A0A3Q0KCD0_SCHMA Loading...

Acetylcholine receptor-related

AlphaFold DB , UniProt , Accession A0A3Q0KCD0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 905 aa.

						>A0A3Q0KCD0_SCHMA|A0A3Q0KCD0
MFCINLHKSLEIFLMMDLRYIILLLFICLTHFSSLTFSHSSTESWYIRSRKGVAANVAASASSKTQPVPISTQLTTSGRVSTFSYDEPQYTISDSNLRSGSFTAEEKLVAQLLNRGSLTVRPNGYMNQSTNPVHVNITYNVVQILGFSQSEETLSISGWFTMRWTDPRLTWDPEEFSEIQEVSLPTTNLWIPDVGVMNGKASTDFDFSAGVRGRVTVSNDGSVTWLHGAVLDVTCPLDVSFFPFDYQTCFLILVPWQSGEQQLLLQPFTHGSAVDNSYLPNSNVSEWEIQSVHFVRKKYRSDMNVTYQYVSIAIHLKRQPLYFIVLVLVPFSMLSALACLIFTLDDTGDRLSVALSLVLSMTMYVVIVSTNAPRSMRTLPVLGIFLLDQLGLLSIATILAVMNNKLYQSTELLNWQDFIYAISGTGQGKRRNSEPYSEHLYVNRHIHDNHNYNNRNKTSRNNTNRQEPKYKSSLQQTDQLIEKSTSRQQYYFKKYCKPVKLLSRKSNKTVNTNSNSNCGKSNNQSNRYFPIHPDSGHFINHCDPEVILNATNLTSDVKYRPIDPDSDSPIGQVNKISRPKFLDSANSNIIHNINTFKNSNTEIKNSTISDKQDIMKCHDYKMIHPRIHNSDFLNKSHFIKNKPKGSISERSPWREHLPMSYDQIMKQKYPMKSSYKYAAPSVTESSPSDDEEDDCINSDTDEVDSDTSERIFRTTVTATAAAALAATRVIASDYGVTDLNPSQLKIYGAKANANTNKNASGFYETARSRKCIRNDLPIKTVEELDHIDSKLAAQAAINAAFEAAAQTYQLSKEYTRHHNHRHSYHFPPSKCGKSHKRSLLSNSSYNHCTDYPAELNPYPYRKLASRLDCIQMITYLFLSTINAIACLIIMPKYSQDSNPPAHLIS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.7	Very low	34.8	Very low	121 Å²	121	85.2 Å²	85.2	60%	0.596	43%	0.428	S	S	*	.				0	-59	0	-157	175	-173.2	0	0	113.2	C3 I4 N5 I730	M1-C3 VanDerWaalsContact C-N 3.28Å; M1-C3 PolarHBondContact O-N 3.37Å; M1-I4 WeakPolarHBondContact O-CA 3.39Å; M1-I4 WeakPolarHBondContact O-CB 3.31Å; M1-I4 PolarHBondContact O-N 3.41Å; M1-N5 PolarHBondContact O-N 3.21Å; M1-I730 HydrophobicContact CE-CD1 3.8Å; M1-I730 HydrophobicContact CE-CG2 4.26Å; M1-I730 HydrophobicContact SD-CD1 4.05Å; M1-I730 HydrophobicContact SD-CG2 4.13Å
2	F	27.5	Very low	35.1	Very low	137 Å²	137	78.4 Å²	78.4	60%	0.601	39%	0.394	S	S	*	.	H	α-helix	trans	-51.7	-46.3	178.2	-154.3	-96.4	0	0	0	112.3	I4 N5 L6 I395	F2-I4 PolarHBondContact O-N 2.99Å; F2-I4 VanDerWaalsContact O-N 3.16Å; F2-N5 PolarHBondContact O-N 3.02Å; F2-L6 PolarHBondContact O-N 3.27Å; F2-I395 HydrophobicContact CE2-CD1 4.5Å; F2-I395 HydrophobicContact CZ-CD1 4.47Å
3	C	25.6	Very low	35.4	Very low	103 Å²	103	78.4 Å²	78.4	70%	0.696	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-22.2	175.1	-40	0	0	0	0	114.9	M1 H7	M1-C3 VanDerWaalsContact C-N 3.28Å; M1-C3 PolarHBondContact O-N 3.37Å; C3-H7 WeakPolarHBondContact O-CB 3.36Å; C3-H7 PolarHBondContact O-N 3.49Å
4	I	37.1	Very low	35.8	Very low	85 Å²	85	78.4 Å²	78.4	44%	0.436	39%	0.392	S	S	.	.	H	α-helix	trans	-84.9	-30.4	-179.3	-55.4	175.7	0	0	0	110.8	M1 F2	M1-I4 WeakPolarHBondContact O-CA 3.39Å; M1-I4 WeakPolarHBondContact O-CB 3.31Å; M1-I4 PolarHBondContact O-N 3.41Å; F2-I4 PolarHBondContact O-N 2.99Å; F2-I4 VanDerWaalsContact O-N 3.16Å
5	N	35.5	Very low	36.3	Very low	89 Å²	89	79.1 Å²	79.1	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-79.9	-38.9	173.1	-68.4	-9.1	0	0	0	111	M1 F2 H7 K8 S9	M1-N5 PolarHBondContact O-N 3.21Å; F2-N5 PolarHBondContact O-N 3.02Å; N5-H7 PolarHBondContact O-N 2.78Å; N5-K8 PolarHBondContact O-N 3.47Å; N5-S9 PolarHBondContact O-N 3.11Å
6	L	37	Very low	36.8	Very low	54 Å²	54	74.5 Å²	74.5	28%	0.283	37%	0.372	S	S	.	.	H	α-helix	trans	-57.1	-38	173.8	-157.6	75.6	0	0	0	111.6	F2 K8 S9	F2-L6 PolarHBondContact O-N 3.27Å; L6-K8 PolarHBondContact O-N 3.02Å; L6-K8 VanDerWaalsContact O-N 3.13Å; L6-S9 PolarHBondContact O-N 3.17Å
7	H	37.2	Very low	37.6	Very low	116 Å²	116	74.7 Å²	74.7	54%	0.537	38%	0.375	S	S	.	.	H	α-helix	trans	-57.4	-23.7	175.2	-166.5	-51.3	0	0	0	114	C3 N5	C3-H7 WeakPolarHBondContact O-CB 3.36Å; C3-H7 PolarHBondContact O-N 3.49Å; N5-H7 PolarHBondContact O-N 2.78Å
8	K	36	Very low	38.1	Very low	105 Å²	105	77.2 Å²	77.2	46%	0.457	39%	0.388	S	S	.	.	H	α-helix	trans	-103.9	-24.5	-177.8	-66.3	-172.6	176.9	-173.1	0	114.4	N5 L6 L10 I384	N5-K8 PolarHBondContact O-N 3.47Å; L6-K8 PolarHBondContact O-N 3.02Å; L6-K8 VanDerWaalsContact O-N 3.13Å; K8-L10 PolarHBondContact O-N 3.4Å; K8-I384 HydrophobicContact CB-CD1 3.79Å; K8-I384 HydrophobicContact CB-CG2 4.01Å; K8-I384 HydrophobicContact CD-CD1 3.87Å; K8-I384 HydrophobicContact CG-CD1 4.46Å
9	S	37.6	Very low	38.9	Very low	8 Å²	8	82.8 Å²	82.8	6%	0.056	41%	0.405	C	S	.	.	H	α-helix	trans	-67.4	-24.7	172.5	-159.2	0	0	0	0	111.8	N5 L6 I12 D388	N5-S9 PolarHBondContact O-N 3.11Å; L6-S9 PolarHBondContact O-N 3.17Å; S9-I12 WeakPolarHBondContact O-CD1 3.48Å; S9-D388 WeakPolarHBondContact CB-OD2 3.36Å; S9-D388 PolarHBondContact OG-OD2 3.28Å
10	L	40.1	Very low	39.6	Very low	36 Å²	36	81 Å²	81	19%	0.188	39%	0.394	C	S	.	.	S	Bend	trans	-76.4	-37.3	-175.5	-101.3	55	0	0	0	114.4	K8 I12 F13 A883 L887	K8-L10 PolarHBondContact O-N 3.4Å; L10-I12 PolarHBondContact O-N 3.22Å; L10-F13 PolarHBondContact O-N 3.34Å; L10-F13 VanDerWaalsContact O-N 3.14Å; L10-A883 HydrophobicContact CD1-CB 4.35Å; L10-A883 HydrophobicContact CD2-CB 4.24Å; L10-L887 HydrophobicContact CB-CD2 3.53Å; L10-L887 HydrophobicContact CD2-CD2 4.04Å; L10-L887 HydrophobicContact CG-CD1 4.21Å; L10-L887 HydrophobicContact CG-CD2 3.62Å; L10-L887 HydrophobicContact CG-CG 4.46Å; L10-L887 WeakPolarHBondContact O-CD2 3.47Å
11	E	39.2	Very low	40.3	Very low	83 Å²	83	79.2 Å²	79.2	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-59.9	-24.9	-174	-62	-175.3	134.5	0	0	113.7	F13	E11-F13 PolarHBondContact O-N 3.27Å
12	I	38.6	Very low	41.4	Very low	4 Å²	4	78 Å²	78	2%	0.021	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-42.3	178.1	-56.2	162.4	0	0	0	112	S9 L10 L14 F244 L328 V381 F385	S9-I12 WeakPolarHBondContact O-CD1 3.48Å; L10-I12 PolarHBondContact O-N 3.22Å; I12-L14 VanDerWaalsContact C-N 3.32Å; I12-L14 PolarHBondContact O-N 3.07Å; I12-F244 HydrophobicContact CG2-CE2 3.94Å; I12-F244 WeakPolarHBondContact O-CE2 3.26Å; I12-L328 HydrophobicContact CG2-CD1 4.22Å; I12-L328 HydrophobicContact CG2-CD2 4.33Å; I12-V381 HydrophobicContact CB-CG1 4.45Å; I12-V381 HydrophobicContact CD1-CG1 4.07Å; I12-V381 WeakPolarHBondContact CD1-O 3.29Å; I12-V381 HydrophobicContact CG1-CB 4.45Å; I12-V381 HydrophobicContact CG1-CG1 3.24Å; I12-F385 HydrophobicContact CD1-CB 3.19Å; I12-F385 HydrophobicContact CD1-CD2 4.44Å; I12-F385 HydrophobicContact CD1-CG 4.06Å
13	F	38.6	Very low	42.8	Very low	78 Å²	78	75.3 Å²	75.3	34%	0.342	37%	0.372	S	S	.	.	H	α-helix	trans	-81.7	-14.8	-165.8	-140.4	-92.3	0	0	0	112.8	L10 E11 L24	L10-F13 PolarHBondContact O-N 3.34Å; L10-F13 VanDerWaalsContact O-N 3.14Å; E11-F13 PolarHBondContact O-N 3.27Å; F13-L24 HydrophobicContact CE1-CD1 4.21Å; F13-L24 HydrophobicContact CE2-CD1 4.33Å; F13-L24 HydrophobicContact CZ-CD1 3.72Å
14	L	41.3	Very low	44	Very low	78 Å²	78	71 Å²	71	41%	0.408	34%	0.342	S	S	.	.	H	α-helix	trans	-100.2	-12.9	178.5	-71.7	-177.6	0	0	0	114.8	I12 M16 L887 P891	I12-L14 VanDerWaalsContact C-N 3.32Å; I12-L14 PolarHBondContact O-N 3.07Å; L14-M16 PolarHBondContact O-N 3.05Å; L14-L887 HydrophobicContact CD1-CB 4.27Å; L14-L887 HydrophobicContact CD1-CD2 3.63Å; L14-L887 HydrophobicContact CD1-CG 3.64Å; L14-L887 WeakPolarHBondContact CD1-O 3.35Å; L14-L887 HydrophobicContact CD2-CG 4.21Å; L14-L887 HydrophobicContact CG-CD2 3.89Å; L14-L887 HydrophobicContact CG-CG 3.74Å; L14-P891 HydrophobicContact CD1-CG 4.06Å
15	M	42.9	Very low	44.4	Very low	89 Å²	89	71.7 Å²	71.7	44%	0.438	35%	0.346	S	S	.	.	S	Bend	trans	-78.8	-0.1	168.1	-67	-154.9	170.2	0	0	112.8	D17 F241 F244	M15-D17 PolarHBondContact O-N 3.21Å; M15-F241 HydrophobicContact CE-CD1 3.92Å; M15-F241 HydrophobicContact CE-CE1 4.18Å; M15-F241 HydrophobicContact CE-CG 4.48Å; M15-F241 HydrophobicContact SD-CD1 4.26Å; M15-F244 HydrophobicContact CB-CB 3.65Å; M15-F244 HydrophobicContact CB-CD1 3.57Å; M15-F244 HydrophobicContact CB-CD2 3.98Å; M15-F244 HydrophobicContact CB-CE1 4.2Å; M15-F244 HydrophobicContact CB-CG 3.44Å; M15-F244 VanDerWaalsContact CB-CG 3.44Å; M15-F244 HydrophobicContact CG-CB 4.29Å; M15-F244 HydrophobicContact CG-CG 4.49Å; M15-F244 WeakPolarHBondContact O-CD1 3.37Å; M15-F244 WeakPolarHBondContact O-CE1 3.49Å; M15-F244 HydrophobicContact SD-CB 3.7Å; M15-F244 HydrophobicContact SD-CG 4.49Å
16	M	44.9	Very low	45.3	Very low	6 Å²	6	74 Å²	74	3%	0.03	35%	0.352	C	S	.	.	S	Bend	trans	-76.1	118.6	172	-67.5	-172.6	56.8	0	0	111.5	L14 L18 Y20 I21 L24 F244 I324 L328	L14-M16 PolarHBondContact O-N 3.05Å; M16-L18 PolarHBondContact O-N 3.11Å; M16-Y20 VanDerWaalsContact CE-CB 3.45Å; M16-I21 HydrophobicContact CB-CD1 4.43Å; M16-I21 HydrophobicContact CB-CG1 3.99Å; M16-I21 WeakPolarHBondContact O-CD1 3.45Å; M16-L24 HydrophobicContact CE-CD1 3.39Å; M16-L24 HydrophobicContact CE-CG 4.3Å; M16-L24 HydrophobicContact SD-CD1 3.96Å; M16-F244 HydrophobicContact CB-CE1 4.48Å; M16-F244 HydrophobicContact CG-CE1 3.74Å; M16-F244 HydrophobicContact CG-CZ 3.47Å; M16-F244 VanDerWaalsContact CG-CZ 3.47Å; M16-F244 HydrophobicContact SD-CZ 4.5Å; M16-I324 HydrophobicContact CE-CB 4.35Å; M16-I324 HydrophobicContact CE-CD1 3.98Å; M16-I324 HydrophobicContact CE-CG1 3.97Å; M16-I324 HydrophobicContact CE-CG2 3.43Å; M16-I324 VanDerWaalsContact CE-CG2 3.43Å; M16-I324 HydrophobicContact CG-CD1 4.17Å; M16-I324 HydrophobicContact CG-CG1 4.38Å; M16-I324 HydrophobicContact SD-CG1 4.29Å; M16-I324 HydrophobicContact SD-CG2 4.5Å; M16-L328 HydrophobicContact SD-CD1 4Å
17	D	50.6	Low	46.1	Very low	78 Å²	78	73.7 Å²	73.7	42%	0.417	35%	0.35	S	S	.	.			trans	-48.4	139.5	167.2	-174.3	-24.8	0	0	0	110.2	M15 R19 Y20 I21	M15-D17 PolarHBondContact O-N 3.21Å; D17-R19 PolarHBondContact O-N 2.71Å; D17-R19 PolarHBondContact OD1-N 3.25Å; D17-R19 IonicContact OD2-NE 2.8Å; D17-Y20 HydrophobicContact CB-CD2 3.69Å; D17-Y20 HydrophobicContact CB-CE2 3.68Å; D17-Y20 WeakPolarHBondContact O-CB 3.26Å; D17-Y20 PolarHBondContact O-N 3.47Å; D17-I21 PolarHBondContact O-N 2.82Å
18	L	46.4	Very low	46.4	Very low	119 Å²	119	70.9 Å²	70.9	62%	0.623	34%	0.343	S	S	*	.	H	α-helix	trans	-49	-32.8	-176.7	-170.6	70.8	0	0	0	112.5	M16 Y20 I21 I22	M16-L18 PolarHBondContact O-N 3.11Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 3.47Å; L18-I21 PolarHBondContact O-N 3.41Å; L18-I22 HydrophobicContact CD2-CD1 4.46Å; L18-I22 HydrophobicContact CG-CD1 4.06Å; L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 3.27Å
19	R	53.3	Low	46.8	Very low	185 Å²	185	71.4 Å²	71.4	70%	0.698	35%	0.35	S	S	*	.	H	α-helix	trans	-57.3	-40.4	175.4	-57.8	176.5	-167.4	-156.9	1.4	112.6	D17 L23	D17-R19 PolarHBondContact O-N 2.71Å; D17-R19 PolarHBondContact OD1-N 3.25Å; D17-R19 IonicContact OD2-NE 2.8Å; R19-L23 PolarHBondContact O-N 3.3Å
20	Y	52.6	Low	47.2	Very low	46 Å²	46	74 Å²	74	18%	0.18	37%	0.365	C	S	.	.	H	α-helix	trans	-79.3	-31.1	179.8	-50.2	-50	0	0	0	112.3	M16 D17 L18 L23 L24 P320 L321 I324	M16-Y20 VanDerWaalsContact CE-CB 3.45Å; D17-Y20 HydrophobicContact CB-CD2 3.69Å; D17-Y20 HydrophobicContact CB-CE2 3.68Å; D17-Y20 WeakPolarHBondContact O-CB 3.26Å; D17-Y20 PolarHBondContact O-N 3.47Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 3.47Å; Y20-L23 PolarHBondContact O-N 3.24Å; Y20-L24 WeakPolarHBondContact O-CB 3.27Å; Y20-L24 PolarHBondContact O-N 3.42Å; Y20-P320 HydrophobicContact CE2-CG 4.42Å; Y20-L321 HydrophobicContact CD1-CD1 4.01Å; Y20-L321 HydrophobicContact CE1-CB 4.09Å; Y20-L321 HydrophobicContact CE1-CD1 3.68Å; Y20-L321 HydrophobicContact CE1-CD2 4.42Å; Y20-L321 HydrophobicContact CE1-CG 4.26Å; Y20-I324 HydrophobicContact CD2-CD1 3.54Å; Y20-I324 HydrophobicContact CE2-CD1 4.04Å; Y20-I324 HydrophobicContact CG-CD1 3.84Å
21	I	54.1	Low	47.6	Very low	43 Å²	43	77.3 Å²	77.3	22%	0.221	38%	0.38	C	S	.	.	H	α-helix	trans	-65.4	-43.8	171.1	-59.3	177.9	0	0	0	109.8	M16 D17 L18 L23 L24 L25	M16-I21 HydrophobicContact CB-CD1 4.43Å; M16-I21 HydrophobicContact CB-CG1 3.99Å; M16-I21 WeakPolarHBondContact O-CD1 3.45Å; D17-I21 PolarHBondContact O-N 2.82Å; L18-I21 PolarHBondContact O-N 3.41Å; I21-L23 VanDerWaalsContact C-N 3.35Å; I21-L23 PolarHBondContact O-N 3.13Å; I21-L24 PolarHBondContact O-N 2.99Å; I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.48Å; I21-L25 WeakPolarHBondContact O-CB 3.38Å; I21-L25 VanDerWaalsContact O-CG 3.29Å; I21-L25 WeakPolarHBondContact O-CG 3.42Å; I21-L25 PolarHBondContact O-N 3.2Å
22	I	53.5	Low	47.6	Very low	97 Å²	97	79.6 Å²	79.6	50%	0.497	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-44	173	-69.2	164	0	0	0	110.7	L18 L25 F26	L18-I22 HydrophobicContact CD2-CD1 4.46Å; L18-I22 HydrophobicContact CG-CD1 4.06Å; L18-I22 VanDerWaalsContact O-CG1 3.29Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 3.27Å; I22-L25 PolarHBondContact O-N 2.94Å; I22-F26 WeakPolarHBondContact O-CB 3.26Å; I22-F26 PolarHBondContact O-N 3.16Å
23	L	55.7	Low	47.5	Very low	79 Å²	79	82.4 Å²	82.4	41%	0.414	41%	0.409	S	S	.	.	H	α-helix	trans	-60.9	-47.9	177	-170	73.4	0	0	0	112	R19 Y20 I21 F26 I27 V325	R19-L23 PolarHBondContact O-N 3.3Å; Y20-L23 PolarHBondContact O-N 3.24Å; I21-L23 VanDerWaalsContact C-N 3.35Å; I21-L23 PolarHBondContact O-N 3.13Å; L23-F26 PolarHBondContact O-N 3.03Å; L23-I27 HydrophobicContact CG-CD1 4.06Å; L23-I27 VanDerWaalsContact O-CG1 3.28Å; L23-I27 WeakPolarHBondContact O-CG1 3.34Å; L23-I27 PolarHBondContact O-N 2.98Å; L23-V325 HydrophobicContact CD2-CG2 4.2Å
24	L	50.6	Low	47.7	Very low	13 Å²	13	82.3 Å²	82.3	7%	0.068	42%	0.418	C	S	.	.	H	α-helix	trans	-57.9	-47.9	174.9	-88.7	171.3	0	0	0	111.9	F13 M16 Y20 I21 F26 I27 C28 V329	F13-L24 HydrophobicContact CE1-CD1 4.21Å; F13-L24 HydrophobicContact CE2-CD1 4.33Å; F13-L24 HydrophobicContact CZ-CD1 3.72Å; M16-L24 HydrophobicContact CE-CD1 3.39Å; M16-L24 HydrophobicContact CE-CG 4.3Å; M16-L24 HydrophobicContact SD-CD1 3.96Å; Y20-L24 WeakPolarHBondContact O-CB 3.27Å; Y20-L24 PolarHBondContact O-N 3.42Å; I21-L24 PolarHBondContact O-N 2.99Å; L24-F26 VanDerWaalsContact C-N 3.32Å; L24-F26 PolarHBondContact O-N 3.45Å; L24-I27 PolarHBondContact O-N 3.14Å; L24-C28 WeakPolarHBondContact O-CB 3.41Å; L24-C28 PolarHBondContact O-N 3.17Å; L24-C28 PolarHBondContact O-SG 3.14Å; L24-C28 VanDerWaalsContact O-SG 3.39Å; L24-V329 HydrophobicContact CD2-CG2 3.72Å
25	L	47.1	Very low	47.5	Very low	99 Å²	99	83.2 Å²	83.2	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-40.9	177.4	-73.4	169.5	0	0	0	111.3	I21 I22 C28 L29	I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.48Å; I21-L25 WeakPolarHBondContact O-CB 3.38Å; I21-L25 VanDerWaalsContact O-CG 3.29Å; I21-L25 WeakPolarHBondContact O-CG 3.42Å; I21-L25 PolarHBondContact O-N 3.2Å; I22-L25 PolarHBondContact O-N 2.94Å; L25-C28 PolarHBondContact O-N 3.3Å; L25-L29 VanDerWaalsContact O-CB 3.23Å; L25-L29 WeakPolarHBondContact O-CB 3.4Å; L25-L29 WeakPolarHBondContact O-CD1 3.42Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 2.85Å
26	F	54.2	Low	47.2	Very low	139 Å²	139	83 Å²	83	61%	0.61	43%	0.426	S	S	*	.	H	α-helix	trans	-66.1	-41.6	178.4	-153.3	-88	0	0	0	112.2	I22 L23 L24 T30	I22-F26 WeakPolarHBondContact O-CB 3.26Å; I22-F26 PolarHBondContact O-N 3.16Å; L23-F26 PolarHBondContact O-N 3.03Å; L24-F26 VanDerWaalsContact C-N 3.32Å; L24-F26 PolarHBondContact O-N 3.45Å; F26-T30 HydrophobicContact CD1-CG2 3.99Å; F26-T30 HydrophobicContact CE1-CG2 3.9Å; F26-T30 WeakPolarHBondContact O-CB 3.49Å; F26-T30 WeakPolarHBondContact O-CG2 3.38Å; F26-T30 PolarHBondContact O-N 3.02Å; F26-T30 PolarHBondContact O-OG1 3.17Å
27	I	52.9	Low	46.6	Very low	47 Å²	47	91.2 Å²	91.2	24%	0.241	46%	0.462	C	S	.	.	H	α-helix	trans	-64	-47.4	173.9	-64.7	165.2	0	0	0	110.4	L23 L24 L29 T30 H31 M333	L23-I27 HydrophobicContact CG-CD1 4.06Å; L23-I27 VanDerWaalsContact O-CG1 3.28Å; L23-I27 WeakPolarHBondContact O-CG1 3.34Å; L23-I27 PolarHBondContact O-N 2.98Å; L24-I27 PolarHBondContact O-N 3.14Å; I27-L29 PolarHBondContact O-N 3.25Å; I27-T30 WeakPolarHBondContact CA-OG1 3.49Å; I27-T30 PolarHBondContact O-N 3.02Å; I27-T30 PolarHBondContact O-OG1 3.29Å; I27-H31 PolarHBondContact O-CD2 3.47Å; I27-H31 PolarHBondContact O-N 3.22Å; I27-M333 HydrophobicContact CG2-CE 3.55Å
28	C	44.2	Very low	46	Very low	57 Å²	57	90.7 Å²	90.7	39%	0.385	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-43.6	177.2	-74.2	0	0	0	0	112.4	L24 L25 H31 F32	L24-C28 WeakPolarHBondContact O-CB 3.41Å; L24-C28 PolarHBondContact O-N 3.17Å; L24-C28 PolarHBondContact O-SG 3.14Å; L24-C28 VanDerWaalsContact O-SG 3.39Å; L25-C28 PolarHBondContact O-N 3.3Å; C28-H31 PolarHBondContact O-N 3.05Å; C28-F32 WeakPolarHBondContact O-CB 3.43Å; C28-F32 PolarHBondContact O-N 3.39Å
29	L	43.7	Very low	45.5	Very low	115 Å²	115	92.3 Å²	92.3	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-67.5	-39.9	179	-74.4	167.1	0	0	0	112.5	L25 I27 F32 S33	L25-L29 VanDerWaalsContact O-CB 3.23Å; L25-L29 WeakPolarHBondContact O-CB 3.4Å; L25-L29 WeakPolarHBondContact O-CD1 3.42Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 2.85Å; I27-L29 PolarHBondContact O-N 3.25Å; L29-F32 PolarHBondContact O-N 3.17Å; L29-S33 WeakPolarHBondContact O-CB 3.42Å; L29-S33 PolarHBondContact O-N 3.36Å; L29-S33 PolarHBondContact O-OG 2.97Å
30	T	46.9	Very low	44.5	Very low	62 Å²	62	88.9 Å²	88.9	38%	0.38	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-36.4	175.8	46.7	0	0	0	0	112	F26 I27 S33 S34	F26-T30 HydrophobicContact CD1-CG2 3.99Å; F26-T30 HydrophobicContact CE1-CG2 3.9Å; F26-T30 WeakPolarHBondContact O-CB 3.49Å; F26-T30 WeakPolarHBondContact O-CG2 3.38Å; F26-T30 PolarHBondContact O-N 3.02Å; F26-T30 PolarHBondContact O-OG1 3.17Å; I27-T30 WeakPolarHBondContact CA-OG1 3.49Å; I27-T30 PolarHBondContact O-N 3.02Å; I27-T30 PolarHBondContact O-OG1 3.29Å; T30-S33 WeakPolarHBondContact CA-OG 3.3Å; T30-S33 PolarHBondContact O-OG 3.27Å; T30-S34 WeakPolarHBondContact O-CB 3.42Å; T30-S34 PolarHBondContact O-N 3.3Å; T30-S34 PolarHBondContact O-OG 3.2Å
31	H	47.6	Very low	43.6	Very low	106 Å²	106	90.2 Å²	90.2	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-68.2	-45.1	170.3	-85.6	-90.6	0	0	0	112.7	I27 C28 S33 S34 L35	I27-H31 PolarHBondContact O-CD2 3.47Å; I27-H31 PolarHBondContact O-N 3.22Å; C28-H31 PolarHBondContact O-N 3.05Å; H31-S33 PolarHBondContact O-N 2.99Å; H31-S34 PolarHBondContact O-N 3.1Å; H31-L35 PolarHBondContact O-N 3.47Å
32	F	39.2	Very low	42.8	Very low	131 Å²	131	91 Å²	91	58%	0.575	50%	0.496	S	S	*	.	H	α-helix	trans	-65.9	-39.6	-178.6	-120.9	-91	0	0	0	113.1	C28 L29 L35 T36	C28-F32 WeakPolarHBondContact O-CB 3.43Å; C28-F32 PolarHBondContact O-N 3.39Å; L29-F32 PolarHBondContact O-N 3.17Å; F32-L35 PolarHBondContact O-N 3.4Å; F32-T36 HydrophobicContact CD1-CG2 4.29Å; F32-T36 WeakPolarHBondContact O-CB 3.36Å; F32-T36 WeakPolarHBondContact O-CG2 3.32Å; F32-T36 PolarHBondContact O-N 2.97Å; F32-T36 PolarHBondContact O-OG1 3.27Å
33	S	37.3	Very low	41.9	Very low	64 Å²	64	94.6 Å²	94.6	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-41.1	175.1	49.9	0	0	0	0	111.6	L29 T30 H31 L35 T36 F37	L29-S33 WeakPolarHBondContact O-CB 3.42Å; L29-S33 PolarHBondContact O-N 3.36Å; L29-S33 PolarHBondContact O-OG 2.97Å; T30-S33 WeakPolarHBondContact CA-OG 3.3Å; T30-S33 PolarHBondContact O-OG 3.27Å; H31-S33 PolarHBondContact O-N 2.99Å; S33-L35 PolarHBondContact O-N 3.39Å; S33-T36 WeakPolarHBondContact CA-OG1 3.44Å; S33-T36 PolarHBondContact O-N 3.3Å; S33-T36 PolarHBondContact O-OG1 2.77Å; S33-F37 VanDerWaalsContact O-CB 3.29Å; S33-F37 WeakPolarHBondContact O-CB 3.4Å; S33-F37 PolarHBondContact O-N 2.98Å
34	S	42.1	Very low	40.8	Very low	76 Å²	76	95.5 Å²	95.5	53%	0.531	52%	0.524	S	S	.	.	H	α-helix	trans	-61.3	-42.1	174.2	-58.9	0	0	0	0	112.7	T30 H31 S38	T30-S34 WeakPolarHBondContact O-CB 3.42Å; T30-S34 PolarHBondContact O-N 3.3Å; T30-S34 PolarHBondContact O-OG 3.2Å; H31-S34 PolarHBondContact O-N 3.1Å; S34-S38 WeakPolarHBondContact O-CB 3.26Å; S34-S38 PolarHBondContact O-N 3.05Å; S34-S38 PolarHBondContact O-OG 3.03Å
35	L	37	Very low	39.9	Very low	97 Å²	97	103.9 Å²	103.9	51%	0.508	55%	0.554	S	S	.	*	H	α-helix	trans	-68.7	-43.8	177.2	-86.4	154.9	0	0	0	113	H31 F32 S33	H31-L35 PolarHBondContact O-N 3.47Å; F32-L35 PolarHBondContact O-N 3.4Å; S33-L35 PolarHBondContact O-N 3.39Å
36	T	37.2	Very low	39.2	Very low	83 Å²	83	107.8 Å²	107.8	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-72.7	-40.7	-178	48	0	0	0	0	112.8	F32 S33 S38 H39	F32-T36 HydrophobicContact CD1-CG2 4.29Å; F32-T36 WeakPolarHBondContact O-CB 3.36Å; F32-T36 WeakPolarHBondContact O-CG2 3.32Å; F32-T36 PolarHBondContact O-N 2.97Å; F32-T36 PolarHBondContact O-OG1 3.27Å; S33-T36 WeakPolarHBondContact CA-OG1 3.44Å; S33-T36 PolarHBondContact O-N 3.3Å; S33-T36 PolarHBondContact O-OG1 2.77Å; T36-S38 PolarHBondContact O-N 3.46Å; T36-H39 PolarHBondContact O-N 3.05Å; T36-H39 VanDerWaalsContact O-N 3.13Å
37	F	33.1	Very low	38.4	Very low	179 Å²	179	108.6 Å²	108.6	79%	0.785	57%	0.573	S	S	*	*	H	α-helix	trans	-63.1	-29.8	176.4	-159.5	-97.8	0	0	0	112.4	S33 H39	S33-F37 VanDerWaalsContact O-CB 3.29Å; S33-F37 WeakPolarHBondContact O-CB 3.4Å; S33-F37 PolarHBondContact O-N 2.98Å; F37-H39 VanDerWaalsContact C-N 3.31Å; F37-H39 PolarHBondContact O-N 3.23Å
38	S	36.8	Very low	37.5	Very low	68 Å²	68	117.2 Å²	117.2	48%	0.476	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-16.8	176.8	-60.3	0	0	0	0	114.4	S34 T36 T42	S34-S38 WeakPolarHBondContact O-CB 3.26Å; S34-S38 PolarHBondContact O-N 3.05Å; S34-S38 PolarHBondContact O-OG 3.03Å; T36-S38 PolarHBondContact O-N 3.46Å; S38-T42 WeakPolarHBondContact O-CG2 3.46Å; S38-T42 PolarHBondContact O-OG1 2.73Å
39	H	35.3	Very low	37.2	Very low	152 Å²	152	117.1 Å²	117.1	70%	0.704	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-7.1	-173.5	-149	-55.1	0	0	0	114	T36 F37	T36-H39 PolarHBondContact O-N 3.05Å; T36-H39 VanDerWaalsContact O-N 3.13Å; F37-H39 VanDerWaalsContact C-N 3.31Å; F37-H39 PolarHBondContact O-N 3.23Å
40	S	33.3	Very low	36.8	Very low	114 Å²	114	122.4 Å²	122.4	80%	0.797	61%	0.614	S	S	*	*	S	Bend	trans	-93.4	-16.1	-177.6	-166	0	0	0	0	114
41	S	34.1	Very low	36.3	Very low	74 Å²	74	129.3 Å²	129.3	52%	0.517	64%	0.639	S	S	.	*	S	Bend	trans	-122	-3.1	-167.2	56.9	0	0	0	0	115.1
42	T	36	Very low	35.7	Very low	59 Å²	59	126.6 Å²	126.6	36%	0.362	64%	0.64	S	S	.	*			trans	-99.9	-16	-161.1	36.8	0	0	0	0	116.3	S38 S44 W45 Y46	S38-T42 WeakPolarHBondContact O-CG2 3.46Å; S38-T42 PolarHBondContact O-OG1 2.73Å; T42-S44 VanDerWaalsContact C-N 3.25Å; T42-S44 PolarHBondContact O-N 2.66Å; T42-W45 PolarHBondContact O-N 3.41Å; T42-W45 VanDerWaalsContact O-N 3.08Å; T42-Y46 PolarHBondContact O-N 3.21Å
43	E	34.9	Very low	35.5	Very low	172 Å²	172	125 Å²	125	80%	0.804	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-31.4	-177.5	-67.1	-156.8	138.5	0	0	113.6
44	S	32.8	Very low	35.5	Very low	98 Å²	98	127.1 Å²	127.1	69%	0.685	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-20.4	178.3	62.2	0	0	0	0	114.3	T42	T42-S44 VanDerWaalsContact C-N 3.25Å; T42-S44 PolarHBondContact O-N 2.66Å
45	W	32.8	Very low	35.2	Very low	189 Å²	189	126.7 Å²	126.7	72%	0.716	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-29.4	-178.3	-89.7	79.6	0	0	0	113.4	T42 I47 R48 S49	T42-W45 PolarHBondContact O-N 3.41Å; T42-W45 VanDerWaalsContact O-N 3.08Å; W45-I47 PolarHBondContact O-N 3.25Å; W45-I47 VanDerWaalsContact O-N 3.13Å; W45-R48 PolarHBondContact O-N 3.02Å; W45-S49 PolarHBondContact O-N 3.38Å
46	Y	32.8	Very low	35.2	Very low	181 Å²	181	128 Å²	128	71%	0.71	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-25.3	-170.5	-135.3	-88.8	0	0	0	114.4	T42	T42-Y46 PolarHBondContact O-N 3.21Å
47	I	36.8	Very low	35	Very low	157 Å²	157	129.5 Å²	129.5	81%	0.805	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-21.4	179.7	-63.7	177.2	0	0	0	112.3	W45	W45-I47 PolarHBondContact O-N 3.25Å; W45-I47 VanDerWaalsContact O-N 3.13Å
48	R	34.1	Very low	35	Very low	228 Å²	228	125.3 Å²	125.3	86%	0.86	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-19.9	-172.7	-153.5	169.7	-171.4	161.4	1.5	114.2	W45	W45-R48 PolarHBondContact O-N 3.02Å
49	S	37.9	Very low	34.9	Very low	54 Å²	54	125.7 Å²	125.7	38%	0.378	69%	0.685	S	S	.	*	S	Bend	trans	-76.1	-23.9	-175.1	58.3	0	0	0	0	115	W45 K51 G52	W45-S49 PolarHBondContact O-N 3.38Å; S49-K51 PolarHBondContact O-N 2.79Å; S49-G52 PolarHBondContact O-N 2.98Å; S49-G52 VanDerWaalsContact O-N 3.14Å
50	R	35.3	Very low	34.8	Very low	226 Å²	226	123 Å²	123	85%	0.853	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	15.1	-171.1	-113.4	-178.4	-176.5	173.8	4.8	116.7
51	K	35.3	Very low	34.7	Very low	208 Å²	208	122.3 Å²	122.3	90%	0.904	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	-2.7	172.5	-72.3	-170.7	176.5	-177.7	0	115.5	S49	S49-K51 PolarHBondContact O-N 2.79Å
52	G	36	Very low	34.4	Very low	49 Å²	49	124 Å²	124	51%	0.505	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.4	-30.1	-174.9	0	0	0	0	0	116.5	S49 A54	S49-G52 PolarHBondContact O-N 2.98Å; S49-G52 VanDerWaalsContact O-N 3.14Å; G52-A54 PolarHBondContact O-N 3.29Å
53	V	35.6	Very low	34.3	Very low	98 Å²	98	126.4 Å²	126.4	59%	0.594	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-77.8	-21.7	-161.4	-174.9	0	0	0	0	114.2	A55 N56	V53-A55 PolarHBondContact O-N 3.36Å; V53-A55 VanDerWaalsContact O-N 3.11Å; V53-N56 PolarHBondContact O-N 3.21Å
54	A	35.6	Very low	34	Very low	107 Å²	107	128.3 Å²	128.3	88%	0.884	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-69	-7.2	-177.5	0	0	0	0	0	115	G52	G52-A54 PolarHBondContact O-N 3.29Å
55	A	36.4	Very low	34	Very low	68 Å²	68	130.1 Å²	130.1	56%	0.562	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-95.2	-30.6	179.8	0	0	0	0	0	114	V53	V53-A55 PolarHBondContact O-N 3.36Å; V53-A55 VanDerWaalsContact O-N 3.11Å
56	N	36.2	Very low	33.9	Very low	124 Å²	124	129.9 Å²	129.9	66%	0.663	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-10.8	-164.4	-71	9.1	0	0	0	114.9	V53	V53-N56 PolarHBondContact O-N 3.21Å
57	V	33.8	Very low	33.9	Very low	114 Å²	114	127 Å²	127	69%	0.691	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-13.9	178.3	-175.6	0	0	0	0	112.3
58	A	34.3	Very low	33.7	Very low	91 Å²	91	125.3 Å²	125.3	75%	0.752	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-0.9	175.5	0	0	0	0	0	114.1
59	A	34.1	Very low	33.6	Very low	77 Å²	77	119.6 Å²	119.6	64%	0.636	73%	0.727	S	S	*	*	S	Bend	trans	-110.1	-12.6	-168.2	0	0	0	0	0	115.1
60	S	32.8	Very low	33.4	Very low	96 Å²	96	124 Å²	124	67%	0.671	75%	0.745	S	S	*	*	S	Bend	trans	-87.6	-8.8	-179.1	49.9	0	0	0	0	114.4	S62	S60-S62 PolarHBondContact O-N 3.04Å
61	A	31.5	Very low	33.1	Very low	98 Å²	98	118 Å²	118	81%	0.81	74%	0.738	S	S	*	*	S	Bend	trans	-81.4	32.4	-179.1	0	0	0	0	0	114.2
62	S	28.2	Very low	32.9	Very low	111 Å²	111	113.9 Å²	113.9	78%	0.776	73%	0.73	S	S	*	*			trans	-159.7	72.2	179.1	-179.8	0	0	0	0	114.2	S60	S60-S62 PolarHBondContact O-N 3.04Å
63	S	33.1	Very low	32.6	Very low	108 Å²	108	119.6 Å²	119.6	76%	0.755	74%	0.744	S	S	*	*			trans	-138.3	103.4	160.5	60.4	0	0	0	0	110.9
64	K	28.4	Very low	32.3	Very low	213 Å²	213	121.9 Å²	121.9	93%	0.926	75%	0.752	S	S	*	*			trans	-78	125.6	170.7	-68.2	175.2	176.6	177	0	109.8
65	T	33.5	Very low	31.9	Very low	135 Å²	135	122.9 Å²	122.9	83%	0.828	75%	0.747	S	S	*	*			trans	-141	130.9	158.4	24.2	0	0	0	0	108.6
66	Q	29.3	Very low	31.6	Very low	185 Å²	185	125.2 Å²	125.2	86%	0.864	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-92.9	144.2	-174	-62	164.6	-80	0	0	111.2
67	P	33.7	Very low	31.3	Very low	119 Å²	119	125 Å²	125	77%	0.773	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-90.2	145.5	140.4	17.7	-1.5	0	0	0	110.2
68	V	33.6	Very low	31.1	Very low	122 Å²	122	122.7 Å²	122.7	74%	0.739	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-81.2	130.6	-175.9	175.6	0	0	0	0	111.3	I70	V68-I70 HydrophobicContact CG1-CG1 4.45Å; V68-I70 PolarHBondContact O-N 3.36Å
69	P	31.6	Very low	30.8	Very low	108 Å²	108	129 Å²	129	70%	0.701	77%	0.766	S	S	*	*			trans	-81.4	106.7	165.6	31.9	-30.5	0	0	0	110.2	S71	P69-S71 PolarHBondContact O-N 2.98Å; P69-S71 VanDerWaalsContact O-N 3.16Å
70	I	32.4	Very low	30.5	Very low	147 Å²	147	131.9 Å²	131.9	75%	0.754	78%	0.776	S	S	*	*			trans	-74.9	104.4	169.3	-62.8	179.4	0	0	0	108.1	V68	V68-I70 HydrophobicContact CG1-CG1 4.45Å; V68-I70 PolarHBondContact O-N 3.36Å
71	S	29.6	Very low	30.3	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	77%	0.767	S	S	*	*			trans	-101.3	80.9	-179.2	44.1	0	0	0	0	111.3	P69 Q73	P69-S71 PolarHBondContact O-N 2.98Å; P69-S71 VanDerWaalsContact O-N 3.16Å; S71-Q73 PolarHBondContact O-N 3.32Å
72	T	32	Very low	30.1	Very low	121 Å²	121	132 Å²	132	74%	0.742	77%	0.766	S	S	*	*			trans	-83.9	88.4	166.6	29.7	0	0	0	0	110.4	L74	T72-L74 PolarHBondContact O-N 2.77Å
73	Q	29.3	Very low	30.2	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	76%	0.759	S	S	*	*			trans	-70.3	116.1	166.1	-67.8	-176	-5.6	0	0	109.8	S71	S71-Q73 PolarHBondContact O-N 3.32Å
74	L	28.3	Very low	29.9	Very low	146 Å²	146	132.9 Å²	132.9	76%	0.764	75%	0.754	S	S	*	*			trans	-109.1	98.8	152.2	-94.6	92.5	0	0	0	108.8	T72 T76	T72-L74 PolarHBondContact O-N 2.77Å; L74-T76 VanDerWaalsContact C-N 3.27Å; L74-T76 PolarHBondContact O-N 3.48Å
75	T	27.5	Very low	30.1	Very low	128 Å²	128	130.8 Å²	130.8	79%	0.785	74%	0.741	S	S	*	*			trans	-77.2	75.5	170.3	51.6	0	0	0	0	110	S77	T75-S77 PolarHBondContact O-N 3.11Å
76	T	31.2	Very low	30	Very low	118 Å²	118	130.8 Å²	130.8	72%	0.724	74%	0.736	S	S	*	*			trans	-77.1	102.5	170.9	40.2	0	0	0	0	109.9	L74 G78	L74-T76 VanDerWaalsContact C-N 3.27Å; L74-T76 PolarHBondContact O-N 3.48Å; T76-G78 PolarHBondContact O-N 3.39Å
77	S	28.3	Very low	30.1	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	73%	0.726	S	S	*	*			trans	-68.6	73.4	170.1	175.8	0	0	0	0	110.5	T75 R79	T75-S77 PolarHBondContact O-N 3.11Å; S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.14Å
78	G	30	Very low	30.1	Very low	66 Å²	66	127.4 Å²	127.4	68%	0.68	72%	0.718	S	S	*	*			trans	-67.7	80.8	178.9	0	0	0	0	0	111.9	T76 V80	T76-G78 PolarHBondContact O-N 3.39Å; G78-V80 PolarHBondContact O-N 2.81Å; G78-V80 VanDerWaalsContact O-N 3.14Å
79	R	27.6	Very low	30.1	Very low	223 Å²	223	129.4 Å²	129.4	84%	0.842	72%	0.719	S	S	*	*			trans	-60.1	113.6	176.9	-162.8	-178.1	-153	161	5.5	109.1	S77 S81	S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.14Å; R79-S81 PolarHBondContact O-N 3.46Å
80	V	27.7	Very low	30.5	Very low	138 Å²	138	133.6 Å²	133.6	84%	0.836	72%	0.722	S	S	*	*			trans	-69.1	81.5	172.8	-177.2	0	0	0	0	108.5	G78 T82	G78-V80 PolarHBondContact O-N 2.81Å; G78-V80 VanDerWaalsContact O-N 3.14Å; V80-T82 PolarHBondContact O-N 3.06Å
81	S	28.6	Very low	30.7	Very low	70 Å²	70	132.1 Å²	132.1	49%	0.49	72%	0.72	S	S	.	*			trans	-79.9	107.1	168.5	42.6	0	0	0	0	107.4	R79 F83	R79-S81 PolarHBondContact O-N 3.46Å; S81-F83 VanDerWaalsContact C-N 3.25Å; S81-F83 PolarHBondContact O-N 2.99Å
82	T	28.7	Very low	31.4	Very low	127 Å²	127	130.2 Å²	130.2	78%	0.779	70%	0.702	S	S	*	*			trans	-63.9	90.1	166.4	47.2	0	0	0	0	108.4	V80 S84	V80-T82 PolarHBondContact O-N 3.06Å; T82-S84 PolarHBondContact O-N 3.44Å
83	F	30.5	Very low	32	Very low	145 Å²	145	127.3 Å²	127.3	64%	0.636	69%	0.686	S	S	*	*			trans	-67.3	95.4	172.4	-98.1	-91.8	0	0	0	109.2	S81 Y85	S81-F83 VanDerWaalsContact C-N 3.25Å; S81-F83 PolarHBondContact O-N 2.99Å; F83-Y85 HydrophobicContact CB-CD2 4.1Å; F83-Y85 HydrophobicContact CB-CE2 4.3Å; F83-Y85 HydrophobicContact CD1-CD2 4.33Å; F83-Y85 HydrophobicContact CD1-CE2 4.03Å; F83-Y85 HydrophobicContact CG-CE2 4.43Å; F83-Y85 PolarHBondContact O-N 3.04Å
84	S	26.3	Very low	33.2	Very low	92 Å²	92	125.9 Å²	125.9	64%	0.643	68%	0.684	S	S	*	*			trans	-63.4	95.1	153.5	-164.1	0	0	0	0	106.5	T82 D86	T82-S84 PolarHBondContact O-N 3.44Å; S84-D86 PolarHBondContact O-N 3.49Å; S84-D86 VanDerWaalsContact O-N 3.09Å; S84-D86 PolarHBondContact OG-OD1 2.87Å
85	Y	32	Very low	34.3	Very low	170 Å²	170	122.7 Å²	122.7	67%	0.667	67%	0.674	S	S	*	*			trans	-72.8	92.5	159.9	-97.5	-86.9	0	0	0	106.5	F83 E87	F83-Y85 HydrophobicContact CB-CD2 4.1Å; F83-Y85 HydrophobicContact CB-CE2 4.3Å; F83-Y85 HydrophobicContact CD1-CD2 4.33Å; F83-Y85 HydrophobicContact CD1-CE2 4.03Å; F83-Y85 HydrophobicContact CG-CE2 4.43Å; F83-Y85 PolarHBondContact O-N 3.04Å; Y85-E87 PolarHBondContact O-N 3.24Å
86	D	31.2	Very low	35.2	Very low	134 Å²	134	120.2 Å²	120.2	72%	0.717	66%	0.656	S	S	*	*			trans	-62.5	119.3	167	-65.1	-13.7	0	0	0	107.2	S84 P88	S84-D86 PolarHBondContact O-N 3.49Å; S84-D86 VanDerWaalsContact O-N 3.09Å; S84-D86 PolarHBondContact OG-OD1 2.87Å; D86-P88 WeakPolarHBondContact O-CD 3.47Å
87	E	32.7	Very low	36.1	Very low	140 Å²	140	119.9 Å²	119.9	65%	0.654	65%	0.649	S	S	*	*			trans	-72.1	121.6	-170.5	-176	170.4	-157.1	0	0	110.1	Y85 Q89	Y85-E87 PolarHBondContact O-N 3.24Å; E87-Q89 PolarHBondContact O-N 3.31Å
88	P	33	Very low	37.2	Very low	93 Å²	93	125.3 Å²	125.3	60%	0.604	65%	0.652	S	S	*	*			trans	-68.2	103.5	173.8	28	-32.5	0	0	0	108.3	D86 Y90	D86-P88 WeakPolarHBondContact O-CD 3.47Å; P88-Y90 HydrophobicContact CB-CD2 4.39Å; P88-Y90 HydrophobicContact CB-CE2 4.21Å; P88-Y90 HydrophobicContact CG-CD2 4.37Å; P88-Y90 HydrophobicContact CG-CE2 4.03Å; P88-Y90 WeakPolarHBondContact O-CD2 3.42Å; P88-Y90 PolarHBondContact O-N 3.33Å
89	Q	33.8	Very low	38.3	Very low	164 Å²	164	125.8 Å²	125.8	77%	0.766	65%	0.645	S	S	*	*			trans	-63.2	102.1	172.6	-71.5	-168.7	-21.4	0	0	109.1	E87 T91	E87-Q89 PolarHBondContact O-N 3.31Å; Q89-T91 PolarHBondContact O-N 2.66Å
90	Y	39	Very low	39.7	Very low	196 Å²	196	119.6 Å²	119.6	77%	0.769	65%	0.65	S	S	*	*			trans	-73.2	60.9	173.9	-88.1	-91.5	0	0	0	111.2	P88 I92	P88-Y90 HydrophobicContact CB-CD2 4.39Å; P88-Y90 HydrophobicContact CB-CE2 4.21Å; P88-Y90 HydrophobicContact CG-CD2 4.37Å; P88-Y90 HydrophobicContact CG-CE2 4.03Å; P88-Y90 WeakPolarHBondContact O-CD2 3.42Å; P88-Y90 PolarHBondContact O-N 3.33Å; Y90-I92 PolarHBondContact O-N 2.97Å
91	T	37.1	Very low	41.6	Very low	116 Å²	116	118.2 Å²	118.2	71%	0.712	65%	0.646	S	S	*	*			trans	-72.8	83	162.6	55.8	0	0	0	0	108.3	Q89 S93	Q89-T91 PolarHBondContact O-N 2.66Å; T91-S93 PolarHBondContact O-N 3.18Å
92	I	45	Very low	43.8	Very low	62 Å²	62	117.9 Å²	117.9	32%	0.318	64%	0.636	S	S	.	*			trans	-67.1	102	170.4	-58.4	178	0	0	0	107.2	Y90 N96 L97 A110	Y90-I92 PolarHBondContact O-N 2.97Å; I92-N96 HydrophobicContact CG2-CB 4.44Å; I92-L97 HydrophobicContact CG2-CD1 4.09Å; I92-A110 HydrophobicContact CD1-CB 3.99Å
93	S	44.7	Very low	46.6	Very low	60 Å²	60	115.6 Å²	115.6	42%	0.42	62%	0.622	S	S	.	*			trans	-69.4	143.6	167.7	52.3	0	0	0	0	109.9	T91 S95 N96	T91-S93 PolarHBondContact O-N 3.18Å; S93-S95 PolarHBondContact O-N 3.31Å; S93-S95 PolarHBondContact OG-OG 3.32Å; S93-N96 PolarHBondContact O-N 2.69Å
94	D	53.4	Low	49.4	Very low	138 Å²	138	109.9 Å²	109.9	74%	0.738	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-19.7	-177.7	-68	-59.2	0	0	0	114.3	N96	D94-N96 VanDerWaalsContact C-N 3.27Å; D94-N96 PolarHBondContact O-N 3.13Å
95	S	51.6	Low	52.5	Low	78 Å²	78	109.7 Å²	109.7	55%	0.545	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.9	-40.1	169.6	56.1	0	0	0	0	113.1	S93	S93-S95 PolarHBondContact O-N 3.31Å; S93-S95 PolarHBondContact OG-OG 3.32Å
96	N	46.9	Very low	55.3	Low	76 Å²	76	106.1 Å²	106.1	41%	0.406	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-86.1	-24	-168.7	-60.9	4	0	0	0	111.3	I92 S93 D94 R98 S99	I92-N96 HydrophobicContact CG2-CB 4.44Å; S93-N96 PolarHBondContact O-N 2.69Å; D94-N96 VanDerWaalsContact C-N 3.27Å; D94-N96 PolarHBondContact O-N 3.13Å; N96-R98 PolarHBondContact O-N 2.97Å; N96-R98 VanDerWaalsContact O-N 3.07Å; N96-S99 PolarHBondContact O-N 3.21Å; N96-S99 PolarHBondContact O-OG 3.35Å
97	L	50.6	Low	58.2	Low	112 Å²	112	105.1 Å²	105.1	59%	0.586	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-62.4	-14.9	174.4	-141	78.7	0	0	0	113	I92	I92-L97 HydrophobicContact CG2-CD1 4.09Å
98	R	51.9	Low	61	Low	232 Å²	232	98.5 Å²	98.5	88%	0.875	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-97.7	-8.8	-180	-67.2	-174.7	171.8	-162.2	-3.3	114.7	N96	N96-R98 PolarHBondContact O-N 2.97Å; N96-R98 VanDerWaalsContact O-N 3.07Å
99	S	52.7	Low	63.8	Low	76 Å²	76	95.6 Å²	95.6	53%	0.531	52%	0.519	S	S	.	.	S	Bend	trans	-88.6	111	169.3	48.7	0	0	0	0	110	N96 S101	N96-S99 PolarHBondContact O-N 3.21Å; N96-S99 PolarHBondContact O-OG 3.35Å; S99-S101 PolarHBondContact O-N 3.1Å
100	G	56.8	Low	66.5	Low	92 Å²	92	89.4 Å²	89.4	95%	0.948	50%	0.496	S	S	*	.	S	Bend	trans	-73.4	72.8	-166.7	0	0	0	0	0	115.9
101	S	66.4	Low	68.9	Low	109 Å²	109	84.2 Å²	84.2	76%	0.762	48%	0.478	S	S	*	.			trans	-147.5	36.1	172.6	-169.1	0	0	0	0	113.9	S99	S99-S101 PolarHBondContact O-N 3.1Å
102	F	75.4	Confident	71.5	Confident	64 Å²	64	78.7 Å²	78.7	28%	0.281	44%	0.444	S	S	.	.			trans	-103.6	131.7	165.4	-69.3	-67	0	0	0	110.4	E106 K107	F102-E106 HydrophobicContact CB-CB 4.4Å; F102-E106 HydrophobicContact CD1-CB 4.13Å; F102-K107 HydrophobicContact CB-CG 4.03Å; F102-K107 VanDerWaalsContact O-CE 3.31Å; F102-K107 WeakPolarHBondContact O-CE 3.5Å
103	T	88.7	Confident	73.6	Confident	78 Å²	78	78 Å²	78	48%	0.479	44%	0.441	S	S	.	.			trans	-64	166.7	170.8	60.3	0	0	0	0	111.9	E105 E106 K107	T103-E105 VanDerWaalsContact C-N 3.32Å; T103-E106 WeakPolarHBondContact CB-OE2 3.37Å; T103-E106 WeakPolarHBondContact CG2-OE2 3.33Å; T103-E106 PolarHBondContact N-OE2 3.48Å; T103-E106 WeakPolarHBondContact OG1-CB 3.48Å; T103-E106 VanDerWaalsContact OG1-CG 3.23Å; T103-E106 WeakPolarHBondContact OG1-CG 3.41Å; T103-E106 PolarHBondContact OG1-N 3.01Å; T103-E106 VanDerWaalsContact OG1-N 3.13Å; T103-E106 PolarHBondContact OG1-OE2 3.44Å; T103-K107 WeakPolarHBondContact O-CG 3.41Å; T103-K107 PolarHBondContact O-N 3.21Å
104	A	89.3	Confident	75.5	Confident	26 Å²	26	82 Å²	82	22%	0.215	46%	0.458	C	S	.	.	H	α-helix	trans	-62.5	-39.5	173.6	0	0	0	0	0	111.8	K107 L108 I179	A104-K107 PolarHBondContact O-N 3.02Å; A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 PolarHBondContact O-N 3.3Å; A104-I179 HydrophobicContact CB-CD1 4Å
105	E	90.8	Very high	76.7	Confident	88 Å²	88	79.7 Å²	79.7	41%	0.411	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-45.6	177	-164.4	-173.7	167.1	0	0	111.9	T103 K107 L108 V109 I179 V182	T103-E105 VanDerWaalsContact C-N 3.32Å; E105-K107 VanDerWaalsContact C-N 3.31Å; E105-K107 PolarHBondContact O-N 3.35Å; E105-L108 WeakPolarHBondContact O-CB 3.4Å; E105-L108 PolarHBondContact O-N 2.99Å; E105-V109 HydrophobicContact CG-CG2 4.28Å; E105-V109 WeakPolarHBondContact O-CB 3.42Å; E105-V109 VanDerWaalsContact O-CG2 3.3Å; E105-V109 WeakPolarHBondContact O-CG2 3.39Å; E105-V109 PolarHBondContact O-N 3.42Å; E105-I179 HydrophobicContact CB-CD1 3.83Å; E105-I179 HydrophobicContact CG-CD1 4.42Å; E105-V182 HydrophobicContact CG-CG2 3.87Å
106	E	90.8	Very high	77.8	Confident	94 Å²	94	78.3 Å²	78.3	44%	0.439	44%	0.437	S	S	.	.	H	α-helix	trans	-61.5	-38.6	177.8	-73.7	164.4	122.7	0	0	112.4	F102 T103 A110	F102-E106 HydrophobicContact CB-CB 4.4Å; F102-E106 HydrophobicContact CD1-CB 4.13Å; T103-E106 WeakPolarHBondContact CB-OE2 3.37Å; T103-E106 WeakPolarHBondContact CG2-OE2 3.33Å; T103-E106 PolarHBondContact N-OE2 3.48Å; T103-E106 WeakPolarHBondContact OG1-CB 3.48Å; T103-E106 VanDerWaalsContact OG1-CG 3.23Å; T103-E106 WeakPolarHBondContact OG1-CG 3.41Å; T103-E106 PolarHBondContact OG1-N 3.01Å; T103-E106 VanDerWaalsContact OG1-N 3.13Å; T103-E106 PolarHBondContact OG1-OE2 3.44Å; E106-A110 VanDerWaalsContact O-CB 3.23Å; E106-A110 WeakPolarHBondContact O-CB 3.45Å; E106-A110 PolarHBondContact O-N 3.06Å
107	K	90.8	Very high	79.3	Confident	114 Å²	114	78.3 Å²	78.3	50%	0.496	44%	0.443	S	S	.	.	H	α-helix	trans	-64.4	-45.8	173.8	-69.2	170.3	-173	170.2	0	111.4	F102 T103 A104 E105 A110 Q111	F102-K107 HydrophobicContact CB-CG 4.03Å; F102-K107 VanDerWaalsContact O-CE 3.31Å; F102-K107 WeakPolarHBondContact O-CE 3.5Å; T103-K107 WeakPolarHBondContact O-CG 3.41Å; T103-K107 PolarHBondContact O-N 3.21Å; A104-K107 PolarHBondContact O-N 3.02Å; E105-K107 VanDerWaalsContact C-N 3.31Å; E105-K107 PolarHBondContact O-N 3.35Å; K107-A110 PolarHBondContact O-N 3.13Å; K107-Q111 VanDerWaalsContact O-CB 3.28Å; K107-Q111 WeakPolarHBondContact O-CB 3.36Å; K107-Q111 PolarHBondContact O-N 3.08Å
108	L	92.8	Very high	80.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-59.6	-51.1	176.9	177.6	60.6	0	0	0	111.1	A104 E105 A110 Q111 L112 W171 F176 I179 V182	A104-L108 WeakPolarHBondContact O-CB 3.45Å; A104-L108 PolarHBondContact O-N 3.3Å; E105-L108 WeakPolarHBondContact O-CB 3.4Å; E105-L108 PolarHBondContact O-N 2.99Å; L108-A110 PolarHBondContact O-N 3.28Å; L108-Q111 PolarHBondContact O-N 2.84Å; L108-L112 HydrophobicContact CD1-CD1 3.78Å; L108-L112 HydrophobicContact CD1-CD2 4.41Å; L108-L112 HydrophobicContact CD1-CG 3.87Å; L108-L112 HydrophobicContact CG-CD1 3.82Å; L108-L112 HydrophobicContact CG-CG 4.3Å; L108-L112 WeakPolarHBondContact O-CB 3.5Å; L108-L112 VanDerWaalsContact O-CG 3.26Å; L108-L112 WeakPolarHBondContact O-CG 3.44Å; L108-L112 PolarHBondContact O-N 2.88Å; L108-W171 HydrophobicContact CD1-CB 3.88Å; L108-W171 HydrophobicContact CD1-CD2 3.74Å; L108-W171 HydrophobicContact CD1-CE3 4.21Å; L108-W171 HydrophobicContact CD1-CG 3.55Å; L108-W171 HydrophobicContact CD2-CD2 4Å; L108-W171 HydrophobicContact CD2-CG 4.35Å; L108-W171 HydrophobicContact CD2-CZ2 3.95Å; L108-W171 HydrophobicContact CG-CD2 4.44Å; L108-F176 HydrophobicContact CB-CB 4.5Å; L108-F176 HydrophobicContact CB-CD1 3.63Å; L108-F176 HydrophobicContact CB-CE1 4.06Å; L108-F176 HydrophobicContact CB-CG 4.06Å; L108-F176 HydrophobicContact CD1-CD1 4.13Å; L108-F176 HydrophobicContact CD1-CD2 3.9Å; L108-F176 HydrophobicContact CD1-CE1 4.23Å; L108-F176 HydrophobicContact CD1-CE2 4.03Å; L108-F176 HydrophobicContact CD1-CG 3.96Å; L108-F176 HydrophobicContact CD1-CZ 4.2Å; L108-F176 HydrophobicContact CD2-CB 4.46Å; L108-F176 HydrophobicContact CG-CD1 4.39Å; L108-F176 HydrophobicContact CG-CG 4.4Å; L108-I179 HydrophobicContact CD2-CB 4.34Å; L108-I179 HydrophobicContact CD2-CG2 3.75Å; L108-V182 HydrophobicContact CD2-CB 4.14Å; L108-V182 HydrophobicContact CD2-CG1 4.32Å; L108-V182 HydrophobicContact CD2-CG2 4.32Å
109	V	91.7	Very high	82.4	Confident	32 Å²	32	66.2 Å²	66.2	19%	0.194	40%	0.399	C	S	.	.	H	α-helix	trans	-59.8	-46.6	179	172.3	0	0	0	0	111.1	E105 Q111 L112 L113 V182 L184	E105-V109 HydrophobicContact CG-CG2 4.28Å; E105-V109 WeakPolarHBondContact O-CB 3.42Å; E105-V109 VanDerWaalsContact O-CG2 3.3Å; E105-V109 WeakPolarHBondContact O-CG2 3.39Å; E105-V109 PolarHBondContact O-N 3.42Å; V109-Q111 PolarHBondContact O-N 3.39Å; V109-L112 PolarHBondContact O-N 3.03Å; V109-L113 HydrophobicContact CG1-CD1 3.82Å; V109-L113 HydrophobicContact CG1-CG 4.44Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 3.49Å; V109-V182 HydrophobicContact CG2-CG2 3.48Å; V109-V182 VanDerWaalsContact CG2-CG2 3.48Å; V109-L184 HydrophobicContact CB-CD2 4.37Å; V109-L184 HydrophobicContact CG1-CD2 4.06Å; V109-L184 HydrophobicContact CG2-CD2 3.92Å
110	A	89.8	Confident	83.9	Confident	34 Å²	34	66.1 Å²	66.1	28%	0.281	40%	0.395	S	S	.	.	H	α-helix	trans	-62.3	-42.4	177.2	0	0	0	0	0	112.1	I92 E106 K107 L108 N114	I92-A110 HydrophobicContact CD1-CB 3.99Å; E106-A110 VanDerWaalsContact O-CB 3.23Å; E106-A110 WeakPolarHBondContact O-CB 3.45Å; E106-A110 PolarHBondContact O-N 3.06Å; K107-A110 PolarHBondContact O-N 3.13Å; L108-A110 PolarHBondContact O-N 3.28Å; A110-N114 VanDerWaalsContact O-CB 3.24Å; A110-N114 WeakPolarHBondContact O-CB 3.36Å; A110-N114 PolarHBondContact O-N 3.09Å; A110-N114 VanDerWaalsContact O-N 3.17Å
111	Q	90.3	Very high	85.3	Confident	87 Å²	87	64.6 Å²	64.6	41%	0.407	36%	0.361	S	S	.	.	H	α-helix	trans	-67.6	-45.5	177.9	-177.8	171	-23.7	0	0	112	K107 L108 V109 N114 R115	K107-Q111 VanDerWaalsContact O-CB 3.28Å; K107-Q111 WeakPolarHBondContact O-CB 3.36Å; K107-Q111 PolarHBondContact O-N 3.08Å; L108-Q111 PolarHBondContact O-N 2.84Å; V109-Q111 PolarHBondContact O-N 3.39Å; Q111-N114 PolarHBondContact O-N 3.24Å; Q111-R115 WeakPolarHBondContact O-CG 3.38Å; Q111-R115 PolarHBondContact O-N 2.92Å
112	L	91.6	Very high	86.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-49.4	178.4	-72.2	173.8	0	0	0	111.2	L108 V109 N114 R115 W171 V182 L184	L108-L112 HydrophobicContact CD1-CD1 3.78Å; L108-L112 HydrophobicContact CD1-CD2 4.41Å; L108-L112 HydrophobicContact CD1-CG 3.87Å; L108-L112 HydrophobicContact CG-CD1 3.82Å; L108-L112 HydrophobicContact CG-CG 4.3Å; L108-L112 WeakPolarHBondContact O-CB 3.5Å; L108-L112 VanDerWaalsContact O-CG 3.26Å; L108-L112 WeakPolarHBondContact O-CG 3.44Å; L108-L112 PolarHBondContact O-N 2.88Å; V109-L112 PolarHBondContact O-N 3.03Å; L112-N114 VanDerWaalsContact C-N 3.26Å; L112-N114 PolarHBondContact O-N 3.42Å; L112-R115 PolarHBondContact O-N 3.07Å; L112-W171 HydrophobicContact CD1-CE3 3.95Å; L112-W171 HydrophobicContact CD1-CZ3 4.07Å; L112-W171 HydrophobicContact CD2-CE3 4.17Å; L112-V182 HydrophobicContact CD1-CG1 3.88Å; L112-L184 HydrophobicContact CD1-CD1 4.35Å
113	L	88.4	Confident	86.3	Confident	47 Å²	47	58.1 Å²	58.1	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-67.3	-23.7	-179.1	-66.9	176.8	0	0	0	113.6	V109 L118 N188 L189	V109-L113 HydrophobicContact CG1-CD1 3.82Å; V109-L113 HydrophobicContact CG1-CG 4.44Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.43Å; V109-L113 PolarHBondContact O-N 3.49Å; L113-L118 HydrophobicContact CD2-CD1 4.24Å; L113-N188 HydrophobicContact CD2-CB 4.03Å; L113-L189 HydrophobicContact CD2-CD2 4.44Å
114	N	85.6	Confident	85.2	Confident	144 Å²	144	55.8 Å²	55.8	77%	0.77	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	1.4	179.8	-160.9	27.8	0	0	0	114.2	A110 Q111 L112 G116	A110-N114 VanDerWaalsContact O-CB 3.24Å; A110-N114 WeakPolarHBondContact O-CB 3.36Å; A110-N114 PolarHBondContact O-N 3.09Å; A110-N114 VanDerWaalsContact O-N 3.17Å; Q111-N114 PolarHBondContact O-N 3.24Å; L112-N114 VanDerWaalsContact C-N 3.26Å; L112-N114 PolarHBondContact O-N 3.42Å; N114-G116 PolarHBondContact O-N 3.01Å; N114-G116 VanDerWaalsContact O-N 3.1Å
115	R	78.6	Confident	83.8	Confident	91 Å²	91	62.1 Å²	62.1	34%	0.343	33%	0.332	S	S	.	.	S	Bend	trans	-70.6	1.6	179.8	-78.8	169.9	-174.8	-161.8	4.3	115.2	Q111 L112 R168 T170	Q111-R115 WeakPolarHBondContact O-CG 3.38Å; Q111-R115 PolarHBondContact O-N 2.92Å; L112-R115 PolarHBondContact O-N 3.07Å; R115-R168 WeakPolarHBondContact CD-O 3.36Å; R115-R168 PolarHBondContact NH1-O 2.99Å; R115-T170 VanDerWaalsContact CZ-O 3.32Å; R115-T170 PolarHBondContact NH1-O 3.12Å; R115-T170 PolarHBondContact NH2-O 3.41Å
116	G	74.6	Confident	82.3	Confident	49 Å²	49	63.1 Å²	63.1	51%	0.505	34%	0.338	S	S	.	.	S	Bend	trans	122.5	-152.2	172.8	0	0	0	0	0	113.4	N114 L118	N114-G116 PolarHBondContact O-N 3.01Å; N114-G116 VanDerWaalsContact O-N 3.1Å; G116-L118 VanDerWaalsContact C-N 3.35Å; G116-L118 PolarHBondContact O-N 3.32Å
117	S	78.1	Confident	80.9	Confident	76 Å²	76	65.9 Å²	65.9	53%	0.531	36%	0.355	S	S	.	.			trans	-76.5	82.1	-175.8	-165.6	0	0	0	0	112.2	T119 V120 R168	S117-T119 PolarHBondContact O-N 3.38Å; S117-T119 PolarHBondContact OG-OG1 2.94Å; S117-V120 PolarHBondContact O-N 3.45Å; S117-R168 PolarHBondContact O-NH1 2.76Å; S117-R168 VanDerWaalsContact O-NH1 3.07Å
118	L	84.2	Confident	79.4	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.026	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.8	178.2	-67	174.9	0	0	0	113.3	L113 G116 V120 R168 L169 N188 L189 W190	L113-L118 HydrophobicContact CD2-CD1 4.24Å; G116-L118 VanDerWaalsContact C-N 3.35Å; G116-L118 PolarHBondContact O-N 3.32Å; L118-V120 VanDerWaalsContact C-N 3.25Å; L118-V120 PolarHBondContact O-N 3.36Å; L118-R168 HydrophobicContact CD2-CB 4.07Å; L118-R168 PolarHBondContact O-NH1 3.18Å; L118-R168 PolarHBondContact O-NH2 3.17Å; L118-L169 HydrophobicContact CD1-CD2 4.07Å; L118-L169 HydrophobicContact CD2-CD2 3.83Å; L118-N188 WeakPolarHBondContact CB-O 3.38Å; L118-L189 HydrophobicContact CB-CD2 4.13Å; L118-L189 HydrophobicContact CD1-CD2 3.75Å; L118-L189 HydrophobicContact CG-CD2 4.48Å; L118-W190 VanDerWaalsContact O-CB 3.26Å; L118-W190 WeakPolarHBondContact O-CB 3.42Å; L118-W190 PolarHBondContact O-N 3.21Å
119	T	83.4	Confident	78	Confident	85 Å²	85	68.3 Å²	68.3	52%	0.521	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.2	177.4	57.7	0	0	0	0	114.2	S117	S117-T119 PolarHBondContact O-N 3.38Å; S117-T119 PolarHBondContact OG-OG1 2.94Å
120	V	84	Confident	76.9	Confident	73 Å²	73	71.9 Å²	71.9	44%	0.442	40%	0.398	S	S	.	.	S	Bend	trans	-79.1	145.4	170	180	0	0	0	0	109.8	S117 L118 R168	S117-V120 PolarHBondContact O-N 3.45Å; L118-V120 VanDerWaalsContact C-N 3.25Å; L118-V120 PolarHBondContact O-N 3.36Å; V120-R168 VanDerWaalsContact O-CZ 3.27Å; V120-R168 PolarHBondContact O-NH1 3.16Å; V120-R168 PolarHBondContact O-NH2 2.8Å
121	R	86.4	Confident	76.6	Confident	60 Å²	60	73.6 Å²	73.6	23%	0.226	40%	0.402	C	S	.	.			trans	-52.3	136.3	176.8	66.1	178	176.5	127	-1.1	112.4	N123 G124 S129 V133 W190	R121-N123 PolarHBondContact O-N 3.06Å; R121-G124 PolarHBondContact O-N 3.08Å; R121-S129 PolarHBondContact NH1-O 3.38Å; R121-S129 PolarHBondContact NH2-O 3.11Å; R121-V133 HydrophobicContact CB-CG2 4.31Å; R121-W190 HydrophobicContact CB-CD2 4.34Å; R121-W190 HydrophobicContact CB-CG 4.49Å; R121-W190 HydrophobicContact CB-CZ2 4.33Å
122	P	84.5	Confident	76.5	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.013	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-48.8	-50.8	-173.6	-31.6	33.3	0	0	0	115.4	G124 Y125 D166 W190	P122-G124 PolarHBondContact O-N 3.38Å; P122-Y125 WeakPolarHBondContact O-CB 3.33Å; P122-Y125 PolarHBondContact O-N 3.14Å; P122-Y125 VanDerWaalsContact O-N 3.08Å; P122-D166 HydrophobicContact CB-CB 4.14Å; P122-D166 HydrophobicContact CG-CB 3.84Å; P122-W190 VanDerWaalsContact CD-CE3 3.46Å; P122-W190 HydrophobicContact CG-CE3 4.07Å; P122-W190 HydrophobicContact CG-CZ3 4.5Å
123	N	77.4	Confident	76.5	Confident	36 Å²	36	70.9 Å²	70.9	19%	0.193	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-64.2	-12.8	-177.9	-64.1	0.8	0	0	0	114.1	R121 Y125 Q128 N131 P132 V133	R121-N123 PolarHBondContact O-N 3.06Å; N123-Y125 VanDerWaalsContact C-N 3.25Å; N123-Y125 PolarHBondContact O-N 3.47Å; N123-Q128 CarbonylContact O-C 3.58Å; N123-N131 PolarHBondContact ND2-O 2.95Å; N123-P132 VanDerWaalsContact ND2-C 3.34Å; N123-P132 PolarHBondContact ND2-O 3.35Å; N123-V133 HydrophobicContact CB-CG2 4.48Å
124	G	65.9	Low	76.7	Confident	29 Å²	29	73.3 Å²	73.3	30%	0.299	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-67	-24.7	173.5	0	0	0	0	0	113.6	R121 P122	R121-G124 PolarHBondContact O-N 3.08Å; P122-G124 PolarHBondContact O-N 3.38Å
125	Y	60.4	Low	77	Confident	159 Å²	159	66.4 Å²	66.4	62%	0.624	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-32	-175.3	-173.8	-106.9	0	0	0	113.8	P122 N123 N127 R168	P122-Y125 WeakPolarHBondContact O-CB 3.33Å; P122-Y125 PolarHBondContact O-N 3.14Å; P122-Y125 VanDerWaalsContact O-N 3.08Å; N123-Y125 VanDerWaalsContact C-N 3.25Å; N123-Y125 PolarHBondContact O-N 3.47Å; Y125-N127 VanDerWaalsContact C-N 3.33Å; Y125-N127 PolarHBondContact O-N 3.3Å; Y125-R168 HydrophobicContact CD1-CG 4.02Å; Y125-R168 HydrophobicContact CD2-CG 4.37Å; Y125-R168 HydrophobicContact CG-CG 3.95Å
126	M	59.4	Low	77.7	Confident	108 Å²	108	65.1 Å²	65.1	53%	0.532	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	11.8	-170.9	-69.3	-75.2	-81	0	0	114.1	Q128	M126-Q128 HydrophobicContact CB-CB 4.27Å; M126-Q128 HydrophobicContact CB-CG 4.17Å; M126-Q128 PolarHBondContact O-N 2.87Å
127	N	61	Low	78.5	Confident	152 Å²	152	62.9 Å²	62.9	81%	0.813	34%	0.341	S	S	*	.	S	Bend	trans	56.4	-7	-160.9	-69.4	-37.9	0	0	0	115.6	Y125 S129	Y125-N127 VanDerWaalsContact C-N 3.33Å; Y125-N127 PolarHBondContact O-N 3.3Å; N127-S129 PolarHBondContact O-N 3.44Å
128	Q	59.8	Low	79	Confident	100 Å²	100	59.4 Å²	59.4	47%	0.467	32%	0.317	S	S	.	.			trans	-75.6	49	176.1	-62.1	-178.3	15.6	0	0	112.6	N123 M126 T130 N131	N123-Q128 CarbonylContact O-C 3.58Å; M126-Q128 HydrophobicContact CB-CB 4.27Å; M126-Q128 HydrophobicContact CB-CG 4.17Å; M126-Q128 PolarHBondContact O-N 2.87Å; Q128-T130 PolarHBondContact O-N 3.09Å; Q128-N131 PolarHBondContact O-N 3.21Å
129	S	63.2	Low	79.2	Confident	66 Å²	66	59.1 Å²	59.1	46%	0.462	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-14.4	-176	66.2	0	0	0	0	114.3	R121 N127	R121-S129 PolarHBondContact NH1-O 3.38Å; R121-S129 PolarHBondContact NH2-O 3.11Å; N127-S129 PolarHBondContact O-N 3.44Å
130	T	69.1	Low	79.2	Confident	106 Å²	106	56.4 Å²	56.4	65%	0.65	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-24	177.9	52	0	0	0	0	114.6	Q128	Q128-T130 PolarHBondContact O-N 3.09Å
131	N	83.3	Confident	79.1	Confident	71 Å²	71	53.5 Å²	53.5	38%	0.38	28%	0.28	S	S	.	.	S	Bend	trans	-92	129.8	-170.2	-64.5	-1.5	0	0	0	110	N123 Q128	N123-N131 PolarHBondContact ND2-O 2.95Å; Q128-N131 PolarHBondContact O-N 3.21Å
132	P	88	Confident	78.7	Confident	27 Å²	27	52.2 Å²	52.2	18%	0.175	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-71.6	150.1	178.1	30.7	-35.4	0	0	0	111.2	N123 H134 E260 Q261 Q262 L264	N123-P132 VanDerWaalsContact ND2-C 3.34Å; N123-P132 PolarHBondContact ND2-O 3.35Å; P132-H134 PolarHBondContact O-CD2 3Å; P132-H134 PolarHBondContact O-N 3.27Å; P132-E260 WeakPolarHBondContact CB-O 3.16Å; P132-Q261 WeakPolarHBondContact CA-O 3.4Å; P132-Q262 WeakPolarHBondContact CA-O 3.43Å; P132-L264 HydrophobicContact CB-CB 4.1Å; P132-L264 HydrophobicContact CB-CD1 4.5Å; P132-L264 HydrophobicContact CG-CB 4.21Å; P132-L264 HydrophobicContact CG-CD1 4.26Å
133	V	90.8	Very high	78.4	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.1	170.7	-176.8	0	0	0	0	108.4	R121 N123 V135 W164 W190 Q262 L263 L264	R121-V133 HydrophobicContact CB-CG2 4.31Å; N123-V133 HydrophobicContact CB-CG2 4.48Å; V133-V135 HydrophobicContact CG1-CG2 4.26Å; V133-V135 PolarHBondContact O-N 2.7Å; V133-W164 HydrophobicContact CG1-CB 4.28Å; V133-W190 HydrophobicContact CB-CH2 4Å; V133-W190 HydrophobicContact CB-CZ3 4.41Å; V133-W190 HydrophobicContact CG1-CH2 3.81Å; V133-W190 HydrophobicContact CG1-CZ3 3.77Å; V133-W190 HydrophobicContact CG2-CH2 4.21Å; V133-Q262 PolarHBondContact N-O 2.82Å; V133-L263 CarbonylContact O-C 3.58Å; V133-L263 WeakPolarHBondContact O-CA 3.3Å; V133-L264 PolarHBondContact O-N 2.82Å
134	H	92.1	Very high	78.7	Confident	98 Å²	98	56.1 Å²	56.1	45%	0.454	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.3	177.5	-73	-109.9	0	0	0	109.8	P132 W164 L264 Q266	P132-H134 PolarHBondContact O-CD2 3Å; P132-H134 PolarHBondContact O-N 3.27Å; H134-W164 WeakPolarHBondContact O-CB 3.47Å; H134-L264 WeakPolarHBondContact CE1-CD2 3.32Å; H134-Q266 PolarHBondContact ND1-OE1 3.22Å
135	V	93.4	Very high	79.4	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	102.1	-178.1	-178.2	0	0	0	0	108.3	V133 M162 W164 P192 L263 L264 L265 Q266	V133-V135 HydrophobicContact CG1-CG2 4.26Å; V133-V135 PolarHBondContact O-N 2.7Å; V135-M162 HydrophobicContact CG1-CG 4.49Å; V135-W164 HydrophobicContact CG2-CB 4.27Å; V135-P192 HydrophobicContact CG1-CB 4.22Å; V135-P192 HydrophobicContact CG1-CG 4.14Å; V135-P192 HydrophobicContact CG2-CB 3.94Å; V135-P192 HydrophobicContact CG2-CG 4.47Å; V135-L263 HydrophobicContact CB-CD2 4.47Å; V135-L263 HydrophobicContact CG2-CD1 4.21Å; V135-L263 HydrophobicContact CG2-CD2 4.18Å; V135-L263 HydrophobicContact CG2-CG 3.94Å; V135-L264 PolarHBondContact N-O 3.44Å; V135-L265 HydrophobicContact CB-CD2 4.24Å; V135-L265 HydrophobicContact CG1-CD2 4.22Å; V135-Q266 PolarHBondContact O-N 3.02Å
136	N	93.6	Very high	80.4	Confident	63 Å²	63	52.8 Å²	52.8	34%	0.337	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	122.9	170.7	-72	-35.5	0	0	0	108.5	M162 R163 Q266 F268	N136-M162 CarbonylContact O-C 3.53Å; N136-M162 WeakPolarHBondContact O-CA 3.41Å; N136-R163 HydrophobicContact CB-CB 4.22Å; N136-R163 PolarHBondContact N-O 3.04Å; N136-R163 PolarHBondContact O-N 2.97Å; N136-Q266 CarbonylContact C-O 3.52Å; N136-Q266 VanDerWaalsContact CA-O 3.3Å; N136-Q266 WeakPolarHBondContact CA-O 3.49Å; N136-Q266 WeakPolarHBondContact OD1-CB 3.27Å; N136-F268 HydrophobicContact CB-CD1 3.67Å; N136-F268 HydrophobicContact CB-CE1 3.97Å; N136-F268 HydrophobicContact CB-CG 4.44Å; N136-F268 WeakPolarHBondContact O-CE1 3.43Å
137	I	91	Very high	81.6	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.2	179.8	-169.7	158.5	0	0	0	111.7	F160 M162 V194 L253 L265 Q266 P267 F268 V310	I137-F160 HydrophobicContact CD1-CD1 4.34Å; I137-F160 HydrophobicContact CG1-CD1 4.45Å; I137-M162 HydrophobicContact CB-CG 4.23Å; I137-M162 HydrophobicContact CD1-CG 3.74Å; I137-M162 HydrophobicContact CD1-SD 3.96Å; I137-M162 HydrophobicContact CG1-CG 3.81Å; I137-V194 HydrophobicContact CD1-CG1 4.23Å; I137-L253 HydrophobicContact CD1-CD1 3.88Å; I137-L253 HydrophobicContact CG1-CD1 4.32Å; I137-L265 HydrophobicContact CG2-CD2 4.41Å; I137-Q266 PolarHBondContact N-O 3.49Å; I137-P267 WeakPolarHBondContact O-CA 3.44Å; I137-F268 WeakPolarHBondContact O-CD1 3.43Å; I137-F268 PolarHBondContact O-N 3.19Å; I137-V310 HydrophobicContact CG2-CG2 4.22Å
138	T	89	Confident	82.6	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	163.7	169.3	-156.6	0	0	0	0	109.9	F160 T161 F268	T138-F160 WeakPolarHBondContact O-CA 3.43Å; T138-T161 PolarHBondContact N-O 3.17Å; T138-T161 PolarHBondContact O-N 3.01Å; T138-F268 WeakPolarHBondContact CB-O 3.49Å; T138-F268 HydrophobicContact CG2-CD1 4.49Å; T138-F268 HydrophobicContact CG2-CD2 4.44Å; T138-F268 HydrophobicContact CG2-CE1 3.89Å; T138-F268 HydrophobicContact CG2-CE2 3.82Å; T138-F268 HydrophobicContact CG2-CZ 3.52Å; T138-F268 PolarHBondContact OG1-O 3.06Å
139	Y	86.7	Confident	83.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	128.6	-178.3	178.5	-115.7	0	0	0	109.8	V141 I156 W159 F160 L231 L251 I312	Y139-V141 HydrophobicContact CD1-CG2 4.18Å; Y139-V141 HydrophobicContact CE1-CG2 3.69Å; Y139-I156 HydrophobicContact CE1-CD1 3.98Å; Y139-W159 WeakPolarHBondContact CA-O 3.38Å; Y139-W159 WeakPolarHBondContact CD2-O 3.49Å; Y139-F160 AromaticContact CD2-CD1 3.55Å; Y139-F160 HydrophobicContact CD2-CD1 3.55Å; Y139-F160 AromaticContact CD2-CD2 3.89Å; Y139-F160 HydrophobicContact CD2-CD2 3.89Å; Y139-F160 AromaticContact CD2-CE1 3.39Å; Y139-F160 HydrophobicContact CD2-CE1 3.39Å; Y139-F160 AromaticContact CD2-CE2 3.77Å; Y139-F160 HydrophobicContact CD2-CE2 3.77Å; Y139-F160 AromaticContact CD2-CG 3.81Å; Y139-F160 HydrophobicContact CD2-CG 3.81Å; Y139-F160 AromaticContact CD2-CZ 3.53Å; Y139-F160 HydrophobicContact CD2-CZ 3.53Å; Y139-F160 HydrophobicContact CE2-CD1 4.5Å; Y139-F160 HydrophobicContact CE2-CD2 4.15Å; Y139-F160 HydrophobicContact CE2-CE1 4.12Å; Y139-F160 AromaticContact CE2-CE2 3.77Å; Y139-F160 HydrophobicContact CE2-CE2 3.77Å; Y139-F160 AromaticContact CE2-CZ 3.76Å; Y139-F160 HydrophobicContact CE2-CZ 3.76Å; Y139-F160 HydrophobicContact CG-CD1 4.04Å; Y139-F160 AromaticContact CG-CE1 3.76Å; Y139-F160 HydrophobicContact CG-CE1 3.76Å; Y139-F160 HydrophobicContact CG-CZ 4.2Å; Y139-L231 HydrophobicContact CE2-CD1 4.1Å; Y139-L251 HydrophobicContact CD1-CD2 3.62Å; Y139-L251 HydrophobicContact CE1-CD2 3.66Å; Y139-L251 HydrophobicContact CG-CD2 4.12Å; Y139-I312 HydrophobicContact CG-CD1 4.48Å
140	N	84.1	Confident	84.1	Confident	28 Å²	28	41.4 Å²	41.4	15%	0.15	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.6	-180	-53.9	-78.2	0	0	0	108.4	G158 W159	N140-G158 CarbonylContact O-C 3.58Å; N140-G158 WeakPolarHBondContact O-CA 3.35Å; N140-W159 HydrophobicContact CB-CD2 4.3Å; N140-W159 HydrophobicContact CB-CZ2 3.95Å; N140-W159 PolarHBondContact N-O 3.38Å; N140-W159 PolarHBondContact ND2-NE1 2.79Å; N140-W159 PolarHBondContact O-N 3.1Å
141	V	81.9	Confident	84.7	Confident	12 Å²	12	40.6 Å²	40.6	7%	0.073	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.9	178.9	-174.7	0	0	0	0	109.1	Y139 I156 I289 I314	Y139-V141 HydrophobicContact CD1-CG2 4.18Å; Y139-V141 HydrophobicContact CE1-CG2 3.69Å; V141-I156 HydrophobicContact CG1-CG2 4.47Å; V141-I289 HydrophobicContact CB-CD1 4.06Å; V141-I289 HydrophobicContact CG1-CD1 3.64Å; V141-I314 HydrophobicContact CG2-CD1 4.33Å
142	V	77.6	Confident	84.8	Confident	32 Å²	32	38.7 Å²	38.7	19%	0.194	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-41.9	177.6	176.7	0	0	0	0	111.3	S157 W159 L279	V142-S157 PolarHBondContact N-O 3.03Å; V142-W159 HydrophobicContact CG2-CE3 3.43Å; V142-W159 VanDerWaalsContact CG2-CE3 3.43Å; V142-W159 HydrophobicContact CG2-CH2 4.22Å; V142-W159 HydrophobicContact CG2-CZ3 3.23Å; V142-L279 WeakPolarHBondContact O-CD1 3.31Å; V142-L279 VanDerWaalsContact O-CG 3.23Å; V142-L279 WeakPolarHBondContact O-CG 3.48Å
143	Q	78.4	Confident	84.7	Confident	89 Å²	89	37.6 Å²	37.6	42%	0.416	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	152.7	178.8	54.7	179.9	-14	0	0	111.6	L145 S157	Q143-L145 HydrophobicContact CG-CD2 3.98Å; Q143-S157 PolarHBondContact N-O 3.44Å; Q143-S157 PolarHBondContact O-N 3.22Å
144	I	83.2	Confident	84.6	Confident	31 Å²	31	37.5 Å²	37.5	16%	0.159	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.3	166	-61.8	162.5	0	0	0	106.5	L154 I156 W287 I289 L316	I144-L154 HydrophobicContact CG2-CD1 3.82Å; I144-I156 HydrophobicContact CG1-CG2 4.01Å; I144-W287 HydrophobicContact CD1-CB 3.61Å; I144-W287 HydrophobicContact CD1-CG 4.45Å; I144-I289 HydrophobicContact CD1-CD1 4.35Å; I144-I289 HydrophobicContact CD1-CG1 3.94Å; I144-L316 HydrophobicContact CD1-CD1 4.4Å; I144-L316 HydrophobicContact CD1-CD2 3.65Å
145	L	82.2	Confident	84.4	Confident	89 Å²	89	34 Å²	34	47%	0.466	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-29.9	-179.6	-62.5	174.8	0	0	0	111.7	Q143 S155 V230	Q143-L145 HydrophobicContact CG-CD2 3.98Å; L145-S155 PolarHBondContact N-O 2.94Å; L145-V230 HydrophobicContact CD1-CB 4.45Å; L145-V230 HydrophobicContact CD1-CG1 3.51Å; L145-V230 HydrophobicContact CD1-CG2 4.1Å
146	G	81.7	Confident	84	Confident	29 Å²	29	34 Å²	34	30%	0.299	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	174.3	166.9	176	0	0	0	0	0	112.9	S155	G146-S155 PolarHBondContact N-O 3.48Å; G146-S155 PolarHBondContact O-N 3.01Å
147	F	83.1	Confident	83.5	Confident	21 Å²	21	32.1 Å²	32.1	9%	0.092	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	108.6	170.7	-153.2	-55.9	0	0	0	109.3	Q149 L154 C235 L237 W287 L316	F147-Q149 VanDerWaalsContact C-N 3.35Å; F147-Q149 HydrophobicContact CD1-CG 4.02Å; F147-Q149 PolarHBondContact O-N 3.27Å; F147-L154 HydrophobicContact CD2-CB 4.27Å; F147-L154 HydrophobicContact CD2-CD1 3.79Å; F147-L154 HydrophobicContact CE2-CB 3.95Å; F147-L154 HydrophobicContact CE2-CD1 4.1Å; F147-L154 HydrophobicContact CZ-CB 4.29Å; F147-C235 HydrophobicContact CZ-CB 4.05Å; F147-L237 HydrophobicContact CD1-CD1 4.27Å; F147-L237 HydrophobicContact CD1-CD2 4.35Å; F147-L237 HydrophobicContact CE1-CD1 3.7Å; F147-L237 HydrophobicContact CE1-CD2 3.54Å; F147-L237 HydrophobicContact CE1-CG 3.63Å; F147-L237 HydrophobicContact CE2-CD2 4.1Å; F147-L237 HydrophobicContact CZ-CD1 4.4Å; F147-L237 HydrophobicContact CZ-CD2 3.38Å; F147-L237 HydrophobicContact CZ-CG 3.85Å; F147-W287 HydrophobicContact CB-CZ2 4.35Å; F147-W287 HydrophobicContact CD2-CZ2 4.05Å; F147-W287 HydrophobicContact CG-CZ2 4.25Å; F147-L316 HydrophobicContact CE2-CD1 4.45Å
148	S	82.2	Confident	83	Confident	30 Å²	30	32.2 Å²	32.2	21%	0.21	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	84.6	175.4	-168.9	0	0	0	0	109.6	S150 E151 E152 T153	S148-S150 PolarHBondContact O-N 3.33Å; S148-E151 WeakPolarHBondContact CB-OE2 3.34Å; S148-E151 PolarHBondContact O-N 3.3Å; S148-E151 WeakPolarHBondContact OG-CB 3.29Å; S148-E151 WeakPolarHBondContact OG-CG 3.48Å; S148-E151 PolarHBondContact OG-OE2 3.08Å; S148-E152 PolarHBondContact O-N 2.75Å; S148-T153 WeakPolarHBondContact CB-OG1 3.39Å; S148-T153 PolarHBondContact N-O 3.2Å; S148-T153 PolarHBondContact O-N 2.79Å
149	Q	79.1	Confident	82.9	Confident	38 Å²	38	36 Å²	36	18%	0.178	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.8	-174.5	-56.2	177.3	45.3	0	0	113	F147 L237 P373	F147-Q149 VanDerWaalsContact C-N 3.35Å; F147-Q149 HydrophobicContact CD1-CG 4.02Å; F147-Q149 PolarHBondContact O-N 3.27Å; Q149-L237 HydrophobicContact CB-CD1 3.89Å; Q149-L237 HydrophobicContact CG-CD1 4.16Å; Q149-P373 HydrophobicContact CB-CB 4.08Å
150	S	76.2	Confident	82.9	Confident	99 Å²	99	36 Å²	36	69%	0.692	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-17.6	174.6	46.8	0	0	0	0	114.6	S148	S148-S150 PolarHBondContact O-N 3.33Å
151	E	80.2	Confident	83.2	Confident	89 Å²	89	35.3 Å²	35.3	42%	0.416	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-0.2	-177.2	-58.4	-178.2	105.6	0	0	113	S148 T153 K200	S148-E151 WeakPolarHBondContact CB-OE2 3.34Å; S148-E151 PolarHBondContact O-N 3.3Å; S148-E151 WeakPolarHBondContact OG-CB 3.29Å; S148-E151 WeakPolarHBondContact OG-CG 3.48Å; S148-E151 PolarHBondContact OG-OE2 3.08Å; E151-T153 VanDerWaalsContact C-N 3.32Å; E151-T153 PolarHBondContact O-N 3.15Å; E151-K200 IonicContact OE1-NZ 3.98Å; E151-K200 PolarHBondContact OE1-NZ 3.17Å; E151-K200 IonicContact OE2-NZ 2.67Å; E151-K200 PolarHBondContact OE2-NZ 3.37Å
152	E	85.5	Confident	83.6	Confident	30 Å²	30	34.8 Å²	34.8	14%	0.14	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	41.6	-172.9	-56.1	-162.1	96.1	0	0	113.3	S148 T234 C235 P236 L237 R377 Y661	S148-E152 PolarHBondContact O-N 2.75Å; E152-T234 CarbonylContact O-C 3.51Å; E152-T234 WeakPolarHBondContact O-CA 3.38Å; E152-C235 CarbonylContact C-O 3.53Å; E152-C235 PolarHBondContact O-N 2.77Å; E152-P236 WeakPolarHBondContact OE1-CA 3.07Å; E152-L237 PolarHBondContact OE1-N 3.32Å; E152-R377 IonicContact OE1-CZ 3.34Å; E152-R377 IonicContact OE1-NH1 2.68Å; E152-R377 PolarHBondContact OE1-NH1 3.43Å; E152-R377 IonicContact OE1-NH2 3.67Å; E152-R377 PolarHBondContact OE1-NH2 3.3Å; E152-R377 IonicContact OE2-CZ 2.62Å; E152-R377 IonicContact OE2-NH2 3.86Å; E152-R377 PolarHBondContact OE2-NH2 3.09Å; E152-Y661 PolarHBondContact OE2-OH 3.45Å
153	T	87.2	Confident	84.4	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.3	176.6	63	0	0	0	0	114.9	S148 E151 K200 V233	S148-T153 WeakPolarHBondContact CB-OG1 3.39Å; S148-T153 PolarHBondContact N-O 3.2Å; S148-T153 PolarHBondContact O-N 2.79Å; E151-T153 VanDerWaalsContact C-N 3.32Å; E151-T153 PolarHBondContact O-N 3.15Å; T153-K200 HydrophobicContact CG2-CB 4.25Å; T153-K200 HydrophobicContact CG2-CD 3.57Å; T153-V233 VanDerWaalsContact CA-O 3.3Å; T153-V233 WeakPolarHBondContact CA-O 3.45Å
154	L	87.8	Confident	85.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.3	170.6	169.3	68.3	0	0	0	108.7	I144 F147 I156 V233 C235 C249 L316	I144-L154 HydrophobicContact CG2-CD1 3.82Å; F147-L154 HydrophobicContact CD2-CB 4.27Å; F147-L154 HydrophobicContact CD2-CD1 3.79Å; F147-L154 HydrophobicContact CE2-CB 3.95Å; F147-L154 HydrophobicContact CE2-CD1 4.1Å; F147-L154 HydrophobicContact CZ-CB 4.29Å; L154-I156 HydrophobicContact CD1-CG2 3.94Å; L154-I156 HydrophobicContact CD2-CD1 4.47Å; L154-I156 HydrophobicContact CD2-CG2 3.94Å; L154-I156 HydrophobicContact CG-CG2 3.83Å; L154-V233 HydrophobicContact CB-CG2 4.02Å; L154-V233 HydrophobicContact CD2-CG2 4.24Å; L154-V233 HydrophobicContact CG-CG2 4.34Å; L154-V233 PolarHBondContact N-O 3.32Å; L154-V233 PolarHBondContact O-N 3.05Å; L154-C235 HydrophobicContact CB-CB 4.19Å; L154-C249 HydrophobicContact CD2-CB 3.64Å; L154-L316 HydrophobicContact CD1-CD1 3.95Å; L154-L316 HydrophobicContact CD2-CD1 4.02Å
155	S	87.9	Confident	85.6	Confident	24 Å²	24	35.9 Å²	35.9	17%	0.168	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112	174.4	-59.1	0	0	0	0	109.3	L145 G146 L231 D232	L145-S155 PolarHBondContact N-O 2.94Å; G146-S155 PolarHBondContact N-O 3.48Å; G146-S155 PolarHBondContact O-N 3.01Å; S155-L231 WeakPolarHBondContact CA-O 3.49Å; S155-D232 WeakPolarHBondContact CB-OD1 3.34Å; S155-D232 PolarHBondContact OG-OD1 2.97Å
156	I	84.7	Confident	86	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.9	-179.1	46.5	179.4	0	0	0	111.9	Y139 V141 I144 L154 V230 L231 I314	Y139-I156 HydrophobicContact CE1-CD1 3.98Å; V141-I156 HydrophobicContact CG1-CG2 4.47Å; I144-I156 HydrophobicContact CG1-CG2 4.01Å; L154-I156 HydrophobicContact CD1-CG2 3.94Å; L154-I156 HydrophobicContact CD2-CD1 4.47Å; L154-I156 HydrophobicContact CD2-CG2 3.94Å; L154-I156 HydrophobicContact CG-CG2 3.83Å; I156-V230 WeakPolarHBondContact O-CA 3.43Å; I156-L231 HydrophobicContact CG1-CB 4.1Å; I156-L231 PolarHBondContact N-O 3.5Å; I156-L231 PolarHBondContact O-N 3.1Å; I156-I314 HydrophobicContact CD1-CD1 3.71Å
157	S	83.2	Confident	86.4	Confident	23 Å²	23	33.3 Å²	33.3	16%	0.161	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.6	168.5	-167.5	0	0	0	0	108.8	V142 Q143 A229	V142-S157 PolarHBondContact N-O 3.03Å; Q143-S157 PolarHBondContact N-O 3.44Å; Q143-S157 PolarHBondContact O-N 3.22Å; S157-A229 WeakPolarHBondContact CA-O 3.22Å
158	G	82.2	Confident	86.6	Confident	4 Å²	4	33.2 Å²	33.2	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	-170.7	179.6	0	0	0	0	0	112.3	N140 G228 A229	N140-G158 CarbonylContact O-C 3.58Å; N140-G158 WeakPolarHBondContact O-CA 3.35Å; G158-G228 WeakPolarHBondContact O-CA 3.39Å; G158-A229 PolarHBondContact N-O 3.29Å; G158-A229 PolarHBondContact O-N 3.37Å
159	W	85.2	Confident	87.1	Confident	82 Å²	82	31.9 Å²	31.9	31%	0.311	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145	164.6	66.9	80.5	0	0	0	111.6	Y139 N140 V142 H227 Y278	Y139-W159 WeakPolarHBondContact CA-O 3.38Å; Y139-W159 WeakPolarHBondContact CD2-O 3.49Å; N140-W159 HydrophobicContact CB-CD2 4.3Å; N140-W159 HydrophobicContact CB-CZ2 3.95Å; N140-W159 PolarHBondContact N-O 3.38Å; N140-W159 PolarHBondContact ND2-NE1 2.79Å; N140-W159 PolarHBondContact O-N 3.1Å; V142-W159 HydrophobicContact CG2-CE3 3.43Å; V142-W159 VanDerWaalsContact CG2-CE3 3.43Å; V142-W159 HydrophobicContact CG2-CH2 4.22Å; V142-W159 HydrophobicContact CG2-CZ3 3.23Å; W159-H227 CarbonylContact C-O 3.57Å; W159-H227 VanDerWaalsContact CA-O 3.3Å; W159-H227 WeakPolarHBondContact CA-O 3.37Å; W159-Y278 HydrophobicContact CH2-CD1 4.23Å; W159-Y278 HydrophobicContact CH2-CE1 4.35Å; W159-Y278 HydrophobicContact CH2-CG 4.37Å
160	F	87.6	Confident	87.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	140	167.6	-63.2	-87.2	0	0	0	109.7	I137 T138 Y139 M162 F205 F207 L226 H227 A229 L231 L251 L253	I137-F160 HydrophobicContact CD1-CD1 4.34Å; I137-F160 HydrophobicContact CG1-CD1 4.45Å; T138-F160 WeakPolarHBondContact O-CA 3.43Å; Y139-F160 AromaticContact CD2-CD1 3.55Å; Y139-F160 HydrophobicContact CD2-CD1 3.55Å; Y139-F160 AromaticContact CD2-CD2 3.89Å; Y139-F160 HydrophobicContact CD2-CD2 3.89Å; Y139-F160 AromaticContact CD2-CE1 3.39Å; Y139-F160 HydrophobicContact CD2-CE1 3.39Å; Y139-F160 AromaticContact CD2-CE2 3.77Å; Y139-F160 HydrophobicContact CD2-CE2 3.77Å; Y139-F160 AromaticContact CD2-CG 3.81Å; Y139-F160 HydrophobicContact CD2-CG 3.81Å; Y139-F160 AromaticContact CD2-CZ 3.53Å; Y139-F160 HydrophobicContact CD2-CZ 3.53Å; Y139-F160 HydrophobicContact CE2-CD1 4.5Å; Y139-F160 HydrophobicContact CE2-CD2 4.15Å; Y139-F160 HydrophobicContact CE2-CE1 4.12Å; Y139-F160 AromaticContact CE2-CE2 3.77Å; Y139-F160 HydrophobicContact CE2-CE2 3.77Å; Y139-F160 AromaticContact CE2-CZ 3.76Å; Y139-F160 HydrophobicContact CE2-CZ 3.76Å; Y139-F160 HydrophobicContact CG-CD1 4.04Å; Y139-F160 AromaticContact CG-CE1 3.76Å; Y139-F160 HydrophobicContact CG-CE1 3.76Å; Y139-F160 HydrophobicContact CG-CZ 4.2Å; F160-M162 HydrophobicContact CB-CE 4.43Å; F160-F205 AromaticContact CD2-CZ 3.95Å; F160-F205 HydrophobicContact CD2-CZ 3.95Å; F160-F205 AromaticContact CE2-CE1 3.85Å; F160-F205 HydrophobicContact CE2-CE1 3.85Å; F160-F205 AromaticContact CE2-CZ 3.48Å; F160-F205 HydrophobicContact CE2-CZ 3.48Å; F160-F205 VanDerWaalsContact CE2-CZ 3.48Å; F160-F205 HydrophobicContact CZ-CE1 4.34Å; F160-F205 HydrophobicContact CZ-CZ 4.4Å; F160-F207 HydrophobicContact CB-CE1 4.11Å; F160-F207 HydrophobicContact CB-CZ 4.12Å; F160-F207 HydrophobicContact CD1-CZ 4.02Å; F160-F207 AromaticContact CD2-CE1 3.79Å; F160-F207 HydrophobicContact CD2-CE1 3.79Å; F160-F207 AromaticContact CD2-CZ 3.45Å; F160-F207 HydrophobicContact CD2-CZ 3.45Å; F160-F207 VanDerWaalsContact CD2-CZ 3.45Å; F160-F207 HydrophobicContact CE1-CZ 4.29Å; F160-F207 HydrophobicContact CE2-CE1 4.41Å; F160-F207 AromaticContact CE2-CZ 3.74Å; F160-F207 HydrophobicContact CE2-CZ 3.74Å; F160-F207 HydrophobicContact CG-CE1 4Å; F160-F207 AromaticContact CG-CZ 3.58Å; F160-F207 HydrophobicContact CG-CZ 3.58Å; F160-F207 HydrophobicContact CZ-CZ 4.14Å; F160-L226 WeakPolarHBondContact O-CA 3.49Å; F160-H227 PolarHBondContact N-O 3.15Å; F160-H227 PolarHBondContact O-N 3.13Å; F160-A229 HydrophobicContact CD2-CB 4Å; F160-A229 HydrophobicContact CE2-CB 3.73Å; F160-L231 HydrophobicContact CE2-CD1 3.84Å; F160-L231 HydrophobicContact CE2-CD2 4.46Å; F160-L231 HydrophobicContact CZ-CD1 3.66Å; F160-L251 HydrophobicContact CE1-CD2 4.27Å; F160-L251 HydrophobicContact CZ-CD2 4.15Å; F160-L253 HydrophobicContact CD1-CD1 4.49Å; F160-L253 HydrophobicContact CE1-CD1 3.94Å; F160-L253 HydrophobicContact CE1-CD2 3.72Å; F160-L253 HydrophobicContact CE1-CG 4.42Å; F160-L253 HydrophobicContact CZ-CD2 4.03Å
161	T	89.5	Confident	88.5	Confident	15 Å²	15	28.9 Å²	28.9	9%	0.092	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.4	160.7	-43	0	0	0	0	107.5	T138 T224 W225 L226 F268	T138-T161 PolarHBondContact N-O 3.17Å; T138-T161 PolarHBondContact O-N 3.01Å; T161-T224 HydrophobicContact CG2-CG2 3.88Å; T161-W225 WeakPolarHBondContact CA-O 3.17Å; T161-L226 HydrophobicContact CG2-CD2 3.68Å; T161-L226 HydrophobicContact CG2-CG 4.49Å; T161-L226 VanDerWaalsContact OG1-CD2 3.25Å; T161-L226 WeakPolarHBondContact OG1-CD2 3.43Å; T161-F268 HydrophobicContact CG2-CZ 4.27Å; T161-F268 WeakPolarHBondContact O-CE1 3.47Å
162	M	91.2	Very high	89.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.6	171.4	-74.9	170.6	-77.2	0	0	109.7	V135 N136 I137 F160 W164 P192 V194 F207 T224 W225	V135-M162 HydrophobicContact CG1-CG 4.49Å; N136-M162 CarbonylContact O-C 3.53Å; N136-M162 WeakPolarHBondContact O-CA 3.41Å; I137-M162 HydrophobicContact CB-CG 4.23Å; I137-M162 HydrophobicContact CD1-CG 3.74Å; I137-M162 HydrophobicContact CD1-SD 3.96Å; I137-M162 HydrophobicContact CG1-CG 3.81Å; F160-M162 HydrophobicContact CB-CE 4.43Å; M162-W164 HydrophobicContact CB-CE3 4.41Å; M162-W164 HydrophobicContact CB-CZ3 4.22Å; M162-P192 HydrophobicContact SD-CG 4.16Å; M162-V194 HydrophobicContact SD-CG2 4.24Å; M162-F207 HydrophobicContact CE-CD1 3.42Å; M162-F207 VanDerWaalsContact CE-CD1 3.42Å; M162-F207 HydrophobicContact CE-CE1 3.31Å; M162-F207 HydrophobicContact CE-CG 4.18Å; M162-F207 HydrophobicContact CE-CZ 4.01Å; M162-F207 HydrophobicContact SD-CD1 4.46Å; M162-F207 HydrophobicContact SD-CE1 4.39Å; M162-T224 WeakPolarHBondContact O-CA 3.4Å; M162-W225 HydrophobicContact CE-CD2 4.09Å; M162-W225 HydrophobicContact CE-CE3 3.32Å; M162-W225 HydrophobicContact CE-CH2 4.33Å; M162-W225 HydrophobicContact CE-CZ3 3.46Å; M162-W225 VanDerWaalsContact CE-CZ3 3.46Å; M162-W225 PolarHBondContact N-O 3.01Å; M162-W225 PolarHBondContact O-N 3.4Å; M162-W225 HydrophobicContact SD-CE3 4.34Å; M162-W225 HydrophobicContact SD-CZ3 4.47Å
163	R	93.8	Very high	89.6	Confident	94 Å²	94	27.9 Å²	27.9	36%	0.355	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.8	175.5	-74.1	-177.7	170.5	151.2	-2.3	110.3	N136 V223 T224 H270	N136-R163 HydrophobicContact CB-CB 4.22Å; N136-R163 PolarHBondContact N-O 3.04Å; N136-R163 PolarHBondContact O-N 2.97Å; R163-V223 WeakPolarHBondContact CA-O 3.48Å; R163-T224 HydrophobicContact CG-CG2 4.2Å; R163-T224 WeakPolarHBondContact CG-OG1 3.39Å; R163-T224 PolarHBondContact NE-OG1 3.13Å; R163-T224 VanDerWaalsContact NE-OG1 3.09Å; R163-H270 PolarHBondContact NH1-CD2 3.06Å; R163-H270 PolarHBondContact NH1-NE2 2.76Å; R163-H270 VanDerWaalsContact NH1-NE2 3.16Å
164	W	93.7	Very high	89.8	Confident	8 Å²	8	35 Å²	35	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	172.4	170.6	68.9	94.5	0	0	0	109.6	V133 H134 V135 M162 W190 P192 V215 V223 W225	V133-W164 HydrophobicContact CG1-CB 4.28Å; H134-W164 WeakPolarHBondContact O-CB 3.47Å; V135-W164 HydrophobicContact CG2-CB 4.27Å; M162-W164 HydrophobicContact CB-CE3 4.41Å; M162-W164 HydrophobicContact CB-CZ3 4.22Å; W164-W190 HydrophobicContact CG-CZ3 4.4Å; W164-P192 HydrophobicContact CE3-CG 4.14Å; W164-P192 HydrophobicContact CZ3-CG 4.06Å; W164-V215 HydrophobicContact CH2-CG1 4.5Å; W164-V223 HydrophobicContact CD2-CB 4.03Å; W164-V223 HydrophobicContact CD2-CG1 4.37Å; W164-V223 HydrophobicContact CG-CB 4.45Å; W164-V223 HydrophobicContact CH2-CB 4.47Å; W164-V223 HydrophobicContact CH2-CG1 3.76Å; W164-V223 HydrophobicContact CZ2-CB 3.98Å; W164-V223 HydrophobicContact CZ2-CG1 3.5Å; W164-V223 HydrophobicContact CZ3-CG1 4.28Å; W164-V223 PolarHBondContact N-O 2.82Å; W164-V223 PolarHBondContact O-N 2.76Å; W164-W225 HydrophobicContact CH2-CB 4.06Å; W164-W225 HydrophobicContact CH2-CE3 4.4Å; W164-W225 HydrophobicContact CZ3-CB 3.86Å; W164-W225 HydrophobicContact CZ3-CE3 4.4Å
165	T	92.7	Very high	90	Very high	73 Å²	73	41.5 Å²	41.5	45%	0.448	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.2	175.5	-51.3	0	0	0	0	109.7	G221	T165-G221 WeakPolarHBondContact CA-O 3.46Å
166	D	92.1	Very high	90.1	Very high	2 Å²	2	41 Å²	41	1%	0.011	21%	0.205	C	C	.	.			trans	-122.8	100	170.1	-171.2	-13.4	0	0	0	110.3	P122 R168 L169 G221 V223	P122-D166 HydrophobicContact CB-CB 4.14Å; P122-D166 HydrophobicContact CG-CB 3.84Å; D166-R168 PolarHBondContact O-N 3.13Å; D166-R168 VanDerWaalsContact OD1-CB 3.29Å; D166-R168 WeakPolarHBondContact OD1-CB 3.45Å; D166-R168 WeakPolarHBondContact OD1-CG 3.42Å; D166-R168 IonicContact OD1-CZ 3.78Å; D166-R168 PolarHBondContact OD1-N 3.14Å; D166-R168 IonicContact OD1-NE 2.7Å; D166-R168 PolarHBondContact OD1-NE 3.05Å; D166-R168 IonicContact OD1-NH2 2.74Å; D166-R168 IonicContact OD2-CZ 3.5Å; D166-R168 IonicContact OD2-NE 3.35Å; D166-R168 PolarHBondContact OD2-NE 3.13Å; D166-R168 IonicContact OD2-NH2 3.49Å; D166-R168 PolarHBondContact OD2-NH2 3.4Å; D166-L169 HydrophobicContact CB-CB 4.48Å; D166-L169 HydrophobicContact CB-CD1 3.99Å; D166-L169 HydrophobicContact CB-CG 4.1Å; D166-L169 PolarHBondContact O-N 2.95Å; D166-G221 PolarHBondContact N-O 2.95Å; D166-V223 HydrophobicContact CB-CG2 4.28Å
167	P	88.7	Confident	90.4	Very high	62 Å²	62	45.5 Å²	45.5	40%	0.403	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-56.9	-19.9	-179.3	-27.3	36	0	0	0	114.8	L169 T170	P167-L169 VanDerWaalsContact C-N 3.26Å; P167-L169 PolarHBondContact O-N 3.24Å; P167-T170 WeakPolarHBondContact O-CG2 3.43Å; P167-T170 PolarHBondContact O-OG1 3.43Å
168	R	88.4	Confident	90.8	Very high	20 Å²	20	50.1 Å²	50.1	8%	0.075	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-71	-24	177.3	-57	171.9	-66.4	-174	3.2	112.4	R115 S117 L118 V120 Y125 D166	R115-R168 WeakPolarHBondContact CD-O 3.36Å; R115-R168 PolarHBondContact NH1-O 2.99Å; S117-R168 PolarHBondContact O-NH1 2.76Å; S117-R168 VanDerWaalsContact O-NH1 3.07Å; L118-R168 HydrophobicContact CD2-CB 4.07Å; L118-R168 PolarHBondContact O-NH1 3.18Å; L118-R168 PolarHBondContact O-NH2 3.17Å; V120-R168 VanDerWaalsContact O-CZ 3.27Å; V120-R168 PolarHBondContact O-NH1 3.16Å; V120-R168 PolarHBondContact O-NH2 2.8Å; Y125-R168 HydrophobicContact CD1-CG 4.02Å; Y125-R168 HydrophobicContact CD2-CG 4.37Å; Y125-R168 HydrophobicContact CG-CG 3.95Å; D166-R168 PolarHBondContact O-N 3.13Å; D166-R168 VanDerWaalsContact OD1-CB 3.29Å; D166-R168 WeakPolarHBondContact OD1-CB 3.45Å; D166-R168 WeakPolarHBondContact OD1-CG 3.42Å; D166-R168 IonicContact OD1-CZ 3.78Å; D166-R168 PolarHBondContact OD1-N 3.14Å; D166-R168 IonicContact OD1-NE 2.7Å; D166-R168 PolarHBondContact OD1-NE 3.05Å; D166-R168 IonicContact OD1-NH2 2.74Å; D166-R168 IonicContact OD2-CZ 3.5Å; D166-R168 IonicContact OD2-NE 3.35Å; D166-R168 PolarHBondContact OD2-NE 3.13Å; D166-R168 IonicContact OD2-NH2 3.49Å; D166-R168 PolarHBondContact OD2-NH2 3.4Å
169	L	91.5	Very high	91.3	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-96.5	17.8	-176.2	-56.3	179	0	0	0	113.1	L118 D166 P167 W171 L184 L189 V217 V223	L118-L169 HydrophobicContact CD1-CD2 4.07Å; L118-L169 HydrophobicContact CD2-CD2 3.83Å; D166-L169 HydrophobicContact CB-CB 4.48Å; D166-L169 HydrophobicContact CB-CD1 3.99Å; D166-L169 HydrophobicContact CB-CG 4.1Å; D166-L169 PolarHBondContact O-N 2.95Å; P167-L169 VanDerWaalsContact C-N 3.26Å; P167-L169 PolarHBondContact O-N 3.24Å; L169-W171 WeakPolarHBondContact O-CZ3 3.48Å; L169-L184 HydrophobicContact CD2-CD1 4.34Å; L169-L189 HydrophobicContact CD1-CD2 4.19Å; L169-L189 HydrophobicContact CD2-CD2 4.3Å; L169-V217 HydrophobicContact CB-CG1 3.92Å; L169-V217 HydrophobicContact CD1-CG1 4.35Å; L169-V217 HydrophobicContact CD1-CG2 4.24Å; L169-V223 HydrophobicContact CD1-CG2 3.98Å
170	T	92.6	Very high	91.7	Very high	56 Å²	56	53.5 Å²	53.5	34%	0.344	28%	0.275	S	S	.	.			trans	-78.5	147.2	175.8	49	0	0	0	0	112.5	R115 P167 N219	R115-T170 VanDerWaalsContact CZ-O 3.32Å; R115-T170 PolarHBondContact NH1-O 3.12Å; R115-T170 PolarHBondContact NH2-O 3.41Å; P167-T170 WeakPolarHBondContact O-CG2 3.43Å; P167-T170 PolarHBondContact O-OG1 3.43Å; T170-N219 WeakPolarHBondContact CA-O 3.18Å
171	W	93.6	Very high	92	Very high	17 Å²	17	59.2 Å²	59.2	6%	0.064	30%	0.301	C	S	.	.			trans	-151.4	163.8	169	70.2	92.3	0	0	0	111.5	L108 L112 L169 F176 I179 V182 V217 S218 N219	L108-W171 HydrophobicContact CD1-CB 3.88Å; L108-W171 HydrophobicContact CD1-CD2 3.74Å; L108-W171 HydrophobicContact CD1-CE3 4.21Å; L108-W171 HydrophobicContact CD1-CG 3.55Å; L108-W171 HydrophobicContact CD2-CD2 4Å; L108-W171 HydrophobicContact CD2-CG 4.35Å; L108-W171 HydrophobicContact CD2-CZ2 3.95Å; L108-W171 HydrophobicContact CG-CD2 4.44Å; L112-W171 HydrophobicContact CD1-CE3 3.95Å; L112-W171 HydrophobicContact CD1-CZ3 4.07Å; L112-W171 HydrophobicContact CD2-CE3 4.17Å; L169-W171 WeakPolarHBondContact O-CZ3 3.48Å; W171-F176 HydrophobicContact CB-CD2 4.34Å; W171-F176 HydrophobicContact CB-CE2 4.28Å; W171-F176 AromaticContact CD1-CD2 3.82Å; W171-F176 HydrophobicContact CG-CD2 4.34Å; W171-I179 HydrophobicContact CZ2-CG2 4.34Å; W171-I179 PolarHBondContact NE1-O 2.91Å; W171-V182 HydrophobicContact CH2-CB 4.22Å; W171-V182 HydrophobicContact CH2-CG1 3.57Å; W171-V182 HydrophobicContact CZ2-CG1 4.28Å; W171-V182 HydrophobicContact CZ3-CG1 3.87Å; W171-V217 WeakPolarHBondContact CH2-O 3.28Å; W171-V217 HydrophobicContact CZ3-CB 4.44Å; W171-V217 HydrophobicContact CZ3-CG1 3.99Å; W171-S218 VanDerWaalsContact CH2-C 3.49Å; W171-N219 HydrophobicContact CD2-CB 4.02Å; W171-N219 HydrophobicContact CG-CB 4.48Å; W171-N219 HydrophobicContact CH2-CB 4.25Å; W171-N219 HydrophobicContact CZ2-CB 3.73Å; W171-N219 PolarHBondContact N-O 3.41Å
172	D	94.4	Very high	92.2	Very high	80 Å²	80	58.7 Å²	58.7	43%	0.428	30%	0.298	S	S	.	.			trans	-89.5	119.7	172.5	-164.4	-29.9	0	0	0	109.6	E174 E175 F176	D172-E174 PolarHBondContact O-N 3.45Å; D172-E174 PolarHBondContact OD1-N 2.87Å; D172-E174 VanDerWaalsContact OD1-N 3.09Å; D172-E175 HydrophobicContact CB-CG 4.26Å; D172-E175 PolarHBondContact O-N 3.44Å; D172-F176 WeakPolarHBondContact O-CD2 3.46Å
173	P	93.4	Very high	92.3	Very high	18 Å²	18	60.3 Å²	60.3	12%	0.117	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-57	-30.1	177.7	-25.5	35.9	0	0	0	113.7	E175 F176 S177 E178 N219	P173-E175 VanDerWaalsContact C-N 3.28Å; P173-E175 PolarHBondContact O-N 3.16Å; P173-F176 CarbonylContact O-C 3.5Å; P173-F176 PolarHBondContact O-N 3.39Å; P173-F176 VanDerWaalsContact O-N 3.09Å; P173-S177 PolarHBondContact O-N 2.98Å; P173-E178 WeakPolarHBondContact O-CA 3.47Å; P173-E178 PolarHBondContact O-N 3.13Å; P173-N219 HydrophobicContact CG-CB 4.02Å; P173-N219 VanDerWaalsContact CG-ND2 3.35Å; P173-N219 WeakPolarHBondContact CG-ND2 3.25Å
174	E	92	Very high	92.2	Very high	154 Å²	154	55.9 Å²	55.9	72%	0.72	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-62.7	-34.8	-179.6	-64.6	-169.9	-166.4	0	0	111.6	D172 F176	D172-E174 PolarHBondContact O-N 3.45Å; D172-E174 PolarHBondContact OD1-N 2.87Å; D172-E174 VanDerWaalsContact OD1-N 3.09Å; E174-F176 VanDerWaalsContact C-N 3.3Å; E174-F176 PolarHBondContact O-N 3.02Å
175	E	90.8	Very high	91.9	Very high	136 Å²	136	57.5 Å²	57.5	64%	0.636	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-68.7	-26	176.5	-69.9	-170.8	152.2	0	0	113.1	D172 P173	D172-E175 HydrophobicContact CB-CG 4.26Å; D172-E175 PolarHBondContact O-N 3.44Å; P173-E175 VanDerWaalsContact C-N 3.28Å; P173-E175 PolarHBondContact O-N 3.16Å
176	F	91.5	Very high	91.6	Very high	14 Å²	14	54.3 Å²	54.3	6%	0.061	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-122	31.2	-168.8	-60.6	-82.1	0	0	0	113.8	L108 W171 D172 P173 E174 I179	L108-F176 HydrophobicContact CB-CB 4.5Å; L108-F176 HydrophobicContact CB-CD1 3.63Å; L108-F176 HydrophobicContact CB-CE1 4.06Å; L108-F176 HydrophobicContact CB-CG 4.06Å; L108-F176 HydrophobicContact CD1-CD1 4.13Å; L108-F176 HydrophobicContact CD1-CD2 3.9Å; L108-F176 HydrophobicContact CD1-CE1 4.23Å; L108-F176 HydrophobicContact CD1-CE2 4.03Å; L108-F176 HydrophobicContact CD1-CG 3.96Å; L108-F176 HydrophobicContact CD1-CZ 4.2Å; L108-F176 HydrophobicContact CD2-CB 4.46Å; L108-F176 HydrophobicContact CG-CD1 4.39Å; L108-F176 HydrophobicContact CG-CG 4.4Å; W171-F176 HydrophobicContact CB-CD2 4.34Å; W171-F176 HydrophobicContact CB-CE2 4.28Å; W171-F176 AromaticContact CD1-CD2 3.82Å; W171-F176 HydrophobicContact CG-CD2 4.34Å; D172-F176 WeakPolarHBondContact O-CD2 3.46Å; P173-F176 CarbonylContact O-C 3.5Å; P173-F176 PolarHBondContact O-N 3.39Å; P173-F176 VanDerWaalsContact O-N 3.09Å; E174-F176 VanDerWaalsContact C-N 3.3Å; E174-F176 PolarHBondContact O-N 3.02Å; F176-I179 VanDerWaalsContact O-CD1 3.29Å; F176-I179 WeakPolarHBondContact O-CD1 3.49Å; F176-I179 VanDerWaalsContact O-CG1 3.23Å; F176-I179 WeakPolarHBondContact O-CG1 3.33Å
177	S	89.6	Confident	91.1	Very high	95 Å²	95	58 Å²	58	66%	0.664	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	46.2	175.5	-48.2	0	0	0	0	113.9	P173 I179	P173-S177 PolarHBondContact O-N 2.98Å; S177-I179 PolarHBondContact O-N 3.06Å
178	E	91.7	Very high	90.8	Very high	120 Å²	120	58.5 Å²	58.5	56%	0.561	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	21.8	177.4	-55.5	-58.9	152.6	0	0	115.1	P173 Q180	P173-E178 WeakPolarHBondContact O-CA 3.47Å; P173-E178 PolarHBondContact O-N 3.13Å; E178-Q180 PolarHBondContact O-N 3.23Å; E178-Q180 VanDerWaalsContact O-N 3.09Å
179	I	92.5	Very high	90.7	Very high	34 Å²	34	58.2 Å²	58.2	17%	0.174	31%	0.307	C	S	.	.			trans	-68.3	109.2	173.2	-66.4	172.3	0	0	0	109	A104 E105 L108 W171 F176 S177 E181	A104-I179 HydrophobicContact CB-CD1 4Å; E105-I179 HydrophobicContact CB-CD1 3.83Å; E105-I179 HydrophobicContact CG-CD1 4.42Å; L108-I179 HydrophobicContact CD2-CB 4.34Å; L108-I179 HydrophobicContact CD2-CG2 3.75Å; W171-I179 HydrophobicContact CZ2-CG2 4.34Å; W171-I179 PolarHBondContact NE1-O 2.91Å; F176-I179 VanDerWaalsContact O-CD1 3.29Å; F176-I179 WeakPolarHBondContact O-CD1 3.49Å; F176-I179 VanDerWaalsContact O-CG1 3.23Å; F176-I179 WeakPolarHBondContact O-CG1 3.33Å; S177-I179 PolarHBondContact O-N 3.06Å; I179-E181 WeakPolarHBondContact CG2-O 3.46Å
180	Q	93.7	Very high	90.6	Very high	124 Å²	124	59.7 Å²	59.7	58%	0.579	31%	0.312	S	S	*	.			trans	-91.9	-27	178.4	-66.3	177.8	5.4	0	0	113.3	E178 S218 N219	E178-Q180 PolarHBondContact O-N 3.23Å; E178-Q180 VanDerWaalsContact O-N 3.09Å; Q180-S218 CarbonylContact O-C 3.53Å; Q180-S218 WeakPolarHBondContact O-CA 3.45Å; Q180-N219 PolarHBondContact O-N 3.32Å
181	E	94.9	Very high	90.4	Very high	119 Å²	119	58.5 Å²	58.5	56%	0.556	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.3	177.4	-58.2	-160.8	144	0	0	111.2	I179 T216 V217 S218	I179-E181 WeakPolarHBondContact CG2-O 3.46Å; E181-T216 HydrophobicContact CB-CG2 4.02Å; E181-T216 HydrophobicContact CG-CG2 4.4Å; E181-T216 WeakPolarHBondContact OE2-CG2 3.2Å; E181-V217 CarbonylContact C-O 3.52Å; E181-V217 VanDerWaalsContact CA-O 3.26Å; E181-V217 WeakPolarHBondContact CA-O 3.33Å; E181-S218 PolarHBondContact OE1-OG 3.44Å
182	V	94.1	Very high	90.3	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.1	179.1	71.4	0	0	0	0	110.8	E105 L108 V109 L112 W171 L184 V217	E105-V182 HydrophobicContact CG-CG2 3.87Å; L108-V182 HydrophobicContact CD2-CB 4.14Å; L108-V182 HydrophobicContact CD2-CG1 4.32Å; L108-V182 HydrophobicContact CD2-CG2 4.32Å; V109-V182 HydrophobicContact CG2-CG2 3.48Å; V109-V182 VanDerWaalsContact CG2-CG2 3.48Å; L112-V182 HydrophobicContact CD1-CG1 3.88Å; W171-V182 HydrophobicContact CH2-CB 4.22Å; W171-V182 HydrophobicContact CH2-CG1 3.57Å; W171-V182 HydrophobicContact CZ2-CG1 4.28Å; W171-V182 HydrophobicContact CZ3-CG1 3.87Å; V182-L184 HydrophobicContact CG1-CD2 4.2Å; V182-L184 HydrophobicContact CG1-CG 4.27Å; V182-L184 HydrophobicContact CG2-CD2 4.36Å; V182-V217 HydrophobicContact CG1-CB 4.27Å; V182-V217 PolarHBondContact N-O 2.85Å; V182-V217 PolarHBondContact O-N 2.8Å
183	S	92.4	Very high	89.9	Confident	35 Å²	35	54.8 Å²	54.8	25%	0.245	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	104.2	-175.7	-172	0	0	0	0	112.2	R214 V215	S183-R214 PolarHBondContact O-NE 3.36Å; S183-R214 PolarHBondContact O-NH2 2.92Å; S183-R214 WeakPolarHBondContact OG-CB 3.42Å; S183-R214 PolarHBondContact OG-NE 2.81Å; S183-V215 CarbonylContact C-O 3.56Å; S183-V215 VanDerWaalsContact CA-O 3.31Å; S183-V215 WeakPolarHBondContact CA-O 3.42Å
184	L	91.3	Very high	89.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	149.6	-176.5	-59.7	-172.3	0	0	0	112.6	V109 L112 L169 V182 L189 R214 V215 V217	V109-L184 HydrophobicContact CB-CD2 4.37Å; V109-L184 HydrophobicContact CG1-CD2 4.06Å; V109-L184 HydrophobicContact CG2-CD2 3.92Å; L112-L184 HydrophobicContact CD1-CD1 4.35Å; L169-L184 HydrophobicContact CD2-CD1 4.34Å; V182-L184 HydrophobicContact CG1-CD2 4.2Å; V182-L184 HydrophobicContact CG1-CG 4.27Å; V182-L184 HydrophobicContact CG2-CD2 4.36Å; L184-L189 HydrophobicContact CB-CD1 3.89Å; L184-L189 HydrophobicContact CD1-CD1 4.26Å; L184-L189 HydrophobicContact CD1-CD2 4.43Å; L184-R214 CarbonylContact O-C 3.51Å; L184-R214 WeakPolarHBondContact O-CA 3.43Å; L184-R214 WeakPolarHBondContact O-CB 3.37Å; L184-V215 HydrophobicContact CB-CG2 4.11Å; L184-V215 PolarHBondContact N-O 3.44Å; L184-V215 PolarHBondContact O-N 2.85Å; L184-V217 HydrophobicContact CB-CG2 4.46Å; L184-V217 HydrophobicContact CD1-CG2 3.85Å; L184-V217 HydrophobicContact CG-CG2 4.04Å
185	P	88.7	Confident	89.3	Confident	43 Å²	43	46.7 Å²	46.7	28%	0.279	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	143.5	174.2	30.6	-34.9	0	0	0	111.7	T187	P185-T187 VanDerWaalsContact C-N 3.3Å; P185-T187 PolarHBondContact O-N 3.41Å
186	T	85.9	Confident	89.1	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.031	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-64.4	-30.5	178.6	47	0	0	0	0	113.9	N188 L189 I191 V211 G213 V215	T186-N188 VanDerWaalsContact C-N 3.26Å; T186-N188 PolarHBondContact O-N 2.82Å; T186-N188 VanDerWaalsContact O-N 3.15Å; T186-L189 PolarHBondContact O-N 2.96Å; T186-I191 HydrophobicContact CG2-CD1 4.11Å; T186-V211 PolarHBondContact OG1-O 2.93Å; T186-G213 PolarHBondContact N-O 3.06Å; T186-G213 VanDerWaalsContact N-O 3.08Å; T186-G213 PolarHBondContact OG1-N 3.23Å; T186-G213 VanDerWaalsContact OG1-N 3.12Å; T186-G213 PolarHBondContact OG1-O 2.95Å; T186-G213 VanDerWaalsContact OG1-O 3.1Å; T186-V215 HydrophobicContact CG2-CG1 3.97Å
187	T	82.5	Confident	88.9	Confident	80 Å²	80	45.3 Å²	45.3	49%	0.491	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-58.4	-30.9	-169.8	49.1	0	0	0	0	115.1	P185	P185-T187 VanDerWaalsContact C-N 3.3Å; P185-T187 PolarHBondContact O-N 3.41Å
188	N	80.8	Confident	88.9	Confident	73 Å²	73	41.9 Å²	41.9	39%	0.39	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-100.7	-0.9	-173.9	-65.5	-10.2	0	0	0	113.3	L113 L118 T186	L113-N188 HydrophobicContact CD2-CB 4.03Å; L118-N188 WeakPolarHBondContact CB-O 3.38Å; T186-N188 VanDerWaalsContact C-N 3.26Å; T186-N188 PolarHBondContact O-N 2.82Å; T186-N188 VanDerWaalsContact O-N 3.15Å
189	L	87.8	Confident	88.6	Confident	14 Å²	14	37.6 Å²	37.6	7%	0.073	21%	0.205	C	C	.	.	S	Bend	trans	-111.2	154.3	-171.2	-60.8	180	0	0	0	112	L113 L118 L169 L184 T186 V215	L113-L189 HydrophobicContact CD2-CD2 4.44Å; L118-L189 HydrophobicContact CB-CD2 4.13Å; L118-L189 HydrophobicContact CD1-CD2 3.75Å; L118-L189 HydrophobicContact CG-CD2 4.48Å; L169-L189 HydrophobicContact CD1-CD2 4.19Å; L169-L189 HydrophobicContact CD2-CD2 4.3Å; L184-L189 HydrophobicContact CB-CD1 3.89Å; L184-L189 HydrophobicContact CD1-CD1 4.26Å; L184-L189 HydrophobicContact CD1-CD2 4.43Å; T186-L189 PolarHBondContact O-N 2.96Å; L189-V215 HydrophobicContact CD1-CG2 3.5Å
190	W	89	Confident	87.8	Confident	32 Å²	32	40.7 Å²	40.7	12%	0.121	22%	0.217	C	C	.	.			trans	-70.4	131.3	163.6	178.9	83.1	0	0	0	110	L118 R121 P122 V133 W164 P192 L263	L118-W190 VanDerWaalsContact O-CB 3.26Å; L118-W190 WeakPolarHBondContact O-CB 3.42Å; L118-W190 PolarHBondContact O-N 3.21Å; R121-W190 HydrophobicContact CB-CD2 4.34Å; R121-W190 HydrophobicContact CB-CG 4.49Å; R121-W190 HydrophobicContact CB-CZ2 4.33Å; P122-W190 VanDerWaalsContact CD-CE3 3.46Å; P122-W190 HydrophobicContact CG-CE3 4.07Å; P122-W190 HydrophobicContact CG-CZ3 4.5Å; V133-W190 HydrophobicContact CB-CH2 4Å; V133-W190 HydrophobicContact CB-CZ3 4.41Å; V133-W190 HydrophobicContact CG1-CH2 3.81Å; V133-W190 HydrophobicContact CG1-CZ3 3.77Å; V133-W190 HydrophobicContact CG2-CH2 4.21Å; W164-W190 HydrophobicContact CG-CZ3 4.4Å; W190-P192 HydrophobicContact CH2-CB 3.89Å; W190-P192 HydrophobicContact CZ2-CB 4.48Å; W190-P192 HydrophobicContact CZ3-CB 4.3Å; W190-L263 HydrophobicContact CH2-CD1 4.04Å; W190-L263 HydrophobicContact CZ2-CD1 4.13Å
191	I	88.9	Confident	86.4	Confident	31 Å²	31	37.6 Å²	37.6	16%	0.159	21%	0.213	C	C	.	.			trans	-120.8	138.8	178.9	-57.4	173.5	0	0	0	107.2	T186 D193 W225	T186-I191 HydrophobicContact CG2-CD1 4.11Å; I191-D193 PolarHBondContact O-N 2.95Å; I191-W225 HydrophobicContact CG2-CE3 3.89Å; I191-W225 HydrophobicContact CG2-CH2 3.97Å; I191-W225 HydrophobicContact CG2-CZ3 3.32Å
192	P	89.8	Confident	84.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.226	C	C	.	.			trans	-62.8	131.2	175	26.8	-35.8	0	0	0	111.6	V135 M162 W164 W190 V194 L263	V135-P192 HydrophobicContact CG1-CB 4.22Å; V135-P192 HydrophobicContact CG1-CG 4.14Å; V135-P192 HydrophobicContact CG2-CB 3.94Å; V135-P192 HydrophobicContact CG2-CG 4.47Å; M162-P192 HydrophobicContact SD-CG 4.16Å; W164-P192 HydrophobicContact CE3-CG 4.14Å; W164-P192 HydrophobicContact CZ3-CG 4.06Å; W190-P192 HydrophobicContact CH2-CB 3.89Å; W190-P192 HydrophobicContact CZ2-CB 4.48Å; W190-P192 HydrophobicContact CZ3-CB 4.3Å; P192-V194 HydrophobicContact CB-CG2 4.15Å; P192-V194 PolarHBondContact O-N 2.93Å; P192-L263 HydrophobicContact CB-CD1 3.69Å
193	D	85.9	Confident	81.9	Confident	19 Å²	19	42.5 Å²	42.5	10%	0.102	26%	0.256	C	S	.	.			trans	-75.9	52.8	-176.1	63.2	-66	0	0	0	112.9	I191 P255 W256 Q257 S258 L263	I191-D193 PolarHBondContact O-N 2.95Å; D193-P255 CarbonylContact O-C 3.51Å; D193-P255 WeakPolarHBondContact O-CA 3.5Å; D193-W256 WeakPolarHBondContact O-CB 3.14Å; D193-W256 PolarHBondContact O-N 2.95Å; D193-W256 PolarHBondContact OD2-N 3.08Å; D193-W256 VanDerWaalsContact OD2-N 3.16Å; D193-Q257 WeakPolarHBondContact OD2-CA 3.5Å; D193-Q257 PolarHBondContact OD2-N 3.47Å; D193-S258 VanDerWaalsContact OD1-CB 3.26Å; D193-S258 WeakPolarHBondContact OD1-CB 3.39Å; D193-S258 PolarHBondContact OD1-OG 2.91Å; D193-S258 PolarHBondContact OD2-N 3.48Å; D193-S258 PolarHBondContact OD2-OG 3.48Å; D193-L263 WeakPolarHBondContact OD1-CD1 3.46Å
194	V	87.3	Confident	79.9	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	149.4	178.4	-169.7	0	0	0	0	110	I137 M162 P192 F207 L253 V254 L265	I137-V194 HydrophobicContact CD1-CG1 4.23Å; M162-V194 HydrophobicContact SD-CG2 4.24Å; P192-V194 HydrophobicContact CB-CG2 4.15Å; P192-V194 PolarHBondContact O-N 2.93Å; V194-F207 HydrophobicContact CB-CD2 3.57Å; V194-F207 HydrophobicContact CB-CE2 3.93Å; V194-F207 HydrophobicContact CB-CG 4.36Å; V194-F207 HydrophobicContact CG1-CD2 3.93Å; V194-F207 HydrophobicContact CG1-CE2 3.77Å; V194-F207 WeakPolarHBondContact O-CD2 3.39Å; V194-F207 PolarHBondContact O-N 2.95Å; V194-L253 HydrophobicContact CG1-CB 4.28Å; V194-L253 HydrophobicContact CG1-CD2 4.3Å; V194-V254 CarbonylContact C-O 3.52Å; V194-V254 WeakPolarHBondContact CA-O 3.46Å; V194-L265 HydrophobicContact CG2-CD2 3.93Å
195	G	85.8	Confident	78.2	Confident	2 Å²	2	48.9 Å²	48.9	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	160.4	171.1	0	0	0	0	0	112.2	V254	G195-V254 PolarHBondContact N-O 3.33Å; G195-V254 PolarHBondContact O-N 3.09Å
196	V	87.8	Confident	76.4	Confident	19 Å²	19	48.7 Å²	48.7	12%	0.115	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	106.5	178.1	175.3	0	0	0	0	109.9	N198 G199 F205 L231 V233 L251 L253	V196-N198 VanDerWaalsContact C-N 3.32Å; V196-N198 PolarHBondContact O-N 3.27Å; V196-G199 PolarHBondContact O-N 2.9Å; V196-F205 HydrophobicContact CB-CD1 4.21Å; V196-F205 HydrophobicContact CG2-CD1 3.55Å; V196-F205 HydrophobicContact CG2-CE1 3.64Å; V196-L231 HydrophobicContact CG2-CD2 4.27Å; V196-V233 HydrophobicContact CG1-CG1 4.12Å; V196-L251 HydrophobicContact CB-CD1 4.41Å; V196-L251 HydrophobicContact CG1-CD1 3.59Å; V196-L251 HydrophobicContact CG2-CD1 3.88Å; V196-L253 HydrophobicContact CG2-CD2 3.82Å
197	M	87.2	Confident	75.1	Confident	103 Å²	103	48.6 Å²	48.6	51%	0.507	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.5	-170.3	-165.3	-173.1	78.1	0	0	113.8	I252 V254	M197-I252 HydrophobicContact CB-CB 4.24Å; M197-I252 HydrophobicContact CB-CG2 4Å; M197-I252 HydrophobicContact CE-CB 4.44Å; M197-I252 HydrophobicContact CE-CD1 3.9Å; M197-I252 HydrophobicContact CE-CG2 3.89Å; M197-I252 PolarHBondContact N-O 2.9Å; M197-I252 HydrophobicContact SD-CG2 4.28Å; M197-V254 HydrophobicContact CB-CG1 3.99Å; M197-V254 HydrophobicContact CB-CG2 4.05Å; M197-V254 HydrophobicContact CG-CG1 4.28Å; M197-V254 HydrophobicContact SD-CG1 3.92Å
198	N	89.1	Confident	73.4	Confident	23 Å²	23	48 Å²	48	12%	0.123	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	22.5	-178.2	69.6	-56.4	0	0	0	114.1	V196 T234 F250 I252	V196-N198 VanDerWaalsContact C-N 3.32Å; V196-N198 PolarHBondContact O-N 3.27Å; N198-T234 PolarHBondContact ND2-O 2.97Å; N198-T234 PolarHBondContact O-N 2.93Å; N198-T234 PolarHBondContact O-OG1 2.91Å; N198-F250 PolarHBondContact ND2-O 2.92Å; N198-I252 PolarHBondContact OD1-N 3.35Å
199	G	84.9	Confident	71.8	Confident	30 Å²	30	46.7 Å²	46.7	31%	0.309	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-70.9	138.8	172.1	0	0	0	0	0	112.2	V196 D232	V196-G199 PolarHBondContact O-N 2.9Å; G199-D232 CarbonylContact C-O 3.5Å; G199-D232 WeakPolarHBondContact CA-O 3.4Å
200	K	75.6	Confident	70.1	Confident	98 Å²	98	49.8 Å²	49.8	43%	0.426	32%	0.315	S	S	.	.	S	Bend	trans	-78	-39	175.1	175	174.8	168.5	-168.1	0	112	E151 T153 D232	E151-K200 IonicContact OE1-NZ 3.98Å; E151-K200 PolarHBondContact OE1-NZ 3.17Å; E151-K200 IonicContact OE2-NZ 2.67Å; E151-K200 PolarHBondContact OE2-NZ 3.37Å; T153-K200 HydrophobicContact CG2-CB 4.25Å; T153-K200 HydrophobicContact CG2-CD 3.57Å; K200-D232 HydrophobicContact CB-CB 4.28Å; K200-D232 PolarHBondContact N-O 3.42Å
201	A	63.8	Low	68.5	Low	60 Å²	60	50.4 Å²	50.4	50%	0.496	32%	0.322	S	S	.	.			trans	-83.8	116	172.6	0	0	0	0	0	109.9
202	S	52.3	Low	67.1	Low	118 Å²	118	58.5 Å²	58.5	83%	0.825	35%	0.35	S	S	*	.			trans	-103.9	19.6	-172.4	56.2	0	0	0	0	114.3
203	T	43.5	Very low	66.4	Low	107 Å²	107	59.4 Å²	59.4	66%	0.656	36%	0.36	S	S	*	.	S	Bend	trans	-114.6	-33.2	-165.5	50.4	0	0	0	0	115.5
204	D	50.5	Low	66.5	Low	129 Å²	129	65.8 Å²	65.8	69%	0.69	38%	0.382	S	S	*	.	S	Bend	trans	-133.2	8.7	-166.8	-57.2	-88.6	0	0	0	114.4
205	F	54.1	Low	66.7	Low	41 Å²	41	65.9 Å²	65.9	18%	0.18	38%	0.383	C	S	.	.			trans	-123	51	178.5	-148.4	-92.4	0	0	0	114.2	F160 V196 F207 H227 A229 L231	F160-F205 AromaticContact CD2-CZ 3.95Å; F160-F205 HydrophobicContact CD2-CZ 3.95Å; F160-F205 AromaticContact CE2-CE1 3.85Å; F160-F205 HydrophobicContact CE2-CE1 3.85Å; F160-F205 AromaticContact CE2-CZ 3.48Å; F160-F205 HydrophobicContact CE2-CZ 3.48Å; F160-F205 VanDerWaalsContact CE2-CZ 3.48Å; F160-F205 HydrophobicContact CZ-CE1 4.34Å; F160-F205 HydrophobicContact CZ-CZ 4.4Å; V196-F205 HydrophobicContact CB-CD1 4.21Å; V196-F205 HydrophobicContact CG2-CD1 3.55Å; V196-F205 HydrophobicContact CG2-CE1 3.64Å; F205-F207 HydrophobicContact CD1-CE2 4.47Å; F205-F207 HydrophobicContact CE1-CD2 4.03Å; F205-F207 HydrophobicContact CE1-CE1 4.2Å; F205-F207 AromaticContact CE1-CE2 3.48Å; F205-F207 HydrophobicContact CE1-CE2 3.48Å; F205-F207 VanDerWaalsContact CE1-CE2 3.48Å; F205-F207 AromaticContact CE1-CZ 3.6Å; F205-F207 HydrophobicContact CE1-CZ 3.6Å; F205-F207 HydrophobicContact CZ-CD1 4.36Å; F205-F207 HydrophobicContact CZ-CD2 4.48Å; F205-F207 AromaticContact CZ-CE1 3.78Å; F205-F207 HydrophobicContact CZ-CE1 3.78Å; F205-F207 AromaticContact CZ-CE2 3.95Å; F205-F207 HydrophobicContact CZ-CE2 3.95Å; F205-F207 AromaticContact CZ-CZ 3.58Å; F205-F207 HydrophobicContact CZ-CZ 3.58Å; F205-H227 AromaticContact CE2-CD2 3.65Å; F205-H227 AromaticContact CE2-NE2 3.33Å; F205-H227 VanDerWaalsContact CE2-NE2 3.33Å; F205-H227 WeakPolarHBondContact CE2-NE2 3.49Å; F205-H227 AromaticContact CZ-CD2 3.75Å; F205-H227 AromaticContact CZ-NE2 3.91Å; F205-A229 HydrophobicContact CD2-CB 4.39Å; F205-A229 HydrophobicContact CE2-CB 3.38Å; F205-A229 HydrophobicContact CZ-CB 3.63Å; F205-L231 HydrophobicContact CD1-CD2 3.64Å; F205-L231 HydrophobicContact CD2-CD2 3.85Å; F205-L231 HydrophobicContact CE1-CD2 3.66Å; F205-L231 HydrophobicContact CE2-CD2 3.87Å; F205-L231 HydrophobicContact CG-CD2 3.75Å; F205-L231 HydrophobicContact CZ-CD2 3.79Å
206	D	52.7	Low	67.1	Low	39 Å²	39	68 Å²	68	21%	0.209	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-100.6	124.6	153.7	175.9	-24.2	0	0	0	106	S208 A209	D206-S208 VanDerWaalsContact CG-OG 3.28Å; D206-S208 PolarHBondContact O-N 3.16Å; D206-S208 VanDerWaalsContact O-N 3.09Å; D206-S208 WeakPolarHBondContact OD1-CA 3.47Å; D206-S208 WeakPolarHBondContact OD1-CB 3.25Å; D206-S208 PolarHBondContact OD1-N 3.5Å; D206-S208 PolarHBondContact OD1-OG 3.34Å; D206-S208 PolarHBondContact OD2-OG 3.07Å; D206-A209 HydrophobicContact CB-CB 3.81Å; D206-A209 PolarHBondContact O-N 3.37Å
207	F	57	Low	67.4	Low	2 Å²	2	67.1 Å²	67.1	1%	0.009	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-16.9	-176.9	-76.1	-88.1	0	0	0	112.5	F160 M162 V194 F205 W225 H227	F160-F207 HydrophobicContact CB-CE1 4.11Å; F160-F207 HydrophobicContact CB-CZ 4.12Å; F160-F207 HydrophobicContact CD1-CZ 4.02Å; F160-F207 AromaticContact CD2-CE1 3.79Å; F160-F207 HydrophobicContact CD2-CE1 3.79Å; F160-F207 AromaticContact CD2-CZ 3.45Å; F160-F207 HydrophobicContact CD2-CZ 3.45Å; F160-F207 VanDerWaalsContact CD2-CZ 3.45Å; F160-F207 HydrophobicContact CE1-CZ 4.29Å; F160-F207 HydrophobicContact CE2-CE1 4.41Å; F160-F207 AromaticContact CE2-CZ 3.74Å; F160-F207 HydrophobicContact CE2-CZ 3.74Å; F160-F207 HydrophobicContact CG-CE1 4Å; F160-F207 AromaticContact CG-CZ 3.58Å; F160-F207 HydrophobicContact CG-CZ 3.58Å; F160-F207 HydrophobicContact CZ-CZ 4.14Å; M162-F207 HydrophobicContact CE-CD1 3.42Å; M162-F207 VanDerWaalsContact CE-CD1 3.42Å; M162-F207 HydrophobicContact CE-CE1 3.31Å; M162-F207 HydrophobicContact CE-CG 4.18Å; M162-F207 HydrophobicContact CE-CZ 4.01Å; M162-F207 HydrophobicContact SD-CD1 4.46Å; M162-F207 HydrophobicContact SD-CE1 4.39Å; V194-F207 HydrophobicContact CB-CD2 3.57Å; V194-F207 HydrophobicContact CB-CE2 3.93Å; V194-F207 HydrophobicContact CB-CG 4.36Å; V194-F207 HydrophobicContact CG1-CD2 3.93Å; V194-F207 HydrophobicContact CG1-CE2 3.77Å; V194-F207 WeakPolarHBondContact O-CD2 3.39Å; V194-F207 PolarHBondContact O-N 2.95Å; F205-F207 HydrophobicContact CD1-CE2 4.47Å; F205-F207 HydrophobicContact CE1-CD2 4.03Å; F205-F207 HydrophobicContact CE1-CE1 4.2Å; F205-F207 AromaticContact CE1-CE2 3.48Å; F205-F207 HydrophobicContact CE1-CE2 3.48Å; F205-F207 VanDerWaalsContact CE1-CE2 3.48Å; F205-F207 AromaticContact CE1-CZ 3.6Å; F205-F207 HydrophobicContact CE1-CZ 3.6Å; F205-F207 HydrophobicContact CZ-CD1 4.36Å; F205-F207 HydrophobicContact CZ-CD2 4.48Å; F205-F207 AromaticContact CZ-CE1 3.78Å; F205-F207 HydrophobicContact CZ-CE1 3.78Å; F205-F207 AromaticContact CZ-CE2 3.95Å; F205-F207 HydrophobicContact CZ-CE2 3.95Å; F205-F207 AromaticContact CZ-CZ 3.58Å; F205-F207 HydrophobicContact CZ-CZ 3.58Å; F207-W225 HydrophobicContact CB-CH2 3.87Å; F207-W225 HydrophobicContact CB-CZ3 3.89Å; F207-W225 AromaticContact CD1-CH2 3.68Å; F207-W225 HydrophobicContact CD1-CH2 3.68Å; F207-W225 AromaticContact CD1-CZ3 3.79Å; F207-W225 HydrophobicContact CD1-CZ3 3.79Å; F207-W225 HydrophobicContact CG-CH2 4.26Å; F207-W225 HydrophobicContact CG-CZ3 4.26Å; F207-W225 VanDerWaalsContact O-CH2 3.28Å; F207-W225 WeakPolarHBondContact O-CH2 3.35Å; F207-H227 HydrophobicContact CD1-CB 4.38Å; F207-H227 AromaticContact CD1-CD2 3.7Å; F207-H227 HydrophobicContact CE1-CB 4.08Å; F207-H227 AromaticContact CE1-CD2 3.48Å; F207-H227 VanDerWaalsContact CE1-CD2 3.48Å; F207-H227 WeakPolarHBondContact CE1-CD2 3.35Å
208	S	47.4	Very low	67.9	Low	68 Å²	68	63 Å²	63	48%	0.476	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-10.4	172.8	73.5	0	0	0	0	114.4	D206	D206-S208 VanDerWaalsContact CG-OG 3.28Å; D206-S208 PolarHBondContact O-N 3.16Å; D206-S208 VanDerWaalsContact O-N 3.09Å; D206-S208 WeakPolarHBondContact OD1-CA 3.47Å; D206-S208 WeakPolarHBondContact OD1-CB 3.25Å; D206-S208 PolarHBondContact OD1-N 3.5Å; D206-S208 PolarHBondContact OD1-OG 3.34Å; D206-S208 PolarHBondContact OD2-OG 3.07Å
209	A	47.5	Very low	68.1	Low	46 Å²	46	64.5 Å²	64.5	38%	0.38	38%	0.38	S	S	.	.	S	Bend	trans	-96.5	103.7	-173.5	0	0	0	0	0	113.2	D206 V211	D206-A209 HydrophobicContact CB-CB 3.81Å; D206-A209 PolarHBondContact O-N 3.37Å; A209-V211 VanDerWaalsContact C-N 3.28Å; A209-V211 PolarHBondContact O-N 3.42Å
210	G	51.4	Low	68.6	Low	78 Å²	78	67.5 Å²	67.5	80%	0.804	39%	0.388	S	S	*	.	S	Bend	trans	76.8	-8.5	158.5	0	0	0	0	0	117.8	R212	G210-R212 PolarHBondContact O-N 3.27Å; G210-R212 VanDerWaalsContact O-N 3.09Å
211	V	55.9	Low	69.4	Low	45 Å²	45	62.8 Å²	62.8	27%	0.273	37%	0.368	S	S	.	.			trans	-70.3	105.7	-179.5	-175.3	0	0	0	0	111.4	T186 A209 G213 W225	T186-V211 PolarHBondContact OG1-O 2.93Å; A209-V211 VanDerWaalsContact C-N 3.28Å; A209-V211 PolarHBondContact O-N 3.42Å; V211-G213 PolarHBondContact O-N 3.21Å; V211-W225 HydrophobicContact CG1-CZ2 4.33Å
212	R	59.4	Low	70.8	Confident	201 Å²	201	61.3 Å²	61.3	76%	0.758	35%	0.354	S	S	*	.			trans	-72.2	62.3	168.3	-69.4	-179.6	173	148.7	-5.9	111.5	G210	G210-R212 PolarHBondContact O-N 3.27Å; G210-R212 VanDerWaalsContact O-N 3.09Å
213	G	75.8	Confident	72.9	Confident	19 Å²	19	55.7 Å²	55.7	20%	0.196	32%	0.315	C	S	.	.			trans	-83.9	171.6	176.1	0	0	0	0	0	112.9	T186 V211	T186-G213 PolarHBondContact N-O 3.06Å; T186-G213 VanDerWaalsContact N-O 3.08Å; T186-G213 PolarHBondContact OG1-N 3.23Å; T186-G213 VanDerWaalsContact OG1-N 3.12Å; T186-G213 PolarHBondContact OG1-O 2.95Å; T186-G213 VanDerWaalsContact OG1-O 3.1Å; V211-G213 PolarHBondContact O-N 3.21Å
214	R	86.7	Confident	75.2	Confident	153 Å²	153	51.7 Å²	51.7	58%	0.577	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.8	155.9	-63.2	177.8	77.4	154.8	1.4	108.4	S183 L184	S183-R214 PolarHBondContact O-NE 3.36Å; S183-R214 PolarHBondContact O-NH2 2.92Å; S183-R214 WeakPolarHBondContact OG-CB 3.42Å; S183-R214 PolarHBondContact OG-NE 2.81Å; L184-R214 CarbonylContact O-C 3.51Å; L184-R214 WeakPolarHBondContact O-CA 3.43Å; L184-R214 WeakPolarHBondContact O-CB 3.37Å
215	V	91.9	Very high	77.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.2	168.4	-57.3	0	0	0	0	108.6	W164 S183 L184 T186 L189 V217 V223 W225	W164-V215 HydrophobicContact CH2-CG1 4.5Å; S183-V215 CarbonylContact C-O 3.56Å; S183-V215 VanDerWaalsContact CA-O 3.31Å; S183-V215 WeakPolarHBondContact CA-O 3.42Å; L184-V215 HydrophobicContact CB-CG2 4.11Å; L184-V215 PolarHBondContact N-O 3.44Å; L184-V215 PolarHBondContact O-N 2.85Å; T186-V215 HydrophobicContact CG2-CG1 3.97Å; L189-V215 HydrophobicContact CD1-CG2 3.5Å; V215-V217 HydrophobicContact CG2-CG2 3.91Å; V215-V223 HydrophobicContact CB-CG1 3.8Å; V215-V223 HydrophobicContact CG1-CG1 4.25Å; V215-V223 HydrophobicContact CG2-CG1 3.84Å; V215-W225 HydrophobicContact CG1-CB 3.85Å; V215-W225 HydrophobicContact CG1-CG 3.8Å
216	T	94	Very high	78.8	Confident	48 Å²	48	48.8 Å²	48.8	29%	0.294	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127	164.4	-58.3	0	0	0	0	107.5	E181 T224	E181-T216 HydrophobicContact CB-CG2 4.02Å; E181-T216 HydrophobicContact CG-CG2 4.4Å; E181-T216 WeakPolarHBondContact OE2-CG2 3.2Å; T216-T224 PolarHBondContact N-O 3.45Å; T216-T224 PolarHBondContact O-N 3.12Å
217	V	95.2	Very high	80.3	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.4	171.3	-170.7	0	0	0	0	107.5	L169 W171 E181 V182 L184 V215 S222 V223	L169-V217 HydrophobicContact CB-CG1 3.92Å; L169-V217 HydrophobicContact CD1-CG1 4.35Å; L169-V217 HydrophobicContact CD1-CG2 4.24Å; W171-V217 WeakPolarHBondContact CH2-O 3.28Å; W171-V217 HydrophobicContact CZ3-CB 4.44Å; W171-V217 HydrophobicContact CZ3-CG1 3.99Å; E181-V217 CarbonylContact C-O 3.52Å; E181-V217 VanDerWaalsContact CA-O 3.26Å; E181-V217 WeakPolarHBondContact CA-O 3.33Å; V182-V217 HydrophobicContact CG1-CB 4.27Å; V182-V217 PolarHBondContact N-O 2.85Å; V182-V217 PolarHBondContact O-N 2.8Å; L184-V217 HydrophobicContact CB-CG2 4.46Å; L184-V217 HydrophobicContact CD1-CG2 3.85Å; L184-V217 HydrophobicContact CG-CG2 4.04Å; V215-V217 HydrophobicContact CG2-CG2 3.91Å; V217-S222 WeakPolarHBondContact CA-O 3.4Å; V217-V223 HydrophobicContact CG1-CG2 4.27Å; V217-V223 HydrophobicContact CG2-CG1 4.33Å; V217-V223 HydrophobicContact CG2-CG2 4.21Å
218	S	96.2	Very high	81.6	Confident	15 Å²	15	50.6 Å²	50.6	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	157.8	172.6	-44.3	0	0	0	0	109.7	W171 Q180 E181 D220 G221 S222	W171-S218 VanDerWaalsContact CH2-C 3.49Å; Q180-S218 CarbonylContact O-C 3.53Å; Q180-S218 WeakPolarHBondContact O-CA 3.45Å; E181-S218 PolarHBondContact OE1-OG 3.44Å; S218-D220 PolarHBondContact O-N 3.3Å; S218-D220 VanDerWaalsContact O-N 3.09Å; S218-G221 WeakPolarHBondContact O-CA 3.38Å; S218-G221 PolarHBondContact O-N 3.09Å; S218-S222 PolarHBondContact N-O 3.14Å
219	N	95.2	Very high	83.1	Confident	56 Å²	56	47.6 Å²	47.6	30%	0.299	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.7	-170	73.2	-56.9	0	0	0	114.9	T170 W171 P173 Q180 G221	T170-N219 WeakPolarHBondContact CA-O 3.18Å; W171-N219 HydrophobicContact CD2-CB 4.02Å; W171-N219 HydrophobicContact CG-CB 4.48Å; W171-N219 HydrophobicContact CH2-CB 4.25Å; W171-N219 HydrophobicContact CZ2-CB 3.73Å; W171-N219 PolarHBondContact N-O 3.41Å; P173-N219 HydrophobicContact CG-CB 4.02Å; P173-N219 VanDerWaalsContact CG-ND2 3.35Å; P173-N219 WeakPolarHBondContact CG-ND2 3.25Å; Q180-N219 PolarHBondContact O-N 3.32Å; N219-G221 PolarHBondContact O-N 3.38Å
220	D	94	Very high	84.9	Confident	92 Å²	92	49.6 Å²	49.6	49%	0.492	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-1.5	171.8	78.2	-34.2	0	0	0	113.9	S218 S222	S218-D220 PolarHBondContact O-N 3.3Å; S218-D220 VanDerWaalsContact O-N 3.09Å; D220-S222 VanDerWaalsContact C-N 3.29Å; D220-S222 WeakPolarHBondContact OD1-CB 3.43Å; D220-S222 PolarHBondContact OD1-N 3.04Å; D220-S222 PolarHBondContact OD1-OG 3.23Å; D220-S222 WeakPolarHBondContact OD2-CB 3.45Å; D220-S222 PolarHBondContact OD2-OG 2.76Å
221	G	92.1	Very high	86.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	78.5	9.4	-174.7	0	0	0	0	0	113.4	T165 D166 S218 N219	T165-G221 WeakPolarHBondContact CA-O 3.46Å; D166-G221 PolarHBondContact N-O 2.95Å; S218-G221 WeakPolarHBondContact O-CA 3.38Å; S218-G221 PolarHBondContact O-N 3.09Å; N219-G221 PolarHBondContact O-N 3.38Å
222	S	94.7	Very high	88.1	Confident	28 Å²	28	46.9 Å²	46.9	20%	0.196	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.3	170.4	69.1	0	0	0	0	110.4	V217 S218 D220	V217-S222 WeakPolarHBondContact CA-O 3.4Å; S218-S222 PolarHBondContact N-O 3.14Å; D220-S222 VanDerWaalsContact C-N 3.29Å; D220-S222 WeakPolarHBondContact OD1-CB 3.43Å; D220-S222 PolarHBondContact OD1-N 3.04Å; D220-S222 PolarHBondContact OD1-OG 3.23Å; D220-S222 WeakPolarHBondContact OD2-CB 3.45Å; D220-S222 PolarHBondContact OD2-OG 2.76Å
223	V	94.7	Very high	89.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	113.8	-179.3	-173.9	0	0	0	0	107.9	R163 W164 D166 L169 V215 V217	R163-V223 WeakPolarHBondContact CA-O 3.48Å; W164-V223 HydrophobicContact CD2-CB 4.03Å; W164-V223 HydrophobicContact CD2-CG1 4.37Å; W164-V223 HydrophobicContact CG-CB 4.45Å; W164-V223 HydrophobicContact CH2-CB 4.47Å; W164-V223 HydrophobicContact CH2-CG1 3.76Å; W164-V223 HydrophobicContact CZ2-CB 3.98Å; W164-V223 HydrophobicContact CZ2-CG1 3.5Å; W164-V223 HydrophobicContact CZ3-CG1 4.28Å; W164-V223 PolarHBondContact N-O 2.82Å; W164-V223 PolarHBondContact O-N 2.76Å; D166-V223 HydrophobicContact CB-CG2 4.28Å; L169-V223 HydrophobicContact CD1-CG2 3.98Å; V215-V223 HydrophobicContact CB-CG1 3.8Å; V215-V223 HydrophobicContact CG1-CG1 4.25Å; V215-V223 HydrophobicContact CG2-CG1 3.84Å; V217-V223 HydrophobicContact CG1-CG2 4.27Å; V217-V223 HydrophobicContact CG2-CG1 4.33Å; V217-V223 HydrophobicContact CG2-CG2 4.21Å
224	T	93.3	Very high	90.2	Very high	22 Å²	22	38.2 Å²	38.2	14%	0.135	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.2	169.4	-63.3	0	0	0	0	109.3	T161 M162 R163 T216	T161-T224 HydrophobicContact CG2-CG2 3.88Å; M162-T224 WeakPolarHBondContact O-CA 3.4Å; R163-T224 HydrophobicContact CG-CG2 4.2Å; R163-T224 WeakPolarHBondContact CG-OG1 3.39Å; R163-T224 PolarHBondContact NE-OG1 3.13Å; R163-T224 VanDerWaalsContact NE-OG1 3.09Å; T216-T224 PolarHBondContact N-O 3.45Å; T216-T224 PolarHBondContact O-N 3.12Å
225	W	90.8	Very high	90.4	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.7	171.7	-175.2	31.3	0	0	0	110.9	T161 M162 W164 I191 F207 V211 V215 H227	T161-W225 WeakPolarHBondContact CA-O 3.17Å; M162-W225 HydrophobicContact CE-CD2 4.09Å; M162-W225 HydrophobicContact CE-CE3 3.32Å; M162-W225 HydrophobicContact CE-CH2 4.33Å; M162-W225 HydrophobicContact CE-CZ3 3.46Å; M162-W225 VanDerWaalsContact CE-CZ3 3.46Å; M162-W225 PolarHBondContact N-O 3.01Å; M162-W225 PolarHBondContact O-N 3.4Å; M162-W225 HydrophobicContact SD-CE3 4.34Å; M162-W225 HydrophobicContact SD-CZ3 4.47Å; W164-W225 HydrophobicContact CH2-CB 4.06Å; W164-W225 HydrophobicContact CH2-CE3 4.4Å; W164-W225 HydrophobicContact CZ3-CB 3.86Å; W164-W225 HydrophobicContact CZ3-CE3 4.4Å; I191-W225 HydrophobicContact CG2-CE3 3.89Å; I191-W225 HydrophobicContact CG2-CH2 3.97Å; I191-W225 HydrophobicContact CG2-CZ3 3.32Å; F207-W225 HydrophobicContact CB-CH2 3.87Å; F207-W225 HydrophobicContact CB-CZ3 3.89Å; F207-W225 AromaticContact CD1-CH2 3.68Å; F207-W225 HydrophobicContact CD1-CH2 3.68Å; F207-W225 AromaticContact CD1-CZ3 3.79Å; F207-W225 HydrophobicContact CD1-CZ3 3.79Å; F207-W225 HydrophobicContact CG-CH2 4.26Å; F207-W225 HydrophobicContact CG-CZ3 4.26Å; F207-W225 VanDerWaalsContact O-CH2 3.28Å; F207-W225 WeakPolarHBondContact O-CH2 3.35Å; V211-W225 HydrophobicContact CG1-CZ2 4.33Å; V215-W225 HydrophobicContact CG1-CB 3.85Å; V215-W225 HydrophobicContact CG1-CG 3.8Å; W225-H227 HydrophobicContact CZ2-CB 4.01Å; W225-H227 AromaticContact CZ2-CG 4Å; W225-H227 AromaticContact CZ2-ND1 3.92Å
226	L	88.4	Confident	90.1	Very high	107 Å²	107	34.4 Å²	34.4	56%	0.56	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103	122.8	172.9	-69.4	166.2	0	0	0	108.8	F160 T161	F160-L226 WeakPolarHBondContact O-CA 3.49Å; T161-L226 HydrophobicContact CG2-CD2 3.68Å; T161-L226 HydrophobicContact CG2-CG 4.49Å; T161-L226 VanDerWaalsContact OG1-CD2 3.25Å; T161-L226 WeakPolarHBondContact OG1-CD2 3.43Å
227	H	85.2	Confident	89.6	Confident	23 Å²	23	32.8 Å²	32.8	11%	0.106	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	108.1	179.7	-175.1	62.4	0	0	0	111.1	W159 F160 F205 F207 W225	W159-H227 CarbonylContact C-O 3.57Å; W159-H227 VanDerWaalsContact CA-O 3.3Å; W159-H227 WeakPolarHBondContact CA-O 3.37Å; F160-H227 PolarHBondContact N-O 3.15Å; F160-H227 PolarHBondContact O-N 3.13Å; F205-H227 AromaticContact CE2-CD2 3.65Å; F205-H227 AromaticContact CE2-NE2 3.33Å; F205-H227 VanDerWaalsContact CE2-NE2 3.33Å; F205-H227 WeakPolarHBondContact CE2-NE2 3.49Å; F205-H227 AromaticContact CZ-CD2 3.75Å; F205-H227 AromaticContact CZ-NE2 3.91Å; F207-H227 HydrophobicContact CD1-CB 4.38Å; F207-H227 AromaticContact CD1-CD2 3.7Å; F207-H227 HydrophobicContact CE1-CB 4.08Å; F207-H227 AromaticContact CE1-CD2 3.48Å; F207-H227 VanDerWaalsContact CE1-CD2 3.48Å; F207-H227 WeakPolarHBondContact CE1-CD2 3.35Å; W225-H227 HydrophobicContact CZ2-CB 4.01Å; W225-H227 AromaticContact CZ2-CG 4Å; W225-H227 AromaticContact CZ2-ND1 3.92Å
228	G	83.2	Confident	89.1	Confident	56 Å²	56	36.8 Å²	36.8	58%	0.577	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	132.2	172.8	0	0	0	0	0	111.1	G158	G158-G228 WeakPolarHBondContact O-CA 3.39Å
229	A	80.2	Confident	88.6	Confident	6 Å²	6	36.2 Å²	36.2	5%	0.05	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.5	-169.6	0	0	0	0	0	111.8	S157 G158 F160 F205 L231	S157-A229 WeakPolarHBondContact CA-O 3.22Å; G158-A229 PolarHBondContact N-O 3.29Å; G158-A229 PolarHBondContact O-N 3.37Å; F160-A229 HydrophobicContact CD2-CB 4Å; F160-A229 HydrophobicContact CE2-CB 3.73Å; F205-A229 HydrophobicContact CD2-CB 4.39Å; F205-A229 HydrophobicContact CE2-CB 3.38Å; F205-A229 HydrophobicContact CZ-CB 3.63Å; A229-L231 HydrophobicContact CB-CD2 4.02Å; A229-L231 HydrophobicContact CB-CG 4.11Å
230	V	84.1	Confident	88.1	Confident	87 Å²	87	34.6 Å²	34.6	53%	0.527	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.1	160.5	173.3	0	0	0	0	107.1	L145 I156	L145-V230 HydrophobicContact CD1-CB 4.45Å; L145-V230 HydrophobicContact CD1-CG1 3.51Å; L145-V230 HydrophobicContact CD1-CG2 4.1Å; I156-V230 WeakPolarHBondContact O-CA 3.43Å
231	L	86	Confident	87.7	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117	-171.9	-53.2	173	0	0	0	110.1	Y139 S155 I156 F160 V196 F205 A229 V233 L251	Y139-L231 HydrophobicContact CE2-CD1 4.1Å; S155-L231 WeakPolarHBondContact CA-O 3.49Å; I156-L231 HydrophobicContact CG1-CB 4.1Å; I156-L231 PolarHBondContact N-O 3.5Å; I156-L231 PolarHBondContact O-N 3.1Å; F160-L231 HydrophobicContact CE2-CD1 3.84Å; F160-L231 HydrophobicContact CE2-CD2 4.46Å; F160-L231 HydrophobicContact CZ-CD1 3.66Å; V196-L231 HydrophobicContact CG2-CD2 4.27Å; F205-L231 HydrophobicContact CD1-CD2 3.64Å; F205-L231 HydrophobicContact CD2-CD2 3.85Å; F205-L231 HydrophobicContact CE1-CD2 3.66Å; F205-L231 HydrophobicContact CE2-CD2 3.87Å; F205-L231 HydrophobicContact CG-CD2 3.75Å; F205-L231 HydrophobicContact CZ-CD2 3.79Å; A229-L231 HydrophobicContact CB-CD2 4.02Å; A229-L231 HydrophobicContact CB-CG 4.11Å; L231-V233 HydrophobicContact CB-CG1 4.17Å; L231-L251 HydrophobicContact CD1-CD1 3.95Å; L231-L251 HydrophobicContact CD1-CD2 4Å
232	D	88.6	Confident	87.4	Confident	60 Å²	60	34.4 Å²	34.4	32%	0.321	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	96.1	165.4	-68.8	-32.1	0	0	0	108.9	S155 G199 K200	S155-D232 WeakPolarHBondContact CB-OD1 3.34Å; S155-D232 PolarHBondContact OG-OD1 2.97Å; G199-D232 CarbonylContact C-O 3.5Å; G199-D232 WeakPolarHBondContact CA-O 3.4Å; K200-D232 HydrophobicContact CB-CB 4.28Å; K200-D232 PolarHBondContact N-O 3.42Å
233	V	89.5	Confident	86.9	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.4	-179.4	-64	0	0	0	0	112	T153 L154 V196 L231 C235 L251	T153-V233 VanDerWaalsContact CA-O 3.3Å; T153-V233 WeakPolarHBondContact CA-O 3.45Å; L154-V233 HydrophobicContact CB-CG2 4.02Å; L154-V233 HydrophobicContact CD2-CG2 4.24Å; L154-V233 HydrophobicContact CG-CG2 4.34Å; L154-V233 PolarHBondContact N-O 3.32Å; L154-V233 PolarHBondContact O-N 3.05Å; V196-V233 HydrophobicContact CG1-CG1 4.12Å; L231-V233 HydrophobicContact CB-CG1 4.17Å; V233-C235 PolarHBondContact O-N 3.24Å; V233-L251 HydrophobicContact CG1-CD1 3.9Å
234	T	90.4	Very high	86.6	Confident	36 Å²	36	33.8 Å²	33.8	22%	0.221	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	118.5	172.1	-48.7	0	0	0	0	109	E152 N198	E152-T234 CarbonylContact O-C 3.51Å; E152-T234 WeakPolarHBondContact O-CA 3.38Å; N198-T234 PolarHBondContact ND2-O 2.97Å; N198-T234 PolarHBondContact O-N 2.93Å; N198-T234 PolarHBondContact O-OG1 2.91Å
235	C	90.5	Very high	86.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.194	C	C	.	.			trans	-127.9	110.7	-179.9	176.8	0	0	0	0	109.9	F147 E152 L154 V233 L237 C249	F147-C235 HydrophobicContact CZ-CB 4.05Å; E152-C235 CarbonylContact C-O 3.53Å; E152-C235 PolarHBondContact O-N 2.77Å; L154-C235 HydrophobicContact CB-CB 4.19Å; V233-C235 PolarHBondContact O-N 3.24Å; C235-L237 PolarHBondContact O-N 3.36Å; C235-C249 HydrophobicContact CB-CB 3.73Å; C235-C249 WeakPolarHBondContact CB-SG 3.47Å; C235-C249 WeakPolarHBondContact SG-CA 3.48Å; C235-C249 WeakPolarHBondContact SG-CB 3.47Å; C235-C249 CovalentContact SG-SG 2.03Å; C235-C249 PolarHBondContact SG-SG 2.88Å
236	P	86.1	Confident	86.3	Confident	76 Å²	76	39.1 Å²	39.1	49%	0.494	22%	0.218	S	C	.	.			trans	-68.6	122	179.9	28.6	-33.3	0	0	0	110.3	E152	E152-P236 WeakPolarHBondContact OE1-CA 3.07Å
237	L	83	Confident	86.5	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.073	19%	0.193	C	C	.	.			trans	-81.9	140.6	-178.7	-79.2	174.8	0	0	0	112.6	F147 Q149 E152 C235 V239 Q247 R377	F147-L237 HydrophobicContact CD1-CD1 4.27Å; F147-L237 HydrophobicContact CD1-CD2 4.35Å; F147-L237 HydrophobicContact CE1-CD1 3.7Å; F147-L237 HydrophobicContact CE1-CD2 3.54Å; F147-L237 HydrophobicContact CE1-CG 3.63Å; F147-L237 HydrophobicContact CE2-CD2 4.1Å; F147-L237 HydrophobicContact CZ-CD1 4.4Å; F147-L237 HydrophobicContact CZ-CD2 3.38Å; F147-L237 HydrophobicContact CZ-CG 3.85Å; Q149-L237 HydrophobicContact CB-CD1 3.89Å; Q149-L237 HydrophobicContact CG-CD1 4.16Å; E152-L237 PolarHBondContact OE1-N 3.32Å; C235-L237 PolarHBondContact O-N 3.36Å; L237-V239 HydrophobicContact CB-CG1 4.04Å; L237-V239 HydrophobicContact CD1-CG1 4.22Å; L237-Q247 HydrophobicContact CD2-CG 3.65Å; L237-R377 PolarHBondContact O-NH1 3.14Å
238	D	85.4	Confident	86.8	Confident	83 Å²	83	35.7 Å²	35.7	44%	0.444	20%	0.203	S	C	.	.			trans	-107	99.1	155.5	-174.1	4	0	0	0	109.9	S240 Q247	D238-S240 VanDerWaalsContact C-N 3.28Å; D238-S240 PolarHBondContact O-N 3.12Å; D238-S240 WeakPolarHBondContact OD1-CB 3.49Å; D238-S240 PolarHBondContact OD1-N 2.7Å; D238-S240 PolarHBondContact OD1-OG 2.96Å; D238-Q247 PolarHBondContact O-NE2 2.99Å
239	V	84.7	Confident	87.2	Confident	3 Å²	3	33 Å²	33	2%	0.018	18%	0.176	C	C	.	.			trans	-88.2	9.4	178.6	-54.3	0	0	0	0	113.1	L237 F241 F242 P373 P380	L237-V239 HydrophobicContact CB-CG1 4.04Å; L237-V239 HydrophobicContact CD1-CG1 4.22Å; V239-F241 VanDerWaalsContact C-N 3.3Å; V239-F241 PolarHBondContact O-N 3.06Å; V239-F242 HydrophobicContact CB-CB 4.23Å; V239-F242 WeakPolarHBondContact O-CB 3.41Å; V239-F242 PolarHBondContact O-N 3.45Å; V239-P373 HydrophobicContact CB-CG 4.2Å; V239-P373 HydrophobicContact CG1-CB 3.98Å; V239-P373 HydrophobicContact CG1-CG 3.93Å; V239-P380 HydrophobicContact CG2-CB 4.36Å; V239-P380 WeakPolarHBondContact O-CB 3.46Å
240	S	85.3	Confident	87.7	Confident	22 Å²	22	36.8 Å²	36.8	15%	0.154	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-43.7	-171.8	-58.2	0	0	0	0	111.8	D238 T378 V381	D238-S240 VanDerWaalsContact C-N 3.28Å; D238-S240 PolarHBondContact O-N 3.12Å; D238-S240 WeakPolarHBondContact OD1-CB 3.49Å; D238-S240 PolarHBondContact OD1-N 2.7Å; D238-S240 PolarHBondContact OD1-OG 2.96Å; S240-T378 WeakPolarHBondContact OG-CB 3.45Å; S240-T378 WeakPolarHBondContact OG-CG2 3.41Å; S240-T378 PolarHBondContact OG-OG1 3.48Å; S240-V381 WeakPolarHBondContact O-CB 3.37Å; S240-V381 WeakPolarHBondContact O-CG2 3.23Å; S240-V381 PolarHBondContact O-N 2.78Å
241	F	86.6	Confident	88.1	Confident	86 Å²	86	32.6 Å²	32.6	38%	0.377	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	10.8	178	-67.8	-75.2	0	0	0	115.2	M15 V239 F244	M15-F241 HydrophobicContact CE-CD1 3.92Å; M15-F241 HydrophobicContact CE-CE1 4.18Å; M15-F241 HydrophobicContact CE-CG 4.48Å; M15-F241 HydrophobicContact SD-CD1 4.26Å; V239-F241 VanDerWaalsContact C-N 3.3Å; V239-F241 PolarHBondContact O-N 3.06Å; F241-F244 CarbonylContact O-C 3.53Å; F241-F244 WeakPolarHBondContact O-CA 3.45Å; F241-F244 PolarHBondContact O-N 3.44Å
242	F	84.5	Confident	88.3	Confident	3 Å²	3	33.7 Å²	33.7	1%	0.013	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	132	-178.5	-179.9	-85.6	0	0	0	112	V239 R318 F323 P373 P380 L382	V239-F242 HydrophobicContact CB-CB 4.23Å; V239-F242 WeakPolarHBondContact O-CB 3.41Å; V239-F242 PolarHBondContact O-N 3.45Å; F242-R318 VanDerWaalsContact CE2-CZ 3.46Å; F242-F323 HydrophobicContact CE1-CD1 4.3Å; F242-F323 HydrophobicContact CE1-CE1 4.18Å; F242-F323 HydrophobicContact CE2-CZ 4.3Å; F242-F323 HydrophobicContact CZ-CD1 4.16Å; F242-F323 AromaticContact CZ-CE1 3.65Å; F242-F323 HydrophobicContact CZ-CE1 3.65Å; F242-F323 HydrophobicContact CZ-CE2 4.18Å; F242-F323 AromaticContact CZ-CZ 3.67Å; F242-F323 HydrophobicContact CZ-CZ 3.67Å; F242-P373 HydrophobicContact CD1-CG 4.41Å; F242-P373 HydrophobicContact CD2-CG 3.83Å; F242-P373 HydrophobicContact CE1-CG 4.45Å; F242-P373 HydrophobicContact CE2-CG 3.85Å; F242-P373 HydrophobicContact CG-CG 4.11Å; F242-P373 VanDerWaalsContact CZ-CD 3.49Å; F242-P373 HydrophobicContact CZ-CG 4.18Å; F242-P380 HydrophobicContact CB-CB 4.13Å; F242-L382 HydrophobicContact CD1-CB 4.26Å; F242-L382 HydrophobicContact CD1-CD2 3.89Å; F242-L382 HydrophobicContact CE1-CD2 3.7Å; F242-L382 VanDerWaalsContact O-CB 3.27Å; F242-L382 WeakPolarHBondContact O-CB 3.45Å; F242-L382 PolarHBondContact O-N 3.4Å
243	P	85.1	Confident	88.4	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.006	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.8	12.3	10.3	39.6	-39.9	0	0	0	115.4	D245 P320 F323	P243-D245 VanDerWaalsContact C-N 3.28Å; P243-P320 HydrophobicContact CG-CB 4.4Å; P243-F323 HydrophobicContact CB-CB 3.72Å; P243-F323 HydrophobicContact CB-CD2 3.69Å; P243-F323 HydrophobicContact CB-CE2 4.5Å; P243-F323 HydrophobicContact CB-CG 3.74Å; P243-F323 HydrophobicContact CG-CB 3.75Å; P243-F323 HydrophobicContact CG-CG 4.31Å
244	F	87	Confident	88.4	Confident	15 Å²	15	31.4 Å²	31.4	7%	0.066	16%	0.159	C	C	.	.	S	Bend	trans	-96.9	30.3	179.9	-55.4	-84.7	0	0	0	111.8	I12 M15 M16 F241 P320 I324	I12-F244 HydrophobicContact CG2-CE2 3.94Å; I12-F244 WeakPolarHBondContact O-CE2 3.26Å; M15-F244 HydrophobicContact CB-CB 3.65Å; M15-F244 HydrophobicContact CB-CD1 3.57Å; M15-F244 HydrophobicContact CB-CD2 3.98Å; M15-F244 HydrophobicContact CB-CE1 4.2Å; M15-F244 HydrophobicContact CB-CG 3.44Å; M15-F244 VanDerWaalsContact CB-CG 3.44Å; M15-F244 HydrophobicContact CG-CB 4.29Å; M15-F244 HydrophobicContact CG-CG 4.49Å; M15-F244 WeakPolarHBondContact O-CD1 3.37Å; M15-F244 WeakPolarHBondContact O-CE1 3.49Å; M15-F244 HydrophobicContact SD-CB 3.7Å; M15-F244 HydrophobicContact SD-CG 4.49Å; M16-F244 HydrophobicContact CB-CE1 4.48Å; M16-F244 HydrophobicContact CG-CE1 3.74Å; M16-F244 HydrophobicContact CG-CZ 3.47Å; M16-F244 VanDerWaalsContact CG-CZ 3.47Å; M16-F244 HydrophobicContact SD-CZ 4.5Å; F241-F244 CarbonylContact O-C 3.53Å; F241-F244 WeakPolarHBondContact O-CA 3.45Å; F241-F244 PolarHBondContact O-N 3.44Å; F244-P320 HydrophobicContact CD1-CB 3.69Å; F244-P320 HydrophobicContact CD1-CG 3.71Å; F244-P320 HydrophobicContact CE1-CB 3.52Å; F244-P320 HydrophobicContact CE1-CG 3.61Å; F244-P320 HydrophobicContact CG-CB 4.46Å; F244-P320 HydrophobicContact CZ-CB 4.17Å; F244-I324 HydrophobicContact CE1-CD1 4.07Å; F244-I324 HydrophobicContact CE1-CG1 4.46Å; F244-I324 HydrophobicContact CZ-CD1 4.23Å; F244-I324 HydrophobicContact CZ-CG1 4.13Å
245	D	88.3	Confident	88.3	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.011	15%	0.153	C	C	.	.			trans	-84.2	147.2	-170.6	56.7	-66.3	0	0	0	114	P243 Q247 R318	P243-D245 VanDerWaalsContact C-N 3.28Å; D245-Q247 PolarHBondContact OD2-NE2 3.34Å; D245-R318 PolarHBondContact O-N 3.44Å; D245-R318 VanDerWaalsContact O-N 3.16Å; D245-R318 IonicContact OD1-CZ 2.81Å; D245-R318 IonicContact OD1-NE 3.18Å; D245-R318 PolarHBondContact OD1-NE 3.34Å; D245-R318 IonicContact OD1-NH2 2.86Å; D245-R318 PolarHBondContact OD1-NH2 3.5Å; D245-R318 IonicContact OD2-CZ 3.09Å; D245-R318 IonicContact OD2-NE 2.77Å; D245-R318 PolarHBondContact OD2-NE 2.87Å; D245-R318 IonicContact OD2-NH2 2.66Å; D245-R318 PolarHBondContact OD2-NH2 2.8Å
246	Y	90.9	Very high	87.9	Confident	134 Å²	134	37 Å²	37	53%	0.525	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.4	172.5	-64.4	-102.8	0	0	0	107.7	L316 K317	Y246-L316 CarbonylContact C-O 3.6Å; Y246-L316 WeakPolarHBondContact CA-O 3.46Å; Y246-K317 HydrophobicContact CD1-CB 3.95Å; Y246-K317 HydrophobicContact CD1-CG 4.17Å; Y246-K317 HydrophobicContact CE1-CB 4Å; Y246-K317 HydrophobicContact CE1-CD 3.77Å; Y246-K317 HydrophobicContact CE1-CG 3.8Å
247	Q	91.1	Very high	87.7	Confident	4 Å²	4	41 Å²	41	2%	0.019	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.3	179.8	-55	-57.7	-26.2	0	0	109.9	L237 D238 D245 W287 L316	L237-Q247 HydrophobicContact CD2-CG 3.65Å; D238-Q247 PolarHBondContact O-NE2 2.99Å; D245-Q247 PolarHBondContact OD2-NE2 3.34Å; Q247-W287 HydrophobicContact CB-CZ3 4.37Å; Q247-W287 HydrophobicContact CG-CH2 3.63Å; Q247-W287 HydrophobicContact CG-CZ3 3.72Å; Q247-L316 HydrophobicContact CB-CB 4.37Å; Q247-L316 PolarHBondContact N-O 3.47Å; Q247-L316 PolarHBondContact O-N 3.09Å
248	T	91.6	Very high	87.7	Confident	53 Å²	53	41.2 Å²	41.2	33%	0.325	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	97.1	174.3	-59	0	0	0	0	108.6	F250 A313 H315	T248-F250 HydrophobicContact CG2-CE1 4.14Å; T248-F250 HydrophobicContact CG2-CE2 4.17Å; T248-F250 HydrophobicContact CG2-CZ 3.73Å; T248-A313 HydrophobicContact CG2-CB 4.44Å; T248-H315 WeakPolarHBondContact CG2-CE1 3.29Å; T248-H315 PolarHBondContact OG1-CE1 2.99Å; T248-H315 PolarHBondContact OG1-ND1 3.39Å
249	C	92.1	Very high	87.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.4	-179.1	-64.7	0	0	0	0	110.8	L154 C235 I314	L154-C249 HydrophobicContact CD2-CB 3.64Å; C235-C249 HydrophobicContact CB-CB 3.73Å; C235-C249 WeakPolarHBondContact CB-SG 3.47Å; C235-C249 WeakPolarHBondContact SG-CA 3.48Å; C235-C249 WeakPolarHBondContact SG-CB 3.47Å; C235-C249 CovalentContact SG-SG 2.03Å; C235-C249 PolarHBondContact SG-SG 2.88Å; C249-I314 PolarHBondContact N-O 3.42Å; C249-I314 PolarHBondContact O-N 3.17Å
250	F	92	Very high	87.6	Confident	85 Å²	85	39 Å²	39	37%	0.373	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.5	177.7	-59.8	-78.7	0	0	0	110.4	N198 T248 I252 I312 A313	N198-F250 PolarHBondContact ND2-O 2.92Å; T248-F250 HydrophobicContact CG2-CE1 4.14Å; T248-F250 HydrophobicContact CG2-CE2 4.17Å; T248-F250 HydrophobicContact CG2-CZ 3.73Å; F250-I252 HydrophobicContact CB-CG1 4.38Å; F250-I312 CarbonylContact C-O 3.58Å; F250-I312 WeakPolarHBondContact CA-O 3.4Å; F250-A313 HydrophobicContact CD1-CB 3.91Å; F250-A313 HydrophobicContact CE1-CB 3.74Å
251	L	90.6	Very high	87.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.2	166.4	163.2	64	0	0	0	107.2	Y139 F160 V196 L231 V233 L253 I312	Y139-L251 HydrophobicContact CD1-CD2 3.62Å; Y139-L251 HydrophobicContact CE1-CD2 3.66Å; Y139-L251 HydrophobicContact CG-CD2 4.12Å; F160-L251 HydrophobicContact CE1-CD2 4.27Å; F160-L251 HydrophobicContact CZ-CD2 4.15Å; V196-L251 HydrophobicContact CB-CD1 4.41Å; V196-L251 HydrophobicContact CG1-CD1 3.59Å; V196-L251 HydrophobicContact CG2-CD1 3.88Å; L231-L251 HydrophobicContact CD1-CD1 3.95Å; L231-L251 HydrophobicContact CD1-CD2 4Å; V233-L251 HydrophobicContact CG1-CD1 3.9Å; L251-L253 HydrophobicContact CD1-CD2 4.47Å; L251-I312 HydrophobicContact CB-CB 4.16Å; L251-I312 HydrophobicContact CD2-CD1 4.01Å; L251-I312 HydrophobicContact CG-CB 4.49Å; L251-I312 HydrophobicContact CG-CD1 4.37Å; L251-I312 PolarHBondContact N-O 3.5Å; L251-I312 PolarHBondContact O-N 2.87Å
252	I	91.1	Very high	87.4	Confident	30 Å²	30	45.4 Å²	45.4	15%	0.154	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	109.2	-172.6	-56.7	174.6	0	0	0	110	M197 N198 F250 V254 Y309	M197-I252 HydrophobicContact CB-CB 4.24Å; M197-I252 HydrophobicContact CB-CG2 4Å; M197-I252 HydrophobicContact CE-CB 4.44Å; M197-I252 HydrophobicContact CE-CD1 3.9Å; M197-I252 HydrophobicContact CE-CG2 3.89Å; M197-I252 PolarHBondContact N-O 2.9Å; M197-I252 HydrophobicContact SD-CG2 4.28Å; N198-I252 PolarHBondContact OD1-N 3.35Å; F250-I252 HydrophobicContact CB-CG1 4.38Å; I252-V254 HydrophobicContact CG2-CG1 4.34Å; I252-Y309 HydrophobicContact CG2-CD2 3.8Å; I252-Y309 HydrophobicContact CG2-CG 4.25Å
253	L	90.3	Very high	87.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.9	177.5	-59.9	167	0	0	0	110.2	I137 F160 V194 V196 L251 Y309 V310 I312	I137-L253 HydrophobicContact CD1-CD1 3.88Å; I137-L253 HydrophobicContact CG1-CD1 4.32Å; F160-L253 HydrophobicContact CD1-CD1 4.49Å; F160-L253 HydrophobicContact CE1-CD1 3.94Å; F160-L253 HydrophobicContact CE1-CD2 3.72Å; F160-L253 HydrophobicContact CE1-CG 4.42Å; F160-L253 HydrophobicContact CZ-CD2 4.03Å; V194-L253 HydrophobicContact CG1-CB 4.28Å; V194-L253 HydrophobicContact CG1-CD2 4.3Å; V196-L253 HydrophobicContact CG2-CD2 3.82Å; L251-L253 HydrophobicContact CD1-CD2 4.47Å; L253-Y309 CarbonylContact O-C 3.51Å; L253-Y309 WeakPolarHBondContact O-CA 3.46Å; L253-Y309 VanDerWaalsContact O-CB 3.31Å; L253-Y309 WeakPolarHBondContact O-CB 3.34Å; L253-V310 HydrophobicContact CB-CB 4.31Å; L253-V310 PolarHBondContact N-O 3.12Å; L253-V310 PolarHBondContact O-N 3.13Å; L253-I312 HydrophobicContact CD1-CD1 3.55Å; L253-I312 HydrophobicContact CD1-CG1 4.36Å; L253-I312 HydrophobicContact CG-CD1 4.41Å
254	V	89.4	Confident	87.9	Confident	12 Å²	12	46.3 Å²	46.3	7%	0.073	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150	177.5	-68.3	0	0	0	0	110	V194 G195 M197 I252 W256	V194-V254 CarbonylContact C-O 3.52Å; V194-V254 WeakPolarHBondContact CA-O 3.46Å; G195-V254 PolarHBondContact N-O 3.33Å; G195-V254 PolarHBondContact O-N 3.09Å; M197-V254 HydrophobicContact CB-CG1 3.99Å; M197-V254 HydrophobicContact CB-CG2 4.05Å; M197-V254 HydrophobicContact CG-CG1 4.28Å; M197-V254 HydrophobicContact SD-CG1 3.92Å; I252-V254 HydrophobicContact CG2-CG1 4.34Å; V254-W256 HydrophobicContact CG2-CE3 3.99Å; V254-W256 HydrophobicContact CG2-CZ3 4.42Å
255	P	88.8	Confident	88.2	Confident	13 Å²	13	45.6 Å²	45.6	8%	0.084	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	134.7	150.9	-1.9	20.3	0	0	0	108	D193 S258 L263 L265 Q308	D193-P255 CarbonylContact O-C 3.51Å; D193-P255 WeakPolarHBondContact O-CA 3.5Å; P255-S258 WeakPolarHBondContact CB-O 3.26Å; P255-L263 HydrophobicContact CB-CD2 4.38Å; P255-L263 HydrophobicContact CG-CD2 4.21Å; P255-L265 HydrophobicContact CG-CD1 4Å; P255-L265 HydrophobicContact CG-CG 4.31Å; P255-Q308 VanDerWaalsContact CD-O 3.3Å; P255-Q308 WeakPolarHBondContact CD-O 3.33Å; P255-Q308 HydrophobicContact CG-CG 4.08Å
256	W	81.7	Confident	88.3	Confident	142 Å²	142	48.5 Å²	48.5	54%	0.538	23%	0.226	S	C	.	.	S	Bend	trans	-85.7	-30.8	-170.2	-164.4	-115.9	0	0	0	112.6	D193 V254	D193-W256 WeakPolarHBondContact O-CB 3.14Å; D193-W256 PolarHBondContact O-N 2.95Å; D193-W256 PolarHBondContact OD2-N 3.08Å; D193-W256 VanDerWaalsContact OD2-N 3.16Å; V254-W256 HydrophobicContact CG2-CE3 3.99Å; V254-W256 HydrophobicContact CG2-CZ3 4.42Å
257	Q	81.6	Confident	88.2	Confident	159 Å²	159	44.2 Å²	44.2	74%	0.743	22%	0.215	S	C	*	.	S	Bend	trans	-128.7	-32.1	178.6	-58.2	-173.2	0.3	0	0	112.4	D193	D193-Q257 WeakPolarHBondContact OD2-CA 3.5Å; D193-Q257 PolarHBondContact OD2-N 3.47Å
258	S	83.1	Confident	87.9	Confident	18 Å²	18	45.7 Å²	45.7	13%	0.126	22%	0.221	C	C	.	.			trans	-72.3	128.9	-176.2	-71.5	0	0	0	0	113.9	D193 P255	D193-S258 VanDerWaalsContact OD1-CB 3.26Å; D193-S258 WeakPolarHBondContact OD1-CB 3.39Å; D193-S258 PolarHBondContact OD1-OG 2.91Å; D193-S258 PolarHBondContact OD2-N 3.48Å; D193-S258 PolarHBondContact OD2-OG 3.48Å; P255-S258 WeakPolarHBondContact CB-O 3.26Å
259	G	83.8	Confident	87	Confident	10 Å²	10	47.8 Å²	47.8	10%	0.103	23%	0.234	C	C	.	.			trans	-75.6	167.7	166.3	0	0	0	0	0	113.1	Q261 Q262 L263	G259-Q261 PolarHBondContact O-N 2.82Å; G259-Q261 VanDerWaalsContact O-N 3.08Å; G259-Q262 PolarHBondContact O-N 3.36Å; G259-L263 PolarHBondContact O-N 3.42Å
260	E	84.4	Confident	85.5	Confident	30 Å²	30	53.6 Å²	53.6	14%	0.14	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.7	-179.5	-177.4	176.5	-158.8	0	0	114	P132 L264 R296 K298 T306	P132-E260 WeakPolarHBondContact CB-O 3.16Å; E260-L264 HydrophobicContact CG-CD1 3.88Å; E260-R296 IonicContact OE1-NH2 2.85Å; E260-K298 WeakPolarHBondContact OE1-CD 3.29Å; E260-K298 WeakPolarHBondContact OE1-CE 3.37Å; E260-K298 IonicContact OE1-NZ 2.7Å; E260-K298 PolarHBondContact OE1-NZ 3.34Å; E260-T306 WeakPolarHBondContact CB-O 3.39Å; E260-T306 PolarHBondContact N-O 3.35Å; E260-T306 WeakPolarHBondContact OE2-CB 3.38Å; E260-T306 PolarHBondContact OE2-OG1 3.5Å
261	Q	82.5	Confident	84.1	Confident	157 Å²	157	52.5 Å²	52.5	73%	0.734	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-13.7	177	-65.5	179.1	-16.4	0	0	113.9	P132 G259	P132-Q261 WeakPolarHBondContact CA-O 3.4Å; G259-Q261 PolarHBondContact O-N 2.82Å; G259-Q261 VanDerWaalsContact O-N 3.08Å
262	Q	85.7	Confident	82.4	Confident	86 Å²	86	57.1 Å²	57.1	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-39	-177.8	-67.5	166.2	-58.7	0	0	111.7	P132 V133 G259	P132-Q262 WeakPolarHBondContact CA-O 3.43Å; V133-Q262 PolarHBondContact N-O 2.82Å; G259-Q262 PolarHBondContact O-N 3.36Å
263	L	89.6	Confident	80.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	140.5	-176.9	-172.2	153.8	0	0	0	109.3	V133 V135 W190 P192 D193 P255 G259 L265 Q308	V133-L263 CarbonylContact O-C 3.58Å; V133-L263 WeakPolarHBondContact O-CA 3.3Å; V135-L263 HydrophobicContact CB-CD2 4.47Å; V135-L263 HydrophobicContact CG2-CD1 4.21Å; V135-L263 HydrophobicContact CG2-CD2 4.18Å; V135-L263 HydrophobicContact CG2-CG 3.94Å; W190-L263 HydrophobicContact CH2-CD1 4.04Å; W190-L263 HydrophobicContact CZ2-CD1 4.13Å; P192-L263 HydrophobicContact CB-CD1 3.69Å; D193-L263 WeakPolarHBondContact OD1-CD1 3.46Å; P255-L263 HydrophobicContact CB-CD2 4.38Å; P255-L263 HydrophobicContact CG-CD2 4.21Å; G259-L263 PolarHBondContact O-N 3.42Å; L263-L265 HydrophobicContact CD2-CD2 3.74Å; L263-L265 HydrophobicContact CD2-CG 3.72Å; L263-Q308 PolarHBondContact O-NE2 3.45Å
264	L	91.1	Very high	79.4	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.12	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	98.6	179.8	-147.5	78.2	0	0	0	111	P132 V133 H134 V135 E260 Q266 R296	P132-L264 HydrophobicContact CB-CB 4.1Å; P132-L264 HydrophobicContact CB-CD1 4.5Å; P132-L264 HydrophobicContact CG-CB 4.21Å; P132-L264 HydrophobicContact CG-CD1 4.26Å; V133-L264 PolarHBondContact O-N 2.82Å; H134-L264 WeakPolarHBondContact CE1-CD2 3.32Å; V135-L264 PolarHBondContact N-O 3.44Å; E260-L264 HydrophobicContact CG-CD1 3.88Å; L264-Q266 PolarHBondContact O-N 2.75Å; L264-R296 VanDerWaalsContact CG-NH2 3.3Å
265	L	92.2	Very high	77.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.3	173.4	-68.6	178.4	0	0	0	110.5	V135 I137 V194 P255 L263 R296 Q308 V310	V135-L265 HydrophobicContact CB-CD2 4.24Å; V135-L265 HydrophobicContact CG1-CD2 4.22Å; I137-L265 HydrophobicContact CG2-CD2 4.41Å; V194-L265 HydrophobicContact CG2-CD2 3.93Å; P255-L265 HydrophobicContact CG-CD1 4Å; P255-L265 HydrophobicContact CG-CG 4.31Å; L263-L265 HydrophobicContact CD2-CD2 3.74Å; L263-L265 HydrophobicContact CD2-CG 3.72Å; L265-R296 WeakPolarHBondContact O-CD 3.49Å; L265-R296 VanDerWaalsContact O-CZ 3.27Å; L265-R296 PolarHBondContact O-NE 3.31Å; L265-R296 PolarHBondContact O-NH1 3.45Å; L265-Q308 VanDerWaalsContact N-NE2 3.14Å; L265-V310 HydrophobicContact CB-CG2 3.82Å; L265-V310 HydrophobicContact CD1-CG2 4.35Å
266	Q	91	Very high	76.4	Confident	63 Å²	63	63.6 Å²	63.6	29%	0.294	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.4	175	-72.6	-178.3	-110.5	0	0	109.8	H134 V135 N136 I137 L264	H134-Q266 PolarHBondContact ND1-OE1 3.22Å; V135-Q266 PolarHBondContact O-N 3.02Å; N136-Q266 CarbonylContact C-O 3.52Å; N136-Q266 VanDerWaalsContact CA-O 3.3Å; N136-Q266 WeakPolarHBondContact CA-O 3.49Å; N136-Q266 WeakPolarHBondContact OD1-CB 3.27Å; I137-Q266 PolarHBondContact N-O 3.49Å; L264-Q266 PolarHBondContact O-N 2.75Å
267	P	89.7	Confident	75.2	Confident	43 Å²	43	61.2 Å²	61.2	28%	0.279	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.8	172.4	27.9	-31.9	0	0	0	110.4	I137 F294 R296 V310	I137-P267 WeakPolarHBondContact O-CA 3.44Å; P267-F294 HydrophobicContact CB-CB 3.55Å; P267-F294 HydrophobicContact CB-CD1 4.33Å; P267-F294 HydrophobicContact CB-CG 4.27Å; P267-F294 HydrophobicContact CG-CB 4.37Å; P267-R296 HydrophobicContact CG-CB 4.14Å; P267-V310 HydrophobicContact CB-CG1 4.03Å
268	F	84.2	Confident	74	Confident	36 Å²	36	59.6 Å²	59.6	16%	0.158	34%	0.336	C	S	.	.			trans	-127	158.5	165.9	75.1	-77.8	0	0	0	111	N136 I137 T138 T161 H270	N136-F268 HydrophobicContact CB-CD1 3.67Å; N136-F268 HydrophobicContact CB-CE1 3.97Å; N136-F268 HydrophobicContact CB-CG 4.44Å; N136-F268 WeakPolarHBondContact O-CE1 3.43Å; I137-F268 WeakPolarHBondContact O-CD1 3.43Å; I137-F268 PolarHBondContact O-N 3.19Å; T138-F268 WeakPolarHBondContact CB-O 3.49Å; T138-F268 HydrophobicContact CG2-CD1 4.49Å; T138-F268 HydrophobicContact CG2-CD2 4.44Å; T138-F268 HydrophobicContact CG2-CE1 3.89Å; T138-F268 HydrophobicContact CG2-CE2 3.82Å; T138-F268 HydrophobicContact CG2-CZ 3.52Å; T138-F268 PolarHBondContact OG1-O 3.06Å; T161-F268 HydrophobicContact CG2-CZ 4.27Å; T161-F268 WeakPolarHBondContact O-CE1 3.47Å; F268-H270 HydrophobicContact CD2-CB 4.11Å; F268-H270 HydrophobicContact CE2-CB 3.85Å; F268-H270 AromaticContact CE2-CD2 3.77Å
269	T	71.8	Confident	72.9	Confident	96 Å²	96	59.6 Å²	59.6	59%	0.589	33%	0.334	S	S	*	.			trans	-122.4	115.2	177.4	50.1	0	0	0	0	108.7	G271 F294	T269-G271 PolarHBondContact O-N 3.13Å; T269-F294 HydrophobicContact CG2-CD2 3.82Å; T269-F294 HydrophobicContact CG2-CE2 4.03Å
270	H	60.6	Low	71.3	Confident	123 Å²	123	63.8 Å²	63.8	57%	0.569	36%	0.36	S	S	*	.			trans	-103.7	72.5	-174	-153.3	-81.2	0	0	0	110.5	R163 F268	R163-H270 PolarHBondContact NH1-CD2 3.06Å; R163-H270 PolarHBondContact NH1-NE2 2.76Å; R163-H270 VanDerWaalsContact NH1-NE2 3.16Å; F268-H270 HydrophobicContact CD2-CB 4.11Å; F268-H270 HydrophobicContact CE2-CB 3.85Å; F268-H270 AromaticContact CE2-CD2 3.77Å
271	G	62.3	Low	69.8	Low	62 Å²	62	67.8 Å²	67.8	64%	0.639	38%	0.382	S	S	*	.	S	Bend	trans	85	-157.9	-164.7	0	0	0	0	0	111.8	T269 A273	T269-G271 PolarHBondContact O-N 3.13Å; G271-A273 PolarHBondContact O-N 3.42Å
272	S	56.6	Low	68.5	Low	96 Å²	96	62.7 Å²	62.7	67%	0.671	36%	0.363	S	S	*	.			trans	-68	114.5	175.5	-64.8	0	0	0	0	110.6	V274	S272-V274 WeakPolarHBondContact CB-O 3.34Å; S272-V274 PolarHBondContact O-N 2.91Å
273	A	57.8	Low	67	Low	14 Å²	14	64.5 Å²	64.5	12%	0.116	38%	0.376	C	S	.	.	S	Bend	trans	-66.3	-5.3	174.5	0	0	0	0	0	114.2	G271 V292 F294	G271-A273 PolarHBondContact O-N 3.42Å; A273-V292 HydrophobicContact CB-CB 4.25Å; A273-V292 HydrophobicContact CB-CG1 4.46Å; A273-F294 HydrophobicContact CB-CE2 3.59Å; A273-F294 HydrophobicContact CB-CZ 4.07Å
274	V	60.2	Low	65.6	Low	37 Å²	37	69.7 Å²	69.7	22%	0.224	41%	0.407	C	S	.	.			trans	-123.9	100.2	166.6	-178.4	0	0	0	0	106.6	S272 N276 I289 V292	S272-V274 WeakPolarHBondContact CB-O 3.34Å; S272-V274 PolarHBondContact O-N 2.91Å; V274-N276 VanDerWaalsContact CG1-OD1 3.3Å; V274-N276 WeakPolarHBondContact CG1-OD1 3.44Å; V274-I289 HydrophobicContact CG1-CB 4.19Å; V274-I289 HydrophobicContact CG1-CG2 3.93Å; V274-I289 HydrophobicContact CG2-CG2 3.72Å; V274-V292 HydrophobicContact CG2-CB 3.99Å; V274-V292 HydrophobicContact CG2-CG2 3.57Å
275	D	58	Low	64.5	Low	71 Å²	71	70.4 Å²	70.4	38%	0.38	42%	0.415	S	S	.	.			trans	-110.4	97.6	168.4	-175.6	-12.6	0	0	0	108.7	S277 Y278	D275-S277 PolarHBondContact O-N 3.07Å; D275-S277 VanDerWaalsContact O-N 3.07Å; D275-S277 WeakPolarHBondContact OD1-CB 3.29Å; D275-S277 PolarHBondContact OD1-N 2.79Å; D275-S277 PolarHBondContact OD1-OG 3.14Å; D275-S277 PolarHBondContact OD2-OG 3.26Å; D275-Y278 HydrophobicContact CB-CD2 3.87Å; D275-Y278 HydrophobicContact CB-CE2 4.11Å; D275-Y278 PolarHBondContact O-N 3.26Å; D275-Y278 WeakPolarHBondContact OD2-CE2 3.31Å
276	N	57.4	Low	63.9	Low	70 Å²	70	73.8 Å²	73.8	37%	0.374	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-67.4	-3.5	-177.7	-72.5	-21.8	0	0	0	113.6	V274 Y278 L279	V274-N276 VanDerWaalsContact CG1-OD1 3.3Å; V274-N276 WeakPolarHBondContact CG1-OD1 3.44Å; N276-Y278 VanDerWaalsContact C-N 3.32Å; N276-L279 PolarHBondContact O-N 3.45Å
277	S	56.8	Low	63.6	Low	91 Å²	91	71.2 Å²	71.2	64%	0.636	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-70.8	-26.7	171.3	71.5	0	0	0	0	112.9	D275 L279	D275-S277 PolarHBondContact O-N 3.07Å; D275-S277 VanDerWaalsContact O-N 3.07Å; D275-S277 WeakPolarHBondContact OD1-CB 3.29Å; D275-S277 PolarHBondContact OD1-N 2.79Å; D275-S277 PolarHBondContact OD1-OG 3.14Å; D275-S277 PolarHBondContact OD2-OG 3.26Å; S277-L279 VanDerWaalsContact C-N 3.27Å; S277-L279 PolarHBondContact O-N 3.29Å
278	Y	55.3	Low	63.2	Low	125 Å²	125	72.6 Å²	72.6	49%	0.49	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-80.6	-2.1	175.2	-64.5	-77.5	0	0	0	114.1	W159 D275 N276 P280	W159-Y278 HydrophobicContact CH2-CD1 4.23Å; W159-Y278 HydrophobicContact CH2-CE1 4.35Å; W159-Y278 HydrophobicContact CH2-CG 4.37Å; D275-Y278 HydrophobicContact CB-CD2 3.87Å; D275-Y278 HydrophobicContact CB-CE2 4.11Å; D275-Y278 PolarHBondContact O-N 3.26Å; D275-Y278 WeakPolarHBondContact OD2-CE2 3.31Å; N276-Y278 VanDerWaalsContact C-N 3.32Å; Y278-P280 VanDerWaalsContact C-CD 3.46Å; Y278-P280 WeakPolarHBondContact O-CD 3.4Å
279	L	59.2	Low	63.2	Low	19 Å²	19	71.2 Å²	71.2	10%	0.099	42%	0.415	C	S	.	.			trans	-97.1	86.3	172.9	-82.4	70	0	0	0	109.7	V142 N276 S277 N281 S282 I289	V142-L279 WeakPolarHBondContact O-CD1 3.31Å; V142-L279 VanDerWaalsContact O-CG 3.23Å; V142-L279 WeakPolarHBondContact O-CG 3.48Å; N276-L279 PolarHBondContact O-N 3.45Å; S277-L279 VanDerWaalsContact C-N 3.27Å; S277-L279 PolarHBondContact O-N 3.29Å; L279-N281 PolarHBondContact O-N 3.46Å; L279-S282 PolarHBondContact O-N 3.47Å; L279-S282 VanDerWaalsContact O-N 3.11Å; L279-S282 PolarHBondContact O-OG 2.98Å; L279-I289 HydrophobicContact CD2-CD1 4.31Å
280	P	50.7	Low	63.7	Low	98 Å²	98	71.3 Å²	71.3	64%	0.636	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	123.4	168.2	27.2	-33.9	0	0	0	108.5	Y278	Y278-P280 VanDerWaalsContact C-CD 3.46Å; Y278-P280 WeakPolarHBondContact O-CD 3.4Å
281	N	53.4	Low	64.9	Low	113 Å²	113	66.9 Å²	66.9	60%	0.604	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	33.8	-174	-34.4	-74.2	0	0	0	115.5	L279 N283 V284 S285	L279-N281 PolarHBondContact O-N 3.46Å; N281-N283 WeakPolarHBondContact CA-OD1 3.45Å; N281-N283 PolarHBondContact O-N 3.16Å; N281-V284 HydrophobicContact CB-CB 3.96Å; N281-V284 HydrophobicContact CB-CG2 3.91Å; N281-V284 PolarHBondContact O-N 3.41Å; N281-S285 PolarHBondContact O-N 2.98Å
282	S	54.3	Low	66	Low	50 Å²	50	64.5 Å²	64.5	35%	0.35	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-17.3	167.2	46.1	0	0	0	0	115	L279 S285	L279-S282 PolarHBondContact O-N 3.47Å; L279-S282 VanDerWaalsContact O-N 3.11Å; L279-S282 PolarHBondContact O-OG 2.98Å; S282-S285 PolarHBondContact O-OG 2.98Å
283	N	56	Low	67.5	Low	125 Å²	125	64.7 Å²	64.7	67%	0.668	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	3.5	172.4	64.8	-36.5	0	0	0	114.5	N281	N281-N283 WeakPolarHBondContact CA-OD1 3.45Å; N281-N283 PolarHBondContact O-N 3.16Å
284	V	59.2	Low	69.1	Low	108 Å²	108	65.6 Å²	65.6	66%	0.655	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-19.1	-178.8	-172.8	0	0	0	0	112	N281	N281-V284 HydrophobicContact CB-CB 3.96Å; N281-V284 HydrophobicContact CB-CG2 3.91Å; N281-V284 PolarHBondContact O-N 3.41Å
285	S	68.9	Low	70.5	Confident	39 Å²	39	67 Å²	67	27%	0.273	37%	0.365	S	S	.	.	S	Bend	trans	-66.5	139.2	175.5	51.9	0	0	0	0	112.1	N281 S282 W287 Q319	N281-S285 PolarHBondContact O-N 2.98Å; S282-S285 PolarHBondContact O-OG 2.98Å; S285-W287 PolarHBondContact O-N 3.39Å; S285-W287 PolarHBondContact OG-O 2.87Å; S285-Q319 VanDerWaalsContact O-CD 3.31Å; S285-Q319 PolarHBondContact O-NE2 3.34Å
286	E	79.2	Confident	72	Confident	71 Å²	71	67 Å²	67	33%	0.332	36%	0.359	S	S	.	.	S	Bend	trans	-56.4	-25.2	174	-173.8	-168.4	-162.4	0	0	112.2	R318 Q319	E286-R318 HydrophobicContact CG-CG 3.93Å; E286-R318 CarbonylContact O-C 3.59Å; E286-R318 WeakPolarHBondContact O-CA 3.41Å; E286-R318 IonicContact OE1-CZ 2.79Å; E286-R318 IonicContact OE1-NH1 2.7Å; E286-R318 PolarHBondContact OE1-NH1 3.19Å; E286-R318 IonicContact OE2-NH1 3.83Å; E286-Q319 PolarHBondContact O-N 3.46Å
287	W	83.7	Confident	73.6	Confident	8 Å²	8	68 Å²	68	3%	0.03	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.9	-173.7	-62.5	92.7	0	0	0	112.1	I144 F147 Q247 S285 L316 R318	I144-W287 HydrophobicContact CD1-CB 3.61Å; I144-W287 HydrophobicContact CD1-CG 4.45Å; F147-W287 HydrophobicContact CB-CZ2 4.35Å; F147-W287 HydrophobicContact CD2-CZ2 4.05Å; F147-W287 HydrophobicContact CG-CZ2 4.25Å; Q247-W287 HydrophobicContact CB-CZ3 4.37Å; Q247-W287 HydrophobicContact CG-CH2 3.63Å; Q247-W287 HydrophobicContact CG-CZ3 3.72Å; S285-W287 PolarHBondContact O-N 3.39Å; S285-W287 PolarHBondContact OG-O 2.87Å; W287-L316 HydrophobicContact CE3-CB 3.88Å; W287-L316 HydrophobicContact CZ3-CB 4.29Å; W287-R318 HydrophobicContact CE3-CB 4.16Å; W287-R318 HydrophobicContact CH2-CB 4.22Å; W287-R318 HydrophobicContact CH2-CG 4.38Å; W287-R318 VanDerWaalsContact CH2-CZ 3.49Å; W287-R318 VanDerWaalsContact CH2-NH2 3.33Å; W287-R318 HydrophobicContact CZ2-CG 4.43Å; W287-R318 HydrophobicContact CZ3-CB 3.88Å; W287-R318 HydrophobicContact CZ3-CG 4.4Å
288	E	82.4	Confident	75.1	Confident	72 Å²	72	69.7 Å²	69.7	34%	0.336	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128	171.7	179.3	-176.7	-173.8	0	0	108.6	L316 K317	E288-L316 WeakPolarHBondContact O-CA 3.15Å; E288-K317 HydrophobicContact CB-CB 4.47Å; E288-K317 PolarHBondContact N-O 3.02Å; E288-K317 PolarHBondContact O-N 3.44Å; E288-K317 IonicContact OE1-NZ 3.2Å; E288-K317 WeakPolarHBondContact OE2-CD 3.46Å; E288-K317 WeakPolarHBondContact OE2-CE 3.05Å; E288-K317 IonicContact OE2-NZ 3.66Å; E288-K317 PolarHBondContact OE2-NZ 3.23Å
289	I	83.8	Confident	76.5	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.4	174	-54.4	173.6	0	0	0	107.9	V141 I144 V274 L279 V292 I314 L316	V141-I289 HydrophobicContact CB-CD1 4.06Å; V141-I289 HydrophobicContact CG1-CD1 3.64Å; I144-I289 HydrophobicContact CD1-CD1 4.35Å; I144-I289 HydrophobicContact CD1-CG1 3.94Å; V274-I289 HydrophobicContact CG1-CB 4.19Å; V274-I289 HydrophobicContact CG1-CG2 3.93Å; V274-I289 HydrophobicContact CG2-CG2 3.72Å; L279-I289 HydrophobicContact CD2-CD1 4.31Å; I289-V292 HydrophobicContact CG2-CG2 4.23Å; I289-I314 HydrophobicContact CG2-CG2 4.4Å; I289-L316 HydrophobicContact CB-CD2 4.44Å; I289-L316 HydrophobicContact CG1-CD2 3.87Å
290	Q	82.7	Confident	77.7	Confident	98 Å²	98	75.5 Å²	75.5	46%	0.458	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-45	-178.8	-59.9	-158.8	-70.3	0	0	112.5	H315 K317	Q290-H315 HydrophobicContact CB-CB 4.41Å; Q290-H315 PolarHBondContact N-O 3.1Å; Q290-K317 HydrophobicContact CG-CB 3.91Å
291	S	84.2	Confident	79.2	Confident	30 Å²	30	72.3 Å²	72.3	21%	0.21	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	158.6	177.2	67.5	0	0	0	0	111.9	H293 H315	S291-H293 WeakPolarHBondContact CB-NE2 3.4Å; S291-H293 PolarHBondContact OG-CD2 2.99Å; S291-H293 PolarHBondContact OG-NE2 3.38Å; S291-H315 PolarHBondContact O-N 2.89Å; S291-H315 PolarHBondContact OG-CD2 3.44Å; S291-H315 VanDerWaalsContact OG-CD2 3.24Å
292	V	86.4	Confident	80.6	Confident	13 Å²	13	75.4 Å²	75.4	8%	0.079	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.6	170.4	175.7	0	0	0	0	108.2	A273 V274 I289 F294 I312 A313 I314	A273-V292 HydrophobicContact CB-CB 4.25Å; A273-V292 HydrophobicContact CB-CG1 4.46Å; V274-V292 HydrophobicContact CG2-CB 3.99Å; V274-V292 HydrophobicContact CG2-CG2 3.57Å; I289-V292 HydrophobicContact CG2-CG2 4.23Å; V292-F294 HydrophobicContact CG1-CD2 4.47Å; V292-F294 HydrophobicContact CG1-CE2 3.75Å; V292-F294 HydrophobicContact CG1-CZ 3.86Å; V292-I312 HydrophobicContact CG1-CG2 3.54Å; V292-A313 CarbonylContact C-O 3.51Å; V292-A313 WeakPolarHBondContact CA-O 3.36Å; V292-I314 HydrophobicContact CG2-CG1 4.28Å; V292-I314 HydrophobicContact CG2-CG2 4.21Å
293	H	88.6	Confident	82	Confident	99 Å²	99	79.9 Å²	79.9	46%	0.458	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.2	-177	-60.4	-52.9	0	0	0	111.1	S291 I312 A313 H315	S291-H293 WeakPolarHBondContact CB-NE2 3.4Å; S291-H293 PolarHBondContact OG-CD2 2.99Å; S291-H293 PolarHBondContact OG-NE2 3.38Å; H293-I312 CarbonylContact O-C 3.52Å; H293-I312 WeakPolarHBondContact O-CA 3.4Å; H293-A313 PolarHBondContact N-O 3.35Å; H293-A313 PolarHBondContact O-N 3.45Å; H293-H315 AromaticContact CD2-CD2 3.59Å; H293-H315 AromaticContact CD2-NE2 3.59Å
294	F	90.1	Very high	83.1	Confident	33 Å²	33	79.1 Å²	79.1	15%	0.145	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.1	-176.3	-58.6	-104.4	0	0	0	110.3	P267 T269 A273 V292 I312	P267-F294 HydrophobicContact CB-CB 3.55Å; P267-F294 HydrophobicContact CB-CD1 4.33Å; P267-F294 HydrophobicContact CB-CG 4.27Å; P267-F294 HydrophobicContact CG-CB 4.37Å; T269-F294 HydrophobicContact CG2-CD2 3.82Å; T269-F294 HydrophobicContact CG2-CE2 4.03Å; A273-F294 HydrophobicContact CB-CE2 3.59Å; A273-F294 HydrophobicContact CB-CZ 4.07Å; V292-F294 HydrophobicContact CG1-CD2 4.47Å; V292-F294 HydrophobicContact CG1-CE2 3.75Å; V292-F294 HydrophobicContact CG1-CZ 3.86Å; F294-I312 HydrophobicContact CD1-CD1 3.92Å; F294-I312 HydrophobicContact CD1-CG1 3.65Å; F294-I312 HydrophobicContact CD1-CG2 4.41Å; F294-I312 HydrophobicContact CE1-CD1 3.71Å; F294-I312 HydrophobicContact CE1-CG1 3.89Å; F294-I312 HydrophobicContact CE1-CG2 4.21Å
295	V	89.4	Confident	84.1	Confident	67 Å²	67	76.8 Å²	76.8	41%	0.406	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	111.3	-179.5	-172.3	0	0	0	0	109.9	K297 S311	V295-K297 HydrophobicContact CG1-CG 4.02Å; V295-S311 PolarHBondContact N-O 2.84Å; V295-S311 WeakPolarHBondContact O-CB 3.44Å; V295-S311 PolarHBondContact O-N 3.31Å
296	R	90.7	Very high	84.9	Confident	72 Å²	72	76.6 Å²	76.6	27%	0.272	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.3	168.7	-174	179.8	174.5	-171.2	-6.4	109.6	E260 L264 L265 P267	E260-R296 IonicContact OE1-NH2 2.85Å; L264-R296 VanDerWaalsContact CG-NH2 3.3Å; L265-R296 WeakPolarHBondContact O-CD 3.49Å; L265-R296 VanDerWaalsContact O-CZ 3.27Å; L265-R296 PolarHBondContact O-NE 3.31Å; L265-R296 PolarHBondContact O-NH1 3.45Å; P267-R296 HydrophobicContact CG-CB 4.14Å
297	K	90.5	Very high	85.2	Confident	89 Å²	89	76.5 Å²	76.5	39%	0.387	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	159.4	175.9	-66	-178.6	-179.4	174.8	0	110	V295 Q308 Y309	V295-K297 HydrophobicContact CG1-CG 4.02Å; K297-Q308 WeakPolarHBondContact O-CA 3.39Å; K297-Y309 HydrophobicContact CB-CD1 4.12Å; K297-Y309 HydrophobicContact CB-CD2 4.19Å; K297-Y309 HydrophobicContact CB-CE1 3.65Å; K297-Y309 HydrophobicContact CB-CE2 3.74Å; K297-Y309 HydrophobicContact CB-CG 4.38Å; K297-Y309 VanDerWaalsContact CB-CZ 3.45Å; K297-Y309 HydrophobicContact CD-CE2 3.71Å; K297-Y309 VanDerWaalsContact CD-OH 3.29Å; K297-Y309 WeakPolarHBondContact CD-OH 3.3Å; K297-Y309 HydrophobicContact CG-CE2 4.19Å; K297-Y309 PolarHBondContact N-O 3.07Å; K297-Y309 PolarHBondContact O-N 2.74Å
298	K	88.8	Confident	85.5	Confident	128 Å²	128	76.2 Å²	76.2	56%	0.557	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	149.1	173.6	-55.8	-171.6	-170.5	-169.3	0	109.4	E260 Y307	E260-K298 WeakPolarHBondContact OE1-CD 3.29Å; E260-K298 WeakPolarHBondContact OE1-CE 3.37Å; E260-K298 IonicContact OE1-NZ 2.7Å; E260-K298 PolarHBondContact OE1-NZ 3.34Å; K298-Y307 CarbonylContact C-O 3.55Å; K298-Y307 VanDerWaalsContact CA-O 3.29Å; K298-Y307 WeakPolarHBondContact CA-O 3.33Å
299	Y	85.3	Confident	86	Confident	103 Å²	103	75.5 Å²	75.5	40%	0.404	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	152.1	167.8	75	-89.4	0	0	0	110.2	Y307 Y309	Y299-Y307 HydrophobicContact CE1-CG 4.22Å; Y299-Y307 AromaticContact CE2-CD2 3.83Å; Y299-Y307 HydrophobicContact CE2-CD2 3.83Å; Y299-Y307 HydrophobicContact CE2-CG 4.17Å; Y299-Y307 AromaticContact CZ-CD2 3.9Å; Y299-Y307 AromaticContact CZ-CG 3.78Å; Y299-Y307 PolarHBondContact N-O 3.34Å; Y299-Y307 PolarHBondContact O-N 3.26Å; Y299-Y309 AromaticContact CD1-CD1 3.96Å; Y299-Y309 HydrophobicContact CD1-CD1 3.96Å; Y299-Y309 HydrophobicContact CD1-CE1 4.15Å
300	R	83.7	Confident	86.4	Confident	163 Å²	163	75.2 Å²	75.2	62%	0.615	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	135.8	165.3	-88.3	-176.6	141.1	77.7	10.7	108.6	N304 V305 T306	R300-N304 PolarHBondContact NE-OD1 3.48Å; R300-N304 PolarHBondContact NH2-OD1 3.28Å; R300-V305 WeakPolarHBondContact CA-O 3.38Å; R300-T306 HydrophobicContact CG-CG2 3.77Å
301	S	82.3	Confident	86.8	Confident	30 Å²	30	70.8 Å²	70.8	21%	0.21	34%	0.339	C	S	.	.			trans	-78.9	165.8	164.6	65.9	0	0	0	0	110.8	M303 N304 V305	S301-M303 PolarHBondContact O-N 2.9Å; S301-M303 VanDerWaalsContact O-N 3.15Å; S301-M303 PolarHBondContact OG-N 2.99Å; S301-N304 WeakPolarHBondContact O-CA 3.47Å; S301-N304 PolarHBondContact O-N 3.35Å; S301-V305 PolarHBondContact N-O 3.21Å; S301-V305 PolarHBondContact OG-N 3Å; S301-V305 PolarHBondContact OG-O 2.97Å
302	D	83.3	Confident	87.2	Confident	178 Å²	178	69.4 Å²	69.4	95%	0.952	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-24	171.7	-66.3	-31.6	0	0	0	112.4	N304	D302-N304 PolarHBondContact O-N 2.94Å
303	M	82.4	Confident	87.4	Confident	144 Å²	144	69.2 Å²	69.2	71%	0.709	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	8.8	173.6	-56	-60	-69.3	0	0	113.5	S301 V305	S301-M303 PolarHBondContact O-N 2.9Å; S301-M303 VanDerWaalsContact O-N 3.15Å; S301-M303 PolarHBondContact OG-N 2.99Å; M303-V305 HydrophobicContact CB-CG2 4.34Å; M303-V305 PolarHBondContact O-N 2.77Å; M303-V305 VanDerWaalsContact O-N 3.09Å
304	N	80.3	Confident	87.4	Confident	109 Å²	109	64.7 Å²	64.7	58%	0.583	31%	0.308	S	S	*	.	S	Bend	trans	61.2	10.7	-177.8	-163.6	16.9	0	0	0	115.3	R300 S301 D302	R300-N304 PolarHBondContact NE-OD1 3.48Å; R300-N304 PolarHBondContact NH2-OD1 3.28Å; S301-N304 WeakPolarHBondContact O-CA 3.47Å; S301-N304 PolarHBondContact O-N 3.35Å; D302-N304 PolarHBondContact O-N 2.94Å
305	V	80	Confident	87.4	Confident	60 Å²	60	65.6 Å²	65.6	36%	0.364	31%	0.312	S	S	.	.			trans	-77.7	134.7	173.6	-180	0	0	0	0	109.1	R300 S301 M303 Y307	R300-V305 WeakPolarHBondContact CA-O 3.38Å; S301-V305 PolarHBondContact N-O 3.21Å; S301-V305 PolarHBondContact OG-N 3Å; S301-V305 PolarHBondContact OG-O 2.97Å; M303-V305 HydrophobicContact CB-CG2 4.34Å; M303-V305 PolarHBondContact O-N 2.77Å; M303-V305 VanDerWaalsContact O-N 3.09Å; V305-Y307 HydrophobicContact CB-CD2 4.37Å; V305-Y307 HydrophobicContact CB-CE2 3.78Å; V305-Y307 HydrophobicContact CG1-CD2 4.1Å; V305-Y307 HydrophobicContact CG1-CE1 4.4Å; V305-Y307 HydrophobicContact CG1-CE2 3.62Å
306	T	84.2	Confident	87.4	Confident	35 Å²	35	62.5 Å²	62.5	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.2	170.4	52.9	0	0	0	0	110.9	E260 R300	E260-T306 WeakPolarHBondContact CB-O 3.39Å; E260-T306 PolarHBondContact N-O 3.35Å; E260-T306 WeakPolarHBondContact OE2-CB 3.38Å; E260-T306 PolarHBondContact OE2-OG1 3.5Å; R300-T306 HydrophobicContact CG-CG2 3.77Å
307	Y	86.8	Confident	87.3	Confident	69 Å²	69	61.9 Å²	61.9	27%	0.271	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	163.3	171.1	-68	-84.3	0	0	0	109.4	K298 Y299 V305	K298-Y307 CarbonylContact C-O 3.55Å; K298-Y307 VanDerWaalsContact CA-O 3.29Å; K298-Y307 WeakPolarHBondContact CA-O 3.33Å; Y299-Y307 HydrophobicContact CE1-CG 4.22Å; Y299-Y307 AromaticContact CE2-CD2 3.83Å; Y299-Y307 HydrophobicContact CE2-CD2 3.83Å; Y299-Y307 HydrophobicContact CE2-CG 4.17Å; Y299-Y307 AromaticContact CZ-CD2 3.9Å; Y299-Y307 AromaticContact CZ-CG 3.78Å; Y299-Y307 PolarHBondContact N-O 3.34Å; Y299-Y307 PolarHBondContact O-N 3.26Å; V305-Y307 HydrophobicContact CB-CD2 4.37Å; V305-Y307 HydrophobicContact CB-CE2 3.78Å; V305-Y307 HydrophobicContact CG1-CD2 4.1Å; V305-Y307 HydrophobicContact CG1-CE1 4.4Å; V305-Y307 HydrophobicContact CG1-CE2 3.62Å
308	Q	90.2	Very high	87.2	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.009	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159	-179.9	73.4	-162.6	-22.7	0	0	110.6	P255 L263 L265 K297	P255-Q308 VanDerWaalsContact CD-O 3.3Å; P255-Q308 WeakPolarHBondContact CD-O 3.33Å; P255-Q308 HydrophobicContact CG-CG 4.08Å; L263-Q308 PolarHBondContact O-NE2 3.45Å; L265-Q308 VanDerWaalsContact N-NE2 3.14Å; K297-Q308 WeakPolarHBondContact O-CA 3.39Å
309	Y	92	Very high	87.1	Confident	57 Å²	57	54.3 Å²	54.3	22%	0.224	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	154.3	168	60.2	-83.1	0	0	0	110.6	I252 L253 K297 Y299	I252-Y309 HydrophobicContact CG2-CD2 3.8Å; I252-Y309 HydrophobicContact CG2-CG 4.25Å; L253-Y309 CarbonylContact O-C 3.51Å; L253-Y309 WeakPolarHBondContact O-CA 3.46Å; L253-Y309 VanDerWaalsContact O-CB 3.31Å; L253-Y309 WeakPolarHBondContact O-CB 3.34Å; K297-Y309 HydrophobicContact CB-CD1 4.12Å; K297-Y309 HydrophobicContact CB-CD2 4.19Å; K297-Y309 HydrophobicContact CB-CE1 3.65Å; K297-Y309 HydrophobicContact CB-CE2 3.74Å; K297-Y309 HydrophobicContact CB-CG 4.38Å; K297-Y309 VanDerWaalsContact CB-CZ 3.45Å; K297-Y309 HydrophobicContact CD-CE2 3.71Å; K297-Y309 VanDerWaalsContact CD-OH 3.29Å; K297-Y309 WeakPolarHBondContact CD-OH 3.3Å; K297-Y309 HydrophobicContact CG-CE2 4.19Å; K297-Y309 PolarHBondContact N-O 3.07Å; K297-Y309 PolarHBondContact O-N 2.74Å; Y299-Y309 AromaticContact CD1-CD1 3.96Å; Y299-Y309 HydrophobicContact CD1-CD1 3.96Å; Y299-Y309 HydrophobicContact CD1-CE1 4.15Å
310	V	92.2	Very high	87.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.2	168	178.5	0	0	0	0	107.3	I137 L253 L265 P267 I312	I137-V310 HydrophobicContact CG2-CG2 4.22Å; L253-V310 HydrophobicContact CB-CB 4.31Å; L253-V310 PolarHBondContact N-O 3.12Å; L253-V310 PolarHBondContact O-N 3.13Å; L265-V310 HydrophobicContact CB-CG2 3.82Å; L265-V310 HydrophobicContact CD1-CG2 4.35Å; P267-V310 HydrophobicContact CB-CG1 4.03Å; V310-I312 HydrophobicContact CG1-CG1 4.15Å
311	S	92.5	Very high	87.3	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	111	175.9	-179.6	0	0	0	0	108.3	V295	V295-S311 PolarHBondContact N-O 2.84Å; V295-S311 WeakPolarHBondContact O-CB 3.44Å; V295-S311 PolarHBondContact O-N 3.31Å
312	I	91	Very high	87.5	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.7	174.7	-57.6	174.4	0	0	0	107.3	Y139 F250 L251 L253 V292 H293 F294 V310 I314	Y139-I312 HydrophobicContact CG-CD1 4.48Å; F250-I312 CarbonylContact C-O 3.58Å; F250-I312 WeakPolarHBondContact CA-O 3.4Å; L251-I312 HydrophobicContact CB-CB 4.16Å; L251-I312 HydrophobicContact CD2-CD1 4.01Å; L251-I312 HydrophobicContact CG-CB 4.49Å; L251-I312 HydrophobicContact CG-CD1 4.37Å; L251-I312 PolarHBondContact N-O 3.5Å; L251-I312 PolarHBondContact O-N 2.87Å; L253-I312 HydrophobicContact CD1-CD1 3.55Å; L253-I312 HydrophobicContact CD1-CG1 4.36Å; L253-I312 HydrophobicContact CG-CD1 4.41Å; V292-I312 HydrophobicContact CG1-CG2 3.54Å; H293-I312 CarbonylContact O-C 3.52Å; H293-I312 WeakPolarHBondContact O-CA 3.4Å; F294-I312 HydrophobicContact CD1-CD1 3.92Å; F294-I312 HydrophobicContact CD1-CG1 3.65Å; F294-I312 HydrophobicContact CD1-CG2 4.41Å; F294-I312 HydrophobicContact CE1-CD1 3.71Å; F294-I312 HydrophobicContact CE1-CG1 3.89Å; F294-I312 HydrophobicContact CE1-CG2 4.21Å; V310-I312 HydrophobicContact CG1-CG1 4.15Å; I312-I314 HydrophobicContact CG2-CG1 4.23Å
313	A	91.5	Very high	87.6	Confident	9 Å²	9	43.9 Å²	43.9	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.2	174.8	0	0	0	0	0	109.2	T248 F250 V292 H293	T248-A313 HydrophobicContact CG2-CB 4.44Å; F250-A313 HydrophobicContact CD1-CB 3.91Å; F250-A313 HydrophobicContact CE1-CB 3.74Å; V292-A313 CarbonylContact C-O 3.51Å; V292-A313 WeakPolarHBondContact CA-O 3.36Å; H293-A313 PolarHBondContact N-O 3.35Å; H293-A313 PolarHBondContact O-N 3.45Å
314	I	89.1	Confident	87.8	Confident	3 Å²	3	37 Å²	37	2%	0.015	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.3	177.8	-53.1	177.2	0	0	0	107.2	V141 I156 C249 I289 V292 I312 L316	V141-I314 HydrophobicContact CG2-CD1 4.33Å; I156-I314 HydrophobicContact CD1-CD1 3.71Å; C249-I314 PolarHBondContact N-O 3.42Å; C249-I314 PolarHBondContact O-N 3.17Å; I289-I314 HydrophobicContact CG2-CG2 4.4Å; V292-I314 HydrophobicContact CG2-CG1 4.28Å; V292-I314 HydrophobicContact CG2-CG2 4.21Å; I312-I314 HydrophobicContact CG2-CG1 4.23Å; I314-L316 HydrophobicContact CG2-CD2 3.73Å; I314-L316 HydrophobicContact CG2-CG 4.15Å
315	H	89.9	Confident	88.1	Confident	52 Å²	52	34.7 Å²	34.7	24%	0.241	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119	177.9	-65.7	-82.7	0	0	0	110.1	T248 Q290 S291 H293	T248-H315 WeakPolarHBondContact CG2-CE1 3.29Å; T248-H315 PolarHBondContact OG1-CE1 2.99Å; T248-H315 PolarHBondContact OG1-ND1 3.39Å; Q290-H315 HydrophobicContact CB-CB 4.41Å; Q290-H315 PolarHBondContact N-O 3.1Å; S291-H315 PolarHBondContact O-N 2.89Å; S291-H315 PolarHBondContact OG-CD2 3.44Å; S291-H315 VanDerWaalsContact OG-CD2 3.24Å; H293-H315 AromaticContact CD2-CD2 3.59Å; H293-H315 AromaticContact CD2-NE2 3.59Å
316	L	88	Confident	88.5	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.1	-176.1	-58	-179.7	0	0	0	110	I144 F147 L154 Y246 Q247 W287 E288 I289 I314	I144-L316 HydrophobicContact CD1-CD1 4.4Å; I144-L316 HydrophobicContact CD1-CD2 3.65Å; F147-L316 HydrophobicContact CE2-CD1 4.45Å; L154-L316 HydrophobicContact CD1-CD1 3.95Å; L154-L316 HydrophobicContact CD2-CD1 4.02Å; Y246-L316 CarbonylContact C-O 3.6Å; Y246-L316 WeakPolarHBondContact CA-O 3.46Å; Q247-L316 HydrophobicContact CB-CB 4.37Å; Q247-L316 PolarHBondContact N-O 3.47Å; Q247-L316 PolarHBondContact O-N 3.09Å; W287-L316 HydrophobicContact CE3-CB 3.88Å; W287-L316 HydrophobicContact CZ3-CB 4.29Å; E288-L316 WeakPolarHBondContact O-CA 3.15Å; I289-L316 HydrophobicContact CB-CD2 4.44Å; I289-L316 HydrophobicContact CG1-CD2 3.87Å; I314-L316 HydrophobicContact CG2-CD2 3.73Å; I314-L316 HydrophobicContact CG2-CG 4.15Å
317	K	88.7	Confident	88.6	Confident	60 Å²	60	34.4 Å²	34.4	26%	0.261	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.5	174.6	169.2	-176.2	159.1	-135.6	0	108.9	Y246 E288 Q290	Y246-K317 HydrophobicContact CD1-CB 3.95Å; Y246-K317 HydrophobicContact CD1-CG 4.17Å; Y246-K317 HydrophobicContact CE1-CB 4Å; Y246-K317 HydrophobicContact CE1-CD 3.77Å; Y246-K317 HydrophobicContact CE1-CG 3.8Å; E288-K317 HydrophobicContact CB-CB 4.47Å; E288-K317 PolarHBondContact N-O 3.02Å; E288-K317 PolarHBondContact O-N 3.44Å; E288-K317 IonicContact OE1-NZ 3.2Å; E288-K317 WeakPolarHBondContact OE2-CD 3.46Å; E288-K317 WeakPolarHBondContact OE2-CE 3.05Å; E288-K317 IonicContact OE2-NZ 3.66Å; E288-K317 PolarHBondContact OE2-NZ 3.23Å; Q290-K317 HydrophobicContact CG-CB 3.91Å
318	R	88.1	Confident	88.4	Confident	3 Å²	3	31.2 Å²	31.2	1%	0.011	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	146.9	176.3	-156.5	-172.7	-59.1	-97.8	-1.8	111.4	F242 D245 E286 W287 P320	F242-R318 VanDerWaalsContact CE2-CZ 3.46Å; D245-R318 PolarHBondContact O-N 3.44Å; D245-R318 VanDerWaalsContact O-N 3.16Å; D245-R318 IonicContact OD1-CZ 2.81Å; D245-R318 IonicContact OD1-NE 3.18Å; D245-R318 PolarHBondContact OD1-NE 3.34Å; D245-R318 IonicContact OD1-NH2 2.86Å; D245-R318 PolarHBondContact OD1-NH2 3.5Å; D245-R318 IonicContact OD2-CZ 3.09Å; D245-R318 IonicContact OD2-NE 2.77Å; D245-R318 PolarHBondContact OD2-NE 2.87Å; D245-R318 IonicContact OD2-NH2 2.66Å; D245-R318 PolarHBondContact OD2-NH2 2.8Å; E286-R318 HydrophobicContact CG-CG 3.93Å; E286-R318 CarbonylContact O-C 3.59Å; E286-R318 WeakPolarHBondContact O-CA 3.41Å; E286-R318 IonicContact OE1-CZ 2.79Å; E286-R318 IonicContact OE1-NH1 2.7Å; E286-R318 PolarHBondContact OE1-NH1 3.19Å; E286-R318 IonicContact OE2-NH1 3.83Å; W287-R318 HydrophobicContact CE3-CB 4.16Å; W287-R318 HydrophobicContact CH2-CB 4.22Å; W287-R318 HydrophobicContact CH2-CG 4.38Å; W287-R318 VanDerWaalsContact CH2-CZ 3.49Å; W287-R318 VanDerWaalsContact CH2-NH2 3.33Å; W287-R318 HydrophobicContact CZ2-CG 4.43Å; W287-R318 HydrophobicContact CZ3-CB 3.88Å; W287-R318 HydrophobicContact CZ3-CG 4.4Å; R318-P320 WeakPolarHBondContact O-CD 3.48Å
319	Q	87.4	Confident	88	Confident	54 Å²	54	32 Å²	32	25%	0.252	16%	0.155	S	C	.	.			trans	-89.7	106.3	167.1	-60.2	-165.5	17.6	0	0	110	S285 E286 L321	S285-Q319 VanDerWaalsContact O-CD 3.31Å; S285-Q319 PolarHBondContact O-NE2 3.34Å; E286-Q319 PolarHBondContact O-N 3.46Å; Q319-L321 VanDerWaalsContact C-N 3.29Å; Q319-L321 PolarHBondContact O-N 2.99Å
320	P	88.1	Confident	87.7	Confident	15 Å²	15	31.1 Å²	31.1	10%	0.097	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.6	-169.3	31.8	-38.2	0	0	0	114.6	Y20 P243 F244 R318 Y322 F323 I324	Y20-P320 HydrophobicContact CE2-CG 4.42Å; P243-P320 HydrophobicContact CG-CB 4.4Å; F244-P320 HydrophobicContact CD1-CB 3.69Å; F244-P320 HydrophobicContact CD1-CG 3.71Å; F244-P320 HydrophobicContact CE1-CB 3.52Å; F244-P320 HydrophobicContact CE1-CG 3.61Å; F244-P320 HydrophobicContact CG-CB 4.46Å; F244-P320 HydrophobicContact CZ-CB 4.17Å; R318-P320 WeakPolarHBondContact O-CD 3.48Å; P320-Y322 VanDerWaalsContact C-N 3.31Å; P320-Y322 PolarHBondContact O-N 3.21Å; P320-F323 PolarHBondContact O-N 2.83Å; P320-I324 HydrophobicContact CB-CD1 3.82Å; P320-I324 HydrophobicContact CB-CG1 4.29Å; P320-I324 HydrophobicContact CG-CD1 3.82Å; P320-I324 WeakPolarHBondContact O-CG1 2.99Å; P320-I324 PolarHBondContact O-N 3.45Å
321	L	86.4	Confident	87.3	Confident	74 Å²	74	31.2 Å²	31.2	39%	0.387	16%	0.156	S	C	.	.	H	α-helix	trans	-51.3	-43.8	-171.2	170.3	57.9	0	0	0	113.6	Y20 Q319 F323 I324 V325	Y20-L321 HydrophobicContact CD1-CD1 4.01Å; Y20-L321 HydrophobicContact CE1-CB 4.09Å; Y20-L321 HydrophobicContact CE1-CD1 3.68Å; Y20-L321 HydrophobicContact CE1-CD2 4.42Å; Y20-L321 HydrophobicContact CE1-CG 4.26Å; Q319-L321 VanDerWaalsContact C-N 3.29Å; Q319-L321 PolarHBondContact O-N 2.99Å; L321-F323 PolarHBondContact O-N 3.25Å; L321-I324 PolarHBondContact O-N 3.47Å; L321-V325 HydrophobicContact CD1-CG2 3.64Å; L321-V325 PolarHBondContact O-N 3.3Å
322	Y	86	Confident	86.7	Confident	143 Å²	143	32.5 Å²	32.5	56%	0.561	17%	0.165	S	C	*	.	H	α-helix	trans	-57	-50.3	177.4	178.4	-89.4	0	0	0	111.5	P320 L326	P320-Y322 VanDerWaalsContact C-N 3.31Å; P320-Y322 PolarHBondContact O-N 3.21Å; Y322-L326 HydrophobicContact CD1-CD1 4.37Å; Y322-L326 HydrophobicContact CD2-CD1 3.72Å; Y322-L326 HydrophobicContact CE1-CD1 4.03Å; Y322-L326 HydrophobicContact CE2-CD1 3.34Å; Y322-L326 HydrophobicContact CG-CD1 4.22Å; Y322-L326 WeakPolarHBondContact O-CB 3.42Å; Y322-L326 PolarHBondContact O-N 2.76Å
323	F	85.2	Confident	86.2	Confident	23 Å²	23	34.7 Å²	34.7	10%	0.101	18%	0.176	C	C	.	.	H	α-helix	trans	-71.2	-33	179.9	-62.7	-79.3	0	0	0	112.3	F242 P243 P320 L321 V327 L328	F242-F323 HydrophobicContact CE1-CD1 4.3Å; F242-F323 HydrophobicContact CE1-CE1 4.18Å; F242-F323 HydrophobicContact CE2-CZ 4.3Å; F242-F323 HydrophobicContact CZ-CD1 4.16Å; F242-F323 AromaticContact CZ-CE1 3.65Å; F242-F323 HydrophobicContact CZ-CE1 3.65Å; F242-F323 HydrophobicContact CZ-CE2 4.18Å; F242-F323 AromaticContact CZ-CZ 3.67Å; F242-F323 HydrophobicContact CZ-CZ 3.67Å; P243-F323 HydrophobicContact CB-CB 3.72Å; P243-F323 HydrophobicContact CB-CD2 3.69Å; P243-F323 HydrophobicContact CB-CE2 4.5Å; P243-F323 HydrophobicContact CB-CG 3.74Å; P243-F323 HydrophobicContact CG-CB 3.75Å; P243-F323 HydrophobicContact CG-CG 4.31Å; P320-F323 PolarHBondContact O-N 2.83Å; L321-F323 PolarHBondContact O-N 3.25Å; F323-V327 HydrophobicContact CD1-CG2 4.18Å; F323-V327 VanDerWaalsContact O-CA 3.31Å; F323-V327 WeakPolarHBondContact O-CA 3.35Å; F323-V327 WeakPolarHBondContact O-CB 3.47Å; F323-V327 PolarHBondContact O-N 3.47Å; F323-L328 PolarHBondContact O-N 2.78Å; F323-L328 VanDerWaalsContact O-N 3.14Å
324	I	85.7	Confident	85.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.179	C	C	.	.	I	π-helix	trans	-60.9	-56.4	173.3	-70.2	160.6	0	0	0	110.5	M16 Y20 F244 P320 L321 L328 V329	M16-I324 HydrophobicContact CE-CB 4.35Å; M16-I324 HydrophobicContact CE-CD1 3.98Å; M16-I324 HydrophobicContact CE-CG1 3.97Å; M16-I324 HydrophobicContact CE-CG2 3.43Å; M16-I324 VanDerWaalsContact CE-CG2 3.43Å; M16-I324 HydrophobicContact CG-CD1 4.17Å; M16-I324 HydrophobicContact CG-CG1 4.38Å; M16-I324 HydrophobicContact SD-CG1 4.29Å; M16-I324 HydrophobicContact SD-CG2 4.5Å; Y20-I324 HydrophobicContact CD2-CD1 3.54Å; Y20-I324 HydrophobicContact CE2-CD1 4.04Å; Y20-I324 HydrophobicContact CG-CD1 3.84Å; F244-I324 HydrophobicContact CE1-CD1 4.07Å; F244-I324 HydrophobicContact CE1-CG1 4.46Å; F244-I324 HydrophobicContact CZ-CD1 4.23Å; F244-I324 HydrophobicContact CZ-CG1 4.13Å; P320-I324 HydrophobicContact CB-CD1 3.82Å; P320-I324 HydrophobicContact CB-CG1 4.29Å; P320-I324 HydrophobicContact CG-CD1 3.82Å; P320-I324 WeakPolarHBondContact O-CG1 2.99Å; P320-I324 PolarHBondContact O-N 3.45Å; L321-I324 PolarHBondContact O-N 3.47Å; I324-L328 HydrophobicContact CG1-CD1 4.19Å; I324-L328 WeakPolarHBondContact O-CB 3.49Å; I324-L328 PolarHBondContact O-N 3.41Å; I324-L328 VanDerWaalsContact O-N 3.17Å; I324-V329 PolarHBondContact O-N 3.43Å
325	V	87.8	Confident	85.2	Confident	59 Å²	59	36.8 Å²	36.8	36%	0.358	19%	0.188	S	C	.	.	I	π-helix	trans	-74.4	-34.4	-171.5	172.4	0	0	0	0	112.2	L23 L321	L23-V325 HydrophobicContact CD2-CG2 4.2Å; L321-V325 HydrophobicContact CD1-CG2 3.64Å; L321-V325 PolarHBondContact O-N 3.3Å
326	L	87.8	Confident	84.6	Confident	79 Å²	79	36.6 Å²	36.6	41%	0.414	20%	0.195	S	C	.	.	I	π-helix	trans	-94	-29.9	-178.9	-62.9	174.2	0	0	0	113.9	Y322 P330 Y364	Y322-L326 HydrophobicContact CD1-CD1 4.37Å; Y322-L326 HydrophobicContact CD2-CD1 3.72Å; Y322-L326 HydrophobicContact CE1-CD1 4.03Å; Y322-L326 HydrophobicContact CE2-CD1 3.34Å; Y322-L326 HydrophobicContact CG-CD1 4.22Å; Y322-L326 WeakPolarHBondContact O-CB 3.42Å; Y322-L326 PolarHBondContact O-N 2.76Å; L326-P330 WeakPolarHBondContact O-CD 3.35Å; L326-P330 WeakPolarHBondContact O-CG 3.14Å; L326-Y364 PolarHBondContact O-OH 2.77Å
327	V	85.8	Confident	84.3	Confident	10 Å²	10	40.7 Å²	40.7	6%	0.061	22%	0.217	C	C	.	.	I	π-helix	trans	-101.5	-56	-179.1	-172.7	0	0	0	0	111.3	F323 P330 F331 V368 L382	F323-V327 HydrophobicContact CD1-CG2 4.18Å; F323-V327 VanDerWaalsContact O-CA 3.31Å; F323-V327 WeakPolarHBondContact O-CA 3.35Å; F323-V327 WeakPolarHBondContact O-CB 3.47Å; F323-V327 PolarHBondContact O-N 3.47Å; V327-P330 WeakPolarHBondContact O-CD 3.31Å; V327-F331 HydrophobicContact CG1-CD2 3.79Å; V327-F331 HydrophobicContact CG1-CE2 3.73Å; V327-F331 WeakPolarHBondContact O-CD2 3.35Å; V327-F331 PolarHBondContact O-N 3.48Å; V327-V368 HydrophobicContact CG1-CG1 3.9Å; V327-V368 HydrophobicContact CG1-CG2 4Å; V327-V368 HydrophobicContact CG2-CG1 4.34Å; V327-V368 HydrophobicContact CG2-CG2 4.16Å; V327-L382 HydrophobicContact CG1-CD1 4.07Å
328	L	82.9	Confident	83.7	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	21%	0.207	C	C	.	.	I	π-helix	trans	-69.7	-45.5	-172.7	-58.7	-179.3	0	0	0	112.4	I12 M16 F323 I324 F331 S332 L382 F385	I12-L328 HydrophobicContact CG2-CD1 4.22Å; I12-L328 HydrophobicContact CG2-CD2 4.33Å; M16-L328 HydrophobicContact SD-CD1 4Å; F323-L328 PolarHBondContact O-N 2.78Å; F323-L328 VanDerWaalsContact O-N 3.14Å; I324-L328 HydrophobicContact CG1-CD1 4.19Å; I324-L328 WeakPolarHBondContact O-CB 3.49Å; I324-L328 PolarHBondContact O-N 3.41Å; I324-L328 VanDerWaalsContact O-N 3.17Å; L328-F331 PolarHBondContact O-N 3.24Å; L328-S332 WeakPolarHBondContact O-CB 3.22Å; L328-S332 PolarHBondContact O-N 3.02Å; L328-S332 PolarHBondContact O-OG 3.02Å; L328-S332 VanDerWaalsContact O-OG 3.05Å; L328-L382 HydrophobicContact CD2-CD1 3.89Å; L328-F385 HydrophobicContact CD2-CD1 4.05Å; L328-F385 HydrophobicContact CD2-CE1 3.73Å; L328-F385 HydrophobicContact CD2-CZ 4.17Å
329	V	82.8	Confident	83	Confident	20 Å²	20	40.7 Å²	40.7	12%	0.121	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-50.8	-179	179.2	0	0	0	0	112.4	L24 I324 F331 S332 M333	L24-V329 HydrophobicContact CD2-CG2 3.72Å; I324-V329 PolarHBondContact O-N 3.43Å; V329-F331 PolarHBondContact O-N 2.93Å; V329-S332 PolarHBondContact O-N 3.21Å; V329-M333 WeakPolarHBondContact O-CG 3.28Å; V329-M333 PolarHBondContact O-N 3.45Å
330	P	86	Confident	82.5	Confident	38 Å²	38	41.6 Å²	41.6	25%	0.247	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-34.9	-177.7	-23.7	38.5	0	0	0	113.4	L326 V327 M333 L334 Y364	L326-P330 WeakPolarHBondContact O-CD 3.35Å; L326-P330 WeakPolarHBondContact O-CG 3.14Å; V327-P330 WeakPolarHBondContact O-CD 3.31Å; P330-M333 PolarHBondContact O-N 3.08Å; P330-L334 WeakPolarHBondContact O-CG 3.48Å; P330-L334 PolarHBondContact O-N 2.95Å; P330-Y364 HydrophobicContact CB-CE1 3.8Å; P330-Y364 HydrophobicContact CG-CE1 4.32Å
331	F	83.4	Confident	82	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-41.8	173	-80.2	-56.1	0	0	0	112	V327 L328 V329 M333 L334 S335 M361 Y364 V365 V368 F385 L386	V327-F331 HydrophobicContact CG1-CD2 3.79Å; V327-F331 HydrophobicContact CG1-CE2 3.73Å; V327-F331 WeakPolarHBondContact O-CD2 3.35Å; V327-F331 PolarHBondContact O-N 3.48Å; L328-F331 PolarHBondContact O-N 3.24Å; V329-F331 PolarHBondContact O-N 2.93Å; F331-M333 VanDerWaalsContact C-N 3.28Å; F331-M333 PolarHBondContact O-N 3.3Å; F331-L334 HydrophobicContact CD1-CD1 4.42Å; F331-L334 PolarHBondContact O-N 2.69Å; F331-S335 PolarHBondContact O-N 3.39Å; F331-S335 PolarHBondContact O-OG 3.27Å; F331-M361 HydrophobicContact CD1-CE 3.5Å; F331-M361 HydrophobicContact CD1-SD 3.43Å; F331-M361 WeakPolarHBondContact CD1-SD 3.41Å; F331-M361 HydrophobicContact CE1-CE 3.41Å; F331-M361 VanDerWaalsContact CE1-CE 3.41Å; F331-M361 HydrophobicContact CE1-SD 3.4Å; F331-M361 WeakPolarHBondContact CE1-SD 3.11Å; F331-M361 HydrophobicContact CZ-CE 4.47Å; F331-Y364 HydrophobicContact CD1-CD1 4.09Å; F331-Y364 HydrophobicContact CD2-CD1 4.16Å; F331-Y364 HydrophobicContact CD2-CE1 4.4Å; F331-Y364 AromaticContact CE1-CD1 3.66Å; F331-Y364 HydrophobicContact CE1-CD1 3.66Å; F331-Y364 HydrophobicContact CE1-CG 4.31Å; F331-Y364 AromaticContact CE2-CD1 3.71Å; F331-Y364 HydrophobicContact CE2-CD1 3.71Å; F331-Y364 HydrophobicContact CE2-CE1 4.17Å; F331-Y364 HydrophobicContact CG-CD1 4.33Å; F331-Y364 AromaticContact CZ-CD1 3.45Å; F331-Y364 HydrophobicContact CZ-CD1 3.45Å; F331-Y364 VanDerWaalsContact CZ-CD1 3.45Å; F331-Y364 HydrophobicContact CZ-CE1 4.35Å; F331-Y364 HydrophobicContact CZ-CG 4.19Å; F331-V365 HydrophobicContact CE1-CG2 3.83Å; F331-V365 HydrophobicContact CZ-CG2 3.74Å; F331-V368 HydrophobicContact CE2-CG2 4.06Å; F331-V368 HydrophobicContact CZ-CG2 4.44Å; F331-F385 HydrophobicContact CB-CE1 3.92Å; F331-F385 HydrophobicContact CB-CZ 4.16Å; F331-F385 HydrophobicContact CD2-CE1 4.28Å; F331-F385 HydrophobicContact CG-CE1 4.36Å; F331-L386 HydrophobicContact CD2-CD2 3.67Å; F331-L386 HydrophobicContact CE1-CD2 4.43Å; F331-L386 HydrophobicContact CE2-CD2 3.14Å; F331-L386 HydrophobicContact CZ-CD2 3.59Å
332	S	78.2	Confident	81.2	Confident	33 Å²	33	38.7 Å²	38.7	23%	0.231	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-34	173.8	-61.2	0	0	0	0	112.9	L328 V329 S335 A336	L328-S332 WeakPolarHBondContact O-CB 3.22Å; L328-S332 PolarHBondContact O-N 3.02Å; L328-S332 PolarHBondContact O-OG 3.02Å; L328-S332 VanDerWaalsContact O-OG 3.05Å; V329-S332 PolarHBondContact O-N 3.21Å; S332-S335 PolarHBondContact O-OG 3.21Å; S332-A336 WeakPolarHBondContact O-CB 3.39Å; S332-A336 PolarHBondContact O-N 3.02Å; S332-A336 VanDerWaalsContact O-N 3.08Å
333	M	82.1	Confident	80.7	Confident	47 Å²	47	36.1 Å²	36.1	23%	0.232	21%	0.213	C	C	.	.	H	α-helix	trans	-72.4	-37.6	174.4	-68.6	-62.5	169.4	0	0	112.5	I27 V329 P330 F331 A336 L337	I27-M333 HydrophobicContact CG2-CE 3.55Å; V329-M333 WeakPolarHBondContact O-CG 3.28Å; V329-M333 PolarHBondContact O-N 3.45Å; P330-M333 PolarHBondContact O-N 3.08Å; F331-M333 VanDerWaalsContact C-N 3.28Å; F331-M333 PolarHBondContact O-N 3.3Å; M333-A336 PolarHBondContact O-N 3.32Å; M333-L337 WeakPolarHBondContact O-CB 3.35Å; M333-L337 VanDerWaalsContact O-CG 3.29Å; M333-L337 WeakPolarHBondContact O-CG 3.32Å; M333-L337 PolarHBondContact O-N 2.98Å
334	L	83.2	Confident	80.2	Confident	28 Å²	28	38.1 Å²	38.1	15%	0.147	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-40.4	175.7	-73.5	170.9	0	0	0	112.3	P330 F331 L337 A338 L357 M361	P330-L334 WeakPolarHBondContact O-CG 3.48Å; P330-L334 PolarHBondContact O-N 2.95Å; F331-L334 HydrophobicContact CD1-CD1 4.42Å; F331-L334 PolarHBondContact O-N 2.69Å; L334-L337 PolarHBondContact O-N 3.43Å; L334-A338 PolarHBondContact O-N 2.93Å; L334-L357 HydrophobicContact CD2-CD2 4.15Å; L334-M361 HydrophobicContact CD1-SD 4.34Å
335	S	76.6	Confident	79.3	Confident	29 Å²	29	41.9 Å²	41.9	20%	0.203	25%	0.245	C	C	.	.	H	α-helix	trans	-71.6	-35.9	175.2	54.6	0	0	0	0	112.7	F331 S332 A338 C339 Q389	F331-S335 PolarHBondContact O-N 3.39Å; F331-S335 PolarHBondContact O-OG 3.27Å; S332-S335 PolarHBondContact O-OG 3.21Å; S335-A338 PolarHBondContact O-N 3.43Å; S335-C339 PolarHBondContact O-N 2.86Å; S335-Q389 VanDerWaalsContact CB-OE1 3.26Å; S335-Q389 PolarHBondContact OG-OE1 3.01Å; S335-Q389 VanDerWaalsContact OG-OE1 3.07Å
336	A	76.3	Confident	78.5	Confident	47 Å²	47	44 Å²	44	39%	0.388	25%	0.254	S	S	.	.	H	α-helix	trans	-61	-42.5	169.7	0	0	0	0	0	112.6	S332 M333 A338 C339 L340	S332-A336 WeakPolarHBondContact O-CB 3.39Å; S332-A336 PolarHBondContact O-N 3.02Å; S332-A336 VanDerWaalsContact O-N 3.08Å; M333-A336 PolarHBondContact O-N 3.32Å; A336-A338 VanDerWaalsContact C-N 3.32Å; A336-A338 PolarHBondContact O-N 2.76Å; A336-C339 WeakPolarHBondContact O-CB 3.17Å; A336-C339 PolarHBondContact O-N 3.33Å; A336-L340 PolarHBondContact O-N 3.5Å; A336-L340 VanDerWaalsContact O-N 3.14Å
337	L	81.6	Confident	77.6	Confident	89 Å²	89	42.3 Å²	42.3	47%	0.466	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-37.3	173.7	-75.5	169.2	0	0	0	112.2	M333 L334 L340 I341 L357	M333-L337 WeakPolarHBondContact O-CB 3.35Å; M333-L337 VanDerWaalsContact O-CG 3.29Å; M333-L337 WeakPolarHBondContact O-CG 3.32Å; M333-L337 PolarHBondContact O-N 2.98Å; L334-L337 PolarHBondContact O-N 3.43Å; L337-L340 HydrophobicContact CD2-CD1 4.44Å; L337-L340 WeakPolarHBondContact O-CB 3.42Å; L337-L340 PolarHBondContact O-N 3.04Å; L337-L340 VanDerWaalsContact O-N 3.13Å; L337-I341 PolarHBondContact O-N 3.22Å; L337-L357 HydrophobicContact CB-CD1 3.91Å; L337-L357 HydrophobicContact CB-CD2 4.41Å
338	A	76	Confident	76.8	Confident	5 Å²	5	44.1 Å²	44.1	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-32.8	176.1	0	0	0	0	0	113.2	L334 S335 A336 L340 I341 L357 L393	L334-A338 PolarHBondContact O-N 2.93Å; S335-A338 PolarHBondContact O-N 3.43Å; A336-A338 VanDerWaalsContact C-N 3.32Å; A336-A338 PolarHBondContact O-N 2.76Å; A338-L340 VanDerWaalsContact C-N 3.32Å; A338-I341 WeakPolarHBondContact O-CB 3.44Å; A338-I341 PolarHBondContact O-N 3.39Å; A338-L357 HydrophobicContact CB-CD1 3.92Å; A338-L393 HydrophobicContact CB-CD2 3.19Å
339	C	73.1	Confident	76.4	Confident	58 Å²	58	48.9 Å²	48.9	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-36	168.6	-69.3	0	0	0	0	112	S335 A336 I341 F342	S335-C339 PolarHBondContact O-N 2.86Å; A336-C339 WeakPolarHBondContact O-CB 3.17Å; A336-C339 PolarHBondContact O-N 3.33Å; C339-I341 VanDerWaalsContact C-N 3.29Å; C339-I341 PolarHBondContact O-N 3.16Å; C339-F342 PolarHBondContact O-N 3.26Å
340	L	77.1	Confident	76.1	Confident	72 Å²	72	49.1 Å²	49.1	38%	0.377	29%	0.292	S	S	.	.	H	α-helix	trans	-69.5	-19.8	177	-68.1	171.8	0	0	0	113.8	A336 L337 A338 F342 T343 L344	A336-L340 PolarHBondContact O-N 3.5Å; A336-L340 VanDerWaalsContact O-N 3.14Å; L337-L340 HydrophobicContact CD2-CD1 4.44Å; L337-L340 WeakPolarHBondContact O-CB 3.42Å; L337-L340 PolarHBondContact O-N 3.04Å; L337-L340 VanDerWaalsContact O-N 3.13Å; A338-L340 VanDerWaalsContact C-N 3.32Å; L340-F342 PolarHBondContact O-N 2.92Å; L340-F342 VanDerWaalsContact O-N 3.09Å; L340-T343 PolarHBondContact O-N 3.34Å; L340-T343 PolarHBondContact O-OG1 2.73Å; L340-L344 WeakPolarHBondContact O-CD1 3.49Å
341	I	77.5	Confident	75.9	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.036	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-56.4	-27.1	172.7	-68.1	-179.8	0	0	0	112	L337 A338 C339 T343 R350 V353 A354 L357 A400	L337-I341 PolarHBondContact O-N 3.22Å; A338-I341 WeakPolarHBondContact O-CB 3.44Å; A338-I341 PolarHBondContact O-N 3.39Å; C339-I341 VanDerWaalsContact C-N 3.29Å; C339-I341 PolarHBondContact O-N 3.16Å; I341-T343 VanDerWaalsContact C-N 3.29Å; I341-T343 PolarHBondContact O-N 2.7Å; I341-R350 HydrophobicContact CG2-CG 3.54Å; I341-R350 WeakPolarHBondContact O-CD 3.21Å; I341-R350 WeakPolarHBondContact O-CG 3.4Å; I341-R350 PolarHBondContact O-NE 3.39Å; I341-V353 HydrophobicContact CD1-CG1 4Å; I341-V353 HydrophobicContact CG1-CG1 3.94Å; I341-A354 HydrophobicContact CD1-CB 3.99Å; I341-A354 HydrophobicContact CG2-CB 4.47Å; I341-L357 HydrophobicContact CD1-CD1 3.64Å; I341-L357 HydrophobicContact CD1-CG 4.27Å; I341-L357 HydrophobicContact CG1-CD1 4.33Å; I341-A400 HydrophobicContact CG2-CB 4.36Å
342	F	70.1	Confident	75.9	Confident	22 Å²	22	53 Å²	53	10%	0.096	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-77.4	-7.6	180	-67.8	-90.5	0	0	0	114.4	C339 L340 R350 A396 L399 I873	C339-F342 PolarHBondContact O-N 3.26Å; L340-F342 PolarHBondContact O-N 2.92Å; L340-F342 VanDerWaalsContact O-N 3.09Å; F342-R350 VanDerWaalsContact CE1-NH2 3.29Å; F342-A396 HydrophobicContact CE2-CB 4.22Å; F342-A396 HydrophobicContact CZ-CB 4.46Å; F342-A396 WeakPolarHBondContact CZ-O 3.38Å; F342-L399 HydrophobicContact CE1-CB 4.14Å; F342-L399 HydrophobicContact CZ-CB 4.03Å; F342-I873 HydrophobicContact CB-CD1 4.22Å
343	T	75.5	Confident	76.2	Confident	88 Å²	88	54.2 Å²	54.2	54%	0.54	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-95.7	-9.8	176.4	70.7	0	0	0	0	113.8	L340 I341 D345	L340-T343 PolarHBondContact O-N 3.34Å; L340-T343 PolarHBondContact O-OG1 2.73Å; I341-T343 VanDerWaalsContact C-N 3.29Å; I341-T343 PolarHBondContact O-N 2.7Å; T343-D345 PolarHBondContact O-N 3.36Å
344	L	75.1	Confident	76.2	Confident	65 Å²	65	52.1 Å²	52.1	34%	0.34	31%	0.311	S	S	.	.			trans	-74.6	115.6	178.2	-83.7	65.6	0	0	0	111.1	L340 R350	L340-L344 WeakPolarHBondContact O-CD1 3.49Å; L344-R350 HydrophobicContact CB-CB 4.27Å; L344-R350 HydrophobicContact CB-CG 4.48Å
345	D	67.3	Low	76.3	Confident	81 Å²	81	55.7 Å²	55.7	43%	0.433	33%	0.33	S	S	.	.			trans	-68.3	-29.1	174.9	-97.6	13.1	0	0	0	112.7	T343 K862 R866	T343-D345 PolarHBondContact O-N 3.36Å; D345-K862 IonicContact OD2-NZ 3.6Å; D345-K862 PolarHBondContact OD2-NZ 3.13Å; D345-R866 IonicContact OD1-CZ 2.78Å; D345-R866 IonicContact OD1-NE 3.43Å; D345-R866 IonicContact OD1-NH2 3.97Å; D345-R866 PolarHBondContact OD1-NH2 2.94Å; D345-R866 IonicContact OD2-NH2 2.8Å; D345-R866 PolarHBondContact OD2-NH2 3.08Å; D345-R866 VanDerWaalsContact OD2-NH2 3.09Å
346	D	70.9	Confident	76.9	Confident	104 Å²	104	57.7 Å²	57.7	56%	0.556	34%	0.344	S	S	*	.			trans	-87.1	112.4	-176.6	-92.7	-42.8	0	0	0	112.2	G348 R350	D346-G348 PolarHBondContact O-N 3.41Å; D346-R350 WeakPolarHBondContact O-CB 3.32Å; D346-R350 PolarHBondContact O-N 2.92Å; D346-R350 VanDerWaalsContact O-N 3.08Å
347	T	67.7	Low	77.4	Confident	42 Å²	42	56.5 Å²	56.5	26%	0.258	33%	0.331	S	S	.	.	H	α-helix	trans	-68.6	-31.4	-170.2	55	0	0	0	0	115.4	L351 N404 Y407	T347-L351 PolarHBondContact O-N 3.05Å; T347-N404 WeakPolarHBondContact CB-OD1 3.14Å; T347-N404 PolarHBondContact O-ND2 3.02Å; T347-Y407 HydrophobicContact CG2-CD1 3.68Å; T347-Y407 HydrophobicContact CG2-CD2 4.36Å; T347-Y407 HydrophobicContact CG2-CE1 4.04Å; T347-Y407 HydrophobicContact CG2-CG 3.86Å
348	G	69	Low	77.6	Confident	49 Å²	49	54.6 Å²	54.6	51%	0.505	32%	0.323	S	S	.	.	H	α-helix	trans	-68.7	-48.1	178.1	0	0	0	0	0	112.3	D346 L351 S352	D346-G348 PolarHBondContact O-N 3.41Å; G348-L351 PolarHBondContact O-N 2.88Å; G348-S352 PolarHBondContact O-N 3.37Å
349	D	75.2	Confident	78.2	Confident	101 Å²	101	60.1 Å²	60.1	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-69.2	-36.5	179.9	-67.5	2	0	0	0	110.6	L351 S352 V353	D349-L351 VanDerWaalsContact C-N 3.3Å; D349-L351 PolarHBondContact O-N 3.16Å; D349-S352 PolarHBondContact O-N 3.43Å; D349-S352 PolarHBondContact O-OG 3.04Å; D349-V353 WeakPolarHBondContact O-CG2 3.29Å; D349-V353 PolarHBondContact O-N 3.27Å
350	R	77.2	Confident	79	Confident	25 Å²	25	59.5 Å²	59.5	9%	0.094	35%	0.347	C	S	.	.	H	α-helix	trans	-55.5	-41	173.9	-172.2	177.8	171.8	-159.8	-6.2	113	I341 F342 L344 D346 A354	I341-R350 HydrophobicContact CG2-CG 3.54Å; I341-R350 WeakPolarHBondContact O-CD 3.21Å; I341-R350 WeakPolarHBondContact O-CG 3.4Å; I341-R350 PolarHBondContact O-NE 3.39Å; F342-R350 VanDerWaalsContact CE1-NH2 3.29Å; L344-R350 HydrophobicContact CB-CB 4.27Å; L344-R350 HydrophobicContact CB-CG 4.48Å; D346-R350 WeakPolarHBondContact O-CB 3.32Å; D346-R350 PolarHBondContact O-N 2.92Å; D346-R350 VanDerWaalsContact O-N 3.08Å; R350-A354 WeakPolarHBondContact O-CB 3.22Å; R350-A354 PolarHBondContact O-N 3Å; R350-A354 VanDerWaalsContact O-N 3.15Å
351	L	80.2	Confident	79.3	Confident	59 Å²	59	56.1 Å²	56.1	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-73.3	-40.1	179.1	-178.9	60.2	0	0	0	112.5	T347 G348 D349 A354 L355 V401	T347-L351 PolarHBondContact O-N 3.05Å; G348-L351 PolarHBondContact O-N 2.88Å; D349-L351 VanDerWaalsContact C-N 3.3Å; D349-L351 PolarHBondContact O-N 3.16Å; L351-A354 PolarHBondContact O-N 3.12Å; L351-L355 HydrophobicContact CD1-CD1 4.33Å; L351-L355 HydrophobicContact CD1-CG 4.33Å; L351-L355 HydrophobicContact CG-CD1 4.27Å; L351-L355 WeakPolarHBondContact O-CG 3.35Å; L351-L355 PolarHBondContact O-N 3.11Å; L351-V401 HydrophobicContact CD1-CG2 3.79Å
352	S	84.4	Confident	79.7	Confident	63 Å²	63	58.9 Å²	58.9	44%	0.441	35%	0.347	S	S	.	.	H	α-helix	trans	-68	-37.7	179.9	67.6	0	0	0	0	112	G348 D349 S356	G348-S352 PolarHBondContact O-N 3.37Å; D349-S352 PolarHBondContact O-N 3.43Å; D349-S352 PolarHBondContact O-OG 3.04Å; S352-S356 WeakPolarHBondContact O-CB 3.46Å; S352-S356 PolarHBondContact O-N 2.92Å; S352-S356 PolarHBondContact O-OG 3.39Å
353	V	84.8	Confident	80.7	Confident	58 Å²	58	63.7 Å²	63.7	35%	0.352	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-43.3	172.2	176.7	0	0	0	0	111.2	I341 D349 L355 S356 L357	I341-V353 HydrophobicContact CD1-CG1 4Å; I341-V353 HydrophobicContact CG1-CG1 3.94Å; D349-V353 WeakPolarHBondContact O-CG2 3.29Å; D349-V353 PolarHBondContact O-N 3.27Å; V353-L355 PolarHBondContact O-N 3.2Å; V353-S356 WeakPolarHBondContact O-CB 3.48Å; V353-S356 PolarHBondContact O-N 3.42Å; V353-L357 PolarHBondContact O-N 3.36Å
354	A	82.4	Confident	81.2	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-58.6	-47.7	177.6	0	0	0	0	0	113.2	I341 R350 L351 S356 L357 V358 T397 A400	I341-A354 HydrophobicContact CD1-CB 3.99Å; I341-A354 HydrophobicContact CG2-CB 4.47Å; R350-A354 WeakPolarHBondContact O-CB 3.22Å; R350-A354 PolarHBondContact O-N 3Å; R350-A354 VanDerWaalsContact O-N 3.15Å; L351-A354 PolarHBondContact O-N 3.12Å; A354-S356 VanDerWaalsContact C-N 3.33Å; A354-S356 PolarHBondContact O-N 3.37Å; A354-L357 PolarHBondContact O-N 3.05Å; A354-V358 PolarHBondContact O-N 3.14Å; A354-T397 HydrophobicContact CB-CG2 3.96Å; A354-A400 HydrophobicContact CB-CB 4.42Å
355	L	85.1	Confident	81.8	Confident	104 Å²	104	60.5 Å²	60.5	55%	0.545	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-38.1	175.8	-67.1	171.4	0	0	0	111.7	L351 V353 V358 L359	L351-L355 HydrophobicContact CD1-CD1 4.33Å; L351-L355 HydrophobicContact CD1-CG 4.33Å; L351-L355 HydrophobicContact CG-CD1 4.27Å; L351-L355 WeakPolarHBondContact O-CG 3.35Å; L351-L355 PolarHBondContact O-N 3.11Å; V353-L355 PolarHBondContact O-N 3.2Å; L355-V358 PolarHBondContact O-N 2.84Å; L355-L359 WeakPolarHBondContact O-CG 3.43Å; L355-L359 PolarHBondContact O-N 3.4Å
356	S	88.7	Confident	82.8	Confident	70 Å²	70	60.8 Å²	60.8	49%	0.49	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-41.2	177.7	-58.6	0	0	0	0	112.4	S352 V353 A354 L359 S360	S352-S356 WeakPolarHBondContact O-CB 3.46Å; S352-S356 PolarHBondContact O-N 2.92Å; S352-S356 PolarHBondContact O-OG 3.39Å; V353-S356 WeakPolarHBondContact O-CB 3.48Å; V353-S356 PolarHBondContact O-N 3.42Å; A354-S356 VanDerWaalsContact C-N 3.33Å; A354-S356 PolarHBondContact O-N 3.37Å; S356-L359 PolarHBondContact O-N 3.28Å; S356-S360 PolarHBondContact O-N 3.13Å; S356-S360 PolarHBondContact O-OG 3.32Å
357	L	86.2	Confident	83.6	Confident	22 Å²	22	59 Å²	59	12%	0.115	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-40.3	176.3	-70.1	-166.8	0	0	0	112.2	L334 L337 A338 I341 V353 A354 S360 M361	L334-L357 HydrophobicContact CD2-CD2 4.15Å; L337-L357 HydrophobicContact CB-CD1 3.91Å; L337-L357 HydrophobicContact CB-CD2 4.41Å; A338-L357 HydrophobicContact CB-CD1 3.92Å; I341-L357 HydrophobicContact CD1-CD1 3.64Å; I341-L357 HydrophobicContact CD1-CG 4.27Å; I341-L357 HydrophobicContact CG1-CD1 4.33Å; V353-L357 PolarHBondContact O-N 3.36Å; A354-L357 PolarHBondContact O-N 3.05Å; L357-S360 WeakPolarHBondContact CA-OG 3.3Å; L357-S360 PolarHBondContact O-N 3.07Å; L357-S360 PolarHBondContact O-OG 2.79Å; L357-M361 WeakPolarHBondContact O-CB 3.47Å; L357-M361 PolarHBondContact O-N 2.72Å
358	V	85.4	Confident	84.5	Confident	49 Å²	49	57.6 Å²	57.6	30%	0.297	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176.1	172.3	0	0	0	0	111.4	A354 L355 M361 T362 T397	A354-V358 PolarHBondContact O-N 3.14Å; L355-V358 PolarHBondContact O-N 2.84Å; V358-M361 PolarHBondContact O-N 3.27Å; V358-T362 HydrophobicContact CG1-CG2 4.46Å; V358-T362 WeakPolarHBondContact O-CB 3.34Å; V358-T362 WeakPolarHBondContact O-CG2 3.46Å; V358-T362 PolarHBondContact O-N 2.89Å; V358-T362 PolarHBondContact O-OG1 2.86Å; V358-T397 HydrophobicContact CG2-CG2 3.49Å; V358-T397 VanDerWaalsContact CG2-CG2 3.49Å
359	L	89.3	Confident	85.2	Confident	121 Å²	121	58.2 Å²	58.2	63%	0.634	33%	0.33	S	S	*	.	H	α-helix	trans	-64.6	-44.6	175.1	-70.7	169.7	0	0	0	111.9	L355 S356 M361 T362 M363	L355-L359 WeakPolarHBondContact O-CG 3.43Å; L355-L359 PolarHBondContact O-N 3.4Å; S356-L359 PolarHBondContact O-N 3.28Å; L359-M361 PolarHBondContact O-N 2.65Å; L359-T362 PolarHBondContact O-OG1 3.17Å; L359-T362 VanDerWaalsContact O-OG1 3.06Å; L359-M363 PolarHBondContact O-N 2.91Å; L359-M363 VanDerWaalsContact O-N 3.16Å
360	S	89	Confident	85.6	Confident	46 Å²	46	57.3 Å²	57.3	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-65	-39.5	175.1	56.8	0	0	0	0	112.7	S356 L357 M363 Y364	S356-S360 PolarHBondContact O-N 3.13Å; S356-S360 PolarHBondContact O-OG 3.32Å; L357-S360 WeakPolarHBondContact CA-OG 3.3Å; L357-S360 PolarHBondContact O-N 3.07Å; L357-S360 PolarHBondContact O-OG 2.79Å; S360-M363 PolarHBondContact O-N 3.14Å; S360-Y364 WeakPolarHBondContact O-CB 3.18Å; S360-Y364 PolarHBondContact O-N 3.3Å
361	M	83.7	Confident	85.7	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-49.3	179.5	-179.9	71.8	-174.9	0	0	111.5	F331 L334 L357 V358 L359 M363 Y364 V365 Q389 L390 L393	F331-M361 HydrophobicContact CD1-CE 3.5Å; F331-M361 HydrophobicContact CD1-SD 3.43Å; F331-M361 WeakPolarHBondContact CD1-SD 3.41Å; F331-M361 HydrophobicContact CE1-CE 3.41Å; F331-M361 VanDerWaalsContact CE1-CE 3.41Å; F331-M361 HydrophobicContact CE1-SD 3.4Å; F331-M361 WeakPolarHBondContact CE1-SD 3.11Å; F331-M361 HydrophobicContact CZ-CE 4.47Å; L334-M361 HydrophobicContact CD1-SD 4.34Å; L357-M361 WeakPolarHBondContact O-CB 3.47Å; L357-M361 PolarHBondContact O-N 2.72Å; V358-M361 PolarHBondContact O-N 3.27Å; L359-M361 PolarHBondContact O-N 2.65Å; M361-M363 VanDerWaalsContact C-N 3.34Å; M361-M363 PolarHBondContact O-N 3.05Å; M361-Y364 PolarHBondContact O-N 3.02Å; M361-Y364 VanDerWaalsContact O-N 3.12Å; M361-V365 HydrophobicContact CE-CG2 3.97Å; M361-V365 WeakPolarHBondContact O-CG2 3.45Å; M361-V365 PolarHBondContact O-N 2.76Å; M361-Q389 HydrophobicContact CE-CB 3.57Å; M361-L390 HydrophobicContact CE-CD2 4.17Å; M361-L390 HydrophobicContact CE-CG 4.04Å; M361-L390 HydrophobicContact CG-CD2 3.69Å; M361-L393 HydrophobicContact CB-CD1 4.01Å; M361-L393 HydrophobicContact CE-CD1 3.85Å; M361-L393 HydrophobicContact CG-CD1 3.42Å; M361-L393 VanDerWaalsContact CG-CD1 3.42Å; M361-L393 HydrophobicContact SD-CD1 3.3Å; M361-L393 WeakPolarHBondContact SD-CD1 3.16Å
362	T	86.5	Confident	85.5	Confident	65 Å²	65	59.7 Å²	59.7	40%	0.399	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-41.6	179.6	48	0	0	0	0	111.4	V358 L359 Y364 V365 V366 L390	V358-T362 HydrophobicContact CG1-CG2 4.46Å; V358-T362 WeakPolarHBondContact O-CB 3.34Å; V358-T362 WeakPolarHBondContact O-CG2 3.46Å; V358-T362 PolarHBondContact O-N 2.89Å; V358-T362 PolarHBondContact O-OG1 2.86Å; L359-T362 PolarHBondContact O-OG1 3.17Å; L359-T362 VanDerWaalsContact O-OG1 3.06Å; T362-Y364 VanDerWaalsContact C-N 3.32Å; T362-Y364 PolarHBondContact O-N 2.84Å; T362-V365 PolarHBondContact O-N 3.34Å; T362-V366 WeakPolarHBondContact O-CG2 3.27Å; T362-V366 PolarHBondContact O-N 3.43Å; T362-L390 HydrophobicContact CG2-CD2 4.39Å
363	M	90.2	Very high	84.8	Confident	123 Å²	123	57.4 Å²	57.4	61%	0.606	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-39.4	172.8	-163	-176.6	86.4	0	0	112.2	L359 S360 M361 V366 I367	L359-M363 PolarHBondContact O-N 2.91Å; L359-M363 VanDerWaalsContact O-N 3.16Å; S360-M363 PolarHBondContact O-N 3.14Å; M361-M363 VanDerWaalsContact C-N 3.34Å; M361-M363 PolarHBondContact O-N 3.05Å; M363-V366 PolarHBondContact O-N 2.85Å; M363-I367 HydrophobicContact CE-CD1 4.07Å; M363-I367 HydrophobicContact CG-CD1 4.33Å; M363-I367 WeakPolarHBondContact O-CG1 3.33Å; M363-I367 PolarHBondContact O-N 2.99Å; M363-I367 VanDerWaalsContact O-N 3.08Å
364	Y	87.6	Confident	84.1	Confident	60 Å²	60	64.2 Å²	64.2	24%	0.235	35%	0.35	C	S	.	.	H	α-helix	trans	-70	-39.9	179.8	-146.2	-120.4	0	0	0	112.9	L326 P330 F331 S360 M361 T362 V366 I367 V368	L326-Y364 PolarHBondContact O-OH 2.77Å; P330-Y364 HydrophobicContact CB-CE1 3.8Å; P330-Y364 HydrophobicContact CG-CE1 4.32Å; F331-Y364 HydrophobicContact CD1-CD1 4.09Å; F331-Y364 HydrophobicContact CD2-CD1 4.16Å; F331-Y364 HydrophobicContact CD2-CE1 4.4Å; F331-Y364 AromaticContact CE1-CD1 3.66Å; F331-Y364 HydrophobicContact CE1-CD1 3.66Å; F331-Y364 HydrophobicContact CE1-CG 4.31Å; F331-Y364 AromaticContact CE2-CD1 3.71Å; F331-Y364 HydrophobicContact CE2-CD1 3.71Å; F331-Y364 HydrophobicContact CE2-CE1 4.17Å; F331-Y364 HydrophobicContact CG-CD1 4.33Å; F331-Y364 AromaticContact CZ-CD1 3.45Å; F331-Y364 HydrophobicContact CZ-CD1 3.45Å; F331-Y364 VanDerWaalsContact CZ-CD1 3.45Å; F331-Y364 HydrophobicContact CZ-CE1 4.35Å; F331-Y364 HydrophobicContact CZ-CG 4.19Å; S360-Y364 WeakPolarHBondContact O-CB 3.18Å; S360-Y364 PolarHBondContact O-N 3.3Å; M361-Y364 PolarHBondContact O-N 3.02Å; M361-Y364 VanDerWaalsContact O-N 3.12Å; T362-Y364 VanDerWaalsContact C-N 3.32Å; T362-Y364 PolarHBondContact O-N 2.84Å; Y364-V366 VanDerWaalsContact C-N 3.31Å; Y364-V366 PolarHBondContact O-N 3Å; Y364-I367 HydrophobicContact CD2-CD1 4.45Å; Y364-I367 PolarHBondContact O-N 3.35Å; Y364-V368 WeakPolarHBondContact O-CG2 3.2Å; Y364-V368 PolarHBondContact O-N 2.82Å
365	V	86.4	Confident	83.4	Confident	25 Å²	25	65.9 Å²	65.9	15%	0.152	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-39.1	172.3	174.6	0	0	0	0	111.2	F331 M361 T362 V368 S369 L390	F331-V365 HydrophobicContact CE1-CG2 3.83Å; F331-V365 HydrophobicContact CZ-CG2 3.74Å; M361-V365 HydrophobicContact CE-CG2 3.97Å; M361-V365 WeakPolarHBondContact O-CG2 3.45Å; M361-V365 PolarHBondContact O-N 2.76Å; T362-V365 PolarHBondContact O-N 3.34Å; V365-V368 PolarHBondContact O-N 3.14Å; V365-S369 VanDerWaalsContact O-CB 3.26Å; V365-S369 WeakPolarHBondContact O-CB 3.33Å; V365-S369 PolarHBondContact O-N 2.87Å; V365-S369 PolarHBondContact O-OG 3.41Å; V365-L390 HydrophobicContact CB-CD1 4.49Å; V365-L390 HydrophobicContact CG1-CD1 4.14Å; V365-L390 HydrophobicContact CG2-CD1 4.01Å; V365-L390 HydrophobicContact CG2-CD2 4.22Å; V365-L390 HydrophobicContact CG2-CG 4.04Å
366	V	88.5	Confident	82.2	Confident	87 Å²	87	68.2 Å²	68.2	53%	0.527	37%	0.371	S	S	.	.	H	α-helix	trans	-59.5	-51.4	173.9	170.2	0	0	0	0	111	T362 M363 Y364 V368 S369 T370	T362-V366 WeakPolarHBondContact O-CG2 3.27Å; T362-V366 PolarHBondContact O-N 3.43Å; M363-V366 PolarHBondContact O-N 2.85Å; Y364-V366 VanDerWaalsContact C-N 3.31Å; Y364-V366 PolarHBondContact O-N 3Å; V366-V368 VanDerWaalsContact C-N 3.31Å; V366-V368 PolarHBondContact O-N 3.05Å; V366-S369 WeakPolarHBondContact CA-OG 3.34Å; V366-S369 PolarHBondContact O-N 3.39Å; V366-S369 VanDerWaalsContact O-N 3.13Å; V366-S369 PolarHBondContact O-OG 2.78Å; V366-T370 PolarHBondContact O-N 3.03Å; V366-T370 PolarHBondContact O-OG1 2.96Å
367	I	88.7	Confident	81.4	Confident	68 Å²	68	71.8 Å²	71.8	35%	0.349	37%	0.374	S	S	.	.	H	α-helix	trans	-57.9	-42	179.6	-68.4	163	0	0	0	112	M363 Y364 T370 N371	M363-I367 HydrophobicContact CE-CD1 4.07Å; M363-I367 HydrophobicContact CG-CD1 4.33Å; M363-I367 WeakPolarHBondContact O-CG1 3.33Å; M363-I367 PolarHBondContact O-N 2.99Å; M363-I367 VanDerWaalsContact O-N 3.08Å; Y364-I367 HydrophobicContact CD2-CD1 4.45Å; Y364-I367 PolarHBondContact O-N 3.35Å; I367-T370 WeakPolarHBondContact CA-OG1 3.13Å; I367-T370 PolarHBondContact O-N 3.45Å; I367-T370 PolarHBondContact O-OG1 2.75Å; I367-N371 PolarHBondContact O-N 3.47Å; I367-N371 PolarHBondContact O-ND2 2.99Å
368	V	86.6	Confident	80.9	Confident	11 Å²	11	73.5 Å²	73.5	7%	0.067	39%	0.385	C	S	.	.	H	α-helix	trans	-71.8	-38.3	178	176	0	0	0	0	111	V327 F331 Y364 V365 V366 T370 N371 A372 L386	V327-V368 HydrophobicContact CG1-CG1 3.9Å; V327-V368 HydrophobicContact CG1-CG2 4Å; V327-V368 HydrophobicContact CG2-CG1 4.34Å; V327-V368 HydrophobicContact CG2-CG2 4.16Å; F331-V368 HydrophobicContact CE2-CG2 4.06Å; F331-V368 HydrophobicContact CZ-CG2 4.44Å; Y364-V368 WeakPolarHBondContact O-CG2 3.2Å; Y364-V368 PolarHBondContact O-N 2.82Å; V365-V368 PolarHBondContact O-N 3.14Å; V366-V368 VanDerWaalsContact C-N 3.31Å; V366-V368 PolarHBondContact O-N 3.05Å; V368-T370 VanDerWaalsContact C-N 3.28Å; V368-T370 PolarHBondContact O-N 3.44Å; V368-N371 PolarHBondContact O-N 2.94Å; V368-N371 VanDerWaalsContact O-N 3.13Å; V368-A372 WeakPolarHBondContact O-CB 3.13Å; V368-A372 PolarHBondContact O-N 3.25Å; V368-L386 HydrophobicContact CB-CD1 4.42Å; V368-L386 HydrophobicContact CG1-CD1 3.8Å
369	S	83.6	Confident	80.7	Confident	62 Å²	62	77 Å²	77	43%	0.434	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-24.3	176.3	76.7	0	0	0	0	114.1	V365 V366	V365-S369 VanDerWaalsContact O-CB 3.26Å; V365-S369 WeakPolarHBondContact O-CB 3.33Å; V365-S369 PolarHBondContact O-N 2.87Å; V365-S369 PolarHBondContact O-OG 3.41Å; V366-S369 WeakPolarHBondContact CA-OG 3.34Å; V366-S369 PolarHBondContact O-N 3.39Å; V366-S369 VanDerWaalsContact O-N 3.13Å; V366-S369 PolarHBondContact O-OG 2.78Å
370	T	83.4	Confident	80.5	Confident	82 Å²	82	72.2 Å²	72.2	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-77.3	-23.6	172.7	44.8	0	0	0	0	113.3	V366 I367 V368	V366-T370 PolarHBondContact O-N 3.03Å; V366-T370 PolarHBondContact O-OG1 2.96Å; I367-T370 WeakPolarHBondContact CA-OG1 3.13Å; I367-T370 PolarHBondContact O-N 3.45Å; I367-T370 PolarHBondContact O-OG1 2.75Å; V368-T370 VanDerWaalsContact C-N 3.28Å; V368-T370 PolarHBondContact O-N 3.44Å
371	N	78.3	Confident	80.3	Confident	108 Å²	108	70.7 Å²	70.7	58%	0.578	37%	0.367	S	S	*	.	H	α-helix	trans	-100.7	-18.9	-178	-63.5	-9.3	0	0	0	113.3	I367 V368	I367-N371 PolarHBondContact O-N 3.47Å; I367-N371 PolarHBondContact O-ND2 2.99Å; V368-N371 PolarHBondContact O-N 2.94Å; V368-N371 VanDerWaalsContact O-N 3.13Å
372	A	76.8	Confident	80.3	Confident	27 Å²	27	70.9 Å²	70.9	22%	0.223	37%	0.368	C	S	.	.	S	Bend	trans	-76.5	153	179	0	0	0	0	0	112.8	V368 R374	V368-A372 WeakPolarHBondContact O-CB 3.13Å; V368-A372 PolarHBondContact O-N 3.25Å; A372-R374 PolarHBondContact O-N 3.44Å
373	P	70.3	Confident	80.2	Confident	14 Å²	14	68.5 Å²	68.5	9%	0.091	36%	0.356	C	S	.	.			trans	-62.3	129.1	176.1	23.9	-33.8	0	0	0	112.5	Q149 V239 F242 S375	Q149-P373 HydrophobicContact CB-CB 4.08Å; V239-P373 HydrophobicContact CB-CG 4.2Å; V239-P373 HydrophobicContact CG1-CB 3.98Å; V239-P373 HydrophobicContact CG1-CG 3.93Å; F242-P373 HydrophobicContact CD1-CG 4.41Å; F242-P373 HydrophobicContact CD2-CG 3.83Å; F242-P373 HydrophobicContact CE1-CG 4.45Å; F242-P373 HydrophobicContact CE2-CG 3.85Å; F242-P373 HydrophobicContact CG-CG 4.11Å; F242-P373 VanDerWaalsContact CZ-CD 3.49Å; F242-P373 HydrophobicContact CZ-CG 4.18Å; P373-S375 VanDerWaalsContact C-N 3.31Å; P373-S375 PolarHBondContact O-N 3.26Å
374	R	69.6	Low	79.9	Confident	201 Å²	201	64.1 Å²	64.1	76%	0.758	34%	0.335	S	S	*	.			trans	-81.7	70.7	175.1	-64.3	-174.6	-176.4	176.6	2.6	111.7	A372	A372-R374 PolarHBondContact O-N 3.44Å
375	S	68	Low	79.7	Confident	38 Å²	38	62 Å²	62	27%	0.266	33%	0.327	S	S	.	.			trans	-79.3	141.8	169.4	-178.8	0	0	0	0	111.6	P373 R377	P373-S375 VanDerWaalsContact C-N 3.31Å; P373-S375 PolarHBondContact O-N 3.26Å; S375-R377 PolarHBondContact OG-N 3.43Å; S375-R377 VanDerWaalsContact OG-N 3.15Å
376	M	60	Low	79.6	Confident	152 Å²	152	61.5 Å²	61.5	75%	0.749	32%	0.323	S	S	*	.	S	Bend	trans	-107.6	-2.2	168.8	-61.7	-175	-68.5	0	0	112.6	Y669	M376-Y669 HydrophobicContact CE-CE1 4.21Å; M376-Y669 HydrophobicContact CE-CE2 4.31Å
377	R	70.9	Confident	79.4	Confident	145 Å²	145	62.4 Å²	62.4	55%	0.547	33%	0.325	S	S	.	.	S	Bend	trans	-84.7	-44.1	-177.1	-61.7	-172	-169.3	113.4	12.1	112.3	E152 L237 S375	E152-R377 IonicContact OE1-CZ 3.34Å; E152-R377 IonicContact OE1-NH1 2.68Å; E152-R377 PolarHBondContact OE1-NH1 3.43Å; E152-R377 IonicContact OE1-NH2 3.67Å; E152-R377 PolarHBondContact OE1-NH2 3.3Å; E152-R377 IonicContact OE2-CZ 2.62Å; E152-R377 IonicContact OE2-NH2 3.86Å; E152-R377 PolarHBondContact OE2-NH2 3.09Å; L237-R377 PolarHBondContact O-NH1 3.14Å; S375-R377 PolarHBondContact OG-N 3.43Å; S375-R377 VanDerWaalsContact OG-N 3.15Å
378	T	76.9	Confident	79	Confident	58 Å²	58	60.7 Å²	60.7	36%	0.356	32%	0.316	S	S	.	.	S	Bend	trans	-143.1	145.6	-177.8	49.5	0	0	0	0	109.4	S240	S240-T378 WeakPolarHBondContact OG-CB 3.45Å; S240-T378 WeakPolarHBondContact OG-CG2 3.41Å; S240-T378 PolarHBondContact OG-OG1 3.48Å
379	L	80	Confident	78.7	Confident	122 Å²	122	61 Å²	61	64%	0.639	32%	0.317	S	S	*	.			trans	-70.8	121.6	165.8	-82.7	160.3	0	0	0	107.7
380	P	85.4	Confident	78.6	Confident	21 Å²	21	60.5 Å²	60.5	14%	0.136	31%	0.309	C	S	.	.			trans	-64.1	145.5	177.7	27.3	-34.1	0	0	0	109.8	V239 F242 L382 G383 I384	V239-P380 HydrophobicContact CG2-CB 4.36Å; V239-P380 WeakPolarHBondContact O-CB 3.46Å; F242-P380 HydrophobicContact CB-CB 4.13Å; P380-L382 VanDerWaalsContact C-N 3.29Å; P380-L382 PolarHBondContact O-N 3.15Å; P380-G383 VanDerWaalsContact O-CA 3.3Å; P380-G383 WeakPolarHBondContact O-CA 3.35Å; P380-G383 PolarHBondContact O-N 3.48Å; P380-I384 PolarHBondContact O-N 3.08Å
381	V	84.4	Confident	78.5	Confident	15 Å²	15	57.8 Å²	57.8	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-34.2	-175	159.7	0	0	0	0	111.2	I12 S240 G383 I384 F385	I12-V381 HydrophobicContact CB-CG1 4.45Å; I12-V381 HydrophobicContact CD1-CG1 4.07Å; I12-V381 WeakPolarHBondContact CD1-O 3.29Å; I12-V381 HydrophobicContact CG1-CB 4.45Å; I12-V381 HydrophobicContact CG1-CG1 3.24Å; S240-V381 WeakPolarHBondContact O-CB 3.37Å; S240-V381 WeakPolarHBondContact O-CG2 3.23Å; S240-V381 PolarHBondContact O-N 2.78Å; V381-G383 VanDerWaalsContact C-N 3.33Å; V381-G383 PolarHBondContact O-N 3.44Å; V381-I384 HydrophobicContact CG2-CD1 4.39Å; V381-I384 WeakPolarHBondContact O-CB 3.41Å; V381-I384 PolarHBondContact O-N 3.3Å; V381-F385 PolarHBondContact O-N 3.36Å
382	L	84.8	Confident	78.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-53.3	-44	163.4	177.3	65.2	0	0	0	113.7	F242 V327 L328 P380 I384 F385 L386	F242-L382 HydrophobicContact CD1-CB 4.26Å; F242-L382 HydrophobicContact CD1-CD2 3.89Å; F242-L382 HydrophobicContact CE1-CD2 3.7Å; F242-L382 VanDerWaalsContact O-CB 3.27Å; F242-L382 WeakPolarHBondContact O-CB 3.45Å; F242-L382 PolarHBondContact O-N 3.4Å; V327-L382 HydrophobicContact CG1-CD1 4.07Å; L328-L382 HydrophobicContact CD2-CD1 3.89Å; P380-L382 VanDerWaalsContact C-N 3.29Å; P380-L382 PolarHBondContact O-N 3.15Å; L382-I384 VanDerWaalsContact C-N 3.26Å; L382-I384 PolarHBondContact O-N 3.2Å; L382-F385 HydrophobicContact CD1-CD1 4.46Å; L382-F385 WeakPolarHBondContact O-CB 3.48Å; L382-F385 PolarHBondContact O-N 3.03Å; L382-F385 VanDerWaalsContact O-N 3.14Å; L382-L386 WeakPolarHBondContact O-CG 3.4Å; L382-L386 PolarHBondContact O-N 2.93Å
383	G	84.5	Confident	78.5	Confident	15 Å²	15	55 Å²	55	16%	0.155	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-30.7	-179.5	0	0	0	0	0	113	P380 V381 L386 L387	P380-G383 VanDerWaalsContact O-CA 3.3Å; P380-G383 WeakPolarHBondContact O-CA 3.35Å; P380-G383 PolarHBondContact O-N 3.48Å; V381-G383 VanDerWaalsContact C-N 3.33Å; V381-G383 PolarHBondContact O-N 3.44Å; G383-L386 PolarHBondContact O-N 3.38Å; G383-L387 WeakPolarHBondContact O-CG 3.46Å; G383-L387 PolarHBondContact O-N 3.29Å; G383-L387 VanDerWaalsContact O-N 3.14Å
384	I	84.3	Confident	79	Confident	31 Å²	31	57 Å²	57	16%	0.159	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-43	173	-60	177.9	0	0	0	110.3	K8 P380 V381 L382 L387 D388	K8-I384 HydrophobicContact CB-CD1 3.79Å; K8-I384 HydrophobicContact CB-CG2 4.01Å; K8-I384 HydrophobicContact CD-CD1 3.87Å; K8-I384 HydrophobicContact CG-CD1 4.46Å; P380-I384 PolarHBondContact O-N 3.08Å; V381-I384 HydrophobicContact CG2-CD1 4.39Å; V381-I384 WeakPolarHBondContact O-CB 3.41Å; V381-I384 PolarHBondContact O-N 3.3Å; L382-I384 VanDerWaalsContact C-N 3.26Å; L382-I384 PolarHBondContact O-N 3.2Å; I384-L387 PolarHBondContact O-N 3.49Å; I384-D388 WeakPolarHBondContact O-CB 3.23Å; I384-D388 PolarHBondContact O-N 2.66Å
385	F	82.8	Confident	79.6	Confident	15 Å²	15	51 Å²	51	7%	0.066	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-37.7	173.9	166.8	-91.5	0	0	0	113.3	I12 L328 F331 V381 L382 L387 D388 Q389	I12-F385 HydrophobicContact CD1-CB 3.19Å; I12-F385 HydrophobicContact CD1-CD2 4.44Å; I12-F385 HydrophobicContact CD1-CG 4.06Å; L328-F385 HydrophobicContact CD2-CD1 4.05Å; L328-F385 HydrophobicContact CD2-CE1 3.73Å; L328-F385 HydrophobicContact CD2-CZ 4.17Å; F331-F385 HydrophobicContact CB-CE1 3.92Å; F331-F385 HydrophobicContact CB-CZ 4.16Å; F331-F385 HydrophobicContact CD2-CE1 4.28Å; F331-F385 HydrophobicContact CG-CE1 4.36Å; V381-F385 PolarHBondContact O-N 3.36Å; L382-F385 HydrophobicContact CD1-CD1 4.46Å; L382-F385 WeakPolarHBondContact O-CB 3.48Å; L382-F385 PolarHBondContact O-N 3.03Å; L382-F385 VanDerWaalsContact O-N 3.14Å; F385-L387 VanDerWaalsContact C-N 3.29Å; F385-L387 PolarHBondContact O-N 2.81Å; F385-D388 PolarHBondContact O-N 2.86Å; F385-Q389 HydrophobicContact CD1-CG 4.16Å; F385-Q389 HydrophobicContact CD2-CG 3.97Å; F385-Q389 HydrophobicContact CE1-CG 3.88Å; F385-Q389 HydrophobicContact CE2-CG 3.69Å; F385-Q389 HydrophobicContact CG-CG 4.19Å; F385-Q389 HydrophobicContact CZ-CG 3.65Å; F385-Q389 WeakPolarHBondContact O-CB 3.38Å; F385-Q389 VanDerWaalsContact O-CG 3.3Å; F385-Q389 WeakPolarHBondContact O-CG 3.38Å; F385-Q389 PolarHBondContact O-N 3.25Å
386	L	83.5	Confident	80	Confident	15 Å²	15	50 Å²	50	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-40.4	174.6	-59.9	-176.3	0	0	0	111.8	F331 V368 L382 G383 L390	F331-L386 HydrophobicContact CD2-CD2 3.67Å; F331-L386 HydrophobicContact CE1-CD2 4.43Å; F331-L386 HydrophobicContact CE2-CD2 3.14Å; F331-L386 HydrophobicContact CZ-CD2 3.59Å; V368-L386 HydrophobicContact CB-CD1 4.42Å; V368-L386 HydrophobicContact CG1-CD1 3.8Å; L382-L386 WeakPolarHBondContact O-CG 3.4Å; L382-L386 PolarHBondContact O-N 2.93Å; G383-L386 PolarHBondContact O-N 3.38Å; L386-L390 WeakPolarHBondContact O-CB 3.49Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 3.01Å; L386-L390 VanDerWaalsContact O-N 3.09Å
387	L	83.7	Confident	80.8	Confident	107 Å²	107	44.1 Å²	44.1	56%	0.56	24%	0.242	S	C	*	.	H	α-helix	trans	-69.7	-39.3	175.6	-67.8	169.9	0	0	0	112.4	G383 I384 F385 L390 G391	G383-L387 WeakPolarHBondContact O-CG 3.46Å; G383-L387 PolarHBondContact O-N 3.29Å; G383-L387 VanDerWaalsContact O-N 3.14Å; I384-L387 PolarHBondContact O-N 3.49Å; F385-L387 VanDerWaalsContact C-N 3.29Å; F385-L387 PolarHBondContact O-N 2.81Å; L387-L390 PolarHBondContact O-N 3.29Å; L387-G391 PolarHBondContact O-N 3.16Å
388	D	80.7	Confident	81.3	Confident	31 Å²	31	42 Å²	42	17%	0.166	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-48.2	176.8	-178	48.8	0	0	0	111.8	S9 I384 F385 L390 G391 L392	S9-D388 WeakPolarHBondContact CB-OD2 3.36Å; S9-D388 PolarHBondContact OG-OD2 3.28Å; I384-D388 WeakPolarHBondContact O-CB 3.23Å; I384-D388 PolarHBondContact O-N 2.66Å; F385-D388 PolarHBondContact O-N 2.86Å; D388-L390 PolarHBondContact O-N 3.25Å; D388-G391 WeakPolarHBondContact O-CA 3.49Å; D388-G391 PolarHBondContact O-N 2.86Å; D388-G391 VanDerWaalsContact O-N 3.1Å; D388-L392 WeakPolarHBondContact O-CG 3.41Å; D388-L392 PolarHBondContact O-N 2.7Å
389	Q	81	Confident	81.4	Confident	17 Å²	17	41.4 Å²	41.4	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-39.2	174.9	-65.1	-57.8	-64.4	0	0	112	S335 M361 F385 G391 L393	S335-Q389 VanDerWaalsContact CB-OE1 3.26Å; S335-Q389 PolarHBondContact OG-OE1 3.01Å; S335-Q389 VanDerWaalsContact OG-OE1 3.07Å; M361-Q389 HydrophobicContact CE-CB 3.57Å; F385-Q389 HydrophobicContact CD1-CG 4.16Å; F385-Q389 HydrophobicContact CD2-CG 3.97Å; F385-Q389 HydrophobicContact CE1-CG 3.88Å; F385-Q389 HydrophobicContact CE2-CG 3.69Å; F385-Q389 HydrophobicContact CG-CG 4.19Å; F385-Q389 HydrophobicContact CZ-CG 3.65Å; F385-Q389 WeakPolarHBondContact O-CB 3.38Å; F385-Q389 VanDerWaalsContact O-CG 3.3Å; F385-Q389 WeakPolarHBondContact O-CG 3.38Å; F385-Q389 PolarHBondContact O-N 3.25Å; Q389-G391 VanDerWaalsContact C-N 3.34Å; Q389-L393 WeakPolarHBondContact O-CB 3.3Å; Q389-L393 WeakPolarHBondContact O-CD1 3.45Å; Q389-L393 VanDerWaalsContact O-CG 3.26Å; Q389-L393 WeakPolarHBondContact O-CG 3.48Å; Q389-L393 PolarHBondContact O-N 3.02Å
390	L	81.7	Confident	81.1	Confident	52 Å²	52	35.7 Å²	35.7	27%	0.272	21%	0.206	S	C	.	.	H	α-helix	trans	-61.2	-42.3	171	-80.9	172	0	0	0	111.9	M361 T362 V365 L386 L387 D388 L393 S394	M361-L390 HydrophobicContact CE-CD2 4.17Å; M361-L390 HydrophobicContact CE-CG 4.04Å; M361-L390 HydrophobicContact CG-CD2 3.69Å; T362-L390 HydrophobicContact CG2-CD2 4.39Å; V365-L390 HydrophobicContact CB-CD1 4.49Å; V365-L390 HydrophobicContact CG1-CD1 4.14Å; V365-L390 HydrophobicContact CG2-CD1 4.01Å; V365-L390 HydrophobicContact CG2-CD2 4.22Å; V365-L390 HydrophobicContact CG2-CG 4.04Å; L386-L390 WeakPolarHBondContact O-CB 3.49Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 3.01Å; L386-L390 VanDerWaalsContact O-N 3.09Å; L387-L390 PolarHBondContact O-N 3.29Å; D388-L390 PolarHBondContact O-N 3.25Å; L390-L393 PolarHBondContact O-N 3.19Å; L390-S394 WeakPolarHBondContact O-CB 3.08Å; L390-S394 PolarHBondContact O-N 3.21Å
391	G	80.9	Confident	80.8	Confident	25 Å²	25	38.3 Å²	38.3	26%	0.258	22%	0.221	S	C	.	.	H	α-helix	trans	-58.6	-54.1	175.4	0	0	0	0	0	111.9	L387 D388 Q389 L393 S394 I395	L387-G391 PolarHBondContact O-N 3.16Å; D388-G391 WeakPolarHBondContact O-CA 3.49Å; D388-G391 PolarHBondContact O-N 2.86Å; D388-G391 VanDerWaalsContact O-N 3.1Å; Q389-G391 VanDerWaalsContact C-N 3.34Å; G391-L393 VanDerWaalsContact C-N 3.31Å; G391-L393 PolarHBondContact O-N 2.7Å; G391-S394 PolarHBondContact O-N 3.37Å; G391-S394 VanDerWaalsContact O-N 3.17Å; G391-S394 PolarHBondContact O-OG 2.79Å; G391-I395 WeakPolarHBondContact O-CG1 3.37Å; G391-I395 PolarHBondContact O-N 3.14Å
392	L	77.6	Confident	80.5	Confident	69 Å²	69	42.3 Å²	42.3	36%	0.361	24%	0.24	S	C	.	.	H	α-helix	trans	-56.6	-42.4	177.9	-69.3	170	0	0	0	112.3	D388 I395 A396	D388-L392 WeakPolarHBondContact O-CG 3.41Å; D388-L392 PolarHBondContact O-N 2.7Å; L392-I395 PolarHBondContact O-N 3.32Å; L392-A396 WeakPolarHBondContact O-CB 3.1Å; L392-A396 PolarHBondContact O-N 3.21Å
393	L	78.3	Confident	80	Confident	9 Å²	9	44.8 Å²	44.8	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-71	-34.7	178.2	-70.5	169.7	0	0	0	113.1	A338 M361 Q389 L390 G391 A396 T397	A338-L393 HydrophobicContact CB-CD2 3.19Å; M361-L393 HydrophobicContact CB-CD1 4.01Å; M361-L393 HydrophobicContact CE-CD1 3.85Å; M361-L393 HydrophobicContact CG-CD1 3.42Å; M361-L393 VanDerWaalsContact CG-CD1 3.42Å; M361-L393 HydrophobicContact SD-CD1 3.3Å; M361-L393 WeakPolarHBondContact SD-CD1 3.16Å; Q389-L393 WeakPolarHBondContact O-CB 3.3Å; Q389-L393 WeakPolarHBondContact O-CD1 3.45Å; Q389-L393 VanDerWaalsContact O-CG 3.26Å; Q389-L393 WeakPolarHBondContact O-CG 3.48Å; Q389-L393 PolarHBondContact O-N 3.02Å; L390-L393 PolarHBondContact O-N 3.19Å; G391-L393 VanDerWaalsContact C-N 3.31Å; G391-L393 PolarHBondContact O-N 2.7Å; L393-A396 PolarHBondContact O-N 3.06Å; L393-T397 WeakPolarHBondContact O-CB 3.5Å; L393-T397 WeakPolarHBondContact O-CG2 3.34Å; L393-T397 PolarHBondContact O-N 3.37Å; L393-T397 PolarHBondContact O-OG1 3.36Å
394	S	80.6	Confident	79.6	Confident	55 Å²	55	45.4 Å²	45.4	39%	0.385	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-42.3	172	76.8	0	0	0	0	111.4	L390 G391 T397 I398	L390-S394 WeakPolarHBondContact O-CB 3.08Å; L390-S394 PolarHBondContact O-N 3.21Å; G391-S394 PolarHBondContact O-N 3.37Å; G391-S394 VanDerWaalsContact O-N 3.17Å; G391-S394 PolarHBondContact O-OG 2.79Å; S394-T397 PolarHBondContact O-N 3.18Å; S394-T397 PolarHBondContact O-OG1 3.22Å; S394-T397 VanDerWaalsContact O-OG1 3.12Å; S394-I398 WeakPolarHBondContact O-CB 3.15Å; S394-I398 WeakPolarHBondContact O-CD1 3.36Å; S394-I398 WeakPolarHBondContact O-CG1 3.21Å; S394-I398 PolarHBondContact O-N 3.34Å
395	I	80.7	Confident	79.1	Confident	74 Å²	74	51.4 Å²	51.4	38%	0.379	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-47.5	176.5	-66.4	164.2	0	0	0	110.3	F2 G391 L392 T397 I398 L399	F2-I395 HydrophobicContact CE2-CD1 4.5Å; F2-I395 HydrophobicContact CZ-CD1 4.47Å; G391-I395 WeakPolarHBondContact O-CG1 3.37Å; G391-I395 PolarHBondContact O-N 3.14Å; L392-I395 PolarHBondContact O-N 3.32Å; I395-T397 VanDerWaalsContact C-N 3.31Å; I395-T397 PolarHBondContact O-N 3.4Å; I395-I398 PolarHBondContact O-N 2.92Å; I395-L399 HydrophobicContact CG2-CD1 3.79Å; I395-L399 HydrophobicContact CG2-CG 4.45Å; I395-L399 WeakPolarHBondContact O-CB 3.22Å; I395-L399 WeakPolarHBondContact O-CD1 3.43Å; I395-L399 VanDerWaalsContact O-CG 3.25Å; I395-L399 WeakPolarHBondContact O-CG 3.4Å; I395-L399 PolarHBondContact O-N 3.38Å
396	A	76.5	Confident	78.4	Confident	19 Å²	19	55.1 Å²	55.1	16%	0.157	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-38.7	178.3	0	0	0	0	0	112.8	F342 L392 L393 A400	F342-A396 HydrophobicContact CE2-CB 4.22Å; F342-A396 HydrophobicContact CZ-CB 4.46Å; F342-A396 WeakPolarHBondContact CZ-O 3.38Å; L392-A396 WeakPolarHBondContact O-CB 3.1Å; L392-A396 PolarHBondContact O-N 3.21Å; L393-A396 PolarHBondContact O-N 3.06Å; A396-A400 WeakPolarHBondContact O-CB 3.34Å; A396-A400 PolarHBondContact O-N 3.32Å
397	T	77.6	Confident	77.7	Confident	28 Å²	28	62.5 Å²	62.5	17%	0.172	33%	0.326	C	S	.	.	H	α-helix	trans	-77.2	-36.4	178.2	51.3	0	0	0	0	113.4	A354 V358 L393 S394 I395 L399 A400 V401	A354-T397 HydrophobicContact CB-CG2 3.96Å; V358-T397 HydrophobicContact CG2-CG2 3.49Å; V358-T397 VanDerWaalsContact CG2-CG2 3.49Å; L393-T397 WeakPolarHBondContact O-CB 3.5Å; L393-T397 WeakPolarHBondContact O-CG2 3.34Å; L393-T397 PolarHBondContact O-N 3.37Å; L393-T397 PolarHBondContact O-OG1 3.36Å; S394-T397 PolarHBondContact O-N 3.18Å; S394-T397 PolarHBondContact O-OG1 3.22Å; S394-T397 VanDerWaalsContact O-OG1 3.12Å; I395-T397 VanDerWaalsContact C-N 3.31Å; I395-T397 PolarHBondContact O-N 3.4Å; T397-L399 VanDerWaalsContact C-N 3.33Å; T397-L399 PolarHBondContact O-N 3.41Å; T397-A400 PolarHBondContact O-N 2.89Å; T397-V401 WeakPolarHBondContact O-CG2 3.46Å; T397-V401 PolarHBondContact O-N 3.03Å
398	I	81.5	Confident	76.9	Confident	100 Å²	100	64.6 Å²	64.6	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-57.8	-47.1	168.9	-70.7	164	0	0	0	110.2	S394 I395 A400 V401 M402	S394-I398 WeakPolarHBondContact O-CB 3.15Å; S394-I398 WeakPolarHBondContact O-CD1 3.36Å; S394-I398 WeakPolarHBondContact O-CG1 3.21Å; S394-I398 PolarHBondContact O-N 3.34Å; I395-I398 PolarHBondContact O-N 2.92Å; I398-A400 VanDerWaalsContact C-N 3.34Å; I398-A400 PolarHBondContact O-N 2.81Å; I398-V401 PolarHBondContact O-N 2.79Å; I398-M402 HydrophobicContact CG2-CG 4.41Å; I398-M402 HydrophobicContact CG2-SD 3.99Å; I398-M402 WeakPolarHBondContact O-CG 3.37Å; I398-M402 PolarHBondContact O-N 3.42Å
399	L	78	Confident	76.1	Confident	45 Å²	45	66.1 Å²	66.1	24%	0.236	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-37.3	176	-70.4	165.3	0	0	0	112.6	F342 I395 T397 M402 N403 M872	F342-L399 HydrophobicContact CE1-CB 4.14Å; F342-L399 HydrophobicContact CZ-CB 4.03Å; I395-L399 HydrophobicContact CG2-CD1 3.79Å; I395-L399 HydrophobicContact CG2-CG 4.45Å; I395-L399 WeakPolarHBondContact O-CB 3.22Å; I395-L399 WeakPolarHBondContact O-CD1 3.43Å; I395-L399 VanDerWaalsContact O-CG 3.25Å; I395-L399 WeakPolarHBondContact O-CG 3.4Å; I395-L399 PolarHBondContact O-N 3.38Å; T397-L399 VanDerWaalsContact C-N 3.33Å; T397-L399 PolarHBondContact O-N 3.41Å; L399-M402 PolarHBondContact O-N 2.75Å; L399-N403 WeakPolarHBondContact O-CB 3.47Å; L399-N403 VanDerWaalsContact O-CG 3.24Å; L399-N403 PolarHBondContact O-N 3.18Å; L399-N403 PolarHBondContact O-OD1 3.38Å; L399-N403 VanDerWaalsContact O-OD1 3.09Å; L399-M872 HydrophobicContact CD1-CE 3.64Å; L399-M872 HydrophobicContact CD2-CE 4.26Å
400	A	75	Confident	74.8	Confident	3 Å²	3	71.1 Å²	71.1	3%	0.025	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-41.1	174.3	0	0	0	0	0	112.3	I341 A354 A396 T397 I398 N404	I341-A400 HydrophobicContact CG2-CB 4.36Å; A354-A400 HydrophobicContact CB-CB 4.42Å; A396-A400 WeakPolarHBondContact O-CB 3.34Å; A396-A400 PolarHBondContact O-N 3.32Å; T397-A400 PolarHBondContact O-N 2.89Å; I398-A400 VanDerWaalsContact C-N 3.34Å; I398-A400 PolarHBondContact O-N 2.81Å; A400-N404 WeakPolarHBondContact O-CB 3.49Å; A400-N404 PolarHBondContact O-N 3.48Å; A400-N404 VanDerWaalsContact O-N 3.09Å
401	V	79.5	Confident	73.5	Confident	75 Å²	75	76.9 Å²	76.9	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-66.1	-44	174.3	172.3	0	0	0	0	111.3	L351 T397 I398 N404 K405	L351-V401 HydrophobicContact CD1-CG2 3.79Å; T397-V401 WeakPolarHBondContact O-CG2 3.46Å; T397-V401 PolarHBondContact O-N 3.03Å; I398-V401 PolarHBondContact O-N 2.79Å; V401-N404 PolarHBondContact O-N 2.9Å; V401-K405 PolarHBondContact O-N 2.87Å
402	M	77	Confident	71.9	Confident	99 Å²	99	81.9 Å²	81.9	49%	0.488	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-46.8	176.9	-72.6	-179.4	71.4	0	0	111.7	I398 L399 N404 K405 L406	I398-M402 HydrophobicContact CG2-CG 4.41Å; I398-M402 HydrophobicContact CG2-SD 3.99Å; I398-M402 WeakPolarHBondContact O-CG 3.37Å; I398-M402 PolarHBondContact O-N 3.42Å; L399-M402 PolarHBondContact O-N 2.75Å; M402-N404 VanDerWaalsContact C-N 3.27Å; M402-N404 PolarHBondContact O-N 3.25Å; M402-K405 PolarHBondContact O-N 3.37Å; M402-L406 WeakPolarHBondContact O-CB 3.29Å; M402-L406 WeakPolarHBondContact O-CG 3.37Å; M402-L406 PolarHBondContact O-N 3.22Å
403	N	75.2	Confident	70.9	Confident	56 Å²	56	84 Å²	84	30%	0.299	43%	0.434	S	S	.	.	H	α-helix	trans	-64.1	-32.9	177.7	-68.9	18	0	0	0	112	L399 Y407	L399-N403 WeakPolarHBondContact O-CB 3.47Å; L399-N403 VanDerWaalsContact O-CG 3.24Å; L399-N403 PolarHBondContact O-N 3.18Å; L399-N403 PolarHBondContact O-OD1 3.38Å; L399-N403 VanDerWaalsContact O-OD1 3.09Å; N403-Y407 WeakPolarHBondContact O-CB 3.38Å; N403-Y407 PolarHBondContact O-N 2.99Å
404	N	75.6	Confident	69.7	Low	28 Å²	28	88.1 Å²	88.1	15%	0.15	46%	0.457	C	S	.	.	H	α-helix	trans	-67.7	-45.6	174.1	-164.3	-0.2	0	0	0	111.2	T347 A400 V401 M402 L406 Y407 Q408	T347-N404 WeakPolarHBondContact CB-OD1 3.14Å; T347-N404 PolarHBondContact O-ND2 3.02Å; A400-N404 WeakPolarHBondContact O-CB 3.49Å; A400-N404 PolarHBondContact O-N 3.48Å; A400-N404 VanDerWaalsContact O-N 3.09Å; V401-N404 PolarHBondContact O-N 2.9Å; M402-N404 VanDerWaalsContact C-N 3.27Å; M402-N404 PolarHBondContact O-N 3.25Å; N404-L406 PolarHBondContact O-N 3.35Å; N404-Y407 PolarHBondContact O-N 3.48Å; N404-Q408 PolarHBondContact O-N 3.36Å
405	K	73.4	Confident	68.7	Low	157 Å²	157	94.1 Å²	94.1	68%	0.683	47%	0.471	S	S	*	.	H	α-helix	trans	-60.6	-42.5	175	-170.9	175	-178.5	178.3	0	112.1	V401 M402 Y407 Q408 S409	V401-K405 PolarHBondContact O-N 2.87Å; M402-K405 PolarHBondContact O-N 3.37Å; K405-Y407 VanDerWaalsContact C-N 3.34Å; K405-Q408 PolarHBondContact O-N 2.9Å; K405-S409 PolarHBondContact O-N 3.44Å; K405-S409 PolarHBondContact O-OG 3.01Å
406	L	69.4	Low	67.7	Low	93 Å²	93	95 Å²	95	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-66.3	-32.5	176.4	-72	169.5	0	0	0	113.1	M402 N404 S409	M402-L406 WeakPolarHBondContact O-CB 3.29Å; M402-L406 WeakPolarHBondContact O-CG 3.37Å; M402-L406 PolarHBondContact O-N 3.22Å; N404-L406 PolarHBondContact O-N 3.35Å; L406-S409 WeakPolarHBondContact CA-OG 3.06Å; L406-S409 PolarHBondContact O-OG 3.42Å
407	Y	68.3	Low	66.8	Low	170 Å²	170	97.4 Å²	97.4	67%	0.667	48%	0.484	S	S	*	.	H	α-helix	trans	-70.8	-33.5	172.7	-174.2	-86.3	0	0	0	112	T347 N403 N404 K405	T347-Y407 HydrophobicContact CG2-CD1 3.68Å; T347-Y407 HydrophobicContact CG2-CD2 4.36Å; T347-Y407 HydrophobicContact CG2-CE1 4.04Å; T347-Y407 HydrophobicContact CG2-CG 3.86Å; N403-Y407 WeakPolarHBondContact O-CB 3.38Å; N403-Y407 PolarHBondContact O-N 2.99Å; N404-Y407 PolarHBondContact O-N 3.48Å; K405-Y407 VanDerWaalsContact C-N 3.34Å
408	Q	67.4	Low	65.9	Low	151 Å²	151	100.6 Å²	100.6	71%	0.706	50%	0.495	S	S	*	.	H	α-helix	trans	-79.2	-28.3	178.9	-169	173.7	2.4	0	0	113.2	N404 K405 T410	N404-Q408 PolarHBondContact O-N 3.36Å; K405-Q408 PolarHBondContact O-N 2.9Å; Q408-T410 PolarHBondContact O-N 3.31Å; Q408-T410 VanDerWaalsContact O-N 3.1Å
409	S	62.5	Low	65	Low	63 Å²	63	100.2 Å²	100.2	44%	0.441	49%	0.493	S	S	.	.			trans	-71.9	100.1	174.6	53.7	0	0	0	0	111.3	K405 L406 E411	K405-S409 PolarHBondContact O-N 3.44Å; K405-S409 PolarHBondContact O-OG 3.01Å; L406-S409 WeakPolarHBondContact CA-OG 3.06Å; L406-S409 PolarHBondContact O-OG 3.42Å; S409-E411 VanDerWaalsContact C-N 3.31Å; S409-E411 PolarHBondContact O-N 3.29Å
410	T	53.7	Low	63.9	Low	122 Å²	122	105.3 Å²	105.3	75%	0.748	51%	0.51	S	S	*	.			trans	-77.7	-12	-179.4	46.8	0	0	0	0	114.6	Q408	Q408-T410 PolarHBondContact O-N 3.31Å; Q408-T410 VanDerWaalsContact O-N 3.1Å
411	E	54.4	Low	63.2	Low	173 Å²	173	108.8 Å²	108.8	81%	0.808	54%	0.539	S	S	*	.	S	Bend	trans	-78.5	136.2	179.4	-57.6	-135.9	133.9	0	0	111.8	S409 L413	S409-E411 VanDerWaalsContact C-N 3.31Å; S409-E411 PolarHBondContact O-N 3.29Å; E411-L413 VanDerWaalsContact C-N 3.34Å; E411-L413 PolarHBondContact O-N 2.93Å
412	L	48.4	Very low	62	Low	131 Å²	131	110.9 Å²	110.9	69%	0.686	55%	0.547	S	S	*	.			trans	-81	77.1	-178.2	-85.6	155.1	0	0	0	110.9	N414	L412-N414 PolarHBondContact O-N 3.28Å
413	L	56.2	Low	61	Low	113 Å²	113	108.8 Å²	108.8	59%	0.592	54%	0.542	S	S	*	.			trans	-62.6	120.4	162.4	-160.5	74	0	0	0	108.1	E411 D417 F418	E411-L413 VanDerWaalsContact C-N 3.34Å; E411-L413 PolarHBondContact O-N 2.93Å; L413-D417 HydrophobicContact CD1-CB 3.79Å; L413-D417 HydrophobicContact CG-CB 3.85Å; L413-F418 HydrophobicContact CD2-CB 4.15Å; L413-F418 HydrophobicContact CD2-CD2 4.39Å
414	N	53.1	Low	59.7	Low	96 Å²	96	109.4 Å²	109.4	51%	0.513	56%	0.561	S	S	.	*			trans	-67.3	154.1	178.1	-69.5	-65.2	0	0	0	109.9	L412 Q416 D417 F418	L412-N414 PolarHBondContact O-N 3.28Å; N414-Q416 PolarHBondContact O-N 3.45Å; N414-D417 WeakPolarHBondContact CB-OD2 3.32Å; N414-D417 PolarHBondContact N-OD2 2.95Å; N414-D417 PolarHBondContact ND2-OD2 3.36Å; N414-D417 PolarHBondContact O-N 3.33Å; N414-F418 PolarHBondContact O-N 3.5Å
415	W	59.6	Low	58.6	Low	180 Å²	180	113.5 Å²	113.5	68%	0.682	59%	0.588	S	S	*	*	H	α-helix	trans	-55.9	-28.7	176.7	68.4	-93.8	0	0	0	112.7	I419	W415-I419 HydrophobicContact CE3-CD1 3.78Å; W415-I419 HydrophobicContact CZ3-CD1 3.95Å; W415-I419 WeakPolarHBondContact O-CG1 3.44Å; W415-I419 PolarHBondContact O-N 2.99Å; W415-I419 VanDerWaalsContact O-N 3.16Å
416	Q	58.6	Low	57	Low	94 Å²	94	108.9 Å²	108.9	44%	0.439	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-50.6	173.9	-61.7	178.1	-8.1	0	0	111.2	N414 F418 I419 Y420	N414-Q416 PolarHBondContact O-N 3.45Å; Q416-F418 VanDerWaalsContact C-N 3.29Å; Q416-F418 PolarHBondContact O-N 2.84Å; Q416-I419 PolarHBondContact O-N 3.2Å; Q416-I419 VanDerWaalsContact O-N 3.13Å; Q416-Y420 HydrophobicContact CB-CD2 4.39Å; Q416-Y420 HydrophobicContact CB-CE2 4.11Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.47Å; Q416-Y420 PolarHBondContact O-N 2.88Å
417	D	58.7	Low	55.7	Low	69 Å²	69	113.7 Å²	113.7	37%	0.369	61%	0.605	S	S	.	*	H	α-helix	trans	-63.9	-34.7	179.6	-56.5	-45.9	0	0	0	111.7	L413 N414 Y420 A421	L413-D417 HydrophobicContact CD1-CB 3.79Å; L413-D417 HydrophobicContact CG-CB 3.85Å; N414-D417 WeakPolarHBondContact CB-OD2 3.32Å; N414-D417 PolarHBondContact N-OD2 2.95Å; N414-D417 PolarHBondContact ND2-OD2 3.36Å; N414-D417 PolarHBondContact O-N 3.33Å; D417-Y420 PolarHBondContact O-N 3.47Å; D417-A421 WeakPolarHBondContact O-CB 3.34Å; D417-A421 PolarHBondContact O-N 3.45Å
418	F	59	Low	54.2	Low	95 Å²	95	108.9 Å²	108.9	42%	0.417	61%	0.607	S	S	.	*	H	α-helix	trans	-63.3	-43.6	171.9	-176.8	-105.9	0	0	0	112.4	L413 N414 Q416 A421 I422	L413-F418 HydrophobicContact CD2-CB 4.15Å; L413-F418 HydrophobicContact CD2-CD2 4.39Å; N414-F418 PolarHBondContact O-N 3.5Å; Q416-F418 VanDerWaalsContact C-N 3.29Å; Q416-F418 PolarHBondContact O-N 2.84Å; F418-A421 PolarHBondContact O-N 3.11Å; F418-I422 HydrophobicContact CD1-CD1 3.98Å; F418-I422 HydrophobicContact CD2-CD1 4.35Å; F418-I422 HydrophobicContact CE1-CD1 3.49Å; F418-I422 VanDerWaalsContact CE1-CD1 3.49Å; F418-I422 HydrophobicContact CE2-CD1 3.91Å; F418-I422 HydrophobicContact CG-CD1 4.39Å; F418-I422 HydrophobicContact CZ-CD1 3.46Å; F418-I422 VanDerWaalsContact CZ-CD1 3.46Å; F418-I422 WeakPolarHBondContact O-CG1 3.03Å; F418-I422 PolarHBondContact O-N 3.41Å; F418-I422 VanDerWaalsContact O-N 3.12Å
419	I	61.8	Low	52.7	Low	92 Å²	92	111.5 Å²	111.5	47%	0.472	62%	0.616	S	S	.	*	H	α-helix	trans	-66.8	-42.6	175.1	-70.1	175.7	0	0	0	111	W415 Q416 A421 I422 S423	W415-I419 HydrophobicContact CE3-CD1 3.78Å; W415-I419 HydrophobicContact CZ3-CD1 3.95Å; W415-I419 WeakPolarHBondContact O-CG1 3.44Å; W415-I419 PolarHBondContact O-N 2.99Å; W415-I419 VanDerWaalsContact O-N 3.16Å; Q416-I419 PolarHBondContact O-N 3.2Å; Q416-I419 VanDerWaalsContact O-N 3.13Å; I419-A421 VanDerWaalsContact C-N 3.3Å; I419-A421 PolarHBondContact O-N 3.15Å; I419-I422 PolarHBondContact O-N 3.44Å; I419-S423 WeakPolarHBondContact O-CB 3.38Å; I419-S423 PolarHBondContact O-N 2.77Å; I419-S423 PolarHBondContact O-OG 2.7Å
420	Y	55.9	Low	51.3	Low	151 Å²	151	119.5 Å²	119.5	59%	0.592	64%	0.636	S	S	*	*	H	α-helix	trans	-65.3	-30.2	176.8	-69.2	-52.2	0	0	0	113.3	Q416 D417 S423	Q416-Y420 HydrophobicContact CB-CD2 4.39Å; Q416-Y420 HydrophobicContact CB-CE2 4.11Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.47Å; Q416-Y420 PolarHBondContact O-N 2.88Å; D417-Y420 PolarHBondContact O-N 3.47Å; Y420-S423 PolarHBondContact O-OG 2.9Å
421	A	58.6	Low	50.4	Low	76 Å²	76	124.9 Å²	124.9	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-71.7	-38.7	172.9	0	0	0	0	0	112.4	D417 F418 I419	D417-A421 WeakPolarHBondContact O-CB 3.34Å; D417-A421 PolarHBondContact O-N 3.45Å; F418-A421 PolarHBondContact O-N 3.11Å; I419-A421 VanDerWaalsContact C-N 3.3Å; I419-A421 PolarHBondContact O-N 3.15Å
422	I	55.9	Low	49.2	Very low	120 Å²	120	123.7 Å²	123.7	62%	0.615	64%	0.642	S	S	*	*	H	α-helix	trans	-78.5	-33.2	-179.5	-70.8	174.5	0	0	0	112.4	F418 I419 G424	F418-I422 HydrophobicContact CD1-CD1 3.98Å; F418-I422 HydrophobicContact CD2-CD1 4.35Å; F418-I422 HydrophobicContact CE1-CD1 3.49Å; F418-I422 VanDerWaalsContact CE1-CD1 3.49Å; F418-I422 HydrophobicContact CE2-CD1 3.91Å; F418-I422 HydrophobicContact CG-CD1 4.39Å; F418-I422 HydrophobicContact CZ-CD1 3.46Å; F418-I422 VanDerWaalsContact CZ-CD1 3.46Å; F418-I422 WeakPolarHBondContact O-CG1 3.03Å; F418-I422 PolarHBondContact O-N 3.41Å; F418-I422 VanDerWaalsContact O-N 3.12Å; I419-I422 PolarHBondContact O-N 3.44Å; I422-G424 PolarHBondContact O-N 3.18Å
423	S	54.8	Low	48.5	Very low	55 Å²	55	122.7 Å²	122.7	39%	0.385	65%	0.646	S	S	.	*	S	Bend	trans	-70.8	-14.5	-175.6	69.6	0	0	0	0	114.3	I419 Y420 T425	I419-S423 WeakPolarHBondContact O-CB 3.38Å; I419-S423 PolarHBondContact O-N 2.77Å; I419-S423 PolarHBondContact O-OG 2.7Å; Y420-S423 PolarHBondContact O-OG 2.9Å; S423-T425 WeakPolarHBondContact CB-OG1 3.2Å; S423-T425 PolarHBondContact O-N 2.8Å; S423-T425 PolarHBondContact OG-OG1 3.32Å
424	G	48.9	Very low	47.4	Very low	69 Å²	69	125.2 Å²	125.2	71%	0.711	66%	0.655	S	S	*	*			trans	66.8	-10.3	-177.5	0	0	0	0	0	115.1	I422 G426	I422-G424 PolarHBondContact O-N 3.18Å; G424-G426 PolarHBondContact O-N 2.86Å
425	T	51.5	Low	46.2	Very low	114 Å²	114	126.8 Å²	126.8	70%	0.699	67%	0.67	S	S	*	*			trans	-79	30.5	-178	48.6	0	0	0	0	113.6	S423 Q427	S423-T425 WeakPolarHBondContact CB-OG1 3.2Å; S423-T425 PolarHBondContact O-N 2.8Å; S423-T425 PolarHBondContact OG-OG1 3.32Å; T425-Q427 PolarHBondContact O-N 3.29Å
426	G	40.3	Very low	44.8	Very low	60 Å²	60	128.9 Å²	128.9	62%	0.619	68%	0.679	S	S	*	*			trans	-88.4	60.3	-178.6	0	0	0	0	0	113.9	G424 G428	G424-G426 PolarHBondContact O-N 2.86Å; G426-G428 PolarHBondContact O-N 3.05Å
427	Q	42.5	Very low	43.6	Very low	194 Å²	194	128.4 Å²	128.4	91%	0.907	69%	0.686	S	S	*	*			trans	-64	103.1	162.6	-86.4	-164.7	-7.9	0	0	108.5	T425 K429	T425-Q427 PolarHBondContact O-N 3.29Å; Q427-K429 PolarHBondContact O-N 3.02Å
428	G	35.4	Very low	42.2	Very low	69 Å²	69	132.9 Å²	132.9	71%	0.711	71%	0.705	S	S	*	*			trans	-58.6	111.2	-173.8	0	0	0	0	0	111.9	G426 R430	G426-G428 PolarHBondContact O-N 3.05Å; G428-R430 VanDerWaalsContact C-N 3.27Å; G428-R430 PolarHBondContact O-N 3.49Å
429	K	36.6	Very low	40.8	Very low	205 Å²	205	136.2 Å²	136.2	89%	0.891	72%	0.722	S	S	*	*			trans	-62.4	94.5	161.5	-87.9	-174.8	173.8	177	0	107.9	Q427 R431	Q427-K429 PolarHBondContact O-N 3.02Å; K429-R431 PolarHBondContact O-N 3.24Å
430	R	32.5	Very low	39.2	Very low	232 Å²	232	138.8 Å²	138.8	88%	0.875	74%	0.735	S	S	*	*			trans	-51.2	102.9	160.8	-73.6	-178.1	173.6	-178.7	-3	107.4	G428	G428-R430 VanDerWaalsContact C-N 3.27Å; G428-R430 PolarHBondContact O-N 3.49Å
431	R	35.3	Very low	38	Very low	234 Å²	234	142.2 Å²	142.2	88%	0.883	75%	0.749	S	S	*	*			trans	-72.6	125.7	154.7	-88.2	-177.3	165.1	158.9	-3.7	105.6	K429 S433	K429-R431 PolarHBondContact O-N 3.24Å; R431-S433 PolarHBondContact O-N 3.01Å
432	N	30	Very low	36.7	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	75%	0.75	S	S	*	*			trans	-66.2	103.1	177	-63.9	-8.5	0	0	0	108.5
433	S	33.9	Very low	35.4	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	76%	0.757	S	S	*	*			trans	-87.4	105.3	151.3	52.6	0	0	0	0	106.4	R431	R431-S433 PolarHBondContact O-N 3.01Å
434	E	31.3	Very low	34.1	Very low	166 Å²	166	152.3 Å²	152.3	78%	0.776	78%	0.777	S	S	*	*			trans	-63.1	136.5	174.1	-65.9	172.6	125	0	0	109.6	Y436	E434-Y436 PolarHBondContact O-N 2.82Å; E434-Y436 VanDerWaalsContact O-N 3.1Å
435	P	29.7	Very low	33.4	Very low	128 Å²	128	156.9 Å²	156.9	83%	0.831	78%	0.779	S	S	*	*			trans	-77.4	96.9	174.8	31.3	-31.7	0	0	0	108.9
436	Y	30.5	Very low	32.4	Very low	224 Å²	224	158.7 Å²	158.7	88%	0.878	78%	0.783	S	S	*	*			trans	-99.5	103.5	164.5	-122.7	-81.9	0	0	0	110.1	E434	E434-Y436 PolarHBondContact O-N 2.82Å; E434-Y436 VanDerWaalsContact O-N 3.1Å
437	S	31.9	Very low	32	Very low	84 Å²	84	163 Å²	163	59%	0.587	79%	0.787	S	S	*	*			trans	-84.1	167	173.8	55.3	0	0	0	0	111.5
438	E	29.7	Very low	31.6	Very low	164 Å²	164	160.5 Å²	160.5	77%	0.766	78%	0.78	S	S	*	*			trans	66	129.2	159.1	-61.9	-173	123.9	0	0	120
439	H	30	Very low	31.5	Very low	165 Å²	165	164.7 Å²	164.7	76%	0.764	79%	0.786	S	S	*	*			trans	35.7	149.6	130.3	-64.9	-87.8	0	0	0	122.9
440	L	28.7	Very low	31.5	Very low	145 Å²	145	162.7 Å²	162.7	76%	0.759	78%	0.779	S	S	*	*			trans	72.8	99.7	167.2	-59.3	132.5	0	0	0	116.3
441	Y	30.3	Very low	31.8	Very low	224 Å²	224	157.8 Å²	157.8	88%	0.878	77%	0.77	S	S	*	*				-140.3	102.8	111	-117.9	-75.6	0	0	0	111.6
442	V	31.2	Very low	31.8	Very low	105 Å²	105	155.8 Å²	155.8	64%	0.636	76%	0.764	S	S	*	*			trans	-89.9	141.9	174.7	172.2	0	0	0	0	109.3
443	N	27.9	Very low	32.4	Very low	143 Å²	143	154.4 Å²	154.4	77%	0.765	76%	0.757	S	S	*	*			trans	42.9	96.1	164.4	-67.4	-22.1	0	0	0	119.2
444	R	28.1	Very low	32.7	Very low	215 Å²	215	154.7 Å²	154.7	81%	0.811	75%	0.75	S	S	*	*			trans	-155.6	125.7	139.4	-102.5	171.1	-169.3	171.9	3.7	106.8
445	H	33.2	Very low	32.9	Very low	165 Å²	165	156.4 Å²	156.4	76%	0.764	75%	0.749	S	S	*	*	S	Bend	cis	-129.8	125.7	14.2	-71.9	-105	0	0	0	112.8
446	I	30.5	Very low	33.3	Very low	151 Å²	151	156.3 Å²	156.3	77%	0.774	74%	0.742	S	S	*	*			trans	-132.9	151	152.1	-62.3	179.5	0	0	0	104.6
447	H	32.1	Very low	33.5	Very low	151 Å²	151	154.6 Å²	154.6	70%	0.699	74%	0.739	S	S	*	*			trans	73.9	129.8	-160.5	-62.2	-80.4	0	0	0	113.6
448	D	35.6	Very low	33.7	Very low	142 Å²	142	156.8 Å²	156.8	76%	0.759	75%	0.749	S	S	*	*			cis	-135.4	149.1	-5	-88.2	-46.7	0	0	0	112.2
449	N	32.1	Very low	33.9	Very low	156 Å²	156	154 Å²	154	83%	0.834	75%	0.747	S	S	*	*			trans	-109.6	79.1	178.3	-173	19.7	0	0	0	110.1
450	H	38.1	Very low	34.1	Very low	164 Å²	164	156.5 Å²	156.5	76%	0.759	75%	0.75	S	S	*	*			trans	-147.5	122.3	170.7	-100.4	-60.5	0	0	0	115.3
451	N	38.8	Very low	34.4	Very low	128 Å²	128	156 Å²	156	68%	0.684	75%	0.748	S	S	*	*			trans	65.2	121.6	145	-76.6	-2.9	0	0	0	122.9
452	Y	35.3	Very low	34.4	Very low	192 Å²	192	152.4 Å²	152.4	75%	0.753	74%	0.744	S	S	*	*			trans	82.1	92.8	130.1	-88.2	-124.7	0	0	0	120.8
453	N	41.6	Very low	34.6	Very low	121 Å²	121	154.3 Å²	154.3	65%	0.647	76%	0.756	S	S	*	*				80	136.2	114.6	-81.6	-24.9	0	0	0	122.4
454	N	39.4	Very low	34.8	Very low	116 Å²	116	155 Å²	155	62%	0.62	76%	0.76	S	S	*	*			trans	78.2	96.5	147	-76.1	-37.5	0	0	0	120.8
455	R	36.6	Very low	34.9	Very low	201 Å²	201	155.2 Å²	155.2	76%	0.758	76%	0.761	S	S	*	*				116.4	137.2	99.8	-87.9	168.7	-167.8	-163.5	-3.5	118.2
456	N	37.3	Very low	34.9	Very low	127 Å²	127	154.8 Å²	154.8	68%	0.679	76%	0.759	S	S	*	*			trans	71	104.1	156.2	-59.8	-22.4	0	0	0	116
457	K	34.7	Very low	34.9	Very low	188 Å²	188	156.3 Å²	156.3	82%	0.817	76%	0.763	S	S	*	*				68.6	116.4	87	-75.2	178.9	173.2	-178.6	0	110.8
458	T	37.4	Very low	35.3	Very low	130 Å²	130	154.6 Å²	154.6	80%	0.798	77%	0.765	S	S	*	*				-155.9	165.9	59	40.5	0	0	0	0	114.4
459	S	34	Very low	35.3	Very low	104 Å²	104	156.6 Å²	156.6	73%	0.727	77%	0.767	S	S	*	*			trans	29.4	139.4	150.3	-72.7	0	0	0	0	121.8
460	R	33.6	Very low	35.3	Very low	219 Å²	219	159 Å²	159	83%	0.826	77%	0.766	S	S	*	*			cis	-165.5	163.1	13.8	-129.2	174	178.5	156.6	-2.2	111.6
461	N	34.2	Very low	35.3	Very low	133 Å²	133	160.6 Å²	160.6	71%	0.711	77%	0.771	S	S	*	*			trans	66.8	92.1	157.9	-65.4	5.1	0	0	0	120.7
462	N	31.1	Very low	35.2	Very low	149 Å²	149	158.3 Å²	158.3	80%	0.797	77%	0.765	S	S	*	*				35.8	119.1	124.5	-57.2	-2.7	0	0	0	121.1
463	T	35.6	Very low	35.5	Very low	146 Å²	146	151.8 Å²	151.8	90%	0.896	75%	0.747	S	S	*	*				-161.2	148.8	111.5	7.3	0	0	0	0	111.3
464	N	31.2	Very low	35.5	Very low	156 Å²	156	151.5 Å²	151.5	83%	0.834	75%	0.745	S	S	*	*			trans	-115.1	138.6	177.6	-69.6	-45.7	0	0	0	110
465	R	30.6	Very low	35.6	Very low	221 Å²	221	153 Å²	153	83%	0.834	75%	0.748	S	S	*	*				159.5	129.1	122.7	-90.2	178	139.3	154.9	-1.2	115.8
466	Q	33.7	Very low	35.9	Very low	156 Å²	156	149.6 Å²	149.6	73%	0.729	74%	0.741	S	S	*	*			trans	55	104.3	130.9	-59.9	177.2	-91.8	0	0	121.5
467	E	30	Very low	36.1	Very low	182 Å²	182	146.9 Å²	146.9	85%	0.85	73%	0.729	S	S	*	*				-73.2	172.5	129.1	-70.8	-159.9	127.8	0	0	110.6
468	P	39.9	Very low	36.6	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	71%	0.714	S	S	*	*			cis	-133	171.3	10.9	42.7	-27.4	0	0	0	116.2
469	K	36.7	Very low	37.1	Very low	184 Å²	184	141.6 Å²	141.6	80%	0.8	70%	0.701	S	S	*	*			trans	-163.6	-4.9	162.8	-120.6	166.6	-172.2	178.5	0	120.1	K471	K469-K471 PolarHBondContact O-N 3.4Å
470	Y	31.6	Very low	37.7	Very low	206 Å²	206	142 Å²	142	81%	0.808	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-16.3	-161.2	-159.5	-103	0	0	0	117.2	S473	Y470-S473 PolarHBondContact O-OG 3.13Å; Y470-S473 VanDerWaalsContact O-OG 3.11Å
471	K	37.9	Very low	38.3	Very low	198 Å²	198	136.5 Å²	136.5	86%	0.861	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-12.8	-170.1	-121	178.1	-176.5	178.5	0	116.1	K469	K469-K471 PolarHBondContact O-N 3.4Å
472	S	37.3	Very low	38.8	Very low	80 Å²	80	136.6 Å²	136.6	56%	0.559	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-20.3	-178.4	55.3	0	0	0	0	114.3
473	S	41.1	Very low	39.2	Very low	54 Å²	54	135.9 Å²	135.9	38%	0.378	67%	0.666	S	S	.	*	H	α-helix	trans	-70.5	-38.5	-179.3	37.9	0	0	0	0	112.8	Y470 Q476 T477	Y470-S473 PolarHBondContact O-OG 3.13Å; Y470-S473 VanDerWaalsContact O-OG 3.11Å; S473-Q476 WeakPolarHBondContact O-CA 3.43Å; S473-Q476 WeakPolarHBondContact O-CB 3.34Å; S473-Q476 PolarHBondContact O-N 3.38Å; S473-T477 PolarHBondContact O-N 2.83Å; S473-T477 PolarHBondContact O-OG1 3.35Å
474	L	41.4	Very low	39.4	Very low	116 Å²	116	131.8 Å²	131.8	61%	0.607	64%	0.644	S	S	*	*	H	α-helix	trans	-67.3	-43.6	-172.7	-151.3	72.8	0	0	0	112.8	Q476 T477 D478	L474-Q476 PolarHBondContact O-N 2.57Å; L474-T477 PolarHBondContact O-N 2.95Å; L474-T477 PolarHBondContact O-OG1 2.7Å; L474-D478 PolarHBondContact O-N 3.43Å
475	Q	41.5	Very low	39.9	Very low	147 Å²	147	127.3 Å²	127.3	69%	0.687	62%	0.622	S	S	*	*	H	α-helix	trans	-64.8	-21.7	172.2	-74.1	-172.4	-42.2	0	0	113.1	Q479	Q475-Q479 WeakPolarHBondContact O-CG 3.45Å
476	Q	42.5	Very low	40.2	Very low	130 Å²	130	120 Å²	120	61%	0.607	60%	0.604	S	S	*	*	H	α-helix	trans	-83.2	-29.1	179.4	-158.1	169	23.2	0	0	112	S473 L474 L480	S473-Q476 WeakPolarHBondContact O-CA 3.43Å; S473-Q476 WeakPolarHBondContact O-CB 3.34Å; S473-Q476 PolarHBondContact O-N 3.38Å; L474-Q476 PolarHBondContact O-N 2.57Å; Q476-L480 WeakPolarHBondContact O-CD1 2.96Å; Q476-L480 VanDerWaalsContact O-CG 3.31Å; Q476-L480 WeakPolarHBondContact O-CG 3.43Å
477	T	42	Very low	40.7	Very low	69 Å²	69	121.5 Å²	121.5	42%	0.423	60%	0.604	S	S	.	*	H	α-helix	trans	-69.8	-44.1	171.8	38.5	0	0	0	0	112.2	S473 L474 Q479 L480 I481	S473-T477 PolarHBondContact O-N 2.83Å; S473-T477 PolarHBondContact O-OG1 3.35Å; L474-T477 PolarHBondContact O-N 2.95Å; L474-T477 PolarHBondContact O-OG1 2.7Å; T477-Q479 PolarHBondContact O-N 3.44Å; T477-L480 WeakPolarHBondContact O-CB 3.45Å; T477-L480 PolarHBondContact O-N 2.74Å; T477-I481 PolarHBondContact O-N 3.14Å; T477-I481 VanDerWaalsContact O-N 3.13Å
478	D	44.5	Very low	41.2	Very low	93 Å²	93	119.4 Å²	119.4	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-63.5	-42.9	-176.6	-57.6	-20	0	0	0	111.7	L474 L480 I481 E482	L474-D478 PolarHBondContact O-N 3.43Å; D478-L480 PolarHBondContact O-N 2.78Å; D478-I481 PolarHBondContact O-N 2.82Å; D478-I481 VanDerWaalsContact O-N 3.17Å; D478-E482 PolarHBondContact O-N 3.45Å
479	Q	48.7	Very low	41.3	Very low	115 Å²	115	120.7 Å²	120.7	54%	0.537	59%	0.59	S	S	.	*	H	α-helix	trans	-65.8	-17.8	175.2	-71.5	-171	10	0	0	114.4	Q475 T477 K483	Q475-Q479 WeakPolarHBondContact O-CG 3.45Å; T477-Q479 PolarHBondContact O-N 3.44Å; Q479-K483 WeakPolarHBondContact O-CD 3.33Å; Q479-K483 WeakPolarHBondContact O-CG 3.5Å
480	L	47.1	Very low	41.6	Very low	112 Å²	112	119.6 Å²	119.6	59%	0.586	58%	0.582	S	S	*	*	H	α-helix	trans	-84.8	-35.4	173.6	-72.7	168.3	0	0	0	111.4	Q476 T477 D478 K483 S484	Q476-L480 WeakPolarHBondContact O-CD1 2.96Å; Q476-L480 VanDerWaalsContact O-CG 3.31Å; Q476-L480 WeakPolarHBondContact O-CG 3.43Å; T477-L480 WeakPolarHBondContact O-CB 3.45Å; T477-L480 PolarHBondContact O-N 2.74Å; D478-L480 PolarHBondContact O-N 2.78Å; L480-K483 PolarHBondContact O-N 3.2Å; L480-S484 PolarHBondContact O-N 3.29Å; L480-S484 VanDerWaalsContact O-N 3.14Å
481	I	44.8	Very low	42	Very low	103 Å²	103	116.6 Å²	116.6	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-68.1	-45.3	175.9	-64.2	166.1	0	0	0	110.5	T477 D478 K483 S484 T485	T477-I481 PolarHBondContact O-N 3.14Å; T477-I481 VanDerWaalsContact O-N 3.13Å; D478-I481 PolarHBondContact O-N 2.82Å; D478-I481 VanDerWaalsContact O-N 3.17Å; I481-K483 VanDerWaalsContact C-N 3.26Å; I481-K483 PolarHBondContact O-N 3.05Å; I481-S484 PolarHBondContact O-N 3.45Å; I481-S484 VanDerWaalsContact O-N 3.16Å; I481-S484 PolarHBondContact O-OG 2.98Å; I481-T485 PolarHBondContact O-N 2.92Å; I481-T485 PolarHBondContact O-OG1 2.93Å
482	E	45.8	Very low	42.1	Very low	135 Å²	135	114.5 Å²	114.5	63%	0.631	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-32.7	177.2	-167.1	-178.4	-148.6	0	0	112.5	D478 T485 S486	D478-E482 PolarHBondContact O-N 3.45Å; E482-T485 PolarHBondContact O-OG1 2.95Å; E482-S486 VanDerWaalsContact O-CB 3.26Å; E482-S486 WeakPolarHBondContact O-CB 3.44Å; E482-S486 PolarHBondContact O-N 2.77Å; E482-S486 PolarHBondContact O-OG 2.86Å
483	K	39.7	Very low	42.2	Very low	134 Å²	134	119.6 Å²	119.6	58%	0.583	57%	0.573	S	S	*	*	H	α-helix	trans	-74.3	-28.6	175.2	-82.4	174.4	-178.7	156.2	0	114	Q479 L480 I481 R487	Q479-K483 WeakPolarHBondContact O-CD 3.33Å; Q479-K483 WeakPolarHBondContact O-CG 3.5Å; L480-K483 PolarHBondContact O-N 3.2Å; I481-K483 VanDerWaalsContact C-N 3.26Å; I481-K483 PolarHBondContact O-N 3.05Å; K483-R487 PolarHBondContact O-N 3.4Å
484	S	39.2	Very low	42.1	Very low	60 Å²	60	122.5 Å²	122.5	42%	0.42	58%	0.579	S	S	.	*	H	α-helix	trans	-77.5	-45.6	-179.5	71.1	0	0	0	0	111.4	L480 I481 R487 Q488	L480-S484 PolarHBondContact O-N 3.29Å; L480-S484 VanDerWaalsContact O-N 3.14Å; I481-S484 PolarHBondContact O-N 3.45Å; I481-S484 VanDerWaalsContact O-N 3.16Å; I481-S484 PolarHBondContact O-OG 2.98Å; S484-R487 WeakPolarHBondContact O-CB 3.06Å; S484-R487 PolarHBondContact O-N 2.79Å; S484-R487 VanDerWaalsContact O-N 3.17Å; S484-Q488 PolarHBondContact O-N 3.42Å
485	T	41.2	Very low	42	Very low	63 Å²	63	124.5 Å²	124.5	39%	0.387	58%	0.58	S	S	.	*	H	α-helix	trans	-62.6	-43.9	175.4	55.4	0	0	0	0	111.5	I481 E482 R487 Q488 Q489	I481-T485 PolarHBondContact O-N 2.92Å; I481-T485 PolarHBondContact O-OG1 2.93Å; E482-T485 PolarHBondContact O-OG1 2.95Å; T485-R487 VanDerWaalsContact C-N 3.27Å; T485-R487 PolarHBondContact O-N 3.4Å; T485-Q488 PolarHBondContact O-N 3.07Å; T485-Q488 VanDerWaalsContact O-N 3.14Å; T485-Q489 PolarHBondContact O-N 3.27Å
486	S	37.5	Very low	41.7	Very low	66 Å²	66	121.2 Å²	121.2	46%	0.462	57%	0.572	S	S	.	*	H	α-helix	trans	-55.2	-39.7	172.9	-66.5	0	0	0	0	112.9	E482 Y490	E482-S486 VanDerWaalsContact O-CB 3.26Å; E482-S486 WeakPolarHBondContact O-CB 3.44Å; E482-S486 PolarHBondContact O-N 2.77Å; E482-S486 PolarHBondContact O-OG 2.86Å; S486-Y490 PolarHBondContact O-N 2.84Å
487	R	43.3	Very low	41.2	Very low	188 Å²	188	123.8 Å²	123.8	71%	0.709	58%	0.581	S	S	*	*	H	α-helix	trans	-68.6	-45.6	175.1	-88.8	-177.6	166.3	-175.1	-3	112	K483 S484 T485 Q489 Y490 Y491	K483-R487 PolarHBondContact O-N 3.4Å; S484-R487 WeakPolarHBondContact O-CB 3.06Å; S484-R487 PolarHBondContact O-N 2.79Å; S484-R487 VanDerWaalsContact O-N 3.17Å; T485-R487 VanDerWaalsContact C-N 3.27Å; T485-R487 PolarHBondContact O-N 3.4Å; R487-Q489 PolarHBondContact O-N 2.97Å; R487-Y490 PolarHBondContact O-N 2.89Å; R487-Y490 VanDerWaalsContact O-N 3.17Å; R487-Y491 WeakPolarHBondContact O-CD2 3.42Å; R487-Y491 PolarHBondContact O-N 3.44Å
488	Q	41.2	Very low	40.8	Very low	138 Å²	138	126 Å²	126	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-60	-44.6	179.1	-73	-176.7	-12.6	0	0	111.9	S484 T485 Y490 Y491 F492	S484-Q488 PolarHBondContact O-N 3.42Å; T485-Q488 PolarHBondContact O-N 3.07Å; T485-Q488 VanDerWaalsContact O-N 3.14Å; Q488-Y490 VanDerWaalsContact C-N 3.32Å; Q488-Y490 PolarHBondContact O-N 3.26Å; Q488-Y491 PolarHBondContact O-N 3.26Å; Q488-F492 PolarHBondContact O-N 3.36Å
489	Q	43	Very low	40.2	Very low	143 Å²	143	128 Å²	128	67%	0.668	61%	0.612	S	S	*	*	H	α-helix	trans	-60.2	-39.7	174.9	-69.6	-173.7	4.4	0	0	112.5	T485 R487 F492 K493	T485-Q489 PolarHBondContact O-N 3.27Å; R487-Q489 PolarHBondContact O-N 2.97Å; Q489-F492 PolarHBondContact O-N 2.82Å; Q489-K493 VanDerWaalsContact O-CB 3.26Å; Q489-K493 WeakPolarHBondContact O-CB 3.46Å; Q489-K493 PolarHBondContact O-N 3.3Å
490	Y	41.9	Very low	39.4	Very low	161 Å²	161	131.6 Å²	131.6	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-65	-37.7	176.4	-177.8	-105.4	0	0	0	112.8	S486 R487 Q488 K494	S486-Y490 PolarHBondContact O-N 2.84Å; R487-Y490 PolarHBondContact O-N 2.89Å; R487-Y490 VanDerWaalsContact O-N 3.17Å; Q488-Y490 VanDerWaalsContact C-N 3.32Å; Q488-Y490 PolarHBondContact O-N 3.26Å; Y490-K494 VanDerWaalsContact O-CB 3.27Å; Y490-K494 WeakPolarHBondContact O-CB 3.15Å; Y490-K494 PolarHBondContact O-N 3.01Å
491	Y	40.5	Very low	38.7	Very low	143 Å²	143	133.9 Å²	133.9	56%	0.561	64%	0.638	S	S	*	*	H	α-helix	trans	-66.2	-50.1	172.5	-87.5	-88.7	0	0	0	111.5	R487 Q488 K493 K494 Y495	R487-Y491 WeakPolarHBondContact O-CD2 3.42Å; R487-Y491 PolarHBondContact O-N 3.44Å; Q488-Y491 PolarHBondContact O-N 3.26Å; Y491-K493 VanDerWaalsContact C-N 3.3Å; Y491-K493 PolarHBondContact O-N 3.38Å; Y491-K494 PolarHBondContact O-N 3.39Å; Y491-Y495 HydrophobicContact CD1-CD2 4.37Å; Y491-Y495 AromaticContact CD1-CE2 3.89Å; Y491-Y495 HydrophobicContact CD1-CE2 3.89Å; Y491-Y495 HydrophobicContact CE1-CE2 4.35Å; Y491-Y495 WeakPolarHBondContact O-CD2 3.23Å; Y491-Y495 PolarHBondContact O-N 3.23Å
492	F	40.1	Very low	38	Very low	155 Å²	155	137.3 Å²	137.3	68%	0.68	66%	0.656	S	S	*	*	H	α-helix	trans	-55.7	-46.5	-179.7	-139.1	-87.1	0	0	0	111.5	Q488 Q489 K494 C496	Q488-F492 PolarHBondContact O-N 3.36Å; Q489-F492 PolarHBondContact O-N 2.82Å; F492-K494 PolarHBondContact O-N 3.2Å; F492-C496 WeakPolarHBondContact O-CB 3.3Å; F492-C496 PolarHBondContact O-N 2.87Å
493	K	38.9	Very low	37.3	Very low	186 Å²	186	135.6 Å²	135.6	81%	0.809	66%	0.659	S	S	*	*	H	α-helix	trans	-71.3	-11.6	180	-156.8	168.7	-168.8	168.5	0	114.5	Q489 Y491	Q489-K493 VanDerWaalsContact O-CB 3.26Å; Q489-K493 WeakPolarHBondContact O-CB 3.46Å; Q489-K493 PolarHBondContact O-N 3.3Å; Y491-K493 VanDerWaalsContact C-N 3.3Å; Y491-K493 PolarHBondContact O-N 3.38Å
494	K	38.6	Very low	36.8	Very low	116 Å²	116	140.4 Å²	140.4	50%	0.504	67%	0.673	S	S	.	*	H	α-helix	trans	-94.2	-34.1	179	-175.9	-179.1	175.4	-162.2	0	113.1	Y490 Y491 F492	Y490-K494 VanDerWaalsContact O-CB 3.27Å; Y490-K494 WeakPolarHBondContact O-CB 3.15Å; Y490-K494 PolarHBondContact O-N 3.01Å; Y491-K494 PolarHBondContact O-N 3.39Å; F492-K494 PolarHBondContact O-N 3.2Å
495	Y	40.5	Very low	36.4	Very low	157 Å²	157	146.4 Å²	146.4	62%	0.616	69%	0.692	S	S	*	*	H	α-helix	trans	-98.5	-30.1	-177.7	-68.9	-91.1	0	0	0	112.8	Y491 K497	Y491-Y495 HydrophobicContact CD1-CD2 4.37Å; Y491-Y495 AromaticContact CD1-CE2 3.89Å; Y491-Y495 HydrophobicContact CD1-CE2 3.89Å; Y491-Y495 HydrophobicContact CE1-CE2 4.35Å; Y491-Y495 WeakPolarHBondContact O-CD2 3.23Å; Y491-Y495 PolarHBondContact O-N 3.23Å; Y495-K497 PolarHBondContact O-N 3.34Å
496	C	33.6	Very low	36	Very low	78 Å²	78	148.2 Å²	148.2	53%	0.527	71%	0.707	S	S	.	*			trans	-80.9	76.5	170.9	-63.5	0	0	0	0	111.9	F492	F492-C496 WeakPolarHBondContact O-CB 3.3Å; F492-C496 PolarHBondContact O-N 2.87Å
497	K	33.6	Very low	35.7	Very low	185 Å²	185	152.4 Å²	152.4	80%	0.804	73%	0.725	S	S	*	*			trans	-81.2	119.9	159.7	-90	-173.9	175.7	178.7	0	109.2	Y495 V499	Y495-K497 PolarHBondContact O-N 3.34Å; K497-V499 PolarHBondContact O-N 2.92Å
498	P	33.5	Very low	35.1	Very low	114 Å²	114	152.2 Å²	152.2	74%	0.74	73%	0.729	S	S	*	*			trans	-65.9	134.5	174.4	27.1	-33.5	0	0	0	110.3	K500	P498-K500 PolarHBondContact O-N 3.2Å
499	V	32.4	Very low	34.6	Very low	135 Å²	135	151.9 Å²	151.9	82%	0.818	74%	0.737	S	S	*	*			trans	-66	105.7	172.2	177.3	0	0	0	0	108	K497 L501	K497-V499 PolarHBondContact O-N 2.92Å; V499-L501 PolarHBondContact O-N 3.3Å
500	K	31.3	Very low	34	Very low	192 Å²	192	150.3 Å²	150.3	84%	0.835	74%	0.737	S	S	*	*			trans	-69.8	98.2	171.4	-82.2	-169.3	171.9	-174.2	0	109.2	P498 L502	P498-K500 PolarHBondContact O-N 3.2Å; K500-L502 PolarHBondContact O-N 2.98Å
501	L	31.6	Very low	33.5	Very low	160 Å²	160	150.4 Å²	150.4	84%	0.838	75%	0.748	S	S	*	*			trans	-47	126.7	162.3	-80	159.8	0	0	0	109.5	V499 S503	V499-L501 PolarHBondContact O-N 3.3Å; L501-S503 PolarHBondContact O-N 2.55Å
502	L	30.4	Very low	33	Very low	174 Å²	174	149.1 Å²	149.1	91%	0.911	76%	0.755	S	S	*	*			trans	-76.4	72.8	-179.5	-81.9	166.4	0	0	0	110.7	K500 R504	K500-L502 PolarHBondContact O-N 2.98Å; L502-R504 PolarHBondContact O-N 2.96Å
503	S	30.6	Very low	32.6	Very low	99 Å²	99	149 Å²	149	69%	0.692	76%	0.762	S	S	*	*			trans	-56.8	106.7	164.8	-179.9	0	0	0	0	108.9	L501 K505	L501-S503 PolarHBondContact O-N 2.55Å; S503-K505 PolarHBondContact O-N 2.88Å
504	R	28.8	Very low	32.4	Very low	235 Å²	235	144.3 Å²	144.3	89%	0.887	75%	0.752	S	S	*	*			trans	-73.9	66.9	-174.5	-169.2	-178.1	-175.6	178.2	1.7	110.8	L502 S506	L502-R504 PolarHBondContact O-N 2.96Å; R504-S506 PolarHBondContact O-N 2.82Å; R504-S506 VanDerWaalsContact O-N 3.11Å
505	K	31.9	Very low	32	Very low	187 Å²	187	146.2 Å²	146.2	81%	0.813	77%	0.768	S	S	*	*			trans	-60.4	115.8	177.1	-90.1	-166.1	171.7	-173.1	0	110.5	S503 N507	S503-K505 PolarHBondContact O-N 2.88Å; K505-N507 PolarHBondContact O-N 2.91Å
506	S	31.9	Very low	31.6	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	77%	0.772	S	S	*	*			trans	-66.4	125.1	170.1	-178.9	0	0	0	0	110	R504 K508	R504-S506 PolarHBondContact O-N 2.82Å; R504-S506 VanDerWaalsContact O-N 3.11Å; S506-K508 VanDerWaalsContact C-N 3.33Å; S506-K508 PolarHBondContact O-N 3.32Å
507	N	31.6	Very low	31.6	Very low	154 Å²	154	147 Å²	147	82%	0.824	79%	0.785	S	S	*	*			trans	-75.6	85.6	168.2	-82.4	-9	0	0	0	109.6	K505 T509	K505-N507 PolarHBondContact O-N 2.91Å; N507-T509 PolarHBondContact O-N 2.91Å
508	K	30.6	Very low	31.2	Very low	183 Å²	183	144.6 Å²	144.6	80%	0.796	79%	0.791	S	S	*	*			trans	-88.9	89.2	157.7	-100	-175	172.3	-179.5	0	109	S506 V510	S506-K508 VanDerWaalsContact C-N 3.33Å; S506-K508 PolarHBondContact O-N 3.32Å; K508-V510 PolarHBondContact O-N 2.8Å
509	T	31	Very low	31	Very low	132 Å²	132	142.2 Å²	142.2	81%	0.81	79%	0.787	S	S	*	*			trans	-69.8	89.6	169.9	7.8	0	0	0	0	109.8	N507 N511	N507-T509 PolarHBondContact O-N 2.91Å; T509-N511 PolarHBondContact O-N 3.3Å
510	V	30.6	Very low	30.7	Very low	110 Å²	110	146 Å²	146	67%	0.667	79%	0.792	S	S	*	*			trans	-83.7	87.6	170	-179.4	0	0	0	0	108.5	K508 T512	K508-V510 PolarHBondContact O-N 2.8Å; V510-T512 HydrophobicContact CG1-CG2 4Å; V510-T512 PolarHBondContact O-N 2.03Å
511	N	31.5	Very low	30.7	Very low	162 Å²	162	142.5 Å²	142.5	87%	0.866	79%	0.792	S	S	*	*			trans	-88.5	88	166.3	-108.5	18.7	0	0	0	109	T509 N513	T509-N511 PolarHBondContact O-N 3.3Å; N511-N513 PolarHBondContact O-N 2.8Å
512	T	29.4	Very low	30.5	Very low	117 Å²	117	141.7 Å²	141.7	72%	0.718	79%	0.788	S	S	*	*			trans	-77	107.6	164.1	44	0	0	0	0	109.5	V510	V510-T512 HydrophobicContact CG1-CG2 4Å; V510-T512 PolarHBondContact O-N 2.03Å
513	N	33	Very low	30.6	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	78%	0.779	S	S	*	*			trans	-152.9	110.3	151.6	-104.3	-17	0	0	0	111.2	N511	N511-N513 PolarHBondContact O-N 2.8Å
514	S	33.2	Very low	30.5	Very low	86 Å²	86	143.3 Å²	143.3	60%	0.601	79%	0.785	S	S	*	*			trans	14.1	130	146.9	58.9	0	0	0	0	120.5
515	N	31.1	Very low	30.7	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	77%	0.773	S	S	*	*			trans	68	132.7	144.8	-54.4	-11.5	0	0	0	116.5
516	S	33	Very low	30.7	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	76%	0.761	S	S	*	*			cis	-166.9	161	13.7	50.3	0	0	0	0	112.9
517	N	32.1	Very low	30.6	Very low	150 Å²	150	136.6 Å²	136.6	80%	0.802	76%	0.761	S	S	*	*			trans	48.9	111.5	146.1	-65.9	-4.4	0	0	0	123
518	C	26.2	Very low	30.6	Very low	135 Å²	135	139 Å²	139	91%	0.912	76%	0.76	S	S	*	*				84.9	148.7	120.2	-160.6	0	0	0	0	121
519	G	29.5	Very low	30.5	Very low	64 Å²	64	139.7 Å²	139.7	66%	0.66	76%	0.763	S	S	*	*			trans	86.8	110.9	178.7	0	0	0	0	0	112.7
520	K	26	Very low	30.6	Very low	214 Å²	214	138.1 Å²	138.1	93%	0.93	76%	0.755	S	S	*	*			cis	52.7	93.5	41.2	-71.9	-169.1	179	-178.6	0	114.8
521	S	31.1	Very low	30.7	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	77%	0.765	S	S	*	*				-177.1	157	111	60.5	0	0	0	0	113.5
522	N	27.2	Very low	30.7	Very low	143 Å²	143	141.4 Å²	141.4	77%	0.765	76%	0.761	S	S	*	*			trans	-66.5	152.8	175.2	-52.6	-28.8	0	0	0	113
523	N	32	Very low	31	Very low	134 Å²	134	140.4 Å²	140.4	72%	0.717	76%	0.757	S	S	*	*				-173.6	129.2	115	-92.5	-18.1	0	0	0	110
524	Q	29.2	Very low	31	Very low	173 Å²	173	140 Å²	140	81%	0.808	75%	0.754	S	S	*	*				53.1	126.7	98.1	-60	-173.1	-8.4	0	0	113.3
525	S	32.1	Very low	30.9	Very low	91 Å²	91	141.4 Å²	141.4	64%	0.636	76%	0.764	S	S	*	*			cis	-166.2	169.5	46.6	58.8	0	0	0	0	114.5
526	N	32	Very low	30.9	Very low	106 Å²	106	137.2 Å²	137.2	57%	0.567	76%	0.758	S	S	*	*			trans	69.2	103.7	156.4	-56.3	-34.5	0	0	0	117.3
527	R	29.6	Very low	30.8	Very low	184 Å²	184	141.5 Å²	141.5	69%	0.694	77%	0.767	S	S	*	*				88.5	131.4	79	-87.1	-177.2	-84.3	176.7	-4.5	111.3
528	Y	32.2	Very low	30.5	Very low	205 Å²	205	143.2 Å²	143.2	80%	0.804	77%	0.767	S	S	*	*			cis	-125.5	-176.1	11	-110.1	-75.9	0	0	0	113.8
529	F	28.5	Very low	30.7	Very low	198 Å²	198	144.6 Å²	144.6	87%	0.868	76%	0.764	S	S	*	*			trans	-100.4	165.7	-156.2	-104.2	-120.4	0	0	0	116.4
530	P	32.6	Very low	30.5	Very low	98 Å²	98	147.3 Å²	147.3	64%	0.636	76%	0.763	S	S	*	*			trans	-112.6	-177.5	-171.7	43.4	-34.1	0	0	0	114.3
531	I	32.8	Very low	30.7	Very low	173 Å²	173	146.3 Å²	146.3	89%	0.887	76%	0.761	S	S	*	*			trans	-130.4	126.7	148.7	-60.2	-178	0	0	0	109.5
532	H	31.8	Very low	30.5	Very low	168 Å²	168	145.5 Å²	145.5	78%	0.778	76%	0.755	S	S	*	*			trans	-122.6	178.2	167	-121.3	-73.4	0	0	0	105.2
533	P	35.9	Very low	30.6	Very low	96 Å²	96	146 Å²	146	62%	0.623	76%	0.758	S	S	*	*			cis	-120	-164.8	-7.1	26.8	-0.1	0	0	0	110.2
534	D	32.4	Very low	30.7	Very low	144 Å²	144	145.3 Å²	145.3	77%	0.77	76%	0.76	S	S	*	*				-159.2	168.8	60.9	-95	-39.7	0	0	0	115.4
535	S	32	Very low	30.6	Very low	116 Å²	116	145.8 Å²	145.8	81%	0.811	76%	0.762	S	S	*	*			trans	-28.4	148	-179.7	55.6	0	0	0	0	119.5
536	G	30.5	Very low	30.5	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	76%	0.764	S	S	*	*			cis	166.1	-176.2	-0.8	0	0	0	0	0	115.1
537	H	31.1	Very low	30.4	Very low	191 Å²	191	148.6 Å²	148.6	88%	0.884	77%	0.772	S	S	*	*			trans	65.7	109.5	175.2	-84.1	-83.2	0	0	0	120.6
538	F	25.6	Very low	30.2	Very low	187 Å²	187	146.5 Å²	146.5	82%	0.82	77%	0.774	S	S	*	*			trans	-71.2	155.2	153.8	-76	-113.9	0	0	0	111.2
539	I	30.5	Very low	30	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	77%	0.771	S	S	*	*				-160.5	148.6	122.1	-100.7	154.6	0	0	0	108.7
540	N	25.7	Very low	30	Very low	120 Å²	120	138.4 Å²	138.4	64%	0.642	77%	0.768	S	S	*	*			trans	-102.3	139.9	167.9	-62.1	-101.1	0	0	0	108.2
541	H	31	Very low	29.9	Very low	193 Å²	193	139 Å²	139	89%	0.894	77%	0.77	S	S	*	*				-163.6	169.2	129.5	-116.5	-82.5	0	0	0	111.3
542	C	26.7	Very low	29.7	Very low	102 Å²	102	138.2 Å²	138.2	69%	0.689	77%	0.767	S	S	*	*			trans	-95	178.4	-176.6	-57.1	0	0	0	0	112.8
543	D	27.7	Very low	29.5	Very low	155 Å²	155	138.4 Å²	138.4	83%	0.829	77%	0.773	S	S	*	*			trans	84.8	147.1	158.1	-54.8	-31.8	0	0	0	117.1
544	P	34.9	Very low	29.1	Very low	118 Å²	118	140 Å²	140	77%	0.766	78%	0.781	S	S	*	*			trans	-130.3	132.1	-138.6	36.8	-19.5	0	0	0	115.9
545	E	27	Very low	28.9	Very low	184 Å²	184	138.7 Å²	138.7	86%	0.86	78%	0.783	S	S	*	*			trans	-164.2	168.8	148.6	-126.5	177.5	-159.7	0	0	112.4
546	V	29.3	Very low	28.7	Very low	110 Å²	110	139.9 Å²	139.9	67%	0.667	78%	0.78	S	S	*	*			trans	69.1	108.6	148.4	167.9	0	0	0	0	120.4
547	I	29.7	Very low	28.7	Very low	145 Å²	145	143 Å²	143	74%	0.744	79%	0.786	S	S	*	*			trans	76.9	121.6	136.2	-68.1	-179.5	0	0	0	122.1
548	L	26.8	Very low	28.6	Very low	141 Å²	141	142.8 Å²	142.8	74%	0.738	78%	0.782	S	S	*	*			trans	34.4	151	145	-79	84.2	0	0	0	124.6
549	N	26.7	Very low	28.7	Very low	136 Å²	136	144.5 Å²	144.5	73%	0.727	79%	0.785	S	S	*	*			trans	85	89.8	151.3	-69.7	-5.6	0	0	0	120.5
550	A	29.1	Very low	28.6	Very low	97 Å²	97	147.8 Å²	147.8	80%	0.802	79%	0.786	S	S	*	*			trans	-147.7	76.9	133.4	0	0	0	0	0	109.1
551	T	31.1	Very low	28.7	Very low	111 Å²	111	148 Å²	148	68%	0.681	79%	0.794	S	S	*	*				48.3	85.7	97.1	65.2	0	0	0	0	115.3
552	N	28.5	Very low	28.8	Very low	156 Å²	156	146.9 Å²	146.9	83%	0.834	79%	0.793	S	S	*	*			trans	-177.9	69.9	133.5	-95.6	-11.9	0	0	0	113.2
553	L	27.2	Very low	29	Very low	172 Å²	172	149.3 Å²	149.3	90%	0.901	80%	0.799	S	S	*	*			trans	-178.3	109.7	137.8	-123.4	70.8	0	0	0	108.4
554	T	26.9	Very low	29.3	Very low	129 Å²	129	146.9 Å²	146.9	79%	0.791	79%	0.792	S	S	*	*			trans	-147.3	117.6	-179.3	45.9	0	0	0	0	111.3
555	S	29.5	Very low	29.2	Very low	116 Å²	116	148.7 Å²	148.7	81%	0.811	80%	0.795	S	S	*	*			trans	-136.9	72.4	167.5	60.3	0	0	0	0	108.3	V557	S555-V557 PolarHBondContact O-N 2.78Å
556	D	28.2	Very low	29.6	Very low	141 Å²	141	144.9 Å²	144.9	75%	0.754	79%	0.789	S	S	*	*			trans	-61.6	123.6	175.2	-94.2	-68.7	0	0	0	110.8
557	V	29.3	Very low	29.8	Very low	136 Å²	136	147 Å²	147	82%	0.824	80%	0.796	S	S	*	*			trans	-104	88.7	164.1	-178.3	0	0	0	0	108	S555	S555-V557 PolarHBondContact O-N 2.78Å
558	K	29.2	Very low	29.7	Very low	185 Å²	185	145 Å²	145	80%	0.804	80%	0.796	S	S	*	*			trans	-139.9	106.9	177.5	-144.1	167.5	-166	165.7	0	111.9	R560	K558-R560 PolarHBondContact O-N 2.85Å
559	Y	27.1	Very low	30.1	Very low	224 Å²	224	143.4 Å²	143.4	88%	0.878	79%	0.793	S	S	*	*			trans	-54.7	128.1	178.7	-93.3	-111.1	0	0	0	113
560	R	28.1	Very low	30.3	Very low	233 Å²	233	144.9 Å²	144.9	88%	0.879	80%	0.8	S	S	*	*			trans	-142.2	144.6	138.3	-77.4	-162.9	-179.8	-177.2	1.6	109.6	K558	K558-R560 PolarHBondContact O-N 2.85Å
561	P	28.6	Very low	30.5	Very low	123 Å²	123	143.9 Å²	143.9	80%	0.799	80%	0.799	S	S	*	*			trans	-79.2	161.8	175	34.6	-35.5	0	0	0	111.6
562	I	32.4	Very low	30.4	Very low	170 Å²	170	147.4 Å²	147.4	87%	0.872	81%	0.808	S	S	*	*			trans	-130	138.5	165.4	-62.9	174.9	0	0	0	106.6
563	D	32.6	Very low	30.6	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	81%	0.807	S	S	*	*			trans	-73.2	158.1	179	-83.1	-58.9	0	0	0	112.7
564	P	33.2	Very low	30.7	Very low	105 Å²	105	145.3 Å²	145.3	68%	0.682	80%	0.802	S	S	*	*			trans	-84.4	155.5	-178.1	35.4	-36.4	0	0	0	113.2
565	D	33.5	Very low	30.7	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	80%	0.803	S	S	*	*				-178.5	172.8	128.3	-96.4	-18.9	0	0	0	111.6
566	S	33.9	Very low	30.8	Very low	104 Å²	104	150.4 Å²	150.4	73%	0.727	80%	0.804	S	S	*	*			trans	72.6	94.6	176.5	63.9	0	0	0	0	119.1
567	D	34	Very low	30.9	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	80%	0.803	S	S	*	*				66.1	88.9	120.3	-52.7	-27.9	0	0	0	121.8
568	S	28.1	Very low	30.6	Very low	104 Å²	104	153.5 Å²	153.5	73%	0.727	81%	0.807	S	S	*	*			trans	-26.9	166.2	134.1	71.6	0	0	0	0	116.4
569	P	35.6	Very low	30.6	Very low	106 Å²	106	150.4 Å²	150.4	69%	0.688	81%	0.805	S	S	*	*			cis	-160.7	-170.7	44.7	46.9	-24.3	0	0	0	120.5
570	I	31.1	Very low	30.5	Very low	168 Å²	168	149.1 Å²	149.1	86%	0.862	80%	0.804	S	S	*	*			trans	80.6	119.5	160.5	-63.3	164.9	0	0	0	118
571	G	32.5	Very low	30.6	Very low	76 Å²	76	147.2 Å²	147.2	78%	0.784	80%	0.803	S	S	*	*			trans	165.9	81	174.4	0	0	0	0	0	110.1
572	Q	29	Very low	30.7	Very low	185 Å²	185	148.2 Å²	148.2	86%	0.864	80%	0.801	S	S	*	*			trans	-90.5	-176.8	-167	-71.1	-172.5	-16.9	0	0	114.8
573	V	31.9	Very low	30.4	Very low	137 Å²	137	147.6 Å²	147.6	83%	0.83	80%	0.799	S	S	*	*			trans	85.7	116.4	179.2	-173.6	0	0	0	0	112.4
574	N	30.9	Very low	30.2	Very low	146 Å²	146	146.1 Å²	146.1	78%	0.781	80%	0.801	S	S	*	*			cis	-151.9	-170.6	-5	-150.5	-17.7	0	0	0	112
575	K	25.9	Very low	30	Very low	190 Å²	190	145.6 Å²	145.6	83%	0.826	81%	0.805	S	S	*	*			trans	-140.6	123.9	171.9	-78.5	179.4	175.8	173.2	0	113.4
576	I	31.5	Very low	29.8	Very low	163 Å²	163	146 Å²	146	84%	0.836	81%	0.807	S	S	*	*			trans	-150.7	134.8	156.9	-55.3	-178	0	0	0	106.5
577	S	30.9	Very low	29.4	Very low	103 Å²	103	146.1 Å²	146.1	72%	0.72	81%	0.808	S	S	*	*			cis	-158.1	-176.6	-27.4	68.9	0	0	0	0	109
578	R	22.2	Very low	29.4	Very low	239 Å²	239	146 Å²	146	90%	0.902	81%	0.807	S	S	*	*			trans	-148.9	136.4	160.1	-80.5	-167.7	-179.2	-173	0.7	110.1
579	P	29.2	Very low	29.6	Very low	119 Å²	119	148.2 Å²	148.2	77%	0.773	81%	0.81	S	S	*	*			trans	-79	152.7	161.5	14.5	-1	0	0	0	111.4
580	K	25.7	Very low	29.2	Very low	198 Å²	198	151 Å²	151	86%	0.861	82%	0.817	S	S	*	*			trans	-113.1	140.3	162.8	-73.1	-175.8	174.9	-173.3	0	108.7
581	F	30.8	Very low	29.3	Very low	193 Å²	193	150.7 Å²	150.7	85%	0.846	81%	0.811	S	S	*	*			trans	-127	117	145.8	-87.4	-97.3	0	0	0	106.3
582	L	30.3	Very low	29.2	Very low	144 Å²	144	153.7 Å²	153.7	75%	0.754	81%	0.81	S	S	*	*				96.1	110.2	58.7	-151.9	165.6	0	0	0	109.2
583	D	26.1	Very low	29.2	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	80%	0.802	S	S	*	*			trans	-71.9	147.1	-169.4	-50.9	-89	0	0	0	113.5
584	S	29	Very low	29	Very low	123 Å²	123	151.7 Å²	151.7	86%	0.86	80%	0.799	S	S	*	*			trans	-142	123.3	145.6	62.2	0	0	0	0	109.3
585	A	28.2	Very low	29	Very low	93 Å²	93	150.5 Å²	150.5	77%	0.769	80%	0.797	S	S	*	*			trans	-91.5	140.1	175.9	0	0	0	0	0	109.9
586	N	28.9	Very low	29.2	Very low	164 Å²	164	150.7 Å²	150.7	88%	0.877	80%	0.798	S	S	*	*			trans	-150.6	92.7	160.6	-111.4	-31.5	0	0	0	110.2
587	S	26.8	Very low	29.1	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	80%	0.796	S	S	*	*			trans	-78.3	128.5	166.5	53.1	0	0	0	0	109.8
588	N	33.1	Very low	28.9	Very low	152 Å²	152	153.8 Å²	153.8	81%	0.813	80%	0.8	S	S	*	*			trans	-165.5	156.7	155.9	-112	-34.4	0	0	0	115.5
589	I	32	Very low	29.3	Very low	151 Å²	151	147.8 Å²	147.8	77%	0.774	80%	0.795	S	S	*	*			trans	74.5	110.8	164.3	-61	154.5	0	0	0	117.3
590	I	27.6	Very low	29	Very low	164 Å²	164	150.2 Å²	150.2	84%	0.841	80%	0.801	S	S	*	*			trans	-100.8	128.5	163.2	-66.4	165.2	0	0	0	108
591	H	32.5	Very low	29.3	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.745	80%	0.795	S	S	*	*			trans	-172.7	152.4	157.9	-97.5	-56.5	0	0	0	108.3
592	N	30	Very low	29.2	Very low	140 Å²	140	145.3 Å²	145.3	75%	0.749	79%	0.792	S	S	*	*			cis	-145.2	168.1	-4	-148.2	5.2	0	0	0	111.2
593	I	30.4	Very low	29	Very low	136 Å²	136	145.3 Å²	145.3	70%	0.697	79%	0.792	S	S	*	*			trans	-111.4	145	-175.4	-79.8	173.5	0	0	0	112.1
594	N	28	Very low	29.2	Very low	143 Å²	143	147.6 Å²	147.6	77%	0.765	79%	0.794	S	S	*	*			trans	66.6	134.6	169.5	-64.9	-27	0	0	0	119.2
595	T	30.7	Very low	29.1	Very low	122 Å²	122	148.8 Å²	148.8	75%	0.748	79%	0.791	S	S	*	*				175.4	164.5	103.4	34.9	0	0	0	0	112.3
596	F	29.3	Very low	29.2	Very low	193 Å²	193	150.2 Å²	150.2	85%	0.846	80%	0.795	S	S	*	*			trans	56.4	117.3	174.3	-60.8	-79.6	0	0	0	117.7
597	K	29.2	Very low	29.1	Very low	180 Å²	180	147.9 Å²	147.9	78%	0.783	79%	0.787	S	S	*	*			cis	81.8	100.5	12.3	-147.2	-177.7	-171.3	-179.2	0	117.3
598	N	26.3	Very low	29.3	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	79%	0.792	S	S	*	*			trans	62.9	114.9	156	-66.8	19.2	0	0	0	120.9
599	S	30.7	Very low	29	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	78%	0.783	S	S	*	*			trans	-151.4	113.8	143.9	58.5	0	0	0	0	110.8
600	N	24	Very low	29	Very low	169 Å²	169	146.9 Å²	146.9	90%	0.904	78%	0.78	S	S	*	*			trans	-105.7	124.6	171	-79.4	-3.4	0	0	0	109.4
601	T	31.2	Very low	29.1	Very low	119 Å²	119	146.7 Å²	146.7	73%	0.73	77%	0.773	S	S	*	*			trans	-151.2	110.4	161.3	38.1	0	0	0	0	106.9
602	E	28.9	Very low	28.9	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	77%	0.772	S	S	*	*				65.5	94.2	95.9	-66.8	-167	150.3	0	0	112.6
603	I	26.5	Very low	28.8	Very low	145 Å²	145	147.6 Å²	147.6	74%	0.744	78%	0.778	S	S	*	*				70.9	112	92.4	-67	164.5	0	0	0	112.9
604	K	30.3	Very low	28.6	Very low	203 Å²	203	148.6 Å²	148.6	88%	0.883	78%	0.783	S	S	*	*			trans	-154.6	131.9	136.4	-113.1	169.2	-172.3	176.1	0	110.4
605	N	25.6	Very low	28.6	Very low	149 Å²	149	149.8 Å²	149.8	80%	0.797	79%	0.786	S	S	*	*			trans	-88.7	148	177.2	-66.6	-21.2	0	0	0	110.7
606	S	31.4	Very low	28.5	Very low	122 Å²	122	153.1 Å²	153.1	85%	0.853	79%	0.791	S	S	*	*			trans	-141.1	120.2	151.1	55	0	0	0	0	108.2
607	T	26.9	Very low	28.5	Very low	116 Å²	116	149.5 Å²	149.5	71%	0.712	79%	0.788	S	S	*	*			trans	-99.8	-175.2	-173.8	44.7	0	0	0	0	111.7
608	I	30.8	Very low	28.6	Very low	168 Å²	168	149 Å²	149	86%	0.862	79%	0.788	S	S	*	*			trans	80.2	134	170.6	-50.7	163.8	0	0	0	113.2
609	S	27.6	Very low	28.7	Very low	88 Å²	88	149.2 Å²	149.2	62%	0.615	79%	0.789	S	S	*	*			cis	-167.8	138.8	-23.6	-179.7	0	0	0	0	108
610	D	30.8	Very low	28.6	Very low	133 Å²	133	153.9 Å²	153.9	71%	0.711	79%	0.79	S	S	*	*				173.1	124.9	116.2	-91.1	-9.4	0	0	0	115.1
611	K	31.1	Very low	28.8	Very low	160 Å²	160	153.7 Å²	153.7	70%	0.696	78%	0.782	S	S	*	*			trans	32.5	123.8	142.6	-66	175.1	178.9	170	0	122.4
612	Q	27.4	Very low	28.6	Very low	156 Å²	156	156.9 Å²	156.9	73%	0.729	79%	0.791	S	S	*	*				59.4	107.6	128.9	-57.7	169.8	-98.8	0	0	116.4
613	D	28.7	Very low	28.5	Very low	164 Å²	164	155 Å²	155	88%	0.877	79%	0.785	S	S	*	*				-141.2	162.1	70.6	-96.2	-33.2	0	0	0	115.8
614	I	26.1	Very low	28.6	Very low	157 Å²	157	156.5 Å²	156.5	81%	0.805	79%	0.788	S	S	*	*			trans	-109.5	103.3	-174.6	-58.3	175.3	0	0	0	110.7
615	M	28.1	Very low	28.6	Very low	168 Å²	168	151.8 Å²	151.8	83%	0.828	78%	0.778	S	S	*	*			trans	-116	110.5	167	-170.6	67.5	78.1	0	0	110	C617	M615-C617 PolarHBondContact O-N 2.98Å
616	K	26.8	Very low	28.7	Very low	192 Å²	192	155.5 Å²	155.5	84%	0.835	78%	0.781	S	S	*	*			trans	-72.6	93.8	178.2	-73.7	179.3	177.7	174.3	0	111
617	C	29.9	Very low	28.6	Very low	116 Å²	116	156.6 Å²	156.6	78%	0.784	78%	0.776	S	S	*	*			trans	-77.7	128.1	163.7	-69.5	0	0	0	0	110	M615 D619	M615-C617 PolarHBondContact O-N 2.98Å; C617-D619 PolarHBondContact O-N 3.16Å
618	H	31.1	Very low	28.7	Very low	170 Å²	170	158.4 Å²	158.4	79%	0.787	78%	0.776	S	S	*	*			trans	-78.7	115.4	175.9	-115.9	-86.6	0	0	0	110.7	Y620	H618-Y620 PolarHBondContact O-N 3.27Å
619	D	28.3	Very low	28.6	Very low	155 Å²	155	157.6 Å²	157.6	83%	0.829	77%	0.773	S	S	*	*			trans	-69	93.6	172.7	-97.6	-25.6	0	0	0	111	C617 K621	C617-D619 PolarHBondContact O-N 3.16Å; D619-K621 PolarHBondContact O-N 3.46Å
620	Y	30.1	Very low	28.6	Very low	212 Å²	212	157.9 Å²	157.9	83%	0.831	78%	0.775	S	S	*	*			trans	-77.8	70.3	166.6	-96.2	-77.9	0	0	0	111.2	H618 M622	H618-Y620 PolarHBondContact O-N 3.27Å; Y620-M622 PolarHBondContact O-N 3.37Å; Y620-M622 VanDerWaalsContact O-N 3.17Å
621	K	27.5	Very low	28.6	Very low	165 Å²	165	158.6 Å²	158.6	72%	0.717	78%	0.779	S	S	*	*			trans	-72.3	101.1	175.2	-166.8	173.2	-174.6	172.9	0	109.7	D619 I623	D619-K621 PolarHBondContact O-N 3.46Å; K621-I623 HydrophobicContact CD-CD1 4.34Å; K621-I623 HydrophobicContact CD-CG1 4.5Å; K621-I623 HydrophobicContact CG-CD1 4.44Å; K621-I623 HydrophobicContact CG-CG1 4.11Å; K621-I623 PolarHBondContact O-N 3.43Å
622	M	26.3	Very low	28.5	Very low	187 Å²	187	161 Å²	161	92%	0.921	79%	0.79	S	S	*	*			trans	-65.7	93.7	175.4	-67.1	-166.8	-162.7	0	0	110.9	Y620	Y620-M622 PolarHBondContact O-N 3.37Å; Y620-M622 VanDerWaalsContact O-N 3.17Å
623	I	26.9	Very low	28.6	Very low	130 Å²	130	160.6 Å²	160.6	67%	0.667	79%	0.792	S	S	*	*			trans	-94.9	99.7	171.1	-59.2	177.8	0	0	0	107.9	K621	K621-I623 HydrophobicContact CD-CD1 4.34Å; K621-I623 HydrophobicContact CD-CG1 4.5Å; K621-I623 HydrophobicContact CG-CD1 4.44Å; K621-I623 HydrophobicContact CG-CG1 4.11Å; K621-I623 PolarHBondContact O-N 3.43Å
624	H	29.1	Very low	28.5	Very low	175 Å²	175	159.6 Å²	159.6	81%	0.81	79%	0.787	S	S	*	*			trans	-73	126.7	166.3	-113.7	-79.4	0	0	0	109.4	R626	H624-R626 PolarHBondContact O-N 3.31Å
625	P	30.1	Very low	28.8	Very low	104 Å²	104	162.6 Å²	162.6	68%	0.675	79%	0.794	S	S	*	*			trans	-69	115.9	175.7	-17.8	31.3	0	0	0	110.9	I627	P625-I627 PolarHBondContact O-N 2.84Å
626	R	26.7	Very low	28.7	Very low	228 Å²	228	159.2 Å²	159.2	86%	0.86	79%	0.787	S	S	*	*			trans	-77.6	96.5	163.5	-77.9	-171.3	-178.4	172.5	2.5	109	H624 H628	H624-R626 PolarHBondContact O-N 3.31Å; R626-H628 PolarHBondContact O-N 3.09Å
627	I	30.3	Very low	28.9	Very low	145 Å²	145	158 Å²	158	74%	0.744	78%	0.784	S	S	*	*			trans	-77.3	99.4	163.8	-61.1	179.3	0	0	0	107.8	P625 N629	P625-I627 PolarHBondContact O-N 2.84Å; I627-N629 PolarHBondContact O-N 3.25Å
628	H	28.7	Very low	29	Very low	153 Å²	153	160.7 Å²	160.7	71%	0.708	78%	0.783	S	S	*	*			trans	-77.9	105.1	164.6	-105.7	-93.5	0	0	0	108.7	R626	R626-H628 PolarHBondContact O-N 3.09Å
629	N	29.3	Very low	29.1	Very low	152 Å²	152	158.6 Å²	158.6	81%	0.813	78%	0.776	S	S	*	*			trans	-109	88.3	156.1	-91	6	0	0	0	108.5	I627 D631	I627-N629 PolarHBondContact O-N 3.25Å; N629-D631 PolarHBondContact O-N 2.88Å
630	S	26.6	Very low	29.3	Very low	93 Å²	93	159.6 Å²	159.6	65%	0.65	77%	0.773	S	S	*	*			trans	-74.2	109	154.4	49.5	0	0	0	0	107.8
631	D	30.7	Very low	29.4	Very low	148 Å²	148	156.5 Å²	156.5	79%	0.791	77%	0.771	S	S	*	*			trans	163.4	109.4	144.4	-84.5	-15.1	0	0	0	109.6	N629	N629-D631 PolarHBondContact O-N 2.88Å
632	F	29.7	Very low	29.5	Very low	211 Å²	211	158.5 Å²	158.5	93%	0.925	78%	0.779	S	S	*	*				-171.1	120.4	119.9	-114	-78.3	0	0	0	110.1
633	L	29.8	Very low	29.9	Very low	147 Å²	147	154.7 Å²	154.7	77%	0.77	77%	0.768	S	S	*	*			trans	-84.3	150.7	-179	-92.5	155.1	0	0	0	112.3
634	N	26.8	Very low	30.1	Very low	144 Å²	144	158.6 Å²	158.6	77%	0.77	78%	0.781	S	S	*	*			trans	52.1	104.3	153.2	-64.9	-21.1	0	0	0	118.9
635	K	30.9	Very low	30.1	Very low	219 Å²	219	153.5 Å²	153.5	95%	0.952	78%	0.776	S	S	*	*				-153.2	138.1	114.6	-114	163.8	-174.8	174.2	0	112.5
636	S	26.3	Very low	30.2	Very low	97 Å²	97	154.5 Å²	154.5	68%	0.678	79%	0.785	S	S	*	*			trans	-111	146.8	-177.5	48.3	0	0	0	0	111.2
637	H	32.7	Very low	30.3	Very low	167 Å²	167	151.4 Å²	151.4	77%	0.773	78%	0.784	S	S	*	*			trans	-167.9	126.9	149.3	-93.3	-58.8	0	0	0	106.5
638	F	30.4	Very low	30.4	Very low	173 Å²	173	149.9 Å²	149.9	76%	0.759	79%	0.786	S	S	*	*				60.3	134.8	86.3	-76.1	-131.7	0	0	0	112.1
639	I	33.6	Very low	30.4	Very low	126 Å²	126	151.6 Å²	151.6	65%	0.646	79%	0.794	S	S	*	*			cis	-169.9	159.8	2.8	-119.9	-172.7	0	0	0	106.8
640	K	32.9	Very low	30.4	Very low	175 Å²	175	154.6 Å²	154.6	76%	0.761	79%	0.794	S	S	*	*			cis	-153.4	168.6	8.7	-125.6	165.2	-172	169.1	0	112.1
641	N	31.8	Very low	30.5	Very low	148 Å²	148	154.3 Å²	154.3	79%	0.791	79%	0.793	S	S	*	*			trans	-41.9	148.2	172.3	-45.4	-14.5	0	0	0	120.5
642	K	30.3	Very low	30.4	Very low	206 Å²	206	152.9 Å²	152.9	90%	0.896	79%	0.791	S	S	*	*				-158.7	151.5	119.3	-112.7	179.9	-179.3	-177.2	0	112.1
643	P	33.6	Very low	30.4	Very low	107 Å²	107	153 Å²	153	70%	0.695	79%	0.786	S	S	*	*			trans	-137.4	175.3	-160.2	42.9	-25.3	0	0	0	118.6
644	K	31.3	Very low	30.4	Very low	212 Å²	212	155.2 Å²	155.2	92%	0.922	78%	0.784	S	S	*	*			trans	88.5	123.2	161	-60	-176.9	178.2	-176.8	0	118.8
645	G	29.7	Very low	30.7	Very low	69 Å²	69	156.5 Å²	156.5	71%	0.711	79%	0.785	S	S	*	*			trans	-178.8	96.3	167.1	0	0	0	0	0	111
646	S	31.4	Very low	30.9	Very low	125 Å²	125	154.4 Å²	154.4	87%	0.874	78%	0.778	S	S	*	*			trans	20.5	107.3	173.7	57.4	0	0	0	0	119.5
647	I	29.8	Very low	31.2	Very low	163 Å²	163	156.1 Å²	156.1	84%	0.836	78%	0.779	S	S	*	*			trans	-83	137.1	160.9	-67.9	170.6	0	0	0	109.3
648	S	31.3	Very low	31.4	Very low	112 Å²	112	153.7 Å²	153.7	78%	0.783	78%	0.778	S	S	*	*			trans	-116	131.3	158.8	-178.2	0	0	0	0	107.5	R650	S648-R650 PolarHBondContact O-N 2.83Å
649	E	28.6	Very low	31.7	Very low	189 Å²	189	149.7 Å²	149.7	88%	0.883	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-70.5	120.8	-169.3	-63.7	174.7	131	0	0	111.3
650	R	30.1	Very low	31.9	Very low	215 Å²	215	146.6 Å²	146.6	81%	0.811	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-100.7	130.5	169.5	-111.5	-179.6	-178.7	173.3	3.2	109.2	S648	S648-R650 PolarHBondContact O-N 2.83Å
651	S	28.9	Very low	32.4	Very low	88 Å²	88	142.3 Å²	142.3	62%	0.615	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-68.2	151.5	-175.9	52.5	0	0	0	0	112.6	W653	S651-W653 PolarHBondContact O-N 2.86Å
652	P	27.6	Very low	32.8	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	72%	0.717	S	S	*	*	S	Bend	trans	-70.7	-2.4	-168.2	-21.4	35.1	0	0	0	116.4	R654	P652-R654 PolarHBondContact O-N 3.49Å
653	W	30.9	Very low	33.8	Very low	215 Å²	215	134.5 Å²	134.5	81%	0.814	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	22.4	-165.9	-66.1	109.4	0	0	0	115.8	S651	S651-W653 PolarHBondContact O-N 2.86Å
654	R	30.5	Very low	34.4	Very low	192 Å²	192	132.8 Å²	132.8	73%	0.725	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-3.9	-171.7	-164.9	167.1	-78.6	-113.6	-0.1	115.3	P652	P652-R654 PolarHBondContact O-N 3.49Å
655	E	32.4	Very low	34.8	Very low	171 Å²	171	126 Å²	126	80%	0.799	65%	0.654	S	S	*	*	S	Bend	trans	-97.6	-0.9	-171.6	-59.1	-166.5	158.1	0	0	115.3
656	H	34.4	Very low	35.6	Very low	176 Å²	176	129.1 Å²	129.1	82%	0.815	65%	0.648	S	S	*	*	S	Bend	trans	-127.7	17.4	-173.9	-62	-21.5	0	0	0	114.9
657	L	33.3	Very low	36.2	Very low	132 Å²	132	129.9 Å²	129.9	69%	0.691	64%	0.638	S	S	*	*	S	Bend	trans	-88.2	143.4	166.9	-72.5	170.8	0	0	0	110	M659	L657-M659 PolarHBondContact O-N 2.9Å
658	P	37.6	Very low	36.5	Very low	117 Å²	117	129.1 Å²	129.1	76%	0.76	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-59.1	134.6	170.2	26.4	-33.4	0	0	0	109.5
659	M	35.8	Very low	36.7	Very low	88 Å²	88	129.4 Å²	129.4	43%	0.433	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-54.4	146.4	-177.5	-69.2	-175.3	-66.2	0	0	111.7	L657 Q663 I664	L657-M659 PolarHBondContact O-N 2.9Å; M659-Q663 HydrophobicContact CB-CB 4.17Å; M659-I664 HydrophobicContact CB-CD1 4.44Å; M659-I664 HydrophobicContact CB-CG1 3.94Å; M659-I664 HydrophobicContact CE-CG1 4.27Å; M659-I664 WeakPolarHBondContact O-CD1 3.36Å
660	S	37.9	Very low	36.9	Very low	61 Å²	61	125.1 Å²	125.1	43%	0.427	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-60.9	148.2	174.8	68.5	0	0	0	0	110.4	D662 Q663 I664	S660-D662 PolarHBondContact O-N 3.49Å; S660-D662 VanDerWaalsContact O-N 3.11Å; S660-Q663 WeakPolarHBondContact O-CA 3.48Å; S660-Q663 WeakPolarHBondContact O-CB 3.32Å; S660-Q663 PolarHBondContact O-N 3.17Å; S660-Q663 WeakPolarHBondContact OG-CG 3.35Å; S660-Q663 PolarHBondContact OG-N 3.4Å; S660-Q663 PolarHBondContact OG-OE1 3.04Å; S660-I664 PolarHBondContact O-N 3.3Å
661	Y	42.8	Very low	36.9	Very low	85 Å²	85	123.8 Å²	123.8	33%	0.333	61%	0.607	S	S	.	*	H	α-helix	trans	-53.3	-36.5	179.5	179.4	-99.2	0	0	0	112.2	E152 Q663 I664 M665	E152-Y661 PolarHBondContact OE2-OH 3.45Å; Y661-Q663 PolarHBondContact O-N 3.11Å; Y661-I664 PolarHBondContact O-N 3.43Å; Y661-M665 HydrophobicContact CD1-CG 3.95Å; Y661-M665 HydrophobicContact CD2-CG 4.49Å; Y661-M665 HydrophobicContact CE1-CE 4.47Å; Y661-M665 HydrophobicContact CE1-CG 3.58Å; Y661-M665 HydrophobicContact CE1-SD 4.32Å; Y661-M665 HydrophobicContact CE2-CG 4.17Å; Y661-M665 HydrophobicContact CE2-SD 4.37Å; Y661-M665 HydrophobicContact CG-CG 4.4Å; Y661-M665 WeakPolarHBondContact O-CB 3.44Å; Y661-M665 WeakPolarHBondContact O-CG 3.35Å; Y661-M665 PolarHBondContact O-N 3.39Å
662	D	41.8	Very low	36.9	Very low	88 Å²	88	129.5 Å²	129.5	47%	0.471	62%	0.62	S	S	.	*	H	α-helix	trans	-63.7	-35.6	175.9	-176.5	57.5	0	0	0	113.2	S660 K666	S660-D662 PolarHBondContact O-N 3.49Å; S660-D662 VanDerWaalsContact O-N 3.11Å; D662-K666 WeakPolarHBondContact O-CB 3.28Å; D662-K666 VanDerWaalsContact O-CD 3.29Å; D662-K666 WeakPolarHBondContact O-CD 3.46Å; D662-K666 VanDerWaalsContact O-CG 3.22Å; D662-K666 WeakPolarHBondContact O-CG 3.48Å; D662-K666 PolarHBondContact O-N 3.03Å; D662-K666 WeakPolarHBondContact OD1-CE 3.34Å; D662-K666 IonicContact OD1-NZ 3.6Å; D662-K666 PolarHBondContact OD1-NZ 3.49Å; D662-K666 IonicContact OD2-NZ 2.75Å; D662-K666 PolarHBondContact OD2-NZ 3.34Å
663	Q	50.3	Low	36.8	Very low	103 Å²	103	129.2 Å²	129.2	48%	0.481	62%	0.621	S	S	.	*	H	α-helix	trans	-71.2	-41.5	170.1	-70.3	170.1	-49.4	0	0	111.9	M659 S660 Y661 M665 K666 Q667	M659-Q663 HydrophobicContact CB-CB 4.17Å; S660-Q663 WeakPolarHBondContact O-CA 3.48Å; S660-Q663 WeakPolarHBondContact O-CB 3.32Å; S660-Q663 PolarHBondContact O-N 3.17Å; S660-Q663 WeakPolarHBondContact OG-CG 3.35Å; S660-Q663 PolarHBondContact OG-N 3.4Å; S660-Q663 PolarHBondContact OG-OE1 3.04Å; Y661-Q663 PolarHBondContact O-N 3.11Å; Q663-M665 PolarHBondContact O-N 3.2Å; Q663-K666 PolarHBondContact O-N 3.4Å; Q663-Q667 PolarHBondContact O-N 3.32Å
664	I	45.7	Very low	36.7	Very low	70 Å²	70	123.6 Å²	123.6	36%	0.359	62%	0.615	S	S	.	*	H	α-helix	trans	-60.8	-46.2	178.2	-65.6	171.2	0	0	0	110.4	M659 S660 Y661 Q667 K668	M659-I664 HydrophobicContact CB-CD1 4.44Å; M659-I664 HydrophobicContact CB-CG1 3.94Å; M659-I664 HydrophobicContact CE-CG1 4.27Å; M659-I664 WeakPolarHBondContact O-CD1 3.36Å; S660-I664 PolarHBondContact O-N 3.3Å; Y661-I664 PolarHBondContact O-N 3.43Å; I664-Q667 PolarHBondContact O-N 3.24Å; I664-K668 VanDerWaalsContact O-CB 3.23Å; I664-K668 WeakPolarHBondContact O-CB 3.3Å; I664-K668 PolarHBondContact O-N 3.43Å
665	M	40.7	Very low	36.6	Very low	71 Å²	71	126 Å²	126	35%	0.35	63%	0.626	S	S	.	*	H	α-helix	trans	-63.5	-41.4	177.4	-72.1	-67.1	-87.4	0	0	111.9	Y661 Q663 Q667 K668 Y669	Y661-M665 HydrophobicContact CD1-CG 3.95Å; Y661-M665 HydrophobicContact CD2-CG 4.49Å; Y661-M665 HydrophobicContact CE1-CE 4.47Å; Y661-M665 HydrophobicContact CE1-CG 3.58Å; Y661-M665 HydrophobicContact CE1-SD 4.32Å; Y661-M665 HydrophobicContact CE2-CG 4.17Å; Y661-M665 HydrophobicContact CE2-SD 4.37Å; Y661-M665 HydrophobicContact CG-CG 4.4Å; Y661-M665 WeakPolarHBondContact O-CB 3.44Å; Y661-M665 WeakPolarHBondContact O-CG 3.35Å; Y661-M665 PolarHBondContact O-N 3.39Å; Q663-M665 PolarHBondContact O-N 3.2Å; M665-Q667 PolarHBondContact O-N 3.22Å; M665-K668 PolarHBondContact O-N 3.22Å; M665-Y669 HydrophobicContact CE-CD2 4.32Å; M665-Y669 PolarHBondContact O-N 2.98Å; M665-Y669 HydrophobicContact SD-CD2 3.95Å; M665-Y669 HydrophobicContact SD-CE2 4Å
666	K	46.6	Very low	36.3	Very low	134 Å²	134	126.9 Å²	126.9	58%	0.583	63%	0.627	S	S	*	*	H	α-helix	trans	-68.5	-30	177.9	-74.2	166.4	-175.7	161.7	0	113.7	D662 Q663	D662-K666 WeakPolarHBondContact O-CB 3.28Å; D662-K666 VanDerWaalsContact O-CD 3.29Å; D662-K666 WeakPolarHBondContact O-CD 3.46Å; D662-K666 VanDerWaalsContact O-CG 3.22Å; D662-K666 WeakPolarHBondContact O-CG 3.48Å; D662-K666 PolarHBondContact O-N 3.03Å; D662-K666 WeakPolarHBondContact OD1-CE 3.34Å; D662-K666 IonicContact OD1-NZ 3.6Å; D662-K666 PolarHBondContact OD1-NZ 3.49Å; D662-K666 IonicContact OD2-NZ 2.75Å; D662-K666 PolarHBondContact OD2-NZ 3.34Å; Q663-K666 PolarHBondContact O-N 3.4Å
667	Q	44.1	Very low	36	Very low	141 Å²	141	130 Å²	130	66%	0.659	63%	0.633	S	S	*	*	H	α-helix	trans	-78	-40.7	170.4	-82.1	-169.4	-14.9	0	0	113	Q663 I664 M665	Q663-Q667 PolarHBondContact O-N 3.32Å; I664-Q667 PolarHBondContact O-N 3.24Å; M665-Q667 PolarHBondContact O-N 3.22Å
668	K	35.2	Very low	35.8	Very low	146 Å²	146	128.2 Å²	128.2	64%	0.635	64%	0.637	S	S	*	*	H	α-helix	trans	-80.4	-26.6	-172.2	-158.8	169.4	-171.9	175.7	0	113.4	I664 M665	I664-K668 VanDerWaalsContact O-CB 3.23Å; I664-K668 WeakPolarHBondContact O-CB 3.3Å; I664-K668 PolarHBondContact O-N 3.43Å; M665-K668 PolarHBondContact O-N 3.22Å
669	Y	35.8	Very low	35.2	Very low	118 Å²	118	127.3 Å²	127.3	46%	0.463	64%	0.64	S	S	.	*			trans	-133.2	74.5	179.8	-56.9	-69.2	0	0	0	112.2	M376 M665 M671	M376-Y669 HydrophobicContact CE-CE1 4.21Å; M376-Y669 HydrophobicContact CE-CE2 4.31Å; M665-Y669 HydrophobicContact CE-CD2 4.32Å; M665-Y669 PolarHBondContact O-N 2.98Å; M665-Y669 HydrophobicContact SD-CD2 3.95Å; M665-Y669 HydrophobicContact SD-CE2 4Å; Y669-M671 PolarHBondContact O-N 3.04Å
670	P	32.8	Very low	35	Very low	100 Å²	100	129.2 Å²	129.2	65%	0.649	66%	0.659	S	S	*	*			trans	-68.6	93.9	172.5	29.2	-34.5	0	0	0	110.4	K672	P670-K672 PolarHBondContact O-N 2.76Å
671	M	30.5	Very low	34.5	Very low	187 Å²	187	131.3 Å²	131.3	92%	0.921	67%	0.674	S	S	*	*			trans	-61.4	100.8	174.5	-83.1	-164.8	171.2	0	0	111	Y669 S673	Y669-M671 PolarHBondContact O-N 3.04Å; M671-S673 PolarHBondContact O-N 3.4Å
672	K	28	Very low	33.8	Very low	207 Å²	207	133.8 Å²	133.8	90%	0.9	70%	0.697	S	S	*	*			trans	-66.4	111.4	163.6	-75.4	-176.5	175.7	178.8	0	109	P670	P670-K672 PolarHBondContact O-N 2.76Å
673	S	26.8	Very low	33.2	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	71%	0.711	S	S	*	*			trans	-76.6	165.5	162.7	55.8	0	0	0	0	110.6	M671	M671-S673 PolarHBondContact O-N 3.4Å
674	S	26.8	Very low	32	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	73%	0.73	S	S	*	*			trans	70.9	94.4	174.2	-170.7	0	0	0	0	117.4
675	Y	29.1	Very low	31.3	Very low	242 Å²	242	141.8 Å²	141.8	95%	0.949	75%	0.752	S	S	*	*				-125.6	115.2	129.2	-91.2	-77.4	0	0	0	108.7
676	K	25.9	Very low	30.6	Very low	190 Å²	190	143.9 Å²	143.9	83%	0.826	77%	0.774	S	S	*	*			trans	-86.9	137	168.6	-74.7	-177.2	173.9	-177.1	0	108.7
677	Y	28.5	Very low	29.9	Very low	240 Å²	240	143.1 Å²	143.1	94%	0.941	78%	0.782	S	S	*	*			trans	-73.9	142.3	153.6	-94.7	-95.4	0	0	0	109.1
678	A	29.3	Very low	29.4	Very low	95 Å²	95	140.4 Å²	140.4	79%	0.785	78%	0.779	S	S	*	*			trans	-115.6	136.2	170.9	0	0	0	0	0	108.8
679	A	25.1	Very low	29.1	Very low	98 Å²	98	140.3 Å²	140.3	81%	0.81	79%	0.786	S	S	*	*			trans	-106.6	129	174.9	0	0	0	0	0	109.4
680	P	30.7	Very low	29	Very low	128 Å²	128	142.7 Å²	142.7	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.8	135.2	171	-14	29.8	0	0	0	111.1
681	S	28.9	Very low	29	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.7	137.6	172	51.2	0	0	0	0	111.7
682	V	27.4	Very low	29.1	Very low	136 Å²	136	147.6 Å²	147.6	82%	0.824	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79	148	163.4	178.4	0	0	0	0	109
683	T	29.8	Very low	29.3	Very low	123 Å²	123	145.1 Å²	145.1	76%	0.755	82%	0.815	S	S	*	*			trans	-137.4	133.4	171	-40.7	0	0	0	0	108.6
684	E	25.2	Very low	29.5	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	82%	0.819	S	S	*	*			trans	-86.9	143.9	-174.1	-62	173.4	122	0	0	112
685	S	30	Very low	29.5	Very low	118 Å²	118	148.1 Å²	148.1	83%	0.825	82%	0.822	S	S	*	*			trans	-159.4	117.3	154.3	54.8	0	0	0	0	110.4
686	S	25.5	Very low	29.6	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	82%	0.816	S	S	*	*			trans	-79.8	166.6	163.7	-47	0	0	0	0	110
687	P	33.5	Very low	29.8	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	82%	0.817	S	S	*	*				-149.9	163.9	89.2	41.8	-25.5	0	0	0	116.9
688	S	32	Very low	29.8	Very low	84 Å²	84	135.9 Å²	135.9	59%	0.587	80%	0.804	S	S	*	*			trans	32.5	122.4	146.2	62.4	0	0	0	0	122.6
689	D	30.2	Very low	29.8	Very low	144 Å²	144	138.4 Å²	138.4	77%	0.77	80%	0.804	S	S	*	*				51.7	116.9	112.2	-35.7	-34.2	0	0	0	119.9
690	D	33.8	Very low	30.1	Very low	167 Å²	167	140.3 Å²	140.3	89%	0.893	81%	0.806	S	S	*	*				-165.7	162.8	102.9	-96.1	-27.1	0	0	0	110.9
691	E	31.6	Very low	30	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	80%	0.804	S	S	*	*			trans	-97	144.9	-175.1	-59	176.9	135.2	0	0	112.6
692	E	33.8	Very low	30.1	Very low	201 Å²	201	145.4 Å²	145.4	94%	0.939	81%	0.812	S	S	*	*			trans	-161.1	137.9	137.1	-118	172.1	-170.9	0	0	111.2
693	D	30.7	Very low	30.3	Very low	155 Å²	155	145 Å²	145	83%	0.829	81%	0.809	S	S	*	*			trans	-84.7	143.5	178.1	-80	-55.7	0	0	0	111.4
694	D	32.4	Very low	30.6	Very low	162 Å²	162	144.5 Å²	144.5	87%	0.866	80%	0.802	S	S	*	*			trans	-149.2	137.4	144.1	-143	-16.8	0	0	0	112.3
695	C	26	Very low	31.2	Very low	111 Å²	111	140.3 Å²	140.3	75%	0.75	79%	0.794	S	S	*	*			trans	-112.5	112.2	-165.9	-84.4	0	0	0	0	112.9
696	I	32.2	Very low	31.7	Very low	162 Å²	162	138.7 Å²	138.7	83%	0.831	78%	0.776	S	S	*	*			trans	-122.6	118.7	168.9	-60	-178.5	0	0	0	110.3
697	N	28.1	Very low	32.6	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	76%	0.758	S	S	*	*			trans	-80	136.8	168.7	-65.3	-63	0	0	0	110.4
698	S	30.2	Very low	33.1	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	75%	0.748	S	S	*	*				173.1	124.3	125.5	57.6	0	0	0	0	113.4
699	D	29.4	Very low	33.7	Very low	149 Å²	149	135 Å²	135	80%	0.797	74%	0.74	S	S	*	*			trans	63.1	174.8	139	-49	-20.3	0	0	0	121.6
700	T	31.4	Very low	34.7	Very low	138 Å²	138	135.8 Å²	135.8	85%	0.847	73%	0.732	S	S	*	*			trans	79.7	75.9	176.4	57.1	0	0	0	0	118.8
701	D	28.6	Very low	35.5	Very low	148 Å²	148	132.9 Å²	132.9	79%	0.791	72%	0.715	S	S	*	*			trans	-34.3	168.1	146.6	-55.2	-87.4	0	0	0	119.3
702	E	29.6	Very low	36.3	Very low	193 Å²	193	130.5 Å²	130.5	90%	0.902	70%	0.703	S	S	*	*			trans	67	54.3	140.3	-156	167.7	-133.6	0	0	120
703	V	31.9	Very low	37.1	Very low	127 Å²	127	128.4 Å²	128.4	77%	0.77	69%	0.686	S	S	*	*			trans	-137.6	108.7	158.7	-173.7	0	0	0	0	111.6
704	D	36.9	Very low	38.4	Very low	112 Å²	112	125 Å²	125	60%	0.599	67%	0.671	S	S	*	*	S	Bend	trans	-174.2	-19.1	151.4	-114.8	-23.3	0	0	0	115.8	T707	D704-T707 PolarHBondContact O-OG1 3.05Å
705	S	37.2	Very low	39.3	Very low	101 Å²	101	120.2 Å²	120.2	71%	0.706	65%	0.648	S	S	*	*	H	α-helix	trans	-61.3	-50.4	-176.2	-174.4	0	0	0	0	113.4	T707 S708	S705-T707 VanDerWaalsContact C-N 3.28Å; S705-T707 PolarHBondContact O-N 2.83Å; S705-S708 PolarHBondContact O-N 2.84Å; S705-S708 PolarHBondContact O-OG 3.09Å
706	D	40.2	Very low	40.5	Very low	83 Å²	83	118.3 Å²	118.3	44%	0.444	63%	0.633	S	S	.	*	H	α-helix	trans	-65.7	-27.8	-169.4	-168.4	49.3	0	0	0	113.3	S708 E709 R710	D706-S708 VanDerWaalsContact C-N 3.32Å; D706-S708 PolarHBondContact O-N 2.93Å; D706-E709 PolarHBondContact O-N 3.06Å; D706-R710 VanDerWaalsContact O-CG 3.3Å; D706-R710 WeakPolarHBondContact O-CG 3.43Å; D706-R710 PolarHBondContact O-N 2.95Å; D706-R710 IonicContact OD2-CZ 3.08Å; D706-R710 IonicContact OD2-NE 3.84Å; D706-R710 PolarHBondContact OD2-NE 2.82Å; D706-R710 IonicContact OD2-NH2 2.66Å; D706-R710 PolarHBondContact OD2-NH2 2.95Å
707	T	45.5	Very low	41.8	Very low	71 Å²	71	115 Å²	115	44%	0.436	62%	0.62	S	S	.	*	H	α-helix	trans	-60.7	-41.5	177.4	-30.5	0	0	0	0	111.5	D704 S705 I711	D704-T707 PolarHBondContact O-OG1 3.05Å; S705-T707 VanDerWaalsContact C-N 3.28Å; S705-T707 PolarHBondContact O-N 2.83Å; T707-I711 WeakPolarHBondContact O-CG1 3.48Å; T707-I711 PolarHBondContact O-N 2.85Å
708	S	42.4	Very low	42.9	Very low	81 Å²	81	110.4 Å²	110.4	57%	0.566	60%	0.604	S	S	*	*	H	α-helix	trans	-69.7	-39.2	-179.2	73.5	0	0	0	0	112.5	S705 D706 I711 F712	S705-S708 PolarHBondContact O-N 2.84Å; S705-S708 PolarHBondContact O-OG 3.09Å; D706-S708 VanDerWaalsContact C-N 3.32Å; D706-S708 PolarHBondContact O-N 2.93Å; S708-I711 PolarHBondContact O-N 2.88Å; S708-F712 PolarHBondContact O-N 2.67Å; S708-F712 VanDerWaalsContact O-N 3.16Å
709	E	45.7	Very low	43.9	Very low	89 Å²	89	110 Å²	110	42%	0.416	60%	0.598	S	S	.	*	H	α-helix	trans	-70.7	-39	177.8	-175.7	168.8	177.7	0	0	111.5	D706 I711 F712 R713	D706-E709 PolarHBondContact O-N 3.06Å; E709-I711 VanDerWaalsContact C-N 3.35Å; E709-I711 PolarHBondContact O-N 2.91Å; E709-F712 PolarHBondContact O-N 3.15Å; E709-R713 HydrophobicContact CG-CG 4.17Å; E709-R713 WeakPolarHBondContact O-CB 3.44Å; E709-R713 WeakPolarHBondContact O-CG 3.35Å; E709-R713 PolarHBondContact O-N 2.96Å; E709-R713 IonicContact OE1-CZ 2.66Å; E709-R713 IonicContact OE1-NE 3.12Å; E709-R713 PolarHBondContact OE1-NE 2.98Å; E709-R713 IonicContact OE1-NH2 2.73Å; E709-R713 PolarHBondContact OE1-NH2 3.01Å
710	R	50.1	Low	44.9	Very low	161 Å²	161	105.6 Å²	105.6	61%	0.608	58%	0.582	S	S	*	*	H	α-helix	trans	-56.4	-47.7	173.7	-73.5	176	-169.1	-155	8.2	111.6	D706 R713 T714	D706-R710 VanDerWaalsContact O-CG 3.3Å; D706-R710 WeakPolarHBondContact O-CG 3.43Å; D706-R710 PolarHBondContact O-N 2.95Å; D706-R710 IonicContact OD2-CZ 3.08Å; D706-R710 IonicContact OD2-NE 3.84Å; D706-R710 PolarHBondContact OD2-NE 2.82Å; D706-R710 IonicContact OD2-NH2 2.66Å; D706-R710 PolarHBondContact OD2-NH2 2.95Å; R710-R713 PolarHBondContact O-N 3.42Å; R710-T714 WeakPolarHBondContact O-CG2 3.43Å; R710-T714 PolarHBondContact O-N 2.89Å; R710-T714 PolarHBondContact O-OG1 2.99Å
711	I	50.9	Low	46	Very low	105 Å²	105	102 Å²	102	54%	0.538	57%	0.565	S	S	.	*	H	α-helix	trans	-58.3	-52.2	177.6	-67.4	165.9	0	0	0	110.2	T707 S708 E709 R713 T714 T715	T707-I711 WeakPolarHBondContact O-CG1 3.48Å; T707-I711 PolarHBondContact O-N 2.85Å; S708-I711 PolarHBondContact O-N 2.88Å; E709-I711 VanDerWaalsContact C-N 3.35Å; E709-I711 PolarHBondContact O-N 2.91Å; I711-R713 PolarHBondContact O-N 3.19Å; I711-T714 PolarHBondContact O-N 2.86Å; I711-T714 VanDerWaalsContact O-N 3.17Å; I711-T714 PolarHBondContact O-OG1 2.95Å; I711-T715 PolarHBondContact O-N 3.48Å; I711-T715 PolarHBondContact O-OG1 2.62Å; I711-T715 VanDerWaalsContact O-OG1 3.07Å
712	F	48.7	Very low	47.2	Very low	140 Å²	140	97.5 Å²	97.5	61%	0.614	55%	0.549	S	S	*	.	H	α-helix	trans	-57.7	-46.4	179	-176.5	-96.8	0	0	0	112.5	S708 E709 T714 T715 V716	S708-F712 PolarHBondContact O-N 2.67Å; S708-F712 VanDerWaalsContact O-N 3.16Å; E709-F712 PolarHBondContact O-N 3.15Å; F712-T714 PolarHBondContact O-N 3.17Å; F712-T715 PolarHBondContact O-N 2.87Å; F712-V716 HydrophobicContact CD1-CG2 4.29Å; F712-V716 HydrophobicContact CE1-CG2 3.86Å; F712-V716 HydrophobicContact CE2-CG2 4.33Å; F712-V716 HydrophobicContact CZ-CG2 3.88Å; F712-V716 WeakPolarHBondContact O-CG2 3.33Å; F712-V716 PolarHBondContact O-N 3.44Å; F712-V716 VanDerWaalsContact O-N 3.08Å
713	R	51	Low	48.1	Very low	156 Å²	156	91.1 Å²	91.1	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-59	-45.1	176.5	-73.4	-179.5	-179.3	-156	8	111.5	E709 R710 I711 V716 T717	E709-R713 HydrophobicContact CG-CG 4.17Å; E709-R713 WeakPolarHBondContact O-CB 3.44Å; E709-R713 WeakPolarHBondContact O-CG 3.35Å; E709-R713 PolarHBondContact O-N 2.96Å; E709-R713 IonicContact OE1-CZ 2.66Å; E709-R713 IonicContact OE1-NE 3.12Å; E709-R713 PolarHBondContact OE1-NE 2.98Å; E709-R713 IonicContact OE1-NH2 2.73Å; E709-R713 PolarHBondContact OE1-NH2 3.01Å; R710-R713 PolarHBondContact O-N 3.42Å; I711-R713 PolarHBondContact O-N 3.19Å; R713-V716 PolarHBondContact O-N 3.22Å; R713-T717 WeakPolarHBondContact O-CG2 3.22Å; R713-T717 PolarHBondContact O-N 3.24Å; R713-T717 PolarHBondContact O-OG1 2.84Å; R713-T717 VanDerWaalsContact O-OG1 3.14Å
714	T	58.5	Low	49.4	Very low	85 Å²	85	89.5 Å²	89.5	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-64.4	-38	178	53.6	0	0	0	0	113.6	R710 I711 F712 T717 A718	R710-T714 WeakPolarHBondContact O-CG2 3.43Å; R710-T714 PolarHBondContact O-N 2.89Å; R710-T714 PolarHBondContact O-OG1 2.99Å; I711-T714 PolarHBondContact O-N 2.86Å; I711-T714 VanDerWaalsContact O-N 3.17Å; I711-T714 PolarHBondContact O-OG1 2.95Å; F712-T714 PolarHBondContact O-N 3.17Å; T714-T717 WeakPolarHBondContact CA-OG1 3.48Å; T714-T717 PolarHBondContact O-OG1 2.93Å; T714-T717 VanDerWaalsContact O-OG1 3.13Å; T714-A718 VanDerWaalsContact O-CB 3.27Å; T714-A718 WeakPolarHBondContact O-CB 3.48Å; T714-A718 PolarHBondContact O-N 2.99Å
715	T	50.1	Low	50.3	Low	61 Å²	61	86.8 Å²	86.8	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-66.7	-41.3	176.8	-48.7	0	0	0	0	111.7	I711 F712 T719	I711-T715 PolarHBondContact O-N 3.48Å; I711-T715 PolarHBondContact O-OG1 2.62Å; I711-T715 VanDerWaalsContact O-OG1 3.07Å; F712-T715 PolarHBondContact O-N 2.87Å; T715-T719 WeakPolarHBondContact O-CB 3.21Å; T715-T719 WeakPolarHBondContact O-CG2 3.48Å; T715-T719 PolarHBondContact O-N 2.93Å; T715-T719 PolarHBondContact O-OG1 3.41Å
716	V	52	Low	50.9	Low	71 Å²	71	84.4 Å²	84.4	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-41.2	177	174.7	0	0	0	0	111.7	F712 R713 T719 A720	F712-V716 HydrophobicContact CD1-CG2 4.29Å; F712-V716 HydrophobicContact CE1-CG2 3.86Å; F712-V716 HydrophobicContact CE2-CG2 4.33Å; F712-V716 HydrophobicContact CZ-CG2 3.88Å; F712-V716 WeakPolarHBondContact O-CG2 3.33Å; F712-V716 PolarHBondContact O-N 3.44Å; F712-V716 VanDerWaalsContact O-N 3.08Å; R713-V716 PolarHBondContact O-N 3.22Å; V716-T719 PolarHBondContact O-OG1 2.81Å; V716-T719 VanDerWaalsContact O-OG1 3.13Å; V716-A720 VanDerWaalsContact O-CB 3.29Å; V716-A720 WeakPolarHBondContact O-CB 3.41Å; V716-A720 PolarHBondContact O-N 3.09Å
717	T	58.6	Low	51.3	Low	93 Å²	93	84.1 Å²	84.1	57%	0.571	50%	0.497	S	S	*	.	H	α-helix	trans	-70	-37.6	177	53.9	0	0	0	0	112.8	R713 T714 A721	R713-T717 WeakPolarHBondContact O-CG2 3.22Å; R713-T717 PolarHBondContact O-N 3.24Å; R713-T717 PolarHBondContact O-OG1 2.84Å; R713-T717 VanDerWaalsContact O-OG1 3.14Å; T714-T717 WeakPolarHBondContact CA-OG1 3.48Å; T714-T717 PolarHBondContact O-OG1 2.93Å; T714-T717 VanDerWaalsContact O-OG1 3.13Å; T717-A721 WeakPolarHBondContact O-CB 3.4Å; T717-A721 PolarHBondContact O-N 2.84Å
718	A	52.5	Low	51.6	Low	60 Å²	60	89.4 Å²	89.4	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-45.1	176.8	0	0	0	0	0	112.3	T714 A721 A722	T714-A718 VanDerWaalsContact O-CB 3.27Å; T714-A718 WeakPolarHBondContact O-CB 3.48Å; T714-A718 PolarHBondContact O-N 2.99Å; A718-A721 PolarHBondContact O-N 2.91Å; A718-A722 PolarHBondContact O-N 3.35Å
719	T	49.7	Very low	51.9	Low	87 Å²	87	89.1 Å²	89.1	53%	0.534	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-39.1	177.1	47.5	0	0	0	0	112.4	T715 V716 A722 A723	T715-T719 WeakPolarHBondContact O-CB 3.21Å; T715-T719 WeakPolarHBondContact O-CG2 3.48Å; T715-T719 PolarHBondContact O-N 2.93Å; T715-T719 PolarHBondContact O-OG1 3.41Å; V716-T719 PolarHBondContact O-OG1 2.81Å; V716-T719 VanDerWaalsContact O-OG1 3.13Å; T719-A722 PolarHBondContact O-N 2.83Å; T719-A723 PolarHBondContact O-N 2.87Å
720	A	51.2	Low	52	Low	56 Å²	56	88.1 Å²	88.1	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-42.7	172.3	0	0	0	0	0	112.3	V716 A723 L724	V716-A720 VanDerWaalsContact O-CB 3.29Å; V716-A720 WeakPolarHBondContact O-CB 3.41Å; V716-A720 PolarHBondContact O-N 3.09Å; A720-A723 PolarHBondContact O-N 3.24Å; A720-L724 WeakPolarHBondContact O-CB 3.29Å; A720-L724 PolarHBondContact O-N 2.89Å
721	A	54.6	Low	51.7	Low	61 Å²	61	83.5 Å²	83.5	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-41.5	176.9	0	0	0	0	0	112.2	T717 A718 L724 A725	T717-A721 WeakPolarHBondContact O-CB 3.4Å; T717-A721 PolarHBondContact O-N 2.84Å; A718-A721 PolarHBondContact O-N 2.91Å; A721-L724 PolarHBondContact O-N 3.27Å; A721-A725 PolarHBondContact O-N 3.37Å
722	A	52.9	Low	51.2	Low	55 Å²	55	82.8 Å²	82.8	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-42.4	175.3	0	0	0	0	0	112.4	A718 T719 L724 A725 A726	A718-A722 PolarHBondContact O-N 3.35Å; T719-A722 PolarHBondContact O-N 2.83Å; A722-L724 VanDerWaalsContact C-N 3.34Å; A722-L724 PolarHBondContact O-N 2.92Å; A722-A725 PolarHBondContact O-N 3.1Å; A722-A726 WeakPolarHBondContact O-CB 3.38Å; A722-A726 PolarHBondContact O-N 2.88Å
723	A	50.5	Low	50.9	Low	58 Å²	58	81.4 Å²	81.4	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-64.5	-36.7	175.1	0	0	0	0	0	112.6	T719 A720 T727	T719-A723 PolarHBondContact O-N 2.87Å; A720-A723 PolarHBondContact O-N 3.24Å; A723-T727 WeakPolarHBondContact O-CB 3.3Å; A723-T727 WeakPolarHBondContact O-CG2 3.31Å; A723-T727 PolarHBondContact O-N 2.86Å; A723-T727 PolarHBondContact O-OG1 3.12Å
724	L	57.7	Low	50.2	Low	93 Å²	93	81.9 Å²	81.9	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-70.8	-36.5	176.3	-145.8	168.9	0	0	0	111.6	A720 A721 A722 T727 R728	A720-L724 WeakPolarHBondContact O-CB 3.29Å; A720-L724 PolarHBondContact O-N 2.89Å; A721-L724 PolarHBondContact O-N 3.27Å; A722-L724 VanDerWaalsContact C-N 3.34Å; A722-L724 PolarHBondContact O-N 2.92Å; L724-T727 WeakPolarHBondContact CA-OG1 3.2Å; L724-T727 PolarHBondContact O-OG1 2.81Å; L724-R728 HydrophobicContact CD2-CG 4.21Å; L724-R728 WeakPolarHBondContact O-CG 3.34Å; L724-R728 PolarHBondContact O-N 3.04Å; L724-R728 VanDerWaalsContact O-N 3.12Å
725	A	55.6	Low	49	Very low	56 Å²	56	80.8 Å²	80.8	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-49.4	171.9	0	0	0	0	0	111.7	A721 A722 T727 R728 V729	A721-A725 PolarHBondContact O-N 3.37Å; A722-A725 PolarHBondContact O-N 3.1Å; A725-T727 PolarHBondContact O-N 2.91Å; A725-R728 PolarHBondContact O-N 2.97Å; A725-R728 VanDerWaalsContact O-N 3.16Å; A725-V729 PolarHBondContact O-N 2.96Å; A725-V729 VanDerWaalsContact O-N 3.11Å
726	A	50	Low	48.1	Very low	50 Å²	50	84.7 Å²	84.7	41%	0.413	53%	0.532	S	S	.	.	H	α-helix	trans	-59.6	-44.8	178.3	0	0	0	0	0	112.3	A722 R728 V729 I730	A722-A726 WeakPolarHBondContact O-CB 3.38Å; A722-A726 PolarHBondContact O-N 2.88Å; A726-R728 VanDerWaalsContact C-N 3.3Å; A726-R728 PolarHBondContact O-N 3.06Å; A726-V729 PolarHBondContact O-N 2.87Å; A726-I730 WeakPolarHBondContact O-CD1 3.48Å; A726-I730 WeakPolarHBondContact O-CG1 3.34Å; A726-I730 PolarHBondContact O-N 2.93Å
727	T	49.8	Very low	47.2	Very low	77 Å²	77	86.7 Å²	86.7	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-67.3	-26.8	177.5	46.4	0	0	0	0	113.6	A723 L724 A725 A731	A723-T727 WeakPolarHBondContact O-CB 3.3Å; A723-T727 WeakPolarHBondContact O-CG2 3.31Å; A723-T727 PolarHBondContact O-N 2.86Å; A723-T727 PolarHBondContact O-OG1 3.12Å; L724-T727 WeakPolarHBondContact CA-OG1 3.2Å; L724-T727 PolarHBondContact O-OG1 2.81Å; A725-T727 PolarHBondContact O-N 2.91Å; T727-A731 VanDerWaalsContact O-CB 3.32Å; T727-A731 WeakPolarHBondContact O-CB 3.48Å; T727-A731 PolarHBondContact O-N 3.34Å
728	R	51	Low	45.7	Very low	182 Å²	182	89.5 Å²	89.5	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-70	-42.8	170.4	-78.7	178	176	-174.1	-0.1	112.9	L724 A725 A726 I730 A731 S732	L724-R728 HydrophobicContact CD2-CG 4.21Å; L724-R728 WeakPolarHBondContact O-CG 3.34Å; L724-R728 PolarHBondContact O-N 3.04Å; L724-R728 VanDerWaalsContact O-N 3.12Å; A725-R728 PolarHBondContact O-N 2.97Å; A725-R728 VanDerWaalsContact O-N 3.16Å; A726-R728 VanDerWaalsContact C-N 3.3Å; A726-R728 PolarHBondContact O-N 3.06Å; R728-I730 VanDerWaalsContact C-N 3.32Å; R728-I730 PolarHBondContact O-N 3.07Å; R728-A731 WeakPolarHBondContact O-CB 3.46Å; R728-A731 PolarHBondContact O-N 2.62Å; R728-A731 VanDerWaalsContact O-N 3.15Å; R728-S732 PolarHBondContact O-N 3.01Å; R728-S732 VanDerWaalsContact O-N 3.08Å; R728-S732 PolarHBondContact O-OG 2.81Å
729	V	49.8	Very low	44.7	Very low	76 Å²	76	94.9 Å²	94.9	46%	0.461	58%	0.575	S	S	.	*	H	α-helix	trans	-61.9	-42.4	175.8	175.6	0	0	0	0	110.8	A725 A726 A731 S732 D733	A725-V729 PolarHBondContact O-N 2.96Å; A725-V729 VanDerWaalsContact O-N 3.11Å; A726-V729 PolarHBondContact O-N 2.87Å; V729-A731 VanDerWaalsContact C-N 3.27Å; V729-A731 PolarHBondContact O-N 3.33Å; V729-S732 PolarHBondContact O-N 3.36Å; V729-S732 PolarHBondContact O-OG 2.79Å; V729-D733 PolarHBondContact O-N 2.95Å
730	I	46.3	Very low	43.7	Very low	68 Å²	68	97.1 Å²	97.1	35%	0.349	58%	0.584	S	S	.	*	H	α-helix	trans	-69	-26	176.8	-65	159.8	0	0	0	111.9	M1 A726 R728	M1-I730 HydrophobicContact CE-CD1 3.8Å; M1-I730 HydrophobicContact CE-CG2 4.26Å; M1-I730 HydrophobicContact SD-CD1 4.05Å; M1-I730 HydrophobicContact SD-CG2 4.13Å; A726-I730 WeakPolarHBondContact O-CD1 3.48Å; A726-I730 WeakPolarHBondContact O-CG1 3.34Å; A726-I730 PolarHBondContact O-N 2.93Å; R728-I730 VanDerWaalsContact C-N 3.32Å; R728-I730 PolarHBondContact O-N 3.07Å
731	A	43.4	Very low	42.5	Very low	63 Å²	63	100.8 Å²	100.8	52%	0.521	60%	0.603	S	S	.	*	H	α-helix	trans	-76.4	-30.9	174.2	0	0	0	0	0	113.1	T727 R728 V729 Y734	T727-A731 VanDerWaalsContact O-CB 3.32Å; T727-A731 WeakPolarHBondContact O-CB 3.48Å; T727-A731 PolarHBondContact O-N 3.34Å; R728-A731 WeakPolarHBondContact O-CB 3.46Å; R728-A731 PolarHBondContact O-N 2.62Å; R728-A731 VanDerWaalsContact O-N 3.15Å; V729-A731 VanDerWaalsContact C-N 3.27Å; V729-A731 PolarHBondContact O-N 3.33Å; A731-Y734 PolarHBondContact O-N 3.16Å
732	S	41.2	Very low	41.3	Very low	90 Å²	90	102.1 Å²	102.1	63%	0.629	61%	0.609	S	S	*	*	H	α-helix	trans	-70.6	-27	174.5	39.8	0	0	0	0	113.9	R728 V729 Y734	R728-S732 PolarHBondContact O-N 3.01Å; R728-S732 VanDerWaalsContact O-N 3.08Å; R728-S732 PolarHBondContact O-OG 2.81Å; V729-S732 PolarHBondContact O-N 3.36Å; V729-S732 PolarHBondContact O-OG 2.79Å; S732-Y734 PolarHBondContact O-N 3.45Å
733	D	42.6	Very low	40.3	Very low	112 Å²	112	107.5 Å²	107.5	60%	0.599	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-14	173.5	-99.8	12.1	0	0	0	113.2	V729	V729-D733 PolarHBondContact O-N 2.95Å
734	Y	36.9	Very low	39.3	Very low	166 Å²	166	112.9 Å²	112.9	65%	0.651	64%	0.644	S	S	*	*	S	Bend	trans	-114.6	65.4	177.5	-79.4	-84.2	0	0	0	111.4	A731 S732 V736	A731-Y734 PolarHBondContact O-N 3.16Å; S732-Y734 PolarHBondContact O-N 3.45Å; Y734-V736 PolarHBondContact O-N 2.77Å
735	G	32	Very low	37.8	Very low	62 Å²	62	118.4 Å²	118.4	64%	0.639	66%	0.664	S	S	*	*			trans	-64.8	90	-179.8	0	0	0	0	0	114.3	T737	G735-T737 PolarHBondContact O-N 3.41Å
736	V	31.2	Very low	36.7	Very low	142 Å²	142	122.5 Å²	122.5	86%	0.861	68%	0.677	S	S	*	*			trans	-80.9	90.6	162.8	-178.7	0	0	0	0	108.6	Y734	Y734-V736 PolarHBondContact O-N 2.77Å
737	T	33.1	Very low	35.7	Very low	113 Å²	113	131.1 Å²	131.1	69%	0.693	70%	0.701	S	S	*	*			trans	-77.8	146.4	174.1	47.7	0	0	0	0	112.2	G735	G735-T737 PolarHBondContact O-N 3.41Å
738	D	28.6	Very low	34.6	Very low	153 Å²	153	131 Å²	131	82%	0.818	72%	0.715	S	S	*	*			trans	61.1	84	160.7	-58.5	-18.8	0	0	0	119.1
739	L	30.8	Very low	33.7	Very low	173 Å²	173	127.8 Å²	127.8	91%	0.906	73%	0.727	S	S	*	*			trans	-121.1	120.8	146.8	-99.4	164.8	0	0	0	110.1
740	N	27.8	Very low	32.6	Very low	133 Å²	133	134 Å²	134	71%	0.711	75%	0.747	S	S	*	*			trans	-64.6	133.1	-165.3	-98.7	-66.4	0	0	0	114.1	S742	N740-S742 PolarHBondContact O-N 2.94Å
741	P	27.2	Very low	31.9	Very low	133 Å²	133	135.3 Å²	135.3	86%	0.864	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	60.8	178.4	34.6	-36.9	0	0	0	112.4
742	S	29.7	Very low	31.4	Very low	90 Å²	90	139.7 Å²	139.7	63%	0.629	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.7	0	-178	61.5	0	0	0	0	115.5	N740	N740-S742 PolarHBondContact O-N 2.94Å
743	Q	31.7	Very low	31	Very low	167 Å²	167	139.4 Å²	139.4	78%	0.78	79%	0.786	S	S	*	*	S	Bend	trans	-131.1	46.4	-171.8	-75.8	-70.8	2.2	0	0	114.6
744	L	28.8	Very low	30.6	Very low	172 Å²	172	140.7 Å²	140.7	90%	0.901	79%	0.793	S	S	*	*			trans	-157.6	82.7	157.6	-141.3	82.5	0	0	0	112.9
745	K	26.8	Very low	30.3	Very low	208 Å²	208	137.8 Å²	137.8	90%	0.904	79%	0.793	S	S	*	*			trans	-148.3	96.3	169.4	-152.5	174.8	-170.8	179.4	0	111.6
746	I	31.7	Very low	30.4	Very low	143 Å²	143	142.4 Å²	142.4	73%	0.733	80%	0.803	S	S	*	*			trans	-116.1	138.7	176.6	-46.6	-177.8	0	0	0	108.1
747	Y	29.1	Very low	30.5	Very low	231 Å²	231	144.5 Å²	144.5	91%	0.906	80%	0.8	S	S	*	*	S	Bend	trans	63.3	110.9	-176.2	-66	-74.3	0	0	0	117.1
748	G	27.6	Very low	30.5	Very low	75 Å²	75	146.4 Å²	146.4	77%	0.773	81%	0.807	S	S	*	*			trans	150	94.7	159.1	0	0	0	0	0	117
749	A	31.4	Very low	30.7	Very low	113 Å²	113	143.8 Å²	143.8	93%	0.934	81%	0.806	S	S	*	*			trans	65.1	160.1	164.4	0	0	0	0	0	119.3
750	K	27.1	Very low	30.5	Very low	206 Å²	206	141.7 Å²	141.7	90%	0.896	81%	0.806	S	S	*	*			trans	-114.2	149.4	-171.9	-59	169.7	176.9	175	0	111.4
751	A	32	Very low	30.7	Very low	96 Å²	96	139 Å²	139	79%	0.793	81%	0.809	S	S	*	*				-180	110.8	124.8	0	0	0	0	0	114.2
752	N	31.3	Very low	30.6	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	81%	0.807	S	S	*	*			trans	28	128.7	145.1	-66.7	7	0	0	0	124.3
753	A	32.7	Very low	30.7	Very low	83 Å²	83	146.1 Å²	146.1	69%	0.686	81%	0.812	S	S	*	*				74.9	146.7	123.7	0	0	0	0	0	120.8
754	N	34.1	Very low	30.5	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	81%	0.81	S	S	*	*			cis	-159.8	138.9	-11.3	-116.5	3	0	0	0	114.5
755	T	32.5	Very low	30.5	Very low	105 Å²	105	143.5 Å²	143.5	64%	0.644	80%	0.804	S	S	*	*			trans	55.8	124.4	137.9	61.5	0	0	0	0	124
756	N	33.4	Very low	30.8	Very low	159 Å²	159	138 Å²	138	85%	0.85	80%	0.798	S	S	*	*				142	124.9	112.3	-87.7	-14.4	0	0	0	117.6
757	K	32.7	Very low	30.7	Very low	186 Å²	186	142.8 Å²	142.8	81%	0.809	81%	0.806	S	S	*	*			trans	-82.1	171.6	-176	-52.9	162.8	174.7	177.6	0	113.4
758	N	32.7	Very low	30.7	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	80%	0.797	S	S	*	*			trans	139	152.5	134.6	-72.7	-15.9	0	0	0	112.1
759	A	32.8	Very low	30.9	Very low	98 Å²	98	145 Å²	145	81%	0.81	81%	0.806	S	S	*	*			cis	-163.8	176.1	-22.2	0	0	0	0	0	109.3
760	S	27.1	Very low	30.7	Very low	128 Å²	128	148.6 Å²	148.6	90%	0.895	80%	0.8	S	S	*	*			trans	-87.4	158.8	-170.2	52.8	0	0	0	0	116.8
761	G	31.6	Very low	30.8	Very low	76 Å²	76	145.2 Å²	145.2	78%	0.784	80%	0.801	S	S	*	*			trans	-153.6	159.6	167.3	0	0	0	0	0	112.1
762	F	25.3	Very low	30.7	Very low	188 Å²	188	147.5 Å²	147.5	83%	0.825	80%	0.798	S	S	*	*			trans	-147.4	175.6	-164.2	-143.8	-99.5	0	0	0	113
763	Y	31.4	Very low	30.6	Very low	186 Å²	186	151 Å²	151	73%	0.729	80%	0.799	S	S	*	*			trans	91.8	90.2	167.9	-64.2	-78.5	0	0	0	122.2
764	E	28.9	Very low	30.4	Very low	157 Å²	157	153.6 Å²	153.6	73%	0.734	80%	0.802	S	S	*	*				66.7	142.8	103.4	-136	179.5	-176	0	0	125.7
765	T	29.2	Very low	30.2	Very low	127 Å²	127	154.9 Å²	154.9	78%	0.779	81%	0.809	S	S	*	*			trans	96.8	147.2	154.4	72.4	0	0	0	0	122.5
766	A	32.1	Very low	30.1	Very low	93 Å²	93	157.4 Å²	157.4	77%	0.769	82%	0.818	S	S	*	*			trans	92.6	75.7	155	0	0	0	0	0	123.2
767	R	30.7	Very low	30	Very low	242 Å²	242	155 Å²	155	91%	0.913	81%	0.811	S	S	*	*				78.2	99.7	114.9	-160.4	173.5	-165.6	169.5	5.2	122.2
768	S	27.5	Very low	30	Very low	103 Å²	103	153.8 Å²	153.8	72%	0.72	81%	0.811	S	S	*	*			trans	70.3	113.1	131.8	175.8	0	0	0	0	122.3
769	R	31.4	Very low	30	Very low	251 Å²	251	154 Å²	154	95%	0.947	81%	0.805	S	S	*	*				-142.9	146	127.2	-95.1	177.6	-165.6	-177.1	4.7	110.1
770	K	27.8	Very low	30.1	Very low	188 Å²	188	155 Å²	155	82%	0.817	80%	0.801	S	S	*	*			trans	-86.7	140.1	178.6	-72.1	-179.1	176.4	179	0	111.7
771	C	29.5	Very low	30.6	Very low	134 Å²	134	153.4 Å²	153.4	91%	0.905	79%	0.786	S	S	*	*			trans	-145.5	152.5	146.8	-95.3	0	0	0	0	108.9
772	I	29.4	Very low	30.9	Very low	144 Å²	144	157 Å²	157	74%	0.738	78%	0.782	S	S	*	*			trans	-126.5	115.3	-170.3	-59.4	168.5	0	0	0	109.7
773	R	28.9	Very low	31.5	Very low	229 Å²	229	155 Å²	155	86%	0.864	78%	0.775	S	S	*	*			trans	-162.4	113.2	143.1	-147.1	157.3	-68.3	-174.3	-0.9	113.2
774	N	30.4	Very low	31.7	Very low	139 Å²	139	151.5 Å²	151.5	74%	0.743	77%	0.768	S	S	*	*			trans	28.2	115.6	148.7	-51.4	14.3	0	0	0	119.1
775	D	28.9	Very low	32.2	Very low	166 Å²	166	149.2 Å²	149.2	89%	0.888	76%	0.761	S	S	*	*			trans	-60.7	141.9	158.7	-52.1	-83	0	0	0	111.6
776	L	30.4	Very low	32.8	Very low	158 Å²	158	147.4 Å²	147.4	83%	0.827	74%	0.744	S	S	*	*			trans	-119.3	117.4	171.7	-149.7	81	0	0	0	108.1	I778	L776-I778 PolarHBondContact O-N 3.04Å
777	P	32.1	Very low	33.6	Very low	108 Å²	108	147.8 Å²	147.8	70%	0.701	73%	0.732	S	S	*	*			trans	-72.2	123.4	-175.5	27.7	-33.2	0	0	0	111.1	K779	P777-K779 PolarHBondContact O-N 3.25Å
778	I	31.2	Very low	34.6	Very low	161 Å²	161	141 Å²	141	83%	0.826	71%	0.714	S	S	*	*	S	Bend	trans	-64.7	99.9	175.2	-59.2	165.7	0	0	0	108.4	L776	L776-I778 PolarHBondContact O-N 3.04Å
779	K	33.7	Very low	35.6	Very low	158 Å²	158	138.4 Å²	138.4	69%	0.687	70%	0.695	S	S	*	*			trans	-145.4	-5.6	177.1	-79.6	-153.4	166.7	-161.4	0	116	P777	P777-K779 PolarHBondContact O-N 3.25Å
780	T	33.9	Very low	36.6	Very low	120 Å²	120	132.3 Å²	132.3	74%	0.736	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	15.1	-172.3	54.9	0	0	0	0	114.6
781	V	38	Very low	38	Very low	93 Å²	93	129 Å²	129	56%	0.564	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-53	180	-175.8	0	0	0	0	110.7	E783 L784 D785	V781-E783 PolarHBondContact O-N 3.42Å; V781-L784 WeakPolarHBondContact O-CB 3.49Å; V781-L784 PolarHBondContact O-N 2.83Å; V781-D785 PolarHBondContact O-N 3.45Å
782	E	38.7	Very low	39.1	Very low	153 Å²	153	125.6 Å²	125.6	72%	0.715	65%	0.648	S	S	*	*	H	α-helix	trans	-59	-31.6	177.9	-63.7	176.6	121.8	0	0	113.3	L784 H786	E782-L784 PolarHBondContact O-N 2.87Å; E782-H786 PolarHBondContact O-N 2.9Å
783	E	38.6	Very low	40.1	Very low	145 Å²	145	120.7 Å²	120.7	68%	0.678	63%	0.629	S	S	*	*	H	α-helix	trans	-71.8	-18.2	178.6	-166	165.9	-150	0	0	112.9	V781 I787	V781-E783 PolarHBondContact O-N 3.42Å; E783-I787 WeakPolarHBondContact O-CD1 3.12Å; E783-I787 WeakPolarHBondContact O-CG1 3.47Å
784	L	35	Very low	41.5	Very low	112 Å²	112	114.6 Å²	114.6	59%	0.586	61%	0.61	S	S	*	*	H	α-helix	trans	-85	-49	176.4	-162.3	68.2	0	0	0	111.3	V781 E782 H786 I787 D788	V781-L784 WeakPolarHBondContact O-CB 3.49Å; V781-L784 PolarHBondContact O-N 2.83Å; E782-L784 PolarHBondContact O-N 2.87Å; L784-H786 PolarHBondContact O-N 2.86Å; L784-I787 WeakPolarHBondContact O-CB 3.33Å; L784-I787 PolarHBondContact O-N 2.85Å; L784-D788 PolarHBondContact O-N 3.21Å
785	D	39.6	Very low	42.8	Very low	109 Å²	109	110.7 Å²	110.7	58%	0.583	60%	0.597	S	S	*	*	H	α-helix	trans	-58.8	-34.1	178.3	-69.6	-24	0	0	0	112.2	V781 I787 D788 S789	V781-D785 PolarHBondContact O-N 3.45Å; D785-I787 VanDerWaalsContact C-N 3.3Å; D785-I787 PolarHBondContact O-N 3.15Å; D785-D788 PolarHBondContact O-N 2.99Å; D785-S789 PolarHBondContact O-N 3.03Å; D785-S789 VanDerWaalsContact O-N 3.14Å
786	H	41.6	Very low	43.9	Very low	90 Å²	90	105.8 Å²	105.8	42%	0.417	58%	0.58	S	S	.	*	H	α-helix	trans	-76.2	-12.3	178.7	-163.7	28.3	0	0	0	114.4	E782 L784 K790	E782-H786 PolarHBondContact O-N 2.9Å; L784-H786 PolarHBondContact O-N 2.86Å; H786-K790 PolarHBondContact CD2-NZ 2.79Å; H786-K790 PolarHBondContact CE1-NZ 3.01Å; H786-K790 VanDerWaalsContact CE1-NZ 3.28Å; H786-K790 PolarHBondContact NE2-NZ 2.96Å
787	I	47.7	Very low	45	Very low	101 Å²	101	102.3 Å²	102.3	52%	0.518	56%	0.561	S	S	.	*	H	α-helix	trans	-83.1	-46.1	170.9	-69.1	168.9	0	0	0	109.6	E783 L784 D785 S789 K790 L791	E783-I787 WeakPolarHBondContact O-CD1 3.12Å; E783-I787 WeakPolarHBondContact O-CG1 3.47Å; L784-I787 WeakPolarHBondContact O-CB 3.33Å; L784-I787 PolarHBondContact O-N 2.85Å; D785-I787 VanDerWaalsContact C-N 3.3Å; D785-I787 PolarHBondContact O-N 3.15Å; I787-S789 PolarHBondContact O-N 3.08Å; I787-K790 PolarHBondContact O-N 2.9Å; I787-L791 PolarHBondContact O-N 2.87Å
788	D	51.7	Low	46.4	Very low	100 Å²	100	101.2 Å²	101.2	54%	0.535	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-36.4	-180	-80.9	-9.2	0	0	0	112.3	L784 D785 K790 L791 A792	L784-D788 PolarHBondContact O-N 3.21Å; D785-D788 PolarHBondContact O-N 2.99Å; D788-K790 VanDerWaalsContact C-N 3.35Å; D788-K790 PolarHBondContact O-N 2.67Å; D788-L791 PolarHBondContact O-N 2.86Å; D788-A792 WeakPolarHBondContact O-CB 3.25Å; D788-A792 PolarHBondContact O-N 2.94Å
789	S	49.5	Very low	47.6	Very low	47 Å²	47	96.2 Å²	96.2	33%	0.329	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-37.4	175.8	71.7	0	0	0	0	113	D785 I787 A793	D785-S789 PolarHBondContact O-N 3.03Å; D785-S789 VanDerWaalsContact O-N 3.14Å; I787-S789 PolarHBondContact O-N 3.08Å; S789-A793 WeakPolarHBondContact O-CB 3.31Å; S789-A793 PolarHBondContact O-N 3.26Å
790	K	51.9	Low	48.2	Very low	123 Å²	123	91.4 Å²	91.4	54%	0.535	52%	0.522	S	S	.	.	H	α-helix	trans	-69.9	-39.1	173.4	-76.8	172.7	-178.3	141.7	0	112.2	H786 I787 D788 A793 Q794	H786-K790 PolarHBondContact CD2-NZ 2.79Å; H786-K790 PolarHBondContact CE1-NZ 3.01Å; H786-K790 VanDerWaalsContact CE1-NZ 3.28Å; H786-K790 PolarHBondContact NE2-NZ 2.96Å; I787-K790 PolarHBondContact O-N 2.9Å; D788-K790 VanDerWaalsContact C-N 3.35Å; D788-K790 PolarHBondContact O-N 2.67Å; K790-A793 PolarHBondContact O-N 2.74Å; K790-Q794 PolarHBondContact O-N 2.68Å
791	L	57.7	Low	49.1	Very low	119 Å²	119	93 Å²	93	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-64.5	-43.6	176.8	-172	64.1	0	0	0	111.3	I787 D788 Q794 A795	I787-L791 PolarHBondContact O-N 2.87Å; D788-L791 PolarHBondContact O-N 2.86Å; L791-Q794 PolarHBondContact O-N 2.95Å; L791-A795 WeakPolarHBondContact O-CB 3.34Å; L791-A795 PolarHBondContact O-N 2.8Å
792	A	51.8	Low	50.3	Low	62 Å²	62	94.9 Å²	94.9	51%	0.512	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-42.5	175.2	0	0	0	0	0	112.4	D788 A795 A796	D788-A792 WeakPolarHBondContact O-CB 3.25Å; D788-A792 PolarHBondContact O-N 2.94Å; A792-A795 PolarHBondContact O-N 3.23Å; A792-A796 WeakPolarHBondContact O-CB 3.37Å; A792-A796 PolarHBondContact O-N 3.43Å
793	A	49.8	Very low	50.8	Low	41 Å²	41	90 Å²	90	34%	0.339	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-43.9	175.5	0	0	0	0	0	112.1	S789 K790 A796 I797	S789-A793 WeakPolarHBondContact O-CB 3.31Å; S789-A793 PolarHBondContact O-N 3.26Å; K790-A793 PolarHBondContact O-N 2.74Å; A793-A796 PolarHBondContact O-N 3.15Å; A793-I797 WeakPolarHBondContact O-CG1 3.49Å; A793-I797 PolarHBondContact O-N 3.44Å
794	Q	59.5	Low	51.3	Low	101 Å²	101	85.7 Å²	85.7	47%	0.472	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-39.6	176.6	-172.2	62.7	63.1	0	0	112.1	K790 L791 I797 N798	K790-Q794 PolarHBondContact O-N 2.68Å; L791-Q794 PolarHBondContact O-N 2.95Å; Q794-I797 PolarHBondContact O-N 3.02Å; Q794-N798 PolarHBondContact NE2-OD1 3.48Å; Q794-N798 PolarHBondContact O-N 3.45Å; Q794-N798 PolarHBondContact O-OD1 2.88Å
795	A	58.1	Low	52.2	Low	57 Å²	57	83 Å²	83	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-43	175.7	0	0	0	0	0	111.9	L791 A792 N798 A799	L791-A795 WeakPolarHBondContact O-CB 3.34Å; L791-A795 PolarHBondContact O-N 2.8Å; A792-A795 PolarHBondContact O-N 3.23Å; A795-N798 PolarHBondContact O-N 2.92Å; A795-A799 WeakPolarHBondContact O-CB 3.43Å; A795-A799 PolarHBondContact O-N 3.09Å
796	A	51.3	Low	53.2	Low	64 Å²	64	84.1 Å²	84.1	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-40.2	176.5	0	0	0	0	0	112.6	A792 A793 A800	A792-A796 WeakPolarHBondContact O-CB 3.37Å; A792-A796 PolarHBondContact O-N 3.43Å; A793-A796 PolarHBondContact O-N 3.15Å; A796-A800 WeakPolarHBondContact O-CB 3.41Å; A796-A800 PolarHBondContact O-N 2.6Å; A796-A800 VanDerWaalsContact O-N 3.1Å
797	I	53.3	Low	53.7	Low	85 Å²	85	83.4 Å²	83.4	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-46.4	174.8	-69.9	165.7	0	0	0	110.7	A793 Q794 A799 A800 F801	A793-I797 WeakPolarHBondContact O-CG1 3.49Å; A793-I797 PolarHBondContact O-N 3.44Å; Q794-I797 PolarHBondContact O-N 3.02Å; I797-A799 PolarHBondContact O-N 2.89Å; I797-A800 PolarHBondContact O-N 2.73Å; I797-F801 HydrophobicContact CG2-CD2 3.98Å; I797-F801 HydrophobicContact CG2-CE2 3.94Å; I797-F801 WeakPolarHBondContact O-CD2 3.23Å; I797-F801 PolarHBondContact O-N 2.91Å; I797-F801 VanDerWaalsContact O-N 3.15Å
798	N	61.3	Low	53.8	Low	84 Å²	84	85.5 Å²	85.5	45%	0.449	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-46.7	179.6	-67.9	-0.4	0	0	0	111.6	Q794 A795 A800 F801 E802	Q794-N798 PolarHBondContact NE2-OD1 3.48Å; Q794-N798 PolarHBondContact O-N 3.45Å; Q794-N798 PolarHBondContact O-OD1 2.88Å; A795-N798 PolarHBondContact O-N 2.92Å; N798-A800 VanDerWaalsContact C-N 3.3Å; N798-A800 PolarHBondContact O-N 3.22Å; N798-F801 PolarHBondContact O-N 3.08Å; N798-F801 VanDerWaalsContact O-N 3.13Å; N798-E802 PolarHBondContact O-N 2.87Å
799	A	55.9	Low	54	Low	56 Å²	56	85.8 Å²	85.8	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-35.7	178.1	0	0	0	0	0	112.8	A795 I797 E802 A803	A795-A799 WeakPolarHBondContact O-CB 3.43Å; A795-A799 PolarHBondContact O-N 3.09Å; I797-A799 PolarHBondContact O-N 2.89Å; A799-E802 PolarHBondContact O-N 3.41Å; A799-A803 WeakPolarHBondContact O-CB 3.26Å; A799-A803 PolarHBondContact O-N 3.31Å
800	A	48.2	Very low	54.3	Low	57 Å²	57	89 Å²	89	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-38.4	174.4	0	0	0	0	0	112.4	A796 I797 N798 A804	A796-A800 WeakPolarHBondContact O-CB 3.41Å; A796-A800 PolarHBondContact O-N 2.6Å; A796-A800 VanDerWaalsContact O-N 3.1Å; I797-A800 PolarHBondContact O-N 2.73Å; N798-A800 VanDerWaalsContact C-N 3.3Å; N798-A800 PolarHBondContact O-N 3.22Å; A800-A804 WeakPolarHBondContact O-CB 3.29Å; A800-A804 PolarHBondContact O-N 2.79Å; A800-A804 VanDerWaalsContact O-N 3.1Å
801	F	52.6	Low	54.1	Low	155 Å²	155	86 Å²	86	68%	0.68	50%	0.502	S	S	*	.	H	α-helix	trans	-67.4	-39.3	173.6	-86.3	-71.8	0	0	0	112.7	I797 N798 A804 A805	I797-F801 HydrophobicContact CG2-CD2 3.98Å; I797-F801 HydrophobicContact CG2-CE2 3.94Å; I797-F801 WeakPolarHBondContact O-CD2 3.23Å; I797-F801 PolarHBondContact O-N 2.91Å; I797-F801 VanDerWaalsContact O-N 3.15Å; N798-F801 PolarHBondContact O-N 3.08Å; N798-F801 VanDerWaalsContact O-N 3.13Å; F801-A804 PolarHBondContact O-N 3.44Å; F801-A805 WeakPolarHBondContact O-CB 3.35Å; F801-A805 PolarHBondContact O-N 2.9Å
802	E	62.3	Low	53.5	Low	131 Å²	131	84.2 Å²	84.2	61%	0.612	49%	0.49	S	S	*	.	H	α-helix	trans	-65.3	-42.5	176	-70.6	-173	150.4	0	0	112.2	N798 A799 A804 A805 Q806	N798-E802 PolarHBondContact O-N 2.87Å; A799-E802 PolarHBondContact O-N 3.41Å; E802-A804 VanDerWaalsContact C-N 3.33Å; E802-A804 PolarHBondContact O-N 3.05Å; E802-A805 PolarHBondContact O-N 3.34Å; E802-Q806 WeakPolarHBondContact O-CG 3.48Å; E802-Q806 PolarHBondContact O-N 3.35Å
803	A	49.9	Very low	53.7	Low	52 Å²	52	86.4 Å²	86.4	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-38.7	175	0	0	0	0	0	112.5	A799 T807	A799-A803 WeakPolarHBondContact O-CB 3.26Å; A799-A803 PolarHBondContact O-N 3.31Å; A803-T807 WeakPolarHBondContact O-CG2 3.19Å; A803-T807 PolarHBondContact O-N 2.97Å; A803-T807 VanDerWaalsContact O-N 3.09Å; A803-T807 PolarHBondContact O-OG1 2.93Å
804	A	47.6	Very low	53.3	Low	54 Å²	54	91.2 Å²	91.2	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-65.8	-37.5	173.3	0	0	0	0	0	112.4	A800 F801 E802 T807 Y808	A800-A804 WeakPolarHBondContact O-CB 3.29Å; A800-A804 PolarHBondContact O-N 2.79Å; A800-A804 VanDerWaalsContact O-N 3.1Å; F801-A804 PolarHBondContact O-N 3.44Å; E802-A804 VanDerWaalsContact C-N 3.33Å; E802-A804 PolarHBondContact O-N 3.05Å; A804-T807 WeakPolarHBondContact CA-OG1 3.26Å; A804-T807 PolarHBondContact O-OG1 3.46Å; A804-T807 VanDerWaalsContact O-OG1 3.14Å; A804-Y808 WeakPolarHBondContact O-CB 3.43Å; A804-Y808 PolarHBondContact O-N 2.89Å; A804-Y808 VanDerWaalsContact O-N 3.11Å
805	A	55.8	Low	52.7	Low	55 Å²	55	90.2 Å²	90.2	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-68.2	-44	176.3	0	0	0	0	0	112.4	F801 E802 Y808 Q809	F801-A805 WeakPolarHBondContact O-CB 3.35Å; F801-A805 PolarHBondContact O-N 2.9Å; E802-A805 PolarHBondContact O-N 3.34Å; A805-Y808 PolarHBondContact O-N 2.83Å; A805-Q809 WeakPolarHBondContact O-CG 3.3Å; A805-Q809 PolarHBondContact O-N 2.83Å
806	Q	60	Low	51.8	Low	133 Å²	133	95.1 Å²	95.1	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-63.7	-46.1	178.2	-71.4	178.8	6.2	0	0	112	E802 Y808 Q809 L810	E802-Q806 WeakPolarHBondContact O-CG 3.48Å; E802-Q806 PolarHBondContact O-N 3.35Å; Q806-Y808 VanDerWaalsContact C-N 3.32Å; Q806-Y808 PolarHBondContact O-N 3.07Å; Q806-Q809 PolarHBondContact O-N 2.99Å; Q806-L810 WeakPolarHBondContact O-CG 3.36Å; Q806-L810 PolarHBondContact O-N 3.04Å
807	T	51.4	Low	51.4	Low	75 Å²	75	99.4 Å²	99.4	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-36.2	177	47.3	0	0	0	0	112.4	A803 A804 S811	A803-T807 WeakPolarHBondContact O-CG2 3.19Å; A803-T807 PolarHBondContact O-N 2.97Å; A803-T807 VanDerWaalsContact O-N 3.09Å; A803-T807 PolarHBondContact O-OG1 2.93Å; A804-T807 WeakPolarHBondContact CA-OG1 3.26Å; A804-T807 PolarHBondContact O-OG1 3.46Å; A804-T807 VanDerWaalsContact O-OG1 3.14Å; T807-S811 PolarHBondContact O-N 3.32Å; T807-S811 VanDerWaalsContact O-N 3.13Å
808	Y	49.5	Very low	51	Low	145 Å²	145	100.8 Å²	100.8	57%	0.569	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-45.7	172.3	-179.5	-101	0	0	0	112.5	A804 A805 Q806 S811 K812	A804-Y808 WeakPolarHBondContact O-CB 3.43Å; A804-Y808 PolarHBondContact O-N 2.89Å; A804-Y808 VanDerWaalsContact O-N 3.11Å; A805-Y808 PolarHBondContact O-N 2.83Å; Q806-Y808 VanDerWaalsContact C-N 3.32Å; Q806-Y808 PolarHBondContact O-N 3.07Å; Y808-S811 PolarHBondContact O-N 3.17Å; Y808-S811 PolarHBondContact O-OG 2.82Å; Y808-K812 HydrophobicContact CE1-CD 4.34Å; Y808-K812 PolarHBondContact O-N 2.92Å
809	Q	57.5	Low	50	Low	105 Å²	105	103.2 Å²	103.2	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-63.4	-44.8	178.6	-64.6	-70.7	18.3	0	0	112.1	A805 Q806 S811 K812 E813	A805-Q809 WeakPolarHBondContact O-CG 3.3Å; A805-Q809 PolarHBondContact O-N 2.83Å; Q806-Q809 PolarHBondContact O-N 2.99Å; Q809-S811 VanDerWaalsContact C-N 3.29Å; Q809-S811 PolarHBondContact O-N 3.32Å; Q809-K812 WeakPolarHBondContact O-CA 3.38Å; Q809-K812 WeakPolarHBondContact O-CB 3.4Å; Q809-K812 PolarHBondContact O-N 2.86Å; Q809-E813 PolarHBondContact O-N 3.46Å
810	L	55.6	Low	49.3	Very low	114 Å²	114	109 Å²	109	60%	0.597	55%	0.55	S	S	*	.	H	α-helix	trans	-58.2	-40.4	176.3	-72.7	166.8	0	0	0	112.1	Q806 K812 E813 Y814	Q806-L810 WeakPolarHBondContact O-CG 3.36Å; Q806-L810 PolarHBondContact O-N 3.04Å; L810-K812 PolarHBondContact O-N 3.46Å; L810-E813 PolarHBondContact O-N 3.49Å; L810-Y814 PolarHBondContact O-N 3.48Å
811	S	47.4	Very low	48.7	Very low	61 Å²	61	116.9 Å²	116.9	43%	0.427	57%	0.568	S	S	.	*	H	α-helix	trans	-62.8	-31.4	174.9	81.3	0	0	0	0	113.2	T807 Y808 Q809 T815	T807-S811 PolarHBondContact O-N 3.32Å; T807-S811 VanDerWaalsContact O-N 3.13Å; Y808-S811 PolarHBondContact O-N 3.17Å; Y808-S811 PolarHBondContact O-OG 2.82Å; Q809-S811 VanDerWaalsContact C-N 3.29Å; Q809-S811 PolarHBondContact O-N 3.32Å; S811-T815 PolarHBondContact O-N 2.89Å; S811-T815 PolarHBondContact O-OG1 3.17Å
812	K	45.9	Very low	47.9	Very low	81 Å²	81	118.1 Å²	118.1	35%	0.352	58%	0.575	S	S	.	*	H	α-helix	trans	-80.5	-29.4	-179	-169.7	177.1	-179.8	179.3	0	112.6	Y808 Q809 L810 T815 R816	Y808-K812 HydrophobicContact CE1-CD 4.34Å; Y808-K812 PolarHBondContact O-N 2.92Å; Q809-K812 WeakPolarHBondContact O-CA 3.38Å; Q809-K812 WeakPolarHBondContact O-CB 3.4Å; Q809-K812 PolarHBondContact O-N 2.86Å; L810-K812 PolarHBondContact O-N 3.46Å; K812-T815 WeakPolarHBondContact CA-OG1 3.24Å; K812-T815 PolarHBondContact O-OG1 2.95Å; K812-R816 WeakPolarHBondContact O-CG 3.48Å; K812-R816 PolarHBondContact O-N 3.09Å
813	E	54.2	Low	46.3	Very low	109 Å²	109	116.8 Å²	116.8	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-76.4	-42.7	172.3	-68.8	-175.7	147.9	0	0	111.4	Q809 L810 T815 R816 H817	Q809-E813 PolarHBondContact O-N 3.46Å; L810-E813 PolarHBondContact O-N 3.49Å; E813-T815 VanDerWaalsContact C-N 3.32Å; E813-T815 PolarHBondContact O-N 2.81Å; E813-R816 WeakPolarHBondContact O-CA 3.32Å; E813-R816 WeakPolarHBondContact O-CB 3.47Å; E813-R816 PolarHBondContact O-N 3.16Å; E813-H817 PolarHBondContact O-CD2 3.2Å; E813-H817 PolarHBondContact O-N 3.48Å
814	Y	43	Very low	45.4	Very low	142 Å²	142	125.3 Å²	125.3	56%	0.557	60%	0.603	S	S	*	*	H	α-helix	trans	-57.4	-44.5	174.4	-166.5	-96.2	0	0	0	112	L810 R816 H817 H818	L810-Y814 PolarHBondContact O-N 3.48Å; Y814-R816 VanDerWaalsContact C-N 3.28Å; Y814-R816 PolarHBondContact O-N 3.03Å; Y814-H817 PolarHBondContact O-N 3.07Å; Y814-H818 AromaticContact CE1-CD2 3.68Å; Y814-H818 AromaticContact CZ-CD2 3.76Å; Y814-H818 PolarHBondContact O-N 3.39Å; Y814-H818 VanDerWaalsContact O-N 3.17Å
815	T	45.3	Very low	44.7	Very low	80 Å²	80	131 Å²	131	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-71.5	-15.3	175.5	45.1	0	0	0	0	114.3	S811 K812 E813 N819	S811-T815 PolarHBondContact O-N 2.89Å; S811-T815 PolarHBondContact O-OG1 3.17Å; K812-T815 WeakPolarHBondContact CA-OG1 3.24Å; K812-T815 PolarHBondContact O-OG1 2.95Å; E813-T815 VanDerWaalsContact C-N 3.32Å; E813-T815 PolarHBondContact O-N 2.81Å; T815-N819 PolarHBondContact O-ND2 3.42Å
816	R	39.7	Very low	43.4	Very low	160 Å²	160	138.1 Å²	138.1	60%	0.604	64%	0.641	S	S	*	*	H	α-helix	trans	-80	-48.4	168	-81.4	171	164	179.2	-8.6	111.7	K812 E813 Y814 H818 N819	K812-R816 WeakPolarHBondContact O-CG 3.48Å; K812-R816 PolarHBondContact O-N 3.09Å; E813-R816 WeakPolarHBondContact O-CA 3.32Å; E813-R816 WeakPolarHBondContact O-CB 3.47Å; E813-R816 PolarHBondContact O-N 3.16Å; Y814-R816 VanDerWaalsContact C-N 3.28Å; Y814-R816 PolarHBondContact O-N 3.03Å; R816-H818 PolarHBondContact O-N 3.2Å; R816-N819 PolarHBondContact O-N 3.37Å
817	H	43.2	Very low	42.2	Very low	154 Å²	154	137.2 Å²	137.2	71%	0.713	65%	0.647	S	S	*	*	H	α-helix	trans	-61.9	-39.7	-178.4	-84.5	-81.4	0	0	0	113	E813 Y814 N819	E813-H817 PolarHBondContact O-CD2 3.2Å; E813-H817 PolarHBondContact O-N 3.48Å; Y814-H817 PolarHBondContact O-N 3.07Å; H817-N819 VanDerWaalsContact C-N 3.34Å; H817-N819 PolarHBondContact O-N 2.92Å
818	H	45.6	Very low	41.4	Very low	113 Å²	113	139.3 Å²	139.3	52%	0.523	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-70.1	-25.9	179.7	-114.7	-58.5	0	0	0	114.6	Y814 R816	Y814-H818 AromaticContact CE1-CD2 3.68Å; Y814-H818 AromaticContact CZ-CD2 3.76Å; Y814-H818 PolarHBondContact O-N 3.39Å; Y814-H818 VanDerWaalsContact O-N 3.17Å; R816-H818 PolarHBondContact O-N 3.2Å
819	N	40.4	Very low	40.5	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-82.4	-8.6	-177.1	-84.8	-58.6	0	0	0	114.2	T815 R816 H817	T815-N819 PolarHBondContact O-ND2 3.42Å; R816-N819 PolarHBondContact O-N 3.37Å; H817-N819 VanDerWaalsContact C-N 3.34Å; H817-N819 PolarHBondContact O-N 2.92Å
820	H	40.1	Very low	39.4	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.815	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-94.1	0.5	-179.9	-93.7	-78.3	0	0	0	115.3
821	R	35.2	Very low	38.1	Very low	224 Å²	224	142.7 Å²	142.7	85%	0.845	70%	0.701	S	S	*	*	S	Bend	trans	-111.5	4.2	-172	-98.7	-175.1	173.8	-172.7	-2.5	117.8
822	H	36.7	Very low	37.5	Very low	181 Å²	181	143.4 Å²	143.4	84%	0.838	72%	0.718	S	S	*	*			trans	-130.9	82.2	176.9	-79.8	-59.6	0	0	0	114.1
823	S	27.8	Very low	36.9	Very low	102 Å²	102	149.7 Å²	149.7	71%	0.713	75%	0.745	S	S	*	*			trans	-159.8	75.8	168	176	0	0	0	0	112.9
824	Y	31.5	Very low	35.8	Very low	231 Å²	231	149.1 Å²	149.1	91%	0.906	75%	0.753	S	S	*	*			trans	-151.4	173	154.9	-87.5	-52.6	0	0	0	113.1
825	H	32.8	Very low	35.5	Very low	174 Å²	174	151 Å²	151	81%	0.806	77%	0.767	S	S	*	*			trans	-74.4	151.7	-151.2	-84.2	-90.8	0	0	0	118.3
826	F	29.7	Very low	34.8	Very low	205 Å²	205	155.9 Å²	155.9	90%	0.899	78%	0.781	S	S	*	*			trans	-107.2	128.8	158.1	-107.4	-85.1	0	0	0	110.7
827	P	34.1	Very low	34.3	Very low	114 Å²	114	158.6 Å²	158.6	74%	0.74	79%	0.791	S	S	*	*			trans	-99.9	155.9	163.7	35.8	-30.3	0	0	0	112.6
828	P	33.9	Very low	33.8	Very low	119 Å²	119	156.6 Å²	156.6	77%	0.773	80%	0.795	S	S	*	*			trans	-116.5	165.7	-169.1	41.2	-34	0	0	0	117.9
829	S	31.7	Very low	33.1	Very low	101 Å²	101	158 Å²	158	71%	0.706	81%	0.806	S	S	*	*			trans	87.7	130	152	79.3	0	0	0	0	121.2
830	K	34.6	Very low	32.4	Very low	199 Å²	199	158.9 Å²	158.9	87%	0.865	81%	0.809	S	S	*	*				-176.7	168.5	105.6	-97.3	167.3	-172.4	172.5	0	115.7
831	C	28.2	Very low	31.9	Very low	134 Å²	134	155.5 Å²	155.5	91%	0.905	81%	0.805	S	S	*	*			trans	-46.1	155.8	-169.1	-59.9	0	0	0	0	122.3
832	G	32.9	Very low	31.6	Very low	76 Å²	76	152.4 Å²	152.4	78%	0.784	81%	0.805	S	S	*	*			trans	-165.7	145.1	153.7	0	0	0	0	0	111.4
833	K	33.2	Very low	31.1	Very low	213 Å²	213	149 Å²	149	93%	0.926	80%	0.802	S	S	*	*			trans	-144.7	159.7	-174.9	-81.1	-174.2	-179.9	175	0	114
834	S	32.2	Very low	31.3	Very low	97 Å²	97	150 Å²	150	68%	0.678	81%	0.809	S	S	*	*			trans	85.8	126.4	159.5	-146.3	0	0	0	0	115.9
835	H	36.2	Very low	31.2	Very low	182 Å²	182	148 Å²	148	84%	0.843	80%	0.801	S	S	*	*				-148.2	-171.2	60.1	-107.2	-92.2	0	0	0	115.2
836	K	31.3	Very low	31.3	Very low	183 Å²	183	147.3 Å²	147.3	80%	0.796	80%	0.804	S	S	*	*			trans	-151.8	148.5	-164.4	-137.9	-178.7	-172.5	174.6	0	113.6
837	R	28.7	Very low	31.4	Very low	217 Å²	217	144.8 Å²	144.8	82%	0.819	79%	0.794	S	S	*	*			trans	64.3	121.2	158.6	-73.2	177.8	165.6	172.7	-6.8	121.5
838	S	33.7	Very low	31	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	79%	0.794	S	S	*	*				-176.5	119.2	116.6	50.1	0	0	0	0	108.4
839	L	29.3	Very low	30.9	Very low	143 Å²	143	144.7 Å²	144.7	75%	0.749	79%	0.793	S	S	*	*				79.8	107.5	65.2	-73.9	175.5	0	0	0	115.5
840	L	27.2	Very low	30.6	Very low	154 Å²	154	147 Å²	147	81%	0.806	80%	0.797	S	S	*	*			trans	50.5	126.3	141.9	-59.5	169	0	0	0	120.6
841	S	28	Very low	30.4	Very low	104 Å²	104	148.2 Å²	148.2	73%	0.727	80%	0.798	S	S	*	*				171.6	169.2	95.7	52	0	0	0	0	114.6
842	N	29.5	Very low	30.5	Very low	159 Å²	159	147.3 Å²	147.3	85%	0.85	79%	0.791	S	S	*	*			trans	71.3	115.5	160.5	-67.5	-0.8	0	0	0	121.6
843	S	26.3	Very low	30.2	Very low	111 Å²	111	148.2 Å²	148.2	78%	0.776	79%	0.79	S	S	*	*			trans	-82.8	162.6	164.2	52.3	0	0	0	0	113.2
844	S	32.3	Very low	30.1	Very low	122 Å²	122	147.8 Å²	147.8	85%	0.853	79%	0.792	S	S	*	*			trans	-146.8	157.8	138.7	-160.4	0	0	0	0	111.7
845	Y	29.4	Very low	30.2	Very low	188 Å²	188	150.9 Å²	150.9	74%	0.737	80%	0.8	S	S	*	*			trans	-73.7	151.6	-173.4	-85.4	-124.9	0	0	0	113
846	N	34.8	Very low	29.9	Very low	161 Å²	161	149.5 Å²	149.5	86%	0.861	80%	0.799	S	S	*	*				-168.8	134.7	108.8	-93.6	-26.3	0	0	0	115.4
847	H	31.3	Very low	30	Very low	152 Å²	152	145.2 Å²	145.2	70%	0.704	79%	0.789	S	S	*	*			trans	-38.9	150.7	179.2	-101.7	-93.7	0	0	0	121.6
848	C	25.3	Very low	30.3	Very low	109 Å²	109	143.5 Å²	143.5	74%	0.736	78%	0.784	S	S	*	*			trans	64.9	153.4	143.7	-74.9	0	0	0	0	119.5
849	T	32.3	Very low	30.7	Very low	121 Å²	121	142.6 Å²	142.6	74%	0.742	78%	0.776	S	S	*	*			cis	-130	165	6.3	48.8	0	0	0	0	112.8
850	D	26.8	Very low	31	Very low	150 Å²	150	143.9 Å²	143.9	80%	0.802	77%	0.772	S	S	*	*			trans	-62.9	144.6	174.9	-57.7	-90.7	0	0	0	115.5
851	Y	30.3	Very low	31.6	Very low	224 Å²	224	144 Å²	144	88%	0.878	76%	0.762	S	S	*	*			trans	-148.9	139.5	146.5	-98.8	-82.1	0	0	0	108.9
852	P	30.4	Very low	32.2	Very low	116 Å²	116	145 Å²	145	75%	0.753	75%	0.753	S	S	*	*			trans	-91.6	148.6	-169.2	34.5	-35.5	0	0	0	115
853	A	26.4	Very low	32.7	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	74%	0.74	S	S	*	*			trans	52.2	89.9	155.2	0	0	0	0	0	118.3	L855	A853-L855 PolarHBondContact O-N 3.36Å
854	E	31.3	Very low	33.5	Very low	205 Å²	205	139.7 Å²	139.7	96%	0.958	72%	0.721	S	S	*	*			trans	-67	131	156.1	-76.9	-163.5	135.9	0	0	110.9
855	L	33.2	Very low	34.1	Very low	162 Å²	162	137 Å²	137	85%	0.848	70%	0.703	S	S	*	*			trans	-84.3	126.6	-169.9	-165	74.5	0	0	0	111	A853 P857	A853-L855 PolarHBondContact O-N 3.36Å; L855-P857 VanDerWaalsContact O-CD 3.26Å; L855-P857 WeakPolarHBondContact O-CD 3.48Å; L855-P857 VanDerWaalsContact O-N 3.13Å
856	N	30.9	Very low	35	Very low	153 Å²	153	134 Å²	134	82%	0.818	69%	0.69	S	S	*	*			trans	-54.7	115.8	173.2	-100.2	-37.7	0	0	0	110.8
857	P	32.8	Very low	35.6	Very low	92 Å²	92	131.2 Å²	131.2	60%	0.597	68%	0.675	S	S	*	*			trans	-81.7	144.2	-176.6	33.7	-35.1	0	0	0	111.9	L855	L855-P857 VanDerWaalsContact O-CD 3.26Å; L855-P857 WeakPolarHBondContact O-CD 3.48Å; L855-P857 VanDerWaalsContact O-N 3.13Å
858	Y	35	Very low	36.5	Very low	182 Å²	182	128.7 Å²	128.7	71%	0.714	67%	0.666	S	S	*	*			trans	75.3	57.1	167.8	-43	-62.6	0	0	0	120.3	Y860	Y858-Y860 PolarHBondContact O-N 3.18Å
859	P	41.6	Very low	37.7	Very low	92 Å²	92	124.5 Å²	124.5	60%	0.597	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-31.2	151.4	29	-33.5	0	0	0	111.4	R861 K862 L863	P859-R861 VanDerWaalsContact C-N 3.27Å; P859-R861 PolarHBondContact O-N 2.87Å; P859-R861 VanDerWaalsContact O-N 3.17Å; P859-K862 PolarHBondContact O-N 2.85Å; P859-L863 PolarHBondContact O-N 2.82Å
860	Y	36.7	Very low	38.8	Very low	170 Å²	170	123.4 Å²	123.4	67%	0.667	63%	0.627	S	S	*	*	H	α-helix	trans	-59.5	-25.8	-176.1	-64.7	-77.2	0	0	0	115.2	Y858 L863 A864	Y858-Y860 PolarHBondContact O-N 3.18Å; Y860-L863 HydrophobicContact CD1-CD2 4.39Å; Y860-L863 PolarHBondContact O-N 2.85Å; Y860-A864 WeakPolarHBondContact O-CB 3.23Å; Y860-A864 PolarHBondContact O-N 2.79Å
861	R	39.8	Very low	40	Very low	158 Å²	158	120.6 Å²	120.6	60%	0.596	61%	0.609	S	S	*	*	H	α-helix	trans	-73	-34.5	-177.5	-153.2	174	-172.6	-174.6	-0.8	112.3	P859	P859-R861 VanDerWaalsContact C-N 3.27Å; P859-R861 PolarHBondContact O-N 2.87Å; P859-R861 VanDerWaalsContact O-N 3.17Å
862	K	40	Very low	41.1	Very low	125 Å²	125	113.4 Å²	113.4	54%	0.543	58%	0.584	S	S	.	*	H	α-helix	trans	-78.3	-25.4	171.8	-147	-174.9	-175.8	-161.9	0	111.8	D345 P859 S865 R866	D345-K862 IonicContact OD2-NZ 3.6Å; D345-K862 PolarHBondContact OD2-NZ 3.13Å; P859-K862 PolarHBondContact O-N 2.85Å; K862-S865 PolarHBondContact O-OG 3.02Å; K862-R866 WeakPolarHBondContact O-CG 3.48Å
863	L	39.5	Very low	42.3	Very low	110 Å²	110	110.1 Å²	110.1	58%	0.576	56%	0.56	S	S	*	*	H	α-helix	trans	-71.8	-46	172.9	-159.9	77.7	0	0	0	111.4	P859 Y860 R866 L867	P859-L863 PolarHBondContact O-N 2.82Å; Y860-L863 HydrophobicContact CD1-CD2 4.39Å; Y860-L863 PolarHBondContact O-N 2.85Å; L863-R866 CarbonylContact O-C 3.5Å; L863-R866 PolarHBondContact O-N 2.95Å; L863-R866 VanDerWaalsContact O-N 3.14Å; L863-L867 WeakPolarHBondContact O-CB 3.33Å; L863-L867 PolarHBondContact O-N 3.3Å
864	A	43.2	Very low	43.7	Very low	47 Å²	47	109.3 Å²	109.3	39%	0.388	55%	0.545	S	S	.	.	H	α-helix	trans	-59	-52.4	-179.9	0	0	0	0	0	111.8	Y860 R866 L867 D868	Y860-A864 WeakPolarHBondContact O-CB 3.23Å; Y860-A864 PolarHBondContact O-N 2.79Å; A864-R866 PolarHBondContact O-N 2.69Å; A864-R866 VanDerWaalsContact O-N 3.12Å; A864-L867 CarbonylContact O-C 3.56Å; A864-L867 WeakPolarHBondContact O-CA 3.3Å; A864-L867 WeakPolarHBondContact O-CB 3.39Å; A864-L867 PolarHBondContact O-N 2.77Å; A864-D868 PolarHBondContact O-N 3.04Å
865	S	45.7	Very low	44.8	Very low	67 Å²	67	106.4 Å²	106.4	47%	0.469	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-26.8	177.3	63.9	0	0	0	0	113.5	K862 C869	K862-S865 PolarHBondContact O-OG 3.02Å; S865-C869 WeakPolarHBondContact O-CB 3.3Å; S865-C869 PolarHBondContact O-N 2.62Å
866	R	48.6	Very low	45.8	Very low	124 Å²	124	102.1 Å²	102.1	47%	0.468	50%	0.504	S	S	.	.	H	α-helix	trans	-81.2	-31.9	172.4	-77.3	-175.5	170.4	-158.1	-2.2	112.4	D345 K862 L863 A864 C869 I870	D345-R866 IonicContact OD1-CZ 2.78Å; D345-R866 IonicContact OD1-NE 3.43Å; D345-R866 IonicContact OD1-NH2 3.97Å; D345-R866 PolarHBondContact OD1-NH2 2.94Å; D345-R866 IonicContact OD2-NH2 2.8Å; D345-R866 PolarHBondContact OD2-NH2 3.08Å; D345-R866 VanDerWaalsContact OD2-NH2 3.09Å; K862-R866 WeakPolarHBondContact O-CG 3.48Å; L863-R866 CarbonylContact O-C 3.5Å; L863-R866 PolarHBondContact O-N 2.95Å; L863-R866 VanDerWaalsContact O-N 3.14Å; A864-R866 PolarHBondContact O-N 2.69Å; A864-R866 VanDerWaalsContact O-N 3.12Å; R866-C869 PolarHBondContact O-N 3.33Å; R866-I870 WeakPolarHBondContact O-CB 3.35Å; R866-I870 WeakPolarHBondContact O-CD1 3.47Å; R866-I870 WeakPolarHBondContact O-CG1 3.17Å; R866-I870 PolarHBondContact O-N 3.48Å
867	L	47	Very low	46.9	Very low	103 Å²	103	99.8 Å²	99.8	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-70.8	-40.7	174.6	-162	72	0	0	0	110.9	L863 A864 I870 Q871	L863-L867 WeakPolarHBondContact O-CB 3.33Å; L863-L867 PolarHBondContact O-N 3.3Å; A864-L867 CarbonylContact O-C 3.56Å; A864-L867 WeakPolarHBondContact O-CA 3.3Å; A864-L867 WeakPolarHBondContact O-CB 3.39Å; A864-L867 PolarHBondContact O-N 2.77Å; L867-I870 PolarHBondContact O-N 3.23Å; L867-Q871 VanDerWaalsContact O-CB 3.25Å; L867-Q871 WeakPolarHBondContact O-CB 3.26Å; L867-Q871 PolarHBondContact O-N 2.79Å
868	D	49.3	Very low	47.9	Very low	98 Å²	98	99.4 Å²	99.4	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-41.5	171.2	-61.4	-37.4	0	0	0	111	A864 Q871 M872	A864-D868 PolarHBondContact O-N 3.04Å; D868-Q871 PolarHBondContact O-N 2.93Å; D868-M872 VanDerWaalsContact O-CB 3.28Å; D868-M872 WeakPolarHBondContact O-CB 3.49Å; D868-M872 WeakPolarHBondContact O-CG 3.06Å; D868-M872 PolarHBondContact O-N 3.47Å
869	C	50.8	Low	48.7	Very low	21 Å²	21	93.9 Å²	93.9	14%	0.142	47%	0.467	C	S	.	.	H	α-helix	trans	-64.5	-43.6	173.2	-118.6	0	0	0	0	111.9	S865 R866 M872 I873	S865-C869 WeakPolarHBondContact O-CB 3.3Å; S865-C869 PolarHBondContact O-N 2.62Å; R866-C869 PolarHBondContact O-N 3.33Å; C869-M872 PolarHBondContact O-N 3.39Å; C869-I873 WeakPolarHBondContact O-CB 3.49Å; C869-I873 WeakPolarHBondContact O-CD1 3.43Å; C869-I873 WeakPolarHBondContact O-CG1 3.48Å; C869-I873 PolarHBondContact O-N 3.03Å
870	I	55	Low	49.1	Very low	99 Å²	99	93 Å²	93	51%	0.508	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-45.5	175.4	-73.9	162.5	0	0	0	109.6	R866 L867 M872 I873 T874	R866-I870 WeakPolarHBondContact O-CB 3.35Å; R866-I870 WeakPolarHBondContact O-CD1 3.47Å; R866-I870 WeakPolarHBondContact O-CG1 3.17Å; R866-I870 PolarHBondContact O-N 3.48Å; L867-I870 PolarHBondContact O-N 3.23Å; I870-M872 PolarHBondContact O-N 3.2Å; I870-I873 CarbonylContact O-C 3.57Å; I870-I873 PolarHBondContact O-N 3.43Å; I870-T874 VanDerWaalsContact O-CB 3.31Å; I870-T874 WeakPolarHBondContact O-CB 3.31Å; I870-T874 PolarHBondContact O-N 3.33Å; I870-T874 PolarHBondContact O-OG1 2.81Å
871	Q	52.8	Low	49.8	Very low	91 Å²	91	89.2 Å²	89.2	43%	0.425	45%	0.45	S	S	.	.	H	α-helix	trans	-67	-35.7	179.5	-172.8	171.3	-6.5	0	0	111.8	L867 D868 T874 Y875	L867-Q871 VanDerWaalsContact O-CB 3.25Å; L867-Q871 WeakPolarHBondContact O-CB 3.26Å; L867-Q871 PolarHBondContact O-N 2.79Å; D868-Q871 PolarHBondContact O-N 2.93Å; Q871-T874 CarbonylContact O-C 3.6Å; Q871-T874 PolarHBondContact O-N 2.89Å; Q871-Y875 HydrophobicContact CG-CD2 3.89Å; Q871-Y875 HydrophobicContact CG-CE2 3.5Å; Q871-Y875 PolarHBondContact NE2-OH 2.68Å; Q871-Y875 WeakPolarHBondContact O-CB 3.44Å; Q871-Y875 WeakPolarHBondContact O-CD2 3.38Å; Q871-Y875 PolarHBondContact O-N 3.1Å
872	M	53.3	Low	50.1	Low	72 Å²	72	85.9 Å²	85.9	36%	0.355	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-47.3	168.3	-87.2	-75.5	-70.6	0	0	112.3	L399 D868 C869 I870 T874 Y875 L876	L399-M872 HydrophobicContact CD1-CE 3.64Å; L399-M872 HydrophobicContact CD2-CE 4.26Å; D868-M872 VanDerWaalsContact O-CB 3.28Å; D868-M872 WeakPolarHBondContact O-CB 3.49Å; D868-M872 WeakPolarHBondContact O-CG 3.06Å; D868-M872 PolarHBondContact O-N 3.47Å; C869-M872 PolarHBondContact O-N 3.39Å; I870-M872 PolarHBondContact O-N 3.2Å; M872-T874 VanDerWaalsContact C-N 3.29Å; M872-T874 PolarHBondContact O-N 2.85Å; M872-Y875 PolarHBondContact O-N 3.07Å; M872-L876 WeakPolarHBondContact O-CB 3.29Å; M872-L876 WeakPolarHBondContact O-CG 3.4Å; M872-L876 PolarHBondContact O-N 2.73Å
873	I	55.7	Low	50.4	Low	48 Å²	48	80.8 Å²	80.8	25%	0.246	43%	0.426	C	S	.	.	H	α-helix	trans	-64.1	-37.1	176.7	-70.4	165	0	0	0	110.1	F342 C869 I870 L876 F877	F342-I873 HydrophobicContact CB-CD1 4.22Å; C869-I873 WeakPolarHBondContact O-CB 3.49Å; C869-I873 WeakPolarHBondContact O-CD1 3.43Å; C869-I873 WeakPolarHBondContact O-CG1 3.48Å; C869-I873 PolarHBondContact O-N 3.03Å; I870-I873 CarbonylContact O-C 3.57Å; I870-I873 PolarHBondContact O-N 3.43Å; I873-L876 PolarHBondContact O-N 2.96Å; I873-F877 HydrophobicContact CG2-CD2 3.81Å; I873-F877 HydrophobicContact CG2-CE2 4.17Å; I873-F877 VanDerWaalsContact O-CB 3.31Å; I873-F877 WeakPolarHBondContact O-CB 3.4Å; I873-F877 WeakPolarHBondContact O-CD2 3.28Å; I873-F877 PolarHBondContact O-N 2.8Å
874	T	55.2	Low	50.6	Low	76 Å²	76	79.8 Å²	79.8	47%	0.466	42%	0.42	S	S	.	.	H	α-helix	trans	-72.2	-35.2	174.5	-59.9	0	0	0	0	111.5	I870 Q871 M872 L878	I870-T874 VanDerWaalsContact O-CB 3.31Å; I870-T874 WeakPolarHBondContact O-CB 3.31Å; I870-T874 PolarHBondContact O-N 3.33Å; I870-T874 PolarHBondContact O-OG1 2.81Å; Q871-T874 CarbonylContact O-C 3.6Å; Q871-T874 PolarHBondContact O-N 2.89Å; M872-T874 VanDerWaalsContact C-N 3.29Å; M872-T874 PolarHBondContact O-N 2.85Å; T874-L878 WeakPolarHBondContact O-CA 3.43Å; T874-L878 WeakPolarHBondContact O-CB 3.44Å; T874-L878 PolarHBondContact O-N 2.89Å
875	Y	54.8	Low	50.5	Low	144 Å²	144	79.6 Å²	79.6	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-68.9	-37	170.7	-78.3	-51	0	0	0	111.7	Q871 M872 S879	Q871-Y875 HydrophobicContact CG-CD2 3.89Å; Q871-Y875 HydrophobicContact CG-CE2 3.5Å; Q871-Y875 PolarHBondContact NE2-OH 2.68Å; Q871-Y875 WeakPolarHBondContact O-CB 3.44Å; Q871-Y875 WeakPolarHBondContact O-CD2 3.38Å; Q871-Y875 PolarHBondContact O-N 3.1Å; M872-Y875 PolarHBondContact O-N 3.07Å; Y875-S879 WeakPolarHBondContact O-CA 3.36Å; Y875-S879 WeakPolarHBondContact O-CB 3.26Å; Y875-S879 PolarHBondContact O-N 2.82Å
876	L	53.3	Low	50.4	Low	72 Å²	72	80.2 Å²	80.2	38%	0.377	42%	0.422	S	S	.	.	H	α-helix	trans	-66.9	-47.5	173.2	-71.8	166.6	0	0	0	111.2	M872 I873 S879 T880	M872-L876 WeakPolarHBondContact O-CB 3.29Å; M872-L876 WeakPolarHBondContact O-CG 3.4Å; M872-L876 PolarHBondContact O-N 2.73Å; I873-L876 PolarHBondContact O-N 2.96Å; L876-S879 PolarHBondContact O-N 2.89Å; L876-T880 WeakPolarHBondContact O-CG2 3.17Å; L876-T880 PolarHBondContact O-N 3.46Å; L876-T880 PolarHBondContact O-OG1 2.98Å
877	F	55	Low	50	Low	105 Å²	105	75.4 Å²	75.4	46%	0.461	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-36.9	175.8	-97.3	-90.3	0	0	0	113	I873 T880 I881	I873-F877 HydrophobicContact CG2-CD2 3.81Å; I873-F877 HydrophobicContact CG2-CE2 4.17Å; I873-F877 VanDerWaalsContact O-CB 3.31Å; I873-F877 WeakPolarHBondContact O-CB 3.4Å; I873-F877 WeakPolarHBondContact O-CD2 3.28Å; I873-F877 PolarHBondContact O-N 2.8Å; F877-T880 WeakPolarHBondContact CA-OG1 3.46Å; F877-T880 PolarHBondContact O-N 2.87Å; F877-T880 PolarHBondContact O-OG1 2.87Å; F877-I881 WeakPolarHBondContact O-CB 3.41Å; F877-I881 WeakPolarHBondContact O-CD1 3.48Å; F877-I881 WeakPolarHBondContact O-CG1 3.33Å; F877-I881 PolarHBondContact O-N 2.81Å
878	L	54.2	Low	49.8	Very low	83 Å²	83	76.3 Å²	76.3	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-75.6	-28.5	175.9	-164.9	69.3	0	0	0	110.7	T874 N882	T874-L878 WeakPolarHBondContact O-CA 3.43Å; T874-L878 WeakPolarHBondContact O-CB 3.44Å; T874-L878 PolarHBondContact O-N 2.89Å; L878-N882 WeakPolarHBondContact O-CB 3.43Å; L878-N882 PolarHBondContact O-N 3.09Å; L878-N882 PolarHBondContact O-ND2 3.25Å
879	S	51.8	Low	49.7	Very low	67 Å²	67	77.1 Å²	77.1	47%	0.469	41%	0.413	S	S	.	.	H	α-helix	trans	-69.1	-39.3	168.6	-172.7	0	0	0	0	111.6	Y875 L876 A883	Y875-S879 WeakPolarHBondContact O-CA 3.36Å; Y875-S879 WeakPolarHBondContact O-CB 3.26Å; Y875-S879 PolarHBondContact O-N 2.82Å; L876-S879 PolarHBondContact O-N 2.89Å; S879-A883 WeakPolarHBondContact O-CB 3.34Å; S879-A883 PolarHBondContact O-N 3.38Å
880	T	49.6	Very low	49.3	Very low	73 Å²	73	82.2 Å²	82.2	45%	0.448	44%	0.436	S	S	.	.	H	α-helix	trans	-72.6	-38.3	173.7	57.7	0	0	0	0	111.6	L876 F877 A883 I884	L876-T880 WeakPolarHBondContact O-CG2 3.17Å; L876-T880 PolarHBondContact O-N 3.46Å; L876-T880 PolarHBondContact O-OG1 2.98Å; F877-T880 WeakPolarHBondContact CA-OG1 3.46Å; F877-T880 PolarHBondContact O-N 2.87Å; F877-T880 PolarHBondContact O-OG1 2.87Å; T880-A883 PolarHBondContact O-N 2.96Å; T880-I884 WeakPolarHBondContact O-CB 3.4Å; T880-I884 WeakPolarHBondContact O-CD1 3.48Å; T880-I884 WeakPolarHBondContact O-CG1 3.36Å; T880-I884 PolarHBondContact O-N 2.63Å
881	I	50.7	Low	48.8	Very low	90 Å²	90	81.6 Å²	81.6	46%	0.462	44%	0.439	S	S	.	.	H	α-helix	trans	-66.3	-41.1	174.8	-71.4	163.2	0	0	0	111.2	F877 I884 A885	F877-I881 WeakPolarHBondContact O-CB 3.41Å; F877-I881 WeakPolarHBondContact O-CD1 3.48Å; F877-I881 WeakPolarHBondContact O-CG1 3.33Å; F877-I881 PolarHBondContact O-N 2.81Å; I881-I884 CarbonylContact O-C 3.56Å; I881-I884 PolarHBondContact O-N 2.88Å; I881-A885 WeakPolarHBondContact O-CB 3.44Å; I881-A885 PolarHBondContact O-N 3.28Å
882	N	47.2	Very low	48.3	Very low	88 Å²	88	86.1 Å²	86.1	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-37.7	174.6	-72.2	-11.1	0	0	0	111.4	L878 I884 A885 C886	L878-N882 WeakPolarHBondContact O-CB 3.43Å; L878-N882 PolarHBondContact O-N 3.09Å; L878-N882 PolarHBondContact O-ND2 3.25Å; N882-I884 VanDerWaalsContact C-N 3.34Å; N882-A885 PolarHBondContact O-N 2.85Å; N882-C886 PolarHBondContact O-N 3.36Å; N882-C886 PolarHBondContact O-SG 2.77Å; N882-C886 VanDerWaalsContact O-SG 3.38Å
883	A	45.1	Very low	47.8	Very low	18 Å²	18	89.6 Å²	89.6	15%	0.149	47%	0.467	C	S	.	.	H	α-helix	trans	-59.4	-45.4	170.1	0	0	0	0	0	111.1	L10 S879 T880 A885 C886 L887	L10-A883 HydrophobicContact CD1-CB 4.35Å; L10-A883 HydrophobicContact CD2-CB 4.24Å; S879-A883 WeakPolarHBondContact O-CB 3.34Å; S879-A883 PolarHBondContact O-N 3.38Å; T880-A883 PolarHBondContact O-N 2.96Å; A883-A885 VanDerWaalsContact C-N 3.32Å; A883-A885 PolarHBondContact O-N 3.19Å; A883-C886 PolarHBondContact O-N 3.43Å; A883-L887 WeakPolarHBondContact O-CB 3.39Å; A883-L887 PolarHBondContact O-N 2.77Å
884	I	44.3	Very low	47.2	Very low	89 Å²	89	92.6 Å²	92.6	46%	0.456	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-32.1	174.3	-70.1	161.4	0	0	0	112.1	T880 I881 N882 L887 I888	T880-I884 WeakPolarHBondContact O-CB 3.4Å; T880-I884 WeakPolarHBondContact O-CD1 3.48Å; T880-I884 WeakPolarHBondContact O-CG1 3.36Å; T880-I884 PolarHBondContact O-N 2.63Å; I881-I884 CarbonylContact O-C 3.56Å; I881-I884 PolarHBondContact O-N 2.88Å; N882-I884 VanDerWaalsContact C-N 3.34Å; I884-L887 HydrophobicContact CG1-CD1 4.42Å; I884-L887 WeakPolarHBondContact O-CB 3.49Å; I884-I888 HydrophobicContact CG2-CD1 4.29Å; I884-I888 WeakPolarHBondContact O-CD1 3.23Å; I884-I888 WeakPolarHBondContact O-CG1 3.29Å; I884-I888 PolarHBondContact O-N 3.09Å
885	A	41.4	Very low	46.6	Very low	43 Å²	43	98.1 Å²	98.1	36%	0.355	51%	0.513	S	S	.	.	H	α-helix	trans	-73.7	-44.5	176.8	0	0	0	0	0	112	I881 N882 A883 L887 I888	I881-A885 WeakPolarHBondContact O-CB 3.44Å; I881-A885 PolarHBondContact O-N 3.28Å; N882-A885 PolarHBondContact O-N 2.85Å; A883-A885 VanDerWaalsContact C-N 3.32Å; A883-A885 PolarHBondContact O-N 3.19Å; A885-L887 PolarHBondContact O-N 3.06Å; A885-I888 PolarHBondContact O-N 2.99Å
886	C	42.8	Very low	45.9	Very low	81 Å²	81	96.5 Å²	96.5	55%	0.547	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-35.2	172.1	-68	0	0	0	0	111.8	N882 A883 I888 I889	N882-C886 PolarHBondContact O-N 3.36Å; N882-C886 PolarHBondContact O-SG 2.77Å; N882-C886 VanDerWaalsContact O-SG 3.38Å; A883-C886 PolarHBondContact O-N 3.43Å; C886-I888 VanDerWaalsContact C-N 3.35Å; C886-I888 PolarHBondContact O-N 2.85Å; C886-I889 PolarHBondContact O-N 3.18Å
887	L	41.7	Very low	45.6	Very low	23 Å²	23	98.4 Å²	98.4	12%	0.12	53%	0.533	C	S	.	.	H	α-helix	trans	-51.6	-50.9	174.6	-144.3	154.3	0	0	0	111.9	L10 L14 A883 I884 A885 I889 P891	L10-L887 HydrophobicContact CB-CD2 3.53Å; L10-L887 HydrophobicContact CD2-CD2 4.04Å; L10-L887 HydrophobicContact CG-CD1 4.21Å; L10-L887 HydrophobicContact CG-CD2 3.62Å; L10-L887 HydrophobicContact CG-CG 4.46Å; L10-L887 WeakPolarHBondContact O-CD2 3.47Å; L14-L887 HydrophobicContact CD1-CB 4.27Å; L14-L887 HydrophobicContact CD1-CD2 3.63Å; L14-L887 HydrophobicContact CD1-CG 3.64Å; L14-L887 WeakPolarHBondContact CD1-O 3.35Å; L14-L887 HydrophobicContact CD2-CG 4.21Å; L14-L887 HydrophobicContact CG-CD2 3.89Å; L14-L887 HydrophobicContact CG-CG 3.74Å; A883-L887 WeakPolarHBondContact O-CB 3.39Å; A883-L887 PolarHBondContact O-N 2.77Å; I884-L887 HydrophobicContact CG1-CD1 4.42Å; I884-L887 WeakPolarHBondContact O-CB 3.49Å; A885-L887 PolarHBondContact O-N 3.06Å; L887-I889 VanDerWaalsContact C-N 3.28Å; L887-I889 PolarHBondContact O-N 2.69Å; L887-P891 WeakPolarHBondContact O-CD 3.49Å
888	I	42	Very low	44.8	Very low	122 Å²	122	100 Å²	100	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-69.2	-23.5	-169.3	-69.3	161.6	0	0	0	112.9	I884 A885 C886	I884-I888 HydrophobicContact CG2-CD1 4.29Å; I884-I888 WeakPolarHBondContact O-CD1 3.23Å; I884-I888 WeakPolarHBondContact O-CG1 3.29Å; I884-I888 PolarHBondContact O-N 3.09Å; A885-I888 PolarHBondContact O-N 2.99Å; C886-I888 VanDerWaalsContact C-N 3.35Å; C886-I888 PolarHBondContact O-N 2.85Å
889	I	46.5	Very low	44.4	Very low	114 Å²	114	100 Å²	100	59%	0.585	55%	0.552	S	S	*	*	H	α-helix	trans	-96.2	-35.5	-166.5	-61.3	173.2	0	0	0	112.8	C886 L887 P891	C886-I889 PolarHBondContact O-N 3.18Å; L887-I889 VanDerWaalsContact C-N 3.28Å; L887-I889 PolarHBondContact O-N 2.69Å; I889-P891 VanDerWaalsContact C-CD 3.48Å
890	M	43	Very low	43.8	Very low	129 Å²	129	99.9 Å²	99.9	64%	0.635	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-62.8	-36.1	-174.2	-76	-64.8	-172.3	0	0	116.8	K892 Y893	M890-K892 PolarHBondContact O-N 3.23Å; M890-Y893 PolarHBondContact O-N 3.23Å; M890-Y893 VanDerWaalsContact O-N 3.15Å
891	P	43.9	Very low	43.6	Very low	86 Å²	86	100.3 Å²	100.3	56%	0.558	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-59.3	-16.3	-174.6	-27.9	36.1	0	0	0	115.5	L14 L887 I889	L14-P891 HydrophobicContact CD1-CG 4.06Å; L887-P891 WeakPolarHBondContact O-CD 3.49Å; I889-P891 VanDerWaalsContact C-CD 3.48Å
892	K	42.4	Very low	43.6	Very low	186 Å²	186	102.8 Å²	102.8	81%	0.809	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-81.8	-12.2	-179.8	-110.7	-175.2	177.1	-175.9	0	115.6	M890	M890-K892 PolarHBondContact O-N 3.23Å
893	Y	44.2	Very low	43.2	Very low	144 Å²	144	104.7 Å²	104.7	57%	0.565	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	-10.4	-172.9	-76.8	-79.1	0	0	0	114.8	M890 Q895 D896	M890-Y893 PolarHBondContact O-N 3.23Å; M890-Y893 VanDerWaalsContact O-N 3.15Å; Y893-Q895 PolarHBondContact O-N 3.3Å; Y893-D896 PolarHBondContact O-N 3.23Å
894	S	42.1	Very low	43	Very low	111 Å²	111	110 Å²	110	78%	0.776	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-2.5	-179.6	-167.9	0	0	0	0	114.6
895	Q	43.6	Very low	42.5	Very low	193 Å²	193	113.6 Å²	113.6	90%	0.902	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-12.4	173.4	-68.4	-174	-14.9	0	0	112.9	Y893	Y893-Q895 PolarHBondContact O-N 3.3Å
896	D	39.1	Very low	42.5	Very low	109 Å²	109	117.1 Å²	117.1	58%	0.583	65%	0.651	S	S	*	*	S	Bend	trans	-89.8	137.4	176.7	-87.9	-46.6	0	0	0	112	Y893 N898	Y893-D896 PolarHBondContact O-N 3.23Å; D896-N898 VanDerWaalsContact C-N 3.26Å; D896-N898 PolarHBondContact O-N 3.41Å
897	S	46.2	Very low	42.5	Very low	113 Å²	113	119 Å²	119	79%	0.79	66%	0.656	S	S	*	*	S	Bend	trans	-75.6	-5.9	-174.2	58	0	0	0	0	115.3
898	N	40.1	Very low	42.6	Very low	137 Å²	137	124.3 Å²	124.3	73%	0.733	69%	0.686	S	S	*	*			trans	-151.2	92.1	-178.5	-71.3	-79.9	0	0	0	112	D896	D896-N898 VanDerWaalsContact C-N 3.26Å; D896-N898 PolarHBondContact O-N 3.41Å
899	P	45.4	Very low	42.6	Very low	84 Å²	84	124.5 Å²	124.5	55%	0.545	69%	0.689	S	S	.	*			trans	-73.5	138.6	170.4	29.7	-33.6	0	0	0	111.3	A901	P899-A901 PolarHBondContact O-N 3.09Å
900	P	37.9	Very low	42.3	Very low	65 Å²	65	125.1 Å²	125.1	42%	0.422	70%	0.696	S	S	.	*			trans	-78.2	123.6	-176.1	30.8	-35.1	0	0	0	112.4	H902 L903	P900-H902 PolarHBondContact O-N 2.89Å; P900-L903 HydrophobicContact CG-CD1 4.24Å; P900-L903 PolarHBondContact O-N 3.09Å
901	A	46.5	Very low	42.3	Very low	82 Å²	82	124.9 Å²	124.9	68%	0.678	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-59.8	-15.1	-171	0	0	0	0	0	116.6	P899 L903 I904	P899-A901 PolarHBondContact O-N 3.09Å; A901-L903 PolarHBondContact O-N 3.35Å; A901-I904 PolarHBondContact O-N 2.88Å
902	H	51	Low	42.2	Very low	142 Å²	142	127.6 Å²	127.6	66%	0.657	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-75.8	-5.8	179.5	79.6	-90.7	0	0	0	114.4	P900	P900-H902 PolarHBondContact O-N 2.89Å
903	L	38	Very low	42.2	Very low	127 Å²	127	123.2 Å²	123.2	67%	0.665	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-105	7.9	178.1	-89.5	155.8	0	0	0	113.1	P900 A901	P900-L903 HydrophobicContact CG-CD1 4.24Å; P900-L903 PolarHBondContact O-N 3.09Å; A901-L903 PolarHBondContact O-N 3.35Å
904	I	41.3	Very low	42	Very low	130 Å²	130	121.4 Å²	121.4	67%	0.667	71%	0.714	S	S	*	*			trans	-108.2	-11.4	-175.1	-62.5	177.2	0	0	0	112.1	A901	A901-I904 PolarHBondContact O-N 2.88Å
905	S	33	Very low	42	Very low	164 Å²	164	122.4 Å²	122.4	100%	1.147	71%	0.708	S	S	*	*			trans	-94.5	0	175.8	65.1	0	0	0	0	112.9

Retrieved 905 of 905 residues in 254.5 ms (Link to these results)

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