å²	65.5	3%	0.031	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-177.7	174.3	0	0	0	0	0	114.4	V795 G867 F868	V795-G808 CarbonylContact O-C 3.49Å; V795-G808 WeakPolarHBondContact O-CA 3.32Å; G808-G867 PolarHBondContact O-N 2.76Å; G808-F868 PolarHBondContact N-O 2.85Å; G808-F868 PolarHBondContact O-N 2.66Å
809	E	93.7	Very high	79.6	Confident	62 Å²	62	65.7 Å²	65.7	29%	0.29	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.7	176.2	-59.5	-178.3	163.9	0	0	110.5	Y794 V795 H811 V864 Y865 D866	Y794-E809 WeakPolarHBondContact CD2-O 2.98Å; V795-E809 PolarHBondContact N-O 3.06Å; V795-E809 PolarHBondContact O-N 2.64Å; E809-H811 IonicContact OE2-CD2 2.64Å; E809-H811 IonicContact OE2-CE1 3.74Å; E809-H811 PolarHBondContact OE2-CE1 2.65Å; E809-H811 IonicContact OE2-NE2 2.66Å; E809-H811 PolarHBondContact OE2-NE2 3.02Å; E809-V864 HydrophobicContact CB-CG1 4.17Å; E809-Y865 CarbonylContact C-O 3.39Å; E809-Y865 VanDerWaalsContact CA-O 3.32Å; E809-Y865 WeakPolarHBondContact CA-O 3.3Å; E809-D866 HydrophobicContact CG-CB 4.39Å
810	V	94.9	Very high	81.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	120	167.4	175.8	0	0	0	0	108.8	Y794 I812 Y865 F868 L873 W923 M926	Y794-V810 HydrophobicContact CD2-CG2 3.93Å; V810-I812 HydrophobicContact CG1-CD1 4.37Å; V810-I812 HydrophobicContact CG1-CG1 4.07Å; V810-Y865 PolarHBondContact N-O 2.86Å; V810-Y865 PolarHBondContact O-N 2.83Å; V810-F868 HydrophobicContact CB-CD2 4.01Å; V810-F868 HydrophobicContact CB-CE2 3.63Å; V810-F868 HydrophobicContact CB-CZ 4.03Å; V810-F868 HydrophobicContact CG2-CB 4.48Å; V810-F868 HydrophobicContact CG2-CD1 4.09Å; V810-F868 HydrophobicContact CG2-CD2 3.54Å; V810-F868 HydrophobicContact CG2-CE1 4.11Å; V810-F868 HydrophobicContact CG2-CE2 3.57Å; V810-F868 HydrophobicContact CG2-CG 3.8Å; V810-F868 HydrophobicContact CG2-CZ 3.84Å; V810-L873 HydrophobicContact CG2-CD2 3.75Å; V810-W923 HydrophobicContact CG1-CH2 4.43Å; V810-M926 HydrophobicContact CG1-SD 4.14Å
811	H	96.7	Very high	82.8	Confident	18 Å²	18	55.7 Å²	55.7	8%	0.083	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.9	179.9	-69.2	-120.2	0	0	0	109.6	L792 Q793 E809 V864 W933	L792-H811 WeakPolarHBondContact CA-O 3.16Å; Q793-H811 HydrophobicContact CB-CB 4.25Å; Q793-H811 PolarHBondContact N-O 3.35Å; Q793-H811 PolarHBondContact O-N 3.19Å; E809-H811 IonicContact OE2-CD2 2.64Å; E809-H811 IonicContact OE2-CE1 3.74Å; E809-H811 PolarHBondContact OE2-CE1 2.65Å; E809-H811 IonicContact OE2-NE2 2.66Å; E809-H811 PolarHBondContact OE2-NE2 3.02Å; H811-V864 WeakPolarHBondContact ND1-CG2 3.39Å; H811-W933 HydrophobicContact CB-CH2 3.7Å; H811-W933 HydrophobicContact CB-CZ2 4.19Å; H811-W933 HydrophobicContact CB-CZ3 4.35Å
812	I	97.7	Very high	84	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	102.4	-172.2	-56.7	165.9	0	0	0	108.1	L792 V810 V814 I836 T862 M863 Y865 V878 L880	L792-I812 HydrophobicContact CD2-CB 4.18Å; L792-I812 HydrophobicContact CD2-CG1 3.91Å; L792-I812 HydrophobicContact CD2-CG2 3.94Å; V810-I812 HydrophobicContact CG1-CD1 4.37Å; V810-I812 HydrophobicContact CG1-CG1 4.07Å; I812-V814 HydrophobicContact CG2-CG2 4.49Å; I812-I836 HydrophobicContact CD1-CD1 4.02Å; I812-T862 WeakPolarHBondContact O-CA 3.44Å; I812-M863 PolarHBondContact N-O 2.94Å; I812-M863 PolarHBondContact O-N 2.78Å; I812-Y865 HydrophobicContact CD1-CD2 3.86Å; I812-Y865 HydrophobicContact CD1-CE2 3.8Å; I812-V878 HydrophobicContact CD1-CG1 3.69Å; I812-V878 HydrophobicContact CD1-CG2 3.94Å; I812-L880 HydrophobicContact CG2-CD1 4.39Å
813	W	97.9	Very high	84.8	Confident	18 Å²	18	50 Å²	50	7%	0.068	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	101.1	179.2	178.7	16	0	0	0	110.3	A233 L790 A791 K815 W933	A233-W813 HydrophobicContact CB-CE3 4.01Å; A233-W813 HydrophobicContact CB-CH2 4.29Å; A233-W813 HydrophobicContact CB-CZ3 3.71Å; L790-W813 CarbonylContact C-O 3.52Å; L790-W813 VanDerWaalsContact CA-O 3.24Å; L790-W813 WeakPolarHBondContact CA-O 3.47Å; L790-W813 WeakPolarHBondContact CB-O 3.48Å; A791-W813 HydrophobicContact CB-CB 4.46Å; A791-W813 HydrophobicContact CB-CE3 4.19Å; A791-W813 PolarHBondContact N-O 2.88Å; A791-W813 PolarHBondContact O-N 3.15Å; W813-K815 HydrophobicContact CD2-CD 4.49Å; W813-K815 HydrophobicContact CD2-CG 4.07Å; W813-K815 HydrophobicContact CG-CG 4.25Å; W813-K815 HydrophobicContact CH2-CD 4.45Å; W813-K815 HydrophobicContact CZ2-CD 4.2Å; W813-K815 HydrophobicContact CZ2-CG 4.22Å; W813-K815 VanDerWaalsContact CZ3-CE 3.49Å; W813-K815 PolarHBondContact O-N 3.14Å; W813-W933 HydrophobicContact CB-CE3 4.43Å; W813-W933 HydrophobicContact CB-CH2 3.82Å; W813-W933 HydrophobicContact CB-CZ3 3.56Å; W813-W933 HydrophobicContact CE3-CE3 4.45Å
814	V	97.9	Very high	85.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	112.5	171.7	-177.8	0	0	0	0	108	M788 I812 V832 F859 N860 H861 M863 L880	M788-V814 HydrophobicContact SD-CG1 4.17Å; I812-V814 HydrophobicContact CG2-CG2 4.49Å; V814-V832 HydrophobicContact CG1-CB 4.47Å; V814-V832 HydrophobicContact CG1-CG2 4.06Å; V814-F859 HydrophobicContact CG1-CB 4.15Å; V814-F859 HydrophobicContact CG1-CD2 3.9Å; V814-F859 HydrophobicContact CG1-CG 4.3Å; V814-N860 WeakPolarHBondContact O-CA 3.33Å; V814-N860 PolarHBondContact O-N 2.91Å; V814-H861 PolarHBondContact N-O 3.31Å; V814-H861 PolarHBondContact O-N 3.48Å; V814-M863 HydrophobicContact CG2-CE 4.46Å; V814-L880 HydrophobicContact CG2-CD2 4.05Å
815	K	97.4	Very high	86	Confident	19 Å²	19	40.3 Å²	40.3	8%	0.083	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-65.2	-177.4	-58.9	-166.4	178.6	-170.1	0	111.2	K789 W813 F859 N860 E935	K789-K815 WeakPolarHBondContact O-CB 2.89Å; K789-K815 PolarHBondContact O-N 2.87Å; W813-K815 HydrophobicContact CD2-CD 4.49Å; W813-K815 HydrophobicContact CD2-CG 4.07Å; W813-K815 HydrophobicContact CG-CG 4.25Å; W813-K815 HydrophobicContact CH2-CD 4.45Å; W813-K815 HydrophobicContact CZ2-CD 4.2Å; W813-K815 HydrophobicContact CZ2-CG 4.22Å; W813-K815 VanDerWaalsContact CZ3-CE 3.49Å; W813-K815 PolarHBondContact O-N 3.14Å; K815-F859 PolarHBondContact O-N 2.9Å; K815-N860 PolarHBondContact O-N 3Å; K815-E935 WeakPolarHBondContact CD-OE1 3.29Å; K815-E935 VanDerWaalsContact CE-OE1 3.3Å; K815-E935 WeakPolarHBondContact CE-OE1 3.01Å; K815-E935 IonicContact NZ-OE1 2.69Å; K815-E935 PolarHBondContact NZ-OE1 2.68Å; K815-E935 IonicContact NZ-OE2 3.47Å; K815-E935 PolarHBondContact NZ-OE2 2.87Å
816	E	97.3	Very high	86.6	Confident	46 Å²	46	41 Å²	41	22%	0.215	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	158.1	-172.2	57.4	-164.9	155.9	0	0	111.2	K789 P857 V858	K789-E816 HydrophobicContact CB-CG 3.87Å; K789-E816 HydrophobicContact CD-CG 3.82Å; K789-E816 WeakPolarHBondContact CD-OE1 3.09Å; K789-E816 WeakPolarHBondContact CE-OE1 3.14Å; K789-E816 PolarHBondContact N-O 2.7Å; K789-E816 IonicContact NZ-OE1 2.64Å; K789-E816 PolarHBondContact NZ-OE1 3.39Å; K789-E816 PolarHBondContact O-N 2.79Å; E816-P857 CarbonylContact C-O 3.48Å; E816-P857 VanDerWaalsContact CA-O 3.29Å; E816-P857 WeakPolarHBondContact CA-O 3.4Å; E816-V858 HydrophobicContact CB-CB 4.48Å; E816-V858 HydrophobicContact CB-CG2 4.15Å
817	C	96.9	Very high	86.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	152.4	160.2	-64.2	0	0	0	0	109.9	E787 L820 N856 P857	E787-C817 CarbonylContact O-C 3.49Å; E787-C817 WeakPolarHBondContact O-CA 3.19Å; E787-C817 VanDerWaalsContact O-CB 3.3Å; E787-C817 WeakPolarHBondContact O-CB 3.42Å; C817-L820 HydrophobicContact CB-CD1 3.88Å; C817-L820 HydrophobicContact CB-CD2 3.89Å; C817-L820 HydrophobicContact CB-CG 3.86Å; C817-N856 CarbonylContact O-C 3.6Å; C817-N856 VanDerWaalsContact O-CA 3.24Å; C817-N856 WeakPolarHBondContact O-CA 3.46Å; C817-P857 HydrophobicContact CB-CG 3.94Å; C817-P857 PolarHBondContact N-O 2.95Å; C817-P857 WeakPolarHBondContact O-CD 3.44Å
818	L	94.6	Very high	87	Confident	55 Å²	55	40.3 Å²	40.3	29%	0.288	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	149.7	176.8	-55.8	176.1	0	0	0	109.5	G786 E787 L820 N856	G786-L818 CarbonylContact C-O 3.51Å; G786-L818 WeakPolarHBondContact CA-O 3.45Å; E787-L818 HydrophobicContact CB-CB 4.45Å; E787-L818 PolarHBondContact N-O 2.9Å; E787-L818 PolarHBondContact O-N 3.02Å; L818-L820 VanDerWaalsContact C-N 3.3Å; L818-L820 PolarHBondContact O-N 3.24Å; L818-L820 VanDerWaalsContact O-N 3.12Å; L818-N856 WeakPolarHBondContact CA-OD1 3.34Å
819	D	91.1	Very high	87	Confident	110 Å²	110	42.6 Å²	42.6	59%	0.588	23%	0.232	S	C	*	.	S	Bend	trans	45.7	41.6	172.2	-65.6	-26	0	0	0	116.1	G786 N856	G786-D819 VanDerWaalsContact CA-O 3.24Å; G786-D819 WeakPolarHBondContact CA-O 3.01Å; G786-D819 PolarHBondContact N-O 3.44Å; D819-N856 PolarHBondContact N-OD1 2.93Å
820	L	91.4	Very high	87	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	22%	0.218	C	C	.	.			trans	-63.2	135.3	177.4	-66.9	178.6	0	0	0	112.1	C817 L818 L822 L828 S830 T855 P857 V882 L893 L940	C817-L820 HydrophobicContact CB-CD1 3.88Å; C817-L820 HydrophobicContact CB-CD2 3.89Å; C817-L820 HydrophobicContact CB-CG 3.86Å; L818-L820 VanDerWaalsContact C-N 3.3Å; L818-L820 PolarHBondContact O-N 3.24Å; L818-L820 VanDerWaalsContact O-N 3.12Å; L820-L822 PolarHBondContact O-N 2.97Å; L820-L828 HydrophobicContact CB-CD1 3.74Å; L820-S830 VanDerWaalsContact CD1-OG 3.31Å; L820-S830 WeakPolarHBondContact CD1-OG 3.29Å; L820-T855 VanDerWaalsContact CB-O 3.28Å; L820-T855 WeakPolarHBondContact CB-O 3.19Å; L820-T855 WeakPolarHBondContact CG-O 3.29Å; L820-T855 PolarHBondContact N-O 2.97Å; L820-T855 VanDerWaalsContact N-O 3.09Å; L820-T855 WeakPolarHBondContact O-CG2 3.22Å; L820-P857 HydrophobicContact CD1-CG 3.51Å; L820-V882 HydrophobicContact CD1-CG1 4Å; L820-V882 HydrophobicContact CD2-CG1 4.16Å; L820-L893 HydrophobicContact CB-CD1 4.25Å; L820-L893 HydrophobicContact CD1-CD1 4.05Å; L820-L893 HydrophobicContact CD2-CD1 4.48Å; L820-L940 HydrophobicContact CD2-CD1 3.42Å; L820-L940 VanDerWaalsContact CD2-CD1 3.42Å
821	P	82.5	Confident	87	Confident	26 Å²	26	40.4 Å²	40.4	17%	0.169	22%	0.221	C	C	.	.			trans	-70.7	125.9	-172.8	27.2	-36.2	0	0	0	112	R785 L823	R785-P821 VanDerWaalsContact C-CD 3.47Å; R785-P821 WeakPolarHBondContact O-CD 3.24Å; P821-L823 VanDerWaalsContact C-N 3.25Å; P821-L823 HydrophobicContact CB-CD2 3.96Å; P821-L823 HydrophobicContact CB-CG 4.23Å; P821-L823 HydrophobicContact CG-CD2 4.37Å; P821-L823 HydrophobicContact CG-CG 4.32Å; P821-L823 PolarHBondContact O-N 2.98Å
822	L	80.3	Confident	87	Confident	84 Å²	84	39.5 Å²	39.5	44%	0.44	22%	0.217	S	C	.	.			trans	-75.9	71.8	177.7	-173.7	60.1	0	0	0	111.6	L820 R824 G825 L828	L820-L822 PolarHBondContact O-N 2.97Å; L822-R824 VanDerWaalsContact C-N 3.28Å; L822-R824 PolarHBondContact O-N 3.5Å; L822-G825 WeakPolarHBondContact CG-O 3.16Å; L822-L828 HydrophobicContact CD1-CD2 3.89Å; L822-L828 HydrophobicContact CD1-CG 3.87Å
823	L	69.5	Low	86.9	Confident	79 Å²	79	42.3 Å²	42.3	41%	0.414	23%	0.229	S	C	.	.			trans	-70.7	-18.9	-174.8	-57.9	-178.3	0	0	0	114.2	P821 Q891 L893	P821-L823 VanDerWaalsContact C-N 3.25Å; P821-L823 HydrophobicContact CB-CD2 3.96Å; P821-L823 HydrophobicContact CB-CG 4.23Å; P821-L823 HydrophobicContact CG-CD2 4.37Å; P821-L823 HydrophobicContact CG-CG 4.32Å; P821-L823 PolarHBondContact O-N 2.98Å; L823-Q891 HydrophobicContact CD1-CG 4.23Å; L823-L893 HydrophobicContact CD1-CD2 3.89Å; L823-L893 HydrophobicContact CG-CD2 4.21Å
824	R	64.6	Low	86.7	Confident	82 Å²	82	41.4 Å²	41.4	31%	0.309	23%	0.226	S	C	.	.	S	Bend	trans	-159	135.8	178.6	177.6	167.3	-79.1	161.3	-4.2	112	L822 Y886	L822-R824 VanDerWaalsContact C-N 3.28Å; L822-R824 PolarHBondContact O-N 3.5Å; R824-Y886 HydrophobicContact CG-CD2 4.43Å; R824-Y886 HydrophobicContact CG-CE2 4.5Å
825	G	64.1	Low	86.5	Confident	53 Å²	53	41.9 Å²	41.9	55%	0.546	23%	0.229	S	C	.	.	S	Bend	trans	81.1	-168.6	177.4	0	0	0	0	0	113.5	L822	L822-G825 WeakPolarHBondContact CG-O 3.16Å
826	S	67.6	Low	86.3	Confident	89 Å²	89	41.7 Å²	41.7	62%	0.622	23%	0.229	S	C	*	.	S	Bend	trans	-97.2	-9	173.5	55.8	0	0	0	0	113.3
827	H	73.9	Confident	86	Confident	98 Å²	98	39.8 Å²	39.8	45%	0.454	22%	0.22	S	C	.	.			trans	-148	128.2	-166.7	-63.1	-40.8	0	0	0	109.5	K853	H827-K853 HydrophobicContact CB-CB 4.43Å; H827-K853 HydrophobicContact CB-CG 4.33Å
828	L	86.6	Confident	85.7	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.238	C	C	.	.			trans	-87.6	148.9	169.3	-61.8	176.4	0	0	0	110.6	L820 L822 G852 K853 T855 D884 L893	L820-L828 HydrophobicContact CB-CD1 3.74Å; L822-L828 HydrophobicContact CD1-CD2 3.89Å; L822-L828 HydrophobicContact CD1-CG 3.87Å; L828-G852 CarbonylContact O-C 3.5Å; L828-K853 PolarHBondContact O-N 3.06Å; L828-T855 HydrophobicContact CD1-CG2 4.35Å; L828-D884 HydrophobicContact CD2-CB 4.04Å; L828-L893 HydrophobicContact CD1-CD1 4.1Å; L828-L893 HydrophobicContact CD2-CD2 4.5Å
829	N	89.8	Confident	85.2	Confident	52 Å²	52	43.5 Å²	43.5	28%	0.278	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	68.6	169	-56.4	-62	0	0	0	109.2	V851 G852 D884 H885	N829-V851 CarbonylContact C-O 3.57Å; N829-V851 WeakPolarHBondContact CA-O 3.35Å; N829-G852 WeakPolarHBondContact OD1-CA 3.48Å; N829-D884 PolarHBondContact N-OD1 3.32Å; N829-H885 HydrophobicContact CB-CB 4.12Å; N829-H885 PolarHBondContact ND2-O 2.85Å; N829-H885 WeakPolarHBondContact O-CB 3.23Å; N829-H885 PolarHBondContact O-N 2.94Å
830	S	93.4	Very high	84.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	141.1	-168.3	-60.8	0	0	0	0	112.7	L820 A850 V851 F859 W883	L820-S830 VanDerWaalsContact CD1-OG 3.31Å; L820-S830 WeakPolarHBondContact CD1-OG 3.29Å; S830-A850 CarbonylContact O-C 3.5Å; S830-A850 WeakPolarHBondContact O-CA 3.43Å; S830-V851 PolarHBondContact N-O 3.29Å; S830-V851 PolarHBondContact O-N 2.77Å; S830-F859 WeakPolarHBondContact O-CE1 3.25Å; S830-W883 CarbonylContact C-O 3.52Å; S830-W883 VanDerWaalsContact CA-O 3.29Å; S830-W883 WeakPolarHBondContact CA-O 3.32Å
831	F	95.7	Very high	83.8	Confident	15 Å²	15	41.8 Å²	41.8	7%	0.066	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.6	167.8	73.1	-78.3	0	0	0	111.3	K833 K847 A850 W883 H885 N890	F831-K833 HydrophobicContact CD2-CG 4.21Å; F831-K833 HydrophobicContact CE2-CD 4.19Å; F831-K833 HydrophobicContact CE2-CG 3.8Å; F831-K847 HydrophobicContact CE2-CD 4.48Å; F831-A850 HydrophobicContact CB-CB 4.07Å; F831-W883 HydrophobicContact CD1-CB 3.96Å; F831-W883 VanDerWaalsContact CD1-O 3.22Å; F831-W883 WeakPolarHBondContact CD1-O 3.43Å; F831-W883 HydrophobicContact CE1-CB 3.55Å; F831-W883 HydrophobicContact CE1-CG 4.49Å; F831-W883 HydrophobicContact CE2-CB 4.48Å; F831-W883 HydrophobicContact CZ-CB 3.86Å; F831-W883 HydrophobicContact CZ-CG 4.34Å; F831-W883 PolarHBondContact N-O 2.87Å; F831-W883 PolarHBondContact O-N 2.68Å; F831-H885 HydrophobicContact CD1-CB 4.14Å; F831-H885 HydrophobicContact CE1-CB 4.04Å; F831-N890 WeakPolarHBondContact CE1-OD1 3.29Å
832	V	96.7	Very high	83.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	138.3	-179.9	-171.7	0	0	0	0	109.9	M788 V814 K847 T848 F859 L880 T881 V882	M788-V832 HydrophobicContact CE-CB 4.45Å; M788-V832 HydrophobicContact CE-CG1 3.78Å; M788-V832 HydrophobicContact CE-CG2 3.75Å; V814-V832 HydrophobicContact CG1-CB 4.47Å; V814-V832 HydrophobicContact CG1-CG2 4.06Å; V832-K847 CarbonylContact O-C 3.26Å; V832-K847 WeakPolarHBondContact O-CA 3.32Å; V832-K847 WeakPolarHBondContact O-CB 3.3Å; V832-T848 HydrophobicContact CB-CG2 3.92Å; V832-T848 HydrophobicContact CG2-CG2 4.46Å; V832-T848 PolarHBondContact N-OG1 2.93Å; V832-T848 PolarHBondContact O-N 2.81Å; V832-F859 HydrophobicContact CG2-CD2 3.94Å; V832-F859 HydrophobicContact CG2-CE1 4.44Å; V832-F859 HydrophobicContact CG2-CE2 3.54Å; V832-F859 HydrophobicContact CG2-CZ 3.82Å; V832-L880 HydrophobicContact CG1-CB 4.43Å; V832-L880 HydrophobicContact CG1-CD2 3.81Å; V832-T881 CarbonylContact C-O 3.5Å; V832-T881 WeakPolarHBondContact CA-O 3.41Å; V832-V882 HydrophobicContact CG2-CG2 4.27Å
833	K	94.9	Very high	83.4	Confident	58 Å²	58	56.4 Å²	56.4	25%	0.252	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.9	167.2	-52.5	170.9	-163.9	155.9	0	108.4	F831 Q846 K847 L880 T881 W883	F831-K833 HydrophobicContact CD2-CG 4.21Å; F831-K833 HydrophobicContact CE2-CD 4.19Å; F831-K833 HydrophobicContact CE2-CG 3.8Å; K833-Q846 WeakPolarHBondContact CA-O 3.18Å; K833-K847 HydrophobicContact CG-CB 4.34Å; K833-L880 WeakPolarHBondContact O-CA 3.29Å; K833-T881 PolarHBondContact N-O 2.82Å; K833-T881 PolarHBondContact O-N 3.45Å; K833-W883 HydrophobicContact CD-CG 4.5Å; K833-W883 VanDerWaalsContact CE-CD1 3.43Å
834	C	95.5	Very high	84	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144	175.3	-172.3	0	0	0	0	109.9	R845 Q846 M863 Y865 E879 L880	C834-R845 WeakPolarHBondContact O-CA 3.35Å; C834-Q846 PolarHBondContact N-O 2.79Å; C834-Q846 PolarHBondContact O-N 2.95Å; C834-Q846 VanDerWaalsContact O-N 3.08Å; C834-M863 HydrophobicContact CB-CE 4.27Å; C834-M863 HydrophobicContact CB-SD 3.3Å; C834-M863 WeakPolarHBondContact CB-SD 3.34Å; C834-Y865 WeakPolarHBondContact CB-OH 3.33Å; C834-Y865 PolarHBondContact O-OH 3.12Å; C834-Y865 VanDerWaalsContact O-OH 3.1Å; C834-Y865 PolarHBondContact SG-OH 2.87Å; C834-Y865 VanDerWaalsContact SG-OH 3.32Å; C834-E879 CarbonylContact C-O 3.46Å; C834-E879 WeakPolarHBondContact CA-O 3.25Å; C834-L880 HydrophobicContact CB-CD2 3.69Å
835	T	93.2	Very high	85.2	Confident	10 Å²	10	54.4 Å²	54.4	6%	0.061	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	136.6	170.4	24.4	0	0	0	0	110.2	R845 E879	T835-R845 HydrophobicContact CG2-CB 3.73Å; T835-R845 HydrophobicContact CG2-CG 3.44Å; T835-R845 VanDerWaalsContact CG2-CG 3.44Å; T835-E879 PolarHBondContact N-O 3.01Å; T835-E879 PolarHBondContact O-N 2.89Å
836	I	92.8	Very high	86.7	Confident	15 Å²	15	54.8 Å²	54.8	8%	0.077	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.3	166.1	-51.5	-58	0	0	0	107.7	I812 D839 Y865 F868 A876 C877 V878	I812-I836 HydrophobicContact CD1-CD1 4.02Å; I836-D839 CarbonylContact O-C 3.58Å; I836-D839 VanDerWaalsContact O-C 3.3Å; I836-D839 WeakPolarHBondContact O-CA 3.23Å; I836-D839 PolarHBondContact O-N 2.81Å; I836-D839 VanDerWaalsContact O-O 3.13Å; I836-Y865 HydrophobicContact CD1-CD1 4.26Å; I836-Y865 HydrophobicContact CD1-CD2 4.01Å; I836-Y865 HydrophobicContact CD1-CE1 4.38Å; I836-Y865 HydrophobicContact CD1-CE2 4.17Å; I836-Y865 HydrophobicContact CD1-CG 4.06Å; I836-Y865 HydrophobicContact CG1-CD1 3.4Å; I836-Y865 HydrophobicContact CG1-CD2 4.05Å; I836-Y865 HydrophobicContact CG1-CE1 3.59Å; I836-Y865 HydrophobicContact CG1-CE2 4.24Å; I836-Y865 HydrophobicContact CG1-CG 3.62Å; I836-F868 HydrophobicContact CB-CZ 4.45Å; I836-F868 HydrophobicContact CD1-CZ 4.01Å; I836-F868 HydrophobicContact CG1-CZ 3.94Å; I836-F868 HydrophobicContact CG2-CE1 3.92Å; I836-F868 HydrophobicContact CG2-CZ 3.73Å; I836-A876 HydrophobicContact CG2-CB 4.29Å; I836-C877 WeakPolarHBondContact CA-O 3.24Å; I836-V878 HydrophobicContact CD1-CB 4.48Å; I836-V878 HydrophobicContact CD1-CG2 3.75Å
837	L	91.7	Very high	88	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.7	169.6	-56.9	-179.9	0	0	0	108.1	T840 A876 C877 E879 W912	L837-T840 HydrophobicContact CD2-CG2 4.02Å; L837-A876 VanDerWaalsContact O-CA 3.3Å; L837-A876 WeakPolarHBondContact O-CA 3.39Å; L837-C877 PolarHBondContact N-O 2.74Å; L837-C877 PolarHBondContact O-N 3.05Å; L837-E879 HydrophobicContact CD1-CB 4.03Å; L837-E879 HydrophobicContact CG-CB 4.31Å; L837-W912 HydrophobicContact CB-CD2 3.87Å; L837-W912 HydrophobicContact CB-CE3 3.52Å; L837-W912 HydrophobicContact CB-CH2 3.83Å; L837-W912 HydrophobicContact CB-CZ2 4.16Å; L837-W912 HydrophobicContact CB-CZ3 3.52Å; L837-W912 HydrophobicContact CD1-CB 3.66Å; L837-W912 HydrophobicContact CD1-CD2 3.65Å; L837-W912 HydrophobicContact CD1-CE3 3.69Å; L837-W912 HydrophobicContact CD1-CG 3.66Å; L837-W912 HydrophobicContact CG-CD2 4.37Å; L837-W912 HydrophobicContact CG-CE3 4.26Å
838	P	89	Confident	89	Confident	61 Å²	61	52.8 Å²	52.8	40%	0.396	25%	0.245	S	C	.	.	S	Bend	cis	-82.9	-0.9	12.4	32	-36.9	0	0	0	117.2	T840 Y906 W912	P838-T840 VanDerWaalsContact C-N 3.32Å; P838-T840 PolarHBondContact O-N 3.08Å; P838-Y906 HydrophobicContact CG-CD2 4.2Å; P838-Y906 HydrophobicContact CG-CE2 3.78Å; P838-W912 HydrophobicContact CB-CH2 4.16Å; P838-W912 HydrophobicContact CB-CZ2 3.9Å
839	D	85	Confident	89.4	Confident	72 Å²	72	61.6 Å²	61.6	39%	0.385	28%	0.278	S	S	.	.			trans	-74.6	79	-178	-171.5	20.9	0	0	0	114.8	I836 S841 S844	I836-D839 CarbonylContact O-C 3.58Å; I836-D839 VanDerWaalsContact O-C 3.3Å; I836-D839 WeakPolarHBondContact O-CA 3.23Å; I836-D839 PolarHBondContact O-N 2.81Å; I836-D839 VanDerWaalsContact O-O 3.13Å; D839-S841 PolarHBondContact O-N 3.04Å; D839-S841 WeakPolarHBondContact OD1-CA 3.21Å; D839-S841 WeakPolarHBondContact OD1-CB 3.3Å; D839-S841 PolarHBondContact OD1-N 3.29Å; D839-S841 WeakPolarHBondContact OD2-CB 3.36Å; D839-S844 PolarHBondContact O-OG 3.1Å; D839-S844 WeakPolarHBondContact OD2-CB 3.28Å
840	T	76.1	Confident	89.6	Confident	47 Å²	47	62 Å²	62	29%	0.288	29%	0.289	S	S	.	.			trans	-67.7	9.4	171.1	65.5	0	0	0	0	114.8	L837 P838 R845 L948	L837-T840 HydrophobicContact CD2-CG2 4.02Å; P838-T840 VanDerWaalsContact C-N 3.32Å; P838-T840 PolarHBondContact O-N 3.08Å; T840-R845 PolarHBondContact O-NH2 3.09Å; T840-L948 HydrophobicContact CG2-CD2 3.94Å
841	S	77.2	Confident	89.6	Confident	30 Å²	30	63.7 Å²	63.7	21%	0.21	30%	0.299	C	S	.	.			trans	-50.3	161.4	175.8	-179.9	0	0	0	0	113.4	D839 K843 S844 R845	D839-S841 PolarHBondContact O-N 3.04Å; D839-S841 WeakPolarHBondContact OD1-CA 3.21Å; D839-S841 WeakPolarHBondContact OD1-CB 3.3Å; D839-S841 PolarHBondContact OD1-N 3.29Å; D839-S841 WeakPolarHBondContact OD2-CB 3.36Å; S841-K843 VanDerWaalsContact C-N 3.3Å; S841-K843 PolarHBondContact OG-N 3.09Å; S841-S844 PolarHBondContact O-OG 3.05Å; S841-R845 WeakPolarHBondContact O-CG 3.47Å; S841-R845 PolarHBondContact O-NE 3.09Å
842	R	77.8	Confident	89.3	Confident	233 Å²	233	65 Å²	65	88%	0.879	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.4	167.9	-72.7	-170.6	65.1	150.4	-1	112.7
843	K	76.9	Confident	88.8	Confident	185 Å²	185	72.6 Å²	72.6	80%	0.804	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-30.8	-179.9	-63.7	-175.8	178.8	-179.5	0	113.3	S841	S841-K843 VanDerWaalsContact C-N 3.3Å; S841-K843 PolarHBondContact OG-N 3.09Å
844	S	81.8	Confident	88.7	Confident	12 Å²	12	72 Å²	72	8%	0.084	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-41.3	175.8	50.3	0	0	0	0	111.9	D839 S841 Q846 Y865	D839-S844 PolarHBondContact O-OG 3.1Å; D839-S844 WeakPolarHBondContact OD2-CB 3.28Å; S841-S844 PolarHBondContact O-OG 3.05Å; S844-Q846 PolarHBondContact O-N 3.06Å; S844-Y865 WeakPolarHBondContact O-CE1 3.49Å
845	R	90.5	Very high	88.5	Confident	107 Å²	107	74.5 Å²	74.5	40%	0.404	37%	0.366	S	S	.	.			trans	-61	121	-167.4	-30.4	-156.9	175.3	-159.4	-0.8	113.2	C834 T835 T840 S841 L948	C834-R845 WeakPolarHBondContact O-CA 3.35Å; T835-R845 HydrophobicContact CG2-CB 3.73Å; T835-R845 HydrophobicContact CG2-CG 3.44Å; T835-R845 VanDerWaalsContact CG2-CG 3.44Å; T840-R845 PolarHBondContact O-NH2 3.09Å; S841-R845 WeakPolarHBondContact O-CG 3.47Å; S841-R845 PolarHBondContact O-NE 3.09Å; R845-L948 VanDerWaalsContact NH2-CD2 3.34Å
846	Q	94.1	Very high	88.5	Confident	60 Å²	60	77.3 Å²	77.3	28%	0.28	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	163	173.6	-66.3	178.9	60.8	0	0	110.6	K833 C834 S844 M863 V864 Y865	K833-Q846 WeakPolarHBondContact CA-O 3.18Å; C834-Q846 PolarHBondContact N-O 2.79Å; C834-Q846 PolarHBondContact O-N 2.95Å; C834-Q846 VanDerWaalsContact O-N 3.08Å; S844-Q846 PolarHBondContact O-N 3.06Å; Q846-M863 HydrophobicContact CB-CB 4.27Å; Q846-M863 HydrophobicContact CB-CG 4.04Å; Q846-M863 HydrophobicContact CB-SD 3.43Å; Q846-M863 WeakPolarHBondContact CB-SD 3.13Å; Q846-V864 PolarHBondContact NE2-O 2.84Å; Q846-Y865 VanDerWaalsContact NE2-CZ 3.33Å
847	K	94.7	Very high	88.7	Confident	139 Å²	139	76.6 Å²	76.6	60%	0.604	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.8	150.5	177.9	62.4	163.1	-173.4	166	0	112.3	F831 V832 K833	F831-K847 HydrophobicContact CE2-CD 4.48Å; V832-K847 CarbonylContact O-C 3.26Å; V832-K847 WeakPolarHBondContact O-CA 3.32Å; V832-K847 WeakPolarHBondContact O-CB 3.3Å; K833-K847 HydrophobicContact CG-CB 4.34Å
848	T	96.5	Very high	88.9	Confident	7 Å²	7	79.8 Å²	79.8	4%	0.043	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-73	170.1	172.1	67.7	0	0	0	0	111.2	V832 F859 H861 M863	V832-T848 HydrophobicContact CB-CG2 3.92Å; V832-T848 HydrophobicContact CG2-CG2 4.46Å; V832-T848 PolarHBondContact N-OG1 2.93Å; V832-T848 PolarHBondContact O-N 2.81Å; T848-F859 HydrophobicContact CG2-CB 4.16Å; T848-F859 HydrophobicContact CG2-CD1 4.09Å; T848-F859 HydrophobicContact CG2-CG 4.16Å; T848-F859 WeakPolarHBondContact OG1-CD1 3.12Å; T848-H861 HydrophobicContact CG2-CB 3.99Å; T848-M863 HydrophobicContact CG2-CE 3.52Å
849	R	94.5	Very high	89.3	Confident	185 Å²	185	78 Å²	78	70%	0.698	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-67.7	154.6	157.2	-67.5	-171.3	177.4	-83.9	-4.6	109.3	E591	E591-R849 IonicContact OE1-NH1 3.38Å; E591-R849 PolarHBondContact OE1-NH1 3.07Å; E591-R849 IonicContact OE1-NH2 2.85Å
850	A	93.5	Very high	89.8	Confident	61 Å²	61	78.8 Å²	78.8	50%	0.504	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-79	136.4	173.3	0	0	0	0	0	110.6	S830 F831	S830-A850 CarbonylContact O-C 3.5Å; S830-A850 WeakPolarHBondContact O-CA 3.43Å; F831-A850 HydrophobicContact CB-CB 4.07Å
851	V	94.2	Very high	90.8	Very high	36 Å²	36	79.6 Å²	79.6	22%	0.218	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	115	-179.6	179.4	0	0	0	0	107.3	N829 S830 T854 P857 V858 F859	N829-V851 CarbonylContact C-O 3.57Å; N829-V851 WeakPolarHBondContact CA-O 3.35Å; S830-V851 PolarHBondContact N-O 3.29Å; S830-V851 PolarHBondContact O-N 2.77Å; V851-T854 HydrophobicContact CG1-CG2 3.92Å; V851-P857 HydrophobicContact CB-CB 3.74Å; V851-P857 HydrophobicContact CG1-CB 3.7Å; V851-P857 HydrophobicContact CG2-CB 4.43Å; V851-V858 WeakPolarHBondContact CG2-O 3.47Å; V851-F859 HydrophobicContact CB-CD1 4.48Å; V851-F859 HydrophobicContact CB-CE1 4.06Å; V851-F859 HydrophobicContact CG2-CD1 3.54Å; V851-F859 HydrophobicContact CG2-CE1 3.59Å; V851-F859 HydrophobicContact CG2-CG 4.48Å
852	G	89.2	Confident	91.7	Very high	41 Å²	41	79 Å²	79	42%	0.423	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	153.5	-170.8	0	0	0	0	0	114.5	L828 N829 T854	L828-G852 CarbonylContact O-C 3.5Å; N829-G852 WeakPolarHBondContact OD1-CA 3.48Å; G852-T854 PolarHBondContact O-N 3.08Å
853	K	86.6	Confident	92.6	Very high	160 Å²	160	68 Å²	68	70%	0.696	34%	0.341	S	S	*	.	S	Bend	trans	64.4	28	167	-51.4	178.6	-176.9	177.8	0	116.4	H827 L828	H827-K853 HydrophobicContact CB-CB 4.43Å; H827-K853 HydrophobicContact CB-CG 4.33Å; L828-K853 PolarHBondContact O-N 3.06Å
854	T	91.1	Very high	93.4	Very high	45 Å²	45	60.5 Å²	60.5	28%	0.276	31%	0.311	S	S	.	.			trans	-144.3	144.6	178.1	-178.3	0	0	0	0	112.6	V851 G852 N856 P857	V851-T854 HydrophobicContact CG1-CG2 3.92Å; G852-T854 PolarHBondContact O-N 3.08Å; T854-N856 VanDerWaalsContact C-N 3.3Å; T854-N856 WeakPolarHBondContact CG2-O 3.5Å; T854-N856 VanDerWaalsContact OG1-C 3.3Å; T854-N856 WeakPolarHBondContact OG1-CA 3.2Å; T854-N856 PolarHBondContact OG1-N 2.83Å; T854-N856 PolarHBondContact OG1-O 2.93Å; T854-P857 HydrophobicContact CG2-CB 3.99Å
855	T	91.5	Very high	94	Very high	53 Å²	53	60.7 Å²	60.7	33%	0.325	31%	0.309	S	S	.	.	S	Bend	trans	-78.7	-18	164.8	49.3	0	0	0	0	112.2	L820 L828 P857	L820-T855 VanDerWaalsContact CB-O 3.28Å; L820-T855 WeakPolarHBondContact CB-O 3.19Å; L820-T855 WeakPolarHBondContact CG-O 3.29Å; L820-T855 PolarHBondContact N-O 2.97Å; L820-T855 VanDerWaalsContact N-O 3.09Å; L820-T855 WeakPolarHBondContact O-CG2 3.22Å; L828-T855 HydrophobicContact CD1-CG2 4.35Å; T855-P857 WeakPolarHBondContact O-CD 3.31Å
856	N	94.4	Very high	94	Very high	69 Å²	69	58 Å²	58	37%	0.369	30%	0.304	S	S	.	.	S	Bend	trans	-114.6	74.7	-179.8	-61	-24.5	0	0	0	109.9	C817 L818 D819 T854	C817-N856 CarbonylContact O-C 3.6Å; C817-N856 VanDerWaalsContact O-CA 3.24Å; C817-N856 WeakPolarHBondContact O-CA 3.46Å; L818-N856 WeakPolarHBondContact CA-OD1 3.34Å; D819-N856 PolarHBondContact N-OD1 2.93Å; T854-N856 VanDerWaalsContact C-N 3.3Å; T854-N856 WeakPolarHBondContact CG2-O 3.5Å; T854-N856 VanDerWaalsContact OG1-C 3.3Å; T854-N856 WeakPolarHBondContact OG1-CA 3.2Å; T854-N856 PolarHBondContact OG1-N 2.83Å; T854-N856 PolarHBondContact OG1-O 2.93Å
857	P	95.5	Very high	93.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.31	C	S	.	.			trans	-81.7	121.5	-178	32.1	-36.4	0	0	0	112.4	E816 C817 L820 V851 T854 T855 F859	E816-P857 CarbonylContact C-O 3.48Å; E816-P857 VanDerWaalsContact CA-O 3.29Å; E816-P857 WeakPolarHBondContact CA-O 3.4Å; C817-P857 HydrophobicContact CB-CG 3.94Å; C817-P857 PolarHBondContact N-O 2.95Å; C817-P857 WeakPolarHBondContact O-CD 3.44Å; L820-P857 HydrophobicContact CD1-CG 3.51Å; V851-P857 HydrophobicContact CB-CB 3.74Å; V851-P857 HydrophobicContact CG1-CB 3.7Å; V851-P857 HydrophobicContact CG2-CB 4.43Å; T854-P857 HydrophobicContact CG2-CB 3.99Å; T855-P857 WeakPolarHBondContact O-CD 3.31Å; P857-F859 HydrophobicContact CB-CE1 4.25Å; P857-F859 HydrophobicContact CB-CE2 3.92Å; P857-F859 HydrophobicContact CB-CZ 3.7Å; P857-F859 HydrophobicContact CG-CE2 3.66Å; P857-F859 HydrophobicContact CG-CZ 3.69Å
858	V	97.2	Very high	93.4	Very high	73 Å²	73	51.1 Å²	51.1	44%	0.442	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.1	169	-176.5	0	0	0	0	109.3	E816 V851 N860	E816-V858 HydrophobicContact CB-CB 4.48Å; E816-V858 HydrophobicContact CB-CG2 4.15Å; V851-V858 WeakPolarHBondContact CG2-O 3.47Å; V858-N860 VanDerWaalsContact CG1-ND2 3.3Å; V858-N860 WeakPolarHBondContact CG1-ND2 3.15Å
859	F	96.7	Very high	92.9	Very high	24 Å²	24	56.2 Å²	56.2	11%	0.105	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-39.8	-178.1	-66	-68.3	0	0	0	113.5	V814 K815 S830 V832 T848 V851 P857 H861	V814-F859 HydrophobicContact CG1-CB 4.15Å; V814-F859 HydrophobicContact CG1-CD2 3.9Å; V814-F859 HydrophobicContact CG1-CG 4.3Å; K815-F859 PolarHBondContact O-N 2.9Å; S830-F859 WeakPolarHBondContact O-CE1 3.25Å; V832-F859 HydrophobicContact CG2-CD2 3.94Å; V832-F859 HydrophobicContact CG2-CE1 4.44Å; V832-F859 HydrophobicContact CG2-CE2 3.54Å; V832-F859 HydrophobicContact CG2-CZ 3.82Å; T848-F859 HydrophobicContact CG2-CB 4.16Å; T848-F859 HydrophobicContact CG2-CD1 4.09Å; T848-F859 HydrophobicContact CG2-CG 4.16Å; T848-F859 WeakPolarHBondContact OG1-CD1 3.12Å; V851-F859 HydrophobicContact CB-CD1 4.48Å; V851-F859 HydrophobicContact CB-CE1 4.06Å; V851-F859 HydrophobicContact CG2-CD1 3.54Å; V851-F859 HydrophobicContact CG2-CE1 3.59Å; V851-F859 HydrophobicContact CG2-CG 4.48Å; P857-F859 HydrophobicContact CB-CE1 4.25Å; P857-F859 HydrophobicContact CB-CE2 3.92Å; P857-F859 HydrophobicContact CB-CZ 3.7Å; P857-F859 HydrophobicContact CG-CE2 3.66Å; P857-F859 HydrophobicContact CG-CZ 3.69Å; F859-H861 VanDerWaalsContact C-N 3.31Å; F859-H861 PolarHBondContact O-N 2.81Å
860	N	96.2	Very high	92.5	Very high	87 Å²	87	51 Å²	51	47%	0.465	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	38.2	55.5	-175.4	-80.7	-35	0	0	0	114.2	V814 K815 V858	V814-N860 WeakPolarHBondContact O-CA 3.33Å; V814-N860 PolarHBondContact O-N 2.91Å; K815-N860 PolarHBondContact O-N 3Å; V858-N860 VanDerWaalsContact CG1-ND2 3.3Å; V858-N860 WeakPolarHBondContact CG1-ND2 3.15Å
861	H	96.5	Very high	92.2	Very high	65 Å²	65	52.5 Å²	52.5	30%	0.301	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	118.8	-169.7	-172.2	78.8	0	0	0	112.2	V814 T848 F859	V814-H861 PolarHBondContact N-O 3.31Å; V814-H861 PolarHBondContact O-N 3.48Å; T848-H861 HydrophobicContact CG2-CB 3.99Å; F859-H861 VanDerWaalsContact C-N 3.31Å; F859-H861 PolarHBondContact O-N 2.81Å
862	T	96.9	Very high	92.1	Very high	18 Å²	18	52.4 Å²	52.4	11%	0.11	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.8	176.3	-46.7	0	0	0	0	110.8	P234 P236 I812 V864 W933	P234-T862 PolarHBondContact O-OG1 3.05Å; P236-T862 HydrophobicContact CB-CG2 4.17Å; P236-T862 HydrophobicContact CG-CG2 4.16Å; I812-T862 WeakPolarHBondContact O-CA 3.44Å; T862-V864 HydrophobicContact CG2-CG2 4.25Å; T862-W933 HydrophobicContact CG2-CH2 4.04Å
863	M	96	Very high	92.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.9	169.2	-55.9	-174.1	-159.1	0	0	108.5	I812 V814 C834 Q846 T848 Y865	I812-M863 PolarHBondContact N-O 2.94Å; I812-M863 PolarHBondContact O-N 2.78Å; V814-M863 HydrophobicContact CG2-CE 4.46Å; C834-M863 HydrophobicContact CB-CE 4.27Å; C834-M863 HydrophobicContact CB-SD 3.3Å; C834-M863 WeakPolarHBondContact CB-SD 3.34Å; Q846-M863 HydrophobicContact CB-CB 4.27Å; Q846-M863 HydrophobicContact CB-CG 4.04Å; Q846-M863 HydrophobicContact CB-SD 3.43Å; Q846-M863 WeakPolarHBondContact CB-SD 3.13Å; T848-M863 HydrophobicContact CG2-CE 3.52Å; M863-Y865 HydrophobicContact CB-CE2 4.16Å
864	V	94.7	Very high	92.4	Very high	29 Å²	29	48.3 Å²	48.3	18%	0.176	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.4	-177.5	-175.5	0	0	0	0	109.6	P236 E809 H811 Q846 T862	P236-V864 HydrophobicContact CB-CG2 3.53Å; P236-V864 HydrophobicContact CG-CG2 3.49Å; P236-V864 VanDerWaalsContact CG-CG2 3.49Å; E809-V864 HydrophobicContact CB-CG1 4.17Å; H811-V864 WeakPolarHBondContact ND1-CG2 3.39Å; Q846-V864 PolarHBondContact NE2-O 2.84Å; T862-V864 HydrophobicContact CG2-CG2 4.25Å
865	Y	93.1	Very high	92.5	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.059	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.8	178.7	-67.7	-98.7	0	0	0	109.2	E809 V810 I812 C834 I836 S844 Q846 M863	E809-Y865 CarbonylContact C-O 3.39Å; E809-Y865 VanDerWaalsContact CA-O 3.32Å; E809-Y865 WeakPolarHBondContact CA-O 3.3Å; V810-Y865 PolarHBondContact N-O 2.86Å; V810-Y865 PolarHBondContact O-N 2.83Å; I812-Y865 HydrophobicContact CD1-CD2 3.86Å; I812-Y865 HydrophobicContact CD1-CE2 3.8Å; C834-Y865 WeakPolarHBondContact CB-OH 3.33Å; C834-Y865 PolarHBondContact O-OH 3.12Å; C834-Y865 VanDerWaalsContact O-OH 3.1Å; C834-Y865 PolarHBondContact SG-OH 2.87Å; C834-Y865 VanDerWaalsContact SG-OH 3.32Å; I836-Y865 HydrophobicContact CD1-CD1 4.26Å; I836-Y865 HydrophobicContact CD1-CD2 4.01Å; I836-Y865 HydrophobicContact CD1-CE1 4.38Å; I836-Y865 HydrophobicContact CD1-CE2 4.17Å; I836-Y865 HydrophobicContact CD1-CG 4.06Å; I836-Y865 HydrophobicContact CG1-CD1 3.4Å; I836-Y865 HydrophobicContact CG1-CD2 4.05Å; I836-Y865 HydrophobicContact CG1-CE1 3.59Å; I836-Y865 HydrophobicContact CG1-CE2 4.24Å; I836-Y865 HydrophobicContact CG1-CG 3.62Å; S844-Y865 WeakPolarHBondContact O-CE1 3.49Å; Q846-Y865 VanDerWaalsContact NE2-CZ 3.33Å; M863-Y865 HydrophobicContact CB-CE2 4.16Å
866	D	90.6	Very high	92.6	Very high	52 Å²	52	46.3 Å²	46.3	28%	0.278	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	157.8	177.8	55.1	-20.9	0	0	0	112.1	K240 L241 E809	K240-D866 WeakPolarHBondContact CA-OD2 3.39Å; L241-D866 WeakPolarHBondContact CD1-OD1 3.41Å; L241-D866 PolarHBondContact N-OD2 2.91Å; E809-D866 HydrophobicContact CG-CB 4.39Å
867	G	86.9	Confident	92.6	Very high	40 Å²	40	43 Å²	43	41%	0.412	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	104.2	5.9	168.8	0	0	0	0	0	116.6	T807 G808	T807-G867 WeakPolarHBondContact CG2-O 3.2Å; G808-G867 PolarHBondContact O-N 2.76Å
868	F	89	Confident	92.6	Very high	14 Å²	14	43 Å²	43	6%	0.061	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.1	179.7	-67.8	-96.5	0	0	0	112	Y794 T807 G808 V810 I836 D872 L873 A876	Y794-F868 HydrophobicContact CE2-CB 4.32Å; T807-F868 CarbonylContact C-O 3.6Å; T807-F868 VanDerWaalsContact CA-O 3.24Å; T807-F868 WeakPolarHBondContact CA-O 3.36Å; G808-F868 PolarHBondContact N-O 2.85Å; G808-F868 PolarHBondContact O-N 2.66Å; V810-F868 HydrophobicContact CB-CD2 4.01Å; V810-F868 HydrophobicContact CB-CE2 3.63Å; V810-F868 HydrophobicContact CB-CZ 4.03Å; V810-F868 HydrophobicContact CG2-CB 4.48Å; V810-F868 HydrophobicContact CG2-CD1 4.09Å; V810-F868 HydrophobicContact CG2-CD2 3.54Å; V810-F868 HydrophobicContact CG2-CE1 4.11Å; V810-F868 HydrophobicContact CG2-CE2 3.57Å; V810-F868 HydrophobicContact CG2-CG 3.8Å; V810-F868 HydrophobicContact CG2-CZ 3.84Å; I836-F868 HydrophobicContact CB-CZ 4.45Å; I836-F868 HydrophobicContact CD1-CZ 4.01Å; I836-F868 HydrophobicContact CG1-CZ 3.94Å; I836-F868 HydrophobicContact CG2-CE1 3.92Å; I836-F868 HydrophobicContact CG2-CZ 3.73Å; F868-D872 HydrophobicContact CD1-CB 4.46Å; F868-L873 HydrophobicContact CB-CD2 4.22Å; F868-L873 HydrophobicContact CD1-CD2 3.81Å; F868-L873 HydrophobicContact CE1-CD2 4.45Å; F868-L873 HydrophobicContact CG-CD2 4.19Å; F868-A876 HydrophobicContact CE1-CB 4.06Å
869	R	86.8	Confident	92.5	Very high	114 Å²	114	40.2 Å²	40.2	43%	0.43	21%	0.21	S	C	.	.			trans	-77.6	158.5	159.7	-56.9	169.1	173.3	-132.1	0.6	110.1	T807 E871 D872 L873	T807-R869 HydrophobicContact CG2-CG 4.02Å; R869-E871 HydrophobicContact CB-CB 4.49Å; R869-E871 WeakPolarHBondContact CD-OE2 3.49Å; R869-E871 IonicContact NH1-OE2 3.91Å; R869-E871 PolarHBondContact O-N 2.85Å; R869-D872 HydrophobicContact CB-CB 4.45Å; R869-D872 VanDerWaalsContact CB-OD2 3.29Å; R869-D872 WeakPolarHBondContact CB-OD2 3.34Å; R869-D872 VanDerWaalsContact CG-OD2 3.31Å; R869-D872 WeakPolarHBondContact CG-OD2 3.39Å; R869-D872 PolarHBondContact N-OD2 2.7Å; R869-D872 PolarHBondContact O-N 3.46Å; R869-D872 VanDerWaalsContact O-N 3.09Å; R869-L873 PolarHBondContact O-N 2.81Å
870	P	85.6	Confident	92.4	Very high	74 Å²	74	39.1 Å²	39.1	48%	0.481	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-38.6	166.9	-26.7	34.7	0	0	0	113.1
871	E	87.8	Confident	92.4	Very high	94 Å²	94	35.3 Å²	35.3	44%	0.439	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-45.3	175.6	-50	88	-88.3	0	0	112.5	R869 L873 M874	R869-E871 HydrophobicContact CB-CB 4.49Å; R869-E871 WeakPolarHBondContact CD-OE2 3.49Å; R869-E871 IonicContact NH1-OE2 3.91Å; R869-E871 PolarHBondContact O-N 2.85Å; E871-L873 PolarHBondContact O-N 2.97Å; E871-M874 PolarHBondContact O-N 2.8Å; E871-M874 VanDerWaalsContact O-N 3.13Å
872	D	90.9	Very high	92.3	Very high	34 Å²	34	32.2 Å²	32.2	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-25	-173.4	-54.6	-28.3	0	0	0	112.1	F868 R869 M874 E875 A876	F868-D872 HydrophobicContact CD1-CB 4.46Å; R869-D872 HydrophobicContact CB-CB 4.45Å; R869-D872 VanDerWaalsContact CB-OD2 3.29Å; R869-D872 WeakPolarHBondContact CB-OD2 3.34Å; R869-D872 VanDerWaalsContact CG-OD2 3.31Å; R869-D872 WeakPolarHBondContact CG-OD2 3.39Å; R869-D872 PolarHBondContact N-OD2 2.7Å; R869-D872 PolarHBondContact O-N 3.46Å; R869-D872 VanDerWaalsContact O-N 3.09Å; D872-M874 PolarHBondContact O-N 3.32Å; D872-E875 PolarHBondContact O-N 3.4Å; D872-E875 VanDerWaalsContact O-N 3.16Å; D872-A876 WeakPolarHBondContact O-CB 3.5Å; D872-A876 PolarHBondContact O-N 3.24Å
873	L	92.2	Very high	92.1	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-23.9	177	-63.7	173.7	0	0	0	113.2	Y794 V810 F868 R869 E871 F900 W923 M926 V927	Y794-L873 HydrophobicContact CD1-CD1 3.68Å; Y794-L873 HydrophobicContact CD2-CD1 4.04Å; Y794-L873 HydrophobicContact CD2-CD2 4.26Å; Y794-L873 HydrophobicContact CE1-CD1 3.59Å; Y794-L873 HydrophobicContact CE2-CD1 3.97Å; Y794-L873 HydrophobicContact CE2-CD2 4.44Å; Y794-L873 HydrophobicContact CG-CD1 3.91Å; V810-L873 HydrophobicContact CG2-CD2 3.75Å; F868-L873 HydrophobicContact CB-CD2 4.22Å; F868-L873 HydrophobicContact CD1-CD2 3.81Å; F868-L873 HydrophobicContact CE1-CD2 4.45Å; F868-L873 HydrophobicContact CG-CD2 4.19Å; R869-L873 PolarHBondContact O-N 2.81Å; E871-L873 PolarHBondContact O-N 2.97Å; L873-F900 WeakPolarHBondContact O-CD2 3.41Å; L873-F900 VanDerWaalsContact O-CE2 3.29Å; L873-F900 WeakPolarHBondContact O-CE2 3.45Å; L873-W923 HydrophobicContact CD2-CZ2 4.18Å; L873-W923 PolarHBondContact O-NE1 3.1Å; L873-M926 HydrophobicContact CD2-CE 4.32Å; L873-V927 HydrophobicContact CB-CG2 4.24Å; L873-V927 HydrophobicContact CD1-CG2 4.3Å
874	M	91.7	Very high	91.8	Very high	112 Å²	112	33.4 Å²	33.4	55%	0.552	17%	0.173	S	C	*	.	H	α-helix	trans	-77.8	-28.2	175.7	-60.1	-171.3	-62.3	0	0	112.5	E871 D872 F900	E871-M874 PolarHBondContact O-N 2.8Å; E871-M874 VanDerWaalsContact O-N 3.13Å; D872-M874 PolarHBondContact O-N 3.32Å; M874-F900 HydrophobicContact CB-CE2 4.48Å; M874-F900 HydrophobicContact CG-CE2 4.3Å
875	E	92.1	Very high	91.4	Very high	53 Å²	53	36.2 Å²	36.2	25%	0.248	18%	0.184	C	C	.	.	H	α-helix	trans	-108.6	-7.9	-169.7	-62.5	-79.5	-146.6	0	0	113	D872 S905 Y906 M913	D872-E875 PolarHBondContact O-N 3.4Å; D872-E875 VanDerWaalsContact O-N 3.16Å; E875-S905 PolarHBondContact O-OG 3.12Å; E875-S905 VanDerWaalsContact OE2-CA 3.24Å; E875-S905 WeakPolarHBondContact OE2-CA 3.36Å; E875-Y906 HydrophobicContact CB-CD1 4.18Å; E875-Y906 HydrophobicContact CB-CD2 3.89Å; E875-Y906 HydrophobicContact CB-CE1 3.89Å; E875-Y906 HydrophobicContact CB-CE2 3.54Å; E875-Y906 HydrophobicContact CB-CG 4.18Å; E875-Y906 HydrophobicContact CG-CD1 4.23Å; E875-Y906 HydrophobicContact CG-CE1 4.21Å; E875-Y906 HydrophobicContact CG-CG 4.43Å; E875-Y906 WeakPolarHBondContact OE1-CA 3.43Å; E875-Y906 PolarHBondContact OE1-N 3.46Å; E875-Y906 PolarHBondContact OE2-N 2.79Å; E875-M913 WeakPolarHBondContact O-CE 3.49Å
876	A	93	Very high	90.7	Very high	3 Å²	3	39.3 Å²	39.3	3%	0.025	20%	0.196	C	C	.	.			trans	-100.1	159.4	179.3	0	0	0	0	0	113.4	I836 L837 F868 D872	I836-A876 HydrophobicContact CG2-CB 4.29Å; L837-A876 VanDerWaalsContact O-CA 3.3Å; L837-A876 WeakPolarHBondContact O-CA 3.39Å; F868-A876 HydrophobicContact CE1-CB 4.06Å; D872-A876 WeakPolarHBondContact O-CB 3.5Å; D872-A876 PolarHBondContact O-N 3.24Å
877	C	94.5	Very high	90.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.4	177.1	-174.9	0	0	0	0	111.9	I836 L837 I898 W912 M913	I836-C877 WeakPolarHBondContact CA-O 3.24Å; L837-C877 PolarHBondContact N-O 2.74Å; L837-C877 PolarHBondContact O-N 3.05Å; C877-I898 PolarHBondContact SG-O 3.46Å; C877-W912 HydrophobicContact CB-CE3 3.86Å; C877-W912 HydrophobicContact CB-CZ3 3.66Å; C877-M913 HydrophobicContact CB-CE 4.47Å; C877-M913 HydrophobicContact CB-SD 4.01Å
878	V	95.5	Very high	89.4	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	103.9	176.5	179.8	0	0	0	0	110.1	I812 I836 L880 R897 I898 W923	I812-V878 HydrophobicContact CD1-CG1 3.69Å; I812-V878 HydrophobicContact CD1-CG2 3.94Å; I836-V878 HydrophobicContact CD1-CB 4.48Å; I836-V878 HydrophobicContact CD1-CG2 3.75Å; V878-L880 HydrophobicContact CG1-CD1 4.26Å; V878-L880 HydrophobicContact CG1-CG 4.02Å; V878-R897 CarbonylContact O-C 3.6Å; V878-R897 VanDerWaalsContact O-CA 3.31Å; V878-R897 WeakPolarHBondContact O-CA 3.4Å; V878-I898 HydrophobicContact CB-CB 4.28Å; V878-I898 PolarHBondContact N-O 3.24Å; V878-I898 PolarHBondContact O-N 3.5Å; V878-W923 HydrophobicContact CG2-CE3 4.41Å; V878-W923 HydrophobicContact CG2-CH2 3.77Å; V878-W923 HydrophobicContact CG2-CZ3 3.45Å; V878-W923 VanDerWaalsContact CG2-CZ3 3.45Å
879	E	95.1	Very high	88.7	Confident	14 Å²	14	53.8 Å²	53.8	7%	0.065	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114.3	169.8	-172.6	176.4	91.5	0	0	110.3	C834 T835 L837 T881 L896 R897 L943	C834-E879 CarbonylContact C-O 3.46Å; C834-E879 WeakPolarHBondContact CA-O 3.25Å; T835-E879 PolarHBondContact N-O 3.01Å; T835-E879 PolarHBondContact O-N 2.89Å; L837-E879 HydrophobicContact CD1-CB 4.03Å; L837-E879 HydrophobicContact CG-CB 4.31Å; E879-T881 HydrophobicContact CG-CG2 4.12Å; E879-L896 WeakPolarHBondContact CA-O 3.48Å; E879-R897 HydrophobicContact CB-CG 4.15Å; E879-R897 HydrophobicContact CG-CG 3.96Å; E879-R897 IonicContact OE2-CZ 2.79Å; E879-R897 VanDerWaalsContact OE2-CZ 3.31Å; E879-R897 IonicContact OE2-NE 2.81Å; E879-R897 PolarHBondContact OE2-NE 2.82Å; E879-R897 IonicContact OE2-NH2 2.7Å; E879-R897 PolarHBondContact OE2-NH2 2.83Å; E879-L943 HydrophobicContact CG-CD1 3.86Å
880	L	96.1	Very high	88.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.3	173	-75.8	164.4	0	0	0	109.5	M788 L790 I812 V814 V832 K833 C834 V878 G895 L896 I898	M788-L880 HydrophobicContact SD-CB 4.47Å; M788-L880 HydrophobicContact SD-CD1 4.05Å; L790-L880 HydrophobicContact CD2-CD1 4.06Å; I812-L880 HydrophobicContact CG2-CD1 4.39Å; V814-L880 HydrophobicContact CG2-CD2 4.05Å; V832-L880 HydrophobicContact CG1-CB 4.43Å; V832-L880 HydrophobicContact CG1-CD2 3.81Å; K833-L880 WeakPolarHBondContact O-CA 3.29Å; C834-L880 HydrophobicContact CB-CD2 3.69Å; V878-L880 HydrophobicContact CG1-CD1 4.26Å; V878-L880 HydrophobicContact CG1-CG 4.02Å; L880-G895 CarbonylContact O-C 3.53Å; L880-G895 WeakPolarHBondContact O-CA 3.42Å; L880-L896 HydrophobicContact CB-CB 4.45Å; L880-L896 PolarHBondContact N-O 2.88Å; L880-L896 PolarHBondContact O-N 2.81Å; L880-I898 HydrophobicContact CD1-CD1 4.03Å
881	T	94.8	Very high	88.5	Confident	8 Å²	8	50.5 Å²	50.5	5%	0.049	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.1	-179.3	53.1	0	0	0	0	112.1	V832 K833 E879 W883 F892 L943	V832-T881 CarbonylContact C-O 3.5Å; V832-T881 WeakPolarHBondContact CA-O 3.41Å; K833-T881 PolarHBondContact N-O 2.82Å; K833-T881 PolarHBondContact O-N 3.45Å; E879-T881 HydrophobicContact CG-CG2 4.12Å; T881-W883 VanDerWaalsContact CB-NE1 3.28Å; T881-W883 PolarHBondContact OG1-NE1 3.14Å; T881-F892 HydrophobicContact CG2-CE2 3.8Å; T881-L943 HydrophobicContact CG2-CD1 3.98Å
882	V	94.8	Very high	88.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.1	179	-164.6	0	0	0	0	110.2	M788 L820 V832 F892 L893 G894 L940	M788-V882 HydrophobicContact CE-CG2 3.39Å; L820-V882 HydrophobicContact CD1-CG1 4Å; L820-V882 HydrophobicContact CD2-CG1 4.16Å; V832-V882 HydrophobicContact CG2-CG2 4.27Å; V882-F892 WeakPolarHBondContact O-CD2 3.42Å; V882-L893 HydrophobicContact CB-CB 4.38Å; V882-L893 HydrophobicContact CG1-CB 4.47Å; V882-L893 HydrophobicContact CG1-CD1 4.13Å; V882-L893 PolarHBondContact O-N 3.03Å; V882-G894 PolarHBondContact N-O 3.34Å; V882-L940 HydrophobicContact CG2-CD1 3.96Å; V882-L940 HydrophobicContact CG2-CD2 3.79Å
883	W	93	Very high	88.5	Confident	41 Å²	41	45.9 Å²	45.9	16%	0.155	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.8	-175.7	-60.3	79.3	0	0	0	111.4	S830 F831 K833 T881 N890 Q891 F892 I945	S830-W883 CarbonylContact C-O 3.52Å; S830-W883 VanDerWaalsContact CA-O 3.29Å; S830-W883 WeakPolarHBondContact CA-O 3.32Å; F831-W883 HydrophobicContact CD1-CB 3.96Å; F831-W883 VanDerWaalsContact CD1-O 3.22Å; F831-W883 WeakPolarHBondContact CD1-O 3.43Å; F831-W883 HydrophobicContact CE1-CB 3.55Å; F831-W883 HydrophobicContact CE1-CG 4.49Å; F831-W883 HydrophobicContact CE2-CB 4.48Å; F831-W883 HydrophobicContact CZ-CB 3.86Å; F831-W883 HydrophobicContact CZ-CG 4.34Å; F831-W883 PolarHBondContact N-O 2.87Å; F831-W883 PolarHBondContact O-N 2.68Å; K833-W883 HydrophobicContact CD-CG 4.5Å; K833-W883 VanDerWaalsContact CE-CD1 3.43Å; T881-W883 VanDerWaalsContact CB-NE1 3.28Å; T881-W883 PolarHBondContact OG1-NE1 3.14Å; W883-N890 HydrophobicContact CE3-CB 3.88Å; W883-Q891 CarbonylContact C-O 3.55Å; W883-Q891 VanDerWaalsContact CA-O 3.25Å; W883-Q891 WeakPolarHBondContact CA-O 3.42Å; W883-F892 HydrophobicContact CD2-CB 4.39Å; W883-F892 HydrophobicContact CD2-CD2 4.35Å; W883-F892 AromaticContact CE2-CD2 3.95Å; W883-F892 HydrophobicContact CE3-CB 4.01Å; W883-F892 HydrophobicContact CH2-CB 4.09Å; W883-F892 HydrophobicContact CH2-CD2 4.48Å; W883-F892 HydrophobicContact CZ2-CB 4.46Å; W883-F892 HydrophobicContact CZ2-CD2 4.04Å; W883-F892 HydrophobicContact CZ3-CB 3.86Å; W883-I945 HydrophobicContact CH2-CD1 3.84Å; W883-I945 HydrophobicContact CZ2-CD1 3.82Å
884	D	90.4	Very high	88.4	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.011	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	132.8	163.2	170.5	46.6	0	0	0	110.5	L828 N829 N890 Q891 L893	L828-D884 HydrophobicContact CD2-CB 4.04Å; N829-D884 PolarHBondContact N-OD1 3.32Å; D884-N890 CarbonylContact O-C 3.57Å; D884-N890 VanDerWaalsContact O-CA 3.26Å; D884-N890 WeakPolarHBondContact O-CA 3.38Å; D884-Q891 HydrophobicContact CB-CB 4.41Å; D884-Q891 PolarHBondContact N-O 2.79Å; D884-Q891 PolarHBondContact O-N 2.8Å; D884-L893 HydrophobicContact CB-CD1 4.26Å; D884-L893 HydrophobicContact CB-CD2 4.05Å; D884-L893 HydrophobicContact CB-CG 4.3Å
885	H	86.7	Confident	88.5	Confident	87 Å²	87	40.4 Å²	40.4	40%	0.403	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	87.1	176.9	-175.2	-81.9	0	0	0	111.6	N829 F831 N890	N829-H885 HydrophobicContact CB-CB 4.12Å; N829-H885 PolarHBondContact ND2-O 2.85Å; N829-H885 WeakPolarHBondContact O-CB 3.23Å; N829-H885 PolarHBondContact O-N 2.94Å; F831-H885 HydrophobicContact CD1-CB 4.14Å; F831-H885 HydrophobicContact CE1-CB 4.04Å; H885-N890 PolarHBondContact CD2-OD1 2.87Å
886	Y	78.3	Confident	88.7	Confident	81 Å²	81	37.9 Å²	37.9	32%	0.318	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	98.7	179.5	-168.1	-90.7	0	0	0	113.1	R824 L888 T889	R824-Y886 HydrophobicContact CG-CD2 4.43Å; R824-Y886 HydrophobicContact CG-CE2 4.5Å; Y886-L888 VanDerWaalsContact C-N 3.32Å; Y886-L888 PolarHBondContact O-N 2.84Å; Y886-T889 PolarHBondContact N-O 3.02Å; Y886-T889 PolarHBondContact O-N 2.87Å; Y886-T889 VanDerWaalsContact O-O 3.1Å; Y886-T889 PolarHBondContact O-OG1 3.06Å
887	K	76.6	Confident	88.8	Confident	164 Å²	164	37.8 Å²	37.8	71%	0.713	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	-77.2	176.2	-59.9	-167.2	177	-157.2	0	115.5
888	L	73.6	Confident	88.9	Confident	172 Å²	172	37.8 Å²	37.8	90%	0.901	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126	-4.2	-174	-70	163.5	0	0	0	112.3	Y886	Y886-L888 VanDerWaalsContact C-N 3.32Å; Y886-L888 PolarHBondContact O-N 2.84Å
889	T	72.9	Confident	88.9	Confident	73 Å²	73	37.8 Å²	37.8	45%	0.448	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	121.8	-175.6	56.6	0	0	0	0	110.7	Y886	Y886-T889 PolarHBondContact N-O 3.02Å; Y886-T889 PolarHBondContact O-N 2.87Å; Y886-T889 VanDerWaalsContact O-O 3.1Å; Y886-T889 PolarHBondContact O-OG1 3.06Å
890	N	85.5	Confident	88.9	Confident	73 Å²	73	39.6 Å²	39.6	39%	0.39	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130.4	169.7	-61.5	-62.2	0	0	0	109.7	F831 W883 D884 H885	F831-N890 WeakPolarHBondContact CE1-OD1 3.29Å; W883-N890 HydrophobicContact CE3-CB 3.88Å; D884-N890 CarbonylContact O-C 3.57Å; D884-N890 VanDerWaalsContact O-CA 3.26Å; D884-N890 WeakPolarHBondContact O-CA 3.38Å; H885-N890 PolarHBondContact CD2-OD1 2.87Å
891	Q	84	Confident	88.7	Confident	46 Å²	46	40.9 Å²	40.9	22%	0.215	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.9	177.4	179.8	157.3	-4.2	0	0	109.8	L823 W883 D884	L823-Q891 HydrophobicContact CD1-CG 4.23Å; W883-Q891 CarbonylContact C-O 3.55Å; W883-Q891 VanDerWaalsContact CA-O 3.25Å; W883-Q891 WeakPolarHBondContact CA-O 3.42Å; D884-Q891 HydrophobicContact CB-CB 4.41Å; D884-Q891 PolarHBondContact N-O 2.79Å; D884-Q891 PolarHBondContact O-N 2.8Å
892	F	88.6	Confident	88.6	Confident	31 Å²	31	44.3 Å²	44.3	14%	0.136	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	130.1	176.2	179.2	-119.7	0	0	0	109.9	T881 V882 W883 G894 M942 L943 I945	T881-F892 HydrophobicContact CG2-CE2 3.8Å; V882-F892 WeakPolarHBondContact O-CD2 3.42Å; W883-F892 HydrophobicContact CD2-CB 4.39Å; W883-F892 HydrophobicContact CD2-CD2 4.35Å; W883-F892 AromaticContact CE2-CD2 3.95Å; W883-F892 HydrophobicContact CE3-CB 4.01Å; W883-F892 HydrophobicContact CH2-CB 4.09Å; W883-F892 HydrophobicContact CH2-CD2 4.48Å; W883-F892 HydrophobicContact CZ2-CB 4.46Å; W883-F892 HydrophobicContact CZ2-CD2 4.04Å; W883-F892 HydrophobicContact CZ3-CB 3.86Å; F892-G894 WeakPolarHBondContact CE2-O 3.31Å; F892-M942 HydrophobicContact CD1-SD 4.03Å; F892-M942 HydrophobicContact CE1-SD 3.83Å; F892-L943 HydrophobicContact CZ-CB 4.08Å; F892-L943 HydrophobicContact CZ-CG 4.4Å; F892-I945 HydrophobicContact CB-CD1 4.46Å; F892-I945 HydrophobicContact CD1-CD1 4.09Å; F892-I945 HydrophobicContact CD2-CD1 3.94Å; F892-I945 HydrophobicContact CE1-CD1 4.27Å; F892-I945 HydrophobicContact CE1-CG1 4.47Å; F892-I945 HydrophobicContact CE2-CD1 4.13Å; F892-I945 HydrophobicContact CE2-CG1 4.48Å; F892-I945 HydrophobicContact CG-CD1 3.92Å; F892-I945 HydrophobicContact CZ-CD1 4.29Å; F892-I945 HydrophobicContact CZ-CG1 4.33Å
893	L	88.7	Confident	88.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-53.1	177.6	-56.9	-177.1	0	0	0	110.4	R785 L820 L823 L828 V882 D884	R785-L893 WeakPolarHBondContact CD-O 3.16Å; R785-L893 PolarHBondContact NH1-O 3.45Å; L820-L893 HydrophobicContact CB-CD1 4.25Å; L820-L893 HydrophobicContact CD1-CD1 4.05Å; L820-L893 HydrophobicContact CD2-CD1 4.48Å; L823-L893 HydrophobicContact CD1-CD2 3.89Å; L823-L893 HydrophobicContact CG-CD2 4.21Å; L828-L893 HydrophobicContact CD1-CD1 4.1Å; L828-L893 HydrophobicContact CD2-CD2 4.5Å; V882-L893 HydrophobicContact CB-CB 4.38Å; V882-L893 HydrophobicContact CG1-CB 4.47Å; V882-L893 HydrophobicContact CG1-CD1 4.13Å; V882-L893 PolarHBondContact O-N 3.03Å; D884-L893 HydrophobicContact CB-CD1 4.26Å; D884-L893 HydrophobicContact CB-CD2 4.05Å; D884-L893 HydrophobicContact CB-CG 4.3Å
894	G	90.7	Very high	88.3	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	179.3	178.1	0	0	0	0	0	110.9	V882 F892	V882-G894 PolarHBondContact N-O 3.34Å; F892-G894 WeakPolarHBondContact CE2-O 3.31Å
895	G	93.6	Very high	88.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	179.3	177.9	0	0	0	0	0	113.7	L880 R941	L880-G895 CarbonylContact O-C 3.53Å; L880-G895 WeakPolarHBondContact O-CA 3.42Å; G895-R941 PolarHBondContact N-O 2.96Å; G895-R941 VanDerWaalsContact O-CG 3.26Å; G895-R941 WeakPolarHBondContact O-CG 3.3Å; G895-R941 PolarHBondContact O-N 3.26Å
896	L	95.4	Very high	88.5	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.4	177.1	-58	173.9	0	0	0	109.6	M788 L790 E879 L880 I898 E919 L938 P939 L940	M788-L896 HydrophobicContact CB-CD1 4.11Å; M788-L896 HydrophobicContact SD-CD1 4.23Å; L790-L896 HydrophobicContact CD2-CD1 3.6Å; E879-L896 WeakPolarHBondContact CA-O 3.48Å; L880-L896 HydrophobicContact CB-CB 4.45Å; L880-L896 PolarHBondContact N-O 2.88Å; L880-L896 PolarHBondContact O-N 2.81Å; L896-I898 HydrophobicContact CB-CD1 4.38Å; L896-I898 HydrophobicContact CB-CG1 4.08Å; L896-I898 HydrophobicContact CD1-CD1 4.18Å; L896-E919 WeakPolarHBondContact CA-OE1 3.13Å; L896-E919 WeakPolarHBondContact CB-OE1 3.31Å; L896-L938 HydrophobicContact CD1-CB 3.82Å; L896-L938 HydrophobicContact CD1-CD1 3.98Å; L896-L938 HydrophobicContact CD2-CB 3.84Å; L896-P939 VanDerWaalsContact CD2-O 3.25Å; L896-P939 WeakPolarHBondContact CD2-O 3.29Å; L896-L940 HydrophobicContact CD2-CD2 4.42Å; L896-L940 HydrophobicContact CG-CD2 4.12Å
897	R	95.4	Very high	88.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	104.3	167.4	-69.1	165.2	168.5	175.3	-10.8	109.3	V878 E879 D911 D914 S915 E919 L943 L944	V878-R897 CarbonylContact O-C 3.6Å; V878-R897 VanDerWaalsContact O-CA 3.31Å; V878-R897 WeakPolarHBondContact O-CA 3.4Å; E879-R897 HydrophobicContact CB-CG 4.15Å; E879-R897 HydrophobicContact CG-CG 3.96Å; E879-R897 IonicContact OE2-CZ 2.79Å; E879-R897 VanDerWaalsContact OE2-CZ 3.31Å; E879-R897 IonicContact OE2-NE 2.81Å; E879-R897 PolarHBondContact OE2-NE 2.82Å; E879-R897 IonicContact OE2-NH2 2.7Å; E879-R897 PolarHBondContact OE2-NH2 2.83Å; R897-D911 PolarHBondContact NH1-O 3.11Å; R897-D911 VanDerWaalsContact NH1-O 3.11Å; R897-D914 WeakPolarHBondContact CD-OD1 3.44Å; R897-D914 IonicContact NE-OD1 3.36Å; R897-D914 IonicContact NH1-OD1 3.49Å; R897-D914 PolarHBondContact NH1-OD1 2.7Å; R897-D914 IonicContact NH1-OD2 3.51Å; R897-D914 PolarHBondContact NH1-OD2 2.94Å; R897-S915 WeakPolarHBondContact O-CB 3.25Å; R897-S915 PolarHBondContact O-OG 2.81Å; R897-E919 PolarHBondContact N-OE1 3.07Å; R897-E919 VanDerWaalsContact O-CD 3.27Å; R897-L943 HydrophobicContact CG-CD1 3.93Å; R897-L943 HydrophobicContact CG-CD2 3.99Å; R897-L944 PolarHBondContact NH2-O 2.81Å
898	I	96.9	Very high	89.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	113.4	-168.3	-43.5	179.5	0	0	0	108.4	L790 L792 C877 V878 L880 L896 E919 L922 W923 L938	L790-I898 HydrophobicContact CD1-CD1 3.8Å; L790-I898 HydrophobicContact CD2-CD1 3.86Å; L790-I898 HydrophobicContact CG-CD1 4.47Å; L792-I898 HydrophobicContact CD1-CG2 3.98Å; C877-I898 PolarHBondContact SG-O 3.46Å; V878-I898 HydrophobicContact CB-CB 4.28Å; V878-I898 PolarHBondContact N-O 3.24Å; V878-I898 PolarHBondContact O-N 3.5Å; L880-I898 HydrophobicContact CD1-CD1 4.03Å; L896-I898 HydrophobicContact CB-CD1 4.38Å; L896-I898 HydrophobicContact CB-CG1 4.08Å; L896-I898 HydrophobicContact CD1-CD1 4.18Å; I898-E919 HydrophobicContact CG1-CG 4.49Å; I898-E919 WeakPolarHBondContact CG2-O 3.3Å; I898-L922 HydrophobicContact CD1-CD2 4.28Å; I898-L922 HydrophobicContact CG2-CB 4.45Å; I898-L922 HydrophobicContact CG2-CD2 4.24Å; I898-L922 HydrophobicContact CG2-CG 4.49Å; I898-W923 HydrophobicContact CG2-CB 4.22Å; I898-W923 HydrophobicContact CG2-CE3 4.14Å; I898-L938 HydrophobicContact CD1-CD1 4.02Å; I898-L938 HydrophobicContact CG1-CD1 4.45Å
899	G	95.5	Very high	90.3	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-173.2	-168.9	0	0	0	0	0	110.2	G901 S915 V920	G899-G901 VanDerWaalsContact C-N 3.32Å; G899-G901 PolarHBondContact O-N 2.73Å; G899-S915 PolarHBondContact N-OG 3.41Å; G899-S915 WeakPolarHBondContact O-CB 3.43Å; G899-S915 PolarHBondContact O-OG 3.45Å; G899-V920 WeakPolarHBondContact O-CA 3.36Å; G899-V920 WeakPolarHBondContact O-CG2 3.16Å
900	F	95	Very high	91	Very high	52 Å²	52	42.1 Å²	42.1	23%	0.228	24%	0.24	C	C	.	.			trans	-78.4	-2.5	-176.6	-80.9	-82.8	0	0	0	115.8	L873 M874 T902 W923 E924 V927	L873-F900 WeakPolarHBondContact O-CD2 3.41Å; L873-F900 VanDerWaalsContact O-CE2 3.29Å; L873-F900 WeakPolarHBondContact O-CE2 3.45Å; M874-F900 HydrophobicContact CB-CE2 4.48Å; M874-F900 HydrophobicContact CG-CE2 4.3Å; F900-T902 HydrophobicContact CB-CG2 3.85Å; F900-T902 PolarHBondContact O-N 3.05Å; F900-W923 AromaticContact CD2-CD1 3.31Å; F900-W923 AromaticContact CD2-NE1 3.4Å; F900-W923 AromaticContact CE2-CD1 3.4Å; F900-W923 VanDerWaalsContact CE2-CD1 3.4Å; F900-W923 AromaticContact CE2-NE1 3.45Å; F900-W923 AromaticContact CG-CD1 3.94Å; F900-E924 HydrophobicContact CD1-CG 4.14Å; F900-E924 HydrophobicContact CE1-CG 3.71Å; F900-V927 HydrophobicContact CE2-CG2 4.2Å; F900-V927 HydrophobicContact CZ-CG2 4.22Å
901	G	92.2	Very high	91	Very high	28 Å²	28	43.4 Å²	43.4	29%	0.289	25%	0.247	S	C	.	.			trans	63.2	16.5	172.5	0	0	0	0	0	116.4	G899 G903 M913	G899-G901 VanDerWaalsContact C-N 3.32Å; G899-G901 PolarHBondContact O-N 2.73Å; G901-G903 PolarHBondContact O-N 2.76Å; G901-G903 VanDerWaalsContact O-N 3.15Å; G901-M913 CarbonylContact C-O 3.59Å; G901-M913 VanDerWaalsContact C-O 3.26Å; G901-M913 WeakPolarHBondContact CA-O 3.29Å
902	T	92.8	Very high	91.2	Very high	80 Å²	80	42.4 Å²	42.4	49%	0.491	24%	0.241	S	C	.	.			trans	-70	-7	-172	65.1	0	0	0	0	115.3	F900 K904 M913	F900-T902 HydrophobicContact CB-CG2 3.85Å; F900-T902 PolarHBondContact O-N 3.05Å; T902-K904 PolarHBondContact O-N 3.04Å; T902-K904 PolarHBondContact OG1-N 3.47Å; T902-K904 PolarHBondContact OG1-O 2.88Å; T902-M913 WeakPolarHBondContact OG1-CG 3.5Å
903	G	89.8	Confident	91.3	Very high	30 Å²	30	41 Å²	41	31%	0.309	24%	0.235	S	C	.	.	S	Bend	trans	66.4	4	-168.6	0	0	0	0	0	114.9	G901 V910 M913	G901-G903 PolarHBondContact O-N 2.76Å; G901-G903 VanDerWaalsContact O-N 3.15Å; G903-V910 PolarHBondContact O-N 2.72Å; G903-M913 WeakPolarHBondContact CA-O 3.22Å; G903-M913 PolarHBondContact N-O 3.12Å
904	K	90.9	Very high	91.5	Very high	88 Å²	88	43.9 Å²	43.9	38%	0.383	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.3	-175.6	-55.8	-164.6	-179	-145.7	0	111.8	T902 T908 E909 M913	T902-K904 PolarHBondContact O-N 3.04Å; T902-K904 PolarHBondContact OG1-N 3.47Å; T902-K904 PolarHBondContact OG1-O 2.88Å; K904-T908 CarbonylContact C-O 3.3Å; K904-T908 WeakPolarHBondContact CA-O 3.19Å; K904-E909 HydrophobicContact CD-CG 4.04Å; K904-E909 WeakPolarHBondContact CE-OE1 3.14Å; K904-E909 HydrophobicContact CG-CG 3.99Å; K904-E909 IonicContact NZ-OE1 3.14Å; K904-E909 PolarHBondContact NZ-OE1 3.39Å; K904-M913 WeakPolarHBondContact O-CE 3.48Å
905	S	90.7	Very high	91.6	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	125.3	173.8	-179.4	0	0	0	0	109.8	E875 G907 T908 W912	E875-S905 PolarHBondContact O-OG 3.12Å; E875-S905 VanDerWaalsContact OE2-CA 3.24Å; E875-S905 WeakPolarHBondContact OE2-CA 3.36Å; S905-G907 VanDerWaalsContact C-N 3.25Å; S905-G907 PolarHBondContact O-N 2.77Å; S905-T908 PolarHBondContact N-O 2.95Å; S905-T908 WeakPolarHBondContact O-CB 3.28Å; S905-T908 PolarHBondContact O-N 3.49Å; S905-W912 VanDerWaalsContact OG-CH2 3.23Å; S905-W912 WeakPolarHBondContact OG-CH2 3.38Å
906	Y	90.9	Very high	91.6	Very high	116 Å²	116	47.1 Å²	47.1	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	48.5	-173.1	-58.4	-88.1	0	0	0	111.5	P838 E875 T908	P838-Y906 HydrophobicContact CG-CD2 4.2Å; P838-Y906 HydrophobicContact CG-CE2 3.78Å; E875-Y906 HydrophobicContact CB-CD1 4.18Å; E875-Y906 HydrophobicContact CB-CD2 3.89Å; E875-Y906 HydrophobicContact CB-CE1 3.89Å; E875-Y906 HydrophobicContact CB-CE2 3.54Å; E875-Y906 HydrophobicContact CB-CG 4.18Å; E875-Y906 HydrophobicContact CG-CD1 4.23Å; E875-Y906 HydrophobicContact CG-CE1 4.21Å; E875-Y906 HydrophobicContact CG-CG 4.43Å; E875-Y906 WeakPolarHBondContact OE1-CA 3.43Å; E875-Y906 PolarHBondContact OE1-N 3.46Å; E875-Y906 PolarHBondContact OE2-N 2.79Å; Y906-T908 PolarHBondContact O-N 3.21Å; Y906-T908 VanDerWaalsContact O-N 3.12Å
907	G	88.1	Confident	91.5	Very high	64 Å²	64	52 Å²	52	66%	0.66	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-5.7	-176.4	0	0	0	0	0	116.6	S905	S905-G907 VanDerWaalsContact C-N 3.25Å; S905-G907 PolarHBondContact O-N 2.77Å
908	T	89	Confident	91.5	Very high	90 Å²	90	56.9 Å²	56.9	55%	0.552	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.2	-178.3	-54.6	0	0	0	0	111	K904 S905 Y906	K904-T908 CarbonylContact C-O 3.3Å; K904-T908 WeakPolarHBondContact CA-O 3.19Å; S905-T908 PolarHBondContact N-O 2.95Å; S905-T908 WeakPolarHBondContact O-CB 3.28Å; S905-T908 PolarHBondContact O-N 3.49Å; Y906-T908 PolarHBondContact O-N 3.21Å; Y906-T908 VanDerWaalsContact O-N 3.12Å
909	E	89.5	Confident	91.5	Very high	145 Å²	145	56.9 Å²	56.9	68%	0.678	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	132.5	174.4	-77.1	170.9	-171.3	0	0	111.6	K904	K904-E909 HydrophobicContact CD-CG 4.04Å; K904-E909 WeakPolarHBondContact CE-OE1 3.14Å; K904-E909 HydrophobicContact CG-CG 3.99Å; K904-E909 IonicContact NZ-OE1 3.14Å; K904-E909 PolarHBondContact NZ-OE1 3.39Å
910	V	87.6	Confident	91.6	Very high	34 Å²	34	58.1 Å²	58.1	21%	0.206	34%	0.335	C	S	.	.			trans	-140.4	142.9	-170.9	-69.6	0	0	0	0	113.2	G903 W912 M913	G903-V910 PolarHBondContact O-N 2.72Å; V910-W912 HydrophobicContact CB-CD2 4.24Å; V910-W912 HydrophobicContact CB-CG 4.34Å; V910-W912 HydrophobicContact CB-CZ2 4.23Å; V910-W912 HydrophobicContact CG1-CZ2 4.01Å; V910-W912 HydrophobicContact CG2-CD2 4.14Å; V910-W912 HydrophobicContact CG2-CH2 4.5Å; V910-W912 HydrophobicContact CG2-CZ2 4.09Å; V910-W912 PolarHBondContact O-N 3.41Å; V910-M913 HydrophobicContact CG2-CB 3.67Å
911	D	85.7	Confident	91.7	Very high	100 Å²	100	58.1 Å²	58.1	54%	0.535	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	5.5	-177.8	69.3	-29.1	0	0	0	114.6	R897	R897-D911 PolarHBondContact NH1-O 3.11Å; R897-D911 VanDerWaalsContact NH1-O 3.11Å
912	W	88.3	Confident	91.9	Very high	26 Å²	26	57 Å²	57	10%	0.098	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-5.3	-174.5	57.5	-101.7	0	0	0	114.9	L837 P838 C877 S905 V910 D914	L837-W912 HydrophobicContact CB-CD2 3.87Å; L837-W912 HydrophobicContact CB-CE3 3.52Å; L837-W912 HydrophobicContact CB-CH2 3.83Å; L837-W912 HydrophobicContact CB-CZ2 4.16Å; L837-W912 HydrophobicContact CB-CZ3 3.52Å; L837-W912 HydrophobicContact CD1-CB 3.66Å; L837-W912 HydrophobicContact CD1-CD2 3.65Å; L837-W912 HydrophobicContact CD1-CE3 3.69Å; L837-W912 HydrophobicContact CD1-CG 3.66Å; L837-W912 HydrophobicContact CG-CD2 4.37Å; L837-W912 HydrophobicContact CG-CE3 4.26Å; P838-W912 HydrophobicContact CB-CH2 4.16Å; P838-W912 HydrophobicContact CB-CZ2 3.9Å; C877-W912 HydrophobicContact CB-CE3 3.86Å; C877-W912 HydrophobicContact CB-CZ3 3.66Å; S905-W912 VanDerWaalsContact OG-CH2 3.23Å; S905-W912 WeakPolarHBondContact OG-CH2 3.38Å; V910-W912 HydrophobicContact CB-CD2 4.24Å; V910-W912 HydrophobicContact CB-CG 4.34Å; V910-W912 HydrophobicContact CB-CZ2 4.23Å; V910-W912 HydrophobicContact CG1-CZ2 4.01Å; V910-W912 HydrophobicContact CG2-CD2 4.14Å; V910-W912 HydrophobicContact CG2-CH2 4.5Å; V910-W912 HydrophobicContact CG2-CZ2 4.09Å; V910-W912 PolarHBondContact O-N 3.41Å; W912-D914 PolarHBondContact O-N 3.01Å
913	M	91.1	Very high	92.1	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	31%	0.309	C	S	.	.			trans	-91.1	56.3	169.1	-167.9	69.4	91.1	0	0	109.1	E875 C877 G901 T902 G903 K904 V910	E875-M913 WeakPolarHBondContact O-CE 3.49Å; C877-M913 HydrophobicContact CB-CE 4.47Å; C877-M913 HydrophobicContact CB-SD 4.01Å; G901-M913 CarbonylContact C-O 3.59Å; G901-M913 VanDerWaalsContact C-O 3.26Å; G901-M913 WeakPolarHBondContact CA-O 3.29Å; T902-M913 WeakPolarHBondContact OG1-CG 3.5Å; G903-M913 WeakPolarHBondContact CA-O 3.22Å; G903-M913 PolarHBondContact N-O 3.12Å; K904-M913 WeakPolarHBondContact O-CE 3.48Å; V910-M913 HydrophobicContact CG2-CB 3.67Å
914	D	91.7	Very high	92.5	Very high	61 Å²	61	56 Å²	56	33%	0.326	31%	0.314	S	S	.	.			trans	-113.2	27.7	-167.6	71.8	-16.1	0	0	0	112.9	R897 W912 R941	R897-D914 WeakPolarHBondContact CD-OD1 3.44Å; R897-D914 IonicContact NE-OD1 3.36Å; R897-D914 IonicContact NH1-OD1 3.49Å; R897-D914 PolarHBondContact NH1-OD1 2.7Å; R897-D914 IonicContact NH1-OD2 3.51Å; R897-D914 PolarHBondContact NH1-OD2 2.94Å; W912-D914 PolarHBondContact O-N 3.01Å; D914-R941 PolarHBondContact O-NH2 3.17Å; D914-R941 IonicContact OD1-CZ 2.75Å; D914-R941 IonicContact OD1-NH1 2.75Å; D914-R941 PolarHBondContact OD1-NH1 2.97Å; D914-R941 IonicContact OD1-NH2 2.76Å; D914-R941 PolarHBondContact OD1-NH2 3.23Å; D914-R941 IonicContact OD2-CZ 3.07Å; D914-R941 IonicContact OD2-NH1 2.74Å; D914-R941 PolarHBondContact OD2-NH1 2.92Å; D914-R941 IonicContact OD2-NH2 3.45Å
915	S	93.8	Very high	92.7	Very high	15 Å²	15	57.2 Å²	57.2	11%	0.105	32%	0.319	C	S	.	.			trans	-58.4	135.9	-174.2	-56.7	0	0	0	0	113.4	R897 G899 E919	R897-S915 WeakPolarHBondContact O-CB 3.25Å; R897-S915 PolarHBondContact O-OG 2.81Å; G899-S915 PolarHBondContact N-OG 3.41Å; G899-S915 WeakPolarHBondContact O-CB 3.43Å; G899-S915 PolarHBondContact O-OG 3.45Å; S915-E919 VanDerWaalsContact CA-OE2 3.3Å; S915-E919 WeakPolarHBondContact CA-OE2 3.39Å
916	T	92.5	Very high	93	Very high	53 Å²	53	57 Å²	57	33%	0.325	32%	0.317	S	S	.	.			trans	-68.6	164.8	170.9	70.7	0	0	0	0	111.4	E918 E919 V920	T916-E918 PolarHBondContact O-N 3.02Å; T916-E919 PolarHBondContact N-OE2 3.08Å; T916-E919 PolarHBondContact O-N 2.88Å; T916-E919 VanDerWaalsContact O-N 3.11Å; T916-E919 WeakPolarHBondContact OG1-CG 3.42Å; T916-E919 PolarHBondContact OG1-N 3Å; T916-V920 WeakPolarHBondContact O-CG2 3.35Å; T916-V920 PolarHBondContact O-N 3.05Å
917	S	94.4	Very high	93.2	Very high	103 Å²	103	53.4 Å²	53.4	72%	0.72	31%	0.308	S	S	*	.	H	α-helix	trans	-54.6	-33.6	175.4	44.5	0	0	0	0	113.7	A921	S917-A921 VanDerWaalsContact O-CB 3.24Å; S917-A921 WeakPolarHBondContact O-CB 3.03Å; S917-A921 PolarHBondContact O-N 3.04Å
918	E	94.9	Very high	93.5	Very high	102 Å²	102	56.4 Å²	56.4	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-76.6	-39.4	177.3	-57.4	177.5	167	0	0	112.1	T916 A921 L922 L938 P939	T916-E918 PolarHBondContact O-N 3.02Å; E918-A921 PolarHBondContact O-N 3.12Å; E918-L922 PolarHBondContact O-N 2.85Å; E918-L922 VanDerWaalsContact O-N 3.11Å; E918-L938 HydrophobicContact CB-CD2 3.5Å; E918-P939 WeakPolarHBondContact OE2-CD 3.46Å
919	E	96.7	Very high	93.7	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-41.9	172.7	-72	173.8	143	0	0	111.1	L896 R897 I898 S915 T916 W923 L938 R941	L896-E919 WeakPolarHBondContact CA-OE1 3.13Å; L896-E919 WeakPolarHBondContact CB-OE1 3.31Å; R897-E919 PolarHBondContact N-OE1 3.07Å; R897-E919 VanDerWaalsContact O-CD 3.27Å; I898-E919 HydrophobicContact CG1-CG 4.49Å; I898-E919 WeakPolarHBondContact CG2-O 3.3Å; S915-E919 VanDerWaalsContact CA-OE2 3.3Å; S915-E919 WeakPolarHBondContact CA-OE2 3.39Å; T916-E919 PolarHBondContact N-OE2 3.08Å; T916-E919 PolarHBondContact O-N 2.88Å; T916-E919 VanDerWaalsContact O-N 3.11Å; T916-E919 WeakPolarHBondContact OG1-CG 3.42Å; T916-E919 PolarHBondContact OG1-N 3Å; E919-W923 PolarHBondContact O-N 3.17Å; E919-L938 HydrophobicContact CG-CD1 4.23Å; E919-R941 IonicContact OE1-CZ 2.57Å; E919-R941 IonicContact OE1-NE 3.53Å; E919-R941 PolarHBondContact OE1-NE 2.87Å; E919-R941 VanDerWaalsContact OE1-NE 3.08Å; E919-R941 IonicContact OE1-NH2 2.64Å; E919-R941 IonicContact OE2-CZ 3.99Å; E919-R941 VanDerWaalsContact OE2-CZ 3.25Å; E919-R941 IonicContact OE2-NE 3.29Å; E919-R941 PolarHBondContact OE2-NE 2.95Å; E919-R941 IonicContact OE2-NH2 3.89Å; E919-R941 PolarHBondContact OE2-NH2 3.24Å
920	V	97.2	Very high	93.8	Very high	25 Å²	25	49.6 Å²	49.6	15%	0.152	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-50	174.5	174.7	0	0	0	0	110.9	G899 T916 L922 W923 E924	G899-V920 WeakPolarHBondContact O-CA 3.36Å; G899-V920 WeakPolarHBondContact O-CG2 3.16Å; T916-V920 WeakPolarHBondContact O-CG2 3.35Å; T916-V920 PolarHBondContact O-N 3.05Å; V920-L922 VanDerWaalsContact C-N 3.26Å; V920-L922 PolarHBondContact O-N 3.13Å; V920-W923 WeakPolarHBondContact O-CA 3.3Å; V920-W923 WeakPolarHBondContact O-CB 3.16Å; V920-W923 PolarHBondContact O-N 3.28Å; V920-E924 HydrophobicContact CG1-CG 4.02Å; V920-E924 WeakPolarHBondContact O-CG 3.34Å; V920-E924 PolarHBondContact O-N 3.47Å
921	A	97.3	Very high	94	Very high	52 Å²	52	52.6 Å²	52.6	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-59.9	-34.8	-178.6	0	0	0	0	0	112.8	S917 E918 K925	S917-A921 VanDerWaalsContact O-CB 3.24Å; S917-A921 WeakPolarHBondContact O-CB 3.03Å; S917-A921 PolarHBondContact O-N 3.04Å; E918-A921 PolarHBondContact O-N 3.12Å; A921-K925 WeakPolarHBondContact O-CB 3.27Å; A921-K925 PolarHBondContact O-N 3.35Å; A921-K925 VanDerWaalsContact O-N 3.07Å
922	L	97.5	Very high	94.5	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-41.7	172.8	-178.8	62.9	0	0	0	112.1	L790 L792 I898 E918 V920 M926 V934 A936 L938	L790-L922 HydrophobicContact CD1-CD2 3.83Å; L790-L922 HydrophobicContact CG-CD2 4.38Å; L792-L922 HydrophobicContact CD1-CD2 4.12Å; L792-L922 HydrophobicContact CD1-CG 4.04Å; L792-L922 HydrophobicContact CG-CD2 4.26Å; L792-L922 HydrophobicContact CG-CG 4.41Å; I898-L922 HydrophobicContact CD1-CD2 4.28Å; I898-L922 HydrophobicContact CG2-CB 4.45Å; I898-L922 HydrophobicContact CG2-CD2 4.24Å; I898-L922 HydrophobicContact CG2-CG 4.49Å; E918-L922 PolarHBondContact O-N 2.85Å; E918-L922 VanDerWaalsContact O-N 3.11Å; V920-L922 VanDerWaalsContact C-N 3.26Å; V920-L922 PolarHBondContact O-N 3.13Å; L922-M926 PolarHBondContact O-N 3.02Å; L922-M926 VanDerWaalsContact O-N 3.09Å; L922-V934 HydrophobicContact CD1-CB 4.29Å; L922-V934 HydrophobicContact CD1-CG2 3.81Å; L922-A936 HydrophobicContact CD1-CB 3.96Å; L922-A936 HydrophobicContact CD2-CB 4.17Å; L922-A936 HydrophobicContact CG-CB 4.48Å; L922-L938 HydrophobicContact CD2-CD1 3.75Å
923	W	97.3	Very high	95	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-48.9	178.8	-165.7	-109.9	0	0	0	111.9	L792 V810 L873 V878 I898 F900 E919 V920 K925 M926 V927	L792-W923 HydrophobicContact CD1-CE3 3.8Å; L792-W923 HydrophobicContact CD1-CZ3 4.09Å; V810-W923 HydrophobicContact CG1-CH2 4.43Å; L873-W923 HydrophobicContact CD2-CZ2 4.18Å; L873-W923 PolarHBondContact O-NE1 3.1Å; V878-W923 HydrophobicContact CG2-CE3 4.41Å; V878-W923 HydrophobicContact CG2-CH2 3.77Å; V878-W923 HydrophobicContact CG2-CZ3 3.45Å; V878-W923 VanDerWaalsContact CG2-CZ3 3.45Å; I898-W923 HydrophobicContact CG2-CB 4.22Å; I898-W923 HydrophobicContact CG2-CE3 4.14Å; F900-W923 AromaticContact CD2-CD1 3.31Å; F900-W923 AromaticContact CD2-NE1 3.4Å; F900-W923 AromaticContact CE2-CD1 3.4Å; F900-W923 VanDerWaalsContact CE2-CD1 3.4Å; F900-W923 AromaticContact CE2-NE1 3.45Å; F900-W923 AromaticContact CG-CD1 3.94Å; E919-W923 PolarHBondContact O-N 3.17Å; V920-W923 WeakPolarHBondContact O-CA 3.3Å; V920-W923 WeakPolarHBondContact O-CB 3.16Å; V920-W923 PolarHBondContact O-N 3.28Å; W923-K925 VanDerWaalsContact C-N 3.31Å; W923-K925 PolarHBondContact O-N 2.84Å; W923-M926 HydrophobicContact CD2-CE 3.98Å; W923-M926 HydrophobicContact CE3-CE 3.7Å; W923-M926 HydrophobicContact CE3-SD 4.37Å; W923-M926 HydrophobicContact CH2-CE 3.64Å; W923-M926 HydrophobicContact CZ2-CE 3.92Å; W923-M926 HydrophobicContact CZ3-CE 3.51Å; W923-M926 HydrophobicContact CZ3-SD 4.08Å; W923-M926 WeakPolarHBondContact O-CB 3.45Å; W923-M926 PolarHBondContact O-N 3.18Å; W923-M926 VanDerWaalsContact O-N 3.09Å; W923-V927 WeakPolarHBondContact O-CG2 3.33Å; W923-V927 PolarHBondContact O-N 2.84Å
924	E	96.7	Very high	95.3	Very high	87 Å²	87	54 Å²	54	41%	0.407	30%	0.301	S	S	.	.	H	α-helix	trans	-56.8	-44.9	174.8	-72	-174.3	161.3	0	0	111.6	F900 V920 M926 V927 N928	F900-E924 HydrophobicContact CD1-CG 4.14Å; F900-E924 HydrophobicContact CE1-CG 3.71Å; V920-E924 HydrophobicContact CG1-CG 4.02Å; V920-E924 WeakPolarHBondContact O-CG 3.34Å; V920-E924 PolarHBondContact O-N 3.47Å; E924-M926 VanDerWaalsContact C-N 3.28Å; E924-M926 PolarHBondContact O-N 3.2Å; E924-V927 PolarHBondContact O-N 3.21Å; E924-N928 VanDerWaalsContact O-CB 3.28Å; E924-N928 WeakPolarHBondContact O-CB 3.29Å; E924-N928 VanDerWaalsContact O-CG 3.28Å; E924-N928 PolarHBondContact O-N 3.16Å; E924-N928 PolarHBondContact O-ND2 3.07Å
925	K	96.8	Very high	95.5	Very high	114 Å²	114	55 Å²	55	50%	0.496	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-36.2	177.7	-165.5	-177.5	175.3	-179.5	0	111.8	A921 W923 S929 V934	A921-K925 WeakPolarHBondContact O-CB 3.27Å; A921-K925 PolarHBondContact O-N 3.35Å; A921-K925 VanDerWaalsContact O-N 3.07Å; W923-K925 VanDerWaalsContact C-N 3.31Å; W923-K925 PolarHBondContact O-N 2.84Å; K925-S929 WeakPolarHBondContact O-CB 3.48Å; K925-S929 PolarHBondContact O-N 3.08Å; K925-S929 VanDerWaalsContact O-N 3.12Å; K925-S929 PolarHBondContact O-OG 2.98Å; K925-V934 HydrophobicContact CB-CG1 4.41Å; K925-V934 HydrophobicContact CD-CB 4.15Å; K925-V934 HydrophobicContact CD-CG1 4.2Å; K925-V934 HydrophobicContact CG-CB 4.17Å; K925-V934 HydrophobicContact CG-CG1 3.81Å
926	M	96.2	Very high	95.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-49.7	174.1	-175.5	-161.1	64.2	0	0	111.4	L792 V810 L873 L922 W923 E924 N928 S929 V934	L792-M926 HydrophobicContact CB-CB 4.25Å; L792-M926 HydrophobicContact CB-CG 3.96Å; L792-M926 HydrophobicContact CB-SD 3.71Å; L792-M926 HydrophobicContact CD1-SD 4.16Å; V810-M926 HydrophobicContact CG1-SD 4.14Å; L873-M926 HydrophobicContact CD2-CE 4.32Å; L922-M926 PolarHBondContact O-N 3.02Å; L922-M926 VanDerWaalsContact O-N 3.09Å; W923-M926 HydrophobicContact CD2-CE 3.98Å; W923-M926 HydrophobicContact CE3-CE 3.7Å; W923-M926 HydrophobicContact CE3-SD 4.37Å; W923-M926 HydrophobicContact CH2-CE 3.64Å; W923-M926 HydrophobicContact CZ2-CE 3.92Å; W923-M926 HydrophobicContact CZ3-CE 3.51Å; W923-M926 HydrophobicContact CZ3-SD 4.08Å; W923-M926 WeakPolarHBondContact O-CB 3.45Å; W923-M926 PolarHBondContact O-N 3.18Å; W923-M926 VanDerWaalsContact O-N 3.09Å; E924-M926 VanDerWaalsContact C-N 3.28Å; E924-M926 PolarHBondContact O-N 3.2Å; M926-N928 VanDerWaalsContact C-N 3.34Å; M926-N928 PolarHBondContact O-N 3.48Å; M926-S929 CarbonylContact O-C 3.48Å; M926-S929 PolarHBondContact O-N 3.45Å; M926-V934 HydrophobicContact CB-CG2 3.64Å; M926-V934 HydrophobicContact CG-CG2 4.31Å
927	V	94.3	Very high	95.9	Very high	41 Å²	41	56 Å²	56	25%	0.248	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-41.7	-178.3	175.8	0	0	0	0	111.1	L873 F900 W923 E924 S929	L873-V927 HydrophobicContact CB-CG2 4.24Å; L873-V927 HydrophobicContact CD1-CG2 4.3Å; F900-V927 HydrophobicContact CE2-CG2 4.2Å; F900-V927 HydrophobicContact CZ-CG2 4.22Å; W923-V927 WeakPolarHBondContact O-CG2 3.33Å; W923-V927 PolarHBondContact O-N 2.84Å; E924-V927 PolarHBondContact O-N 3.21Å; V927-S929 VanDerWaalsContact C-N 3.3Å; V927-S929 PolarHBondContact O-N 2.89Å
928	N	94.8	Very high	96	Very high	128 Å²	128	51.3 Å²	51.3	68%	0.684	28%	0.279	S	S	*	.	H	α-helix	trans	-75.2	-13.9	177.9	-68.5	-37.6	0	0	0	114	E924 M926 P930	E924-N928 VanDerWaalsContact O-CB 3.28Å; E924-N928 WeakPolarHBondContact O-CB 3.29Å; E924-N928 VanDerWaalsContact O-CG 3.28Å; E924-N928 PolarHBondContact O-N 3.16Å; E924-N928 PolarHBondContact O-ND2 3.07Å; M926-N928 VanDerWaalsContact C-N 3.34Å; M926-N928 PolarHBondContact O-N 3.48Å; N928-P930 VanDerWaalsContact C-CD 3.4Å; N928-P930 WeakPolarHBondContact O-CD 3.18Å
929	S	93.9	Very high	96	Very high	36 Å²	36	49.3 Å²	49.3	25%	0.252	28%	0.275	S	S	.	.	S	Bend	trans	-123.4	58.9	-177.1	-43.2	0	0	0	0	112.2	K925 M926 V927 T932	K925-S929 WeakPolarHBondContact O-CB 3.48Å; K925-S929 PolarHBondContact O-N 3.08Å; K925-S929 VanDerWaalsContact O-N 3.12Å; K925-S929 PolarHBondContact O-OG 2.98Å; M926-S929 CarbonylContact O-C 3.48Å; M926-S929 PolarHBondContact O-N 3.45Å; V927-S929 VanDerWaalsContact C-N 3.3Å; V927-S929 PolarHBondContact O-N 2.89Å; S929-T932 VanDerWaalsContact O-CB 3.23Å; S929-T932 WeakPolarHBondContact O-CB 3.21Å; S929-T932 PolarHBondContact O-N 3.03Å; S929-T932 PolarHBondContact O-OG1 3.41Å
930	P	91.9	Very high	95.9	Very high	56 Å²	56	49.8 Å²	49.8	36%	0.364	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	147.5	-178.7	25.9	-35.2	0	0	0	111.8	P796 N928 T932	P796-P930 HydrophobicContact CG-CB 3.91Å; N928-P930 VanDerWaalsContact C-CD 3.4Å; N928-P930 WeakPolarHBondContact O-CD 3.18Å; P930-T932 PolarHBondContact O-N 2.83Å; P930-T932 VanDerWaalsContact O-N 3.09Å; P930-T932 PolarHBondContact O-OG1 3.17Å
931	N	92.1	Very high	95.5	Very high	96 Å²	96	50.9 Å²	50.9	51%	0.513	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	4.2	-171.4	-52.7	-67.6	0	0	0	115.4	Q793 Y794	Q793-N931 PolarHBondContact NE2-O 2.88Å; Y794-N931 PolarHBondContact O-N 3.5Å
932	T	96.3	Very high	94.7	Very high	77 Å²	77	53 Å²	53	47%	0.472	28%	0.281	S	S	.	.	S	Bend	trans	-105.8	138.4	178.9	-50.4	0	0	0	0	110.7	S929 P930	S929-T932 VanDerWaalsContact O-CB 3.23Å; S929-T932 WeakPolarHBondContact O-CB 3.21Å; S929-T932 PolarHBondContact O-N 3.03Å; S929-T932 PolarHBondContact O-OG1 3.41Å; P930-T932 PolarHBondContact O-N 2.83Å; P930-T932 VanDerWaalsContact O-N 3.09Å; P930-T932 PolarHBondContact O-OG1 3.17Å
933	W	97.2	Very high	93.9	Very high	77 Å²	77	53 Å²	53	29%	0.292	28%	0.281	S	S	.	.			trans	-77.4	123.6	170.2	-76.8	96.5	0	0	0	110.1	A233 A791 L792 Q793 H811 W813 T862	A233-W933 HydrophobicContact CB-CZ2 4.48Å; A791-W933 HydrophobicContact CB-CE3 3.66Å; A791-W933 HydrophobicContact CB-CZ3 4.2Å; A791-W933 WeakPolarHBondContact O-CZ3 3.04Å; L792-W933 CarbonylContact O-C 3.56Å; L792-W933 WeakPolarHBondContact O-CA 3.42Å; Q793-W933 HydrophobicContact CB-CD2 3.72Å; Q793-W933 HydrophobicContact CB-CE3 3.76Å; Q793-W933 HydrophobicContact CB-CG 4.19Å; Q793-W933 HydrophobicContact CB-CH2 4.31Å; Q793-W933 HydrophobicContact CB-CZ2 4.25Å; Q793-W933 HydrophobicContact CB-CZ3 4.07Å; Q793-W933 HydrophobicContact CG-CD2 4.49Å; Q793-W933 VanDerWaalsContact OE1-CE2 3.27Å; Q793-W933 VanDerWaalsContact OE1-NE1 3.16Å; H811-W933 HydrophobicContact CB-CH2 3.7Å; H811-W933 HydrophobicContact CB-CZ2 4.19Å; H811-W933 HydrophobicContact CB-CZ3 4.35Å; W813-W933 HydrophobicContact CB-CE3 4.43Å; W813-W933 HydrophobicContact CB-CH2 3.82Å; W813-W933 HydrophobicContact CB-CZ3 3.56Å; W813-W933 HydrophobicContact CE3-CE3 4.45Å; T862-W933 HydrophobicContact CG2-CH2 4.04Å
934	V	97.5	Very high	92.4	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.024	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.3	174.7	-58.2	0	0	0	0	108.9	A791 L792 L922 K925 M926	A791-V934 CarbonylContact C-O 3.53Å; A791-V934 WeakPolarHBondContact CA-O 3.3Å; L792-V934 HydrophobicContact CB-CG2 4.05Å; L792-V934 PolarHBondContact N-O 2.66Å; L792-V934 WeakPolarHBondContact O-CG2 3.06Å; L792-V934 PolarHBondContact O-N 3.22Å; L922-V934 HydrophobicContact CD1-CB 4.29Å; L922-V934 HydrophobicContact CD1-CG2 3.81Å; K925-V934 HydrophobicContact CB-CG1 4.41Å; K925-V934 HydrophobicContact CD-CB 4.15Å; K925-V934 HydrophobicContact CD-CG1 4.2Å; K925-V934 HydrophobicContact CG-CB 4.17Å; K925-V934 HydrophobicContact CG-CG1 3.81Å; M926-V934 HydrophobicContact CB-CG2 3.64Å; M926-V934 HydrophobicContact CG-CG2 4.31Å
935	E	97.3	Very high	90.6	Very high	82 Å²	82	58.2 Å²	58.2	38%	0.383	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.8	-174.1	177.1	165.4	-167.7	0	0	111.2	K789 L790 A791 K815	K789-E935 VanDerWaalsContact CE-OE1 3.25Å; K789-E935 WeakPolarHBondContact CE-OE1 3.37Å; L790-E935 WeakPolarHBondContact O-CA 3.17Å; A791-E935 HydrophobicContact CB-CB 4.06Å; K815-E935 WeakPolarHBondContact CD-OE1 3.29Å; K815-E935 VanDerWaalsContact CE-OE1 3.3Å; K815-E935 WeakPolarHBondContact CE-OE1 3.01Å; K815-E935 IonicContact NZ-OE1 2.69Å; K815-E935 PolarHBondContact NZ-OE1 2.68Å; K815-E935 IonicContact NZ-OE2 3.47Å; K815-E935 PolarHBondContact NZ-OE2 2.87Å
936	A	97.2	Very high	88	Confident	27 Å²	27	53.9 Å²	53.9	22%	0.223	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	161.9	167.6	0	0	0	0	0	111.1	K789 L790 L922 L938	K789-A936 WeakPolarHBondContact CA-O 3.49Å; L790-A936 PolarHBondContact N-O 3.3Å; L790-A936 PolarHBondContact O-N 3.23Å; L790-A936 VanDerWaalsContact O-N 3.1Å; L790-A936 VanDerWaalsContact O-O 3.12Å; L922-A936 HydrophobicContact CD1-CB 3.96Å; L922-A936 HydrophobicContact CD2-CB 4.17Å; L922-A936 HydrophobicContact CG-CB 4.48Å; A936-L938 HydrophobicContact CB-CD2 4.47Å; A936-L938 HydrophobicContact CB-CG 4.34Å
937	T	97.4	Very high	85.1	Confident	62 Å²	62	62.3 Å²	62.3	38%	0.38	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	160.1	-55.3	0	0	0	0	107.1	E787 M788 K789	E787-T937 HydrophobicContact CB-CG2 3.71Å; E787-T937 HydrophobicContact CG-CG2 4.35Å; E787-T937 WeakPolarHBondContact OE2-CG2 3.46Å; M788-T937 WeakPolarHBondContact O-CA 3.39Å; K789-T937 HydrophobicContact CB-CG2 4.48Å
938	L	96.5	Very high	82.4	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.5	-176.7	-65.3	170.9	0	0	0	110.5	E787 M788 L790 L896 I898 E918 E919 L922 A936	E787-L938 WeakPolarHBondContact CA-O 3.49Å; M788-L938 PolarHBondContact N-O 2.77Å; M788-L938 PolarHBondContact O-N 2.95Å; L790-L938 HydrophobicContact CD2-CD1 4.42Å; L896-L938 HydrophobicContact CD1-CB 3.82Å; L896-L938 HydrophobicContact CD1-CD1 3.98Å; L896-L938 HydrophobicContact CD2-CB 3.84Å; I898-L938 HydrophobicContact CD1-CD1 4.02Å; I898-L938 HydrophobicContact CG1-CD1 4.45Å; E918-L938 HydrophobicContact CB-CD2 3.5Å; E919-L938 HydrophobicContact CG-CD1 4.23Å; L922-L938 HydrophobicContact CD2-CD1 3.75Å; A936-L938 HydrophobicContact CB-CD2 4.47Å; A936-L938 HydrophobicContact CB-CG 4.34Å
939	P	94.4	Very high	79.1	Confident	61 Å²	61	63.6 Å²	63.6	40%	0.396	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.2	179.6	28.7	-34.1	0	0	0	110.8	L896 E918 R941	L896-P939 VanDerWaalsContact CD2-O 3.25Å; L896-P939 WeakPolarHBondContact CD2-O 3.29Å; E918-P939 WeakPolarHBondContact OE2-CD 3.46Å; P939-R941 PolarHBondContact O-N 2.9Å
940	L	93.8	Very high	75.9	Confident	10 Å²	10	73 Å²	73	5%	0.052	38%	0.383	C	S	.	.			trans	-69.4	136	178.6	-69.9	166	0	0	0	110.2	R785 G786 M788 L820 V882 L896	R785-L940 HydrophobicContact CB-CB 3.77Å; R785-L940 VanDerWaalsContact CB-O 3.23Å; R785-L940 WeakPolarHBondContact CB-O 3.28Å; R785-L940 WeakPolarHBondContact O-CD1 3.23Å; G786-L940 VanDerWaalsContact O-CB 3.3Å; G786-L940 WeakPolarHBondContact O-CB 3.26Å; G786-L940 PolarHBondContact O-N 2.64Å; M788-L940 HydrophobicContact CB-CD2 4.06Å; M788-L940 HydrophobicContact CB-CG 4.38Å; M788-L940 HydrophobicContact CE-CD2 4.26Å; L820-L940 HydrophobicContact CD2-CD1 3.42Å; L820-L940 VanDerWaalsContact CD2-CD1 3.42Å; V882-L940 HydrophobicContact CG2-CD1 3.96Å; V882-L940 HydrophobicContact CG2-CD2 3.79Å; L896-L940 HydrophobicContact CD2-CD2 4.42Å; L896-L940 HydrophobicContact CG-CD2 4.12Å
941	R	88.7	Confident	75.1	Confident	48 Å²	48	73.9 Å²	73.9	18%	0.181	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-116.5	157.4	179.1	52	-178.9	-173.8	108	-13.4	112.5	G895 D914 E919 P939 L943	G895-R941 PolarHBondContact N-O 2.96Å; G895-R941 VanDerWaalsContact O-CG 3.26Å; G895-R941 WeakPolarHBondContact O-CG 3.3Å; G895-R941 PolarHBondContact O-N 3.26Å; D914-R941 PolarHBondContact O-NH2 3.17Å; D914-R941 IonicContact OD1-CZ 2.75Å; D914-R941 IonicContact OD1-NH1 2.75Å; D914-R941 PolarHBondContact OD1-NH1 2.97Å; D914-R941 IonicContact OD1-NH2 2.76Å; D914-R941 PolarHBondContact OD1-NH2 3.23Å; D914-R941 IonicContact OD2-CZ 3.07Å; D914-R941 IonicContact OD2-NH1 2.74Å; D914-R941 PolarHBondContact OD2-NH1 2.92Å; D914-R941 IonicContact OD2-NH2 3.45Å; E919-R941 IonicContact OE1-CZ 2.57Å; E919-R941 IonicContact OE1-NE 3.53Å; E919-R941 PolarHBondContact OE1-NE 2.87Å; E919-R941 VanDerWaalsContact OE1-NE 3.08Å; E919-R941 IonicContact OE1-NH2 2.64Å; E919-R941 IonicContact OE2-CZ 3.99Å; E919-R941 VanDerWaalsContact OE2-CZ 3.25Å; E919-R941 IonicContact OE2-NE 3.29Å; E919-R941 PolarHBondContact OE2-NE 2.95Å; E919-R941 IonicContact OE2-NH2 3.89Å; E919-R941 PolarHBondContact OE2-NH2 3.24Å; P939-R941 PolarHBondContact O-N 2.9Å; R941-L943 HydrophobicContact CG-CD2 3.87Å; R941-L943 PolarHBondContact O-N 3.34Å; R941-L943 VanDerWaalsContact O-N 3.07Å
942	M	81.3	Confident	74.2	Confident	96 Å²	96	72.7 Å²	72.7	47%	0.473	38%	0.377	S	S	.	.			trans	-75.4	93.3	172.2	-179	72.8	109.2	0	0	109.1	R785 F892	R785-M942 VanDerWaalsContact NH2-CE 3.31Å; F892-M942 HydrophobicContact CD1-SD 4.03Å; F892-M942 HydrophobicContact CE1-SD 3.83Å
943	L	79.8	Confident	73	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.042	37%	0.372	C	S	.	.			trans	-69	135.8	175.9	-60.7	-174.7	0	0	0	111.6	E879 T881 F892 R897 R941 I945	E879-L943 HydrophobicContact CG-CD1 3.86Å; T881-L943 HydrophobicContact CG2-CD1 3.98Å; F892-L943 HydrophobicContact CZ-CB 4.08Å; F892-L943 HydrophobicContact CZ-CG 4.4Å; R897-L943 HydrophobicContact CG-CD1 3.93Å; R897-L943 HydrophobicContact CG-CD2 3.99Å; R941-L943 HydrophobicContact CG-CD2 3.87Å; R941-L943 PolarHBondContact O-N 3.34Å; R941-L943 VanDerWaalsContact O-N 3.07Å; L943-I945 HydrophobicContact CB-CG1 4.46Å; L943-I945 PolarHBondContact O-N 2.94Å
944	L	65.4	Low	71.6	Confident	130 Å²	130	72.2 Å²	72.2	68%	0.681	38%	0.377	S	S	*	.			trans	-69.8	79.6	155.2	-74.6	175.1	0	0	0	108.1	R897 A946	R897-L944 PolarHBondContact NH2-O 2.81Å; L944-A946 PolarHBondContact O-N 2.94Å
945	I	60.4	Low	70	Confident	67 Å²	67	76.5 Å²	76.5	34%	0.344	40%	0.399	S	S	.	.			trans	-49.9	115.2	179.2	-58.1	172	0	0	0	108.2	W883 F892 L943 K947	W883-I945 HydrophobicContact CH2-CD1 3.84Å; W883-I945 HydrophobicContact CZ2-CD1 3.82Å; F892-I945 HydrophobicContact CB-CD1 4.46Å; F892-I945 HydrophobicContact CD1-CD1 4.09Å; F892-I945 HydrophobicContact CD2-CD1 3.94Å; F892-I945 HydrophobicContact CE1-CD1 4.27Å; F892-I945 HydrophobicContact CE1-CG1 4.47Å; F892-I945 HydrophobicContact CE2-CD1 4.13Å; F892-I945 HydrophobicContact CE2-CG1 4.48Å; F892-I945 HydrophobicContact CG-CD1 3.92Å; F892-I945 HydrophobicContact CZ-CD1 4.29Å; F892-I945 HydrophobicContact CZ-CG1 4.33Å; L943-I945 HydrophobicContact CB-CG1 4.46Å; L943-I945 PolarHBondContact O-N 2.94Å; I945-K947 PolarHBondContact O-N 3.34Å
946	A	41	Very low	68.1	Low	23 Å²	23	76.1 Å²	76.1	19%	0.19	40%	0.4	C	S	.	.			trans	-55.6	116	-170.3	0	0	0	0	0	109.6	L944 L948	L944-A946 PolarHBondContact O-N 2.94Å; A946-L948 PolarHBondContact O-N 3.43Å; A946-L948 VanDerWaalsContact O-N 3.1Å
947	K	36.5	Very low	66.1	Low	176 Å²	176	79.6 Å²	79.6	77%	0.765	41%	0.413	S	S	*	.			trans	-63.8	118.5	172.3	-84.7	175.2	-177.5	151.5	0	106.5	I945 S949	I945-K947 PolarHBondContact O-N 3.34Å; K947-S949 VanDerWaalsContact C-N 3.26Å; K947-S949 PolarHBondContact O-N 3.11Å
948	L	36	Very low	63.6	Low	79 Å²	79	81 Å²	81	41%	0.414	42%	0.415	S	S	.	.			trans	-63	87.8	178.6	-63.9	164.6	0	0	0	109.9	T840 R845 A946 K950	T840-L948 HydrophobicContact CG2-CD2 3.94Å; R845-L948 VanDerWaalsContact NH2-CD2 3.34Å; A946-L948 PolarHBondContact O-N 3.43Å; A946-L948 VanDerWaalsContact O-N 3.1Å; L948-K950 PolarHBondContact O-N 3.12Å
949	S	26.6	Very low	60.9	Low	118 Å²	118	87.5 Å²	87.5	83%	0.825	45%	0.448	S	S	*	.			trans	-60.6	115.1	155.4	36.2	0	0	0	0	107.2	K947	K947-S949 VanDerWaalsContact C-N 3.26Å; K947-S949 PolarHBondContact O-N 3.11Å
950	K	27	Very low	57.9	Low	234 Å²	234	89.9 Å²	89.9	100%	1.017	45%	0.453	S	S	*	.			trans	-158.5	0	179.4	-156.6	165.7	-168.4	161	0	110.5	L948	L948-K950 PolarHBondContact O-N 3.12Å

Retrieved 950 of 950 residues in 1221.6 ms (Link to these results)

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