A0A087XW23_POEFO Loading...

Zinc finger and AT-hook domain containing

AlphaFold DB , UniProt , Accession A0A087XW23, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,201 aa.

						>A0A087XW23_POEFO|A0A087XW23
MNGEKAAGSVFMCRLCNLFSPSHSQLLAHCSKNHPQYESPDSIITALQPLITEPVEKLLDNPIKRKRGRPKGSTKKLQGDLMDQTTVAAQSAEENLKGKESNNKNNGQQQCGLVKDGESQDGALGRECRICHRTFSNKRQILKHICLRQEDEEDDVQQHGITSGAEEDVGSRGTDSNQTKQKPTRSGLKRQKDTSSSNLTSVNRVCSERGKTTGQKKTLINVVLTEDKILPGVCKMVTVENTSAERESSATQGQHQLLASGGTACENNQTPQEELSSNLKSGTTASTSKGFQEYSIKQDAANLPQSKLKIFACEFCNKIFKFRHSLVAHLRTHTKEKPFQCPHCDYASAIKANLNVHLRKHTGEKFSCDHCAFSCLSPGHLKVHIERVHLKMKQHCSFCEKKYSDVKNLLKHMETRHNLKDSAVLQTYQQLRLKTRQGLRQLLYHCPTCNRRFKNQQERERHLLIHGPQPPFACLLCDHTATKMVALTAHVRKHLFLYVCSVCSKKLVSSQRLRGHLEESHPELDMEQTFINCINISYYLILPEGGGGSEVAGGKEREATFKEGENAGTKVEGNKGPGGDEEELRNDGKQQQEEEQTQSVQMMEEEKGKEDRLSIGGAQKDSQDKSNEEAVEEKLLNSSACVSAADAHAEKNDSSSSPDGVHSSSLKDRTQENTQPDVVNSSAVSSTASSSSSGVSNSSDLPGETQSSSASQVESSQTSPTEKSAFEQVFSSLQKTRLDMETYQRLRKIYGDLECQYCGKLFWYKVHYNVHVRTHTKEHLHYCSKCSYSSITKSSLKRHQIQKHSGLLLPCSSPGCKYSTPDKYKLQAHMRTQHEQESCAVCPICQRTYPQHRLKHHLKSSHPDKVPVGGKGPMVQRAEKCPYCDSYFLKNSSDFQQHIWAHQGLKPYVCSVCSYSSCNRSNLKTHMNRHSSEKHHLCDHCGKKFKSKLTLKSHRLNHTDEGKRFQCSECPFTSVFKPSLLRHMEQHAKFKPFRCAHCHYSCNIAGALKRHFNIKHPEETYENAGLGLPNSETLKQQGGMKCPECEFVYGTKWELTRHLKTKHNLKVVEGNWEVAEEAEAQYVSVENEEHLTEAPLAVLEDNGNVQQIAELSSETHNAVASVVAMAPGTVTVVQQVQVAQDHEVGDCSNQLMVVNADEGLDGNQVMVVEDGHGLDALTVLTQGENTHHYIVYIQEQTVEIN
					

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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	29.3	Very low	46.2	Very low	234 Å²	234	112.8 Å²	112.8	100%	1.153	67%	0.674	S	S	*	*				0	151.4	0	-64.5	-47.3	-174.4	0	0	108.7
2	N	32.8	Very low	49	Very low	168 Å²	168	106.4 Å²	106.4	90%	0.898	63%	0.632	S	S	*	*			trans	-96.7	159	-150.5	-56.2	-11.4	0	0	0	113.2
3	G	30.1	Very low	51.3	Low	76 Å²	76	98.2 Å²	98.2	78%	0.784	58%	0.584	S	S	*	*			trans	-178.4	107.6	176.7	0	0	0	0	0	109.6
4	E	32.9	Very low	52.8	Low	196 Å²	196	102 Å²	102	92%	0.916	58%	0.583	S	S	*	*			trans	-78.7	161.6	-158.4	-64.8	161.9	127.6	0	0	115	A6	E4-A6 PolarHBondContact O-N 3.47Å
5	K	42.7	Very low	53.9	Low	211 Å²	211	100.8 Å²	100.8	92%	0.917	57%	0.573	S	S	*	*			trans	-81.4	111.6	173.8	-68	173	-177.9	166	0	110.8
6	A	36.1	Very low	55.3	Low	101 Å²	101	97.6 Å²	97.6	84%	0.835	56%	0.558	S	S	*	*			trans	-76.6	130.6	158	0	0	0	0	0	110.1	E4	E4-A6 PolarHBondContact O-N 3.47Å
7	A	44	Very low	56.4	Low	53 Å²	53	98 Å²	98	44%	0.438	56%	0.558	S	S	.	*			trans	-72.9	128.7	179.4	0	0	0	0	0	111.5	S9 P49 I51	A7-S9 PolarHBondContact O-N 3.4Å; A7-P49 HydrophobicContact CB-CG 4.14Å; A7-I51 HydrophobicContact CB-CD1 4.19Å
8	G	49.3	Very low	57.5	Low	66 Å²	66	97.1 Å²	97.1	68%	0.68	55%	0.551	S	S	*	*			trans	-67.8	92.6	-179.2	0	0	0	0	0	112.8
9	S	59.8	Low	58.8	Low	36 Å²	36	97.8 Å²	97.8	25%	0.252	55%	0.548	S	S	.	.			trans	-70.4	132.6	170.6	-61.9	0	0	0	0	109.9	A7 F11	A7-S9 PolarHBondContact O-N 3.4Å; S9-F11 WeakPolarHBondContact O-CE2 3.38Å
10	V	71.8	Confident	59.4	Low	58 Å²	58	93.7 Å²	93.7	35%	0.352	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.4	180	-178.4	0	0	0	0	109.1	F19 L47	V10-F19 HydrophobicContact CG1-CB 4.39Å; V10-F19 HydrophobicContact CG1-CD1 4.24Å; V10-L47 PolarHBondContact N-O 3.29Å; V10-L47 VanDerWaalsContact N-O 3.15Å; V10-L47 WeakPolarHBondContact O-CB 3.46Å; V10-L47 PolarHBondContact O-N 2.86Å
11	F	78.8	Confident	60	Low	42 Å²	42	94.4 Å²	94.4	18%	0.184	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	144.7	-175	-56.9	-90.7	0	0	0	111.1	S9 F19 S20 H23 L26 I44 T45 A46	S9-F11 WeakPolarHBondContact O-CE2 3.38Å; F11-F19 CarbonylContact O-C 3.56Å; F11-F19 VanDerWaalsContact O-CA 3.28Å; F11-F19 WeakPolarHBondContact O-CA 3.3Å; F11-S20 PolarHBondContact N-O 3.43Å; F11-S20 PolarHBondContact O-N 3.28Å; F11-H23 HydrophobicContact CD1-CB 4.13Å; F11-H23 AromaticContact CD1-CD2 3.3Å; F11-H23 WeakPolarHBondContact CD1-CD2 3.47Å; F11-H23 HydrophobicContact CD2-CB 4.06Å; F11-H23 HydrophobicContact CE1-CB 4.05Å; F11-H23 AromaticContact CE1-CD2 3.71Å; F11-H23 HydrophobicContact CE2-CB 4.02Å; F11-H23 HydrophobicContact CG-CB 4.12Å; F11-H23 AromaticContact CG-CD2 3.77Å; F11-H23 HydrophobicContact CZ-CB 4.01Å; F11-L26 HydrophobicContact CB-CD2 3.82Å; F11-L26 WeakPolarHBondContact O-CD2 3.4Å; F11-I44 HydrophobicContact CB-CG2 3.9Å; F11-I44 HydrophobicContact CD1-CG2 4.38Å; F11-T45 CarbonylContact C-O 3.39Å; F11-T45 WeakPolarHBondContact CA-O 3.2Å; F11-A46 HydrophobicContact CD1-CB 3.72Å; F11-A46 HydrophobicContact CE1-CB 3.58Å
12	M	80.1	Confident	62.2	Low	36 Å²	36	84.8 Å²	84.8	18%	0.177	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.1	-179.1	-169.1	-154.7	-32.8	0	0	110.9	L18 F19 I44 T45 L47	M12-L18 WeakPolarHBondContact CA-O 3.34Å; M12-F19 HydrophobicContact CB-CD1 3.93Å; M12-F19 HydrophobicContact CB-CE1 3.87Å; M12-F19 HydrophobicContact CB-CG 4.49Å; M12-F19 HydrophobicContact CB-CZ 4.37Å; M12-F19 HydrophobicContact CE-CE1 3.71Å; M12-F19 HydrophobicContact CE-CZ 3.76Å; M12-F19 HydrophobicContact CG-CD1 3.94Å; M12-F19 HydrophobicContact CG-CD2 4.21Å; M12-F19 HydrophobicContact CG-CE1 3.64Å; M12-F19 HydrophobicContact CG-CE2 3.91Å; M12-F19 HydrophobicContact CG-CG 4.22Å; M12-F19 HydrophobicContact CG-CZ 3.62Å; M12-F19 HydrophobicContact SD-CE1 4.07Å; M12-F19 HydrophobicContact SD-CE2 4.27Å; M12-F19 HydrophobicContact SD-CZ 3.7Å; M12-I44 CarbonylContact O-C 3.45Å; M12-I44 WeakPolarHBondContact O-CA 3.4Å; M12-T45 PolarHBondContact N-O 3.01Å; M12-T45 PolarHBondContact O-N 2.84Å; M12-L47 HydrophobicContact CE-CD1 3.99Å; M12-L47 HydrophobicContact CE-CD2 4.47Å; M12-L47 HydrophobicContact CE-CG 4.47Å
13	C	79.6	Confident	64.2	Low	0 Å²	0	79.6 Å²	79.6	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122	168.7	170.1	0	0	0	0	109.8	L15 C16 N17 L18 L26 I43	C13-L15 VanDerWaalsContact C-N 3.29Å; C13-L15 PolarHBondContact O-N 3.25Å; C13-C16 PolarHBondContact SG-SG 3.26Å; C13-N17 WeakPolarHBondContact O-CA 3.45Å; C13-N17 PolarHBondContact O-N 2.75Å; C13-L18 PolarHBondContact N-O 3.43Å; C13-L26 HydrophobicContact CB-CD1 4.06Å; C13-L26 HydrophobicContact CB-CD2 4.47Å; C13-L26 HydrophobicContact CB-CG 4.23Å; C13-I43 VanDerWaalsContact SG-CG2 3.53Å
14	R	71.6	Confident	66.4	Low	151 Å²	151	79.9 Å²	79.9	57%	0.57	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.4	-177.8	-69.6	174.7	-178.4	164.5	3.7	114.4	S42 I43 T45	R14-S42 PolarHBondContact NH1-O 3.33Å; R14-I43 WeakPolarHBondContact CB-O 3.4Å; R14-I43 VanDerWaalsContact CG-O 3.31Å; R14-I43 WeakPolarHBondContact CG-O 3.46Å; R14-I43 PolarHBondContact N-O 3.32Å; R14-T45 PolarHBondContact NE-OG1 3.23Å; R14-T45 PolarHBondContact NH2-OG1 3.36Å
15	L	70	Confident	68.3	Low	84 Å²	84	76.7 Å²	76.7	44%	0.44	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-36.5	-175.5	-65.3	178.1	0	0	0	113	C13 H34 Y37 I43	C13-L15 VanDerWaalsContact C-N 3.29Å; C13-L15 PolarHBondContact O-N 3.25Å; L15-H34 HydrophobicContact CD1-CB 4.03Å; L15-Y37 HydrophobicContact CD1-CD2 4.15Å; L15-Y37 HydrophobicContact CD1-CE2 4.21Å; L15-I43 HydrophobicContact CB-CG2 4.45Å; L15-I43 HydrophobicContact CD1-CD1 3.97Å; L15-I43 HydrophobicContact CD1-CG1 4.32Å; L15-I43 HydrophobicContact CD1-CG2 3.97Å; L15-I43 HydrophobicContact CG-CG2 3.89Å
16	C	75.7	Confident	69.9	Low	50 Å²	50	66.8 Å²	66.8	34%	0.338	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-6.1	-177.9	66.5	0	0	0	0	114.3	C13 L18 H29	C13-C16 PolarHBondContact SG-SG 3.26Å; C16-L18 PolarHBondContact O-N 3.01Å; C16-L18 WeakPolarHBondContact SG-CB 3.32Å; C16-H29 PolarHBondContact SG-NE2 3.48Å
17	N	74.5	Confident	71.8	Confident	104 Å²	104	63.9 Å²	63.9	56%	0.556	36%	0.362	S	S	*	.			trans	54.8	27.6	-173.7	-60.9	-72.4	0	0	0	114.1	C13 F19	C13-N17 WeakPolarHBondContact O-CA 3.45Å; C13-N17 PolarHBondContact O-N 2.75Å; N17-F19 WeakPolarHBondContact O-CD2 3.38Å; N17-F19 WeakPolarHBondContact O-CE2 3.28Å
18	L	76.4	Confident	73.4	Confident	81 Å²	81	63.5 Å²	63.5	42%	0.424	36%	0.359	S	S	.	.			trans	-76.6	131.4	171.1	-174.1	64.5	0	0	0	109.7	M12 C13 C16 L26	M12-L18 WeakPolarHBondContact CA-O 3.34Å; C13-L18 PolarHBondContact N-O 3.43Å; C16-L18 PolarHBondContact O-N 3.01Å; C16-L18 WeakPolarHBondContact SG-CB 3.32Å; L18-L26 HydrophobicContact CB-CD1 4.19Å; L18-L26 HydrophobicContact CD2-CD1 4.01Å; L18-L26 HydrophobicContact CG-CD1 4.08Å
19	F	80.7	Confident	74.7	Confident	112 Å²	112	62.8 Å²	62.8	49%	0.491	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.9	177.4	-67.4	-102.5	0	0	0	110.5	V10 F11 M12 N17 L47	V10-F19 HydrophobicContact CG1-CB 4.39Å; V10-F19 HydrophobicContact CG1-CD1 4.24Å; F11-F19 CarbonylContact O-C 3.56Å; F11-F19 VanDerWaalsContact O-CA 3.28Å; F11-F19 WeakPolarHBondContact O-CA 3.3Å; M12-F19 HydrophobicContact CB-CD1 3.93Å; M12-F19 HydrophobicContact CB-CE1 3.87Å; M12-F19 HydrophobicContact CB-CG 4.49Å; M12-F19 HydrophobicContact CB-CZ 4.37Å; M12-F19 HydrophobicContact CE-CE1 3.71Å; M12-F19 HydrophobicContact CE-CZ 3.76Å; M12-F19 HydrophobicContact CG-CD1 3.94Å; M12-F19 HydrophobicContact CG-CD2 4.21Å; M12-F19 HydrophobicContact CG-CE1 3.64Å; M12-F19 HydrophobicContact CG-CE2 3.91Å; M12-F19 HydrophobicContact CG-CG 4.22Å; M12-F19 HydrophobicContact CG-CZ 3.62Å; M12-F19 HydrophobicContact SD-CE1 4.07Å; M12-F19 HydrophobicContact SD-CE2 4.27Å; M12-F19 HydrophobicContact SD-CZ 3.7Å; N17-F19 WeakPolarHBondContact O-CD2 3.38Å; N17-F19 WeakPolarHBondContact O-CE2 3.28Å; F19-L47 HydrophobicContact CE1-CD1 3.95Å
20	S	72.1	Confident	75.2	Confident	14 Å²	14	61.1 Å²	61.1	10%	0.098	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	141.9	172.3	-176.5	0	0	0	0	111.4	F11 S22	F11-S20 PolarHBondContact N-O 3.43Å; F11-S20 PolarHBondContact O-N 3.28Å; S20-S22 PolarHBondContact O-N 2.92Å; S20-S22 PolarHBondContact OG-N 3.24Å; S20-S22 PolarHBondContact OG-O 3.32Å
21	P	71.9	Confident	75.2	Confident	109 Å²	109	61.5 Å²	61.5	71%	0.708	33%	0.332	S	S	*	.	S	Bend	trans	-65.7	-15.4	165.5	-18	32.1	0	0	0	113.5
22	S	74.5	Confident	75.1	Confident	33 Å²	33	67.7 Å²	67.7	23%	0.231	36%	0.358	C	S	.	.			trans	-113.5	118	-177.7	176	0	0	0	0	111.8	S20 S24 L26	S20-S22 PolarHBondContact O-N 2.92Å; S20-S22 PolarHBondContact OG-N 3.24Å; S20-S22 PolarHBondContact OG-O 3.32Å; S22-S24 PolarHBondContact OG-OG 2.89Å; S22-L26 PolarHBondContact O-N 3.2Å
23	H	75.3	Confident	74.6	Confident	58 Å²	58	70.5 Å²	70.5	27%	0.269	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-43	176.9	-164.8	-117.2	0	0	0	112.2	F11 Q25 L26 L27 D41 I44	F11-H23 HydrophobicContact CD1-CB 4.13Å; F11-H23 AromaticContact CD1-CD2 3.3Å; F11-H23 WeakPolarHBondContact CD1-CD2 3.47Å; F11-H23 HydrophobicContact CD2-CB 4.06Å; F11-H23 HydrophobicContact CE1-CB 4.05Å; F11-H23 AromaticContact CE1-CD2 3.71Å; F11-H23 HydrophobicContact CE2-CB 4.02Å; F11-H23 HydrophobicContact CG-CB 4.12Å; F11-H23 AromaticContact CG-CD2 3.77Å; F11-H23 HydrophobicContact CZ-CB 4.01Å; H23-Q25 PolarHBondContact O-N 2.81Å; H23-L26 CarbonylContact O-C 3.54Å; H23-L26 PolarHBondContact O-N 3.5Å; H23-L26 VanDerWaalsContact O-N 3.11Å; H23-L27 PolarHBondContact O-N 3.08Å; H23-D41 IonicContact CE1-OD1 2.71Å; H23-D41 PolarHBondContact CE1-OD1 3.01Å; H23-I44 VanDerWaalsContact CD2-CG2 3.47Å; H23-I44 WeakPolarHBondContact CD2-CG2 3.45Å; H23-I44 WeakPolarHBondContact NE2-CG2 3.35Å
24	S	75.9	Confident	74.3	Confident	82 Å²	82	72.7 Å²	72.7	57%	0.573	38%	0.384	S	S	*	.	H	α-helix	trans	-66.9	-36.1	-176.8	55.9	0	0	0	0	113.1	S22 L26 A28	S22-S24 PolarHBondContact OG-OG 2.89Å; S24-L26 VanDerWaalsContact C-N 3.31Å; S24-L26 PolarHBondContact O-N 3.45Å; S24-A28 WeakPolarHBondContact O-CB 3.43Å; S24-A28 PolarHBondContact O-N 2.87Å
25	Q	74.4	Confident	73.8	Confident	130 Å²	130	70.1 Å²	70.1	61%	0.607	39%	0.387	S	S	*	.	H	α-helix	trans	-65	-36.9	172.3	-69.8	177.3	-7.3	0	0	111.7	H23 A28 H29	H23-Q25 PolarHBondContact O-N 2.81Å; Q25-A28 PolarHBondContact O-N 2.83Å; Q25-H29 PolarHBondContact O-N 3.11Å
26	L	76	Confident	73.3	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.01	41%	0.405	C	S	.	.	H	α-helix	trans	-77.6	-33.6	-179.4	-160.6	57.6	0	0	0	112	F11 C13 L18 S22 H23 S24 H29 C30 I44	F11-L26 HydrophobicContact CB-CD2 3.82Å; F11-L26 WeakPolarHBondContact O-CD2 3.4Å; C13-L26 HydrophobicContact CB-CD1 4.06Å; C13-L26 HydrophobicContact CB-CD2 4.47Å; C13-L26 HydrophobicContact CB-CG 4.23Å; L18-L26 HydrophobicContact CB-CD1 4.19Å; L18-L26 HydrophobicContact CD2-CD1 4.01Å; L18-L26 HydrophobicContact CG-CD1 4.08Å; S22-L26 PolarHBondContact O-N 3.2Å; H23-L26 CarbonylContact O-C 3.54Å; H23-L26 PolarHBondContact O-N 3.5Å; H23-L26 VanDerWaalsContact O-N 3.11Å; S24-L26 VanDerWaalsContact C-N 3.31Å; S24-L26 PolarHBondContact O-N 3.45Å; L26-H29 WeakPolarHBondContact O-CB 3.36Å; L26-H29 PolarHBondContact O-N 2.98Å; L26-C30 PolarHBondContact O-N 3.36Å; L26-C30 PolarHBondContact O-SG 3.34Å; L26-I44 HydrophobicContact CB-CD1 4.1Å; L26-I44 HydrophobicContact CD2-CG2 3.91Å; L26-I44 HydrophobicContact CG-CD1 4.1Å; L26-I44 HydrophobicContact CG-CG1 4.37Å
27	L	74.4	Confident	72.6	Confident	40 Å²	40	78.7 Å²	78.7	21%	0.209	42%	0.415	C	S	.	.	H	α-helix	trans	-60.4	-47.8	166.7	-79.4	171.8	0	0	0	111.3	H23 H29 C30 S31 P40 I44	H23-L27 PolarHBondContact O-N 3.08Å; L27-H29 PolarHBondContact O-N 2.85Å; L27-C30 PolarHBondContact O-N 3.32Å; L27-C30 VanDerWaalsContact O-N 3.08Å; L27-S31 PolarHBondContact O-N 3.24Å; L27-S31 PolarHBondContact O-OG 3.13Å; L27-P40 HydrophobicContact CD2-CB 3.79Å; L27-P40 HydrophobicContact CD2-CG 4.06Å; L27-I44 HydrophobicContact CB-CD1 4.31Å; L27-I44 HydrophobicContact CD2-CD1 3.63Å; L27-I44 HydrophobicContact CG-CD1 3.72Å
28	A	78	Confident	71.7	Confident	45 Å²	45	83.6 Å²	83.6	37%	0.372	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-27.1	176.9	0	0	0	0	0	113.2	S24 Q25 K32	S24-A28 WeakPolarHBondContact O-CB 3.43Å; S24-A28 PolarHBondContact O-N 2.87Å; Q25-A28 PolarHBondContact O-N 2.83Å; A28-K32 WeakPolarHBondContact O-CB 3.28Å; A28-K32 WeakPolarHBondContact O-CG 3.41Å
29	H	77.4	Confident	70.7	Confident	51 Å²	51	82.7 Å²	82.7	24%	0.236	44%	0.435	C	S	.	.	H	α-helix	trans	-70.9	-46.5	168.3	172.9	79.4	0	0	0	111.5	C16 Q25 L26 L27 K32 N33	C16-H29 PolarHBondContact SG-NE2 3.48Å; Q25-H29 PolarHBondContact O-N 3.11Å; L26-H29 WeakPolarHBondContact O-CB 3.36Å; L26-H29 PolarHBondContact O-N 2.98Å; L27-H29 PolarHBondContact O-N 2.85Å; H29-K32 PolarHBondContact O-N 3.15Å; H29-N33 PolarHBondContact ND1-ND2 2.8Å; H29-N33 WeakPolarHBondContact O-CB 3.39Å; H29-N33 PolarHBondContact O-N 2.92Å; H29-N33 PolarHBondContact O-ND2 3.32Å
30	C	69.8	Low	69.6	Low	1 Å²	1	79.6 Å²	79.6	1%	0.007	43%	0.426	C	S	.	.	H	α-helix	trans	-65.5	-44.5	-179.2	-64.5	0	0	0	0	112.3	L26 L27 K32 N33 H34	L26-C30 PolarHBondContact O-N 3.36Å; L26-C30 PolarHBondContact O-SG 3.34Å; L27-C30 PolarHBondContact O-N 3.32Å; L27-C30 VanDerWaalsContact O-N 3.08Å; C30-K32 VanDerWaalsContact C-N 3.32Å; C30-K32 PolarHBondContact O-N 3.39Å; C30-N33 PolarHBondContact O-N 3.46Å; C30-H34 CarbonylContact O-C 3.6Å; C30-H34 VanDerWaalsContact O-CA 3.28Å; C30-H34 WeakPolarHBondContact O-CA 3.41Å; C30-H34 WeakPolarHBondContact O-CB 3.31Å; C30-H34 PolarHBondContact O-N 2.91Å
31	S	72	Confident	69	Low	66 Å²	66	83.6 Å²	83.6	46%	0.462	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-32.8	179.1	61.9	0	0	0	0	113.2	L27	L27-S31 PolarHBondContact O-N 3.24Å; L27-S31 PolarHBondContact O-OG 3.13Å
32	K	76.6	Confident	68.5	Low	172 Å²	172	81.5 Å²	81.5	75%	0.748	43%	0.434	S	S	*	.	H	α-helix	trans	-80.3	-34.7	177.5	-71.5	-176.3	177.6	-172.5	0	114.3	A28 H29 C30	A28-K32 WeakPolarHBondContact O-CB 3.28Å; A28-K32 WeakPolarHBondContact O-CG 3.41Å; H29-K32 PolarHBondContact O-N 3.15Å; C30-K32 VanDerWaalsContact C-N 3.32Å; C30-K32 PolarHBondContact O-N 3.39Å
33	N	70	Confident	68.1	Low	96 Å²	96	80.4 Å²	80.4	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-108.1	-17	-171.5	-60.9	-85.7	0	0	0	113.8	H29 C30	H29-N33 PolarHBondContact ND1-ND2 2.8Å; H29-N33 WeakPolarHBondContact O-CB 3.39Å; H29-N33 PolarHBondContact O-N 2.92Å; H29-N33 PolarHBondContact O-ND2 3.32Å; C30-N33 PolarHBondContact O-N 3.46Å
34	H	72.7	Confident	68.1	Low	45 Å²	45	78.2 Å²	78.2	21%	0.208	42%	0.416	C	S	.	.			trans	-130.5	46.4	179.7	-52.3	-32.9	0	0	0	112.6	L15 C30 Q36	L15-H34 HydrophobicContact CD1-CB 4.03Å; C30-H34 CarbonylContact O-C 3.6Å; C30-H34 VanDerWaalsContact O-CA 3.28Å; C30-H34 WeakPolarHBondContact O-CA 3.41Å; C30-H34 WeakPolarHBondContact O-CB 3.31Å; C30-H34 PolarHBondContact O-N 2.91Å; H34-Q36 PolarHBondContact O-N 2.8Å
35	P	60.7	Low	68	Low	97 Å²	97	76 Å²	76	63%	0.63	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	3.5	-175.7	31.5	-38.7	0	0	0	115
36	Q	61	Low	67.7	Low	173 Å²	173	72.4 Å²	72.4	81%	0.808	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	6.3	-174.5	-56	179	19.2	0	0	113.2	H34	H34-Q36 PolarHBondContact O-N 2.8Å
37	Y	59.3	Low	67.2	Low	142 Å²	142	76.2 Å²	76.2	56%	0.557	41%	0.411	S	S	*	.	S	Bend	trans	-129.5	118.2	-179	-71.2	-90.5	0	0	0	109.5	L15 S39 I43	L15-Y37 HydrophobicContact CD1-CD2 4.15Å; L15-Y37 HydrophobicContact CD1-CE2 4.21Å; Y37-S39 PolarHBondContact O-N 2.88Å; Y37-I43 HydrophobicContact CG-CD1 4.48Å
38	E	55.7	Low	66.3	Low	207 Å²	207	82 Å²	82	97%	0.967	44%	0.438	S	S	*	.	S	Bend	trans	-74.3	5.6	-160.8	-59.8	179.6	131	0	0	116
39	S	56.1	Low	65	Low	61 Å²	61	83 Å²	83	43%	0.427	44%	0.44	S	S	.	.			trans	-144.8	106.4	170.6	55.2	0	0	0	0	112	Y37 D41 S42	Y37-S39 PolarHBondContact O-N 2.88Å; S39-D41 VanDerWaalsContact C-N 3.32Å; S39-D41 PolarHBondContact O-N 3.04Å; S39-S42 PolarHBondContact O-N 3.5Å; S39-S42 PolarHBondContact O-OG 2.87Å; S39-S42 PolarHBondContact OG-OG 2.88Å
40	P	57.7	Low	63.1	Low	47 Å²	47	89.3 Å²	89.3	31%	0.305	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-70.4	-25.1	-173.5	28.8	-35.6	0	0	0	113.5	L27 S42 I43	L27-P40 HydrophobicContact CD2-CB 3.79Å; L27-P40 HydrophobicContact CD2-CG 4.06Å; P40-S42 VanDerWaalsContact C-N 3.3Å; P40-S42 PolarHBondContact O-N 2.9Å; P40-I43 PolarHBondContact O-N 3.43Å
41	D	58.7	Low	61.7	Low	99 Å²	99	94.7 Å²	94.7	53%	0.529	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-67.2	-27.4	175.5	-63.8	-68.9	0	0	0	113.2	H23 S39 I43 I44	H23-D41 IonicContact CE1-OD1 2.71Å; H23-D41 PolarHBondContact CE1-OD1 3.01Å; S39-D41 VanDerWaalsContact C-N 3.32Å; S39-D41 PolarHBondContact O-N 3.04Å; D41-I43 PolarHBondContact O-N 3.33Å; D41-I44 PolarHBondContact O-N 2.97Å
42	S	61.6	Low	59.7	Low	64 Å²	64	98.1 Å²	98.1	45%	0.448	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-68	-20.6	178.5	72.5	0	0	0	0	113.5	R14 S39 P40	R14-S42 PolarHBondContact NH1-O 3.33Å; S39-S42 PolarHBondContact O-N 3.5Å; S39-S42 PolarHBondContact O-OG 2.87Å; S39-S42 PolarHBondContact OG-OG 2.88Å; P40-S42 VanDerWaalsContact C-N 3.3Å; P40-S42 PolarHBondContact O-N 2.9Å
43	I	67.3	Low	57.6	Low	10 Å²	10	98.1 Å²	98.1	5%	0.051	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-88.6	-24.5	-174.8	-62.7	168.3	0	0	0	111.4	C13 R14 L15 Y37 P40 D41	C13-I43 VanDerWaalsContact SG-CG2 3.53Å; R14-I43 WeakPolarHBondContact CB-O 3.4Å; R14-I43 VanDerWaalsContact CG-O 3.31Å; R14-I43 WeakPolarHBondContact CG-O 3.46Å; R14-I43 PolarHBondContact N-O 3.32Å; L15-I43 HydrophobicContact CB-CG2 4.45Å; L15-I43 HydrophobicContact CD1-CD1 3.97Å; L15-I43 HydrophobicContact CD1-CG1 4.32Å; L15-I43 HydrophobicContact CD1-CG2 3.97Å; L15-I43 HydrophobicContact CG-CG2 3.89Å; Y37-I43 HydrophobicContact CG-CD1 4.48Å; P40-I43 PolarHBondContact O-N 3.43Å; D41-I43 PolarHBondContact O-N 3.33Å
44	I	74.3	Confident	56.3	Low	12 Å²	12	98.5 Å²	98.5	6%	0.062	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	144.7	-174.1	-57.6	173.7	0	0	0	110.2	F11 M12 H23 L26 L27 D41	F11-I44 HydrophobicContact CB-CG2 3.9Å; F11-I44 HydrophobicContact CD1-CG2 4.38Å; M12-I44 CarbonylContact O-C 3.45Å; M12-I44 WeakPolarHBondContact O-CA 3.4Å; H23-I44 VanDerWaalsContact CD2-CG2 3.47Å; H23-I44 WeakPolarHBondContact CD2-CG2 3.45Å; H23-I44 WeakPolarHBondContact NE2-CG2 3.35Å; L26-I44 HydrophobicContact CB-CD1 4.1Å; L26-I44 HydrophobicContact CD2-CG2 3.91Å; L26-I44 HydrophobicContact CG-CD1 4.1Å; L26-I44 HydrophobicContact CG-CG1 4.37Å; L27-I44 HydrophobicContact CB-CD1 4.31Å; L27-I44 HydrophobicContact CD2-CD1 3.63Å; L27-I44 HydrophobicContact CG-CD1 3.72Å; D41-I44 PolarHBondContact O-N 2.97Å
45	T	74.2	Confident	54.3	Low	35 Å²	35	103.4 Å²	103.4	22%	0.215	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.3	126.1	177.8	-55.6	0	0	0	0	110.3	F11 M12 R14	F11-T45 CarbonylContact C-O 3.39Å; F11-T45 WeakPolarHBondContact CA-O 3.2Å; M12-T45 PolarHBondContact N-O 3.01Å; M12-T45 PolarHBondContact O-N 2.84Å; R14-T45 PolarHBondContact NE-OG1 3.23Å; R14-T45 PolarHBondContact NH2-OG1 3.36Å
46	A	69.1	Low	52.9	Low	55 Å²	55	106.9 Å²	106.9	46%	0.455	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.6	133.6	168.6	0	0	0	0	0	110.4	F11	F11-A46 HydrophobicContact CD1-CB 3.72Å; F11-A46 HydrophobicContact CE1-CB 3.58Å
47	L	64.8	Low	51.5	Low	82 Å²	82	107.8 Å²	107.8	43%	0.429	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.6	119.2	166.9	-60.4	-178.3	0	0	0	108.8	V10 M12 F19	V10-L47 PolarHBondContact N-O 3.29Å; V10-L47 VanDerWaalsContact N-O 3.15Å; V10-L47 WeakPolarHBondContact O-CB 3.46Å; V10-L47 PolarHBondContact O-N 2.86Å; M12-L47 HydrophobicContact CE-CD1 3.99Å; M12-L47 HydrophobicContact CE-CD2 4.47Å; M12-L47 HydrophobicContact CE-CG 4.47Å; F19-L47 HydrophobicContact CE1-CD1 3.95Å
48	Q	55.6	Low	50.1	Low	163 Å²	163	108.3 Å²	108.3	76%	0.762	58%	0.584	S	S	*	*			trans	-104.1	132.4	-174.8	-164.5	174.9	13.8	0	0	110.3
49	P	49.7	Very low	48.9	Very low	65 Å²	65	105.2 Å²	105.2	42%	0.422	57%	0.573	S	S	.	*			trans	-75	143.8	174.3	30.9	-33.8	0	0	0	111.2	A7	A7-P49 HydrophobicContact CB-CG 4.14Å
50	L	38.2	Very low	47.5	Very low	183 Å²	183	109.1 Å²	109.1	96%	0.958	59%	0.59	S	S	*	*			trans	-72.1	129.1	172	-71.1	167.9	0	0	0	110.1
51	I	40.1	Very low	46	Very low	114 Å²	114	114.3 Å²	114.3	59%	0.585	62%	0.615	S	S	*	*			trans	-109.4	146.9	179.4	-59.7	173.2	0	0	0	109	A7 E53	A7-I51 HydrophobicContact CB-CD1 4.19Å; I51-E53 HydrophobicContact CG2-CG 4.33Å
52	T	31.6	Very low	45.7	Very low	138 Å²	138	114.6 Å²	114.6	85%	0.847	62%	0.622	S	S	*	*			trans	-132.2	123	167.5	50.1	0	0	0	0	109.1
53	E	32.5	Very low	44	Very low	172 Å²	172	115.2 Å²	115.2	80%	0.804	62%	0.62	S	S	*	*			trans	-101.6	162.6	-179.8	-82.2	-71.2	124.1	0	0	111.9	I51	I51-E53 HydrophobicContact CG2-CG 4.33Å
54	P	41.7	Very low	42.2	Very low	104 Å²	104	121.2 Å²	121.2	68%	0.675	65%	0.645	S	S	*	*			trans	-110.1	164.3	-159.7	40.7	-34.1	0	0	0	115.8
55	V	29.7	Very low	40	Very low	148 Å²	148	130 Å²	130	90%	0.897	68%	0.678	S	S	*	*			trans	-140.1	138.6	157.4	-179.9	0	0	0	0	108.4
56	E	33.3	Very low	37.8	Very low	171 Å²	171	136.5 Å²	136.5	80%	0.799	70%	0.703	S	S	*	*			trans	-106.8	169.2	176.4	-69.7	-168.8	135.3	0	0	112.7
57	K	30.3	Very low	35.7	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.835	73%	0.726	S	S	*	*			trans	84.5	132.1	172.5	-52.5	174.6	-175.8	177.1	0	116.4
58	L	30	Very low	33.8	Very low	153 Å²	153	145.2 Å²	145.2	80%	0.801	74%	0.742	S	S	*	*			cis	-165	153.3	-24.2	-124.4	169.3	0	0	0	108.8
59	L	29.8	Very low	32.6	Very low	141 Å²	141	147.5 Å²	147.5	74%	0.738	74%	0.743	S	S	*	*			trans	75.4	152	164.7	-82.2	152.6	0	0	0	121
60	D	27	Very low	32.3	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	76%	0.759	S	S	*	*			trans	70.3	144.3	166.2	-56	-27.9	0	0	0	122.8
61	N	26.2	Very low	32	Very low	157 Å²	157	149.3 Å²	149.3	84%	0.84	75%	0.748	S	S	*	*			trans	-100.4	-169.3	-174.7	-62.6	-63	0	0	0	110.7
62	P	52.1	Low	31.4	Very low	105 Å²	105	147.5 Å²	147.5	68%	0.682	76%	0.758	S	S	*	*				-122	174.7	-95.3	35.2	-17.6	0	0	0	113.2
63	I	27.1	Very low	31.3	Very low	76 Å²	76	146.3 Å²	146.3	39%	0.39	76%	0.755	S	S	.	*			trans	164.7	128.1	130.7	-86.9	163.4	0	0	0	115.4	D154 D155	I63-D154 WeakPolarHBondContact CD1-O 3.48Å; I63-D155 WeakPolarHBondContact CD1-OD2 3.4Å
64	K	28.6	Very low	31.3	Very low	137 Å²	137	144.3 Å²	144.3	60%	0.596	76%	0.755	S	S	*	*			trans	10.6	124.3	148.6	-37.4	156.2	-168	155.9	0	119.3
65	R	27.7	Very low	30.7	Very low	197 Å²	197	148.2 Å²	148.2	74%	0.743	76%	0.761	S	S	*	*				164.7	146.5	108.3	-91.9	160.8	172.9	144.6	-0.6	119.6
66	K	28.1	Very low	30.8	Very low	171 Å²	171	149.9 Å²	149.9	74%	0.743	76%	0.757	S	S	*	*			trans	86.9	134.6	137.5	-80.1	165	-176.3	171.9	0	123.9
67	R	25.8	Very low	30.4	Very low	246 Å²	246	149 Å²	149	93%	0.928	76%	0.756	S	S	*	*			trans	74.2	151.7	156.4	-61.2	164.9	-176.2	-143.2	3	118.8
68	G	25	Very low	30.4	Very low	74 Å²	74	147 Å²	147	76%	0.763	75%	0.75	S	S	*	*			cis	156.4	124.3	-23.8	0	0	0	0	0	119.3
69	R	31.2	Very low	30.4	Very low	210 Å²	210	142.9 Å²	142.9	79%	0.792	75%	0.745	S	S	*	*			trans	70.9	174.5	166	-117.4	-171.3	167.7	162.9	-0.3	117.2
70	P	42.4	Very low	30.5	Very low	116 Å²	116	141.5 Å²	141.5	75%	0.753	74%	0.738	S	S	*	*			cis	-100.5	163.2	24.4	1.1	23.6	0	0	0	115.9
71	K	32.7	Very low	30.8	Very low	170 Å²	170	140.8 Å²	140.8	74%	0.739	73%	0.733	S	S	*	*				68.9	135.4	67.6	-61.3	-174.9	178.4	177.3	0	114.4
72	G	26.6	Very low	31.1	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	73%	0.727	S	S	*	*			cis	-157	-151.2	0.7	0	0	0	0	0	110.7
73	S	29.9	Very low	30	Very low	112 Å²	112	141 Å²	141	78%	0.783	73%	0.726	S	S	*	*			cis	-167.6	-175.3	-5.8	-161.8	0	0	0	0	111.3
74	T	32.3	Very low	30.2	Very low	131 Å²	131	144.4 Å²	144.4	80%	0.804	74%	0.74	S	S	*	*			trans	69.6	134.6	167.9	63.6	0	0	0	0	120.3
75	K	30	Very low	30.1	Very low	185 Å²	185	143.3 Å²	143.3	80%	0.804	75%	0.745	S	S	*	*			cis	-163.8	122	-16.6	-163.4	-179.4	-170	179.8	0	112.2
76	K	30.8	Very low	30	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.796	75%	0.745	S	S	*	*			trans	55.5	159.7	153.8	-76.6	-172.6	167.7	-163.8	0	119.3
77	L	24.1	Very low	29.8	Very low	152 Å²	152	137.8 Å²	137.8	80%	0.796	75%	0.748	S	S	*	*			cis	-140	176.4	3.3	-132.1	159.5	0	0	0	110.9
78	Q	30.4	Very low	29.8	Very low	152 Å²	152	130.1 Å²	130.1	71%	0.71	74%	0.737	S	S	*	*			trans	-131.5	161.2	-167.9	173.8	179.1	-22.7	0	0	110.5	D80	Q78-D80 PolarHBondContact NE2-OD1 3.43Å; Q78-D80 PolarHBondContact NE2-OD2 2.78Å
79	G	31.2	Very low	29.8	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	74%	0.738	S	S	*	*			trans	173.9	97.4	168.7	0	0	0	0	0	107.8
80	D	31.2	Very low	29.5	Very low	111 Å²	111	129.7 Å²	129.7	59%	0.594	74%	0.74	S	S	*	*				72.2	143.3	60.1	-55.8	-30.7	0	0	0	111.6	Q78	Q78-D80 PolarHBondContact NE2-OD1 3.43Å; Q78-D80 PolarHBondContact NE2-OD2 2.78Å
81	L	33.9	Very low	28.5	Very low	128 Å²	128	129.6 Å²	129.6	67%	0.67	74%	0.742	S	S	*	*			cis	-158.6	147.8	17.7	-160	70.7	0	0	0	111.3
82	M	32.8	Very low	28.3	Very low	145 Å²	145	125.5 Å²	125.5	71%	0.714	74%	0.74	S	S	*	*			trans	57.2	163.4	149.4	-81.1	162.7	-169.4	0	0	120.8
83	D	27.3	Very low	28.2	Very low	122 Å²	122	130.7 Å²	130.7	65%	0.652	74%	0.744	S	S	*	*			cis	-173.6	-178.5	-34.6	-106.5	17	0	0	0	106.7
84	Q	32.1	Very low	28.1	Very low	147 Å²	147	133.2 Å²	133.2	69%	0.687	74%	0.743	S	S	*	*			cis	-129.8	-156.3	-1.5	-118.6	132.9	52.2	0	0	107
85	T	27.2	Very low	28	Very low	114 Å²	114	132.7 Å²	132.7	70%	0.699	74%	0.735	S	S	*	*			cis	70.7	130	27.4	-11.4	0	0	0	0	113
86	T	24.8	Very low	28.2	Very low	121 Å²	121	129.4 Å²	129.4	74%	0.742	73%	0.726	S	S	*	*			cis	-146.1	140.1	28.5	39.2	0	0	0	0	112.2
87	V	25.1	Very low	28.1	Very low	132 Å²	132	130 Å²	130	80%	0.8	73%	0.728	S	S	*	*				77.5	121.4	97.6	-175.6	0	0	0	0	118
88	A	24.1	Very low	28.4	Very low	85 Å²	85	125.8 Å²	125.8	70%	0.702	72%	0.722	S	S	*	*			trans	55.7	108.1	149.4	0	0	0	0	0	124.8
89	A	25.7	Very low	28.5	Very low	95 Å²	95	127.3 Å²	127.3	79%	0.785	73%	0.727	S	S	*	*				83.8	153	110.2	0	0	0	0	0	124
90	Q	24.2	Very low	28.3	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	73%	0.725	S	S	*	*			trans	76	98.2	160.9	-72.2	179.1	-4.2	0	0	121.7
91	S	23.1	Very low	28.4	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	73%	0.73	S	S	*	*				69.6	150.7	129.1	56.4	0	0	0	0	123.9
92	A	27.1	Very low	28.1	Very low	84 Å²	84	130.1 Å²	130.1	69%	0.694	73%	0.73	S	S	*	*			trans	86.8	96.9	154.9	0	0	0	0	0	120.7
93	E	26	Very low	27.9	Very low	185 Å²	185	128.6 Å²	128.6	86%	0.864	73%	0.725	S	S	*	*				79	151.8	120.9	-69.5	178.5	166.5	0	0	124.1
94	E	26.4	Very low	28.1	Very low	165 Å²	165	130.5 Å²	130.5	77%	0.771	73%	0.727	S	S	*	*			trans	68.1	148.3	161.7	-63.9	-116.4	102.5	0	0	121.5
95	N	29.8	Very low	27.9	Very low	120 Å²	120	129.8 Å²	129.8	64%	0.642	73%	0.728	S	S	*	*			cis	-166.2	173.3	-37.9	-148.9	-27	0	0	0	111.7
96	L	34.2	Very low	27.9	Very low	116 Å²	116	130.7 Å²	130.7	61%	0.607	73%	0.729	S	S	*	*			trans	80.2	116.7	149.2	-64.2	165.8	0	0	0	123.8
97	K	30.1	Very low	28.1	Very low	195 Å²	195	128.1 Å²	128.1	85%	0.848	73%	0.726	S	S	*	*			trans	70.8	142.4	134.2	-67.1	167.5	176.7	156.2	0	120.5
98	G	30.3	Very low	28.6	Very low	65 Å²	65	128.9 Å²	128.9	67%	0.67	72%	0.721	S	S	*	*			cis	159.3	-178.6	-8.9	0	0	0	0	0	115.1
99	K	31.5	Very low	29	Very low	184 Å²	184	131.6 Å²	131.6	80%	0.8	72%	0.719	S	S	*	*			trans	74.8	147.9	170	-63	-176.9	163.8	-125.2	0	117
100	E	27.4	Very low	29.4	Very low	138 Å²	138	134 Å²	134	65%	0.645	72%	0.715	S	S	*	*			cis	-163.8	155.5	-5.4	-120.5	165	-151.8	0	0	113.6
101	S	33.2	Very low	29.4	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	71%	0.711	S	S	*	*			trans	65.9	145.8	141.4	-68.6	0	0	0	0	121.7
102	N	28.4	Very low	29.6	Very low	126 Å²	126	128 Å²	128	67%	0.674	70%	0.7	S	S	*	*			cis	-165.9	156.4	-5.7	-143.7	-22.4	0	0	0	114.2
103	N	28.9	Very low	29.6	Very low	112 Å²	112	132.1 Å²	132.1	60%	0.599	71%	0.709	S	S	*	*			trans	60.7	150.2	153.3	-71.9	-41.5	0	0	0	121.3
104	K	31.1	Very low	29.6	Very low	163 Å²	163	128.9 Å²	128.9	71%	0.709	70%	0.701	S	S	*	*			cis	-159.4	134.2	-3.3	-126.8	160.1	-170.1	177.6	0	113.9
105	N	27.9	Very low	29.5	Very low	132 Å²	132	129.1 Å²	129.1	71%	0.706	70%	0.7	S	S	*	*			trans	33.6	153.3	133.5	-54.4	15.9	0	0	0	121.8
106	N	26.9	Very low	29.2	Very low	133 Å²	133	130.9 Å²	130.9	71%	0.711	71%	0.709	S	S	*	*			cis	-153.5	167.9	-3.9	-118.5	-2	0	0	0	107.6
107	G	28.6	Very low	28.8	Very low	67 Å²	67	129 Å²	129	69%	0.691	72%	0.718	S	S	*	*			cis	102.8	137.9	36.6	0	0	0	0	0	108.6
108	Q	36.6	Very low	29	Very low	148 Å²	148	128.6 Å²	128.6	69%	0.692	72%	0.719	S	S	*	*			cis	-147.7	172.7	17.3	-85.5	-178.5	-18.6	0	0	109
109	Q	32.4	Very low	29.3	Very low	142 Å²	142	130.8 Å²	130.8	66%	0.664	72%	0.724	S	S	*	*				-148	-125.5	50.1	-149.1	85.3	28.9	0	0	116.4
110	Q	34	Very low	29	Very low	146 Å²	146	131.5 Å²	131.5	68%	0.682	73%	0.73	S	S	*	*			trans	-153.6	167.1	-144.4	-78.7	169.4	-68.2	0	0	110
111	C	24.6	Very low	29.2	Very low	114 Å²	114	132.8 Å²	132.8	77%	0.77	74%	0.742	S	S	*	*			cis	-155.1	-176.2	-0.7	-122.3	0	0	0	0	108.6
112	G	27	Very low	28.9	Very low	54 Å²	54	131 Å²	131	56%	0.557	74%	0.739	S	S	*	*			cis	166.5	168.1	-2.7	0	0	0	0	0	112.5
113	L	25.3	Very low	29.8	Very low	170 Å²	170	129.7 Å²	129.7	89%	0.89	75%	0.746	S	S	*	*			trans	72.8	133.6	179.1	-75.7	80.6	0	0	0	116.9
114	V	26.4	Very low	30.7	Very low	116 Å²	116	132 Å²	132	70%	0.703	76%	0.758	S	S	*	*			cis	-159.1	147.7	-15.8	96.3	0	0	0	0	113.4
115	K	25	Very low	31.5	Very low	170 Å²	170	126.3 Å²	126.3	74%	0.739	75%	0.745	S	S	*	*			trans	67.9	102.5	160.5	-65.6	-179	179.9	-177.7	0	122.1
116	D	24.1	Very low	32.9	Very low	157 Å²	157	126.4 Å²	126.4	84%	0.84	74%	0.736	S	S	*	*				50.5	138.6	114.1	-36.7	-31.3	0	0	0	120.7
117	G	26.2	Very low	34.3	Very low	77 Å²	77	124.5 Å²	124.5	79%	0.794	72%	0.722	S	S	*	*			cis	-162.2	-174.1	5.1	0	0	0	0	0	112.9
118	E	32.3	Very low	35.8	Very low	186 Å²	186	122.1 Å²	122.1	87%	0.869	70%	0.695	S	S	*	*			trans	-110.6	163.2	-151.8	-53	-174.9	113.8	0	0	119
119	S	36.7	Very low	36.8	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	70%	0.7	S	S	*	*			trans	79.3	120.3	142.1	-70.1	0	0	0	0	122.8
120	Q	26.4	Very low	37.9	Very low	199 Å²	199	124.4 Å²	124.4	93%	0.93	70%	0.699	S	S	*	*			trans	-146.5	140.9	136.6	-112.4	-171.2	17.4	0	0	111.2
121	D	31	Very low	39.5	Very low	165 Å²	165	119.7 Å²	119.7	88%	0.882	68%	0.682	S	S	*	*			trans	-95.3	158	166	-171.5	9.8	0	0	0	109.4
122	G	27.6	Very low	40.9	Very low	63 Å²	63	120.7 Å²	120.7	65%	0.649	68%	0.675	S	S	*	*			trans	150.7	104	177.2	0	0	0	0	0	115.5	L124	G122-L124 PolarHBondContact O-N 2.97Å; G122-L124 VanDerWaalsContact O-N 3.07Å
123	A	46.5	Very low	42.1	Very low	99 Å²	99	126.6 Å²	126.6	82%	0.818	68%	0.681	S	S	*	*			trans	-77.9	91.7	-174.2	0	0	0	0	0	115.1
124	L	48.1	Very low	43.3	Very low	160 Å²	160	124 Å²	124	84%	0.838	67%	0.672	S	S	*	*			trans	-110.7	171.8	162.7	-70.8	179.3	0	0	0	113.8	G122 K138	G122-L124 PolarHBondContact O-N 2.97Å; G122-L124 VanDerWaalsContact O-N 3.07Å; L124-K138 WeakPolarHBondContact O-CE 3.21Å; L124-K138 PolarHBondContact O-NZ 2.79Å; L124-K138 VanDerWaalsContact O-NZ 3.12Å
125	G	48.8	Very low	45.1	Very low	43 Å²	43	120.6 Å²	120.6	44%	0.443	65%	0.648	S	S	.	*			trans	104.9	62.6	-176.5	0	0	0	0	0	113.9	K138	G125-K138 WeakPolarHBondContact O-CE 3.19Å; G125-K138 VanDerWaalsContact O-CG 3.3Å; G125-K138 WeakPolarHBondContact O-CG 3.21Å
126	R	57.6	Low	46.7	Very low	135 Å²	135	117 Å²	117	51%	0.509	64%	0.644	S	S	.	*			trans	-136.2	10.2	174.1	-76.2	-166.3	-158.5	-158.3	10.4	114.5	T134 F135 S136 K138 I141	R126-T134 CarbonylContact O-C 3.37Å; R126-F135 WeakPolarHBondContact CB-O 3.4Å; R126-F135 WeakPolarHBondContact CD-O 3.01Å; R126-F135 PolarHBondContact O-N 2.89Å; R126-S136 PolarHBondContact NH1-O 3.4Å; R126-K138 HydrophobicContact CG-CG 4.44Å; R126-I141 WeakPolarHBondContact O-CD1 3.49Å
127	E	54.3	Low	48.1	Very low	92 Å²	92	113.4 Å²	113.4	43%	0.43	63%	0.625	S	S	.	*	B	Isolated β-bridge	trans	-118.7	148	176	54.9	162.4	-133.6	0	0	113.2	R133 T134 I141	E127-R133 WeakPolarHBondContact CA-O 3.41Å; E127-T134 HydrophobicContact CB-CG2 4.1Å; E127-I141 VanDerWaalsContact N-CD1 3.34Å; E127-I141 WeakPolarHBondContact O-CD1 3.18Å
128	C	61.7	Low	49.3	Very low	18 Å²	18	115.2 Å²	115.2	12%	0.122	61%	0.611	C	S	.	*			trans	-91	110.9	176.9	178.3	0	0	0	0	110.3	I130 C131 H132 R133 F135 I141 H144	C128-I130 PolarHBondContact O-N 2.84Å; C128-C131 PolarHBondContact O-N 2.92Å; C128-H132 VanDerWaalsContact O-CA 3.3Å; C128-H132 WeakPolarHBondContact O-CA 3.22Å; C128-H132 PolarHBondContact O-N 3.36Å; C128-R133 PolarHBondContact N-O 3.17Å; C128-F135 HydrophobicContact CB-CE2 4Å; C128-I141 HydrophobicContact CB-CG1 4.49Å; C128-H144 PolarHBondContact SG-CD2 3.47Å
129	R	56.1	Low	50.6	Low	212 Å²	212	115.6 Å²	115.6	80%	0.8	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	13.6	-178.9	-64.5	-175.8	172.5	-179.5	-3.4	116.1
130	I	56.7	Low	51.6	Low	125 Å²	125	114.4 Å²	114.4	64%	0.641	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-20.7	177.7	-54.1	175.8	0	0	0	111.4	C128 C146	C128-I130 PolarHBondContact O-N 2.84Å; I130-C146 HydrophobicContact CB-CB 4.11Å; I130-C146 HydrophobicContact CG2-CB 3.65Å
131	C	67.9	Low	53.3	Low	48 Å²	48	106.9 Å²	106.9	32%	0.324	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-137.2	7.2	175.1	69.5	0	0	0	0	114.3	C128 R133 H144	C128-C131 PolarHBondContact O-N 2.92Å; C131-R133 PolarHBondContact O-N 2.88Å; C131-H144 PolarHBondContact SG-NE2 2.99Å
132	H	52.7	Low	54.5	Low	134 Å²	134	106.2 Å²	106.2	62%	0.62	55%	0.548	S	S	*	.			trans	49.3	21.1	179.6	-61.1	-82.4	0	0	0	116.4	C128	C128-H132 VanDerWaalsContact O-CA 3.3Å; C128-H132 WeakPolarHBondContact O-CA 3.22Å; C128-H132 PolarHBondContact O-N 3.36Å
133	R	52.1	Low	56.2	Low	179 Å²	179	111.1 Å²	111.1	68%	0.675	55%	0.551	S	S	*	*			trans	-77.9	131.5	172	-70	-172.3	173.7	-159.9	-2.9	111.2	E127 C128 C131 F135	E127-R133 WeakPolarHBondContact CA-O 3.41Å; C128-R133 PolarHBondContact N-O 3.17Å; C131-R133 PolarHBondContact O-N 2.88Å; R133-F135 HydrophobicContact CB-CE2 3.88Å; R133-F135 HydrophobicContact CB-CZ 4.09Å; R133-F135 WeakPolarHBondContact O-CD2 3.35Å; R133-F135 WeakPolarHBondContact O-CE2 3.25Å
134	T	51.1	Low	57	Low	114 Å²	114	109.3 Å²	109.3	70%	0.699	53%	0.526	S	S	*	.	B	Isolated β-bridge	trans	-85.5	141.5	172.7	51.2	0	0	0	0	111	R126 E127	R126-T134 CarbonylContact O-C 3.37Å; E127-T134 HydrophobicContact CB-CG2 4.1Å
135	F	64.9	Low	57.3	Low	45 Å²	45	108 Å²	108	20%	0.197	52%	0.518	C	S	.	.			trans	-129.1	130.8	-174.8	-67.2	-89.3	0	0	0	110.9	R126 C128 R133 N137 Q140 I141 H144	R126-F135 WeakPolarHBondContact CB-O 3.4Å; R126-F135 WeakPolarHBondContact CD-O 3.01Å; R126-F135 PolarHBondContact O-N 2.89Å; C128-F135 HydrophobicContact CB-CE2 4Å; R133-F135 HydrophobicContact CB-CE2 3.88Å; R133-F135 HydrophobicContact CB-CZ 4.09Å; R133-F135 WeakPolarHBondContact O-CD2 3.35Å; R133-F135 WeakPolarHBondContact O-CE2 3.25Å; F135-N137 PolarHBondContact O-N 2.89Å; F135-Q140 HydrophobicContact CB-CB 4.23Å; F135-Q140 HydrophobicContact CD1-CB 4.18Å; F135-I141 HydrophobicContact CD2-CD1 3.93Å; F135-I141 HydrophobicContact CD2-CG1 3.73Å; F135-I141 HydrophobicContact CE2-CG1 4.23Å; F135-I141 HydrophobicContact CG-CG1 4.33Å; F135-H144 HydrophobicContact CE1-CB 4.42Å; F135-H144 HydrophobicContact CE2-CB 4.42Å; F135-H144 HydrophobicContact CZ-CB 3.96Å; F135-H144 AromaticContact CZ-CG 3.66Å; F135-H144 AromaticContact CZ-ND1 3.64Å
136	S	57.3	Low	57.1	Low	96 Å²	96	107.9 Å²	107.9	67%	0.671	51%	0.51	S	S	*	.	S	Bend	trans	-69.9	1.1	-173.6	57.6	0	0	0	0	115.2	R126 Q140	R126-S136 PolarHBondContact NH1-O 3.4Å; S136-Q140 PolarHBondContact OG-OE1 2.83Å
137	N	54.7	Low	56.5	Low	81 Å²	81	109.1 Å²	109.1	43%	0.433	53%	0.526	S	S	.	.	S	Bend	trans	-153.7	139.4	173.5	-163	-59.6	0	0	0	113.5	F135 R139 Q140	F135-N137 PolarHBondContact O-N 2.89Å; N137-R139 PolarHBondContact O-N 2.77Å; N137-R139 WeakPolarHBondContact OD1-CB 3.5Å; N137-R139 PolarHBondContact OD1-N 3.01Å; N137-Q140 HydrophobicContact CB-CG 4.29Å; N137-Q140 WeakPolarHBondContact O-CB 3.28Å; N137-Q140 PolarHBondContact O-N 3.37Å
138	K	51.7	Low	55.5	Low	115 Å²	115	114.1 Å²	114.1	50%	0.5	54%	0.541	S	S	.	.	H	α-helix	trans	-53	-28.5	173	-77.9	-173.6	173.9	-176.2	0	113.3	L124 G125 R126 Q140	L124-K138 WeakPolarHBondContact O-CE 3.21Å; L124-K138 PolarHBondContact O-NZ 2.79Å; L124-K138 VanDerWaalsContact O-NZ 3.12Å; G125-K138 WeakPolarHBondContact O-CE 3.19Å; G125-K138 VanDerWaalsContact O-CG 3.3Å; G125-K138 WeakPolarHBondContact O-CG 3.21Å; R126-K138 HydrophobicContact CG-CG 4.44Å; K138-Q140 PolarHBondContact O-N 2.96Å
139	R	58.3	Low	54	Low	193 Å²	193	120.3 Å²	120.3	73%	0.728	57%	0.568	S	S	*	*	H	α-helix	trans	-77.6	-11.9	176.4	-172.1	172.1	-77.1	-177	-2.6	114.7	N137	N137-R139 PolarHBondContact O-N 2.77Å; N137-R139 WeakPolarHBondContact OD1-CB 3.5Å; N137-R139 PolarHBondContact OD1-N 3.01Å
140	Q	57.8	Low	52.7	Low	86 Å²	86	117.2 Å²	117.2	40%	0.402	56%	0.563	S	S	.	*	H	α-helix	trans	-84	-39.3	171	-71	165.2	-32.1	0	0	111	F135 S136 N137 K138 L142 K143 H144	F135-Q140 HydrophobicContact CB-CB 4.23Å; F135-Q140 HydrophobicContact CD1-CB 4.18Å; S136-Q140 PolarHBondContact OG-OE1 2.83Å; N137-Q140 HydrophobicContact CB-CG 4.29Å; N137-Q140 WeakPolarHBondContact O-CB 3.28Å; N137-Q140 PolarHBondContact O-N 3.37Å; K138-Q140 PolarHBondContact O-N 2.96Å; Q140-L142 PolarHBondContact O-N 2.96Å; Q140-K143 PolarHBondContact O-N 2.84Å; Q140-H144 PolarHBondContact O-N 3.01Å
141	I	62.5	Low	51.4	Low	41 Å²	41	116.8 Å²	116.8	21%	0.21	56%	0.562	C	S	.	*	H	α-helix	trans	-65.7	-39.5	-177.6	-134.5	162.9	0	0	0	112.4	R126 E127 C128 F135 K143 H144	R126-I141 WeakPolarHBondContact O-CD1 3.49Å; E127-I141 VanDerWaalsContact N-CD1 3.34Å; E127-I141 WeakPolarHBondContact O-CD1 3.18Å; C128-I141 HydrophobicContact CB-CG1 4.49Å; F135-I141 HydrophobicContact CD2-CD1 3.93Å; F135-I141 HydrophobicContact CD2-CG1 3.73Å; F135-I141 HydrophobicContact CE2-CG1 4.23Å; F135-I141 HydrophobicContact CG-CG1 4.33Å; I141-K143 PolarHBondContact O-N 2.79Å; I141-H144 PolarHBondContact O-N 2.62Å
142	L	56	Low	49.6	Very low	152 Å²	152	124.1 Å²	124.1	80%	0.796	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	8.9	172.3	-66.9	169	0	0	0	114.3	Q140	Q140-L142 PolarHBondContact O-N 2.96Å
143	K	64.1	Low	48.5	Very low	165 Å²	165	125.5 Å²	125.5	72%	0.717	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	-2.3	172.8	-64	-173.9	175.7	-171	0	113.2	Q140 I141	Q140-K143 PolarHBondContact O-N 2.84Å; I141-K143 PolarHBondContact O-N 2.79Å
144	H	63	Low	47.3	Very low	62 Å²	62	123.9 Å²	123.9	29%	0.287	60%	0.603	S	S	.	*			trans	-83.2	123.8	175.2	176.7	72.9	0	0	0	108.5	C128 C131 F135 Q140 I141 C146	C128-H144 PolarHBondContact SG-CD2 3.47Å; C131-H144 PolarHBondContact SG-NE2 2.99Å; F135-H144 HydrophobicContact CE1-CB 4.42Å; F135-H144 HydrophobicContact CE2-CB 4.42Å; F135-H144 HydrophobicContact CZ-CB 3.96Å; F135-H144 AromaticContact CZ-CG 3.66Å; F135-H144 AromaticContact CZ-ND1 3.64Å; Q140-H144 PolarHBondContact O-N 3.01Å; I141-H144 PolarHBondContact O-N 2.62Å; H144-C146 PolarHBondContact NE2-SG 3.18Å
145	I	53.6	Low	46.3	Very low	131 Å²	131	124.7 Å²	124.7	67%	0.672	60%	0.603	S	S	*	*			trans	-113.2	112.6	176.2	-60.7	174.6	0	0	0	106.1	L147	I145-L147 HydrophobicContact CG2-CD2 4.14Å
146	C	45.1	Very low	44.7	Very low	41 Å²	41	128.2 Å²	128.2	28%	0.277	63%	0.628	S	S	.	*			trans	-74.6	134.7	161.8	-84	0	0	0	0	108.5	I130 H144	I130-C146 HydrophobicContact CB-CB 4.11Å; I130-C146 HydrophobicContact CG2-CB 3.65Å; H144-C146 PolarHBondContact NE2-SG 3.18Å
147	L	45	Very low	43.4	Very low	161 Å²	161	130.2 Å²	130.2	84%	0.843	63%	0.626	S	S	*	*			trans	-106.7	115.6	165.6	-63.5	172.3	0	0	0	106.2	I145	I145-L147 HydrophobicContact CG2-CD2 4.14Å
148	R	32.7	Very low	42.2	Very low	198 Å²	198	133 Å²	133	75%	0.747	64%	0.637	S	S	*	*			trans	-68.6	141.1	155.5	-83.8	169.5	58.3	115.2	-6.2	106.9	E150	R148-E150 IonicContact CZ-OE1 3.6Å; R148-E150 IonicContact NE-OE1 3.89Å; R148-E150 PolarHBondContact NE-OE1 3.44Å; R148-E150 IonicContact NH2-OE1 2.81Å; R148-E150 PolarHBondContact NH2-OE1 3.02Å
149	Q	31.6	Very low	41.1	Very low	148 Å²	148	135.6 Å²	135.6	69%	0.692	65%	0.65	S	S	*	*			trans	-105.1	125.4	163.2	-174.3	169.5	-24.7	0	0	105.6	D151	Q149-D151 WeakPolarHBondContact CG-OD1 3.49Å; Q149-D151 VanDerWaalsContact NE2-CG 3.28Å; Q149-D151 PolarHBondContact NE2-OD1 3.45Å; Q149-D151 PolarHBondContact NE2-OD2 3.35Å
150	E	28.7	Very low	39.6	Very low	147 Å²	147	129.6 Å²	129.6	69%	0.687	65%	0.649	S	S	*	*			trans	-107.7	103	172.9	-80.2	155.4	-172.7	0	0	104.7	R148	R148-E150 IonicContact CZ-OE1 3.6Å; R148-E150 IonicContact NE-OE1 3.89Å; R148-E150 PolarHBondContact NE-OE1 3.44Å; R148-E150 IonicContact NH2-OE1 2.81Å; R148-E150 PolarHBondContact NH2-OE1 3.02Å
151	D	29.3	Very low	38.2	Very low	116 Å²	116	133.1 Å²	133.1	62%	0.62	67%	0.669	S	S	*	*			trans	-102.2	124.5	173.3	-64.4	-48.6	0	0	0	106.8	Q149	Q149-D151 WeakPolarHBondContact CG-OD1 3.49Å; Q149-D151 VanDerWaalsContact NE2-CG 3.28Å; Q149-D151 PolarHBondContact NE2-OD1 3.45Å; Q149-D151 PolarHBondContact NE2-OD2 3.35Å
152	E	29.8	Very low	36.6	Very low	201 Å²	201	137.7 Å²	137.7	94%	0.939	70%	0.698	S	S	*	*			trans	-83.7	144.1	168.5	-66.2	-179.8	135.2	0	0	109.4
153	E	28.3	Very low	35.2	Very low	164 Å²	164	136.1 Å²	136.1	77%	0.766	70%	0.701	S	S	*	*			trans	-114.8	111.8	179.5	-64.3	-161.1	122.4	0	0	110.9
154	D	27.2	Very low	33.4	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	71%	0.706	S	S	*	*			trans	-83.6	123.8	158.1	-72.3	-53.4	0	0	0	109.5	I63	I63-D154 WeakPolarHBondContact CD1-O 3.48Å
155	D	29.7	Very low	31.8	Very low	130 Å²	130	133.6 Å²	133.6	70%	0.695	73%	0.729	S	S	*	*			trans	-158.1	153	152.6	-117.2	-38.2	0	0	0	108.6	I63	I63-D155 WeakPolarHBondContact CD1-OD2 3.4Å
156	V	31.8	Very low	30.5	Very low	119 Å²	119	136.2 Å²	136.2	72%	0.721	74%	0.738	S	S	*	*			trans	-126.8	148.4	-153.3	174.8	0	0	0	0	114
157	Q	31.2	Very low	29.7	Very low	138 Å²	138	143.4 Å²	143.4	65%	0.645	77%	0.768	S	S	*	*			trans	90	110.3	160.7	-136.8	67.6	12.4	0	0	120.1
158	Q	28.8	Very low	28.8	Very low	141 Å²	141	142.4 Å²	142.4	66%	0.659	76%	0.763	S	S	*	*			trans	49.7	146.7	138.8	-71	168	-34.2	0	0	121.2
159	H	28	Very low	28.6	Very low	168 Å²	168	138.6 Å²	138.6	78%	0.778	76%	0.762	S	S	*	*			cis	-151.5	164	14.9	-108.6	-67.9	0	0	0	110.4
160	G	27.1	Very low	28.5	Very low	67 Å²	67	134.6 Å²	134.6	69%	0.691	76%	0.76	S	S	*	*			trans	88.7	89.2	139.3	0	0	0	0	0	120.1
161	I	28.8	Very low	28.7	Very low	161 Å²	161	133 Å²	133	83%	0.826	77%	0.765	S	S	*	*			trans	0.3	120.7	149.7	-33.5	174.9	0	0	0	117.7
162	T	28	Very low	28.7	Very low	136 Å²	136	139.4 Å²	139.4	83%	0.834	78%	0.781	S	S	*	*				172.5	165.3	119.6	31.6	0	0	0	0	113
163	S	28.2	Very low	28.7	Very low	120 Å²	120	133 Å²	133	84%	0.839	77%	0.769	S	S	*	*			trans	-76	156.8	176.5	52.6	0	0	0	0	114.4
164	G	26.4	Very low	28.9	Very low	81 Å²	81	131.2 Å²	131.2	84%	0.835	77%	0.769	S	S	*	*			trans	159	132.6	156.3	0	0	0	0	0	113.6
165	A	29.2	Very low	28.9	Very low	92 Å²	92	131 Å²	131	76%	0.76	77%	0.768	S	S	*	*			trans	-92.5	151.3	174	0	0	0	0	0	111.7
166	E	26	Very low	29.1	Very low	186 Å²	186	129.2 Å²	129.2	87%	0.869	77%	0.766	S	S	*	*			trans	32.7	125.9	144.4	-59.3	-178.6	176.5	0	0	120.7
167	E	27.4	Very low	28.9	Very low	192 Å²	192	129.8 Å²	129.8	90%	0.897	77%	0.765	S	S	*	*				-162	147	116.9	-116.4	175.1	-163	0	0	115.5
168	D	25.9	Very low	28.9	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	77%	0.767	S	S	*	*			trans	82.4	140.3	142.2	-141	30.9	0	0	0	127.4
169	V	29.9	Very low	28.7	Very low	117 Å²	117	129.8 Å²	129.8	71%	0.709	77%	0.774	S	S	*	*			trans	44.3	146.4	151.3	153	0	0	0	0	123.4
170	G	27.9	Very low	28.8	Very low	64 Å²	64	130.1 Å²	130.1	66%	0.66	77%	0.773	S	S	*	*			cis	139.3	154	-8.6	0	0	0	0	0	116.8
171	S	34.6	Very low	28.7	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	78%	0.781	S	S	*	*			trans	107.2	148.3	150.6	-53.6	0	0	0	0	123.7
172	R	28.1	Very low	28.5	Very low	251 Å²	251	137.2 Å²	137.2	95%	0.947	78%	0.782	S	S	*	*			trans	73.6	145.4	164	-69.7	173.8	162.9	161	-5.4	119.3
173	G	29.3	Very low	28.7	Very low	68 Å²	68	136.3 Å²	136.3	70%	0.701	78%	0.778	S	S	*	*			cis	124.9	148.8	-0.7	0	0	0	0	0	113.4
174	T	32.7	Very low	28.5	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	78%	0.775	S	S	*	*			cis	-165.9	-179	-6.3	-33.2	0	0	0	0	109.8
175	D	28.2	Very low	28.4	Very low	140 Å²	140	143.7 Å²	143.7	75%	0.749	78%	0.777	S	S	*	*			trans	71	157.8	157.5	-73.3	-59.4	0	0	0	121.5
176	S	33.6	Very low	28.1	Very low	93 Å²	93	145 Å²	145	65%	0.65	78%	0.781	S	S	*	*			cis	-171.3	164.8	-33.8	-103	0	0	0	0	113.4
177	N	27.8	Very low	28.1	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	77%	0.77	S	S	*	*			trans	81.9	110.9	156.3	-79.5	-43.3	0	0	0	126.2
178	Q	31.6	Very low	28	Very low	147 Å²	147	137.5 Å²	137.5	69%	0.687	77%	0.766	S	S	*	*				57.8	128.3	122.6	-66.1	-174.2	64.9	0	0	126.5
179	T	24.7	Very low	28	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	76%	0.762	S	S	*	*				151.9	157.2	119.7	44.8	0	0	0	0	113
180	K	28.5	Very low	27.7	Very low	174 Å²	174	142.2 Å²	142.2	76%	0.757	77%	0.765	S	S	*	*			cis	-165.8	159.4	-40.2	-153.6	168.5	-172.1	170.9	0	110.2
181	Q	25.6	Very low	27.6	Very low	184 Å²	184	145.3 Å²	145.3	86%	0.86	76%	0.762	S	S	*	*			trans	87.5	156.9	162.9	-49.5	-163.1	31.3	0	0	122.5
182	K	25.8	Very low	27.2	Very low	194 Å²	194	147.9 Å²	147.9	84%	0.843	76%	0.759	S	S	*	*			trans	-133.2	162.4	177.7	-75.7	180	175.5	172.3	0	109.9
183	P	32.3	Very low	27	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	74%	0.743	S	S	*	*				-131.3	138.6	116.6	5.7	16.7	0	0	0	111.9
184	T	23.3	Very low	26.8	Very low	125 Å²	125	143.8 Å²	143.8	77%	0.767	75%	0.745	S	S	*	*				59.9	145.2	74.6	66.7	0	0	0	0	116.5
185	R	24.4	Very low	26.4	Very low	231 Å²	231	142.9 Å²	142.9	87%	0.872	74%	0.743	S	S	*	*			cis	-174.7	163.1	-22.8	-177.8	172.8	-179.2	-171.7	0.7	107.9
186	S	22.6	Very low	26.2	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	74%	0.74	S	S	*	*			trans	80.6	149.6	163.4	80	0	0	0	0	118.3
187	G	25.1	Very low	25.8	Very low	62 Å²	62	141 Å²	141	64%	0.639	74%	0.741	S	S	*	*			cis	158.9	159.9	-17	0	0	0	0	0	116.4
188	L	26.5	Very low	25.7	Very low	157 Å²	157	141.5 Å²	141.5	82%	0.822	74%	0.744	S	S	*	*			trans	69.5	158.7	163.9	-47.3	174.4	0	0	0	115.8
189	K	25.1	Very low	25.3	Very low	155 Å²	155	141.5 Å²	141.5	67%	0.674	75%	0.748	S	S	*	*			cis	-167.5	138.3	-24.7	-113.4	176.9	178.5	169	0	108.7
190	R	24.8	Very low	25.3	Very low	202 Å²	202	141.8 Å²	141.8	76%	0.762	75%	0.749	S	S	*	*			trans	60.5	175.5	148.6	-62.1	169.8	75.1	154.7	0.6	114.7
191	Q	24.6	Very low	25	Very low	130 Å²	130	138.2 Å²	138.2	61%	0.607	75%	0.746	S	S	*	*			cis	-156.9	159.5	-32.7	-115.3	-179.1	-60.2	0	0	107.5
192	K	25.9	Very low	25	Very low	166 Å²	166	134.8 Å²	134.8	72%	0.722	74%	0.738	S	S	*	*			trans	64.1	165.7	159.4	-78	-171.7	135.4	-130.5	0	115.3
193	D	24.8	Very low	24.9	Very low	115 Å²	115	132.5 Å²	132.5	62%	0.615	74%	0.735	S	S	*	*			cis	-142.5	-173	-6.2	-120.6	-17.5	0	0	0	111.4
194	T	24.1	Very low	24.5	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	74%	0.742	S	S	*	*			trans	-64.5	160.4	-175.1	50.5	0	0	0	0	117.5
195	S	24.7	Very low	24.5	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	74%	0.743	S	S	*	*				120	133.2	129.2	75.9	0	0	0	0	121.3
196	S	24.7	Very low	24.4	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	74%	0.737	S	S	*	*			trans	59.8	116.2	141.6	55.7	0	0	0	0	124.6
197	S	25.1	Very low	24.3	Very low	97 Å²	97	131.9 Å²	131.9	68%	0.678	73%	0.73	S	S	*	*				74.5	117.7	125.4	67	0	0	0	0	124.1
198	N	24.9	Very low	24.1	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	74%	0.736	S	S	*	*				70.5	101.5	125.7	-60.8	-7.2	0	0	0	123.1
199	L	24.6	Very low	23.9	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	74%	0.741	S	S	*	*				34.4	121.1	129.8	-76.9	87.2	0	0	0	122
200	T	23.9	Very low	23.8	Very low	137 Å²	137	137.1 Å²	137.1	84%	0.84	75%	0.746	S	S	*	*			trans	66.1	157.6	147.8	67.6	0	0	0	0	116.1
201	S	22.6	Very low	23.8	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	75%	0.752	S	S	*	*			cis	-169	171.5	26.9	80.9	0	0	0	0	108.5
202	V	24.9	Very low	23.8	Very low	112 Å²	112	136.6 Å²	136.6	68%	0.679	76%	0.758	S	S	*	*			cis	-174.7	152.8	-10.6	124.2	0	0	0	0	109.6
203	N	23.3	Very low	23.8	Very low	147 Å²	147	135.3 Å²	135.3	79%	0.786	76%	0.764	S	S	*	*			trans	65.7	147.8	165.5	-70.2	-11	0	0	0	121.8
204	R	25.3	Very low	23.9	Very low	238 Å²	238	133 Å²	133	90%	0.898	77%	0.768	S	S	*	*			trans	149.4	150.4	130.1	-85.5	-178.5	-178.1	-164.3	0.8	111.5
205	V	23.4	Very low	24.3	Very low	131 Å²	131	135.1 Å²	135.1	79%	0.794	77%	0.769	S	S	*	*			cis	-159.1	-179.4	-24.4	100.9	0	0	0	0	108.3
206	C	21.3	Very low	24.6	Very low	110 Å²	110	137.5 Å²	137.5	74%	0.743	77%	0.766	S	S	*	*			trans	-58.7	169.4	169.9	-48.3	0	0	0	0	112.2
207	S	20.7	Very low	24.8	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	77%	0.768	S	S	*	*			cis	-168.9	162.5	37.2	-126.5	0	0	0	0	114.3
208	E	21.3	Very low	25.1	Very low	162 Å²	162	141.9 Å²	141.9	76%	0.757	77%	0.771	S	S	*	*			trans	28.3	148.4	144.3	-62.2	-161.4	119.2	0	0	126.5
209	R	22.5	Very low	25.1	Very low	244 Å²	244	141.2 Å²	141.2	92%	0.921	77%	0.767	S	S	*	*			trans	76.7	130.4	145.2	-92.6	-176.4	-177.3	-148.1	1.7	121
210	G	22.8	Very low	25.1	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	76%	0.762	S	S	*	*			trans	155.9	106.4	161.8	0	0	0	0	0	113.5
211	K	24.2	Very low	25.1	Very low	203 Å²	203	141 Å²	141	88%	0.883	76%	0.76	S	S	*	*			trans	-90.8	162.5	161.9	-59.2	176.1	-176.8	175.1	0	107.1
212	T	24.2	Very low	25.2	Very low	118 Å²	118	142 Å²	142	72%	0.724	76%	0.761	S	S	*	*				-170.7	174.4	56.2	46	0	0	0	0	112.1
213	T	26	Very low	25.1	Very low	139 Å²	139	143.2 Å²	143.2	85%	0.853	77%	0.769	S	S	*	*			trans	69.6	138.1	167.4	72.5	0	0	0	0	117.5
214	G	26.4	Very low	25.6	Very low	67 Å²	67	143.8 Å²	143.8	69%	0.691	77%	0.771	S	S	*	*			cis	135.9	145.2	-27.5	0	0	0	0	0	116.1
215	Q	32.5	Very low	25.6	Very low	164 Å²	164	139 Å²	139	77%	0.766	77%	0.769	S	S	*	*			trans	76.8	148.4	174.9	-50.9	-169.6	40.2	0	0	115.2
216	K	31.6	Very low	25.9	Very low	156 Å²	156	141.1 Å²	141.1	68%	0.678	77%	0.77	S	S	*	*			cis	-170.6	164.2	-15.1	-98.1	167.9	-175.1	161.1	0	103.8
217	K	30.2	Very low	26.4	Very low	164 Å²	164	142.3 Å²	142.3	71%	0.713	77%	0.769	S	S	*	*			cis	-163.5	166.2	-22.5	-99.3	175.5	175.7	-167.9	0	103.5
218	T	30.4	Very low	26.8	Very low	121 Å²	121	147.7 Å²	147.7	74%	0.742	78%	0.78	S	S	*	*				168.9	161.7	74.7	40.2	0	0	0	0	107.2
219	L	25.1	Very low	27.4	Very low	128 Å²	128	146.8 Å²	146.8	67%	0.67	78%	0.778	S	S	*	*			cis	-158.4	121.6	-25.5	-91.3	168.4	0	0	0	103.8
220	I	24	Very low	27.6	Very low	129 Å²	129	142.8 Å²	142.8	66%	0.662	77%	0.774	S	S	*	*				74.1	106.4	82.3	-68.3	-173	0	0	0	115.2	V222	I220-V222 HydrophobicContact CG2-CG2 4.26Å
221	N	23.9	Very low	28	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	77%	0.774	S	S	*	*				-175.2	123.4	124.3	-88.4	-17.7	0	0	0	106.2
222	V	24.6	Very low	28.2	Very low	119 Å²	119	138.7 Å²	138.7	72%	0.721	77%	0.768	S	S	*	*			cis	79.9	104.1	33.4	-173.4	0	0	0	0	113.9	I220	I220-V222 HydrophobicContact CG2-CG2 4.26Å
223	V	22.6	Very low	28.4	Very low	139 Å²	139	139.9 Å²	139.9	84%	0.842	78%	0.775	S	S	*	*			trans	-168.6	157.8	134.8	142.2	0	0	0	0	107.7
224	L	34.8	Very low	28.5	Very low	159 Å²	159	139.3 Å²	139.3	83%	0.832	78%	0.775	S	S	*	*			trans	-112.7	147.4	-177.1	-64.3	161.4	0	0	0	110.8
225	T	26.1	Very low	28.6	Very low	138 Å²	138	145.4 Å²	145.4	85%	0.847	78%	0.782	S	S	*	*			trans	-165.9	147.7	139.4	19.5	0	0	0	0	114.2
226	E	29.1	Very low	28.3	Very low	174 Å²	174	145.5 Å²	145.5	81%	0.813	79%	0.785	S	S	*	*			trans	-29.3	149.2	173.4	-70.6	151.8	-158.1	0	0	123.1
227	D	30.7	Very low	28.1	Very low	136 Å²	136	143.8 Å²	143.8	73%	0.727	79%	0.787	S	S	*	*			trans	48.8	126.9	140.7	-77.9	15.5	0	0	0	124.7
228	K	29.3	Very low	28	Very low	213 Å²	213	142.3 Å²	142.3	93%	0.926	79%	0.792	S	S	*	*				-156.3	120.3	123.9	-107.4	144.9	-168.6	163.7	0	113.5
229	I	34	Very low	27.8	Very low	143 Å²	143	142.6 Å²	142.6	73%	0.733	79%	0.793	S	S	*	*			trans	-90.1	151.6	167.6	-66.2	170.1	0	0	0	109.1
230	L	26.5	Very low	28.1	Very low	160 Å²	160	145.4 Å²	145.4	84%	0.838	80%	0.803	S	S	*	*			trans	154.5	163.7	148	-83.6	160.5	0	0	0	109.8
231	P	30.6	Very low	28.3	Very low	122 Å²	122	146.2 Å²	146.2	79%	0.792	81%	0.809	S	S	*	*			cis	-126.7	173.7	-43.2	35.9	-21.7	0	0	0	112.6
232	G	29.9	Very low	28.5	Very low	73 Å²	73	146 Å²	146	75%	0.753	81%	0.814	S	S	*	*			trans	132.6	-4.5	155.3	0	0	0	0	0	119
233	V	28.1	Very low	28.7	Very low	143 Å²	143	145.7 Å²	145.7	87%	0.867	82%	0.816	S	S	*	*			trans	-109.4	106.6	177.8	-176.7	0	0	0	0	110.5
234	C	26.9	Very low	29.1	Very low	126 Å²	126	143.8 Å²	143.8	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-71.4	142.2	174.8	-64.2	0	0	0	0	111.6
235	K	30.1	Very low	28.7	Very low	195 Å²	195	145.5 Å²	145.5	85%	0.848	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75.1	150.9	-172.3	-60.9	175.7	-179.4	177.1	0	112.1	V237	K235-V237 HydrophobicContact CB-CG2 4.46Å
236	M	25.5	Very low	28.8	Very low	166 Å²	166	150.8 Å²	150.8	82%	0.818	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.9	137.2	155.4	-68.1	175.9	-68.1	0	0	108.1
237	V	27.3	Very low	28.7	Very low	120 Å²	120	151.3 Å²	151.3	73%	0.727	83%	0.826	S	S	*	*			trans	-129	131.7	175.7	176.3	0	0	0	0	109	K235	K235-V237 HydrophobicContact CB-CG2 4.46Å
238	T	27.6	Very low	28.6	Very low	133 Å²	133	150.5 Å²	150.5	82%	0.816	83%	0.831	S	S	*	*			trans	-85	138	165.5	38.6	0	0	0	0	109.1
239	V	27.7	Very low	28.4	Very low	127 Å²	127	145.6 Å²	145.6	77%	0.77	82%	0.823	S	S	*	*			trans	-97.5	113.8	177.5	-179.6	0	0	0	0	109.4
240	E	30.7	Very low	28.1	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	82%	0.822	S	S	*	*			trans	-127.6	155.1	156.7	-70.1	179	165.6	0	0	106.8
241	N	28.8	Very low	28.1	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	82%	0.82	S	S	*	*			trans	-92.7	148.6	-167.5	-62.7	-23.5	0	0	0	112.6
242	T	27.3	Very low	28.1	Very low	148 Å²	148	144.4 Å²	144.4	91%	0.908	82%	0.823	S	S	*	*			trans	-162.4	150.4	143.7	8	0	0	0	0	111.5
243	S	28.8	Very low	27.9	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	82%	0.821	S	S	*	*			trans	-81.2	137	173	-50.1	0	0	0	0	109.4
244	A	30.8	Very low	28.1	Very low	99 Å²	99	146.8 Å²	146.8	82%	0.818	82%	0.824	S	S	*	*				67.6	120.6	82.3	0	0	0	0	0	114.7
245	E	26.6	Very low	28.2	Very low	194 Å²	194	147.7 Å²	147.7	91%	0.907	82%	0.815	S	S	*	*			trans	-113.7	156	172.5	-68.3	-178	143	0	0	111.2
246	R	29.2	Very low	28.2	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	81%	0.809	S	S	*	*			trans	-139.9	140.5	157.5	-87	-174.3	171.2	178.6	-3.5	107.6
247	E	26.8	Very low	28.3	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	80%	0.801	S	S	*	*			trans	-89.4	177.9	178	-64.2	-173	116.3	0	0	112.8
248	S	27.1	Very low	28.4	Very low	118 Å²	118	145.3 Å²	145.3	83%	0.825	81%	0.805	S	S	*	*			trans	74	132.8	178.9	70.7	0	0	0	0	116.5
249	S	26.8	Very low	28.4	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	79%	0.794	S	S	*	*			cis	-164.9	143.2	-8.2	47.3	0	0	0	0	114.3
250	A	27.4	Very low	28.4	Very low	86 Å²	86	142.7 Å²	142.7	71%	0.711	80%	0.802	S	S	*	*			trans	65.6	131.1	150	0	0	0	0	0	122.7
251	T	26.8	Very low	28.1	Very low	128 Å²	128	137.7 Å²	137.7	79%	0.785	80%	0.801	S	S	*	*			trans	64.4	148.7	154.1	49.8	0	0	0	0	118.7
252	Q	29.4	Very low	27.9	Very low	186 Å²	186	133.9 Å²	133.9	87%	0.869	80%	0.796	S	S	*	*			cis	-160.5	160.2	1.7	-126.1	170.3	1.2	0	0	110.8
253	G	26.8	Very low	27.8	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	80%	0.797	S	S	*	*			trans	80.1	141.1	173.5	0	0	0	0	0	115.2
254	Q	31.1	Very low	27.5	Very low	197 Å²	197	133.2 Å²	133.2	92%	0.921	80%	0.797	S	S	*	*			cis	60	120.7	34.6	-62.4	-175.9	-12.6	0	0	113.2
255	H	30.6	Very low	27.4	Very low	145 Å²	145	134.3 Å²	134.3	67%	0.671	80%	0.797	S	S	*	*			cis	-144.6	-165.4	3.8	-149.6	-159.6	0	0	0	108.9
256	Q	29.9	Very low	27.5	Very low	153 Å²	153	133.5 Å²	133.5	72%	0.715	79%	0.793	S	S	*	*			cis	-160.6	142.1	10.8	-155.9	152.6	-97.5	0	0	106.2
257	L	27.7	Very low	27.4	Very low	123 Å²	123	128.5 Å²	128.5	64%	0.644	79%	0.785	S	S	*	*				39.5	132.3	84.3	-65.4	175	0	0	0	114.5
258	L	28.5	Very low	27.4	Very low	156 Å²	156	126 Å²	126	82%	0.817	78%	0.778	S	S	*	*			cis	-160.5	-178.9	7	-86	145.1	0	0	0	106.5
259	A	27.1	Very low	27.5	Very low	70 Å²	70	129.5 Å²	129.5	58%	0.579	78%	0.781	S	S	*	*			cis	163.3	151.6	-30	0	0	0	0	0	107.9
260	S	28.4	Very low	27.7	Very low	134 Å²	134	130.5 Å²	130.5	94%	0.937	78%	0.783	S	S	*	*			trans	59.2	160.4	169.6	52.2	0	0	0	0	118.3
261	G	24.7	Very low	28.6	Very low	83 Å²	83	131.2 Å²	131.2	86%	0.856	78%	0.78	S	S	*	*			cis	-153.2	-156.6	-5.5	0	0	0	0	0	108.4
262	G	24.8	Very low	28.6	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	78%	0.778	S	S	*	*			cis	148.7	95.1	-6.5	0	0	0	0	0	114.1
263	T	23.7	Very low	28.7	Very low	152 Å²	152	130.7 Å²	130.7	93%	0.933	77%	0.768	S	S	*	*			trans	64.9	167.5	173.9	67.8	0	0	0	0	116.1
264	A	24.1	Very low	28.7	Very low	94 Å²	94	134.6 Å²	134.6	78%	0.777	77%	0.768	S	S	*	*			cis	-144.2	-151.1	8	0	0	0	0	0	112.6
265	C	27.3	Very low	28.7	Very low	121 Å²	121	131.1 Å²	131.1	82%	0.818	76%	0.755	S	S	*	*			trans	-126.2	179.9	-166	-58.5	0	0	0	0	115.9
266	E	28.9	Very low	28.7	Very low	178 Å²	178	128.8 Å²	128.8	83%	0.832	76%	0.756	S	S	*	*			trans	82.4	128.5	161.1	-53.9	-169.4	141.1	0	0	120.8
267	N	28.1	Very low	28.6	Very low	145 Å²	145	126.4 Å²	126.4	78%	0.775	76%	0.756	S	S	*	*				-174.7	138	118.1	-105	-73.7	0	0	0	117.1
268	N	25.6	Very low	28.8	Very low	132 Å²	132	126.8 Å²	126.8	71%	0.706	76%	0.758	S	S	*	*			trans	-9.6	138.8	157.2	-61.9	-79.9	0	0	0	123.5
269	Q	29.3	Very low	28.8	Very low	191 Å²	191	125.6 Å²	125.6	89%	0.893	75%	0.752	S	S	*	*				176.7	177.7	107.9	-94.6	173.5	18.8	0	0	115.9
270	T	31.2	Very low	28.7	Very low	132 Å²	132	130.8 Å²	130.8	81%	0.81	76%	0.762	S	S	*	*			trans	-106	-175.3	-163.1	51.3	0	0	0	0	114.4
271	P	45.8	Very low	28.5	Very low	100 Å²	100	130.1 Å²	130.1	65%	0.649	76%	0.757	S	S	*	*			cis	-135.6	173.5	-3.4	42.6	-25.9	0	0	0	117.3
272	Q	28.3	Very low	28.4	Very low	160 Å²	160	129.3 Å²	129.3	75%	0.748	75%	0.749	S	S	*	*			trans	55.5	151.4	146.4	-85.7	171.6	-63.8	0	0	121.4
273	E	29.7	Very low	28.2	Very low	143 Å²	143	132.1 Å²	132.1	67%	0.668	75%	0.753	S	S	*	*			cis	-161.1	171.6	-7.1	-148.1	156.5	-126.7	0	0	110.4
274	E	28.2	Very low	28.2	Very low	151 Å²	151	131.4 Å²	131.4	71%	0.706	75%	0.748	S	S	*	*			trans	61.8	148	165.7	-66.2	-62.4	82.1	0	0	119.9
275	L	30.1	Very low	28.2	Very low	124 Å²	124	131.6 Å²	131.6	65%	0.649	75%	0.75	S	S	*	*			cis	-162.6	127.4	-14.7	172.8	64.3	0	0	0	111.5
276	S	31.4	Very low	28.1	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	75%	0.746	S	S	*	*			trans	54.9	149.9	158.2	-64.9	0	0	0	0	120.9
277	S	28.3	Very low	27.9	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	74%	0.744	S	S	*	*			cis	-152.7	130.7	4.9	28.2	0	0	0	0	109.5
278	N	32.2	Very low	27.9	Very low	131 Å²	131	127.5 Å²	127.5	70%	0.701	75%	0.749	S	S	*	*				76	145.9	76.9	-62.2	-28.8	0	0	0	113.8
279	L	28.2	Very low	28.1	Very low	131 Å²	131	131 Å²	131	69%	0.686	76%	0.758	S	S	*	*			cis	-165	164.9	-0.4	-130.4	29.3	0	0	0	107.3
280	K	24.6	Very low	27.9	Very low	180 Å²	180	125.4 Å²	125.4	78%	0.783	75%	0.751	S	S	*	*			cis	-158	170.9	-2.9	-146.7	169.5	-159.5	170.8	0	110.5
281	S	23	Very low	27.6	Very low	119 Å²	119	128.2 Å²	128.2	83%	0.832	75%	0.753	S	S	*	*			trans	-71	168	171	-25	0	0	0	0	114.4
282	G	22.9	Very low	26.5	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	75%	0.753	S	S	*	*			trans	-174.4	69.3	175.2	0	0	0	0	0	120.4
283	T	20.8	Very low	26.7	Very low	125 Å²	125	130.1 Å²	130.1	77%	0.767	75%	0.753	S	S	*	*			trans	39.2	131.6	140.4	39.7	0	0	0	0	124.9
284	T	23.4	Very low	26.4	Very low	136 Å²	136	134 Å²	134	83%	0.834	76%	0.763	S	S	*	*			trans	79.1	161.2	135.4	59.5	0	0	0	0	123.4
285	A	25.3	Very low	26.4	Very low	99 Å²	99	131.4 Å²	131.4	82%	0.818	76%	0.761	S	S	*	*			trans	97.3	116.2	154.4	0	0	0	0	0	120.2
286	S	24.3	Very low	26.5	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	77%	0.768	S	S	*	*			trans	-65	153.3	179.3	-48.5	0	0	0	0	116.8
287	T	25.6	Very low	26.3	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	77%	0.771	S	S	*	*			trans	55	115.6	141.1	53.7	0	0	0	0	120.5
288	S	27.5	Very low	26.4	Very low	125 Å²	125	138.5 Å²	138.5	87%	0.874	77%	0.77	S	S	*	*				166.8	177.2	93	58.4	0	0	0	0	113.3
289	K	30.4	Very low	26.1	Very low	205 Å²	205	138.8 Å²	138.8	89%	0.891	77%	0.771	S	S	*	*			trans	-95.1	145.7	-163.6	-53.6	159.9	-179.8	169.8	0	112.6
290	G	25.6	Very low	26.1	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	78%	0.782	S	S	*	*			trans	-179.8	101.4	163.6	0	0	0	0	0	118.3
291	F	23.1	Very low	26.3	Very low	192 Å²	192	133.3 Å²	133.3	84%	0.842	78%	0.779	S	S	*	*			trans	44	134.9	146.3	-82.6	-96.6	0	0	0	125.1
292	Q	24.4	Very low	26.8	Very low	143 Å²	143	135.1 Å²	135.1	67%	0.668	78%	0.779	S	S	*	*			trans	44.4	104.5	145.6	-75.8	-176.8	-79.8	0	0	122.9
293	E	31.2	Very low	27.1	Very low	157 Å²	157	139.3 Å²	139.3	73%	0.734	79%	0.785	S	S	*	*				57.1	88.3	108	-169.2	175.4	-143.6	0	0	119
294	Y	24.3	Very low	28	Very low	224 Å²	224	138.6 Å²	138.6	88%	0.878	78%	0.782	S	S	*	*			trans	-145.1	136	139.5	-79.1	-67.3	0	0	0	113
295	S	26.9	Very low	28.5	Very low	97 Å²	97	141.7 Å²	141.7	68%	0.678	79%	0.787	S	S	*	*			trans	23.7	117.3	157	-58.8	0	0	0	0	123.2
296	I	34	Very low	28.7	Very low	155 Å²	155	141.2 Å²	141.2	80%	0.795	78%	0.778	S	S	*	*				44.7	114.7	120.6	-49.4	159.7	0	0	0	116.2
297	K	26.3	Very low	29.7	Very low	170 Å²	170	146.7 Å²	146.7	74%	0.739	79%	0.788	S	S	*	*				-156.9	145.4	81.1	-83.9	176.8	-176.9	178.2	0	113
298	Q	30.6	Very low	30.5	Very low	147 Å²	147	145.9 Å²	145.9	69%	0.687	78%	0.779	S	S	*	*			trans	51.7	138.3	136.4	-60.6	-178	-101.7	0	0	121
299	D	26	Very low	31.3	Very low	136 Å²	136	148 Å²	148	73%	0.727	77%	0.772	S	S	*	*			cis	-145.1	149.6	-12.3	-95.8	-41.9	0	0	0	109.5
300	A	27.3	Very low	33.1	Very low	109 Å²	109	143.9 Å²	143.9	90%	0.901	76%	0.759	S	S	*	*			trans	-96.5	104.4	-159.4	0	0	0	0	0	114.3
301	A	29.8	Very low	35.4	Very low	87 Å²	87	142.8 Å²	142.8	72%	0.719	73%	0.733	S	S	*	*			trans	-140.5	66.5	176	0	0	0	0	0	114.1
302	N	33.4	Very low	37.9	Very low	158 Å²	158	136 Å²	136	85%	0.845	71%	0.713	S	S	*	*			trans	-169	162	145.8	-119.7	-68.4	0	0	0	115.7
303	L	28.8	Very low	40.7	Very low	154 Å²	154	129.2 Å²	129.2	81%	0.806	68%	0.681	S	S	*	*			trans	68	156.8	162	-124.4	65.5	0	0	0	118.6
304	P	40.8	Very low	42.6	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	68%	0.681	S	S	*	*				-122	167.5	-70.6	38.6	-29.2	0	0	0	112.7
305	Q	31.9	Very low	44.8	Very low	201 Å²	201	124 Å²	124	94%	0.939	66%	0.663	S	S	*	*			trans	-114.5	106.3	170.1	-71.9	-168.8	7	0	0	113.7
306	S	31.1	Very low	47.2	Very low	89 Å²	89	122 Å²	122	62%	0.622	65%	0.649	S	S	*	*			trans	-56.6	144.7	177.6	58.6	0	0	0	0	114.4	L308	S306-L308 PolarHBondContact O-N 3.23Å
307	K	43.9	Very low	49	Very low	220 Å²	220	119.8 Å²	119.8	96%	0.957	64%	0.639	S	S	*	*			trans	-56.2	91	168.1	-68.6	179.4	177.3	177.4	0	111.9	K309	K307-K309 PolarHBondContact O-N 3.38Å
308	L	43.9	Very low	51.1	Low	111 Å²	111	117.3 Å²	117.3	58%	0.581	63%	0.628	S	S	*	*			trans	-81.7	98.4	179	-79.8	170.9	0	0	0	111.5	S306 I310	S306-L308 PolarHBondContact O-N 3.23Å; L308-I310 VanDerWaalsContact O-CG1 3.29Å; L308-I310 WeakPolarHBondContact O-CG1 3.45Å; L308-I310 PolarHBondContact O-N 2.9Å; L308-I310 VanDerWaalsContact O-N 3.16Å
309	K	44.2	Very low	53.3	Low	169 Å²	169	115.7 Å²	115.7	74%	0.735	62%	0.623	S	S	*	*			trans	-62	115	176.3	-166.3	160.7	-171.8	162.6	0	111	K307 F311	K307-K309 PolarHBondContact O-N 3.38Å; K309-F311 HydrophobicContact CB-CE2 4.48Å; K309-F311 HydrophobicContact CG-CZ 4.28Å; K309-F311 VanDerWaalsContact O-CD2 3.29Å; K309-F311 WeakPolarHBondContact O-CD2 3.2Å; K309-F311 WeakPolarHBondContact O-CE2 3.16Å
310	I	67.8	Low	56	Low	120 Å²	120	111.4 Å²	111.4	62%	0.615	60%	0.598	S	S	*	*			trans	-87.1	136.3	-173.2	-55.2	-171	0	0	0	110.4	L308 I319	L308-I310 VanDerWaalsContact O-CG1 3.29Å; L308-I310 WeakPolarHBondContact O-CG1 3.45Å; L308-I310 PolarHBondContact O-N 2.9Å; L308-I310 VanDerWaalsContact O-N 3.16Å; I310-I319 HydrophobicContact CG2-CB 4.42Å; I310-I319 HydrophobicContact CG2-CG1 4.38Å; I310-I319 HydrophobicContact CG2-CG2 3.35Å
311	F	73.1	Confident	58.1	Low	49 Å²	49	113.2 Å²	113.2	22%	0.215	59%	0.585	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.1	106.8	-179.1	-64.8	-82.4	0	0	0	111.2	K309 F320 R323 L326	K309-F311 HydrophobicContact CB-CE2 4.48Å; K309-F311 HydrophobicContact CG-CZ 4.28Å; K309-F311 VanDerWaalsContact O-CD2 3.29Å; K309-F311 WeakPolarHBondContact O-CD2 3.2Å; K309-F311 WeakPolarHBondContact O-CE2 3.16Å; F311-F320 PolarHBondContact N-O 3.5Å; F311-F320 PolarHBondContact O-N 2.98Å; F311-R323 HydrophobicContact CD1-CB 4.03Å; F311-R323 HydrophobicContact CD1-CG 4.42Å; F311-R323 HydrophobicContact CD2-CB 4.45Å; F311-R323 HydrophobicContact CE1-CB 3.79Å; F311-R323 HydrophobicContact CE1-CG 4.25Å; F311-R323 HydrophobicContact CE2-CB 4.23Å; F311-R323 HydrophobicContact CG-CB 4.35Å; F311-R323 HydrophobicContact CZ-CB 3.9Å; F311-L326 HydrophobicContact CB-CB 4.06Å; F311-L326 HydrophobicContact CB-CD2 3.89Å
312	A	75.3	Confident	60.5	Low	51 Å²	51	114.5 Å²	114.5	42%	0.421	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.1	155.2	177	0	0	0	0	0	112.3	K318 I319 L326	A312-K318 CarbonylContact C-O 3.53Å; A312-K318 WeakPolarHBondContact CA-O 3.37Å; A312-I319 HydrophobicContact CB-CG1 4.42Å; A312-L326 WeakPolarHBondContact O-CD1 3.39Å; A312-L326 VanDerWaalsContact O-CD2 3.25Å; A312-L326 WeakPolarHBondContact O-CD2 3.41Å
313	C	83.3	Confident	62.6	Low	0 Å²	0	113.8 Å²	113.8	0%	0	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.9	105.1	178.1	174.1	0	0	0	0	111.4	F315 C316 N317 K318 F320 L326 H329 L330 H333	C313-F315 VanDerWaalsContact C-N 3.26Å; C313-F315 PolarHBondContact O-N 3.26Å; C313-F315 VanDerWaalsContact O-N 3.09Å; C313-C316 CarbonylContact O-C 3.59Å; C313-C316 PolarHBondContact O-N 3.32Å; C313-N317 VanDerWaalsContact O-CA 3.31Å; C313-N317 WeakPolarHBondContact O-CA 3.5Å; C313-N317 PolarHBondContact O-N 3.07Å; C313-N317 PolarHBondContact O-OD1 2.65Å; C313-K318 PolarHBondContact N-O 3.5Å; C313-F320 HydrophobicContact CB-CE2 4.2Å; C313-L326 HydrophobicContact CB-CD1 3.46Å; C313-L326 VanDerWaalsContact CB-CD1 3.46Å; C313-H329 PolarHBondContact SG-CD2 2.99Å; C313-L330 VanDerWaalsContact SG-CD2 3.57Å; C313-H333 PolarHBondContact SG-NE2 2.86Å; C313-H333 VanDerWaalsContact SG-NE2 3.39Å
314	E	72.4	Confident	64.9	Low	155 Å²	155	112.4 Å²	112.4	72%	0.724	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.7	-45.7	-179.1	-66	130.7	-133.8	0	0	113.7	C316 N317	E314-C316 VanDerWaalsContact C-N 3.28Å; E314-C316 PolarHBondContact O-N 2.88Å; E314-C316 VanDerWaalsContact O-N 3.16Å; E314-N317 PolarHBondContact O-OD1 3.24Å
315	F	70.3	Confident	66.8	Low	116 Å²	116	109.1 Å²	109.1	51%	0.509	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-16.4	-177.4	-59.7	-69.2	0	0	0	116.1	C313 L330 H333	C313-F315 VanDerWaalsContact C-N 3.26Å; C313-F315 PolarHBondContact O-N 3.26Å; C313-F315 VanDerWaalsContact O-N 3.09Å; F315-L330 HydrophobicContact CD2-CD2 3.72Å; F315-L330 HydrophobicContact CE2-CD2 3.99Å; F315-H333 HydrophobicContact CB-CB 4.18Å; F315-H333 HydrophobicContact CD2-CB 4.03Å; F315-H333 AromaticContact CD2-CD2 3.96Å; F315-H333 HydrophobicContact CG-CB 4.11Å
316	C	76.3	Confident	69.3	Low	56 Å²	56	100.3 Å²	100.3	38%	0.378	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.5	17.3	176.8	80.7	0	0	0	0	116.2	C313 E314 K318 H329	C313-C316 CarbonylContact O-C 3.59Å; C313-C316 PolarHBondContact O-N 3.32Å; E314-C316 VanDerWaalsContact C-N 3.28Å; E314-C316 PolarHBondContact O-N 2.88Å; E314-C316 VanDerWaalsContact O-N 3.16Å; C316-K318 PolarHBondContact O-N 3.28Å; C316-H329 PolarHBondContact SG-NE2 2.85Å
317	N	72.8	Confident	71.6	Confident	108 Å²	108	98.6 Å²	98.6	58%	0.578	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	37.8	179.3	-61.5	-16	0	0	0	115.2	C313 E314	C313-N317 VanDerWaalsContact O-CA 3.31Å; C313-N317 WeakPolarHBondContact O-CA 3.5Å; C313-N317 PolarHBondContact O-N 3.07Å; C313-N317 PolarHBondContact O-OD1 2.65Å; E314-N317 PolarHBondContact O-OD1 3.24Å
318	K	70.8	Confident	73.2	Confident	118 Å²	118	89.1 Å²	89.1	51%	0.513	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	133.6	167.7	-80.6	-177.5	-178.7	177.4	0	110.2	A312 C313 C316 F320	A312-K318 CarbonylContact C-O 3.53Å; A312-K318 WeakPolarHBondContact CA-O 3.37Å; C313-K318 PolarHBondContact N-O 3.5Å; C316-K318 PolarHBondContact O-N 3.28Å; K318-F320 HydrophobicContact CB-CE2 3.57Å; K318-F320 HydrophobicContact CB-CZ 3.79Å; K318-F320 HydrophobicContact CD-CZ 4.44Å; K318-F320 WeakPolarHBondContact O-CD2 3.41Å; K318-F320 VanDerWaalsContact O-CE2 3.31Å; K318-F320 WeakPolarHBondContact O-CE2 3.46Å
319	I	75.2	Confident	74.9	Confident	112 Å²	112	84.9 Å²	84.9	57%	0.574	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.8	-177.8	-73.8	168.1	0	0	0	110.2	I310 A312	I310-I319 HydrophobicContact CG2-CB 4.42Å; I310-I319 HydrophobicContact CG2-CG1 4.38Å; I310-I319 HydrophobicContact CG2-CG2 3.35Å; A312-I319 HydrophobicContact CB-CG1 4.42Å
320	F	82.9	Confident	76.4	Confident	46 Å²	46	78.8 Å²	78.8	20%	0.202	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.4	179	-59.7	-86.8	0	0	0	110.6	F311 C313 K318 F322 L326 H329	F311-F320 PolarHBondContact N-O 3.5Å; F311-F320 PolarHBondContact O-N 2.98Å; C313-F320 HydrophobicContact CB-CE2 4.2Å; K318-F320 HydrophobicContact CB-CE2 3.57Å; K318-F320 HydrophobicContact CB-CZ 3.79Å; K318-F320 HydrophobicContact CD-CZ 4.44Å; K318-F320 WeakPolarHBondContact O-CD2 3.41Å; K318-F320 VanDerWaalsContact O-CE2 3.31Å; K318-F320 WeakPolarHBondContact O-CE2 3.46Å; F320-F322 PolarHBondContact O-N 3.38Å; F320-L326 HydrophobicContact CB-CB 4.33Å; F320-L326 HydrophobicContact CD2-CB 4.07Å; F320-L326 HydrophobicContact CD2-CD1 4.04Å; F320-L326 HydrophobicContact CE2-CD1 4.29Å; F320-L326 HydrophobicContact CG-CB 4.35Å; F320-H329 HydrophobicContact CE1-CB 3.98Å; F320-H329 HydrophobicContact CE2-CB 3.93Å; F320-H329 AromaticContact CE2-CD2 3.31Å; F320-H329 WeakPolarHBondContact CE2-CD2 3.49Å; F320-H329 AromaticContact CE2-CG 3.81Å; F320-H329 HydrophobicContact CZ-CB 3.45Å; F320-H329 VanDerWaalsContact CZ-CB 3.45Å; F320-H329 AromaticContact CZ-CD2 3.3Å; F320-H329 WeakPolarHBondContact CZ-CD2 3.27Å; F320-H329 AromaticContact CZ-CG 3.36Å
321	K	72.9	Confident	77	Confident	147 Å²	147	76.4 Å²	76.4	64%	0.639	37%	0.373	S	S	*	.	S	Bend	trans	-72.6	-13.3	176.4	-64.5	-165.1	174.5	-162.9	0	113.9
322	F	79.9	Confident	77	Confident	114 Å²	114	78.1 Å²	78.1	50%	0.5	39%	0.387	S	S	.	.	S	Bend	trans	-145.4	140	-173.6	-53.7	-66.6	0	0	0	112.3	F320 H324 S325 L326	F320-F322 PolarHBondContact O-N 3.38Å; F322-H324 VanDerWaalsContact C-N 3.3Å; F322-H324 WeakPolarHBondContact CB-CE1 3.27Å; F322-H324 AromaticContact CD2-CE1 3.79Å; F322-H324 AromaticContact CG-CE1 3.64Å; F322-H324 PolarHBondContact O-N 2.85Å; F322-S325 WeakPolarHBondContact O-CB 3.28Å; F322-S325 PolarHBondContact O-N 2.85Å; F322-L326 PolarHBondContact O-N 3.1Å; F322-L326 VanDerWaalsContact O-N 3.16Å
323	R	77	Confident	77	Confident	143 Å²	143	78.7 Å²	78.7	54%	0.54	38%	0.381	S	S	.	.	H	α-helix	trans	-54.2	-40.7	178.1	-174.3	173.4	170.6	90.1	-5.5	113.2	F311 S325 L326 V327	F311-R323 HydrophobicContact CD1-CB 4.03Å; F311-R323 HydrophobicContact CD1-CG 4.42Å; F311-R323 HydrophobicContact CD2-CB 4.45Å; F311-R323 HydrophobicContact CE1-CB 3.79Å; F311-R323 HydrophobicContact CE1-CG 4.25Å; F311-R323 HydrophobicContact CE2-CB 4.23Å; F311-R323 HydrophobicContact CG-CB 4.35Å; F311-R323 HydrophobicContact CZ-CB 3.9Å; R323-S325 VanDerWaalsContact C-N 3.26Å; R323-S325 PolarHBondContact O-N 2.95Å; R323-L326 WeakPolarHBondContact O-CB 3.02Å; R323-L326 PolarHBondContact O-N 3.09Å; R323-V327 HydrophobicContact CG-CG2 4.49Å; R323-V327 WeakPolarHBondContact O-CG2 3.45Å; R323-V327 PolarHBondContact O-N 2.66Å
324	H	77.6	Confident	76.3	Confident	126 Å²	126	81.9 Å²	81.9	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-63.4	-32.4	178.1	70.2	-105	0	0	0	112.6	F322 A328	F322-H324 VanDerWaalsContact C-N 3.3Å; F322-H324 WeakPolarHBondContact CB-CE1 3.27Å; F322-H324 AromaticContact CD2-CE1 3.79Å; F322-H324 AromaticContact CG-CE1 3.64Å; F322-H324 PolarHBondContact O-N 2.85Å; H324-A328 VanDerWaalsContact O-CB 3.28Å; H324-A328 WeakPolarHBondContact O-CB 3.44Å; H324-A328 PolarHBondContact O-N 2.9Å
325	S	80.9	Confident	76.1	Confident	41 Å²	41	82.8 Å²	82.8	29%	0.287	40%	0.402	S	S	.	.	H	α-helix	trans	-75.4	-35.8	178.1	-73.4	0	0	0	0	111.3	F322 R323 H329	F322-S325 WeakPolarHBondContact O-CB 3.28Å; F322-S325 PolarHBondContact O-N 2.85Å; R323-S325 VanDerWaalsContact C-N 3.26Å; R323-S325 PolarHBondContact O-N 2.95Å; S325-H329 WeakPolarHBondContact O-CB 3.44Å; S325-H329 PolarHBondContact O-N 3.05Å; S325-H329 VanDerWaalsContact O-N 3.12Å
326	L	83	Confident	76.1	Confident	15 Å²	15	82.6 Å²	82.6	8%	0.079	40%	0.403	C	S	.	.	H	α-helix	trans	-61.2	-51.7	167.8	170.7	60.6	0	0	0	111.1	F311 A312 C313 F320 F322 R323 A328 H329 L330	F311-L326 HydrophobicContact CB-CB 4.06Å; F311-L326 HydrophobicContact CB-CD2 3.89Å; A312-L326 WeakPolarHBondContact O-CD1 3.39Å; A312-L326 VanDerWaalsContact O-CD2 3.25Å; A312-L326 WeakPolarHBondContact O-CD2 3.41Å; C313-L326 HydrophobicContact CB-CD1 3.46Å; C313-L326 VanDerWaalsContact CB-CD1 3.46Å; F320-L326 HydrophobicContact CB-CB 4.33Å; F320-L326 HydrophobicContact CD2-CB 4.07Å; F320-L326 HydrophobicContact CD2-CD1 4.04Å; F320-L326 HydrophobicContact CE2-CD1 4.29Å; F320-L326 HydrophobicContact CG-CB 4.35Å; F322-L326 PolarHBondContact O-N 3.1Å; F322-L326 VanDerWaalsContact O-N 3.16Å; R323-L326 WeakPolarHBondContact O-CB 3.02Å; R323-L326 PolarHBondContact O-N 3.09Å; L326-A328 VanDerWaalsContact C-N 3.32Å; L326-A328 PolarHBondContact O-N 2.71Å; L326-H329 CarbonylContact O-C 3.25Å; L326-H329 WeakPolarHBondContact O-CA 3.26Å; L326-H329 WeakPolarHBondContact O-CB 3.39Å; L326-H329 PolarHBondContact O-N 3.23Å; L326-L330 HydrophobicContact CD1-CD1 4.08Å; L326-L330 HydrophobicContact CD1-CD2 4.18Å; L326-L330 HydrophobicContact CD1-CG 3.85Å; L326-L330 HydrophobicContact CD2-CD1 4.5Å; L326-L330 HydrophobicContact CG-CD1 3.91Å; L326-L330 HydrophobicContact CG-CG 4.18Å; L326-L330 WeakPolarHBondContact O-CG 3.35Å; L326-L330 PolarHBondContact O-N 2.79Å
327	V	79.4	Confident	76.1	Confident	54 Å²	54	85.4 Å²	85.4	33%	0.327	41%	0.408	S	S	.	.	H	α-helix	trans	-60.1	-40.9	179.9	172.1	0	0	0	0	112.1	R323 H329 L330 R331	R323-V327 HydrophobicContact CG-CG2 4.49Å; R323-V327 WeakPolarHBondContact O-CG2 3.45Å; R323-V327 PolarHBondContact O-N 2.66Å; V327-H329 PolarHBondContact O-N 3.33Å; V327-L330 PolarHBondContact O-N 3.16Å; V327-R331 PolarHBondContact O-N 3.49Å
328	A	77.9	Confident	76.4	Confident	21 Å²	21	83.7 Å²	83.7	17%	0.174	40%	0.403	C	S	.	.	H	α-helix	trans	-61.5	-30	173	0	0	0	0	0	113.1	H324 L326 I350	H324-A328 VanDerWaalsContact O-CB 3.28Å; H324-A328 WeakPolarHBondContact O-CB 3.44Å; H324-A328 PolarHBondContact O-N 2.9Å; L326-A328 VanDerWaalsContact C-N 3.32Å; L326-A328 PolarHBondContact O-N 2.71Å; A328-I350 HydrophobicContact CB-CD1 3.86Å; A328-I350 HydrophobicContact CB-CG1 3.96Å
329	H	79.1	Confident	76.8	Confident	22 Å²	22	80.7 Å²	80.7	10%	0.102	39%	0.39	C	S	.	.	H	α-helix	trans	-83.8	-36.3	175	175	48.1	0	0	0	113.5	C313 C316 F320 S325 L326 V327 R331 T332 H333	C313-H329 PolarHBondContact SG-CD2 2.99Å; C316-H329 PolarHBondContact SG-NE2 2.85Å; F320-H329 HydrophobicContact CE1-CB 3.98Å; F320-H329 HydrophobicContact CE2-CB 3.93Å; F320-H329 AromaticContact CE2-CD2 3.31Å; F320-H329 WeakPolarHBondContact CE2-CD2 3.49Å; F320-H329 AromaticContact CE2-CG 3.81Å; F320-H329 HydrophobicContact CZ-CB 3.45Å; F320-H329 VanDerWaalsContact CZ-CB 3.45Å; F320-H329 AromaticContact CZ-CD2 3.3Å; F320-H329 WeakPolarHBondContact CZ-CD2 3.27Å; F320-H329 AromaticContact CZ-CG 3.36Å; S325-H329 WeakPolarHBondContact O-CB 3.44Å; S325-H329 PolarHBondContact O-N 3.05Å; S325-H329 VanDerWaalsContact O-N 3.12Å; L326-H329 CarbonylContact O-C 3.25Å; L326-H329 WeakPolarHBondContact O-CA 3.26Å; L326-H329 WeakPolarHBondContact O-CB 3.39Å; L326-H329 PolarHBondContact O-N 3.23Å; V327-H329 PolarHBondContact O-N 3.33Å; H329-R331 PolarHBondContact O-N 2.93Å; H329-T332 PolarHBondContact CE1-OG1 2.6Å; H329-T332 VanDerWaalsContact CE1-OG1 3.31Å; H329-T332 PolarHBondContact ND1-OG1 3.22Å; H329-T332 WeakPolarHBondContact O-CA 3.44Å; H329-T332 WeakPolarHBondContact O-CB 3.32Å; H329-T332 PolarHBondContact O-N 3.13Å; H329-T332 PolarHBondContact O-OG1 3.4Å; H329-H333 AromaticContact CD2-NE2 3.99Å; H329-H333 AromaticContact CE1-CE1 3.9Å; H329-H333 AromaticContact CE1-NE2 3.27Å; H329-H333 PolarHBondContact CE1-NE2 2.83Å; H329-H333 VanDerWaalsContact CE1-NE2 3.27Å; H329-H333 AromaticContact NE2-CD2 3.99Å; H329-H333 AromaticContact NE2-CE1 4Å; H329-H333 AromaticContact NE2-NE2 3.11Å; H329-H333 PolarHBondContact NE2-NE2 2.93Å; H329-H333 VanDerWaalsContact NE2-NE2 3.11Å
330	L	76.7	Confident	77.1	Confident	41 Å²	41	82.2 Å²	82.2	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-56.4	-36.9	176.3	-72.3	170.2	0	0	0	111.5	C313 F315 L326 V327 T332 H333 T334	C313-L330 VanDerWaalsContact SG-CD2 3.57Å; F315-L330 HydrophobicContact CD2-CD2 3.72Å; F315-L330 HydrophobicContact CE2-CD2 3.99Å; L326-L330 HydrophobicContact CD1-CD1 4.08Å; L326-L330 HydrophobicContact CD1-CD2 4.18Å; L326-L330 HydrophobicContact CD1-CG 3.85Å; L326-L330 HydrophobicContact CD2-CD1 4.5Å; L326-L330 HydrophobicContact CG-CD1 3.91Å; L326-L330 HydrophobicContact CG-CG 4.18Å; L326-L330 WeakPolarHBondContact O-CG 3.35Å; L326-L330 PolarHBondContact O-N 2.79Å; V327-L330 PolarHBondContact O-N 3.16Å; L330-T332 PolarHBondContact O-N 3.18Å; L330-T332 VanDerWaalsContact O-N 3.1Å; L330-H333 WeakPolarHBondContact O-CB 3.35Å; L330-H333 PolarHBondContact O-N 3.22Å; L330-T334 PolarHBondContact O-N 2.14Å; L330-T334 VanDerWaalsContact O-N 3.14Å
331	R	81.1	Confident	77.4	Confident	70 Å²	70	80.7 Å²	80.7	26%	0.264	39%	0.389	S	S	.	.	H	α-helix	trans	-60.3	-16.9	171.9	-68.8	174.4	-177	160	3.1	115.1	V327 H329 H333 T334 K335 A349	V327-R331 PolarHBondContact O-N 3.49Å; H329-R331 PolarHBondContact O-N 2.93Å; R331-H333 VanDerWaalsContact C-N 3.33Å; R331-T334 WeakPolarHBondContact CA-OG1 3.46Å; R331-K335 WeakPolarHBondContact O-CA 3.46Å; R331-K335 PolarHBondContact O-N 2.74Å; R331-K335 VanDerWaalsContact O-N 3.13Å; R331-A349 HydrophobicContact CB-CB 3.77Å; R331-A349 WeakPolarHBondContact CD-O 3.16Å; R331-A349 PolarHBondContact NH1-O 3.27Å; R331-A349 VanDerWaalsContact NH1-O 3.15Å
332	T	72.6	Confident	77.7	Confident	84 Å²	84	78.7 Å²	78.7	52%	0.515	39%	0.391	S	S	.	.	H	α-helix	trans	-78.3	-18.7	171.7	70	0	0	0	0	113	H329 L330	H329-T332 PolarHBondContact CE1-OG1 2.6Å; H329-T332 VanDerWaalsContact CE1-OG1 3.31Å; H329-T332 PolarHBondContact ND1-OG1 3.22Å; H329-T332 WeakPolarHBondContact O-CA 3.44Å; H329-T332 WeakPolarHBondContact O-CB 3.32Å; H329-T332 PolarHBondContact O-N 3.13Å; H329-T332 PolarHBondContact O-OG1 3.4Å; L330-T332 PolarHBondContact O-N 3.18Å; L330-T332 VanDerWaalsContact O-N 3.1Å
333	H	75.6	Confident	77.5	Confident	63 Å²	63	78.9 Å²	78.9	29%	0.292	39%	0.394	S	S	.	.	H	α-helix	trans	-91.8	-47	173.6	-58	-65.5	0	0	0	111.6	C313 F315 H329 L330 R331 K335	C313-H333 PolarHBondContact SG-NE2 2.86Å; C313-H333 VanDerWaalsContact SG-NE2 3.39Å; F315-H333 HydrophobicContact CB-CB 4.18Å; F315-H333 HydrophobicContact CD2-CB 4.03Å; F315-H333 AromaticContact CD2-CD2 3.96Å; F315-H333 HydrophobicContact CG-CB 4.11Å; H329-H333 AromaticContact CD2-NE2 3.99Å; H329-H333 AromaticContact CE1-CE1 3.9Å; H329-H333 AromaticContact CE1-NE2 3.27Å; H329-H333 PolarHBondContact CE1-NE2 2.83Å; H329-H333 VanDerWaalsContact CE1-NE2 3.27Å; H329-H333 AromaticContact NE2-CD2 3.99Å; H329-H333 AromaticContact NE2-CE1 4Å; H329-H333 AromaticContact NE2-NE2 3.11Å; H329-H333 PolarHBondContact NE2-NE2 2.93Å; H329-H333 VanDerWaalsContact NE2-NE2 3.11Å; L330-H333 WeakPolarHBondContact O-CB 3.35Å; L330-H333 PolarHBondContact O-N 3.22Å; R331-H333 VanDerWaalsContact C-N 3.33Å; H333-K335 PolarHBondContact O-N 3.36Å
334	T	69	Low	78	Confident	67 Å²	67	74.6 Å²	74.6	41%	0.411	39%	0.385	S	S	.	.	H	α-helix	trans	-67.8	-18.7	175.8	65.8	0	0	0	0	113.1	L330 R331 E336	L330-T334 PolarHBondContact O-N 2.14Å; L330-T334 VanDerWaalsContact O-N 3.14Å; R331-T334 WeakPolarHBondContact CA-OG1 3.46Å; T334-E336 VanDerWaalsContact CB-OE2 3.3Å; T334-E336 WeakPolarHBondContact CB-OE2 3.19Å; T334-E336 PolarHBondContact O-N 3.29Å; T334-E336 VanDerWaalsContact OG1-CD 3.24Å; T334-E336 WeakPolarHBondContact OG1-CG 3.41Å; T334-E336 PolarHBondContact OG1-N 3.11Å; T334-E336 PolarHBondContact OG1-OE2 3.48Å
335	K	66.7	Low	78.1	Confident	175 Å²	175	76.9 Å²	76.9	76%	0.761	40%	0.402	S	S	*	.			trans	64.3	6.6	-174.9	-56.2	167.3	-173.1	157	0	114.6	R331 H333	R331-K335 WeakPolarHBondContact O-CA 3.46Å; R331-K335 PolarHBondContact O-N 2.74Å; R331-K335 VanDerWaalsContact O-N 3.13Å; H333-K335 PolarHBondContact O-N 3.36Å
336	E	71.1	Confident	78.3	Confident	112 Å²	112	79.1 Å²	79.1	52%	0.523	41%	0.405	S	S	.	.			trans	-61.4	136.1	175.5	-64.4	161.8	141.5	0	0	110.6	T334	T334-E336 VanDerWaalsContact CB-OE2 3.3Å; T334-E336 WeakPolarHBondContact CB-OE2 3.19Å; T334-E336 PolarHBondContact O-N 3.29Å; T334-E336 VanDerWaalsContact OG1-CD 3.24Å; T334-E336 WeakPolarHBondContact OG1-CG 3.41Å; T334-E336 PolarHBondContact OG1-N 3.11Å; T334-E336 PolarHBondContact OG1-OE2 3.48Å
337	K	77.1	Confident	78.3	Confident	115 Å²	115	79.1 Å²	79.1	50%	0.5	41%	0.407	S	S	.	.			trans	-129.4	74.4	-179.9	-72.1	164.3	157.1	-130.1	0	109.7	F339 A347 S348	K337-F339 PolarHBondContact O-N 3.29Å; K337-F339 VanDerWaalsContact O-N 3.12Å; K337-A347 HydrophobicContact CB-CB 3.67Å; K337-A347 HydrophobicContact CD-CB 4.06Å; K337-A347 WeakPolarHBondContact CD-O 3.47Å; K337-A347 WeakPolarHBondContact CE-O 3.47Å; K337-A347 HydrophobicContact CG-CB 4.43Å; K337-A347 PolarHBondContact NZ-O 3.25Å; K337-S348 CarbonylContact C-O 3.39Å; K337-S348 VanDerWaalsContact C-O 3.3Å; K337-S348 WeakPolarHBondContact CA-O 3.44Å
338	P	78.3	Confident	78.4	Confident	71 Å²	71	77 Å²	77	46%	0.461	39%	0.394	S	S	.	.			trans	-64.6	-19.4	-172	-22.1	34.9	0	0	0	114
339	F	79.2	Confident	78.5	Confident	56 Å²	56	76.8 Å²	76.8	25%	0.246	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	85.1	-176.4	-54.2	-72.1	0	0	0	109.9	K337 A347 S348 I350 K351 L354	K337-F339 PolarHBondContact O-N 3.29Å; K337-F339 VanDerWaalsContact O-N 3.12Å; F339-A347 WeakPolarHBondContact O-CA 3.24Å; F339-S348 WeakPolarHBondContact CB-O 3.4Å; F339-S348 PolarHBondContact N-O 3.48Å; F339-S348 VanDerWaalsContact N-O 3.09Å; F339-S348 PolarHBondContact O-N 3.06Å; F339-I350 VanDerWaalsContact CD2-C 3.5Å; F339-K351 HydrophobicContact CD1-CB 3.95Å; F339-K351 HydrophobicContact CD1-CG 4.18Å; F339-K351 HydrophobicContact CD2-CB 4.43Å; F339-K351 VanDerWaalsContact CD2-N 3.34Å; F339-K351 HydrophobicContact CE1-CB 3.79Å; F339-K351 HydrophobicContact CE1-CD 4.33Å; F339-K351 HydrophobicContact CE1-CG 4.17Å; F339-K351 HydrophobicContact CE2-CB 4.28Å; F339-K351 HydrophobicContact CG-CB 4.27Å; F339-K351 HydrophobicContact CZ-CB 3.96Å; F339-L354 HydrophobicContact CB-CB 3.97Å; F339-L354 HydrophobicContact CB-CD2 3.79Å; F339-L354 HydrophobicContact CB-CG 4.47Å
340	Q	81.5	Confident	78.6	Confident	144 Å²	144	78.9 Å²	78.9	67%	0.673	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	152.7	173.9	-49.7	-164.8	11.6	0	0	111.1	A347 L354	Q340-A347 HydrophobicContact CB-CB 4.26Å; Q340-A347 HydrophobicContact CG-CB 3.85Å; Q340-L354 VanDerWaalsContact O-CD2 3.26Å; Q340-L354 WeakPolarHBondContact O-CD2 3.46Å
341	C	87.9	Confident	78.8	Confident	13 Å²	13	83.3 Å²	83.3	9%	0.088	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.2	176	-177.7	0	0	0	0	110.6	H343 C344 Y346 L354 H357 H361	C341-H343 PolarHBondContact O-N 2.93Å; C341-H343 VanDerWaalsContact O-N 3.11Å; C341-C344 WeakPolarHBondContact CB-O 3.29Å; C341-C344 VanDerWaalsContact O-O 3.07Å; C341-Y346 VanDerWaalsContact CB-O 3.25Å; C341-Y346 WeakPolarHBondContact CB-O 3.26Å; C341-Y346 PolarHBondContact N-O 3.31Å; C341-L354 HydrophobicContact CB-CD1 3.79Å; C341-H357 VanDerWaalsContact SG-CD2 3.55Å; C341-H361 PolarHBondContact SG-NE2 2.85Å
342	P	79.9	Confident	78.8	Confident	105 Å²	105	82.8 Å²	82.8	68%	0.682	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.9	176.9	-22.3	34.6	0	0	0	114.8
343	H	76.8	Confident	79.2	Confident	119 Å²	119	82.6 Å²	82.6	55%	0.551	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-4.2	-170.4	-51.6	-58.1	0	0	0	114.2	C341 H361	C341-H343 PolarHBondContact O-N 2.93Å; C341-H343 VanDerWaalsContact O-N 3.11Å; H343-H361 HydrophobicContact CB-CB 4.26Å
344	C	85.9	Confident	79.5	Confident	52 Å²	52	80.4 Å²	80.4	35%	0.351	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	169.2	168.3	66.9	0	0	0	0	112.4	C341 Y346 H357 H361	C341-C344 WeakPolarHBondContact CB-O 3.29Å; C341-C344 VanDerWaalsContact O-O 3.07Å; C344-Y346 PolarHBondContact O-N 3.21Å; C344-H357 PolarHBondContact SG-NE2 3.35Å; C344-H361 PolarHBondContact SG-NE2 3.04Å
345	D	81.1	Confident	80	Confident	175 Å²	175	81 Å²	81	94%	0.936	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.2	7.3	-179.6	-35.4	-28	0	0	0	116.3	A347	D345-A347 PolarHBondContact O-N 3.09Å
346	Y	83.9	Confident	80.6	Confident	88 Å²	88	76 Å²	76	35%	0.345	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	106.4	177	-178.4	-95.2	0	0	0	111.4	C341 C344 S348 H357	C341-Y346 VanDerWaalsContact CB-O 3.25Å; C341-Y346 WeakPolarHBondContact CB-O 3.26Å; C341-Y346 PolarHBondContact N-O 3.31Å; C344-Y346 PolarHBondContact O-N 3.21Å; Y346-S348 PolarHBondContact OH-OG 3.23Å; Y346-H357 WeakPolarHBondContact CB-CE1 3.37Å; Y346-H357 HydrophobicContact CD1-CB 3.77Å; Y346-H357 AromaticContact CD1-CD2 3.7Å; Y346-H357 AromaticContact CD1-CE1 3.63Å; Y346-H357 AromaticContact CD1-CG 3.28Å; Y346-H357 AromaticContact CD1-ND1 3.22Å; Y346-H357 WeakPolarHBondContact CD1-ND1 3.37Å; Y346-H357 AromaticContact CD1-NE2 3.92Å; Y346-H357 AromaticContact CD2-ND1 3.81Å; Y346-H357 HydrophobicContact CE1-CB 3.61Å; Y346-H357 AromaticContact CE1-CG 3.66Å; Y346-H357 AromaticContact CE1-ND1 3.71Å; Y346-H357 AromaticContact CG-CE1 3.36Å; Y346-H357 AromaticContact CG-CG 3.84Å; Y346-H357 AromaticContact CG-ND1 3.28Å; Y346-H357 VanDerWaalsContact CG-ND1 3.28Å; Y346-H357 AromaticContact CG-NE2 3.92Å
347	A	82.9	Confident	81	Confident	15 Å²	15	71.8 Å²	71.8	12%	0.124	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141.7	171.1	0	0	0	0	0	112.6	K337 F339 Q340 D345	K337-A347 HydrophobicContact CB-CB 3.67Å; K337-A347 HydrophobicContact CD-CB 4.06Å; K337-A347 WeakPolarHBondContact CD-O 3.47Å; K337-A347 WeakPolarHBondContact CE-O 3.47Å; K337-A347 HydrophobicContact CG-CB 4.43Å; K337-A347 PolarHBondContact NZ-O 3.25Å; F339-A347 WeakPolarHBondContact O-CA 3.24Å; Q340-A347 HydrophobicContact CB-CB 4.26Å; Q340-A347 HydrophobicContact CG-CB 3.85Å; D345-A347 PolarHBondContact O-N 3.09Å
348	S	81.6	Confident	81	Confident	9 Å²	9	68.3 Å²	68.3	6%	0.063	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.6	-173	-154.9	0	0	0	0	113.2	K337 F339 Y346 N353	K337-S348 CarbonylContact C-O 3.39Å; K337-S348 VanDerWaalsContact C-O 3.3Å; K337-S348 WeakPolarHBondContact CA-O 3.44Å; F339-S348 WeakPolarHBondContact CB-O 3.4Å; F339-S348 PolarHBondContact N-O 3.48Å; F339-S348 VanDerWaalsContact N-O 3.09Å; F339-S348 PolarHBondContact O-N 3.06Å; Y346-S348 PolarHBondContact OH-OG 3.23Å; S348-N353 WeakPolarHBondContact OG-CB 3.45Å
349	A	81.1	Confident	81	Confident	17 Å²	17	68 Å²	68	14%	0.14	36%	0.359	C	S	.	.	S	Bend	trans	-82.7	-13.5	178.9	0	0	0	0	0	113.9	R331	R331-A349 HydrophobicContact CB-CB 3.77Å; R331-A349 WeakPolarHBondContact CD-O 3.16Å; R331-A349 PolarHBondContact NH1-O 3.27Å; R331-A349 VanDerWaalsContact NH1-O 3.15Å
350	I	81.3	Confident	80.7	Confident	65 Å²	65	72.1 Å²	72.1	33%	0.333	38%	0.377	S	S	.	.	S	Bend	trans	-135.8	127.2	-171.5	-47.7	178.5	0	0	0	110.4	A328 F339 A352 N353 L354	A328-I350 HydrophobicContact CB-CD1 3.86Å; A328-I350 HydrophobicContact CB-CG1 3.96Å; F339-I350 VanDerWaalsContact CD2-C 3.5Å; I350-A352 VanDerWaalsContact C-N 3.3Å; I350-A352 HydrophobicContact CG2-CB 4.3Å; I350-A352 PolarHBondContact O-N 2.87Å; I350-N353 PolarHBondContact O-N 3Å; I350-L354 PolarHBondContact O-N 3.11Å
351	K	80.5	Confident	80.4	Confident	134 Å²	134	68.9 Å²	68.9	58%	0.583	36%	0.362	S	S	*	.	H	α-helix	trans	-54.5	-40.4	-179.1	-167.8	173.9	-178.6	177.5	0	113.3	F339 N353 L354 N355	F339-K351 HydrophobicContact CD1-CB 3.95Å; F339-K351 HydrophobicContact CD1-CG 4.18Å; F339-K351 HydrophobicContact CD2-CB 4.43Å; F339-K351 VanDerWaalsContact CD2-N 3.34Å; F339-K351 HydrophobicContact CE1-CB 3.79Å; F339-K351 HydrophobicContact CE1-CD 4.33Å; F339-K351 HydrophobicContact CE1-CG 4.17Å; F339-K351 HydrophobicContact CE2-CB 4.28Å; F339-K351 HydrophobicContact CG-CB 4.27Å; F339-K351 HydrophobicContact CZ-CB 3.96Å; K351-N353 VanDerWaalsContact C-N 3.3Å; K351-N353 PolarHBondContact O-N 2.86Å; K351-L354 WeakPolarHBondContact O-CA 3.28Å; K351-L354 WeakPolarHBondContact O-CB 3.38Å; K351-L354 PolarHBondContact O-N 3.1Å; K351-L354 VanDerWaalsContact O-N 3.08Å; K351-N355 PolarHBondContact O-N 2.81Å; K351-N355 PolarHBondContact O-OD1 2.9Å
352	A	80.3	Confident	79.6	Confident	60 Å²	60	72 Å²	72	50%	0.496	38%	0.381	S	S	.	.	H	α-helix	trans	-59.1	-37.8	177.1	0	0	0	0	0	113.4	I350 N355 V356	I350-A352 VanDerWaalsContact C-N 3.3Å; I350-A352 HydrophobicContact CG2-CB 4.3Å; I350-A352 PolarHBondContact O-N 2.87Å; A352-N355 PolarHBondContact O-N 3.38Å; A352-V356 WeakPolarHBondContact O-CG2 3.27Å; A352-V356 PolarHBondContact O-N 3.47Å
353	N	80.9	Confident	79.1	Confident	79 Å²	79	69.1 Å²	69.1	42%	0.422	37%	0.37	S	S	.	.	H	α-helix	trans	-72.7	-30.4	176.7	-69.8	-15.2	0	0	0	111.9	S348 I350 K351 H357	S348-N353 WeakPolarHBondContact OG-CB 3.45Å; I350-N353 PolarHBondContact O-N 3Å; K351-N353 VanDerWaalsContact C-N 3.3Å; K351-N353 PolarHBondContact O-N 2.86Å; N353-H357 WeakPolarHBondContact O-CB 3.36Å; N353-H357 PolarHBondContact O-N 2.94Å; N353-H357 VanDerWaalsContact O-N 3.14Å
354	L	81.8	Confident	78.9	Confident	17 Å²	17	68 Å²	68	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-66.6	-47.3	168.6	177.4	62.3	0	0	0	110.5	F339 Q340 C341 I350 K351 V356 H357 L358	F339-L354 HydrophobicContact CB-CB 3.97Å; F339-L354 HydrophobicContact CB-CD2 3.79Å; F339-L354 HydrophobicContact CB-CG 4.47Å; Q340-L354 VanDerWaalsContact O-CD2 3.26Å; Q340-L354 WeakPolarHBondContact O-CD2 3.46Å; C341-L354 HydrophobicContact CB-CD1 3.79Å; I350-L354 PolarHBondContact O-N 3.11Å; K351-L354 WeakPolarHBondContact O-CA 3.28Å; K351-L354 WeakPolarHBondContact O-CB 3.38Å; K351-L354 PolarHBondContact O-N 3.1Å; K351-L354 VanDerWaalsContact O-N 3.08Å; L354-V356 VanDerWaalsContact C-N 3.34Å; L354-V356 PolarHBondContact O-N 3.26Å; L354-H357 CarbonylContact O-C 3.54Å; L354-H357 WeakPolarHBondContact O-CA 3.35Å; L354-H357 VanDerWaalsContact O-CB 3.31Å; L354-H357 WeakPolarHBondContact O-CB 3.3Å; L354-H357 PolarHBondContact O-N 3.46Å; L354-L358 HydrophobicContact CD1-CD1 4.37Å; L354-L358 HydrophobicContact CD1-CD2 4.25Å; L354-L358 HydrophobicContact CD1-CG 4Å; L354-L358 HydrophobicContact CD2-CD1 4.41Å; L354-L358 HydrophobicContact CG-CD1 3.94Å; L354-L358 HydrophobicContact CG-CG 4.07Å; L354-L358 WeakPolarHBondContact O-CG 3.43Å; L354-L358 PolarHBondContact O-N 3.15Å
355	N	80.4	Confident	78.5	Confident	80 Å²	80	71.8 Å²	71.8	43%	0.428	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-42.1	179.3	-70.5	23.1	0	0	0	112.6	K351 A352 H357 L358 R359	K351-N355 PolarHBondContact O-N 2.81Å; K351-N355 PolarHBondContact O-OD1 2.9Å; A352-N355 PolarHBondContact O-N 3.38Å; N355-H357 VanDerWaalsContact C-N 3.26Å; N355-H357 PolarHBondContact O-N 2.92Å; N355-L358 PolarHBondContact O-N 3.37Å; N355-R359 PolarHBondContact O-N 3.1Å
356	V	78.7	Confident	78.2	Confident	69 Å²	69	66.4 Å²	66.4	42%	0.418	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-26.4	174.1	175.1	0	0	0	0	112.3	A352 L354	A352-V356 WeakPolarHBondContact O-CG2 3.27Å; A352-V356 PolarHBondContact O-N 3.47Å; L354-V356 VanDerWaalsContact C-N 3.34Å; L354-V356 PolarHBondContact O-N 3.26Å
357	H	79.3	Confident	77.8	Confident	24 Å²	24	65.3 Å²	65.3	11%	0.111	35%	0.349	C	S	.	.	H	α-helix	trans	-75	-41.8	170.5	176.4	99.2	0	0	0	112.3	C341 C344 Y346 N353 L354 N355 R359 K360 H361	C341-H357 VanDerWaalsContact SG-CD2 3.55Å; C344-H357 PolarHBondContact SG-NE2 3.35Å; Y346-H357 WeakPolarHBondContact CB-CE1 3.37Å; Y346-H357 HydrophobicContact CD1-CB 3.77Å; Y346-H357 AromaticContact CD1-CD2 3.7Å; Y346-H357 AromaticContact CD1-CE1 3.63Å; Y346-H357 AromaticContact CD1-CG 3.28Å; Y346-H357 AromaticContact CD1-ND1 3.22Å; Y346-H357 WeakPolarHBondContact CD1-ND1 3.37Å; Y346-H357 AromaticContact CD1-NE2 3.92Å; Y346-H357 AromaticContact CD2-ND1 3.81Å; Y346-H357 HydrophobicContact CE1-CB 3.61Å; Y346-H357 AromaticContact CE1-CG 3.66Å; Y346-H357 AromaticContact CE1-ND1 3.71Å; Y346-H357 AromaticContact CG-CE1 3.36Å; Y346-H357 AromaticContact CG-CG 3.84Å; Y346-H357 AromaticContact CG-ND1 3.28Å; Y346-H357 VanDerWaalsContact CG-ND1 3.28Å; Y346-H357 AromaticContact CG-NE2 3.92Å; N353-H357 WeakPolarHBondContact O-CB 3.36Å; N353-H357 PolarHBondContact O-N 2.94Å; N353-H357 VanDerWaalsContact O-N 3.14Å; L354-H357 CarbonylContact O-C 3.54Å; L354-H357 WeakPolarHBondContact O-CA 3.35Å; L354-H357 VanDerWaalsContact O-CB 3.31Å; L354-H357 WeakPolarHBondContact O-CB 3.3Å; L354-H357 PolarHBondContact O-N 3.46Å; N355-H357 VanDerWaalsContact C-N 3.26Å; N355-H357 PolarHBondContact O-N 2.92Å; H357-R359 PolarHBondContact O-N 2.92Å; H357-K360 VanDerWaalsContact O-CB 3.23Å; H357-K360 WeakPolarHBondContact O-CB 3.35Å; H357-K360 WeakPolarHBondContact O-CG 3.09Å; H357-K360 PolarHBondContact O-N 3.47Å; H357-H361 AromaticContact CD2-CD2 3.8Å; H357-H361 AromaticContact CD2-NE2 3.65Å; H357-H361 AromaticContact CE1-NE2 3.9Å; H357-H361 AromaticContact NE2-CD2 3.59Å; H357-H361 AromaticContact NE2-NE2 2.95Å; H357-H361 PolarHBondContact NE2-NE2 3.14Å
358	L	78.4	Confident	77.7	Confident	42 Å²	42	65 Å²	65	22%	0.22	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-32.3	-178.6	-72.4	171.1	0	0	0	112.4	L354 N355 K360 H361 T362	L354-L358 HydrophobicContact CD1-CD1 4.37Å; L354-L358 HydrophobicContact CD1-CD2 4.25Å; L354-L358 HydrophobicContact CD1-CG 4Å; L354-L358 HydrophobicContact CD2-CD1 4.41Å; L354-L358 HydrophobicContact CG-CD1 3.94Å; L354-L358 HydrophobicContact CG-CG 4.07Å; L354-L358 WeakPolarHBondContact O-CG 3.43Å; L354-L358 PolarHBondContact O-N 3.15Å; N355-L358 PolarHBondContact O-N 3.37Å; L358-K360 PolarHBondContact O-N 3.35Å; L358-H361 WeakPolarHBondContact O-CA 3.04Å; L358-H361 WeakPolarHBondContact O-CB 3.41Å; L358-H361 PolarHBondContact O-N 2.86Å; L358-T362 PolarHBondContact O-N 2.52Å
359	R	77.1	Confident	77.4	Confident	64 Å²	64	70.8 Å²	70.8	24%	0.242	38%	0.376	C	S	.	.	H	α-helix	trans	-60	-15.3	171.8	-67.2	-171.1	172.9	141	3.1	115.3	N355 H357 H361 G363 E364 L376	N355-R359 PolarHBondContact O-N 3.1Å; H357-R359 PolarHBondContact O-N 2.92Å; R359-H361 VanDerWaalsContact C-N 3.32Å; R359-G363 PolarHBondContact O-N 3.01Å; R359-E364 HydrophobicContact CB-CB 4.36Å; R359-E364 HydrophobicContact CG-CB 4.02Å; R359-E364 IonicContact CZ-OE2 3.43Å; R359-E364 IonicContact NE-OE2 3.86Å; R359-E364 PolarHBondContact NE-OE2 3.41Å; R359-E364 IonicContact NH2-OE2 2.82Å; R359-L376 HydrophobicContact CB-CD2 4.32Å
360	K	73	Confident	76.9	Confident	143 Å²	143	75.8 Å²	75.8	62%	0.622	40%	0.396	S	S	*	.	H	α-helix	trans	-75.9	-21.6	169.7	-62.8	-176.6	175.3	-171.4	0	113.1	H357 L358 L376	H357-K360 VanDerWaalsContact O-CB 3.23Å; H357-K360 WeakPolarHBondContact O-CB 3.35Å; H357-K360 WeakPolarHBondContact O-CG 3.09Å; H357-K360 PolarHBondContact O-N 3.47Å; L358-K360 PolarHBondContact O-N 3.35Å; K360-L376 HydrophobicContact CD-CD1 4.5Å; K360-L376 HydrophobicContact CG-CD1 3.67Å
361	H	75.2	Confident	76.7	Confident	76 Å²	76	75.1 Å²	75.1	35%	0.352	40%	0.396	S	S	.	.	H	α-helix	trans	-100.3	-42.4	178.6	-58.8	-75.5	0	0	0	111.4	C341 H343 C344 H357 L358 R359 G363	C341-H361 PolarHBondContact SG-NE2 2.85Å; H343-H361 HydrophobicContact CB-CB 4.26Å; C344-H361 PolarHBondContact SG-NE2 3.04Å; H357-H361 AromaticContact CD2-CD2 3.8Å; H357-H361 AromaticContact CD2-NE2 3.65Å; H357-H361 AromaticContact CE1-NE2 3.9Å; H357-H361 AromaticContact NE2-CD2 3.59Å; H357-H361 AromaticContact NE2-NE2 2.95Å; H357-H361 PolarHBondContact NE2-NE2 3.14Å; L358-H361 WeakPolarHBondContact O-CA 3.04Å; L358-H361 WeakPolarHBondContact O-CB 3.41Å; L358-H361 PolarHBondContact O-N 2.86Å; R359-H361 VanDerWaalsContact C-N 3.32Å; H361-G363 PolarHBondContact O-N 3.01Å
362	T	71.6	Confident	76.5	Confident	80 Å²	80	73.8 Å²	73.8	49%	0.491	41%	0.41	S	S	.	.	H	α-helix	trans	-73.9	-13.1	175.9	67.1	0	0	0	0	113.6	L358 E364	L358-T362 PolarHBondContact O-N 2.52Å; T362-E364 PolarHBondContact O-N 3.1Å; T362-E364 PolarHBondContact OG1-OE1 3.27Å
363	G	69.2	Low	76.3	Confident	43 Å²	43	75.1 Å²	75.1	44%	0.443	41%	0.405	S	S	.	.			trans	76.2	-3.5	176.8	0	0	0	0	0	115.3	R359 H361 K365	R359-G363 PolarHBondContact O-N 3.01Å; H361-G363 PolarHBondContact O-N 3.01Å; G363-K365 PolarHBondContact O-N 3.17Å; G363-K365 VanDerWaalsContact O-N 3.08Å
364	E	73.8	Confident	76.1	Confident	95 Å²	95	74 Å²	74	44%	0.444	40%	0.403	S	S	.	.			trans	-52.4	108.4	175.6	-75.7	165.7	-131.4	0	0	112.2	R359 T362 L376	R359-E364 HydrophobicContact CB-CB 4.36Å; R359-E364 HydrophobicContact CG-CB 4.02Å; R359-E364 IonicContact CZ-OE2 3.43Å; R359-E364 IonicContact NE-OE2 3.86Å; R359-E364 PolarHBondContact NE-OE2 3.41Å; R359-E364 IonicContact NH2-OE2 2.82Å; T362-E364 PolarHBondContact O-N 3.1Å; T362-E364 PolarHBondContact OG1-OE1 3.27Å; E364-L376 WeakPolarHBondContact O-CD2 3.45Å
365	K	75.7	Confident	75.9	Confident	132 Å²	132	74 Å²	74	57%	0.574	41%	0.405	S	S	*	.			trans	-119.1	138.6	172.3	-60.4	162.2	-164	164.7	0	109.6	G363 S367 L376	G363-K365 PolarHBondContact O-N 3.17Å; G363-K365 VanDerWaalsContact O-N 3.08Å; K365-S367 PolarHBondContact O-N 3.39Å; K365-L376 HydrophobicContact CG-CD2 3.95Å
366	F	75.6	Confident	75.7	Confident	62 Å²	62	72.6 Å²	72.6	27%	0.272	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	102	166.5	-58.7	-89.2	0	0	0	107.3	S374 C375 P378 L381	F366-S374 WeakPolarHBondContact O-CA 3.13Å; F366-C375 PolarHBondContact N-O 3.47Å; F366-C375 PolarHBondContact O-N 3.41Å; F366-P378 HydrophobicContact CD1-CG 4.06Å; F366-P378 HydrophobicContact CD2-CG 4.26Å; F366-P378 HydrophobicContact CE1-CG 3.79Å; F366-P378 HydrophobicContact CE2-CG 4.02Å; F366-P378 HydrophobicContact CG-CG 4.3Å; F366-P378 HydrophobicContact CZ-CG 3.78Å; F366-L381 HydrophobicContact CB-CB 4.3Å; F366-L381 HydrophobicContact CB-CD2 3.78Å
367	S	76.3	Confident	75.6	Confident	66 Å²	66	70.7 Å²	70.7	46%	0.462	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	157.4	170.5	43	0	0	0	0	111.5	K365 F373 L381	K365-S367 PolarHBondContact O-N 3.39Å; S367-F373 CarbonylContact C-O 3.14Å; S367-F373 WeakPolarHBondContact CA-O 3.18Å; S367-L381 WeakPolarHBondContact O-CD1 3.37Å; S367-L381 WeakPolarHBondContact O-CD2 3.5Å
368	C	79.9	Confident	75.4	Confident	8 Å²	8	72.9 Å²	72.9	5%	0.054	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.6	164.8	-177.9	0	0	0	0	110.4	H370 C371 F373 L381 H389	C368-H370 PolarHBondContact O-N 2.89Å; C368-H370 PolarHBondContact SG-N 3.37Å; C368-H370 VanDerWaalsContact SG-N 3.43Å; C368-C371 PolarHBondContact O-N 2.92Å; C368-F373 PolarHBondContact N-O 3.17Å; C368-L381 HydrophobicContact CB-CD1 3.74Å; C368-H389 PolarHBondContact SG-CD2 2.81Å
369	D	75.8	Confident	75.3	Confident	130 Å²	130	73.2 Å²	73.2	70%	0.695	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-2.6	179.1	-40.3	-69.5	0	0	0	112.8
370	H	69.9	Low	75.3	Confident	122 Å²	122	76.4 Å²	76.4	57%	0.565	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	-5.2	-177.8	-52.9	-45.4	0	0	0	114.1	C368 H389	C368-H370 PolarHBondContact O-N 2.89Å; C368-H370 PolarHBondContact SG-N 3.37Å; C368-H370 VanDerWaalsContact SG-N 3.43Å; H370-H389 VanDerWaalsContact C-CE1 3.49Å; H370-H389 HydrophobicContact CB-CB 4.09Å; H370-H389 VanDerWaalsContact CB-CG 3.43Å; H370-H389 WeakPolarHBondContact CB-ND1 3.16Å; H370-H389 AromaticContact CD2-CG 3.89Å; H370-H389 PolarHBondContact O-CE1 3.06Å
371	C	76.6	Confident	75.6	Confident	51 Å²	51	70.6 Å²	70.6	35%	0.345	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	166.4	165.7	75.2	0	0	0	0	113.2	C368 F373 H384 H389	C368-C371 PolarHBondContact O-N 2.92Å; C371-F373 PolarHBondContact O-N 2.97Å; C371-F373 VanDerWaalsContact SG-CB 3.56Å; C371-H384 VanDerWaalsContact SG-CE1 3.52Å; C371-H384 PolarHBondContact SG-NE2 3.05Å; C371-H389 PolarHBondContact SG-NE2 3.37Å
372	A	76.6	Confident	75.7	Confident	106 Å²	106	73.3 Å²	73.3	88%	0.876	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	6.6	179.5	0	0	0	0	0	116.3	S374	A372-S374 PolarHBondContact O-N 3.04Å
373	F	76.3	Confident	76	Confident	89 Å²	89	72.2 Å²	72.2	39%	0.39	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.7	172.4	-176.6	-98.7	0	0	0	110.7	S367 C368 C371 C375 H384	S367-F373 CarbonylContact C-O 3.14Å; S367-F373 WeakPolarHBondContact CA-O 3.18Å; C368-F373 PolarHBondContact N-O 3.17Å; C371-F373 PolarHBondContact O-N 2.97Å; C371-F373 VanDerWaalsContact SG-CB 3.56Å; F373-C375 HydrophobicContact CE1-CB 3.93Å; F373-C375 HydrophobicContact CZ-CB 4.19Å; F373-H384 VanDerWaalsContact CB-CE1 3.41Å; F373-H384 WeakPolarHBondContact CB-CE1 3.22Å; F373-H384 HydrophobicContact CD1-CB 3.99Å; F373-H384 AromaticContact CD1-CD2 3.59Å; F373-H384 AromaticContact CD1-CE1 3.74Å; F373-H384 AromaticContact CD1-CG 3.4Å; F373-H384 VanDerWaalsContact CD1-CG 3.4Å; F373-H384 AromaticContact CD1-ND1 3.5Å; F373-H384 WeakPolarHBondContact CD1-ND1 3.17Å; F373-H384 AromaticContact CD1-NE2 3.8Å; F373-H384 HydrophobicContact CE1-CB 3.82Å; F373-H384 AromaticContact CE1-CG 3.74Å; F373-H384 AromaticContact CE1-ND1 3.95Å; F373-H384 AromaticContact CG-CE1 3.56Å; F373-H384 AromaticContact CG-ND1 3.62Å; F373-H384 AromaticContact CG-NE2 3.9Å
374	S	76.3	Confident	76.4	Confident	54 Å²	54	71.3 Å²	71.3	38%	0.378	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	138.8	178.5	58.6	0	0	0	0	111.4	F366 A372	F366-S374 WeakPolarHBondContact O-CA 3.13Å; A372-S374 PolarHBondContact O-N 3.04Å
375	C	78.4	Confident	76.6	Confident	17 Å²	17	68.4 Å²	68.4	12%	0.115	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.5	-174	73.4	0	0	0	0	113.3	F366 F373 S377 H380 L381	F366-C375 PolarHBondContact N-O 3.47Å; F366-C375 PolarHBondContact O-N 3.41Å; F373-C375 HydrophobicContact CE1-CB 3.93Å; F373-C375 HydrophobicContact CZ-CB 4.19Å; C375-S377 VanDerWaalsContact C-N 3.31Å; C375-S377 PolarHBondContact O-N 3.02Å; C375-S377 PolarHBondContact SG-O 3.38Å; C375-H380 HydrophobicContact CB-CB 4.45Å; C375-L381 PolarHBondContact SG-N 2.57Å; C375-L381 VanDerWaalsContact SG-N 3.39Å
376	L	76.1	Confident	76.4	Confident	52 Å²	52	66.2 Å²	66.2	27%	0.272	38%	0.377	S	S	.	.	S	Bend	trans	-84.2	5.3	-170.4	-60.1	172.2	0	0	0	114.8	R359 K360 E364 K365	R359-L376 HydrophobicContact CB-CD2 4.32Å; K360-L376 HydrophobicContact CD-CD1 4.5Å; K360-L376 HydrophobicContact CG-CD1 3.67Å; E364-L376 WeakPolarHBondContact O-CD2 3.45Å; K365-L376 HydrophobicContact CG-CD2 3.95Å
377	S	77.1	Confident	75.9	Confident	28 Å²	28	71 Å²	71	20%	0.196	39%	0.393	C	S	.	.	S	Bend	trans	-150.3	130.4	-174.7	65.3	0	0	0	0	112.7	C375 G379 H380 L381	C375-S377 VanDerWaalsContact C-N 3.31Å; C375-S377 PolarHBondContact O-N 3.02Å; C375-S377 PolarHBondContact SG-O 3.38Å; S377-G379 VanDerWaalsContact C-N 3.26Å; S377-G379 PolarHBondContact O-N 3.15Å; S377-G379 VanDerWaalsContact O-N 3.14Å; S377-H380 PolarHBondContact O-N 2.82Å; S377-H380 PolarHBondContact OG-ND1 3.48Å; S377-L381 PolarHBondContact O-N 3.41Å
378	P	75.8	Confident	75.4	Confident	70 Å²	70	71 Å²	71	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-55.1	-35.9	-177.5	-28.6	35.3	0	0	0	114.7	F366 H380 L381 K382	F366-P378 HydrophobicContact CD1-CG 4.06Å; F366-P378 HydrophobicContact CD2-CG 4.26Å; F366-P378 HydrophobicContact CE1-CG 3.79Å; F366-P378 HydrophobicContact CE2-CG 4.02Å; F366-P378 HydrophobicContact CG-CG 4.3Å; F366-P378 HydrophobicContact CZ-CG 3.78Å; P378-H380 VanDerWaalsContact C-N 3.31Å; P378-H380 PolarHBondContact O-N 3.3Å; P378-L381 PolarHBondContact O-N 2.62Å; P378-L381 VanDerWaalsContact O-N 3.14Å; P378-K382 PolarHBondContact O-N 3.48Å
379	G	75.8	Confident	74.9	Confident	50 Å²	50	73 Å²	73	52%	0.515	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-29.2	179.7	0	0	0	0	0	114.5	S377 V383	S377-G379 VanDerWaalsContact C-N 3.26Å; S377-G379 PolarHBondContact O-N 3.15Å; S377-G379 VanDerWaalsContact O-N 3.14Å; G379-V383 WeakPolarHBondContact O-CG2 3.1Å; G379-V383 PolarHBondContact O-N 3Å
380	H	76	Confident	74.4	Confident	130 Å²	130	71.8 Å²	71.8	60%	0.602	39%	0.391	S	S	*	.	H	α-helix	trans	-79	-32.8	172.8	-75.7	92.8	0	0	0	111.7	C375 S377 P378 H384	C375-H380 HydrophobicContact CB-CB 4.45Å; S377-H380 PolarHBondContact O-N 2.82Å; S377-H380 PolarHBondContact OG-ND1 3.48Å; P378-H380 VanDerWaalsContact C-N 3.31Å; P378-H380 PolarHBondContact O-N 3.3Å; H380-H384 WeakPolarHBondContact O-CB 3.3Å; H380-H384 PolarHBondContact O-N 2.85Å; H380-H384 VanDerWaalsContact O-N 3.1Å
381	L	80.3	Confident	73.8	Confident	21 Å²	21	72.7 Å²	72.7	11%	0.11	39%	0.394	C	S	.	.	H	α-helix	trans	-64.8	-48.1	174.2	178.3	61.7	0	0	0	111	F366 S367 C368 C375 S377 P378 V383 H384 I385	F366-L381 HydrophobicContact CB-CB 4.3Å; F366-L381 HydrophobicContact CB-CD2 3.78Å; S367-L381 WeakPolarHBondContact O-CD1 3.37Å; S367-L381 WeakPolarHBondContact O-CD2 3.5Å; C368-L381 HydrophobicContact CB-CD1 3.74Å; C375-L381 PolarHBondContact SG-N 2.57Å; C375-L381 VanDerWaalsContact SG-N 3.39Å; S377-L381 PolarHBondContact O-N 3.41Å; P378-L381 PolarHBondContact O-N 2.62Å; P378-L381 VanDerWaalsContact O-N 3.14Å; L381-V383 PolarHBondContact O-N 3.2Å; L381-H384 CarbonylContact O-C 3.59Å; L381-H384 WeakPolarHBondContact O-CA 3.2Å; L381-H384 WeakPolarHBondContact O-CB 3.35Å; L381-H384 PolarHBondContact O-N 3.37Å; L381-I385 HydrophobicContact CD1-CD1 3.92Å; L381-I385 HydrophobicContact CD1-CG1 4.01Å; L381-I385 HydrophobicContact CD2-CD1 4.21Å; L381-I385 HydrophobicContact CG-CD1 3.73Å; L381-I385 HydrophobicContact CG-CG1 4.25Å; L381-I385 WeakPolarHBondContact O-CG1 3.42Å; L381-I385 PolarHBondContact O-N 2.8Å
382	K	77.8	Confident	72.7	Confident	134 Å²	134	76.9 Å²	76.9	58%	0.583	41%	0.41	S	S	*	.	H	α-helix	trans	-56.3	-47.9	178.9	178.4	158.2	-179.9	161.2	0	112	P378 H384 I385 E386	P378-K382 PolarHBondContact O-N 3.48Å; K382-H384 PolarHBondContact O-N 3.38Å; K382-I385 PolarHBondContact O-N 2.92Å; K382-E386 WeakPolarHBondContact CE-OE1 3.19Å; K382-E386 HydrophobicContact CG-CG 4.31Å; K382-E386 VanDerWaalsContact CG-OE1 3.3Å; K382-E386 WeakPolarHBondContact CG-OE1 3.39Å; K382-E386 WeakPolarHBondContact O-CB 3.43Å; K382-E386 VanDerWaalsContact O-CG 3.25Å; K382-E386 WeakPolarHBondContact O-CG 3.36Å; K382-E386 PolarHBondContact O-N 3.37Å
383	V	76.1	Confident	71.9	Confident	56 Å²	56	77.4 Å²	77.4	34%	0.339	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-26	176.7	172.8	0	0	0	0	112.9	G379 L381 R387	G379-V383 WeakPolarHBondContact O-CG2 3.1Å; G379-V383 PolarHBondContact O-N 3Å; L381-V383 PolarHBondContact O-N 3.2Å; V383-R387 WeakPolarHBondContact O-CB 3.21Å; V383-R387 WeakPolarHBondContact O-CD 3.45Å; V383-R387 VanDerWaalsContact O-CG 3.3Å; V383-R387 WeakPolarHBondContact O-CG 3.48Å; V383-R387 PolarHBondContact O-N 3.35Å
384	H	78	Confident	71	Confident	25 Å²	25	76.9 Å²	76.9	12%	0.116	39%	0.391	C	S	.	.	H	α-helix	trans	-74.2	-49.5	172	163.9	86.4	0	0	0	111.5	C371 F373 H380 L381 K382 E386 R387 V388 H389	C371-H384 VanDerWaalsContact SG-CE1 3.52Å; C371-H384 PolarHBondContact SG-NE2 3.05Å; F373-H384 VanDerWaalsContact CB-CE1 3.41Å; F373-H384 WeakPolarHBondContact CB-CE1 3.22Å; F373-H384 HydrophobicContact CD1-CB 3.99Å; F373-H384 AromaticContact CD1-CD2 3.59Å; F373-H384 AromaticContact CD1-CE1 3.74Å; F373-H384 AromaticContact CD1-CG 3.4Å; F373-H384 VanDerWaalsContact CD1-CG 3.4Å; F373-H384 AromaticContact CD1-ND1 3.5Å; F373-H384 WeakPolarHBondContact CD1-ND1 3.17Å; F373-H384 AromaticContact CD1-NE2 3.8Å; F373-H384 HydrophobicContact CE1-CB 3.82Å; F373-H384 AromaticContact CE1-CG 3.74Å; F373-H384 AromaticContact CE1-ND1 3.95Å; F373-H384 AromaticContact CG-CE1 3.56Å; F373-H384 AromaticContact CG-ND1 3.62Å; F373-H384 AromaticContact CG-NE2 3.9Å; H380-H384 WeakPolarHBondContact O-CB 3.3Å; H380-H384 PolarHBondContact O-N 2.85Å; H380-H384 VanDerWaalsContact O-N 3.1Å; L381-H384 CarbonylContact O-C 3.59Å; L381-H384 WeakPolarHBondContact O-CA 3.2Å; L381-H384 WeakPolarHBondContact O-CB 3.35Å; L381-H384 PolarHBondContact O-N 3.37Å; K382-H384 PolarHBondContact O-N 3.38Å; H384-E386 PolarHBondContact O-N 2.96Å; H384-R387 PolarHBondContact O-N 3.35Å; H384-V388 WeakPolarHBondContact O-CB 3.26Å; H384-V388 WeakPolarHBondContact O-CG2 3.4Å; H384-V388 PolarHBondContact O-N 2.94Å; H384-H389 AromaticContact CE1-NE2 3.97Å; H384-H389 AromaticContact NE2-CD2 3.66Å; H384-H389 AromaticContact NE2-NE2 3.44Å; H384-H389 PolarHBondContact NE2-NE2 2.68Å
385	I	77.6	Confident	70.7	Confident	33 Å²	33	79.9 Å²	79.9	17%	0.169	40%	0.399	C	S	.	.	H	α-helix	trans	-58.9	-46.6	178.2	-63.8	170.5	0	0	0	110.8	L381 K382 R387 H389 L390	L381-I385 HydrophobicContact CD1-CD1 3.92Å; L381-I385 HydrophobicContact CD1-CG1 4.01Å; L381-I385 HydrophobicContact CD2-CD1 4.21Å; L381-I385 HydrophobicContact CG-CD1 3.73Å; L381-I385 HydrophobicContact CG-CG1 4.25Å; L381-I385 WeakPolarHBondContact O-CG1 3.42Å; L381-I385 PolarHBondContact O-N 2.8Å; K382-I385 PolarHBondContact O-N 2.92Å; I385-R387 VanDerWaalsContact C-N 3.27Å; I385-R387 PolarHBondContact O-N 3.22Å; I385-H389 PolarHBondContact O-N 2.99Å; I385-H389 VanDerWaalsContact O-N 3.09Å; I385-L390 HydrophobicContact CG2-CD1 3.99Å; I385-L390 HydrophobicContact CG2-CG 4.23Å; I385-L390 PolarHBondContact O-N 3.27Å
386	E	72.2	Confident	70.6	Confident	87 Å²	87	79.4 Å²	79.4	41%	0.407	40%	0.396	S	S	.	.	H	α-helix	trans	-55.4	-37.5	176.9	-75.5	170	174.6	0	0	113.2	K382 H384 L390	K382-E386 WeakPolarHBondContact CE-OE1 3.19Å; K382-E386 HydrophobicContact CG-CG 4.31Å; K382-E386 VanDerWaalsContact CG-OE1 3.3Å; K382-E386 WeakPolarHBondContact CG-OE1 3.39Å; K382-E386 WeakPolarHBondContact O-CB 3.43Å; K382-E386 VanDerWaalsContact O-CG 3.25Å; K382-E386 WeakPolarHBondContact O-CG 3.36Å; K382-E386 PolarHBondContact O-N 3.37Å; H384-E386 PolarHBondContact O-N 2.96Å; E386-L390 HydrophobicContact CG-CD1 4.37Å
387	R	65	Low	70.3	Confident	162 Å²	162	80.8 Å²	80.8	61%	0.611	41%	0.41	S	S	*	.	H	α-helix	trans	-92	-40.3	-175.2	-73.4	177.9	175.4	157	5.1	114.5	V383 H384 I385	V383-R387 WeakPolarHBondContact O-CB 3.21Å; V383-R387 WeakPolarHBondContact O-CD 3.45Å; V383-R387 VanDerWaalsContact O-CG 3.3Å; V383-R387 WeakPolarHBondContact O-CG 3.48Å; V383-R387 PolarHBondContact O-N 3.35Å; H384-R387 PolarHBondContact O-N 3.35Å; I385-R387 VanDerWaalsContact C-N 3.27Å; I385-R387 PolarHBondContact O-N 3.22Å
388	V	65.3	Low	70.2	Confident	65 Å²	65	83 Å²	83	39%	0.394	42%	0.416	S	S	.	.	H	α-helix	trans	-92.8	-36.5	-169.6	-177.1	0	0	0	0	111.3	H384 K391	H384-V388 WeakPolarHBondContact O-CB 3.26Å; H384-V388 WeakPolarHBondContact O-CG2 3.4Å; H384-V388 PolarHBondContact O-N 2.94Å; V388-K391 VanDerWaalsContact O-CE 3.29Å; V388-K391 WeakPolarHBondContact O-CE 3.5Å
389	H	69.6	Low	70.2	Confident	50 Å²	50	81.5 Å²	81.5	23%	0.231	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-50.2	-167.6	-64	-68.7	0	0	0	113.1	C368 H370 C371 H384 I385 K391	C368-H389 PolarHBondContact SG-CD2 2.81Å; H370-H389 VanDerWaalsContact C-CE1 3.49Å; H370-H389 HydrophobicContact CB-CB 4.09Å; H370-H389 VanDerWaalsContact CB-CG 3.43Å; H370-H389 WeakPolarHBondContact CB-ND1 3.16Å; H370-H389 AromaticContact CD2-CG 3.89Å; H370-H389 PolarHBondContact O-CE1 3.06Å; C371-H389 PolarHBondContact SG-NE2 3.37Å; H384-H389 AromaticContact CE1-NE2 3.97Å; H384-H389 AromaticContact NE2-CD2 3.66Å; H384-H389 AromaticContact NE2-NE2 3.44Å; H384-H389 PolarHBondContact NE2-NE2 2.68Å; I385-H389 PolarHBondContact O-N 2.99Å; I385-H389 VanDerWaalsContact O-N 3.09Å; H389-K391 PolarHBondContact O-N 3.01Å
390	L	66.7	Low	69.7	Low	105 Å²	105	87.8 Å²	87.8	55%	0.55	42%	0.423	S	S	.	.	S	Bend	trans	-66.3	-20.1	179.6	-80	164.1	0	0	0	113.9	I385 E386 M392	I385-L390 HydrophobicContact CG2-CD1 3.99Å; I385-L390 HydrophobicContact CG2-CG 4.23Å; I385-L390 PolarHBondContact O-N 3.27Å; E386-L390 HydrophobicContact CG-CD1 4.37Å; L390-M392 PolarHBondContact O-N 3.47Å
391	K	55.8	Low	69.4	Low	141 Å²	141	87 Å²	87	61%	0.613	42%	0.418	S	S	*	.			trans	37.1	46.6	170	-71.6	177.5	179.4	167	0	114.2	V388 H389 K393	V388-K391 VanDerWaalsContact O-CE 3.29Å; V388-K391 WeakPolarHBondContact O-CE 3.5Å; H389-K391 PolarHBondContact O-N 3.01Å; K391-K393 PolarHBondContact O-N 2.87Å
392	M	54.2	Low	69	Low	139 Å²	139	92.9 Å²	92.9	69%	0.685	44%	0.442	S	S	*	.			trans	-70.9	62.8	179.2	-77.7	-97.7	75.9	0	0	111.9	L390 Q394	L390-M392 PolarHBondContact O-N 3.47Å; M392-Q394 PolarHBondContact O-N 2.98Å; M392-Q394 PolarHBondContact O-NE2 2.87Å; M392-Q394 VanDerWaalsContact O-NE2 3.11Å
393	K	59.4	Low	68.9	Low	117 Å²	117	89.3 Å²	89.3	51%	0.509	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-66.6	119.4	-173.6	-66.2	-178.2	-174.6	-179.5	0	109.9	K391 H395 K402 Y403	K391-K393 PolarHBondContact O-N 2.87Å; K393-H395 PolarHBondContact O-N 3.12Å; K393-K402 HydrophobicContact CB-CB 4.03Å; K393-K402 HydrophobicContact CD-CB 3.82Å; K393-Y403 CarbonylContact C-O 3.56Å; K393-Y403 WeakPolarHBondContact CA-O 3.41Å
394	Q	58.6	Low	68	Low	78 Å²	78	90.2 Å²	90.2	36%	0.364	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.7	169.7	-53.7	-58.4	-67.6	0	0	107.7	M392 Y403 V406 L409	M392-Q394 PolarHBondContact O-N 2.98Å; M392-Q394 PolarHBondContact O-NE2 2.87Å; M392-Q394 VanDerWaalsContact O-NE2 3.11Å; Q394-Y403 PolarHBondContact N-O 3.28Å; Q394-Y403 PolarHBondContact O-N 3.02Å; Q394-V406 HydrophobicContact CG-CG2 4.12Å; Q394-L409 HydrophobicContact CB-CD2 3.61Å
395	H	68	Low	67.5	Low	118 Å²	118	91.8 Å²	91.8	55%	0.546	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	154.4	170.6	58.6	-95.6	0	0	0	109.6	K393 K402	K393-H395 PolarHBondContact O-N 3.12Å; H395-K402 HydrophobicContact CB-CG 4.3Å
396	C	76.5	Confident	67.1	Low	6 Å²	6	92.1 Å²	92.1	4%	0.041	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	135.3	163.7	-169.7	0	0	0	0	108.6	F398 C399 K401 L409 H412	C396-F398 PolarHBondContact O-N 3.06Å; C396-C399 WeakPolarHBondContact CB-O 3.46Å; C396-K401 PolarHBondContact N-O 2.7Å; C396-L409 HydrophobicContact CB-CD1 3.71Å; C396-H412 WeakPolarHBondContact CB-NE2 3.35Å; C396-H412 PolarHBondContact SG-NE2 2.99Å
397	S	71.4	Confident	67.1	Low	82 Å²	82	93.4 Å²	93.4	57%	0.573	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.6	176.7	-50.9	0	0	0	0	113.2
398	F	75	Confident	67.6	Low	75 Å²	75	88.6 Å²	88.6	33%	0.329	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-1.6	-175.5	-51	-87.1	0	0	0	113.3	C396 M413 H417 A423 V424 T427	C396-F398 PolarHBondContact O-N 3.06Å; F398-M413 HydrophobicContact CD2-CE 4.11Å; F398-M413 HydrophobicContact CE2-CE 3.91Å; F398-H417 PolarHBondContact O-CE1 2.94Å; F398-H417 VanDerWaalsContact O-CE1 3.28Å; F398-A423 HydrophobicContact CE1-CB 4.37Å; F398-V424 HydrophobicContact CD1-CG2 3.95Å; F398-V424 HydrophobicContact CD2-CG2 4.44Å; F398-V424 HydrophobicContact CE1-CG2 3.91Å; F398-V424 HydrophobicContact CE2-CG2 4.43Å; F398-V424 HydrophobicContact CG-CG2 4.23Å; F398-V424 HydrophobicContact CZ-CG2 4.17Å; F398-T427 HydrophobicContact CE2-CG2 4.09Å; F398-T427 WeakPolarHBondContact CE2-OG1 3.38Å; F398-T427 HydrophobicContact CZ-CG2 3.93Å; F398-T427 WeakPolarHBondContact CZ-OG1 3.42Å
399	C	74.4	Confident	68.2	Low	38 Å²	38	85.5 Å²	85.5	26%	0.257	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	158.7	163.1	76	0	0	0	0	111.7	C396 K401 H412	C396-C399 WeakPolarHBondContact CB-O 3.46Å; C399-K401 PolarHBondContact O-N 3.02Å; C399-H412 PolarHBondContact SG-CE1 3.15Å; C399-H412 PolarHBondContact SG-NE2 3.13Å
400	E	65.6	Low	68.6	Low	181 Å²	181	84 Å²	84	85%	0.846	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	5.9	-170.7	-51.6	-174	146.6	0	0	116	K402	E400-K402 WeakPolarHBondContact O-CG 3.47Å
401	K	69	Low	69.1	Low	114 Å²	114	84.7 Å²	84.7	50%	0.496	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.5	-172.7	-66.4	174.7	-178.1	168.5	0	110.8	C396 C399 Y403	C396-K401 PolarHBondContact N-O 2.7Å; C399-K401 PolarHBondContact O-N 3.02Å; K401-Y403 HydrophobicContact CB-CE2 3.56Å; K401-Y403 VanDerWaalsContact O-CD2 3.32Å; K401-Y403 WeakPolarHBondContact O-CD2 3.37Å; K401-Y403 WeakPolarHBondContact O-CE2 3.48Å
402	K	73.7	Confident	70.3	Confident	144 Å²	144	78.4 Å²	78.4	63%	0.626	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.8	-169.2	-61.5	172.9	-172.7	175.8	0	110.8	K393 H395 E400	K393-K402 HydrophobicContact CB-CB 4.03Å; K393-K402 HydrophobicContact CD-CB 3.82Å; H395-K402 HydrophobicContact CB-CG 4.3Å; E400-K402 WeakPolarHBondContact O-CG 3.47Å
403	Y	74.1	Confident	71.2	Confident	60 Å²	60	71.8 Å²	71.8	24%	0.235	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	139	-169.5	-67.3	-85.4	0	0	0	113.6	K393 Q394 K401 D405 N408 L409 H412	K393-Y403 CarbonylContact C-O 3.56Å; K393-Y403 WeakPolarHBondContact CA-O 3.41Å; Q394-Y403 PolarHBondContact N-O 3.28Å; Q394-Y403 PolarHBondContact O-N 3.02Å; K401-Y403 HydrophobicContact CB-CE2 3.56Å; K401-Y403 VanDerWaalsContact O-CD2 3.32Å; K401-Y403 WeakPolarHBondContact O-CD2 3.37Å; K401-Y403 WeakPolarHBondContact O-CE2 3.48Å; Y403-D405 VanDerWaalsContact C-N 3.31Å; Y403-D405 PolarHBondContact O-N 2.84Å; Y403-N408 HydrophobicContact CD1-CB 4.25Å; Y403-L409 HydrophobicContact CD2-CB 4.38Å; Y403-L409 HydrophobicContact CD2-CD1 4.02Å; Y403-L409 HydrophobicContact CG-CB 4.39Å; Y403-H412 HydrophobicContact CE1-CB 4.01Å; Y403-H412 HydrophobicContact CE2-CB 3.87Å; Y403-H412 AromaticContact CE2-CD2 3.22Å; Y403-H412 WeakPolarHBondContact CE2-CD2 3.45Å; Y403-H412 AromaticContact CE2-CG 3.52Å; Y403-H412 AromaticContact CE2-NE2 3.9Å; Y403-H412 AromaticContact CZ-CD2 3.68Å; Y403-H412 AromaticContact CZ-CG 3.45Å; Y403-H412 VanDerWaalsContact CZ-CG 3.45Å; Y403-H412 VanDerWaalsContact OH-CG 3.23Å; Y403-H412 PolarHBondContact OH-ND1 2.98Å
404	S	58.6	Low	72.1	Confident	75 Å²	75	69.6 Å²	69.6	52%	0.524	34%	0.343	S	S	.	.	S	Bend	trans	-66.1	-25.2	-178.8	58.4	0	0	0	0	115.5
405	D	67.2	Low	72.9	Confident	57 Å²	57	70.8 Å²	70.8	31%	0.305	36%	0.356	S	S	.	.	S	Bend	trans	-137.5	137.5	-173.7	-61.7	-103	0	0	0	109.6	Y403 K407 N408 L409	Y403-D405 VanDerWaalsContact C-N 3.31Å; Y403-D405 PolarHBondContact O-N 2.84Å; D405-K407 PolarHBondContact O-N 3.43Å; D405-K407 VanDerWaalsContact O-N 3.08Å; D405-N408 HydrophobicContact CB-CB 4.32Å; D405-N408 WeakPolarHBondContact O-CA 3.4Å; D405-N408 PolarHBondContact O-N 3.32Å; D405-N408 PolarHBondContact OD2-ND2 2.94Å; D405-L409 PolarHBondContact O-N 3.36Å
406	V	69.6	Low	73.2	Confident	40 Å²	40	74 Å²	74	24%	0.242	36%	0.363	C	S	.	.	H	α-helix	trans	-52.5	-33.8	171	-173.6	0	0	0	0	111.2	Q394 N408 L409 L410 L431 T435	Q394-V406 HydrophobicContact CG-CG2 4.12Å; V406-N408 VanDerWaalsContact C-N 3.31Å; V406-N408 PolarHBondContact O-N 3.11Å; V406-L409 PolarHBondContact O-N 3.19Å; V406-L410 HydrophobicContact CG1-CD1 4.03Å; V406-L410 HydrophobicContact CG1-CG 4.27Å; V406-L410 WeakPolarHBondContact O-CB 3.45Å; V406-L410 VanDerWaalsContact O-CG 3.24Å; V406-L410 WeakPolarHBondContact O-CG 3.37Å; V406-L410 PolarHBondContact O-N 2.81Å; V406-L431 HydrophobicContact CG1-CB 4.46Å; V406-T435 HydrophobicContact CB-CG2 4Å; V406-T435 HydrophobicContact CG1-CG2 3.54Å
407	K	72.3	Confident	73.2	Confident	114 Å²	114	75.7 Å²	75.7	50%	0.496	37%	0.37	S	S	.	.	H	α-helix	trans	-67.8	-27.3	177	-175.4	169.5	178.8	172	0	113.9	D405 K411	D405-K407 PolarHBondContact O-N 3.43Å; D405-K407 VanDerWaalsContact O-N 3.08Å; K407-K411 WeakPolarHBondContact O-CG 3.3Å; K407-K411 PolarHBondContact O-N 3.47Å
408	N	74.3	Confident	73.4	Confident	61 Å²	61	75.5 Å²	75.5	33%	0.326	36%	0.363	S	S	.	.	H	α-helix	trans	-85.8	-36	175.6	-65.7	-24.4	0	0	0	110.6	Y403 D405 V406 K411 H412	Y403-N408 HydrophobicContact CD1-CB 4.25Å; D405-N408 HydrophobicContact CB-CB 4.32Å; D405-N408 WeakPolarHBondContact O-CA 3.4Å; D405-N408 PolarHBondContact O-N 3.32Å; D405-N408 PolarHBondContact OD2-ND2 2.94Å; V406-N408 VanDerWaalsContact C-N 3.31Å; V406-N408 PolarHBondContact O-N 3.11Å; N408-K411 PolarHBondContact O-N 3.16Å; N408-H412 WeakPolarHBondContact O-CB 3.47Å; N408-H412 PolarHBondContact O-N 3.19Å
409	L	77.6	Confident	73.2	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-58.6	-49.6	168.5	174.2	56.2	0	0	0	111.9	Q394 C396 Y403 D405 V406 K411 H412 M413 L431	Q394-L409 HydrophobicContact CB-CD2 3.61Å; C396-L409 HydrophobicContact CB-CD1 3.71Å; Y403-L409 HydrophobicContact CD2-CB 4.38Å; Y403-L409 HydrophobicContact CD2-CD1 4.02Å; Y403-L409 HydrophobicContact CG-CB 4.39Å; D405-L409 PolarHBondContact O-N 3.36Å; V406-L409 PolarHBondContact O-N 3.19Å; L409-K411 VanDerWaalsContact C-N 3.34Å; L409-K411 PolarHBondContact O-N 3.11Å; L409-H412 WeakPolarHBondContact O-CA 3.19Å; L409-H412 WeakPolarHBondContact O-CB 3.48Å; L409-H412 PolarHBondContact O-N 2.83Å; L409-M413 HydrophobicContact CD1-CG 4.23Å; L409-M413 HydrophobicContact CD1-SD 4.3Å; L409-M413 HydrophobicContact CG-SD 4.35Å; L409-M413 WeakPolarHBondContact O-CG 3.42Å; L409-M413 PolarHBondContact O-N 3.33Å; L409-L431 HydrophobicContact CD2-CD1 3.9Å; L409-L431 HydrophobicContact CD2-CD2 4.31Å; L409-L431 HydrophobicContact CG-CD1 4.34Å
410	L	78.4	Confident	73	Confident	19 Å²	19	81.3 Å²	81.3	10%	0.099	39%	0.386	C	S	.	.	H	α-helix	trans	-58.9	-42.2	177.1	-73.7	168.3	0	0	0	112.3	V406 H412 M413 E414 Y428 L431 R432 T435	V406-L410 HydrophobicContact CG1-CD1 4.03Å; V406-L410 HydrophobicContact CG1-CG 4.27Å; V406-L410 WeakPolarHBondContact O-CB 3.45Å; V406-L410 VanDerWaalsContact O-CG 3.24Å; V406-L410 WeakPolarHBondContact O-CG 3.37Å; V406-L410 PolarHBondContact O-N 2.81Å; L410-H412 VanDerWaalsContact C-N 3.31Å; L410-H412 PolarHBondContact O-N 3.06Å; L410-M413 PolarHBondContact O-N 2.87Å; L410-E414 VanDerWaalsContact O-CB 3.27Å; L410-E414 WeakPolarHBondContact O-CB 3.18Å; L410-E414 PolarHBondContact O-N 2.76Å; L410-Y428 HydrophobicContact CB-CD2 4.47Å; L410-Y428 HydrophobicContact CB-CE2 4.03Å; L410-Y428 HydrophobicContact CD2-CD2 3.4Å; L410-Y428 VanDerWaalsContact CD2-CD2 3.4Å; L410-Y428 HydrophobicContact CD2-CE2 3.62Å; L410-Y428 HydrophobicContact CD2-CG 4.26Å; L410-Y428 WeakPolarHBondContact CD2-O 3.4Å; L410-Y428 HydrophobicContact CG-CE2 4.44Å; L410-Y428 WeakPolarHBondContact O-CE2 3.32Å; L410-L431 HydrophobicContact CD2-CB 3.73Å; L410-L431 HydrophobicContact CG-CB 4.42Å; L410-R432 HydrophobicContact CD1-CB 4.35Å; L410-R432 HydrophobicContact CD2-CB 4.16Å; L410-T435 HydrophobicContact CD1-CG2 3.87Å
411	K	77.6	Confident	73.6	Confident	118 Å²	118	76.4 Å²	76.4	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-61.4	-39.3	172.6	-82.8	179.4	168.4	-169.6	0	112.5	K407 N408 L409 E414 T415	K407-K411 WeakPolarHBondContact O-CG 3.3Å; K407-K411 PolarHBondContact O-N 3.47Å; N408-K411 PolarHBondContact O-N 3.16Å; L409-K411 VanDerWaalsContact C-N 3.34Å; L409-K411 PolarHBondContact O-N 3.11Å; K411-E414 PolarHBondContact O-N 3.46Å; K411-T415 WeakPolarHBondContact O-CB 3.07Å; K411-T415 WeakPolarHBondContact O-CG2 3.25Å; K411-T415 PolarHBondContact O-N 2.95Å; K411-T415 VanDerWaalsContact O-N 3.15Å; K411-T415 PolarHBondContact O-OG1 3.31Å
412	H	80.8	Confident	73.7	Confident	9 Å²	9	74.7 Å²	74.7	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-65.8	-46	177.8	155.9	55.5	0	0	0	111	C396 C399 Y403 N408 L409 L410 E414 T415 R416 H417	C396-H412 WeakPolarHBondContact CB-NE2 3.35Å; C396-H412 PolarHBondContact SG-NE2 2.99Å; C399-H412 PolarHBondContact SG-CE1 3.15Å; C399-H412 PolarHBondContact SG-NE2 3.13Å; Y403-H412 HydrophobicContact CE1-CB 4.01Å; Y403-H412 HydrophobicContact CE2-CB 3.87Å; Y403-H412 AromaticContact CE2-CD2 3.22Å; Y403-H412 WeakPolarHBondContact CE2-CD2 3.45Å; Y403-H412 AromaticContact CE2-CG 3.52Å; Y403-H412 AromaticContact CE2-NE2 3.9Å; Y403-H412 AromaticContact CZ-CD2 3.68Å; Y403-H412 AromaticContact CZ-CG 3.45Å; Y403-H412 VanDerWaalsContact CZ-CG 3.45Å; Y403-H412 VanDerWaalsContact OH-CG 3.23Å; Y403-H412 PolarHBondContact OH-ND1 2.98Å; N408-H412 WeakPolarHBondContact O-CB 3.47Å; N408-H412 PolarHBondContact O-N 3.19Å; L409-H412 WeakPolarHBondContact O-CA 3.19Å; L409-H412 WeakPolarHBondContact O-CB 3.48Å; L409-H412 PolarHBondContact O-N 2.83Å; L410-H412 VanDerWaalsContact C-N 3.31Å; L410-H412 PolarHBondContact O-N 3.06Å; H412-E414 VanDerWaalsContact C-N 3.32Å; H412-E414 PolarHBondContact O-N 2.82Å; H412-T415 CarbonylContact O-C 3.6Å; H412-T415 PolarHBondContact O-N 3.26Å; H412-T415 VanDerWaalsContact O-N 3.09Å; H412-T415 PolarHBondContact O-OG1 3.46Å; H412-R416 WeakPolarHBondContact ND1-CB 3.26Å; H412-R416 WeakPolarHBondContact O-CB 3.25Å; H412-R416 PolarHBondContact O-N 2.61Å; H412-H417 AromaticContact CE1-CD2 3.64Å; H412-H417 AromaticContact CE1-NE2 3.34Å; H412-H417 PolarHBondContact CE1-NE2 2.99Å; H412-H417 VanDerWaalsContact CE1-NE2 3.34Å; H412-H417 AromaticContact NE2-CD2 3.63Å; H412-H417 AromaticContact NE2-NE2 3.29Å; H412-H417 PolarHBondContact NE2-NE2 3.38Å
413	M	73.6	Confident	73.7	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-57.8	-46.1	173.3	-64.9	176.8	80.8	0	0	111.1	F398 L409 L410 T415 H417 V424 T427 Y428 L431	F398-M413 HydrophobicContact CD2-CE 4.11Å; F398-M413 HydrophobicContact CE2-CE 3.91Å; L409-M413 HydrophobicContact CD1-CG 4.23Å; L409-M413 HydrophobicContact CD1-SD 4.3Å; L409-M413 HydrophobicContact CG-SD 4.35Å; L409-M413 WeakPolarHBondContact O-CG 3.42Å; L409-M413 PolarHBondContact O-N 3.33Å; L410-M413 PolarHBondContact O-N 2.87Å; M413-T415 PolarHBondContact O-N 3.11Å; M413-T415 VanDerWaalsContact O-N 3.12Å; M413-H417 PolarHBondContact O-N 2.75Å; M413-H417 VanDerWaalsContact O-N 3.17Å; M413-V424 HydrophobicContact CE-CG1 4.36Å; M413-T427 WeakPolarHBondContact CE-OG1 3.45Å; M413-Y428 HydrophobicContact CB-CD2 4.03Å; M413-L431 HydrophobicContact CE-CD1 4.32Å; M413-L431 HydrophobicContact SD-CD1 3.6Å
414	E	76.9	Confident	73.8	Confident	70 Å²	70	68 Å²	68	33%	0.327	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-9.1	176.6	-178.5	168.7	-118	0	0	115.2	L410 K411 H412 L419 Y428 K871	L410-E414 VanDerWaalsContact O-CB 3.27Å; L410-E414 WeakPolarHBondContact O-CB 3.18Å; L410-E414 PolarHBondContact O-N 2.76Å; K411-E414 PolarHBondContact O-N 3.46Å; H412-E414 VanDerWaalsContact C-N 3.32Å; H412-E414 PolarHBondContact O-N 2.82Å; E414-L419 HydrophobicContact CB-CD1 4.18Å; E414-L419 HydrophobicContact CG-CD1 4.13Å; E414-Y428 HydrophobicContact CB-CE2 4.19Å; E414-Y428 PolarHBondContact OE1-OH 3.45Å; E414-K871 IonicContact OE1-NZ 2.67Å; E414-K871 PolarHBondContact OE1-NZ 3.36Å; E414-K871 IonicContact OE2-NZ 3.85Å; E414-K871 PolarHBondContact OE2-NZ 3.34Å
415	T	76.1	Confident	74.6	Confident	103 Å²	103	67.3 Å²	67.3	63%	0.632	34%	0.341	S	S	*	.	H	α-helix	trans	-130.4	-5.1	-176.5	55.3	0	0	0	0	115.4	K411 H412 M413	K411-T415 WeakPolarHBondContact O-CB 3.07Å; K411-T415 WeakPolarHBondContact O-CG2 3.25Å; K411-T415 PolarHBondContact O-N 2.95Å; K411-T415 VanDerWaalsContact O-N 3.15Å; K411-T415 PolarHBondContact O-OG1 3.31Å; H412-T415 CarbonylContact O-C 3.6Å; H412-T415 PolarHBondContact O-N 3.26Å; H412-T415 VanDerWaalsContact O-N 3.09Å; H412-T415 PolarHBondContact O-OG1 3.46Å; M413-T415 PolarHBondContact O-N 3.11Å; M413-T415 VanDerWaalsContact O-N 3.12Å
416	R	74.5	Confident	75	Confident	185 Å²	185	70.3 Å²	70.3	70%	0.698	35%	0.353	S	S	*	.	H	α-helix	trans	-138.1	-10.1	-177.3	-64.4	-64	-173.1	128.7	-2.1	114.4	H412	H412-R416 WeakPolarHBondContact ND1-CB 3.26Å; H412-R416 WeakPolarHBondContact O-CB 3.25Å; H412-R416 PolarHBondContact O-N 2.61Å
417	H	75.5	Confident	75.3	Confident	42 Å²	42	70.3 Å²	70.3	19%	0.194	35%	0.353	C	S	.	.	S	Bend	trans	-124.5	149	173.7	-63.3	-75.2	0	0	0	108.5	F398 H412 M413 L419 V424	F398-H417 PolarHBondContact O-CE1 2.94Å; F398-H417 VanDerWaalsContact O-CE1 3.28Å; H412-H417 AromaticContact CE1-CD2 3.64Å; H412-H417 AromaticContact CE1-NE2 3.34Å; H412-H417 PolarHBondContact CE1-NE2 2.99Å; H412-H417 VanDerWaalsContact CE1-NE2 3.34Å; H412-H417 AromaticContact NE2-CD2 3.63Å; H412-H417 AromaticContact NE2-NE2 3.29Å; H412-H417 PolarHBondContact NE2-NE2 3.38Å; M413-H417 PolarHBondContact O-N 2.75Å; M413-H417 VanDerWaalsContact O-N 3.17Å; H417-L419 PolarHBondContact O-N 3.19Å; H417-V424 HydrophobicContact CB-CG1 3.66Å
418	N	76.4	Confident	75.6	Confident	79 Å²	79	66 Å²	66	42%	0.422	33%	0.334	S	S	.	.			trans	-82.6	113.2	-173.4	179.4	21.9	0	0	0	110	K420 D421	N418-K420 PolarHBondContact O-N 2.8Å; N418-K420 VanDerWaalsContact O-N 3.09Å; N418-K420 WeakPolarHBondContact OD1-CB 3.37Å; N418-K420 WeakPolarHBondContact OD1-CG 3.38Å; N418-K420 PolarHBondContact OD1-N 3.23Å; N418-D421 WeakPolarHBondContact CB-OD2 3.47Å; N418-D421 PolarHBondContact ND2-OD1 2.9Å; N418-D421 PolarHBondContact O-N 3.1Å
419	L	71.6	Confident	75.6	Confident	50 Å²	50	67.5 Å²	67.5	26%	0.262	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	1.6	178.9	-69.3	179.4	0	0	0	113.9	E414 H417 V424 Y428	E414-L419 HydrophobicContact CB-CD1 4.18Å; E414-L419 HydrophobicContact CG-CD1 4.13Å; H417-L419 PolarHBondContact O-N 3.19Å; L419-V424 HydrophobicContact CD2-CG1 4.33Å; L419-Y428 HydrophobicContact CD1-CD1 4.39Å; L419-Y428 HydrophobicContact CD1-CE1 4.02Å; L419-Y428 HydrophobicContact CD2-CD1 3.64Å; L419-Y428 HydrophobicContact CD2-CD2 4.14Å; L419-Y428 HydrophobicContact CD2-CE1 4.11Å; L419-Y428 HydrophobicContact CD2-CG 3.66Å
420	K	69.5	Low	75.4	Confident	184 Å²	184	72.7 Å²	72.7	80%	0.8	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-25.3	165.7	-60.1	-179.8	177.1	-174.9	0	112.5	N418 S422	N418-K420 PolarHBondContact O-N 2.8Å; N418-K420 VanDerWaalsContact O-N 3.09Å; N418-K420 WeakPolarHBondContact OD1-CB 3.37Å; N418-K420 WeakPolarHBondContact OD1-CG 3.38Å; N418-K420 PolarHBondContact OD1-N 3.23Å; K420-S422 PolarHBondContact O-N 2.85Å
421	D	77.3	Confident	75.1	Confident	78 Å²	78	73 Å²	73	42%	0.417	37%	0.365	S	S	.	.	S	Bend	trans	-75.2	121.1	-175.9	-50.2	-18.9	0	0	0	109.2	N418 A423 V424 L425	N418-D421 WeakPolarHBondContact CB-OD2 3.47Å; N418-D421 PolarHBondContact ND2-OD1 2.9Å; N418-D421 PolarHBondContact O-N 3.1Å; D421-A423 VanDerWaalsContact C-N 3.33Å; D421-A423 PolarHBondContact O-N 3.47Å; D421-V424 HydrophobicContact CB-CB 4.16Å; D421-V424 HydrophobicContact CB-CG2 3.93Å; D421-V424 PolarHBondContact O-N 3Å; D421-L425 WeakPolarHBondContact O-CB 3.1Å; D421-L425 PolarHBondContact O-N 2.84Å
422	S	72.4	Confident	74.8	Confident	79 Å²	79	71.9 Å²	71.9	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-55.1	-43.6	-169.5	-171	0	0	0	0	113.2	K420 V424 L425 Q426	K420-S422 PolarHBondContact O-N 2.85Å; S422-V424 PolarHBondContact O-N 2.99Å; S422-L425 PolarHBondContact O-N 3.46Å; S422-Q426 WeakPolarHBondContact O-CB 3.41Å; S422-Q426 VanDerWaalsContact O-CG 3.27Å; S422-Q426 WeakPolarHBondContact O-CG 3.4Å; S422-Q426 PolarHBondContact O-N 3.48Å; S422-Q426 PolarHBondContact OG-NE2 2.65Å
423	A	73.8	Confident	74.3	Confident	56 Å²	56	76.5 Å²	76.5	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-65.1	-39.8	178	0	0	0	0	0	113.4	F398 D421 T427	F398-A423 HydrophobicContact CE1-CB 4.37Å; D421-A423 VanDerWaalsContact C-N 3.33Å; D421-A423 PolarHBondContact O-N 3.47Å; A423-T427 WeakPolarHBondContact O-CB 3.5Å; A423-T427 WeakPolarHBondContact O-CG2 3.45Å; A423-T427 PolarHBondContact O-N 2.85Å; A423-T427 VanDerWaalsContact O-N 3.12Å; A423-T427 PolarHBondContact O-OG1 2.82Å
424	V	76.4	Confident	73.7	Confident	8 Å²	8	83.2 Å²	83.2	5%	0.048	41%	0.411	C	S	.	.	H	α-helix	trans	-67.7	-40	175.5	-179.7	0	0	0	0	110	F398 M413 H417 L419 D421 S422 T427 Y428	F398-V424 HydrophobicContact CD1-CG2 3.95Å; F398-V424 HydrophobicContact CD2-CG2 4.44Å; F398-V424 HydrophobicContact CE1-CG2 3.91Å; F398-V424 HydrophobicContact CE2-CG2 4.43Å; F398-V424 HydrophobicContact CG-CG2 4.23Å; F398-V424 HydrophobicContact CZ-CG2 4.17Å; M413-V424 HydrophobicContact CE-CG1 4.36Å; H417-V424 HydrophobicContact CB-CG1 3.66Å; L419-V424 HydrophobicContact CD2-CG1 4.33Å; D421-V424 HydrophobicContact CB-CB 4.16Å; D421-V424 HydrophobicContact CB-CG2 3.93Å; D421-V424 PolarHBondContact O-N 3Å; S422-V424 PolarHBondContact O-N 2.99Å; V424-T427 PolarHBondContact O-OG1 3.29Å; V424-Y428 WeakPolarHBondContact O-CB 3.34Å; V424-Y428 PolarHBondContact O-N 3.09Å
425	L	75.4	Confident	73.1	Confident	59 Å²	59	81 Å²	81	31%	0.309	40%	0.403	S	S	.	.	H	α-helix	trans	-68	-45.8	178.7	-178.1	58.5	0	0	0	112.1	D421 S422 Y428 Q429	D421-L425 WeakPolarHBondContact O-CB 3.1Å; D421-L425 PolarHBondContact O-N 2.84Å; S422-L425 PolarHBondContact O-N 3.46Å; L425-Y428 HydrophobicContact CD1-CD1 4.46Å; L425-Y428 PolarHBondContact O-N 3.12Å; L425-Q429 HydrophobicContact CD1-CG 4.36Å; L425-Q429 WeakPolarHBondContact O-CB 3.33Å; L425-Q429 WeakPolarHBondContact O-CG 3.47Å; L425-Q429 PolarHBondContact O-N 3.13Å
426	Q	74.8	Confident	72.1	Confident	121 Å²	121	86.8 Å²	86.8	57%	0.565	41%	0.413	S	S	*	.	H	α-helix	trans	-61.7	-47.7	177.3	-74.7	177	7.4	0	0	111.8	S422 Q429 Q430	S422-Q426 WeakPolarHBondContact O-CB 3.41Å; S422-Q426 VanDerWaalsContact O-CG 3.27Å; S422-Q426 WeakPolarHBondContact O-CG 3.4Å; S422-Q426 PolarHBondContact O-N 3.48Å; S422-Q426 PolarHBondContact OG-NE2 2.65Å; Q426-Q429 WeakPolarHBondContact O-CB 3.45Å; Q426-Q429 PolarHBondContact O-N 3.27Å; Q426-Q430 WeakPolarHBondContact O-CB 3.25Å; Q426-Q430 PolarHBondContact O-N 3.1Å
427	T	76.8	Confident	70.9	Confident	39 Å²	39	82.7 Å²	82.7	24%	0.239	40%	0.402	C	S	.	.	H	α-helix	trans	-65.9	-39.4	176.8	50.8	0	0	0	0	112.2	F398 M413 A423 V424 Q429 Q430 L431	F398-T427 HydrophobicContact CE2-CG2 4.09Å; F398-T427 WeakPolarHBondContact CE2-OG1 3.38Å; F398-T427 HydrophobicContact CZ-CG2 3.93Å; F398-T427 WeakPolarHBondContact CZ-OG1 3.42Å; M413-T427 WeakPolarHBondContact CE-OG1 3.45Å; A423-T427 WeakPolarHBondContact O-CB 3.5Å; A423-T427 WeakPolarHBondContact O-CG2 3.45Å; A423-T427 PolarHBondContact O-N 2.85Å; A423-T427 VanDerWaalsContact O-N 3.12Å; A423-T427 PolarHBondContact O-OG1 2.82Å; V424-T427 PolarHBondContact O-OG1 3.29Å; T427-Q429 PolarHBondContact O-N 2.97Å; T427-Q430 PolarHBondContact O-N 3.14Å; T427-L431 WeakPolarHBondContact O-CB 3.21Å; T427-L431 WeakPolarHBondContact O-CG 3.4Å; T427-L431 PolarHBondContact O-N 2.98Å
428	Y	78.8	Confident	69.7	Low	25 Å²	25	81 Å²	81	10%	0.098	40%	0.395	C	S	.	.	H	α-helix	trans	-59.9	-43.3	171.5	175	-109.6	0	0	0	111.8	L410 M413 E414 L419 V424 L425 R432	L410-Y428 HydrophobicContact CB-CD2 4.47Å; L410-Y428 HydrophobicContact CB-CE2 4.03Å; L410-Y428 HydrophobicContact CD2-CD2 3.4Å; L410-Y428 VanDerWaalsContact CD2-CD2 3.4Å; L410-Y428 HydrophobicContact CD2-CE2 3.62Å; L410-Y428 HydrophobicContact CD2-CG 4.26Å; L410-Y428 WeakPolarHBondContact CD2-O 3.4Å; L410-Y428 HydrophobicContact CG-CE2 4.44Å; L410-Y428 WeakPolarHBondContact O-CE2 3.32Å; M413-Y428 HydrophobicContact CB-CD2 4.03Å; E414-Y428 HydrophobicContact CB-CE2 4.19Å; E414-Y428 PolarHBondContact OE1-OH 3.45Å; L419-Y428 HydrophobicContact CD1-CD1 4.39Å; L419-Y428 HydrophobicContact CD1-CE1 4.02Å; L419-Y428 HydrophobicContact CD2-CD1 3.64Å; L419-Y428 HydrophobicContact CD2-CD2 4.14Å; L419-Y428 HydrophobicContact CD2-CE1 4.11Å; L419-Y428 HydrophobicContact CD2-CG 3.66Å; V424-Y428 WeakPolarHBondContact O-CB 3.34Å; V424-Y428 PolarHBondContact O-N 3.09Å; L425-Y428 HydrophobicContact CD1-CD1 4.46Å; L425-Y428 PolarHBondContact O-N 3.12Å; Y428-R432 WeakPolarHBondContact O-CB 3.35Å; Y428-R432 PolarHBondContact O-N 2.89Å
429	Q	73.5	Confident	68.5	Low	92 Å²	92	83 Å²	83	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-46	174.4	-72.7	173.8	16.3	0	0	111.7	L425 Q426 T427 L431 R432 L433	L425-Q429 HydrophobicContact CD1-CG 4.36Å; L425-Q429 WeakPolarHBondContact O-CB 3.33Å; L425-Q429 WeakPolarHBondContact O-CG 3.47Å; L425-Q429 PolarHBondContact O-N 3.13Å; Q426-Q429 WeakPolarHBondContact O-CB 3.45Å; Q426-Q429 PolarHBondContact O-N 3.27Å; T427-Q429 PolarHBondContact O-N 2.97Å; Q429-L431 PolarHBondContact O-N 3.14Å; Q429-R432 WeakPolarHBondContact O-CB 3.22Å; Q429-R432 PolarHBondContact O-N 3.02Å; Q429-R432 VanDerWaalsContact O-N 3.15Å; Q429-L433 WeakPolarHBondContact O-CG 3.43Å; Q429-L433 PolarHBondContact O-N 3.49Å
430	Q	72.9	Confident	67.1	Low	110 Å²	110	88 Å²	88	51%	0.514	42%	0.421	S	S	.	.	H	α-helix	trans	-63	-43.5	179.1	-158.6	-157.4	78.2	0	0	111.9	Q426 T427 R432 L433 K434	Q426-Q430 WeakPolarHBondContact O-CB 3.25Å; Q426-Q430 PolarHBondContact O-N 3.1Å; T427-Q430 PolarHBondContact O-N 3.14Å; Q430-R432 VanDerWaalsContact C-N 3.33Å; Q430-R432 PolarHBondContact O-N 2.9Å; Q430-L433 PolarHBondContact O-N 3.2Å; Q430-K434 WeakPolarHBondContact O-CG 3.46Å; Q430-K434 PolarHBondContact O-N 3.42Å; Q430-K434 VanDerWaalsContact O-N 3.15Å
431	L	72.5	Confident	66.2	Low	26 Å²	26	83.5 Å²	83.5	14%	0.136	40%	0.403	C	S	.	.	H	α-helix	trans	-66.2	-33.7	173.9	-73.6	167.2	0	0	0	112.1	V406 L409 L410 M413 T427 Q429	V406-L431 HydrophobicContact CG1-CB 4.46Å; L409-L431 HydrophobicContact CD2-CD1 3.9Å; L409-L431 HydrophobicContact CD2-CD2 4.31Å; L409-L431 HydrophobicContact CG-CD1 4.34Å; L410-L431 HydrophobicContact CD2-CB 3.73Å; L410-L431 HydrophobicContact CG-CB 4.42Å; M413-L431 HydrophobicContact CE-CD1 4.32Å; M413-L431 HydrophobicContact SD-CD1 3.6Å; T427-L431 WeakPolarHBondContact O-CB 3.21Å; T427-L431 WeakPolarHBondContact O-CG 3.4Å; T427-L431 PolarHBondContact O-N 2.98Å; Q429-L431 PolarHBondContact O-N 3.14Å
432	R	72.3	Confident	64.9	Low	93 Å²	93	85.9 Å²	85.9	35%	0.351	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-45.7	175.2	-178.3	179.1	177.7	-145.3	-0.4	111.3	L410 Y428 Q429 Q430 K434 T435 G438	L410-R432 HydrophobicContact CD1-CB 4.35Å; L410-R432 HydrophobicContact CD2-CB 4.16Å; Y428-R432 WeakPolarHBondContact O-CB 3.35Å; Y428-R432 PolarHBondContact O-N 2.89Å; Q429-R432 WeakPolarHBondContact O-CB 3.22Å; Q429-R432 PolarHBondContact O-N 3.02Å; Q429-R432 VanDerWaalsContact O-N 3.15Å; Q430-R432 VanDerWaalsContact C-N 3.33Å; Q430-R432 PolarHBondContact O-N 2.9Å; R432-K434 VanDerWaalsContact C-N 3.31Å; R432-K434 PolarHBondContact O-N 3.17Å; R432-T435 PolarHBondContact O-N 3.05Å; R432-T435 PolarHBondContact O-OG1 3.43Å; R432-G438 WeakPolarHBondContact O-CA 3.4Å
433	L	68.6	Low	64.1	Low	106 Å²	106	86 Å²	86	56%	0.555	41%	0.408	S	S	*	.	H	α-helix	trans	-58.2	-40.7	175.5	-72	169.8	0	0	0	112	Q429 Q430 T435	Q429-L433 WeakPolarHBondContact O-CG 3.43Å; Q429-L433 PolarHBondContact O-N 3.49Å; Q430-L433 PolarHBondContact O-N 3.2Å; L433-T435 PolarHBondContact O-N 3.44Å
434	K	61	Low	63.5	Low	142 Å²	142	86.7 Å²	86.7	62%	0.617	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-6.1	174.3	-73	167.9	175.7	169.4	0	114.4	Q430 R432	Q430-K434 WeakPolarHBondContact O-CG 3.46Å; Q430-K434 PolarHBondContact O-N 3.42Å; Q430-K434 VanDerWaalsContact O-N 3.15Å; R432-K434 VanDerWaalsContact C-N 3.31Å; R432-K434 PolarHBondContact O-N 3.17Å
435	T	64.9	Low	62.9	Low	25 Å²	25	91 Å²	91	15%	0.153	42%	0.419	C	S	.	.	S	Bend	trans	-99.9	144.1	176.5	72.5	0	0	0	0	114.2	V406 L410 R432 L433 Q437 G438 L439	V406-T435 HydrophobicContact CB-CG2 4Å; V406-T435 HydrophobicContact CG1-CG2 3.54Å; L410-T435 HydrophobicContact CD1-CG2 3.87Å; R432-T435 PolarHBondContact O-N 3.05Å; R432-T435 PolarHBondContact O-OG1 3.43Å; L433-T435 PolarHBondContact O-N 3.44Å; T435-Q437 PolarHBondContact O-N 2.86Å; T435-Q437 PolarHBondContact OG1-N 2.97Å; T435-G438 PolarHBondContact O-N 3.44Å; T435-G438 PolarHBondContact OG1-N 3.38Å; T435-L439 PolarHBondContact O-N 3.41Å
436	R	54.7	Low	62.6	Low	224 Å²	224	88.2 Å²	88.2	85%	0.845	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-2.2	167	-70.4	-175.1	174	-171.9	-2	114.8	R440	R436-R440 WeakPolarHBondContact O-CD 3.49Å
437	Q	49.7	Very low	62.1	Low	99 Å²	99	85.8 Å²	85.8	46%	0.463	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-29.9	168	-68.6	-154.4	-103.5	0	0	112.8	T435 R440 Q441	T435-Q437 PolarHBondContact O-N 2.86Å; T435-Q437 PolarHBondContact OG1-N 2.97Å; Q437-R440 CarbonylContact O-C 3.45Å; Q437-R440 VanDerWaalsContact O-C 3.3Å; Q437-R440 WeakPolarHBondContact O-CA 2.99Å; Q437-R440 PolarHBondContact O-N 3.06Å; Q437-R440 VanDerWaalsContact O-N 3.09Å; Q437-Q441 WeakPolarHBondContact O-CB 3.34Å; Q437-Q441 WeakPolarHBondContact O-CG 3.41Å; Q437-Q441 PolarHBondContact O-N 3.23Å
438	G	51	Low	61.6	Low	5 Å²	5	88.1 Å²	88.1	5%	0.052	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-62.9	-48.3	170.9	0	0	0	0	0	111.8	R432 T435 R440 Q441 L442	R432-G438 WeakPolarHBondContact O-CA 3.4Å; T435-G438 PolarHBondContact O-N 3.44Å; T435-G438 PolarHBondContact OG1-N 3.38Å; G438-R440 PolarHBondContact O-N 2.97Å; G438-Q441 PolarHBondContact O-N 3.34Å; G438-L442 PolarHBondContact O-N 3.45Å
439	L	50.8	Low	61.2	Low	122 Å²	122	89.1 Å²	89.1	64%	0.639	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-60.4	-0.3	169.1	-71.5	162.9	0	0	0	114.6	T435	T435-L439 PolarHBondContact O-N 3.41Å
440	R	43.2	Very low	60.4	Low	155 Å²	155	90.4 Å²	90.4	59%	0.585	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-128.5	12	173	-66.3	-177.9	172.2	-176.6	-3.7	113	R436 Q437 G438	R436-R440 WeakPolarHBondContact O-CD 3.49Å; Q437-R440 CarbonylContact O-C 3.45Å; Q437-R440 VanDerWaalsContact O-C 3.3Å; Q437-R440 WeakPolarHBondContact O-CA 2.99Å; Q437-R440 PolarHBondContact O-N 3.06Å; Q437-R440 VanDerWaalsContact O-N 3.09Å; G438-R440 PolarHBondContact O-N 2.97Å
441	Q	49	Very low	59.5	Low	90 Å²	90	93 Å²	93	42%	0.421	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-7.3	177.9	-88.4	-172	-6.8	0	0	113.3	Q437 G438 L443	Q437-Q441 WeakPolarHBondContact O-CB 3.34Å; Q437-Q441 WeakPolarHBondContact O-CG 3.41Å; Q437-Q441 PolarHBondContact O-N 3.23Å; G438-Q441 PolarHBondContact O-N 3.34Å; Q441-L443 PolarHBondContact O-N 2.85Å
442	L	50.1	Low	58.9	Low	127 Å²	127	100.9 Å²	100.9	67%	0.665	47%	0.466	S	S	*	.	S	Bend	trans	-64.3	89	148.3	-67.8	171.6	0	0	0	107	G438 Y444	G438-L442 PolarHBondContact O-N 3.45Å; L442-Y444 WeakPolarHBondContact O-CD2 3.18Å; L442-Y444 PolarHBondContact O-N 2.94Å; L442-Y444 VanDerWaalsContact O-N 3.17Å
443	L	56.3	Low	58.8	Low	81 Å²	81	98.3 Å²	98.3	42%	0.424	46%	0.458	S	S	.	.			trans	-75.9	101.1	-179.5	-79.6	169.8	0	0	0	108.8	Q441 H445 R452 F453	Q441-L443 PolarHBondContact O-N 2.85Å; L443-H445 PolarHBondContact O-N 3.23Å; L443-R452 HydrophobicContact CB-CB 4.24Å; L443-R452 HydrophobicContact CD1-CB 4.44Å; L443-F453 WeakPolarHBondContact CD2-O 3.45Å
444	Y	61.3	Low	58.1	Low	72 Å²	72	99.8 Å²	99.8	28%	0.282	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	104.4	176.3	-67.6	-80	0	0	0	110.8	L442 F453 Q456	L442-Y444 WeakPolarHBondContact O-CD2 3.18Å; L442-Y444 PolarHBondContact O-N 2.94Å; L442-Y444 VanDerWaalsContact O-N 3.17Å; Y444-F453 PolarHBondContact N-O 2.99Å; Y444-F453 WeakPolarHBondContact O-CB 3.11Å; Y444-F453 WeakPolarHBondContact O-CD2 3.44Å; Y444-F453 PolarHBondContact O-N 3.23Å; Y444-Q456 HydrophobicContact CD1-CB 3.95Å; Y444-Q456 HydrophobicContact CD1-CG 3.68Å; Y444-Q456 HydrophobicContact CD2-CB 4.23Å; Y444-Q456 VanDerWaalsContact CD2-N 3.34Å; Y444-Q456 HydrophobicContact CE1-CB 3.59Å; Y444-Q456 HydrophobicContact CE1-CG 3.39Å; Y444-Q456 HydrophobicContact CE2-CB 3.89Å; Y444-Q456 HydrophobicContact CG-CB 4.23Å; Y444-Q456 HydrophobicContact CG-CG 4.38Å; Y444-Q456 PolarHBondContact OH-OE1 3.21Å; Y444-Q456 VanDerWaalsContact OH-OE1 3.12Å
445	H	64.4	Low	58.2	Low	98 Å²	98	95.7 Å²	95.7	45%	0.454	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.6	-177.7	63	97.3	0	0	0	111.4	L443 P447 R451 R459	L443-H445 PolarHBondContact O-N 3.23Å; H445-P447 VanDerWaalsContact O-CD 3.31Å; H445-P447 WeakPolarHBondContact O-CD 3.21Å; H445-R451 CarbonylContact C-O 3.59Å; H445-R451 WeakPolarHBondContact CA-O 3.43Å; H445-R459 VanDerWaalsContact O-CD 3.3Å; H445-R459 WeakPolarHBondContact O-CD 3.47Å; H445-R459 PolarHBondContact O-NE 3.05Å
446	C	69.4	Low	58.2	Low	0 Å²	0	98.5 Å²	98.5	0%	0	46%	0.456	C	S	.	.			trans	-79.1	114.6	165.7	-156.7	0	0	0	0	108.7	T448 C449 N450 R451 F453 H462 L463 H466	C446-T448 VanDerWaalsContact C-N 3.29Å; C446-T448 PolarHBondContact O-N 3.33Å; C446-T448 PolarHBondContact SG-OG1 2.67Å; C446-C449 PolarHBondContact O-N 3.01Å; C446-N450 VanDerWaalsContact O-CA 3.26Å; C446-N450 WeakPolarHBondContact O-CA 3.4Å; C446-N450 PolarHBondContact O-N 3.32Å; C446-R451 PolarHBondContact N-O 3.34Å; C446-F453 HydrophobicContact CB-CE2 4.22Å; C446-H462 PolarHBondContact SG-CD2 2.85Å; C446-L463 VanDerWaalsContact SG-CD2 3.54Å; C446-H466 PolarHBondContact SG-CD2 3.24Å; C446-H466 PolarHBondContact SG-NE2 3.26Å; C446-H466 VanDerWaalsContact SG-NE2 3.45Å
447	P	63.4	Low	58.9	Low	71 Å²	71	94 Å²	94	46%	0.461	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-45.9	174.3	18.2	-32.5	0	0	0	112.5	H445 C449 L463	H445-P447 VanDerWaalsContact O-CD 3.31Å; H445-P447 WeakPolarHBondContact O-CD 3.21Å; P447-C449 VanDerWaalsContact C-N 3.35Å; P447-C449 PolarHBondContact O-N 3.22Å; P447-L463 HydrophobicContact CG-CD2 4.34Å
448	T	66.6	Low	59.5	Low	87 Å²	87	92.7 Å²	92.7	53%	0.534	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13	-176.2	48.2	0	0	0	0	116.6	C446 H466	C446-T448 VanDerWaalsContact C-N 3.29Å; C446-T448 PolarHBondContact O-N 3.33Å; C446-T448 PolarHBondContact SG-OG1 2.67Å; T448-H466 HydrophobicContact CG2-CB 4.28Å; T448-H466 PolarHBondContact OG1-CD2 3.49Å; T448-H466 VanDerWaalsContact OG1-CD2 3.28Å; T448-H466 PolarHBondContact OG1-CE1 3.2Å; T448-H466 PolarHBondContact OG1-ND1 3.5Å; T448-H466 VanDerWaalsContact OG1-ND1 3.08Å; T448-H466 PolarHBondContact OG1-NE2 3.46Å
449	C	69.6	Low	60.7	Low	46 Å²	46	95.7 Å²	95.7	31%	0.311	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.9	13.2	178.8	71	0	0	0	0	115.4	C446 P447 R451 H462 H466	C446-C449 PolarHBondContact O-N 3.01Å; P447-C449 VanDerWaalsContact C-N 3.35Å; P447-C449 PolarHBondContact O-N 3.22Å; C449-R451 PolarHBondContact O-N 3.11Å; C449-H462 PolarHBondContact SG-NE2 3.41Å; C449-H466 VanDerWaalsContact SG-CE1 3.55Å; C449-H466 PolarHBondContact SG-NE2 3.44Å; C449-H466 VanDerWaalsContact SG-NE2 3.36Å
450	N	56.4	Low	61.6	Low	120 Å²	120	93.6 Å²	93.6	64%	0.642	44%	0.435	S	S	*	.			trans	54.4	7.9	176.3	-70.1	-60.4	0	0	0	117.6	C446 R452	C446-N450 VanDerWaalsContact O-CA 3.26Å; C446-N450 WeakPolarHBondContact O-CA 3.4Å; C446-N450 PolarHBondContact O-N 3.32Å; N450-R452 PolarHBondContact O-N 2.95Å
451	R	54.1	Low	62.8	Low	163 Å²	163	91 Å²	91	62%	0.615	43%	0.425	S	S	*	.			trans	-62.2	133.6	172.7	-73.4	-176.3	172.9	-175.6	2.1	110.7	H445 C446 C449 F453	H445-R451 CarbonylContact C-O 3.59Å; H445-R451 WeakPolarHBondContact CA-O 3.43Å; C446-R451 PolarHBondContact N-O 3.34Å; C449-R451 PolarHBondContact O-N 3.11Å; R451-F453 HydrophobicContact CB-CE2 3.52Å; R451-F453 HydrophobicContact CB-CZ 3.73Å; R451-F453 WeakPolarHBondContact O-CD2 3.39Å; R451-F453 VanDerWaalsContact O-CE2 3.28Å; R451-F453 WeakPolarHBondContact O-CE2 3.3Å
452	R	60.8	Low	63.9	Low	193 Å²	193	87.1 Å²	87.1	73%	0.728	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	120.5	-174.3	-64.2	-175.5	-175.2	-171.8	-0.6	111.1	L443 N450	L443-R452 HydrophobicContact CB-CB 4.24Å; L443-R452 HydrophobicContact CD1-CB 4.44Å; N450-R452 PolarHBondContact O-N 2.95Å
453	F	70.4	Confident	64.8	Low	38 Å²	38	83.5 Å²	83.5	17%	0.167	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	150	-175.1	-64.5	-85.6	0	0	0	112.8	L443 Y444 C446 R451 E458 R459 H462	L443-F453 WeakPolarHBondContact CD2-O 3.45Å; Y444-F453 PolarHBondContact N-O 2.99Å; Y444-F453 WeakPolarHBondContact O-CB 3.11Å; Y444-F453 WeakPolarHBondContact O-CD2 3.44Å; Y444-F453 PolarHBondContact O-N 3.23Å; C446-F453 HydrophobicContact CB-CE2 4.22Å; R451-F453 HydrophobicContact CB-CE2 3.52Å; R451-F453 HydrophobicContact CB-CZ 3.73Å; R451-F453 WeakPolarHBondContact O-CD2 3.39Å; R451-F453 VanDerWaalsContact O-CE2 3.28Å; R451-F453 WeakPolarHBondContact O-CE2 3.3Å; F453-E458 HydrophobicContact CB-CB 4.11Å; F453-E458 HydrophobicContact CD1-CB 3.96Å; F453-E458 HydrophobicContact CG-CB 4.4Å; F453-R459 HydrophobicContact CB-CB 4.1Å; F453-R459 HydrophobicContact CD2-CB 4.08Å; F453-R459 HydrophobicContact CG-CB 4.24Å; F453-H462 HydrophobicContact CE1-CB 3.91Å; F453-H462 AromaticContact CE1-CG 3.99Å; F453-H462 HydrophobicContact CE2-CB 4.1Å; F453-H462 AromaticContact CE2-CD2 3.17Å; F453-H462 WeakPolarHBondContact CE2-CD2 3.4Å; F453-H462 AromaticContact CE2-CG 3.76Å; F453-H462 AromaticContact CE2-NE2 3.92Å; F453-H462 HydrophobicContact CZ-CB 3.64Å; F453-H462 AromaticContact CZ-CD2 3.11Å; F453-H462 WeakPolarHBondContact CZ-CD2 3.31Å; F453-H462 AromaticContact CZ-CG 3.28Å; F453-H462 AromaticContact CZ-NE2 3.74Å
454	K	53.8	Low	65.4	Low	137 Å²	137	84.2 Å²	84.2	60%	0.596	39%	0.392	S	S	*	.	S	Bend	trans	-83.4	-21.4	-173.4	-176.4	178.9	178.3	-179.3	0	113.4
455	N	62.2	Low	65.5	Low	56 Å²	56	81.8 Å²	81.8	30%	0.299	38%	0.384	S	S	.	.	S	Bend	trans	-140.2	148	-178.9	-62.2	-55.4	0	0	0	108.6	Q457 E458 R459	N455-Q457 VanDerWaalsContact C-N 3.3Å; N455-Q457 PolarHBondContact O-N 3.31Å; N455-E458 HydrophobicContact CB-CB 4.38Å; N455-E458 HydrophobicContact CB-CG 4.13Å; N455-E458 VanDerWaalsContact ND2-CD 3.32Å; N455-E458 PolarHBondContact ND2-OE1 3.46Å; N455-E458 WeakPolarHBondContact O-CA 3.36Å; N455-E458 WeakPolarHBondContact O-CB 3.46Å; N455-E458 PolarHBondContact O-N 3.31Å; N455-R459 PolarHBondContact O-N 3.33Å
456	Q	64.4	Low	65.6	Low	85 Å²	85	80.8 Å²	80.8	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-56.7	-46.2	177.6	-158.2	174.1	-54.5	0	0	111.7	Y444 E458 R459 E460	Y444-Q456 HydrophobicContact CD1-CB 3.95Å; Y444-Q456 HydrophobicContact CD1-CG 3.68Å; Y444-Q456 HydrophobicContact CD2-CB 4.23Å; Y444-Q456 VanDerWaalsContact CD2-N 3.34Å; Y444-Q456 HydrophobicContact CE1-CB 3.59Å; Y444-Q456 HydrophobicContact CE1-CG 3.39Å; Y444-Q456 HydrophobicContact CE2-CB 3.89Å; Y444-Q456 HydrophobicContact CG-CB 4.23Å; Y444-Q456 HydrophobicContact CG-CG 4.38Å; Y444-Q456 PolarHBondContact OH-OE1 3.21Å; Y444-Q456 VanDerWaalsContact OH-OE1 3.12Å; Q456-E458 PolarHBondContact O-N 2.87Å; Q456-R459 CarbonylContact O-C 3.47Å; Q456-R459 WeakPolarHBondContact O-CA 3.43Å; Q456-R459 WeakPolarHBondContact O-CB 3.47Å; Q456-R459 PolarHBondContact O-N 2.91Å; Q456-E460 HydrophobicContact CG-CG 4.33Å; Q456-E460 VanDerWaalsContact CG-OE1 3.3Å; Q456-E460 WeakPolarHBondContact CG-OE1 3.36Å; Q456-E460 PolarHBondContact NE2-OE1 2.88Å; Q456-E460 WeakPolarHBondContact O-CG 3.43Å; Q456-E460 PolarHBondContact O-N 3.19Å
457	Q	69.3	Low	65.3	Low	129 Å²	129	82.1 Å²	82.1	60%	0.603	39%	0.393	S	S	*	.	H	α-helix	trans	-62.7	-6.2	174.6	-62.1	-179.1	-12.5	0	0	114.8	N455 E460 R461	N455-Q457 VanDerWaalsContact C-N 3.3Å; N455-Q457 PolarHBondContact O-N 3.31Å; Q457-E460 WeakPolarHBondContact CA-OE2 3.25Å; Q457-E460 PolarHBondContact N-OE2 3.21Å; Q457-R461 WeakPolarHBondContact O-CB 3.41Å; Q457-R461 PolarHBondContact O-NH1 2.99Å; Q457-R461 PolarHBondContact O-NH2 3.14Å
458	E	63.6	Low	65	Low	71 Å²	71	85.4 Å²	85.4	33%	0.332	41%	0.414	S	S	.	.	H	α-helix	trans	-97.9	-32.2	169.5	-70.4	167.2	-164.8	0	0	111.7	F453 N455 Q456 H462	F453-E458 HydrophobicContact CB-CB 4.11Å; F453-E458 HydrophobicContact CD1-CB 3.96Å; F453-E458 HydrophobicContact CG-CB 4.4Å; N455-E458 HydrophobicContact CB-CB 4.38Å; N455-E458 HydrophobicContact CB-CG 4.13Å; N455-E458 VanDerWaalsContact ND2-CD 3.32Å; N455-E458 PolarHBondContact ND2-OE1 3.46Å; N455-E458 WeakPolarHBondContact O-CA 3.36Å; N455-E458 WeakPolarHBondContact O-CB 3.46Å; N455-E458 PolarHBondContact O-N 3.31Å; Q456-E458 PolarHBondContact O-N 2.87Å; E458-H462 VanDerWaalsContact O-CB 3.25Å; E458-H462 WeakPolarHBondContact O-CB 3.49Å; E458-H462 PolarHBondContact O-N 2.78Å
459	R	76.5	Confident	64.4	Low	68 Å²	68	89.5 Å²	89.5	26%	0.257	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-51.8	164.8	172.6	-171.1	-178.2	-129.4	15.3	110.7	H445 F453 N455 Q456 R461 H462 L463	H445-R459 VanDerWaalsContact O-CD 3.3Å; H445-R459 WeakPolarHBondContact O-CD 3.47Å; H445-R459 PolarHBondContact O-NE 3.05Å; F453-R459 HydrophobicContact CB-CB 4.1Å; F453-R459 HydrophobicContact CD2-CB 4.08Å; F453-R459 HydrophobicContact CG-CB 4.24Å; N455-R459 PolarHBondContact O-N 3.33Å; Q456-R459 CarbonylContact O-C 3.47Å; Q456-R459 WeakPolarHBondContact O-CA 3.43Å; Q456-R459 WeakPolarHBondContact O-CB 3.47Å; Q456-R459 PolarHBondContact O-N 2.91Å; R459-R461 PolarHBondContact O-N 3.19Å; R459-H462 CarbonylContact O-C 3.59Å; R459-H462 WeakPolarHBondContact O-CA 3.22Å; R459-H462 WeakPolarHBondContact O-CB 3.39Å; R459-H462 PolarHBondContact O-N 3.44Å; R459-L463 HydrophobicContact CG-CD1 3.81Å; R459-L463 HydrophobicContact CG-CG 4.18Å; R459-L463 PolarHBondContact O-N 3.33Å
460	E	68.2	Low	64	Low	79 Å²	79	89.1 Å²	89.1	37%	0.369	42%	0.424	S	S	.	.	H	α-helix	trans	-59.1	-48.2	-176.7	-67.9	158.2	163.4	0	0	111.7	Q456 Q457 H462 L463 L464	Q456-E460 HydrophobicContact CG-CG 4.33Å; Q456-E460 VanDerWaalsContact CG-OE1 3.3Å; Q456-E460 WeakPolarHBondContact CG-OE1 3.36Å; Q456-E460 PolarHBondContact NE2-OE1 2.88Å; Q456-E460 WeakPolarHBondContact O-CG 3.43Å; Q456-E460 PolarHBondContact O-N 3.19Å; Q457-E460 WeakPolarHBondContact CA-OE2 3.25Å; Q457-E460 PolarHBondContact N-OE2 3.21Å; E460-H462 PolarHBondContact O-N 3.48Å; E460-L463 PolarHBondContact O-N 3.47Å; E460-L463 VanDerWaalsContact O-N 3.13Å; E460-L464 PolarHBondContact O-N 3.31Å; E460-L464 VanDerWaalsContact O-N 3.12Å
461	R	68.8	Low	64.3	Low	100 Å²	100	85.9 Å²	85.9	38%	0.377	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-17.8	174.7	-159.6	-171.5	-56.7	88.1	12.1	113.2	Q457 R459 T482	Q457-R461 WeakPolarHBondContact O-CB 3.41Å; Q457-R461 PolarHBondContact O-NH1 2.99Å; Q457-R461 PolarHBondContact O-NH2 3.14Å; R459-R461 PolarHBondContact O-N 3.19Å; R461-T482 WeakPolarHBondContact O-CG2 3.47Å
462	H	71.8	Confident	64.9	Low	8 Å²	8	80.8 Å²	80.8	4%	0.037	39%	0.392	C	S	.	.	H	α-helix	trans	-91.9	-29.3	172.4	174.6	58.3	0	0	0	112.7	C446 C449 F453 E458 R459 E460 L464 I465 H466 T482	C446-H462 PolarHBondContact SG-CD2 2.85Å; C449-H462 PolarHBondContact SG-NE2 3.41Å; F453-H462 HydrophobicContact CE1-CB 3.91Å; F453-H462 AromaticContact CE1-CG 3.99Å; F453-H462 HydrophobicContact CE2-CB 4.1Å; F453-H462 AromaticContact CE2-CD2 3.17Å; F453-H462 WeakPolarHBondContact CE2-CD2 3.4Å; F453-H462 AromaticContact CE2-CG 3.76Å; F453-H462 AromaticContact CE2-NE2 3.92Å; F453-H462 HydrophobicContact CZ-CB 3.64Å; F453-H462 AromaticContact CZ-CD2 3.11Å; F453-H462 WeakPolarHBondContact CZ-CD2 3.31Å; F453-H462 AromaticContact CZ-CG 3.28Å; F453-H462 AromaticContact CZ-NE2 3.74Å; E458-H462 VanDerWaalsContact O-CB 3.25Å; E458-H462 WeakPolarHBondContact O-CB 3.49Å; E458-H462 PolarHBondContact O-N 2.78Å; R459-H462 CarbonylContact O-C 3.59Å; R459-H462 WeakPolarHBondContact O-CA 3.22Å; R459-H462 WeakPolarHBondContact O-CB 3.39Å; R459-H462 PolarHBondContact O-N 3.44Å; E460-H462 PolarHBondContact O-N 3.48Å; H462-L464 PolarHBondContact O-N 2.95Å; H462-I465 WeakPolarHBondContact ND1-CD1 3.21Å; H462-I465 WeakPolarHBondContact O-CA 3.31Å; H462-I465 WeakPolarHBondContact O-CB 3.37Å; H462-I465 WeakPolarHBondContact O-CG1 3.24Å; H462-I465 PolarHBondContact O-N 3.29Å; H462-H466 AromaticContact CD2-NE2 3.93Å; H462-H466 AromaticContact CE1-NE2 3.3Å; H462-H466 PolarHBondContact CE1-NE2 3.02Å; H462-H466 VanDerWaalsContact CE1-NE2 3.3Å; H462-H466 AromaticContact NE2-CD2 3.9Å; H462-H466 AromaticContact NE2-NE2 3.14Å; H462-H466 PolarHBondContact NE2-NE2 2.77Å; H462-H466 VanDerWaalsContact NE2-NE2 3.14Å; H462-H466 PolarHBondContact O-CD2 2.93Å; H462-T482 HydrophobicContact CB-CG2 4.3Å
463	L	69.1	Low	65.3	Low	51 Å²	51	73.5 Å²	73.5	27%	0.267	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-30.2	169	-76	168.4	0	0	0	110.9	C446 P447 R459 E460 I465 H466 G467	C446-L463 VanDerWaalsContact SG-CD2 3.54Å; P447-L463 HydrophobicContact CG-CD2 4.34Å; R459-L463 HydrophobicContact CG-CD1 3.81Å; R459-L463 HydrophobicContact CG-CG 4.18Å; R459-L463 PolarHBondContact O-N 3.33Å; E460-L463 PolarHBondContact O-N 3.47Å; E460-L463 VanDerWaalsContact O-N 3.13Å; L463-I465 PolarHBondContact O-N 3.14Å; L463-I465 VanDerWaalsContact O-N 3.11Å; L463-H466 CarbonylContact O-C 3.57Å; L463-H466 WeakPolarHBondContact O-CA 3.39Å; L463-H466 PolarHBondContact O-N 3.35Å; L463-G467 PolarHBondContact O-N 2.82Å; L463-G467 VanDerWaalsContact O-N 3.12Å
464	L	69.5	Low	65.4	Low	96 Å²	96	72.2 Å²	72.2	50%	0.503	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.2	165.4	-116.5	71.4	0	0	0	114.5	E460 H462 P470 P471	E460-L464 PolarHBondContact O-N 3.31Å; E460-L464 VanDerWaalsContact O-N 3.12Å; H462-L464 PolarHBondContact O-N 2.95Å; L464-P470 WeakPolarHBondContact O-CA 3.35Å; L464-P471 HydrophobicContact CB-CG 4.27Å; L464-P471 HydrophobicContact CD2-CB 4.48Å; L464-P471 HydrophobicContact CD2-CG 4.28Å; L464-P471 WeakPolarHBondContact O-CD 3.37Å
465	I	63.5	Low	65.9	Low	22 Å²	22	69.2 Å²	69.2	11%	0.113	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-29.5	171.5	-59.9	-164.8	0	0	0	111.4	H462 L463 T480 T482	H462-I465 WeakPolarHBondContact ND1-CD1 3.21Å; H462-I465 WeakPolarHBondContact O-CA 3.31Å; H462-I465 WeakPolarHBondContact O-CB 3.37Å; H462-I465 WeakPolarHBondContact O-CG1 3.24Å; H462-I465 PolarHBondContact O-N 3.29Å; L463-I465 PolarHBondContact O-N 3.14Å; L463-I465 VanDerWaalsContact O-N 3.11Å; I465-T480 WeakPolarHBondContact CG2-OG1 3.43Å; I465-T482 HydrophobicContact CD1-CG2 3.6Å; I465-T482 HydrophobicContact CG1-CG2 3.9Å
466	H	65.9	Low	66.1	Low	76 Å²	76	66.7 Å²	66.7	35%	0.352	35%	0.345	S	S	.	.	S	Bend	trans	-100	7.3	-177.8	-54.3	-89.7	0	0	0	112.8	C446 T448 C449 H462 L463	C446-H466 PolarHBondContact SG-CD2 3.24Å; C446-H466 PolarHBondContact SG-NE2 3.26Å; C446-H466 VanDerWaalsContact SG-NE2 3.45Å; T448-H466 HydrophobicContact CG2-CB 4.28Å; T448-H466 PolarHBondContact OG1-CD2 3.49Å; T448-H466 VanDerWaalsContact OG1-CD2 3.28Å; T448-H466 PolarHBondContact OG1-CE1 3.2Å; T448-H466 PolarHBondContact OG1-ND1 3.5Å; T448-H466 VanDerWaalsContact OG1-ND1 3.08Å; T448-H466 PolarHBondContact OG1-NE2 3.46Å; C449-H466 VanDerWaalsContact SG-CE1 3.55Å; C449-H466 PolarHBondContact SG-NE2 3.44Å; C449-H466 VanDerWaalsContact SG-NE2 3.36Å; H462-H466 AromaticContact CD2-NE2 3.93Å; H462-H466 AromaticContact CE1-NE2 3.3Å; H462-H466 PolarHBondContact CE1-NE2 3.02Å; H462-H466 VanDerWaalsContact CE1-NE2 3.3Å; H462-H466 AromaticContact NE2-CD2 3.9Å; H462-H466 AromaticContact NE2-NE2 3.14Å; H462-H466 PolarHBondContact NE2-NE2 2.77Å; H462-H466 VanDerWaalsContact NE2-NE2 3.14Å; H462-H466 PolarHBondContact O-CD2 2.93Å; L463-H466 CarbonylContact O-C 3.57Å; L463-H466 WeakPolarHBondContact O-CA 3.39Å; L463-H466 PolarHBondContact O-N 3.35Å
467	G	63	Low	66.4	Low	28 Å²	28	64.2 Å²	64.2	29%	0.289	34%	0.337	S	S	.	.	S	Bend	trans	-85.5	164.3	169.6	0	0	0	0	0	111	L463 Q469	L463-G467 PolarHBondContact O-N 2.82Å; L463-G467 VanDerWaalsContact O-N 3.12Å; G467-Q469 PolarHBondContact O-N 3Å
468	P	57.5	Low	66	Low	140 Å²	140	65.3 Å²	65.3	91%	0.909	35%	0.347	S	S	*	.	S	Bend	trans	-63.1	-16.2	-175.5	25.3	-35.2	0	0	0	114.3
469	Q	54.5	Low	66.2	Low	174 Å²	174	64.4 Å²	64.4	81%	0.813	34%	0.342	S	S	*	.	S	Bend	trans	-125.3	89.9	169	-67.7	-166.4	6.8	0	0	111.1	G467	G467-Q469 PolarHBondContact O-N 3Å
470	P	61.5	Low	65.8	Low	37 Å²	37	63.3 Å²	63.3	24%	0.24	34%	0.343	C	S	.	.			trans	-61.4	129.2	172.9	23.2	-34.4	0	0	0	111.6	L464 F472 A473 T480	L464-P470 WeakPolarHBondContact O-CA 3.35Å; P470-F472 PolarHBondContact O-N 3.29Å; P470-A473 HydrophobicContact CG-CB 4.05Å; P470-T480 HydrophobicContact CB-CG2 3.6Å; P470-T480 HydrophobicContact CG-CG2 3.61Å
471	P	63	Low	66.1	Low	52 Å²	52	59.8 Å²	59.8	34%	0.338	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.2	-166.8	25.9	-37.1	0	0	0	114.7	L464	L464-P471 HydrophobicContact CB-CG 4.27Å; L464-P471 HydrophobicContact CD2-CB 4.48Å; L464-P471 HydrophobicContact CD2-CG 4.28Å; L464-P471 WeakPolarHBondContact O-CD 3.37Å
472	F	66.7	Low	66	Low	57 Å²	57	57.1 Å²	57.1	25%	0.25	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	86.5	170.8	-55.2	-78.5	0	0	0	109	P470 A481 M484 L487	P470-F472 PolarHBondContact O-N 3.29Å; F472-A481 HydrophobicContact CB-CB 4.46Å; F472-A481 WeakPolarHBondContact CB-O 3.33Å; F472-A481 PolarHBondContact O-N 2.9Å; F472-M484 HydrophobicContact CD1-CB 3.85Å; F472-M484 HydrophobicContact CD1-CE 3.7Å; F472-M484 HydrophobicContact CD1-SD 4.14Å; F472-M484 HydrophobicContact CE1-CB 3.75Å; F472-M484 HydrophobicContact CE1-CE 3.95Å; F472-M484 HydrophobicContact CG-CB 4.47Å; F472-M484 HydrophobicContact CZ-CB 4.28Å; F472-L487 HydrophobicContact CB-CB 4.35Å; F472-L487 HydrophobicContact CB-CD2 3.74Å
473	A	68.3	Low	66	Low	39 Å²	39	62.7 Å²	62.7	32%	0.322	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-81.3	148.1	169.1	0	0	0	0	0	112	P470 T480 L487	P470-A473 HydrophobicContact CG-CB 4.05Å; A473-T480 HydrophobicContact CB-CG2 4Å; A473-L487 WeakPolarHBondContact O-CD2 3.28Å
474	C	71.8	Confident	66	Low	11 Å²	11	63.1 Å²	63.1	7%	0.074	35%	0.348	C	S	.	.			trans	-71.6	142.5	162.3	-166.9	0	0	0	0	109.6	C477 H479 L487 V491	C474-C477 WeakPolarHBondContact CB-O 3.44Å; C474-H479 HydrophobicContact CB-CB 4.33Å; C474-H479 WeakPolarHBondContact CB-O 3.49Å; C474-H479 PolarHBondContact N-O 3.05Å; C474-L487 HydrophobicContact CB-CD1 3.7Å; C474-V491 VanDerWaalsContact SG-CG2 3.58Å
475	L	64.6	Low	66	Low	74 Å²	74	64.3 Å²	64.3	39%	0.387	36%	0.359	S	S	.	.	S	Bend	trans	-88.6	7.5	174.5	-63.2	-176.2	0	0	0	112.5	R745 I749	L475-R745 HydrophobicContact CD1-CB 3.9Å; L475-I749 HydrophobicContact CD1-CD1 3.61Å; L475-I749 HydrophobicContact CG-CD1 4.45Å
476	L	66.7	Low	66.3	Low	4 Å²	4	65.5 Å²	65.5	2%	0.021	37%	0.372	C	S	.	.	S	Bend	trans	-131	-5	-168	-55.2	175.7	0	0	0	113	V491 H494 F496 Y539 I541 T742 L746	L476-V491 HydrophobicContact CD1-CG1 4.45Å; L476-H494 HydrophobicContact CD1-CB 4.3Å; L476-F496 HydrophobicContact CD1-CE1 3.78Å; L476-F496 HydrophobicContact CD1-CZ 3.57Å; L476-Y539 HydrophobicContact CB-CD2 4.19Å; L476-Y539 HydrophobicContact CB-CE2 3.58Å; L476-Y539 HydrophobicContact CD2-CD1 4.09Å; L476-Y539 HydrophobicContact CD2-CD2 4.22Å; L476-Y539 HydrophobicContact CD2-CE1 3.59Å; L476-Y539 HydrophobicContact CD2-CE2 3.74Å; L476-Y539 HydrophobicContact CD2-CG 4.37Å; L476-Y539 HydrophobicContact CG-CE2 4.13Å; L476-I541 WeakPolarHBondContact O-CD1 3.46Å; L476-I541 WeakPolarHBondContact O-CG1 3.47Å; L476-T742 HydrophobicContact CD2-CG2 4.09Å; L476-L746 HydrophobicContact CD1-CD1 4.19Å; L476-L746 HydrophobicContact CD1-CD2 3.83Å; L476-L746 HydrophobicContact CD2-CD1 4.1Å; L476-L746 HydrophobicContact CD2-CD2 4.13Å; L476-L746 HydrophobicContact CD2-CG 4.5Å; L476-L746 HydrophobicContact CG-CD2 4.01Å
477	C	70.9	Confident	66.6	Low	32 Å²	32	62 Å²	62	22%	0.216	36%	0.356	C	S	.	.	S	Bend	trans	-176.2	176.2	167.9	65.1	0	0	0	0	108.9	C474 H479 H490 I541	C474-C477 WeakPolarHBondContact CB-O 3.44Å; C477-H479 PolarHBondContact O-N 2.91Å; C477-H490 PolarHBondContact SG-NE2 3.27Å; C477-I541 HydrophobicContact CB-CG2 4.16Å
478	D	61.5	Low	66.8	Low	153 Å²	153	62 Å²	62	82%	0.818	35%	0.35	S	S	*	.	S	Bend	trans	-74.6	14	-173.6	-40.5	-71.1	0	0	0	114.6	T480	D478-T480 PolarHBondContact O-N 3.47Å; D478-T480 VanDerWaalsContact O-N 3.12Å
479	H	66.9	Low	67.3	Low	51 Å²	51	57.9 Å²	57.9	24%	0.236	33%	0.329	C	S	.	.			trans	-73.7	107.9	-179.1	-172.5	99.2	0	0	0	111.7	C474 C477 H490 E544	C474-H479 HydrophobicContact CB-CB 4.33Å; C474-H479 WeakPolarHBondContact CB-O 3.49Å; C474-H479 PolarHBondContact N-O 3.05Å; C477-H479 PolarHBondContact O-N 2.91Å; H479-H490 WeakPolarHBondContact CB-CE1 3.31Å; H479-H490 WeakPolarHBondContact CB-NE2 3.45Å; H479-H490 AromaticContact CD2-CD2 3.83Å; H479-H490 AromaticContact CD2-CG 3.34Å; H479-H490 AromaticContact CD2-ND1 3.54Å; H479-H490 AromaticContact CE1-ND1 3.65Å; H479-H490 AromaticContact CG-CD2 3.83Å; H479-H490 AromaticContact CG-CE1 3.43Å; H479-H490 VanDerWaalsContact CG-CE1 3.43Å; H479-H490 AromaticContact CG-CG 3.48Å; H479-H490 VanDerWaalsContact CG-CG 3.48Å; H479-H490 AromaticContact CG-ND1 3.21Å; H479-H490 AromaticContact CG-NE2 3.82Å; H479-H490 AromaticContact ND1-CE1 3.72Å; H479-H490 AromaticContact ND1-CG 3.94Å; H479-H490 AromaticContact ND1-ND1 3.3Å; H479-H490 PolarHBondContact ND1-ND1 2.83Å; H479-H490 AromaticContact NE2-CG 3.75Å; H479-H490 AromaticContact NE2-ND1 3.81Å; H479-E544 IonicContact CE1-OE1 3.13Å; H479-E544 IonicContact CE1-OE2 3.21Å; H479-E544 PolarHBondContact CE1-OE2 3.13Å; H479-E544 VanDerWaalsContact CE1-OE2 3.3Å; H479-E544 IonicContact ND1-OE1 2.71Å; H479-E544 IonicContact ND1-OE2 3.63Å; H479-E544 PolarHBondContact ND1-OE2 3.37Å
480	T	68.4	Low	68.2	Low	45 Å²	45	50 Å²	50	28%	0.276	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-109.7	138.8	-174.8	46.8	0	0	0	0	111.4	I465 P470 A473 D478	I465-T480 WeakPolarHBondContact CG2-OG1 3.43Å; P470-T480 HydrophobicContact CB-CG2 3.6Å; P470-T480 HydrophobicContact CG-CG2 3.61Å; A473-T480 HydrophobicContact CB-CG2 4Å; D478-T480 PolarHBondContact O-N 3.47Å; D478-T480 VanDerWaalsContact O-N 3.12Å
481	A	74	Confident	68.5	Low	5 Å²	5	48.7 Å²	48.7	4%	0.041	28%	0.283	C	S	.	.			trans	-134.2	147.5	-167.4	0	0	0	0	0	114	F472 K483 A486 L487	F472-A481 HydrophobicContact CB-CB 4.46Å; F472-A481 WeakPolarHBondContact CB-O 3.33Å; F472-A481 PolarHBondContact O-N 2.9Å; A481-K483 PolarHBondContact O-N 2.73Å; A481-A486 HydrophobicContact CB-CB 4.36Å; A481-L487 HydrophobicContact CB-CB 4.07Å
482	T	67.3	Low	68.7	Low	44 Å²	44	53.2 Å²	53.2	27%	0.27	29%	0.293	S	S	.	.	S	Bend	trans	-73.6	-8.6	174.3	54.7	0	0	0	0	114.1	R461 H462 I465	R461-T482 WeakPolarHBondContact O-CG2 3.47Å; H462-T482 HydrophobicContact CB-CG2 4.3Å; I465-T482 HydrophobicContact CD1-CG2 3.6Å; I465-T482 HydrophobicContact CG1-CG2 3.9Å
483	K	71.4	Confident	68.6	Low	126 Å²	126	55.2 Å²	55.2	55%	0.548	30%	0.302	S	S	.	.	S	Bend	trans	-153.9	131.4	-170.3	-63	176.3	-172.9	164.8	0	111.5	A481 V485 A486 L487	A481-K483 PolarHBondContact O-N 2.73Å; K483-V485 PolarHBondContact O-N 2.79Å; K483-V485 VanDerWaalsContact O-N 3.13Å; K483-A486 HydrophobicContact CB-CB 4.43Å; K483-A486 WeakPolarHBondContact O-CB 3.47Å; K483-A486 PolarHBondContact O-N 3.46Å; K483-L487 PolarHBondContact O-N 3.39Å; K483-L487 VanDerWaalsContact O-N 3.13Å
484	M	69.4	Low	68.7	Low	60 Å²	60	53.9 Å²	53.9	30%	0.296	29%	0.289	S	S	.	.	H	α-helix	trans	-47.1	-43.4	171.4	-172.1	59.6	85.9	0	0	113.2	F472 A486 L487 T488 I749 Y750	F472-M484 HydrophobicContact CD1-CB 3.85Å; F472-M484 HydrophobicContact CD1-CE 3.7Å; F472-M484 HydrophobicContact CD1-SD 4.14Å; F472-M484 HydrophobicContact CE1-CB 3.75Å; F472-M484 HydrophobicContact CE1-CE 3.95Å; F472-M484 HydrophobicContact CG-CB 4.47Å; F472-M484 HydrophobicContact CZ-CB 4.28Å; M484-A486 VanDerWaalsContact C-N 3.28Å; M484-A486 PolarHBondContact O-N 3.42Å; M484-L487 CarbonylContact O-C 3.56Å; M484-L487 WeakPolarHBondContact O-CA 3.28Å; M484-L487 WeakPolarHBondContact O-CB 3.25Å; M484-L487 PolarHBondContact O-N 3.39Å; M484-L487 VanDerWaalsContact O-N 3.08Å; M484-L487 HydrophobicContact SD-CD2 4.25Å; M484-T488 PolarHBondContact O-N 2.96Å; M484-T488 PolarHBondContact O-OG1 3.34Å; M484-I749 HydrophobicContact CE-CG2 3.78Å; M484-I749 HydrophobicContact SD-CG2 4.18Å; M484-Y750 HydrophobicContact SD-CE1 4.23Å
485	V	69.1	Low	68.6	Low	121 Å²	121	58 Å²	58	73%	0.733	31%	0.31	S	S	*	.	H	α-helix	trans	-62.6	-31.5	179.8	-178.2	0	0	0	0	113.4	K483 A489	K483-V485 PolarHBondContact O-N 2.79Å; K483-V485 VanDerWaalsContact O-N 3.13Å; V485-A489 WeakPolarHBondContact O-CB 3.47Å; V485-A489 PolarHBondContact O-N 2.92Å
486	A	70.3	Confident	69.2	Low	47 Å²	47	56 Å²	56	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-74.9	-41.2	174	0	0	0	0	0	110.5	A481 K483 M484 A489 H490	A481-A486 HydrophobicContact CB-CB 4.36Å; K483-A486 HydrophobicContact CB-CB 4.43Å; K483-A486 WeakPolarHBondContact O-CB 3.47Å; K483-A486 PolarHBondContact O-N 3.46Å; M484-A486 VanDerWaalsContact C-N 3.28Å; M484-A486 PolarHBondContact O-N 3.42Å; A486-A489 CarbonylContact O-C 3.54Å; A486-A489 WeakPolarHBondContact O-CA 3.41Å; A486-A489 WeakPolarHBondContact O-CB 3.38Å; A486-A489 PolarHBondContact O-N 3.37Å; A486-A489 VanDerWaalsContact O-N 3.08Å; A486-H490 PolarHBondContact O-N 3.15Å
487	L	72.2	Confident	69.7	Low	2 Å²	2	57 Å²	57	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-46.8	174.7	-177	60.3	0	0	0	112.3	F472 A473 C474 A481 K483 M484 A489 H490 V491 Y750	F472-L487 HydrophobicContact CB-CB 4.35Å; F472-L487 HydrophobicContact CB-CD2 3.74Å; A473-L487 WeakPolarHBondContact O-CD2 3.28Å; C474-L487 HydrophobicContact CB-CD1 3.7Å; A481-L487 HydrophobicContact CB-CB 4.07Å; K483-L487 PolarHBondContact O-N 3.39Å; K483-L487 VanDerWaalsContact O-N 3.13Å; M484-L487 CarbonylContact O-C 3.56Å; M484-L487 WeakPolarHBondContact O-CA 3.28Å; M484-L487 WeakPolarHBondContact O-CB 3.25Å; M484-L487 PolarHBondContact O-N 3.39Å; M484-L487 VanDerWaalsContact O-N 3.08Å; M484-L487 HydrophobicContact SD-CD2 4.25Å; L487-A489 PolarHBondContact O-N 3.5Å; L487-A489 VanDerWaalsContact O-N 3.17Å; L487-H490 CarbonylContact O-C 3.58Å; L487-H490 WeakPolarHBondContact O-CA 3.45Å; L487-H490 PolarHBondContact O-N 2.95Å; L487-V491 HydrophobicContact CD1-CG2 4.2Å; L487-V491 HydrophobicContact CG-CG2 4.36Å; L487-V491 WeakPolarHBondContact O-CG2 3.31Å; L487-V491 PolarHBondContact O-N 2.77Å; L487-Y750 HydrophobicContact CD2-CE1 4.19Å; L487-Y750 VanDerWaalsContact CD2-OH 3.27Å; L487-Y750 WeakPolarHBondContact CD2-OH 3.41Å; L487-Y750 HydrophobicContact CG-CE1 4.02Å
488	T	66.3	Low	70.1	Confident	27 Å²	27	56 Å²	56	17%	0.166	30%	0.295	C	S	.	.	H	α-helix	trans	-60.6	-25.7	173.1	-42.3	0	0	0	0	112.4	M484 R492 Y750	M484-T488 PolarHBondContact O-N 2.96Å; M484-T488 PolarHBondContact O-OG1 3.34Å; T488-R492 WeakPolarHBondContact O-CD 3.49Å; T488-R492 WeakPolarHBondContact O-CG 3.41Å; T488-R492 PolarHBondContact O-NE 2.93Å; T488-Y750 HydrophobicContact CG2-CD1 4.32Å
489	A	68.7	Low	71.1	Confident	55 Å²	55	49.3 Å²	49.3	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-80.1	-31.8	173.6	0	0	0	0	0	112.7	V485 A486 L487	V485-A489 WeakPolarHBondContact O-CB 3.47Å; V485-A489 PolarHBondContact O-N 2.92Å; A486-A489 CarbonylContact O-C 3.54Å; A486-A489 WeakPolarHBondContact O-CA 3.41Å; A486-A489 WeakPolarHBondContact O-CB 3.38Å; A486-A489 PolarHBondContact O-N 3.37Å; A486-A489 VanDerWaalsContact O-N 3.08Å; L487-A489 PolarHBondContact O-N 3.5Å; L487-A489 VanDerWaalsContact O-N 3.17Å
490	H	72.7	Confident	72	Confident	9 Å²	9	46.9 Å²	46.9	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-47.7	170	168.4	88.1	0	0	0	111.5	C477 H479 A486 L487 R492 K493 H494 E544	C477-H490 PolarHBondContact SG-NE2 3.27Å; H479-H490 WeakPolarHBondContact CB-CE1 3.31Å; H479-H490 WeakPolarHBondContact CB-NE2 3.45Å; H479-H490 AromaticContact CD2-CD2 3.83Å; H479-H490 AromaticContact CD2-CG 3.34Å; H479-H490 AromaticContact CD2-ND1 3.54Å; H479-H490 AromaticContact CE1-ND1 3.65Å; H479-H490 AromaticContact CG-CD2 3.83Å; H479-H490 AromaticContact CG-CE1 3.43Å; H479-H490 VanDerWaalsContact CG-CE1 3.43Å; H479-H490 AromaticContact CG-CG 3.48Å; H479-H490 VanDerWaalsContact CG-CG 3.48Å; H479-H490 AromaticContact CG-ND1 3.21Å; H479-H490 AromaticContact CG-NE2 3.82Å; H479-H490 AromaticContact ND1-CE1 3.72Å; H479-H490 AromaticContact ND1-CG 3.94Å; H479-H490 AromaticContact ND1-ND1 3.3Å; H479-H490 PolarHBondContact ND1-ND1 2.83Å; H479-H490 AromaticContact NE2-CG 3.75Å; H479-H490 AromaticContact NE2-ND1 3.81Å; A486-H490 PolarHBondContact O-N 3.15Å; L487-H490 CarbonylContact O-C 3.58Å; L487-H490 WeakPolarHBondContact O-CA 3.45Å; L487-H490 PolarHBondContact O-N 2.95Å; H490-R492 PolarHBondContact O-N 3.23Å; H490-R492 VanDerWaalsContact O-N 3.07Å; H490-K493 WeakPolarHBondContact O-CA 3.25Å; H490-K493 WeakPolarHBondContact O-CB 3.41Å; H490-K493 WeakPolarHBondContact O-CG 3.38Å; H490-K493 PolarHBondContact O-N 3.33Å; H490-H494 AromaticContact NE2-NE2 3.4Å; H490-H494 PolarHBondContact NE2-NE2 2.9Å; H490-E544 IonicContact CE1-OE1 3.64Å; H490-E544 PolarHBondContact CE1-OE1 3.08Å; H490-E544 IonicContact ND1-OE1 2.9Å; H490-E544 PolarHBondContact ND1-OE1 2.9Å
491	V	69.3	Low	72.7	Confident	8 Å²	8	46.8 Å²	46.8	5%	0.048	25%	0.25	C	C	.	.	H	α-helix	trans	-60.2	-26.8	-177.8	170.1	0	0	0	0	112.8	C474 L476 L487 K493 H494 Y750	C474-V491 VanDerWaalsContact SG-CG2 3.58Å; L476-V491 HydrophobicContact CD1-CG1 4.45Å; L487-V491 HydrophobicContact CD1-CG2 4.2Å; L487-V491 HydrophobicContact CG-CG2 4.36Å; L487-V491 WeakPolarHBondContact O-CG2 3.31Å; L487-V491 PolarHBondContact O-N 2.77Å; V491-K493 PolarHBondContact O-N 3.49Å; V491-K493 VanDerWaalsContact O-N 3.13Å; V491-H494 PolarHBondContact O-N 3.18Å; V491-H494 VanDerWaalsContact O-N 3.12Å; V491-Y750 HydrophobicContact CB-CE1 4.32Å; V491-Y750 HydrophobicContact CG1-CD2 4.28Å; V491-Y750 HydrophobicContact CG1-CE2 4.32Å; V491-Y750 HydrophobicContact CG1-CG 4.43Å; V491-Y750 HydrophobicContact CG2-CE1 3.85Å; V491-Y750 HydrophobicContact CG2-CE2 4.18Å
492	R	66.9	Low	73	Confident	147 Å²	147	49.8 Å²	49.8	56%	0.555	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.8	170.5	-72.8	167.1	-176.7	165.7	2.6	114.9	T488 H490	T488-R492 WeakPolarHBondContact O-CD 3.49Å; T488-R492 WeakPolarHBondContact O-CG 3.41Å; T488-R492 PolarHBondContact O-NE 2.93Å; H490-R492 PolarHBondContact O-N 3.23Å; H490-R492 VanDerWaalsContact O-N 3.07Å
493	K	64.9	Low	73.7	Confident	100 Å²	100	49.9 Å²	49.9	44%	0.435	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-31.6	169.2	-61.6	177.5	177.1	-170.7	0	111.9	H490 V491 L495 E544	H490-K493 WeakPolarHBondContact O-CA 3.25Å; H490-K493 WeakPolarHBondContact O-CB 3.41Å; H490-K493 WeakPolarHBondContact O-CG 3.38Å; H490-K493 PolarHBondContact O-N 3.33Å; V491-K493 PolarHBondContact O-N 3.49Å; V491-K493 VanDerWaalsContact O-N 3.13Å; K493-L495 PolarHBondContact O-N 3.49Å; K493-E544 IonicContact NZ-OE1 3.88Å; K493-E544 PolarHBondContact NZ-OE1 2.91Å
494	H	69.9	Low	74.1	Confident	10 Å²	10	48 Å²	48	5%	0.046	27%	0.272	C	S	.	.	S	Bend	trans	-65.2	128.7	173.7	-61.6	-68.6	0	0	0	109.3	L476 H490 V491 F496 L540	L476-H494 HydrophobicContact CD1-CB 4.3Å; H490-H494 AromaticContact NE2-NE2 3.4Å; H490-H494 PolarHBondContact NE2-NE2 2.9Å; V491-H494 PolarHBondContact O-N 3.18Å; V491-H494 VanDerWaalsContact O-N 3.12Å; H494-F496 HydrophobicContact CB-CE2 4.35Å; H494-F496 HydrophobicContact CB-CZ 4.27Å; H494-L540 PolarHBondContact ND1-O 3.08Å; H494-L540 VanDerWaalsContact ND1-O 3.1Å
495	L	70.3	Confident	74.5	Confident	99 Å²	99	50 Å²	50	52%	0.518	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.6	170.2	-118.5	72.6	0	0	0	107.8	K493 Y539 L540	K493-L495 PolarHBondContact O-N 3.49Å; L495-Y539 VanDerWaalsContact O-CA 3.27Å; L495-Y539 WeakPolarHBondContact O-CA 3.17Å; L495-L540 HydrophobicContact CB-CB 4.32Å; L495-L540 HydrophobicContact CB-CD1 4.08Å; L495-L540 HydrophobicContact CB-CG 4.45Å; L495-L540 PolarHBondContact O-N 3.35Å
496	F	75.9	Confident	75	Confident	31 Å²	31	50.5 Å²	50.5	14%	0.136	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	132.1	170.1	-57.7	-82.7	0	0	0	109.3	L476 H494 Y498 Y539 L746	L476-F496 HydrophobicContact CD1-CE1 3.78Å; L476-F496 HydrophobicContact CD1-CZ 3.57Å; H494-F496 HydrophobicContact CB-CE2 4.35Å; H494-F496 HydrophobicContact CB-CZ 4.27Å; F496-Y498 HydrophobicContact CB-CE2 3.91Å; F496-Y539 HydrophobicContact CE1-CG 4.45Å; F496-L746 HydrophobicContact CE1-CD1 3.56Å; F496-L746 HydrophobicContact CZ-CD1 3.93Å
497	L	77.6	Confident	75.5	Confident	26 Å²	26	49.8 Å²	49.8	14%	0.136	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	107.5	177.6	-68.7	173.7	0	0	0	108.8	S537 Y538 L540 F730	L497-S537 WeakPolarHBondContact O-CB 3.06Å; L497-Y538 HydrophobicContact CB-CD2 4.4Å; L497-Y538 HydrophobicContact CB-CE2 4.09Å; L497-Y538 HydrophobicContact CD1-CE2 3.89Å; L497-Y538 PolarHBondContact N-O 3.08Å; L497-Y538 PolarHBondContact O-N 3.29Å; L497-Y538 VanDerWaalsContact O-N 3.08Å; L497-L540 HydrophobicContact CD1-CD1 4.36Å; L497-F730 HydrophobicContact CD1-CE2 3.71Å; L497-F730 HydrophobicContact CD1-CZ 3.49Å; L497-F730 VanDerWaalsContact CD1-CZ 3.49Å
498	Y	79.9	Confident	75.8	Confident	10 Å²	10	53.3 Å²	53.3	4%	0.039	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	140.6	-179.4	-63.6	-84.8	0	0	0	110.1	F496 K506 L507 S509 L513 S537 L738 Y743	F496-Y498 HydrophobicContact CB-CE2 3.91Å; Y498-K506 CarbonylContact O-C 3.22Å; Y498-K506 WeakPolarHBondContact O-CA 3.32Å; Y498-L507 PolarHBondContact N-O 3.39Å; Y498-L507 PolarHBondContact O-N 3.27Å; Y498-S509 VanDerWaalsContact CD2-C 3.45Å; Y498-L513 HydrophobicContact CD1-CD2 4.24Å; Y498-S537 VanDerWaalsContact CA-OG 3.25Å; Y498-S537 WeakPolarHBondContact CA-OG 3.22Å; Y498-L738 HydrophobicContact CD1-CD2 4.43Å; Y498-L738 HydrophobicContact CE1-CD2 3.69Å; Y498-Y743 HydrophobicContact CE1-CD2 4.3Å; Y498-Y743 HydrophobicContact CE1-CE2 4.31Å
499	V	82.3	Confident	76.5	Confident	13 Å²	13	52 Å²	52	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.7	-178	-177	0	0	0	0	109.1	S501 C533 I536 S537 Y538	V499-S501 PolarHBondContact O-N 3.31Å; V499-C533 CarbonylContact O-C 3.45Å; V499-C533 WeakPolarHBondContact O-CA 3.31Å; V499-C533 VanDerWaalsContact O-CB 3.27Å; V499-C533 WeakPolarHBondContact O-CB 3.24Å; V499-I536 HydrophobicContact CB-CG2 4.12Å; V499-I536 HydrophobicContact CG1-CG2 3.98Å; V499-S537 PolarHBondContact N-OG 3.26Å; V499-Y538 HydrophobicContact CG2-CD1 4.23Å; V499-Y538 HydrophobicContact CG2-CE1 3.78Å
500	C	85.6	Confident	77.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.			trans	-71.3	125.5	170.4	-178.6	0	0	0	0	110.1	V502 S504 K505 L513	C500-V502 VanDerWaalsContact C-N 3.25Å; C500-V502 PolarHBondContact O-N 3.05Å; C500-V502 PolarHBondContact SG-N 2.63Å; C500-S504 WeakPolarHBondContact O-CA 3.39Å; C500-S504 PolarHBondContact O-N 3.15Å; C500-K505 PolarHBondContact N-O 3.32Å; C500-L513 HydrophobicContact CB-CD1 4.2Å
501	S	82.8	Confident	77.4	Confident	43 Å²	43	52.4 Å²	52.4	30%	0.301	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.7	177.3	60.8	0	0	0	0	113.2	V499 C533	V499-S501 PolarHBondContact O-N 3.31Å; S501-C533 PolarHBondContact N-SG 3.08Å; S501-C533 PolarHBondContact OG-SG 2.89Å; S501-C533 VanDerWaalsContact OG-SG 3.38Å
502	V	79.9	Confident	78	Confident	67 Å²	67	56.2 Å²	56.2	41%	0.406	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-41	-172.9	-168.7	0	0	0	0	112.1	C500 L524	C500-V502 VanDerWaalsContact C-N 3.25Å; C500-V502 PolarHBondContact O-N 3.05Å; C500-V502 PolarHBondContact SG-N 2.63Å; V502-L524 HydrophobicContact CG1-CD1 4.19Å; V502-L524 HydrophobicContact CG2-CD1 3.73Å
503	C	82.8	Confident	78.6	Confident	46 Å²	46	49.2 Å²	49.2	31%	0.311	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	13.2	-176.6	70.2	0	0	0	0	115	K505 H516 H521	C503-K505 PolarHBondContact O-N 3.23Å; C503-K505 VanDerWaalsContact SG-CD 3.56Å; C503-K505 VanDerWaalsContact SG-CG 3.6Å; C503-H516 VanDerWaalsContact SG-CE1 3.54Å; C503-H516 PolarHBondContact SG-NE2 3.02Å; C503-H521 PolarHBondContact SG-NE2 2.83Å; C503-H521 VanDerWaalsContact SG-NE2 3.37Å
504	S	78.6	Confident	79.5	Confident	87 Å²	87	48.5 Å²	48.5	61%	0.608	25%	0.248	S	C	*	.			trans	56.7	10.8	176	-67.2	0	0	0	0	116.9	C500 K506	C500-S504 WeakPolarHBondContact O-CA 3.39Å; C500-S504 PolarHBondContact O-N 3.15Å; S504-K506 PolarHBondContact O-N 3.11Å
505	K	78.6	Confident	80	Confident	103 Å²	103	48.5 Å²	48.5	45%	0.448	25%	0.251	S	S	.	.			trans	-61.7	127.2	177	-72.3	176.1	-166.8	160.9	0	110.9	C500 C503	C500-K505 PolarHBondContact N-O 3.32Å; C503-K505 PolarHBondContact O-N 3.23Å; C503-K505 VanDerWaalsContact SG-CD 3.56Å; C503-K505 VanDerWaalsContact SG-CG 3.6Å
506	K	80.5	Confident	80.7	Confident	130 Å²	130	44.5 Å²	44.5	57%	0.565	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.3	179.4	-62.7	170.4	-173.7	167.3	0	110.2	Y498 S504	Y498-K506 CarbonylContact O-C 3.22Å; Y498-K506 WeakPolarHBondContact O-CA 3.32Å; S504-K506 PolarHBondContact O-N 3.11Å
507	L	80.6	Confident	81.1	Confident	32 Å²	32	43.1 Å²	43.1	17%	0.168	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.6	-169.6	-64.9	173.8	0	0	0	112.3	Y498 S509 L513 H516	Y498-L507 PolarHBondContact N-O 3.39Å; Y498-L507 PolarHBondContact O-N 3.27Å; L507-S509 VanDerWaalsContact C-N 3.34Å; L507-S509 PolarHBondContact O-N 2.88Å; L507-L513 HydrophobicContact CD1-CB 4.21Å; L507-L513 HydrophobicContact CD1-CD1 4.26Å; L507-H516 HydrophobicContact CD1-CB 3.91Å
508	V	78.3	Confident	81.4	Confident	76 Å²	76	46.5 Å²	46.5	46%	0.461	24%	0.239	S	C	.	.	S	Bend	trans	-93.3	10.8	-170.4	-163.7	0	0	0	0	112.6	G759	V508-G759 WeakPolarHBondContact O-CA 3.41Å; V508-G759 PolarHBondContact O-N 2.75Å
509	S	80.6	Confident	81.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.			trans	-164.1	140.9	-176.9	175.9	0	0	0	0	111.7	Y498 L507 Q511 R512 L513 E754 Q756	Y498-S509 VanDerWaalsContact CD2-C 3.45Å; L507-S509 VanDerWaalsContact C-N 3.34Å; L507-S509 PolarHBondContact O-N 2.88Å; S509-Q511 PolarHBondContact O-N 3.35Å; S509-Q511 PolarHBondContact OG-N 3.25Å; S509-R512 PolarHBondContact O-N 3.36Å; S509-R512 VanDerWaalsContact O-N 3.1Å; S509-L513 PolarHBondContact O-N 2.93Å; S509-E754 WeakPolarHBondContact CA-OE1 3.36Å; S509-E754 WeakPolarHBondContact CB-OE1 3.41Å; S509-E754 PolarHBondContact OG-OE1 3.15Å; S509-Q756 VanDerWaalsContact CB-O 3.26Å; S509-Q756 WeakPolarHBondContact CB-O 3.19Å; S509-Q756 WeakPolarHBondContact OG-CA 3.47Å
510	S	81.3	Confident	81.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-33.8	173.6	70.3	0	0	0	0	111.5	R512 L513 R514 Y743 E754	S510-R512 VanDerWaalsContact C-N 3.28Å; S510-R512 PolarHBondContact O-N 2.79Å; S510-L513 WeakPolarHBondContact O-CB 3.33Å; S510-L513 PolarHBondContact O-N 3.12Å; S510-R514 PolarHBondContact O-N 3.47Å; S510-Y743 PolarHBondContact OG-OH 2.86Å; S510-E754 WeakPolarHBondContact CB-OE2 3.35Å; S510-E754 PolarHBondContact N-OE1 2.96Å; S510-E754 VanDerWaalsContact OG-CD 3.28Å; S510-E754 PolarHBondContact OG-OE2 2.96Å
511	Q	79.8	Confident	81.3	Confident	71 Å²	71	57.3 Å²	57.3	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-69.4	-25.7	176.1	-164.3	65.1	53.4	0	0	112.6	S509 G515 Q756	S509-Q511 PolarHBondContact O-N 3.35Å; S509-Q511 PolarHBondContact OG-N 3.25Å; Q511-G515 PolarHBondContact O-N 3.45Å; Q511-Q756 HydrophobicContact CB-CB 4.22Å; Q511-Q756 HydrophobicContact CB-CG 4.26Å; Q511-Q756 HydrophobicContact CG-CB 4.22Å; Q511-Q756 HydrophobicContact CG-CG 4.19Å
512	R	80.2	Confident	81	Confident	88 Å²	88	59.6 Å²	59.6	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-79.9	-34.3	168.8	-80	-167.5	174.1	124.8	-15.5	112.4	S509 S510 H516 Q756 Y757	S509-R512 PolarHBondContact O-N 3.36Å; S509-R512 VanDerWaalsContact O-N 3.1Å; S510-R512 VanDerWaalsContact C-N 3.28Å; S510-R512 PolarHBondContact O-N 2.79Å; R512-H516 WeakPolarHBondContact O-CB 3.32Å; R512-H516 PolarHBondContact O-N 3.46Å; R512-Q756 HydrophobicContact CG-CG 3.7Å; R512-Q756 PolarHBondContact NH1-O 2.96Å; R512-Y757 VanDerWaalsContact NH1-C 3.32Å; R512-Y757 PolarHBondContact NH1-O 3.33Å
513	L	81.3	Confident	80.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.1	-47.3	173.2	173.8	64.5	0	0	0	110.7	Y498 C500 L507 S509 S510 H516 L517 F530 C533 I534	Y498-L513 HydrophobicContact CD1-CD2 4.24Å; C500-L513 HydrophobicContact CB-CD1 4.2Å; L507-L513 HydrophobicContact CD1-CB 4.21Å; L507-L513 HydrophobicContact CD1-CD1 4.26Å; S509-L513 PolarHBondContact O-N 2.93Å; S510-L513 WeakPolarHBondContact O-CB 3.33Å; S510-L513 PolarHBondContact O-N 3.12Å; L513-H516 PolarHBondContact O-N 3.16Å; L513-L517 HydrophobicContact CD1-CD1 4.46Å; L513-L517 HydrophobicContact CG-CD1 4.41Å; L513-L517 WeakPolarHBondContact O-CG 3.27Å; L513-L517 PolarHBondContact O-N 2.71Å; L513-F530 HydrophobicContact CB-CE2 4.42Å; L513-F530 HydrophobicContact CD2-CD2 3.95Å; L513-F530 HydrophobicContact CD2-CE2 3.96Å; L513-F530 HydrophobicContact CG-CD2 4.06Å; L513-F530 HydrophobicContact CG-CE2 4.17Å; L513-C533 HydrophobicContact CD1-CB 3.84Å; L513-C533 HydrophobicContact CD2-CB 3.55Å; L513-C533 HydrophobicContact CG-CB 4.15Å; L513-I534 HydrophobicContact CD2-CG1 4.37Å
514	R	82.8	Confident	80.5	Confident	86 Å²	86	67 Å²	67	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-51.6	175.8	-175.9	168.3	-68.1	-145.3	-8.9	112.1	S510 H516 L517 E518 E527 F530	S510-R514 PolarHBondContact O-N 3.47Å; R514-H516 VanDerWaalsContact C-N 3.26Å; R514-H516 PolarHBondContact O-N 3.01Å; R514-L517 WeakPolarHBondContact O-CB 3.4Å; R514-L517 PolarHBondContact O-N 3.17Å; R514-L517 VanDerWaalsContact O-N 3.07Å; R514-E518 HydrophobicContact CG-CG 4.47Å; R514-E518 VanDerWaalsContact CG-OE1 3.25Å; R514-E518 WeakPolarHBondContact CG-OE1 3.45Å; R514-E518 WeakPolarHBondContact O-CG 3.35Å; R514-E518 PolarHBondContact O-N 3.26Å; R514-E527 IonicContact NH2-OE1 3.93Å; R514-F530 HydrophobicContact CB-CD2 4.22Å; R514-F530 HydrophobicContact CB-CE2 3.93Å
515	G	81.4	Confident	80.7	Confident	10 Å²	10	67.6 Å²	67.6	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-58.7	-34.5	175.9	0	0	0	0	0	113.9	Q511 E518 E519	Q511-G515 PolarHBondContact O-N 3.45Å; G515-E518 WeakPolarHBondContact CA-OE2 3.21Å; G515-E518 PolarHBondContact O-N 2.91Å; G515-E519 VanDerWaalsContact O-CB 3.22Å; G515-E519 WeakPolarHBondContact O-CB 3.48Å; G515-E519 WeakPolarHBondContact O-CG 3.14Å; G515-E519 PolarHBondContact O-N 3.25Å
516	H	84.3	Confident	80.6	Confident	15 Å²	15	67 Å²	67	7%	0.069	33%	0.332	C	S	.	.	H	α-helix	trans	-71.4	-35.8	175	167.5	35.1	0	0	0	112.9	C503 L507 R512 L513 R514 S520 H521	C503-H516 VanDerWaalsContact SG-CE1 3.54Å; C503-H516 PolarHBondContact SG-NE2 3.02Å; L507-H516 HydrophobicContact CD1-CB 3.91Å; R512-H516 WeakPolarHBondContact O-CB 3.32Å; R512-H516 PolarHBondContact O-N 3.46Å; L513-H516 PolarHBondContact O-N 3.16Å; R514-H516 VanDerWaalsContact C-N 3.26Å; R514-H516 PolarHBondContact O-N 3.01Å; H516-S520 VanDerWaalsContact CE1-CB 3.45Å; H516-S520 WeakPolarHBondContact CE1-CB 3.17Å; H516-S520 PolarHBondContact CE1-OG 2.81Å; H516-S520 WeakPolarHBondContact ND1-CB 3.41Å; H516-S520 PolarHBondContact ND1-OG 3.09Å; H516-S520 WeakPolarHBondContact O-CB 3.45Å; H516-S520 PolarHBondContact O-N 2.82Å; H516-S520 PolarHBondContact O-OG 2.71Å; H516-H521 AromaticContact CE1-CD2 3.8Å; H516-H521 AromaticContact CE1-NE2 3.61Å; H516-H521 AromaticContact NE2-NE2 3.9Å
517	L	84.2	Confident	80.4	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-47.1	170.8	-68.2	166.4	0	0	0	110.1	L513 R514 E519 H521 F530	L513-L517 HydrophobicContact CD1-CD1 4.46Å; L513-L517 HydrophobicContact CG-CD1 4.41Å; L513-L517 WeakPolarHBondContact O-CG 3.27Å; L513-L517 PolarHBondContact O-N 2.71Å; R514-L517 WeakPolarHBondContact O-CB 3.4Å; R514-L517 PolarHBondContact O-N 3.17Å; R514-L517 VanDerWaalsContact O-N 3.07Å; L517-E519 PolarHBondContact O-N 3.33Å; L517-H521 HydrophobicContact CD2-CB 4.33Å; L517-H521 CarbonylContact O-C 3.54Å; L517-H521 WeakPolarHBondContact O-CA 3.38Å; L517-H521 PolarHBondContact O-N 2.86Å; L517-F530 HydrophobicContact CD1-CB 3.92Å; L517-F530 HydrophobicContact CD1-CD2 4.1Å
518	E	83.5	Confident	80.4	Confident	96 Å²	96	68.9 Å²	68.9	45%	0.449	34%	0.342	S	S	.	.	H	α-helix	trans	-57.2	-41.8	175	-69.1	162.7	176.6	0	0	112.6	R514 G515 M526	R514-E518 HydrophobicContact CG-CG 4.47Å; R514-E518 VanDerWaalsContact CG-OE1 3.25Å; R514-E518 WeakPolarHBondContact CG-OE1 3.45Å; R514-E518 WeakPolarHBondContact O-CG 3.35Å; R514-E518 PolarHBondContact O-N 3.26Å; G515-E518 WeakPolarHBondContact CA-OE2 3.21Å; G515-E518 PolarHBondContact O-N 2.91Å; E518-M526 HydrophobicContact CB-SD 4.37Å; E518-M526 HydrophobicContact CG-SD 3.59Å; E518-M526 VanDerWaalsContact CG-SD 3.59Å
519	E	83.1	Confident	80.5	Confident	166 Å²	166	66 Å²	66	78%	0.776	33%	0.325	S	S	*	.	H	α-helix	trans	-86.9	-25.3	-176.4	-73	169.2	-170.7	0	0	115	G515 L517	G515-E519 VanDerWaalsContact O-CB 3.22Å; G515-E519 WeakPolarHBondContact O-CB 3.48Å; G515-E519 WeakPolarHBondContact O-CG 3.14Å; G515-E519 PolarHBondContact O-N 3.25Å; L517-E519 PolarHBondContact O-N 3.33Å
520	S	80.6	Confident	80.6	Confident	52 Å²	52	66.2 Å²	66.2	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-124.9	-15.2	-170.5	-52	0	0	0	0	115.1	H516 P522	H516-S520 VanDerWaalsContact CE1-CB 3.45Å; H516-S520 WeakPolarHBondContact CE1-CB 3.17Å; H516-S520 PolarHBondContact CE1-OG 2.81Å; H516-S520 WeakPolarHBondContact ND1-CB 3.41Å; H516-S520 PolarHBondContact ND1-OG 3.09Å; H516-S520 WeakPolarHBondContact O-CB 3.45Å; H516-S520 PolarHBondContact O-N 2.82Å; H516-S520 PolarHBondContact O-OG 2.71Å; S520-P522 VanDerWaalsContact C-CD 3.49Å
521	H	82.9	Confident	80.6	Confident	33 Å²	33	68 Å²	68	15%	0.153	34%	0.335	C	S	.	.			trans	-137.9	46.2	-178	-58.8	-60.4	0	0	0	112.4	C503 H516 L517 E523 L524	C503-H521 PolarHBondContact SG-NE2 2.83Å; C503-H521 VanDerWaalsContact SG-NE2 3.37Å; H516-H521 AromaticContact CE1-CD2 3.8Å; H516-H521 AromaticContact CE1-NE2 3.61Å; H516-H521 AromaticContact NE2-NE2 3.9Å; L517-H521 HydrophobicContact CD2-CB 4.33Å; L517-H521 CarbonylContact O-C 3.54Å; L517-H521 WeakPolarHBondContact O-CA 3.38Å; L517-H521 PolarHBondContact O-N 2.86Å; H521-E523 PolarHBondContact O-N 3.32Å; H521-L524 HydrophobicContact CB-CD1 4.37Å; H521-L524 PolarHBondContact O-N 3.13Å
522	P	76.1	Confident	80.6	Confident	90 Å²	90	67.8 Å²	67.8	58%	0.584	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.4	-171.7	31	-38.2	0	0	0	114.7	S520	S520-P522 VanDerWaalsContact C-CD 3.49Å
523	E	73.8	Confident	80.7	Confident	190 Å²	190	63.6 Å²	63.6	89%	0.888	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.3	-178.1	-61	178.5	168.6	0	0	113.5	H521	H521-E523 PolarHBondContact O-N 3.32Å
524	L	77.4	Confident	80.7	Confident	80 Å²	80	63.6 Å²	63.6	42%	0.419	32%	0.32	S	S	.	.	S	Bend	trans	-104.7	154.3	179.7	-59.7	177.1	0	0	0	111	V502 H521 M526 T529	V502-L524 HydrophobicContact CG1-CD1 4.19Å; V502-L524 HydrophobicContact CG2-CD1 3.73Å; H521-L524 HydrophobicContact CB-CD1 4.37Å; H521-L524 PolarHBondContact O-N 3.13Å; L524-M526 PolarHBondContact O-N 3.37Å; L524-T529 HydrophobicContact CB-CG2 3.78Å; L524-T529 HydrophobicContact CD1-CG2 4.08Å
525	D	82.8	Confident	80.5	Confident	99 Å²	99	62 Å²	62	53%	0.529	32%	0.318	S	S	.	.			trans	-59.4	112.2	171.5	171.3	29.3	0	0	0	110.6	E527 Q528 T529	D525-E527 VanDerWaalsContact C-N 3.28Å; D525-E527 PolarHBondContact O-N 2.87Å; D525-E527 PolarHBondContact OD1-N 2.84Å; D525-Q528 WeakPolarHBondContact OD2-CB 3.3Å; D525-Q528 PolarHBondContact OD2-N 3.37Å; D525-T529 VanDerWaalsContact O-CB 3.28Å; D525-T529 WeakPolarHBondContact O-CB 3.5Å; D525-T529 VanDerWaalsContact O-CG2 3.27Å; D525-T529 WeakPolarHBondContact O-CG2 3.32Å; D525-T529 PolarHBondContact O-N 3.27Å; D525-T529 PolarHBondContact O-OG1 3.49Å
526	M	77.4	Confident	80.2	Confident	89 Å²	89	65.2 Å²	65.2	44%	0.438	33%	0.332	S	S	.	.	H	α-helix	trans	-68.9	-22.7	-177.6	-63.8	-167.1	-66.5	0	0	113.2	E518 L524 T529 F530	E518-M526 HydrophobicContact CB-SD 4.37Å; E518-M526 HydrophobicContact CG-SD 3.59Å; E518-M526 VanDerWaalsContact CG-SD 3.59Å; L524-M526 PolarHBondContact O-N 3.37Å; M526-T529 WeakPolarHBondContact CA-OG1 3.4Å; M526-F530 WeakPolarHBondContact O-CB 3.17Å; M526-F530 PolarHBondContact O-N 3.22Å
527	E	77.3	Confident	80.1	Confident	106 Å²	106	64.5 Å²	64.5	50%	0.495	33%	0.329	S	S	.	.	H	α-helix	trans	-79.2	-55.1	178	-157.8	83.7	-107.3	0	0	110.1	R514 D525 T529 F530 I531	R514-E527 IonicContact NH2-OE1 3.93Å; D525-E527 VanDerWaalsContact C-N 3.28Å; D525-E527 PolarHBondContact O-N 2.87Å; D525-E527 PolarHBondContact OD1-N 2.84Å; E527-T529 PolarHBondContact O-N 3.14Å; E527-F530 PolarHBondContact O-N 2.78Å; E527-I531 WeakPolarHBondContact O-CG1 3.45Å; E527-I531 PolarHBondContact O-N 2.96Å
528	Q	79.8	Confident	79.9	Confident	96 Å²	96	65.9 Å²	65.9	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-37.8	179.1	-169.9	61.4	48.8	0	0	112.7	D525 F530 I531 N532	D525-Q528 WeakPolarHBondContact OD2-CB 3.3Å; D525-Q528 PolarHBondContact OD2-N 3.37Å; Q528-F530 VanDerWaalsContact C-N 3.35Å; Q528-F530 PolarHBondContact O-N 3.48Å; Q528-I531 PolarHBondContact O-N 3.03Å; Q528-N532 PolarHBondContact NE2-OD1 3.12Å; Q528-N532 WeakPolarHBondContact O-CB 3.46Å; Q528-N532 PolarHBondContact O-N 3.29Å; Q528-N532 PolarHBondContact O-OD1 2.77Å
529	T	80.3	Confident	79.4	Confident	16 Å²	16	62.1 Å²	62.1	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-39	173.5	55.6	0	0	0	0	111.6	L524 D525 M526 E527 N532 C533	L524-T529 HydrophobicContact CB-CG2 3.78Å; L524-T529 HydrophobicContact CD1-CG2 4.08Å; D525-T529 VanDerWaalsContact O-CB 3.28Å; D525-T529 WeakPolarHBondContact O-CB 3.5Å; D525-T529 VanDerWaalsContact O-CG2 3.27Å; D525-T529 WeakPolarHBondContact O-CG2 3.32Å; D525-T529 PolarHBondContact O-N 3.27Å; D525-T529 PolarHBondContact O-OG1 3.49Å; M526-T529 WeakPolarHBondContact CA-OG1 3.4Å; E527-T529 PolarHBondContact O-N 3.14Å; T529-N532 PolarHBondContact O-N 3.49Å; T529-C533 WeakPolarHBondContact O-CB 3.17Å; T529-C533 PolarHBondContact O-N 3.49Å; T529-C533 PolarHBondContact O-SG 3.22Å
530	F	82.9	Confident	78.7	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-38.2	176.2	-177.5	-107.8	0	0	0	112.4	L513 R514 L517 M526 E527 Q528 C533 I534 Y743	L513-F530 HydrophobicContact CB-CE2 4.42Å; L513-F530 HydrophobicContact CD2-CD2 3.95Å; L513-F530 HydrophobicContact CD2-CE2 3.96Å; L513-F530 HydrophobicContact CG-CD2 4.06Å; L513-F530 HydrophobicContact CG-CE2 4.17Å; R514-F530 HydrophobicContact CB-CD2 4.22Å; R514-F530 HydrophobicContact CB-CE2 3.93Å; L517-F530 HydrophobicContact CD1-CB 3.92Å; L517-F530 HydrophobicContact CD1-CD2 4.1Å; M526-F530 WeakPolarHBondContact O-CB 3.17Å; M526-F530 PolarHBondContact O-N 3.22Å; E527-F530 PolarHBondContact O-N 2.78Å; Q528-F530 VanDerWaalsContact C-N 3.35Å; Q528-F530 PolarHBondContact O-N 3.48Å; F530-C533 PolarHBondContact O-N 2.92Å; F530-I534 HydrophobicContact CD1-CD1 3.8Å; F530-I534 HydrophobicContact CE1-CD1 3.44Å; F530-I534 VanDerWaalsContact CE1-CD1 3.44Å; F530-I534 HydrophobicContact CE2-CD1 4.28Å; F530-I534 HydrophobicContact CG-CD1 4.37Å; F530-I534 HydrophobicContact CZ-CD1 3.71Å; F530-I534 WeakPolarHBondContact O-CG1 3.29Å; F530-I534 PolarHBondContact O-N 3.45Å; F530-Y743 HydrophobicContact CE1-CE1 4.27Å
531	I	80.9	Confident	77.7	Confident	40 Å²	40	53.6 Å²	53.6	21%	0.205	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-49.5	171.4	-68.6	163.7	0	0	0	110.7	E527 Q528 C533 I534 N535 M740	E527-I531 WeakPolarHBondContact O-CG1 3.45Å; E527-I531 PolarHBondContact O-N 2.96Å; Q528-I531 PolarHBondContact O-N 3.03Å; I531-C533 VanDerWaalsContact C-N 3.33Å; I531-C533 PolarHBondContact O-N 2.93Å; I531-I534 PolarHBondContact O-N 3.25Å; I531-I534 VanDerWaalsContact O-N 3.14Å; I531-N535 PolarHBondContact O-N 2.89Å; I531-M740 HydrophobicContact CG1-CE 3.96Å; I531-M740 HydrophobicContact CG1-CG 4.29Å; I531-M740 HydrophobicContact CG1-SD 4.33Å; I531-M740 HydrophobicContact CG2-CB 4.46Å
532	N	79.9	Confident	75.9	Confident	66 Å²	66	56.8 Å²	56.8	35%	0.353	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-40.8	179	-67.7	-8.1	0	0	0	111.7	Q528 T529 N535 I536	Q528-N532 PolarHBondContact NE2-OD1 3.12Å; Q528-N532 WeakPolarHBondContact O-CB 3.46Å; Q528-N532 PolarHBondContact O-N 3.29Å; Q528-N532 PolarHBondContact O-OD1 2.77Å; T529-N532 PolarHBondContact O-N 3.49Å; N532-N535 PolarHBondContact O-N 2.89Å; N532-I536 WeakPolarHBondContact O-CD1 3.23Å; N532-I536 WeakPolarHBondContact O-CG1 3.5Å; N532-I536 PolarHBondContact O-N 2.9Å
533	C	82.4	Confident	74.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-44	173	-68.4	0	0	0	0	111.9	V499 S501 L513 T529 F530 I531 I536 S537	V499-C533 CarbonylContact O-C 3.45Å; V499-C533 WeakPolarHBondContact O-CA 3.31Å; V499-C533 VanDerWaalsContact O-CB 3.27Å; V499-C533 WeakPolarHBondContact O-CB 3.24Å; S501-C533 PolarHBondContact N-SG 3.08Å; S501-C533 PolarHBondContact OG-SG 2.89Å; S501-C533 VanDerWaalsContact OG-SG 3.38Å; L513-C533 HydrophobicContact CD1-CB 3.84Å; L513-C533 HydrophobicContact CD2-CB 3.55Å; L513-C533 HydrophobicContact CG-CB 4.15Å; T529-C533 WeakPolarHBondContact O-CB 3.17Å; T529-C533 PolarHBondContact O-N 3.49Å; T529-C533 PolarHBondContact O-SG 3.22Å; F530-C533 PolarHBondContact O-N 2.92Å; I531-C533 VanDerWaalsContact C-N 3.33Å; I531-C533 PolarHBondContact O-N 2.93Å; C533-I536 PolarHBondContact O-N 2.93Å; C533-S537 PolarHBondContact O-N 2.9Å; C533-S537 PolarHBondContact O-OG 3.02Å
534	I	80.2	Confident	72.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-48.2	177.6	-74.5	167.6	0	0	0	110.5	L513 F530 I531 I536 S537 L738 M740 Y743	L513-I534 HydrophobicContact CD2-CG1 4.37Å; F530-I534 HydrophobicContact CD1-CD1 3.8Å; F530-I534 HydrophobicContact CE1-CD1 3.44Å; F530-I534 VanDerWaalsContact CE1-CD1 3.44Å; F530-I534 HydrophobicContact CE2-CD1 4.28Å; F530-I534 HydrophobicContact CG-CD1 4.37Å; F530-I534 HydrophobicContact CZ-CD1 3.71Å; F530-I534 WeakPolarHBondContact O-CG1 3.29Å; F530-I534 PolarHBondContact O-N 3.45Å; I531-I534 PolarHBondContact O-N 3.25Å; I531-I534 VanDerWaalsContact O-N 3.14Å; I534-I536 PolarHBondContact O-N 3.41Å; I534-S537 WeakPolarHBondContact O-CA 3.21Å; I534-S537 WeakPolarHBondContact O-CB 3.21Å; I534-S537 PolarHBondContact O-N 3.06Å; I534-S537 PolarHBondContact O-OG 3.43Å; I534-L738 CarbonylContact C-O 3.6Å; I534-L738 VanDerWaalsContact C-O 3.29Å; I534-L738 HydrophobicContact CG2-CD2 4.44Å; I534-L738 HydrophobicContact CG2-CG 4.28Å; I534-L738 WeakPolarHBondContact CG2-O 3.4Å; I534-M740 HydrophobicContact CB-SD 4.47Å; I534-M740 HydrophobicContact CD1-CE 4.46Å; I534-M740 HydrophobicContact CD1-SD 3.58Å; I534-M740 VanDerWaalsContact CD1-SD 3.58Å; I534-M740 HydrophobicContact CG2-CB 4.41Å; I534-M740 HydrophobicContact CG2-SD 4.28Å; I534-Y743 HydrophobicContact CD1-CD1 3.71Å; I534-Y743 HydrophobicContact CD1-CD2 4.43Å; I534-Y743 HydrophobicContact CD1-CE1 3.6Å; I534-Y743 HydrophobicContact CD1-CE2 4.36Å; I534-Y743 HydrophobicContact CD1-CG 4.1Å; I534-Y743 HydrophobicContact CG2-CG 4.35Å
535	N	78.3	Confident	70.4	Confident	51 Å²	51	53 Å²	53	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-66.6	-11.7	-179.7	-61.3	-19.2	0	0	0	114.3	I531 N532 R737 M740	I531-N535 PolarHBondContact O-N 2.89Å; N532-N535 PolarHBondContact O-N 2.89Å; N535-R737 PolarHBondContact O-NE 3.16Å; N535-R737 VanDerWaalsContact O-NE 3.15Å; N535-R737 PolarHBondContact O-NH2 2.87Å; N535-M740 PolarHBondContact OD1-N 2.78Å
536	I	76.6	Confident	67.8	Low	78 Å²	78	52.4 Å²	52.4	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-99.5	-14.6	171.1	-64.4	167.6	0	0	0	111.5	V499 N532 C533 I534	V499-I536 HydrophobicContact CB-CG2 4.12Å; V499-I536 HydrophobicContact CG1-CG2 3.98Å; N532-I536 WeakPolarHBondContact O-CD1 3.23Å; N532-I536 WeakPolarHBondContact O-CG1 3.5Å; N532-I536 PolarHBondContact O-N 2.9Å; C533-I536 PolarHBondContact O-N 2.93Å; I534-I536 PolarHBondContact O-N 3.41Å
537	S	81.8	Confident	65.3	Low	0 Å²	0	51.8 Å²	51.8	0%	0	33%	0.325	C	S	.	.			trans	-71.8	160	173.9	-56.8	0	0	0	0	111.7	L497 Y498 V499 C533 I534 L738	L497-S537 WeakPolarHBondContact O-CB 3.06Å; Y498-S537 VanDerWaalsContact CA-OG 3.25Å; Y498-S537 WeakPolarHBondContact CA-OG 3.22Å; V499-S537 PolarHBondContact N-OG 3.26Å; C533-S537 PolarHBondContact O-N 2.9Å; C533-S537 PolarHBondContact O-OG 3.02Å; I534-S537 WeakPolarHBondContact O-CA 3.21Å; I534-S537 WeakPolarHBondContact O-CB 3.21Å; I534-S537 PolarHBondContact O-N 3.06Å; I534-S537 PolarHBondContact O-OG 3.43Å; S537-L738 PolarHBondContact O-N 3.19Å
538	Y	80.1	Confident	63	Low	32 Å²	32	50.5 Å²	50.5	13%	0.125	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161.1	-178.1	53.7	-88.3	0	0	0	112.2	L497 V499 F730 K735 T736	L497-Y538 HydrophobicContact CB-CD2 4.4Å; L497-Y538 HydrophobicContact CB-CE2 4.09Å; L497-Y538 HydrophobicContact CD1-CE2 3.89Å; L497-Y538 PolarHBondContact N-O 3.08Å; L497-Y538 PolarHBondContact O-N 3.29Å; L497-Y538 VanDerWaalsContact O-N 3.08Å; V499-Y538 HydrophobicContact CG2-CD1 4.23Å; V499-Y538 HydrophobicContact CG2-CE1 3.78Å; Y538-F730 HydrophobicContact CE2-CE1 4.28Å; Y538-F730 AromaticContact CE2-CZ 3.94Å; Y538-F730 HydrophobicContact CE2-CZ 3.94Å; Y538-K735 HydrophobicContact CD2-CB 4.05Å; Y538-K735 HydrophobicContact CD2-CD 4.42Å; Y538-K735 HydrophobicContact CD2-CG 3.99Å; Y538-K735 HydrophobicContact CE2-CD 4.28Å; Y538-K735 HydrophobicContact CE2-CG 4.18Å; Y538-K735 HydrophobicContact CG-CB 4.38Å; Y538-T736 CarbonylContact C-O 3.45Å; Y538-T736 WeakPolarHBondContact CA-O 3.49Å; Y538-T736 VanDerWaalsContact CB-O 3.24Å; Y538-T736 WeakPolarHBondContact CB-O 3.27Å
539	Y	72.8	Confident	60.6	Low	17 Å²	17	51.4 Å²	51.4	7%	0.067	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.9	172.1	65.3	-88.6	0	0	0	111.3	L476 L495 F496 I541 T736 R737 L738	L476-Y539 HydrophobicContact CB-CD2 4.19Å; L476-Y539 HydrophobicContact CB-CE2 3.58Å; L476-Y539 HydrophobicContact CD2-CD1 4.09Å; L476-Y539 HydrophobicContact CD2-CD2 4.22Å; L476-Y539 HydrophobicContact CD2-CE1 3.59Å; L476-Y539 HydrophobicContact CD2-CE2 3.74Å; L476-Y539 HydrophobicContact CD2-CG 4.37Å; L476-Y539 HydrophobicContact CG-CE2 4.13Å; L495-Y539 VanDerWaalsContact O-CA 3.27Å; L495-Y539 WeakPolarHBondContact O-CA 3.17Å; F496-Y539 HydrophobicContact CE1-CG 4.45Å; Y539-I541 HydrophobicContact CD2-CG1 4.25Å; Y539-I541 HydrophobicContact CE2-CD1 4.19Å; Y539-I541 HydrophobicContact CE2-CG1 3.87Å; Y539-T736 HydrophobicContact CE1-CG2 3.92Å; Y539-T736 HydrophobicContact CE2-CG2 4.46Å; Y539-T736 VanDerWaalsContact CZ-CB 3.45Å; Y539-T736 PolarHBondContact N-O 2.99Å; Y539-T736 PolarHBondContact O-N 3.04Å; Y539-T736 VanDerWaalsContact O-N 3.15Å; Y539-T736 WeakPolarHBondContact OH-CG2 3.39Å; Y539-R737 WeakPolarHBondContact CE1-O 3.49Å; Y539-L738 HydrophobicContact CD1-CB 4.41Å; Y539-L738 HydrophobicContact CD1-CD1 4.3Å
540	L	68.8	Low	58.2	Low	10 Å²	10	59.7 Å²	59.7	5%	0.052	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.3	-179.5	-61.3	175.7	0	0	0	111	H494 L495 L497 F730 L733 K735	H494-L540 PolarHBondContact ND1-O 3.08Å; H494-L540 VanDerWaalsContact ND1-O 3.1Å; L495-L540 HydrophobicContact CB-CB 4.32Å; L495-L540 HydrophobicContact CB-CD1 4.08Å; L495-L540 HydrophobicContact CB-CG 4.45Å; L495-L540 PolarHBondContact O-N 3.35Å; L497-L540 HydrophobicContact CD1-CD1 4.36Å; L540-F730 HydrophobicContact CD1-CD2 4.42Å; L540-F730 HydrophobicContact CD1-CE2 3.88Å; L540-L733 HydrophobicContact CD1-CD1 4.15Å; L540-L733 HydrophobicContact CD2-CB 4.11Å; L540-L733 HydrophobicContact CD2-CD1 4.46Å; L540-K735 HydrophobicContact CD2-CG 3.92Å
541	I	58.5	Low	55.5	Low	29 Å²	29	65.8 Å²	65.8	15%	0.149	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-92.7	125.6	167.4	-55.9	176.4	0	0	0	107.9	L476 C477 Y539 Q734	L476-I541 WeakPolarHBondContact O-CD1 3.46Å; L476-I541 WeakPolarHBondContact O-CG1 3.47Å; C477-I541 HydrophobicContact CB-CG2 4.16Å; Y539-I541 HydrophobicContact CD2-CG1 4.25Å; Y539-I541 HydrophobicContact CE2-CD1 4.19Å; Y539-I541 HydrophobicContact CE2-CG1 3.87Å; I541-Q734 PolarHBondContact N-O 3.27Å
542	L	46	Very low	53.1	Low	100 Å²	100	68.5 Å²	68.5	52%	0.524	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-100	119.1	174.3	-87.2	158.6	0	0	0	108.4	E544	L542-E544 PolarHBondContact O-N 2.91Å; L542-E544 VanDerWaalsContact O-N 3.14Å
543	P	40.4	Very low	50.5	Low	112 Å²	112	69.5 Å²	69.5	73%	0.727	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-56.1	117.7	179	-27.7	35.6	0	0	0	112.3	G545	P543-G545 PolarHBondContact O-N 3.07Å
544	E	39.7	Very low	47.9	Very low	92 Å²	92	72.8 Å²	72.8	43%	0.43	52%	0.52	S	S	.	.			trans	-78.6	97.9	169.2	-69.6	-161.7	161	0	0	108.7	H479 H490 K493 L542 G546	H479-E544 IonicContact CE1-OE1 3.13Å; H479-E544 IonicContact CE1-OE2 3.21Å; H479-E544 PolarHBondContact CE1-OE2 3.13Å; H479-E544 VanDerWaalsContact CE1-OE2 3.3Å; H479-E544 IonicContact ND1-OE1 2.71Å; H479-E544 IonicContact ND1-OE2 3.63Å; H479-E544 PolarHBondContact ND1-OE2 3.37Å; H490-E544 IonicContact CE1-OE1 3.64Å; H490-E544 PolarHBondContact CE1-OE1 3.08Å; H490-E544 IonicContact ND1-OE1 2.9Å; H490-E544 PolarHBondContact ND1-OE1 2.9Å; K493-E544 IonicContact NZ-OE1 3.88Å; K493-E544 PolarHBondContact NZ-OE1 2.91Å; L542-E544 PolarHBondContact O-N 2.91Å; L542-E544 VanDerWaalsContact O-N 3.14Å; E544-G546 PolarHBondContact O-N 2.78Å
545	G	31.1	Very low	45.3	Very low	75 Å²	75	81.4 Å²	81.4	77%	0.773	56%	0.558	S	S	*	*			trans	-61.5	123.7	-170.2	0	0	0	0	0	115.1	P543	P543-G545 PolarHBondContact O-N 3.07Å
546	G	29.6	Very low	42.8	Very low	87 Å²	87	83.9 Å²	83.9	90%	0.897	57%	0.568	S	S	*	*	S	Bend	trans	91.6	73	157.7	0	0	0	0	0	115.7	E544	E544-G546 PolarHBondContact O-N 2.78Å
547	G	24.8	Very low	40.3	Very low	77 Å²	77	89.9 Å²	89.9	79%	0.794	59%	0.585	S	S	*	*			trans	-148.1	26.3	168.7	0	0	0	0	0	113.4
548	G	29	Very low	37.5	Very low	79 Å²	79	98.6 Å²	98.6	81%	0.814	63%	0.626	S	S	*	*			trans	-65.8	143.3	-175	0	0	0	0	0	113.1
549	S	27.6	Very low	34.9	Very low	115 Å²	115	101.1 Å²	101.1	80%	0.804	65%	0.654	S	S	*	*			trans	-141.1	62.5	172.7	-177.3	0	0	0	0	109.1	V551	S549-V551 PolarHBondContact O-N 2.97Å
550	E	30.3	Very low	32.4	Very low	190 Å²	190	107.1 Å²	107.1	89%	0.888	69%	0.692	S	S	*	*			trans	-85.6	103.1	166.8	-71.2	-177.1	138	0	0	109.4
551	V	26.9	Very low	30.3	Very low	132 Å²	132	115.4 Å²	115.4	80%	0.8	73%	0.728	S	S	*	*			trans	-144.9	99.7	159.2	-179.2	0	0	0	0	103.4	S549	S549-V551 PolarHBondContact O-N 2.97Å
552	A	29.8	Very low	28.8	Very low	97 Å²	97	122.3 Å²	122.3	80%	0.802	76%	0.757	S	S	*	*			cis	78.2	131	33.3	0	0	0	0	0	114.1
553	G	25.6	Very low	27.8	Very low	86 Å²	86	125 Å²	125	89%	0.887	77%	0.767	S	S	*	*			trans	124.3	118.2	-175	0	0	0	0	0	110.9
554	G	27.3	Very low	27.2	Very low	70 Å²	70	123.4 Å²	123.4	72%	0.722	77%	0.77	S	S	*	*			cis	-155	-154.3	-3.7	0	0	0	0	0	109.4
555	K	26.4	Very low	26.7	Very low	180 Å²	180	127.7 Å²	127.7	78%	0.783	79%	0.79	S	S	*	*			cis	159.8	149.6	8.4	-114.1	-173.8	163.1	-137.4	0	103.3
556	E	24.9	Very low	26.6	Very low	104 Å²	104	130.4 Å²	130.4	49%	0.486	79%	0.787	S	S	.	*			cis	-136.8	169.1	6.2	-56.8	-149.1	133.9	0	0	110.8
557	R	24.8	Very low	26.6	Very low	203 Å²	203	130.9 Å²	130.9	77%	0.766	78%	0.783	S	S	*	*				55.3	147.1	106.5	-62.8	170	-176.7	162.3	-16.2	115.4
558	E	23.7	Very low	26.6	Very low	183 Å²	183	130.6 Å²	130.6	86%	0.855	78%	0.78	S	S	*	*			cis	-127.7	167	17.1	-68.9	177.7	134	0	0	110.8
559	A	24.7	Very low	26.4	Very low	86 Å²	86	133.1 Å²	133.1	71%	0.711	78%	0.779	S	S	*	*			cis	90.6	100.1	18.2	0	0	0	0	0	116.8
560	T	21.6	Very low	26.3	Very low	142 Å²	142	136.6 Å²	136.6	87%	0.871	78%	0.78	S	S	*	*			trans	-140.3	131	168.1	30.2	0	0	0	0	112.6
561	F	22.9	Very low	26.3	Very low	184 Å²	184	133.1 Å²	133.1	81%	0.807	77%	0.772	S	S	*	*			trans	-87.3	162.1	156.2	-92.1	-122.2	0	0	0	107.9	E563	F561-E563 HydrophobicContact CD1-CG 4.36Å
562	K	27.6	Very low	26.3	Very low	175 Å²	175	136 Å²	136	76%	0.761	78%	0.776	S	S	*	*				-164.8	140.2	62.1	-85.3	-168.9	172.1	-163.7	0	110.5
563	E	26.2	Very low	26.2	Very low	157 Å²	157	134.9 Å²	134.9	73%	0.734	77%	0.774	S	S	*	*				69.5	132.3	86.9	-57.1	-179.7	125.5	0	0	116.8	F561	F561-E563 HydrophobicContact CD1-CG 4.36Å
564	G	26.3	Very low	26.3	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	77%	0.77	S	S	*	*			trans	-172.5	138.5	174.3	0	0	0	0	0	111.4
565	E	29.6	Very low	26.2	Very low	182 Å²	182	144 Å²	144	85%	0.85	78%	0.777	S	S	*	*			trans	-93.2	-173	-162	-46.4	177.3	126.1	0	0	113.8
566	N	29.1	Very low	26.1	Very low	132 Å²	132	138.8 Å²	138.8	71%	0.706	78%	0.775	S	S	*	*			cis	-163.9	175.7	15.5	-146.5	-48.9	0	0	0	114
567	A	30.1	Very low	26.9	Very low	97 Å²	97	140.6 Å²	140.6	80%	0.802	80%	0.795	S	S	*	*			trans	79.7	138.7	159.1	0	0	0	0	0	121.3
568	G	24.5	Very low	27	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	80%	0.795	S	S	*	*			trans	-168.8	-65.7	-177.4	0	0	0	0	0	117.8
569	T	24.3	Very low	27.1	Very low	132 Å²	132	129 Å²	129	81%	0.81	79%	0.788	S	S	*	*			trans	90.7	128.4	166.6	-45.1	0	0	0	0	121.1
570	K	26.2	Very low	27.2	Very low	188 Å²	188	132.3 Å²	132.3	82%	0.817	79%	0.794	S	S	*	*			trans	86.3	96.9	151.3	-88.4	174.6	179.1	-180	0	125
571	V	29.4	Very low	27.4	Very low	117 Å²	117	134.8 Å²	134.8	71%	0.709	80%	0.795	S	S	*	*				99.8	129.4	105.2	153.7	0	0	0	0	123.7
572	E	28.1	Very low	27.7	Very low	192 Å²	192	134.6 Å²	134.6	90%	0.897	80%	0.797	S	S	*	*			trans	73.4	144	158.4	-85.6	164.9	-135.8	0	0	123.4
573	G	26.8	Very low	27.6	Very low	74 Å²	74	133.8 Å²	133.8	76%	0.763	80%	0.796	S	S	*	*			trans	158.6	-47.3	175.4	0	0	0	0	0	117
574	N	27.5	Very low	27.7	Very low	147 Å²	147	131.6 Å²	131.6	79%	0.786	79%	0.789	S	S	*	*			trans	28.5	105.9	165.1	-160.2	8.9	0	0	0	122.1
575	K	26.7	Very low	27.7	Very low	200 Å²	200	138.4 Å²	138.4	87%	0.87	79%	0.79	S	S	*	*				169.6	139.4	124.8	-93.9	172	-178.2	-177.1	0	114.2
576	G	24.3	Very low	27.5	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	79%	0.787	S	S	*	*			trans	-128.8	-148	165.6	0	0	0	0	0	110.4
577	P	41.2	Very low	27.5	Very low	142 Å²	142	137.3 Å²	137.3	92%	0.922	79%	0.791	S	S	*	*			cis	-108.5	-133.4	-12.2	43.9	-30.8	0	0	0	110
578	G	25.3	Very low	27.3	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	79%	0.788	S	S	*	*			cis	161.7	168.4	-2.7	0	0	0	0	0	112.6
579	G	26.8	Very low	27.4	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	79%	0.79	S	S	*	*			trans	101.8	81.5	156.5	0	0	0	0	0	120.6
580	D	26.3	Very low	27.6	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	78%	0.781	S	S	*	*				41.9	157.7	109.3	-47.1	-51.4	0	0	0	125.6
581	E	27.2	Very low	27.7	Very low	193 Å²	193	138.7 Å²	138.7	90%	0.902	77%	0.772	S	S	*	*			trans	83.9	179.6	153.4	-79.2	172.8	-164.4	0	0	123.2
582	E	28	Very low	27.5	Very low	180 Å²	180	138.9 Å²	138.9	84%	0.841	77%	0.765	S	S	*	*			trans	-114.5	-170.7	-135.7	-55.2	-164.9	109.3	0	0	118.2
583	E	26.4	Very low	27.4	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.743	76%	0.759	S	S	*	*			trans	92.2	123.9	152.3	-68.9	-124.4	114	0	0	123.3
584	L	27	Very low	27.3	Very low	111 Å²	111	141.1 Å²	141.1	58%	0.581	76%	0.756	S	S	*	*			trans	51.6	128.5	131.8	-60.4	-174.4	0	0	0	125.5
585	R	26.9	Very low	27.4	Very low	219 Å²	219	141.7 Å²	141.7	83%	0.826	75%	0.754	S	S	*	*			trans	69.4	106.9	132.3	-66.1	173.7	-173	-155	5.1	122.7
586	N	26.2	Very low	27.5	Very low	144 Å²	144	138.9 Å²	138.9	77%	0.77	74%	0.744	S	S	*	*				57.6	144.6	115.4	-115.2	52.6	0	0	0	125.1
587	D	28.9	Very low	27.4	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	74%	0.743	S	S	*	*			trans	83.7	148.4	152.8	-74.2	-56	0	0	0	123.1
588	G	25.5	Very low	27	Very low	73 Å²	73	143.2 Å²	143.2	75%	0.753	74%	0.74	S	S	*	*			trans	80.7	108.6	170.4	0	0	0	0	0	116.9
589	K	27.1	Very low	27.1	Very low	175 Å²	175	144.4 Å²	144.4	76%	0.761	74%	0.737	S	S	*	*			cis	96.6	106.9	6.4	-150.9	-164.7	-172.8	-129.4	0	117.6
590	Q	27.6	Very low	27.1	Very low	134 Å²	134	146.3 Å²	146.3	63%	0.626	74%	0.735	S	S	*	*			trans	68.3	158.7	157.3	-72.6	168.4	-55.5	0	0	117.1
591	Q	28.5	Very low	27.1	Very low	135 Å²	135	147.2 Å²	147.2	63%	0.631	73%	0.734	S	S	*	*			cis	-142.6	-165.9	-0.7	-125.9	149.2	-117.1	0	0	108.1
592	Q	25.3	Very low	27.1	Very low	120 Å²	120	145.2 Å²	145.2	56%	0.561	73%	0.727	S	S	*	*			cis	-122	-120.5	8.9	-162.4	105.8	-59.4	0	0	111.6
593	E	25.7	Very low	27.1	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	72%	0.719	S	S	*	*			cis	-150.2	-173.4	-1.3	-149.8	95.8	-107.3	0	0	110.9
594	E	25.2	Very low	27.3	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	72%	0.723	S	S	*	*			trans	-99.8	143.3	-163.1	-79.8	160.7	-166.9	0	0	114.3
595	E	29.4	Very low	27.3	Very low	160 Å²	160	145.7 Å²	145.7	75%	0.748	73%	0.728	S	S	*	*				68.3	150.1	86.9	-57.6	-142.3	117	0	0	115.8
596	Q	28.9	Very low	27.4	Very low	141 Å²	141	141.9 Å²	141.9	66%	0.659	72%	0.719	S	S	*	*			cis	-162.4	-174.9	-2.4	-124.6	-174.3	49.8	0	0	111.8
597	T	22.6	Very low	27.5	Very low	119 Å²	119	142.9 Å²	142.9	73%	0.73	72%	0.717	S	S	*	*			trans	71.6	138.7	171.8	69.7	0	0	0	0	117.4
598	Q	32.4	Very low	27.4	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.864	72%	0.718	S	S	*	*			cis	82.1	135.8	35	-67.7	-169.7	7.5	0	0	115.2
599	S	27.8	Very low	27.5	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	72%	0.717	S	S	*	*			cis	-172.3	-173.9	-11	51.6	0	0	0	0	112.2
600	V	27	Very low	27.4	Very low	109 Å²	109	142.9 Å²	142.9	66%	0.661	71%	0.714	S	S	*	*			trans	126.7	123.8	139.8	-176.9	0	0	0	0	120.1
601	Q	25.7	Very low	27.2	Very low	175 Å²	175	143.4 Å²	143.4	82%	0.818	72%	0.721	S	S	*	*			trans	57.4	175.8	153.4	-70.6	159.1	9.1	0	0	123.4
602	M	26.4	Very low	27.3	Very low	151 Å²	151	147.2 Å²	147.2	74%	0.744	73%	0.729	S	S	*	*				-171.1	144.1	-59.7	-91.9	-125.1	-59	0	0	114.8
603	M	27.8	Very low	27.3	Very low	139 Å²	139	148 Å²	148	69%	0.685	74%	0.737	S	S	*	*			trans	57.1	142.5	151.4	-52.8	-162.8	-45.6	0	0	127.7
604	E	30.4	Very low	27.6	Very low	176 Å²	176	145 Å²	145	82%	0.822	73%	0.734	S	S	*	*			trans	64.4	165.5	149	-68.6	161.5	128.1	0	0	122.9
605	E	28.5	Very low	27.8	Very low	145 Å²	145	146.2 Å²	146.2	68%	0.678	74%	0.743	S	S	*	*			cis	-131.1	-116.1	7.9	-168.1	-111.1	-175.7	0	0	115.3	K607	E605-K607 IonicContact OE1-NZ 3.1Å; E605-K607 PolarHBondContact OE1-NZ 3.2Å; E605-K607 IonicContact OE2-NZ 2.82Å
606	E	28.9	Very low	27.5	Very low	139 Å²	139	142.1 Å²	142.1	65%	0.65	74%	0.744	S	S	*	*			trans	-139.7	-177.7	-164.5	-58.6	-166.4	128.2	0	0	117.6
607	K	28.2	Very low	27.4	Very low	165 Å²	165	139.2 Å²	139.2	72%	0.717	75%	0.752	S	S	*	*			trans	75	148.1	161.6	-60.5	162.4	-167.7	89.6	0	116.9	E605	E605-K607 IonicContact OE1-NZ 3.1Å; E605-K607 PolarHBondContact OE1-NZ 3.2Å; E605-K607 IonicContact OE2-NZ 2.82Å
608	G	25.9	Very low	27.6	Very low	79 Å²	79	138.5 Å²	138.5	81%	0.814	76%	0.758	S	S	*	*			cis	-178.5	-170.9	-1.6	0	0	0	0	0	109.1
609	K	27.6	Very low	27.6	Very low	167 Å²	167	139 Å²	139	73%	0.726	76%	0.76	S	S	*	*			cis	-168.4	146.5	-10.5	-160.2	-177.3	-165.1	-70.1	0	109.9
610	E	25.5	Very low	27.7	Very low	150 Å²	150	143 Å²	143	70%	0.701	77%	0.766	S	S	*	*			trans	35.4	124.4	156.1	-74.2	154.2	-159.4	0	0	125.8
611	D	24.3	Very low	27.8	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	76%	0.762	S	S	*	*				-176.3	130.4	115.1	-107.1	-27.3	0	0	0	109.9
612	R	30	Very low	27.9	Very low	214 Å²	214	139.4 Å²	139.4	81%	0.808	76%	0.755	S	S	*	*				58.4	134.1	85.8	-74.8	-167.5	151.6	-170.2	-5.2	115.6
613	L	25.4	Very low	28	Very low	137 Å²	137	141 Å²	141	72%	0.717	76%	0.761	S	S	*	*			cis	-152.1	171.3	10.5	-114.2	165.8	0	0	0	113.4
614	S	31.4	Very low	27.8	Very low	101 Å²	101	140 Å²	140	71%	0.706	76%	0.759	S	S	*	*			trans	-38	172.7	-178.4	-50.9	0	0	0	0	120.2
615	I	28.7	Very low	27.8	Very low	174 Å²	174	139 Å²	139	89%	0.892	75%	0.752	S	S	*	*			cis	-145.5	145.3	28.4	-58.9	167.1	0	0	0	109.3
616	G	24.7	Very low	27.7	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	75%	0.752	S	S	*	*			cis	-149.6	-149.3	3.2	0	0	0	0	0	110.2
617	G	26.1	Very low	27.4	Very low	81 Å²	81	136.5 Å²	136.5	84%	0.835	76%	0.755	S	S	*	*			cis	117.4	127.8	1.4	0	0	0	0	0	112.9
618	A	26.9	Very low	27.2	Very low	103 Å²	103	136.4 Å²	136.4	85%	0.851	76%	0.757	S	S	*	*			cis	-162.4	170.8	-9.5	0	0	0	0	0	111.7
619	Q	31.9	Very low	27	Very low	195 Å²	195	141 Å²	141	91%	0.911	76%	0.757	S	S	*	*			trans	-150.7	151.9	169.4	-69.8	-174.3	-66.9	0	0	110.3
620	K	31.1	Very low	26.9	Very low	185 Å²	185	136.7 Å²	136.7	80%	0.804	75%	0.753	S	S	*	*			trans	-172.3	145.9	153.3	-113.8	178.3	172.5	-68.7	0	116.9
621	D	28.3	Very low	26.7	Very low	111 Å²	111	135.5 Å²	135.5	59%	0.594	76%	0.756	S	S	*	*			trans	57.2	108	140.7	-65.9	-26.1	0	0	0	126.7
622	S	28.8	Very low	26.6	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	75%	0.753	S	S	*	*				67.3	141.2	96.8	-53.6	0	0	0	0	124.8
623	Q	27.5	Very low	26.3	Very low	185 Å²	185	131.9 Å²	131.9	86%	0.864	74%	0.743	S	S	*	*			trans	77.2	158.6	162.8	-67.5	172	-40.8	0	0	117.2
624	D	24.6	Very low	26.4	Very low	118 Å²	118	132.1 Å²	132.1	63%	0.631	74%	0.739	S	S	*	*			cis	-139.4	-128.7	14.2	-154.8	30.9	0	0	0	116.1
625	K	30.6	Very low	26	Very low	155 Å²	155	133.9 Å²	133.9	67%	0.674	74%	0.739	S	S	*	*			trans	-117	169.6	-155.6	-56.5	162.2	-165.1	70.8	0	117.9
626	S	25.3	Very low	25.7	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	73%	0.728	S	S	*	*			trans	80.3	132.7	132.1	56	0	0	0	0	125.3
627	N	22.1	Very low	25.6	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	73%	0.728	S	S	*	*			trans	70.7	146.7	136.4	-76.5	34.3	0	0	0	125.2
628	E	23.6	Very low	25.5	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.762	72%	0.72	S	S	*	*			trans	61.7	167.2	149.7	-72.7	151.4	-125.9	0	0	119.8
629	E	23.3	Very low	25.3	Very low	175 Å²	175	136 Å²	136	82%	0.818	72%	0.717	S	S	*	*				-155.3	164	-56	-157.1	176	-135.1	0	0	108.9
630	A	23.9	Very low	24.8	Very low	77 Å²	77	130 Å²	130	64%	0.636	70%	0.702	S	S	*	*			trans	68	148.4	152.5	0	0	0	0	0	121.6
631	V	21.7	Very low	24.5	Very low	125 Å²	125	123.9 Å²	123.9	76%	0.758	68%	0.681	S	S	*	*			trans	63.5	132.1	136.9	164	0	0	0	0	118.3
632	E	22.7	Very low	24.3	Very low	154 Å²	154	121.8 Å²	121.8	72%	0.72	67%	0.672	S	S	*	*			cis	-156.2	172	1.9	-124.7	175.3	174.1	0	0	112.4
633	E	24.5	Very low	24	Very low	129 Å²	129	122 Å²	122	60%	0.603	67%	0.674	S	S	*	*			trans	19.3	156.1	139	-73.5	-162.4	142.6	0	0	123.2
634	K	26.3	Very low	24	Very low	143 Å²	143	118 Å²	118	62%	0.622	67%	0.672	S	S	*	*			cis	-166.7	160.5	11.2	-127.5	174	179.9	127.4	0	111.9
635	L	23.1	Very low	24.1	Very low	137 Å²	137	116.5 Å²	116.5	72%	0.717	68%	0.676	S	S	*	*			trans	64.9	154.5	147.6	-66.3	-169	0	0	0	119.7
636	L	23.6	Very low	23.9	Very low	126 Å²	126	116.8 Å²	116.8	66%	0.66	69%	0.685	S	S	*	*			cis	-149.1	154.8	-0.5	-115.6	162.1	0	0	0	110.8
637	N	22.4	Very low	23.9	Very low	140 Å²	140	116 Å²	116	75%	0.749	69%	0.685	S	S	*	*			trans	18.3	156.8	138.4	-71.8	14.5	0	0	0	122.9
638	S	22.5	Very low	24.1	Very low	97 Å²	97	118.7 Å²	118.7	68%	0.678	69%	0.693	S	S	*	*			cis	-170.3	-179.8	-5.6	44.9	0	0	0	0	111.7
639	S	23	Very low	24.3	Very low	114 Å²	114	114.5 Å²	114.5	80%	0.797	69%	0.686	S	S	*	*			trans	-1.6	153.7	153.9	-41	0	0	0	0	120.3
640	A	22.5	Very low	24.6	Very low	70 Å²	70	113.3 Å²	113.3	58%	0.579	68%	0.68	S	S	*	*			cis	-157.3	-148.8	33.7	0	0	0	0	0	115.9	V1085	A640-V1085 HydrophobicContact CB-CG2 3.48Å; A640-V1085 VanDerWaalsContact CB-CG2 3.48Å
641	C	23.4	Very low	24.9	Very low	55 Å²	55	116.5 Å²	116.5	37%	0.372	68%	0.68	S	S	.	*			trans	-91.2	164	-151.3	-42	0	0	0	0	119.3	S1084 V1085 E1086	C641-S1084 CarbonylContact O-C 3.38Å; C641-S1084 WeakPolarHBondContact O-CB 3.46Å; C641-V1085 HydrophobicContact CB-CG2 3.93Å; C641-V1085 WeakPolarHBondContact O-CA 3.42Å; C641-V1085 WeakPolarHBondContact O-CG2 3.46Å; C641-V1085 PolarHBondContact O-N 3.5Å; C641-E1086 WeakPolarHBondContact CB-OE2 3.38Å; C641-E1086 PolarHBondContact SG-OE2 3.12Å
642	V	24.3	Very low	25.2	Very low	67 Å²	67	116.3 Å²	116.3	41%	0.406	68%	0.675	S	S	.	*				57	140.9	124.8	175.8	0	0	0	0	125.6	V1085 E1086	V642-V1085 PolarHBondContact O-N 3.04Å; V642-E1086 HydrophobicContact CB-CG 3.64Å; V642-E1086 HydrophobicContact CG1-CG 3.27Å; V642-E1086 HydrophobicContact CG2-CG 4.4Å
643	S	23.9	Very low	25.6	Very low	102 Å²	102	115.4 Å²	115.4	71%	0.713	68%	0.675	S	S	*	*			trans	36.3	164.9	150.3	-62.2	0	0	0	0	123.5
644	A	27.7	Very low	25.8	Very low	100 Å²	100	113.5 Å²	113.5	83%	0.826	68%	0.675	S	S	*	*			cis	-133.8	-133	14.8	0	0	0	0	0	116.3
645	A	25.4	Very low	26.1	Very low	86 Å²	86	112.3 Å²	112.3	71%	0.711	69%	0.685	S	S	*	*			trans	-147	-177.6	-151.6	0	0	0	0	0	117.5
646	D	26.1	Very low	26.6	Very low	162 Å²	162	111.1 Å²	111.1	87%	0.866	69%	0.689	S	S	*	*			trans	90.2	162	154.5	-70.9	-51.4	0	0	0	123.7
647	A	26.7	Very low	27.1	Very low	83 Å²	83	110.6 Å²	110.6	69%	0.686	70%	0.695	S	S	*	*			trans	69.9	130.5	176	0	0	0	0	0	118.8
648	H	25.9	Very low	28.2	Very low	187 Å²	187	109.2 Å²	109.2	87%	0.866	69%	0.694	S	S	*	*			cis	82.7	141.4	42	-73	-69.3	0	0	0	114
649	A	26.6	Very low	28.8	Very low	75 Å²	75	112 Å²	112	62%	0.62	70%	0.702	S	S	*	*			cis	-170.9	-164.3	-12.7	0	0	0	0	0	110.9
650	E	29.4	Very low	29	Very low	151 Å²	151	109.5 Å²	109.5	71%	0.706	69%	0.694	S	S	*	*			trans	81.8	153.7	154.9	-53.9	-139.3	118.1	0	0	118.9
651	K	30.4	Very low	29.1	Very low	143 Å²	143	113.2 Å²	113.2	62%	0.622	71%	0.708	S	S	*	*			cis	-163.9	152.8	-2.1	-125.4	174.8	179.4	136.5	0	115
652	N	29.4	Very low	29.4	Very low	122 Å²	122	119 Å²	119	65%	0.652	73%	0.73	S	S	*	*			trans	54	169.8	136.3	-75.3	28.7	0	0	0	123.6
653	D	29.5	Very low	29.4	Very low	135 Å²	135	120.8 Å²	120.8	72%	0.722	75%	0.745	S	S	*	*			cis	-163.7	-174.6	-2.1	-115.8	-27.5	0	0	0	109.9
654	S	30	Very low	29.4	Very low	88 Å²	88	121.1 Å²	121.1	62%	0.615	75%	0.747	S	S	*	*			cis	-173.7	152.5	-15.2	50.6	0	0	0	0	113.4
655	S	33.1	Very low	29.2	Very low	119 Å²	119	121.2 Å²	121.2	83%	0.832	74%	0.742	S	S	*	*			trans	69.2	167.4	152.4	77.8	0	0	0	0	121
656	S	32.3	Very low	29.2	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	75%	0.747	S	S	*	*			cis	-151.9	172.2	9.7	63.2	0	0	0	0	115.5
657	S	34.2	Very low	29.2	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	75%	0.745	S	S	*	*			trans	-89.3	-163.6	-172.1	-31.4	0	0	0	0	115.6
658	P	46.4	Very low	29	Very low	110 Å²	110	127.3 Å²	127.3	71%	0.714	74%	0.742	S	S	*	*			cis	-146.2	-162.2	20.9	46.4	-23.9	0	0	0	119.1
659	D	33.7	Very low	29	Very low	157 Å²	157	128.4 Å²	128.4	84%	0.84	74%	0.738	S	S	*	*			trans	68.3	162.7	159.9	-91.9	-90.4	0	0	0	123.2
660	G	28.4	Very low	28.9	Very low	61 Å²	61	129.7 Å²	129.7	63%	0.629	74%	0.738	S	S	*	*			cis	176.7	172.3	-2.4	0	0	0	0	0	117.4
661	V	25.3	Very low	28.7	Very low	147 Å²	147	130 Å²	130	89%	0.891	74%	0.74	S	S	*	*			trans	70	141.6	168.4	-172.2	0	0	0	0	121.5
662	H	28.5	Very low	28.4	Very low	177 Å²	177	130.3 Å²	130.3	82%	0.819	74%	0.743	S	S	*	*			trans	-77.1	177.1	179.3	-70.6	-88.8	0	0	0	114.8
663	S	25.3	Very low	28.1	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	75%	0.745	S	S	*	*			cis	-164.4	-158.8	14.3	-135.7	0	0	0	0	108.6
664	S	24	Very low	27.9	Very low	109 Å²	109	129.6 Å²	129.6	76%	0.762	74%	0.744	S	S	*	*			cis	179.8	171.2	-10	43	0	0	0	0	108.4
665	S	23.3	Very low	27.5	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	75%	0.753	S	S	*	*			cis	-179	135.1	-39	-171.8	0	0	0	0	112
666	L	24.2	Very low	27.8	Very low	153 Å²	153	132.3 Å²	132.3	80%	0.801	74%	0.741	S	S	*	*			trans	67.7	148.1	156.9	-83.8	172.9	0	0	0	124.6
667	K	25.9	Very low	27.4	Very low	190 Å²	190	133.4 Å²	133.4	83%	0.826	74%	0.738	S	S	*	*			trans	74.6	158.9	157.1	-70.7	171.2	179.9	179	0	120.1
668	D	23.1	Very low	27	Very low	116 Å²	116	134 Å²	134	62%	0.62	74%	0.736	S	S	*	*			cis	-174.4	150.8	-29.7	-179.6	29.8	0	0	0	109.1
669	R	25.8	Very low	26.2	Very low	210 Å²	210	134.6 Å²	134.6	79%	0.792	74%	0.738	S	S	*	*			trans	62	165.3	167.9	-85.1	167.8	163.2	142.6	-10.6	117.3
670	T	24	Very low	25.8	Very low	102 Å²	102	134.2 Å²	134.2	63%	0.626	74%	0.736	S	S	*	*			cis	-153.2	166	13.2	-15	0	0	0	0	112.2
671	Q	26.8	Very low	25.8	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	74%	0.735	S	S	*	*			trans	23.2	150	135.8	-78.9	174.4	-73.1	0	0	122.1
672	E	23.3	Very low	25.9	Very low	148 Å²	148	133.6 Å²	133.6	69%	0.692	73%	0.728	S	S	*	*			cis	-174.4	163.2	-8.5	-156.8	174.3	144.6	0	0	110.8
673	N	24.1	Very low	25.7	Very low	130 Å²	130	129.4 Å²	129.4	70%	0.695	73%	0.725	S	S	*	*			trans	79.2	152	146.2	-142.6	5.5	0	0	0	124
674	T	24	Very low	25.8	Very low	112 Å²	112	130.9 Å²	130.9	69%	0.687	73%	0.729	S	S	*	*			trans	65.2	109.3	153.9	29	0	0	0	0	124.1
675	Q	22.6	Very low	25.9	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.822	73%	0.73	S	S	*	*				0.4	167.9	117.9	-84.7	-166.6	-60.6	0	0	121.1
676	P	38.7	Very low	26	Very low	88 Å²	88	131.7 Å²	131.7	57%	0.571	73%	0.734	S	S	*	*			cis	-146	-165.6	-26.6	39.8	-18.9	0	0	0	115.5
677	D	23.2	Very low	26.1	Very low	136 Å²	136	131.5 Å²	131.5	73%	0.727	74%	0.74	S	S	*	*			trans	78.8	127.5	138.9	-74.3	-15.8	0	0	0	126.1
678	V	26.6	Very low	26.1	Very low	126 Å²	126	127.3 Å²	127.3	76%	0.764	74%	0.741	S	S	*	*			trans	67.7	144.5	142	-175.7	0	0	0	0	115.9
679	V	29.4	Very low	26.5	Very low	124 Å²	124	127.5 Å²	127.5	75%	0.752	75%	0.751	S	S	*	*			cis	-142.1	145.8	35.7	-139.4	0	0	0	0	108.4
680	N	25.5	Very low	26.8	Very low	149 Å²	149	120.8 Å²	120.8	80%	0.797	74%	0.737	S	S	*	*				49.1	139.7	67.3	-114.8	4.7	0	0	0	114.7
681	S	29.1	Very low	27.2	Very low	85 Å²	85	118.7 Å²	118.7	59%	0.594	73%	0.726	S	S	*	*			cis	-157.8	171.8	19.7	-60.5	0	0	0	0	113.2
682	S	26.3	Very low	27.6	Very low	109 Å²	109	114.9 Å²	114.9	76%	0.762	72%	0.717	S	S	*	*			trans	60.9	129	150.2	49.4	0	0	0	0	119.7
683	A	24.7	Very low	27.9	Very low	90 Å²	90	112.5 Å²	112.5	74%	0.744	72%	0.717	S	S	*	*				66.3	137.8	53.9	0	0	0	0	0	112.3
684	V	27.3	Very low	28.1	Very low	135 Å²	135	109.5 Å²	109.5	82%	0.818	72%	0.716	S	S	*	*			cis	-141.8	179.6	33.1	-73.1	0	0	0	0	110.2
685	S	26.7	Very low	28.4	Very low	113 Å²	113	110.8 Å²	110.8	79%	0.79	72%	0.724	S	S	*	*			cis	-147.2	155.6	20.2	-55.9	0	0	0	0	113.3
686	S	25.5	Very low	28.7	Very low	115 Å²	115	107.2 Å²	107.2	80%	0.804	72%	0.718	S	S	*	*			trans	-113.1	164	167.6	48.2	0	0	0	0	111.1
687	T	26	Very low	28.3	Very low	150 Å²	150	110.1 Å²	110.1	92%	0.92	73%	0.729	S	S	*	*			trans	-134.7	158	159.2	46.8	0	0	0	0	109.6
688	A	25.6	Very low	28.6	Very low	102 Å²	102	108.3 Å²	108.3	84%	0.843	73%	0.727	S	S	*	*			trans	-130	175.6	-164.3	0	0	0	0	0	113.4
689	S	32.1	Very low	28.6	Very low	119 Å²	119	107 Å²	107	83%	0.832	72%	0.723	S	S	*	*			trans	-70	162.4	174.5	51.7	0	0	0	0	114.7
690	S	30.8	Very low	28.4	Very low	70 Å²	70	108.9 Å²	108.9	49%	0.49	73%	0.729	S	S	.	*			trans	-148.6	161.4	164.7	86.1	0	0	0	0	107.8	N1155	S690-N1155 PolarHBondContact OG-ND2 3.21Å
691	S	33.8	Very low	28.5	Very low	58 Å²	58	109.5 Å²	109.5	41%	0.406	73%	0.732	S	S	.	*			cis	-177.8	165	-10.3	30.7	0	0	0	0	107.4	D1157	S691-D1157 WeakPolarHBondContact CB-OD1 3.49Å; S691-D1157 PolarHBondContact OG-OD1 2.93Å; S691-D1157 PolarHBondContact OG-OD2 3.36Å
692	S	34.3	Very low	29	Very low	77 Å²	77	111.3 Å²	111.3	54%	0.538	74%	0.741	S	S	.	*			cis	-116	-131	-7.3	40.9	0	0	0	0	108.6
693	S	29.6	Very low	28.9	Very low	99 Å²	99	109.9 Å²	109.9	69%	0.692	74%	0.744	S	S	*	*			cis	-164.3	152.5	-9.6	43.9	0	0	0	0	108.2
694	G	27.6	Very low	29	Very low	67 Å²	67	114 Å²	114	69%	0.691	75%	0.747	S	S	*	*			cis	-175.3	157.3	-9.5	0	0	0	0	0	115.5
695	V	30.2	Very low	28.9	Very low	138 Å²	138	113 Å²	113	84%	0.836	74%	0.742	S	S	*	*			trans	56.9	105.2	151.3	-85	0	0	0	0	124.5
696	S	29.7	Very low	28.9	Very low	102 Å²	102	117.1 Å²	117.1	71%	0.713	75%	0.749	S	S	*	*				78.7	150.4	121.3	81.8	0	0	0	0	120.4
697	N	29.8	Very low	29.2	Very low	149 Å²	149	117.3 Å²	117.3	80%	0.797	75%	0.75	S	S	*	*			cis	-155.7	171.1	7.8	-140.6	-10.1	0	0	0	116.3
698	S	29.3	Very low	29.3	Very low	98 Å²	98	115.5 Å²	115.5	69%	0.685	74%	0.743	S	S	*	*			trans	77.5	123.8	155.9	59.2	0	0	0	0	124
699	S	27.4	Very low	29.3	Very low	98 Å²	98	116.1 Å²	116.1	69%	0.685	74%	0.742	S	S	*	*			trans	83.7	108.8	138.3	44.3	0	0	0	0	123.5
700	D	24.6	Very low	29	Very low	163 Å²	163	115.4 Å²	115.4	87%	0.872	74%	0.743	S	S	*	*				109.5	144.7	127.7	-61.7	-12.9	0	0	0	122.3
701	L	27.4	Very low	28.9	Very low	163 Å²	163	118 Å²	118	85%	0.853	76%	0.761	S	S	*	*			trans	-125.6	-177.4	-164.6	-78	164	0	0	0	108.9
702	P	40.3	Very low	28.9	Very low	122 Å²	122	123.5 Å²	123.5	79%	0.792	78%	0.781	S	S	*	*			cis	-126.5	-174.6	-42.4	35.1	-19.2	0	0	0	111.3
703	G	24.1	Very low	28.5	Very low	79 Å²	79	127.1 Å²	127.1	81%	0.814	80%	0.799	S	S	*	*			trans	-178.9	104.7	165.5	0	0	0	0	0	112.8
704	E	26.7	Very low	28.4	Very low	176 Å²	176	130 Å²	130	82%	0.822	80%	0.802	S	S	*	*			trans	-97.7	154.9	-172.2	-80.7	-151.3	128.4	0	0	115.6
705	T	25.2	Very low	28.4	Very low	116 Å²	116	131.3 Å²	131.3	71%	0.712	80%	0.8	S	S	*	*			trans	45.5	126.8	148.6	57.9	0	0	0	0	121.1
706	Q	26.9	Very low	28.2	Very low	199 Å²	199	126.2 Å²	126.2	93%	0.93	77%	0.77	S	S	*	*				-156	160.2	106	-108	171.8	47.6	0	0	110.8
707	S	32	Very low	28.2	Very low	119 Å²	119	129 Å²	129	83%	0.832	77%	0.772	S	S	*	*			trans	-146.4	145.1	178.4	68.1	0	0	0	0	111.1
708	S	27.6	Very low	28.1	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	77%	0.769	S	S	*	*			trans	-151.9	113.1	173.9	46	0	0	0	0	113.4
709	S	26.3	Very low	28	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	77%	0.771	S	S	*	*			trans	35.2	121.4	140.8	61.4	0	0	0	0	121.9
710	A	26.6	Very low	28.4	Very low	104 Å²	104	129.2 Å²	129.2	86%	0.86	78%	0.777	S	S	*	*				-148.9	139.3	128.9	0	0	0	0	0	109.8
711	S	27.2	Very low	29	Very low	125 Å²	125	127.3 Å²	127.3	87%	0.874	77%	0.772	S	S	*	*			trans	-94.8	161.7	-168.4	-55.5	0	0	0	0	114.4
712	Q	33.5	Very low	29.6	Very low	174 Å²	174	128.9 Å²	128.9	81%	0.813	78%	0.775	S	S	*	*			trans	-86.8	164.9	173.1	-63.4	-178.5	-6.5	0	0	112.8
713	V	26.2	Very low	29.7	Very low	152 Å²	152	130.4 Å²	130.4	92%	0.921	77%	0.769	S	S	*	*			trans	-130.9	141.1	153.9	178.7	0	0	0	0	107.5
714	E	28.8	Very low	30.9	Very low	161 Å²	161	129.7 Å²	129.7	75%	0.752	75%	0.751	S	S	*	*			trans	-99.8	140.9	-163.3	-81.5	-164.3	102	0	0	116.5
715	S	26.9	Very low	31.8	Very low	94 Å²	94	124.4 Å²	124.4	66%	0.657	74%	0.738	S	S	*	*			trans	69	171.9	143.9	93.4	0	0	0	0	117.9
716	S	26.6	Very low	32.3	Very low	30 Å²	30	125.1 Å²	125.1	21%	0.21	73%	0.731	C	S	.	*			cis	-149	157	-10	12.4	0	0	0	0	112.6	T1131	S716-T1131 VanDerWaalsContact O-CG2 3.24Å; S716-T1131 WeakPolarHBondContact O-CG2 3.27Å; S716-T1131 WeakPolarHBondContact OG-CG2 3.4Å
717	Q	28.8	Very low	33.2	Very low	161 Å²	161	120.3 Å²	120.3	75%	0.752	71%	0.709	S	S	*	*			trans	39.8	122	144.3	-57.5	179.1	17.7	0	0	121.5
718	T	27	Very low	33.8	Very low	118 Å²	118	120.4 Å²	120.4	72%	0.724	70%	0.697	S	S	*	*			trans	-124.6	149	142.7	56.1	0	0	0	0	110	T1129	T718-T1129 HydrophobicContact CG2-CG2 4.03Å
719	S	27.2	Very low	35	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-63.9	151.8	-166.8	54	0	0	0	0	116	T721	S719-T721 PolarHBondContact O-N 3.4Å
720	P	37.5	Very low	36	Very low	125 Å²	125	115.7 Å²	115.7	81%	0.812	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-73.7	121.8	178.6	30.3	-34.6	0	0	0	112.4
721	T	35.8	Very low	36.9	Very low	124 Å²	124	114 Å²	114	76%	0.761	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-69.2	131.6	170	49.8	0	0	0	0	111.4	S719 K723	S719-T721 PolarHBondContact O-N 3.4Å; T721-K723 PolarHBondContact O-N 3.14Å
722	E	40	Very low	37.8	Very low	196 Å²	196	112.5 Å²	112.5	92%	0.916	63%	0.626	S	S	*	*			trans	-59.2	107.1	176.8	-66.5	-167.6	141.8	0	0	112.1	S724	E722-S724 PolarHBondContact O-N 3.28Å
723	K	42.8	Very low	38.8	Very low	154 Å²	154	106.6 Å²	106.6	67%	0.67	60%	0.6	S	S	*	*			trans	-66.2	116.4	171.2	-67.9	172.5	-175.9	168.2	0	108.3	T721 Q728	T721-K723 PolarHBondContact O-N 3.14Å; K723-Q728 HydrophobicContact CB-CG 4.48Å
724	S	48.4	Very low	40.2	Very low	63 Å²	63	105.9 Å²	105.9	44%	0.441	59%	0.586	S	S	.	*			trans	-50	142.2	-176.9	-175.5	0	0	0	0	111.7	E722 F726 E727 Q728	E722-S724 PolarHBondContact O-N 3.28Å; S724-F726 PolarHBondContact O-N 3.07Å; S724-F726 PolarHBondContact OG-N 3.08Å; S724-E727 CarbonylContact O-C 3.59Å; S724-E727 WeakPolarHBondContact O-CA 3.33Å; S724-E727 WeakPolarHBondContact O-CB 3.46Å; S724-E727 PolarHBondContact O-N 3.12Å; S724-Q728 PolarHBondContact O-N 3.1Å
725	A	45.7	Very low	42	Very low	66 Å²	66	102.3 Å²	102.3	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-54.5	-27.2	173.8	0	0	0	0	0	112.9	V729	A725-V729 WeakPolarHBondContact O-CB 3.44Å; A725-V729 VanDerWaalsContact O-CG2 3.26Å; A725-V729 WeakPolarHBondContact O-CG2 3.27Å; A725-V729 PolarHBondContact O-N 3.17Å
726	F	35.8	Very low	44	Very low	130 Å²	130	100.2 Å²	100.2	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-66.4	-37.8	170.6	178.1	-96	0	0	0	112.6	S724 F730	S724-F726 PolarHBondContact O-N 3.07Å; S724-F726 PolarHBondContact OG-N 3.08Å; F726-F730 WeakPolarHBondContact O-CB 3.46Å; F726-F730 PolarHBondContact O-N 2.79Å
727	E	46.3	Very low	46.1	Very low	98 Å²	98	106.3 Å²	106.3	46%	0.458	57%	0.57	S	S	.	*	H	α-helix	trans	-79.2	-30.8	-179.3	-165.6	154.4	-127.4	0	0	112.4	S724 S731	S724-E727 CarbonylContact O-C 3.59Å; S724-E727 WeakPolarHBondContact O-CA 3.33Å; S724-E727 WeakPolarHBondContact O-CB 3.46Å; S724-E727 PolarHBondContact O-N 3.12Å; E727-S731 VanDerWaalsContact O-CB 3.27Å; E727-S731 WeakPolarHBondContact O-CB 3.42Å; E727-S731 PolarHBondContact O-N 2.77Å; E727-S731 PolarHBondContact O-OG 3.08Å
728	Q	45.4	Very low	48.3	Very low	122 Å²	122	98.7 Å²	98.7	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-63.2	-51.5	164.9	-68.4	176	-25.4	0	0	111	K723 S724 F730 S731 S732	K723-Q728 HydrophobicContact CB-CG 4.48Å; S724-Q728 PolarHBondContact O-N 3.1Å; Q728-F730 VanDerWaalsContact C-N 3.34Å; Q728-F730 PolarHBondContact O-N 2.91Å; Q728-S731 CarbonylContact O-C 3.4Å; Q728-S731 WeakPolarHBondContact O-CA 3.31Å; Q728-S731 WeakPolarHBondContact O-CB 3.45Å; Q728-S731 PolarHBondContact O-N 3.13Å; Q728-S732 PolarHBondContact O-N 2.94Å
729	V	51.5	Low	50.7	Low	88 Å²	88	97 Å²	97	53%	0.533	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-36.1	177.1	169.4	0	0	0	0	112.4	A725 S731 S732 L733	A725-V729 WeakPolarHBondContact O-CB 3.44Å; A725-V729 VanDerWaalsContact O-CG2 3.26Å; A725-V729 WeakPolarHBondContact O-CG2 3.27Å; A725-V729 PolarHBondContact O-N 3.17Å; V729-S731 PolarHBondContact O-N 3.15Å; V729-S732 WeakPolarHBondContact CA-OG 3.3Å; V729-S732 PolarHBondContact O-N 2.97Å; V729-S732 PolarHBondContact O-OG 3.06Å; V729-L733 PolarHBondContact O-N 3.23Å
730	F	47.7	Very low	53.2	Low	38 Å²	38	93.6 Å²	93.6	17%	0.167	49%	0.494	C	S	.	.	H	α-helix	trans	-68.2	-18.5	171.8	-177.4	-91.7	0	0	0	112.4	L497 Y538 L540 F726 Q728 K735	L497-F730 HydrophobicContact CD1-CE2 3.71Å; L497-F730 HydrophobicContact CD1-CZ 3.49Å; L497-F730 VanDerWaalsContact CD1-CZ 3.49Å; Y538-F730 HydrophobicContact CE2-CE1 4.28Å; Y538-F730 AromaticContact CE2-CZ 3.94Å; Y538-F730 HydrophobicContact CE2-CZ 3.94Å; L540-F730 HydrophobicContact CD1-CD2 4.42Å; L540-F730 HydrophobicContact CD1-CE2 3.88Å; F726-F730 WeakPolarHBondContact O-CB 3.46Å; F726-F730 PolarHBondContact O-N 2.79Å; Q728-F730 VanDerWaalsContact C-N 3.34Å; Q728-F730 PolarHBondContact O-N 2.91Å; F730-K735 WeakPolarHBondContact O-CE 3.31Å
731	S	46.9	Very low	55	Low	68 Å²	68	92.8 Å²	92.8	48%	0.476	48%	0.479	S	S	.	.	H	α-helix	trans	-94.4	-19.6	174.7	-60.3	0	0	0	0	114.5	E727 Q728 V729 K735	E727-S731 VanDerWaalsContact O-CB 3.27Å; E727-S731 WeakPolarHBondContact O-CB 3.42Å; E727-S731 PolarHBondContact O-N 2.77Å; E727-S731 PolarHBondContact O-OG 3.08Å; Q728-S731 CarbonylContact O-C 3.4Å; Q728-S731 WeakPolarHBondContact O-CA 3.31Å; Q728-S731 WeakPolarHBondContact O-CB 3.45Å; Q728-S731 PolarHBondContact O-N 3.13Å; V729-S731 PolarHBondContact O-N 3.15Å; S731-K735 PolarHBondContact OG-NZ 3.26Å
732	S	44.4	Very low	56.8	Low	95 Å²	95	87.9 Å²	87.9	66%	0.664	45%	0.449	S	S	*	.	H	α-helix	trans	-86.5	-8.9	170.7	66.2	0	0	0	0	114.1	Q728 V729	Q728-S732 PolarHBondContact O-N 2.94Å; V729-S732 WeakPolarHBondContact CA-OG 3.3Å; V729-S732 PolarHBondContact O-N 2.97Å; V729-S732 PolarHBondContact O-OG 3.06Å
733	L	55	Low	58.5	Low	50 Å²	50	79.3 Å²	79.3	26%	0.262	41%	0.409	S	S	.	.	S	Bend	trans	-72	136.1	164.1	-70.9	175.2	0	0	0	110.4	L540 V729 K735	L540-L733 HydrophobicContact CD1-CD1 4.15Å; L540-L733 HydrophobicContact CD2-CB 4.11Å; L540-L733 HydrophobicContact CD2-CD1 4.46Å; V729-L733 PolarHBondContact O-N 3.23Å; L733-K735 PolarHBondContact O-N 2.92Å; L733-K735 VanDerWaalsContact O-N 3.12Å
734	Q	55.8	Low	60.2	Low	136 Å²	136	77.1 Å²	77.1	64%	0.636	40%	0.401	S	S	*	.			trans	-61	115	172.7	-73.2	177.1	-20.5	0	0	110.3	I541	I541-Q734 PolarHBondContact N-O 3.27Å
735	K	67.3	Low	61.3	Low	86 Å²	86	79.4 Å²	79.4	37%	0.374	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	95.3	175.6	-63.2	166.2	-167.8	163	0	108.3	Y538 L540 F730 S731 L733	Y538-K735 HydrophobicContact CD2-CB 4.05Å; Y538-K735 HydrophobicContact CD2-CD 4.42Å; Y538-K735 HydrophobicContact CD2-CG 3.99Å; Y538-K735 HydrophobicContact CE2-CD 4.28Å; Y538-K735 HydrophobicContact CE2-CG 4.18Å; Y538-K735 HydrophobicContact CG-CB 4.38Å; L540-K735 HydrophobicContact CD2-CG 3.92Å; F730-K735 WeakPolarHBondContact O-CE 3.31Å; S731-K735 PolarHBondContact OG-NZ 3.26Å; L733-K735 PolarHBondContact O-N 2.92Å; L733-K735 VanDerWaalsContact O-N 3.12Å
736	T	68.8	Low	62.6	Low	51 Å²	51	76.6 Å²	76.6	31%	0.313	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133	174.3	-45.7	0	0	0	0	109	Y538 Y539	Y538-T736 CarbonylContact C-O 3.45Å; Y538-T736 WeakPolarHBondContact CA-O 3.49Å; Y538-T736 VanDerWaalsContact CB-O 3.24Å; Y538-T736 WeakPolarHBondContact CB-O 3.27Å; Y539-T736 HydrophobicContact CE1-CG2 3.92Å; Y539-T736 HydrophobicContact CE2-CG2 4.46Å; Y539-T736 VanDerWaalsContact CZ-CB 3.45Å; Y539-T736 PolarHBondContact N-O 2.99Å; Y539-T736 PolarHBondContact O-N 3.04Å; Y539-T736 VanDerWaalsContact O-N 3.15Å; Y539-T736 WeakPolarHBondContact OH-CG2 3.39Å
737	R	69.6	Low	64.4	Low	158 Å²	158	73.4 Å²	73.4	60%	0.596	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	152.1	175.5	-62.9	-178	77.5	153.4	2	110.1	N535 Y539	N535-R737 PolarHBondContact O-NE 3.16Å; N535-R737 VanDerWaalsContact O-NE 3.15Å; N535-R737 PolarHBondContact O-NH2 2.87Å; Y539-R737 WeakPolarHBondContact CE1-O 3.49Å
738	L	75.9	Confident	65.6	Low	1 Å²	1	76.6 Å²	76.6	1%	0.005	37%	0.372	C	S	.	.			trans	-108.9	98.6	179.3	179.9	66.1	0	0	0	110	Y498 I534 S537 Y539 T742 Y743 L746	Y498-L738 HydrophobicContact CD1-CD2 4.43Å; Y498-L738 HydrophobicContact CE1-CD2 3.69Å; I534-L738 CarbonylContact C-O 3.6Å; I534-L738 VanDerWaalsContact C-O 3.29Å; I534-L738 HydrophobicContact CG2-CD2 4.44Å; I534-L738 HydrophobicContact CG2-CG 4.28Å; I534-L738 WeakPolarHBondContact CG2-O 3.4Å; S537-L738 PolarHBondContact O-N 3.19Å; Y539-L738 HydrophobicContact CD1-CB 4.41Å; Y539-L738 HydrophobicContact CD1-CD1 4.3Å; L738-T742 HydrophobicContact CD1-CG2 3.99Å; L738-Y743 HydrophobicContact CD2-CD2 4.45Å; L738-L746 HydrophobicContact CD1-CD1 4.06Å
739	D	76.8	Confident	66.5	Low	83 Å²	83	73.3 Å²	73.3	44%	0.444	36%	0.358	S	S	.	.			trans	-72.1	149.3	177	-41.8	-63.8	0	0	0	111.2	E741 T742 Y743	D739-E741 PolarHBondContact O-N 3Å; D739-T742 WeakPolarHBondContact O-CB 3.2Å; D739-T742 PolarHBondContact O-N 3.37Å; D739-Y743 PolarHBondContact O-N 2.81Å
740	M	80.6	Confident	67.1	Low	33 Å²	33	69.5 Å²	69.5	16%	0.163	33%	0.334	C	S	.	.	H	α-helix	trans	-54.2	-37.9	177.3	-174.5	59	169.1	0	0	112.7	I531 I534 N535 Y743 Q744	I531-M740 HydrophobicContact CG1-CE 3.96Å; I531-M740 HydrophobicContact CG1-CG 4.29Å; I531-M740 HydrophobicContact CG1-SD 4.33Å; I531-M740 HydrophobicContact CG2-CB 4.46Å; I534-M740 HydrophobicContact CB-SD 4.47Å; I534-M740 HydrophobicContact CD1-CE 4.46Å; I534-M740 HydrophobicContact CD1-SD 3.58Å; I534-M740 VanDerWaalsContact CD1-SD 3.58Å; I534-M740 HydrophobicContact CG2-CB 4.41Å; I534-M740 HydrophobicContact CG2-SD 4.28Å; N535-M740 PolarHBondContact OD1-N 2.78Å; M740-Y743 HydrophobicContact CE-CD1 4.42Å; M740-Y743 HydrophobicContact CE-CE1 4.38Å; M740-Y743 PolarHBondContact O-N 3.16Å; M740-Y743 HydrophobicContact SD-CD1 3.65Å; M740-Y743 HydrophobicContact SD-CE1 4.1Å; M740-Q744 WeakPolarHBondContact O-CG 3.19Å; M740-Q744 PolarHBondContact O-N 2.91Å
741	E	75.3	Confident	68.3	Low	108 Å²	108	67.7 Å²	67.7	51%	0.505	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-43.4	176.5	-151.4	-149.7	155.9	0	0	111.9	D739 Y743 Q744 R745	D739-E741 PolarHBondContact O-N 3Å; E741-Y743 VanDerWaalsContact C-N 3.33Å; E741-Y743 PolarHBondContact O-N 3.27Å; E741-Q744 PolarHBondContact O-N 2.75Å; E741-R745 WeakPolarHBondContact O-CB 3.33Å; E741-R745 WeakPolarHBondContact O-CG 3.41Å; E741-R745 PolarHBondContact O-N 3.08Å; E741-R745 IonicContact OE1-CZ 3.01Å; E741-R745 IonicContact OE1-NE 2.66Å; E741-R745 PolarHBondContact OE1-NE 3Å; E741-R745 IonicContact OE1-NH2 3.6Å; E741-R745 PolarHBondContact OE1-NH2 3.05Å; E741-R745 IonicContact OE2-CZ 2.77Å; E741-R745 VanDerWaalsContact OE2-CZ 3.27Å; E741-R745 IonicContact OE2-NE 3.18Å; E741-R745 IonicContact OE2-NH2 3.44Å; E741-R745 PolarHBondContact OE2-NH2 3.16Å
742	T	73.3	Confident	69.6	Low	21 Å²	21	67.9 Å²	67.9	13%	0.129	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-44.1	174	-64.6	0	0	0	0	110.8	L476 L738 D739 R745 L746	L476-T742 HydrophobicContact CD2-CG2 4.09Å; L738-T742 HydrophobicContact CD1-CG2 3.99Å; D739-T742 WeakPolarHBondContact O-CB 3.2Å; D739-T742 PolarHBondContact O-N 3.37Å; T742-R745 PolarHBondContact O-N 3.25Å; T742-L746 HydrophobicContact CG2-CD1 4.5Å; T742-L746 WeakPolarHBondContact O-CB 3.29Å; T742-L746 VanDerWaalsContact O-CG 3.25Å; T742-L746 WeakPolarHBondContact O-CG 3.26Å; T742-L746 PolarHBondContact O-N 3.07Å
743	Y	76.4	Confident	71.1	Confident	16 Å²	16	66.1 Å²	66.1	6%	0.063	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-44.3	174	164.5	-99.7	0	0	0	113	Y498 S510 F530 I534 L738 D739 M740 E741 L746 R747	Y498-Y743 HydrophobicContact CE1-CD2 4.3Å; Y498-Y743 HydrophobicContact CE1-CE2 4.31Å; S510-Y743 PolarHBondContact OG-OH 2.86Å; F530-Y743 HydrophobicContact CE1-CE1 4.27Å; I534-Y743 HydrophobicContact CD1-CD1 3.71Å; I534-Y743 HydrophobicContact CD1-CD2 4.43Å; I534-Y743 HydrophobicContact CD1-CE1 3.6Å; I534-Y743 HydrophobicContact CD1-CE2 4.36Å; I534-Y743 HydrophobicContact CD1-CG 4.1Å; I534-Y743 HydrophobicContact CG2-CG 4.35Å; L738-Y743 HydrophobicContact CD2-CD2 4.45Å; D739-Y743 PolarHBondContact O-N 2.81Å; M740-Y743 HydrophobicContact CE-CD1 4.42Å; M740-Y743 HydrophobicContact CE-CE1 4.38Å; M740-Y743 PolarHBondContact O-N 3.16Å; M740-Y743 HydrophobicContact SD-CD1 3.65Å; M740-Y743 HydrophobicContact SD-CE1 4.1Å; E741-Y743 VanDerWaalsContact C-N 3.33Å; E741-Y743 PolarHBondContact O-N 3.27Å; Y743-L746 PolarHBondContact O-N 3.34Å; Y743-R747 PolarHBondContact O-N 3.44Å; Y743-R747 PolarHBondContact OH-NH1 3.39Å
744	Q	76.8	Confident	72.3	Confident	108 Å²	108	64 Å²	64	51%	0.505	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-45.8	174.4	-72	179.3	15.5	0	0	112	M740 E741 L746 R747 K748	M740-Q744 WeakPolarHBondContact O-CG 3.19Å; M740-Q744 PolarHBondContact O-N 2.91Å; E741-Q744 PolarHBondContact O-N 2.75Å; Q744-L746 PolarHBondContact O-N 2.77Å; Q744-R747 PolarHBondContact O-N 2.96Å; Q744-K748 WeakPolarHBondContact O-CB 3.31Å; Q744-K748 PolarHBondContact O-N 2.83Å
745	R	72.1	Confident	73.5	Confident	112 Å²	112	57.5 Å²	57.5	42%	0.423	26%	0.263	S	S	.	.	H	α-helix	trans	-58.5	-44	175.7	-69.3	165.3	178.4	-175.1	-1	111.4	L475 E741 T742 R747 K748 I749	L475-R745 HydrophobicContact CD1-CB 3.9Å; E741-R745 WeakPolarHBondContact O-CB 3.33Å; E741-R745 WeakPolarHBondContact O-CG 3.41Å; E741-R745 PolarHBondContact O-N 3.08Å; E741-R745 IonicContact OE1-CZ 3.01Å; E741-R745 IonicContact OE1-NE 2.66Å; E741-R745 PolarHBondContact OE1-NE 3Å; E741-R745 IonicContact OE1-NH2 3.6Å; E741-R745 PolarHBondContact OE1-NH2 3.05Å; E741-R745 IonicContact OE2-CZ 2.77Å; E741-R745 VanDerWaalsContact OE2-CZ 3.27Å; E741-R745 IonicContact OE2-NE 3.18Å; E741-R745 IonicContact OE2-NH2 3.44Å; E741-R745 PolarHBondContact OE2-NH2 3.16Å; T742-R745 PolarHBondContact O-N 3.25Å; R745-R747 PolarHBondContact O-N 2.85Å; R745-K748 PolarHBondContact O-N 3.18Å; R745-I749 WeakPolarHBondContact O-CD1 3.48Å; R745-I749 VanDerWaalsContact O-CG1 3.31Å; R745-I749 WeakPolarHBondContact O-CG1 3.23Å; R745-I749 PolarHBondContact O-N 3Å; R745-I749 VanDerWaalsContact O-N 3.17Å
746	L	72.9	Confident	73.9	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-45.9	174.8	-73.2	177.7	0	0	0	111.8	L476 F496 L738 T742 Y743 Q744 I749 Y750	L476-L746 HydrophobicContact CD1-CD1 4.19Å; L476-L746 HydrophobicContact CD1-CD2 3.83Å; L476-L746 HydrophobicContact CD2-CD1 4.1Å; L476-L746 HydrophobicContact CD2-CD2 4.13Å; L476-L746 HydrophobicContact CD2-CG 4.5Å; L476-L746 HydrophobicContact CG-CD2 4.01Å; F496-L746 HydrophobicContact CE1-CD1 3.56Å; F496-L746 HydrophobicContact CZ-CD1 3.93Å; L738-L746 HydrophobicContact CD1-CD1 4.06Å; T742-L746 HydrophobicContact CG2-CD1 4.5Å; T742-L746 WeakPolarHBondContact O-CB 3.29Å; T742-L746 VanDerWaalsContact O-CG 3.25Å; T742-L746 WeakPolarHBondContact O-CG 3.26Å; T742-L746 PolarHBondContact O-N 3.07Å; Y743-L746 PolarHBondContact O-N 3.34Å; Q744-L746 PolarHBondContact O-N 2.77Å; L746-I749 PolarHBondContact O-N 2.87Å; L746-Y750 HydrophobicContact CB-CD2 4.39Å; L746-Y750 HydrophobicContact CD2-CD2 3.84Å; L746-Y750 HydrophobicContact CD2-CE2 3.63Å; L746-Y750 VanDerWaalsContact O-CD2 3.28Å; L746-Y750 WeakPolarHBondContact O-CD2 3.44Å; L746-Y750 PolarHBondContact O-N 3.08Å
747	R	74.4	Confident	74.1	Confident	64 Å²	64	59.2 Å²	59.2	24%	0.242	27%	0.266	C	S	.	.	H	α-helix	trans	-61.8	-47.1	179.8	-158.9	160.8	-170.8	151.9	-0.6	110.9	Y743 Q744 R745 I749 G751 D752	Y743-R747 PolarHBondContact O-N 3.44Å; Y743-R747 PolarHBondContact OH-NH1 3.39Å; Q744-R747 PolarHBondContact O-N 2.96Å; R745-R747 PolarHBondContact O-N 2.85Å; R747-I749 PolarHBondContact O-N 3.24Å; R747-G751 CarbonylContact O-C 3.55Å; R747-G751 WeakPolarHBondContact O-CA 3.41Å; R747-G751 PolarHBondContact O-N 3.33Å; R747-D752 HydrophobicContact CG-CB 4.33Å; R747-D752 VanDerWaalsContact CZ-O 3.31Å; R747-D752 PolarHBondContact NE-O 2.91Å; R747-D752 PolarHBondContact NH2-O 3.08Å
748	K	70.8	Confident	74.1	Confident	164 Å²	164	53.3 Å²	53.3	71%	0.713	25%	0.248	S	C	*	.	H	α-helix	trans	-64	-14.1	176.7	-168.8	173.6	-179.1	178.5	0	115.2	Q744 R745 W763	Q744-K748 WeakPolarHBondContact O-CB 3.31Å; Q744-K748 PolarHBondContact O-N 2.83Å; R745-K748 PolarHBondContact O-N 3.18Å; K748-W763 WeakPolarHBondContact O-CH2 3.12Å; K748-W763 VanDerWaalsContact O-CZ2 3.25Å; K748-W763 WeakPolarHBondContact O-CZ2 3.26Å
749	I	64	Low	73.9	Confident	54 Å²	54	54.1 Å²	54.1	28%	0.277	26%	0.256	S	S	.	.	H	α-helix	trans	-111.4	-38.2	-179.1	-66.8	167.5	0	0	0	112.2	L475 M484 R745 L746 R747 W763	L475-I749 HydrophobicContact CD1-CD1 3.61Å; L475-I749 HydrophobicContact CG-CD1 4.45Å; M484-I749 HydrophobicContact CE-CG2 3.78Å; M484-I749 HydrophobicContact SD-CG2 4.18Å; R745-I749 WeakPolarHBondContact O-CD1 3.48Å; R745-I749 VanDerWaalsContact O-CG1 3.31Å; R745-I749 WeakPolarHBondContact O-CG1 3.23Å; R745-I749 PolarHBondContact O-N 3Å; R745-I749 VanDerWaalsContact O-N 3.17Å; L746-I749 PolarHBondContact O-N 2.87Å; R747-I749 PolarHBondContact O-N 3.24Å; I749-W763 WeakPolarHBondContact O-CZ2 3.38Å; I749-W763 PolarHBondContact O-NE1 3.29Å
750	Y	64.6	Low	73.7	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-103.7	-11.3	-174.7	-57.1	-67.5	0	0	0	114.2	M484 L487 T488 V491 L746	M484-Y750 HydrophobicContact SD-CE1 4.23Å; L487-Y750 HydrophobicContact CD2-CE1 4.19Å; L487-Y750 VanDerWaalsContact CD2-OH 3.27Å; L487-Y750 WeakPolarHBondContact CD2-OH 3.41Å; L487-Y750 HydrophobicContact CG-CE1 4.02Å; T488-Y750 HydrophobicContact CG2-CD1 4.32Å; V491-Y750 HydrophobicContact CB-CE1 4.32Å; V491-Y750 HydrophobicContact CG1-CD2 4.28Å; V491-Y750 HydrophobicContact CG1-CE2 4.32Å; V491-Y750 HydrophobicContact CG1-CG 4.43Å; V491-Y750 HydrophobicContact CG2-CE1 3.85Å; V491-Y750 HydrophobicContact CG2-CE2 4.18Å; L746-Y750 HydrophobicContact CB-CD2 4.39Å; L746-Y750 HydrophobicContact CD2-CD2 3.84Å; L746-Y750 HydrophobicContact CD2-CE2 3.63Å; L746-Y750 VanDerWaalsContact O-CD2 3.28Å; L746-Y750 WeakPolarHBondContact O-CD2 3.44Å; L746-Y750 PolarHBondContact O-N 3.08Å
751	G	72.9	Confident	73.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.254	C	S	.	.			trans	113.7	141	163.1	0	0	0	0	0	114.5	R747 L753 L761 F762 W763	R747-G751 CarbonylContact O-C 3.55Å; R747-G751 WeakPolarHBondContact O-CA 3.41Å; R747-G751 PolarHBondContact O-N 3.33Å; G751-L753 VanDerWaalsContact C-N 3.32Å; G751-L753 PolarHBondContact O-N 3.35Å; G751-L753 VanDerWaalsContact O-N 3.17Å; G751-L761 WeakPolarHBondContact O-CB 3.29Å; G751-L761 WeakPolarHBondContact O-CD2 3.26Å; G751-F762 CarbonylContact C-O 3.34Å; G751-W763 VanDerWaalsContact CA-CD2 3.47Å
752	D	73.8	Confident	73.6	Confident	73 Å²	73	50.6 Å²	50.6	39%	0.39	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-74.3	-12.2	-158.9	-47.5	-72.6	0	0	0	116.4	R747 F762	R747-D752 HydrophobicContact CG-CB 4.33Å; R747-D752 VanDerWaalsContact CZ-O 3.31Å; R747-D752 PolarHBondContact NE-O 2.91Å; R747-D752 PolarHBondContact NH2-O 3.08Å; D752-F762 PolarHBondContact N-O 2.97Å
753	L	76.8	Confident	73.4	Confident	57 Å²	57	55.4 Å²	55.4	30%	0.298	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	99.8	-175.8	-53.2	174.8	0	0	0	111.1	G751 F762 K765 Y768	G751-L753 VanDerWaalsContact C-N 3.32Å; G751-L753 PolarHBondContact O-N 3.35Å; G751-L753 VanDerWaalsContact O-N 3.17Å; L753-F762 HydrophobicContact CB-CB 4.36Å; L753-F762 VanDerWaalsContact CB-O 3.28Å; L753-F762 WeakPolarHBondContact CB-O 3.49Å; L753-F762 PolarHBondContact N-O 3.21Å; L753-F762 PolarHBondContact O-N 2.91Å; L753-K765 VanDerWaalsContact CD1-CA 3.49Å; L753-K765 HydrophobicContact CD1-CB 3.9Å; L753-K765 HydrophobicContact CD1-CG 4.45Å; L753-Y768 HydrophobicContact CB-CD2 3.71Å; L753-Y768 HydrophobicContact CB-CE2 4.28Å; L753-Y768 HydrophobicContact CB-CG 4.04Å; L753-Y768 HydrophobicContact CD1-CG 4.31Å
754	E	80.5	Confident	73.2	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.028	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128	178.2	-159	-169.9	120.1	0	0	112.6	S509 S510 Q756 G759 K760 L761 Y768	S509-E754 WeakPolarHBondContact CA-OE1 3.36Å; S509-E754 WeakPolarHBondContact CB-OE1 3.41Å; S509-E754 PolarHBondContact OG-OE1 3.15Å; S510-E754 WeakPolarHBondContact CB-OE2 3.35Å; S510-E754 PolarHBondContact N-OE1 2.96Å; S510-E754 VanDerWaalsContact OG-CD 3.28Å; S510-E754 PolarHBondContact OG-OE2 2.96Å; E754-Q756 PolarHBondContact O-N 3.47Å; E754-Q756 VanDerWaalsContact O-N 3.14Å; E754-G759 WeakPolarHBondContact OE1-CA 3.49Å; E754-K760 WeakPolarHBondContact CA-O 3.26Å; E754-L761 HydrophobicContact CB-CD2 3.84Å; E754-L761 HydrophobicContact CG-CD2 3.86Å; E754-Y768 WeakPolarHBondContact O-CE2 3.35Å
755	C	80.2	Confident	73	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	100	175.7	179.3	0	0	0	0	111.8	Y757 C758 G759 K760 F762 Y768 H771	C755-Y757 PolarHBondContact O-N 3.47Å; C755-C758 CarbonylContact O-C 3.6Å; C755-C758 PolarHBondContact O-N 2.95Å; C755-G759 PolarHBondContact O-N 2.8Å; C755-K760 HydrophobicContact CB-CB 4.32Å; C755-K760 PolarHBondContact N-O 2.77Å; C755-F762 HydrophobicContact CB-CE2 4.23Å; C755-Y768 HydrophobicContact CB-CE2 4.45Å; C755-H771 VanDerWaalsContact SG-CD2 3.53Å
756	Q	76.6	Confident	73.1	Confident	78 Å²	78	63.2 Å²	63.2	36%	0.364	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-36.5	-40.3	175.5	-167.6	-172.7	34.9	0	0	114.7	S509 Q511 R512 E754 C758	S509-Q756 VanDerWaalsContact CB-O 3.26Å; S509-Q756 WeakPolarHBondContact CB-O 3.19Å; S509-Q756 WeakPolarHBondContact OG-CA 3.47Å; Q511-Q756 HydrophobicContact CB-CB 4.22Å; Q511-Q756 HydrophobicContact CB-CG 4.26Å; Q511-Q756 HydrophobicContact CG-CB 4.22Å; Q511-Q756 HydrophobicContact CG-CG 4.19Å; R512-Q756 HydrophobicContact CG-CG 3.7Å; R512-Q756 PolarHBondContact NH1-O 2.96Å; E754-Q756 PolarHBondContact O-N 3.47Å; E754-Q756 VanDerWaalsContact O-N 3.14Å; Q756-C758 PolarHBondContact O-N 2.96Å
757	Y	72	Confident	73	Confident	95 Å²	95	68.4 Å²	68.4	37%	0.373	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.6	-179.7	-64.8	-79.5	0	0	0	115.2	R512 C755 V772 H775 T776	R512-Y757 VanDerWaalsContact NH1-C 3.32Å; R512-Y757 PolarHBondContact NH1-O 3.33Å; C755-Y757 PolarHBondContact O-N 3.47Å; Y757-V772 HydrophobicContact CE2-CG1 4.15Å; Y757-H775 HydrophobicContact CD1-CB 4.01Å; Y757-H775 HydrophobicContact CD2-CB 3.78Å; Y757-H775 AromaticContact CD2-CD2 3.97Å; Y757-H775 HydrophobicContact CE1-CB 4.48Å; Y757-H775 HydrophobicContact CE2-CB 4.29Å; Y757-H775 HydrophobicContact CG-CB 3.64Å; Y757-H775 AromaticContact CG-CD2 3.95Å; Y757-H775 AromaticContact CG-CG 3.75Å; Y757-T776 HydrophobicContact CE2-CG2 4.06Å
758	C	70.6	Confident	73.2	Confident	34 Å²	34	68 Å²	68	23%	0.23	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-157	27.8	-172.2	75.2	0	0	0	0	116.2	C755 Q756 K760 H771 H775	C755-C758 CarbonylContact O-C 3.6Å; C755-C758 PolarHBondContact O-N 2.95Å; Q756-C758 PolarHBondContact O-N 2.96Å; C758-K760 VanDerWaalsContact C-N 3.27Å; C758-K760 PolarHBondContact O-N 3.03Å; C758-K760 VanDerWaalsContact O-N 3.1Å; C758-H771 PolarHBondContact SG-NE2 2.92Å; C758-H775 PolarHBondContact SG-NE2 2.93Å; C758-H775 VanDerWaalsContact SG-NE2 3.38Å
759	G	70.6	Confident	73.4	Confident	17 Å²	17	63 Å²	63	18%	0.175	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	16.9	168	0	0	0	0	0	116.7	V508 E754 C755	V508-G759 WeakPolarHBondContact O-CA 3.41Å; V508-G759 PolarHBondContact O-N 2.75Å; E754-G759 WeakPolarHBondContact OE1-CA 3.49Å; C755-G759 PolarHBondContact O-N 2.8Å
760	K	73.6	Confident	73.9	Confident	90 Å²	90	63.8 Å²	63.8	39%	0.391	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	122.2	-174.6	-75.9	176.4	-171.8	163.2	0	112.1	E754 C755 C758 F762	E754-K760 WeakPolarHBondContact CA-O 3.26Å; C755-K760 HydrophobicContact CB-CB 4.32Å; C755-K760 PolarHBondContact N-O 2.77Å; C758-K760 VanDerWaalsContact C-N 3.27Å; C758-K760 PolarHBondContact O-N 3.03Å; C758-K760 VanDerWaalsContact O-N 3.1Å; K760-F762 HydrophobicContact CB-CD2 4.48Å; K760-F762 HydrophobicContact CB-CE2 3.63Å; K760-F762 HydrophobicContact CB-CZ 4.19Å; K760-F762 WeakPolarHBondContact O-CD2 3.38Å; K760-F762 VanDerWaalsContact O-CE2 3.3Å; K760-F762 WeakPolarHBondContact O-CE2 3.37Å
761	L	76.6	Confident	74.5	Confident	32 Å²	32	64.9 Å²	64.9	17%	0.168	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	143.3	175.1	-62.6	175.4	0	0	0	112.6	G751 E754	G751-L761 WeakPolarHBondContact O-CB 3.29Å; G751-L761 WeakPolarHBondContact O-CD2 3.26Å; E754-L761 HydrophobicContact CB-CD2 3.84Å; E754-L761 HydrophobicContact CG-CD2 3.86Å
762	F	75.6	Confident	74.8	Confident	28 Å²	28	65.9 Å²	65.9	12%	0.123	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	134.1	178.7	-65.1	-93.7	0	0	0	111.4	G751 D752 L753 C755 K760 H767 Y768 H771	G751-F762 CarbonylContact C-O 3.34Å; D752-F762 PolarHBondContact N-O 2.97Å; L753-F762 HydrophobicContact CB-CB 4.36Å; L753-F762 VanDerWaalsContact CB-O 3.28Å; L753-F762 WeakPolarHBondContact CB-O 3.49Å; L753-F762 PolarHBondContact N-O 3.21Å; L753-F762 PolarHBondContact O-N 2.91Å; C755-F762 HydrophobicContact CB-CE2 4.23Å; K760-F762 HydrophobicContact CB-CD2 4.48Å; K760-F762 HydrophobicContact CB-CE2 3.63Å; K760-F762 HydrophobicContact CB-CZ 4.19Å; K760-F762 WeakPolarHBondContact O-CD2 3.38Å; K760-F762 VanDerWaalsContact O-CE2 3.3Å; K760-F762 WeakPolarHBondContact O-CE2 3.37Å; F762-H767 HydrophobicContact CD1-CB 3.91Å; F762-H767 HydrophobicContact CE1-CB 4.45Å; F762-Y768 HydrophobicContact CD2-CD2 4.22Å; F762-H771 HydrophobicContact CE1-CB 4.09Å; F762-H771 HydrophobicContact CE2-CB 4.13Å; F762-H771 AromaticContact CE2-CD2 3.4Å; F762-H771 WeakPolarHBondContact CE2-CD2 3.22Å; F762-H771 AromaticContact CE2-CG 3.99Å; F762-H771 HydrophobicContact CZ-CB 3.55Å; F762-H771 AromaticContact CZ-CD2 3.37Å; F762-H771 WeakPolarHBondContact CZ-CD2 3.13Å; F762-H771 AromaticContact CZ-CG 3.52Å
763	W	70.4	Confident	74.9	Confident	123 Å²	123	65.9 Å²	65.9	47%	0.466	31%	0.31	S	S	.	.	S	Bend	trans	-72.4	-29.6	172.3	-79.6	104.2	0	0	0	114.9	K748 I749 G751	K748-W763 WeakPolarHBondContact O-CH2 3.12Å; K748-W763 VanDerWaalsContact O-CZ2 3.25Å; K748-W763 WeakPolarHBondContact O-CZ2 3.26Å; I749-W763 WeakPolarHBondContact O-CZ2 3.38Å; I749-W763 PolarHBondContact O-NE1 3.29Å; G751-W763 VanDerWaalsContact CA-CD2 3.47Å
764	Y	72.3	Confident	74.6	Confident	144 Å²	144	67 Å²	67	57%	0.565	32%	0.319	S	S	*	.			trans	-123.7	126.1	-168.9	-60.9	-68.4	0	0	0	112.6	V766 H767 Y768	Y764-V766 PolarHBondContact O-N 3.37Å; Y764-H767 PolarHBondContact O-N 3.33Å; Y764-Y768 PolarHBondContact O-N 2.76Å
765	K	72.1	Confident	74.3	Confident	150 Å²	150	69.8 Å²	69.8	65%	0.652	33%	0.332	S	S	*	.	H	α-helix	trans	-54.2	-29.3	179.4	-164.1	166.9	-175.8	170.7	0	113.3	L753 N769	L753-K765 VanDerWaalsContact CD1-CA 3.49Å; L753-K765 HydrophobicContact CD1-CB 3.9Å; L753-K765 HydrophobicContact CD1-CG 4.45Å; K765-N769 VanDerWaalsContact O-CB 3.24Å; K765-N769 WeakPolarHBondContact O-CB 2.99Å; K765-N769 PolarHBondContact O-N 3.17Å; K765-N769 PolarHBondContact O-OD1 2.92Å
766	V	73.3	Confident	73.8	Confident	105 Å²	105	72 Å²	72	64%	0.636	35%	0.346	S	S	*	.	H	α-helix	trans	-64.9	-45.9	173.8	-177.8	0	0	0	0	112.3	Y764 V770	Y764-V766 PolarHBondContact O-N 3.37Å; V766-V770 VanDerWaalsContact O-CG2 3.29Å; V766-V770 WeakPolarHBondContact O-CG2 3.5Å; V766-V770 PolarHBondContact O-N 3.03Å; V766-V770 VanDerWaalsContact O-N 3.1Å
767	H	71.9	Confident	73.1	Confident	116 Å²	116	75.2 Å²	75.2	54%	0.537	36%	0.358	S	S	.	.	H	α-helix	trans	-73.6	-38.6	178.9	-65.9	157.2	0	0	0	111.7	F762 Y764 V770 H771	F762-H767 HydrophobicContact CD1-CB 3.91Å; F762-H767 HydrophobicContact CE1-CB 4.45Å; Y764-H767 PolarHBondContact O-N 3.33Å; H767-V770 PolarHBondContact O-N 3.43Å; H767-H771 WeakPolarHBondContact O-CB 3.46Å; H767-H771 PolarHBondContact O-N 3.12Å
768	Y	78.8	Confident	72.7	Confident	56 Å²	56	74.9 Å²	74.9	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-55.4	-55.7	170.2	173	-93.7	0	0	0	111.3	L753 E754 C755 F762 Y764 V770 H771 V772	L753-Y768 HydrophobicContact CB-CD2 3.71Å; L753-Y768 HydrophobicContact CB-CE2 4.28Å; L753-Y768 HydrophobicContact CB-CG 4.04Å; L753-Y768 HydrophobicContact CD1-CG 4.31Å; E754-Y768 WeakPolarHBondContact O-CE2 3.35Å; C755-Y768 HydrophobicContact CB-CE2 4.45Å; F762-Y768 HydrophobicContact CD2-CD2 4.22Å; Y764-Y768 PolarHBondContact O-N 2.76Å; Y768-V770 PolarHBondContact O-N 2.91Å; Y768-H771 CarbonylContact O-C 3.55Å; Y768-H771 WeakPolarHBondContact O-CA 3.41Å; Y768-H771 WeakPolarHBondContact O-CB 3.27Å; Y768-H771 PolarHBondContact O-N 3.37Å; Y768-V772 HydrophobicContact CD1-CG2 4.17Å; Y768-V772 HydrophobicContact CD2-CG2 4.27Å; Y768-V772 HydrophobicContact CE1-CG2 3.78Å; Y768-V772 HydrophobicContact CE2-CG2 3.91Å; Y768-V772 HydrophobicContact CG-CG2 4.39Å; Y768-V772 WeakPolarHBondContact O-CG2 3.48Å; Y768-V772 PolarHBondContact O-N 2.93Å
769	N	75.1	Confident	72.4	Confident	57 Å²	57	76 Å²	76	31%	0.305	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-42.8	179.8	-73.6	-4.5	0	0	0	112.4	K765 H771 V772 R773	K765-N769 VanDerWaalsContact O-CB 3.24Å; K765-N769 WeakPolarHBondContact O-CB 2.99Å; K765-N769 PolarHBondContact O-N 3.17Å; K765-N769 PolarHBondContact O-OD1 2.92Å; N769-H771 VanDerWaalsContact C-N 3.25Å; N769-H771 PolarHBondContact O-N 3.24Å; N769-V772 PolarHBondContact O-N 3.3Å; N769-R773 WeakPolarHBondContact O-CB 3.41Å; N769-R773 WeakPolarHBondContact O-CD 3.44Å; N769-R773 WeakPolarHBondContact O-CG 3.47Å; N769-R773 PolarHBondContact O-N 3.01Å; N769-R773 VanDerWaalsContact O-N 3.1Å
770	V	73.8	Confident	72.3	Confident	72 Å²	72	79 Å²	79	44%	0.436	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-32.9	176	169.3	0	0	0	0	111.6	V766 H767 Y768	V766-V770 VanDerWaalsContact O-CG2 3.29Å; V766-V770 WeakPolarHBondContact O-CG2 3.5Å; V766-V770 PolarHBondContact O-N 3.03Å; V766-V770 VanDerWaalsContact O-N 3.1Å; H767-V770 PolarHBondContact O-N 3.43Å; Y768-V770 PolarHBondContact O-N 2.91Å
771	H	77.4	Confident	72.3	Confident	29 Å²	29	77.8 Å²	77.8	13%	0.134	37%	0.369	C	S	.	.	H	α-helix	trans	-76.6	-45.4	174.8	179.6	43.5	0	0	0	113.2	C755 C758 F762 H767 Y768 N769 R773 T774 H775	C755-H771 VanDerWaalsContact SG-CD2 3.53Å; C758-H771 PolarHBondContact SG-NE2 2.92Å; F762-H771 HydrophobicContact CE1-CB 4.09Å; F762-H771 HydrophobicContact CE2-CB 4.13Å; F762-H771 AromaticContact CE2-CD2 3.4Å; F762-H771 WeakPolarHBondContact CE2-CD2 3.22Å; F762-H771 AromaticContact CE2-CG 3.99Å; F762-H771 HydrophobicContact CZ-CB 3.55Å; F762-H771 AromaticContact CZ-CD2 3.37Å; F762-H771 WeakPolarHBondContact CZ-CD2 3.13Å; F762-H771 AromaticContact CZ-CG 3.52Å; H767-H771 WeakPolarHBondContact O-CB 3.46Å; H767-H771 PolarHBondContact O-N 3.12Å; Y768-H771 CarbonylContact O-C 3.55Å; Y768-H771 WeakPolarHBondContact O-CA 3.41Å; Y768-H771 WeakPolarHBondContact O-CB 3.27Å; Y768-H771 PolarHBondContact O-N 3.37Å; N769-H771 VanDerWaalsContact C-N 3.25Å; N769-H771 PolarHBondContact O-N 3.24Å; H771-R773 PolarHBondContact O-N 3.4Å; H771-T774 PolarHBondContact ND1-OG1 2.92Å; H771-T774 WeakPolarHBondContact O-CA 3.35Å; H771-T774 WeakPolarHBondContact O-CB 3.35Å; H771-T774 PolarHBondContact O-N 3.45Å; H771-T774 PolarHBondContact O-OG1 3.13Å; H771-H775 AromaticContact CE1-CD2 3.86Å; H771-H775 AromaticContact CE1-CE1 3.97Å; H771-H775 AromaticContact CE1-NE2 3.15Å; H771-H775 PolarHBondContact CE1-NE2 3.31Å; H771-H775 AromaticContact NE2-CD2 3.89Å; H771-H775 AromaticContact NE2-NE2 3.13Å; H771-H775 PolarHBondContact NE2-NE2 3.29Å; H771-H775 VanDerWaalsContact NE2-NE2 3.13Å
772	V	78.1	Confident	72.4	Confident	21 Å²	21	84.1 Å²	84.1	13%	0.127	39%	0.392	C	S	.	.	H	α-helix	trans	-56.3	-40	177.6	170.6	0	0	0	0	110.8	Y757 Y768 N769 T774 H775 T776	Y757-V772 HydrophobicContact CE2-CG1 4.15Å; Y768-V772 HydrophobicContact CD1-CG2 4.17Å; Y768-V772 HydrophobicContact CD2-CG2 4.27Å; Y768-V772 HydrophobicContact CE1-CG2 3.78Å; Y768-V772 HydrophobicContact CE2-CG2 3.91Å; Y768-V772 HydrophobicContact CG-CG2 4.39Å; Y768-V772 WeakPolarHBondContact O-CG2 3.48Å; Y768-V772 PolarHBondContact O-N 2.93Å; N769-V772 PolarHBondContact O-N 3.3Å; V772-T774 PolarHBondContact O-N 3.43Å; V772-T774 VanDerWaalsContact O-N 3.11Å; V772-H775 WeakPolarHBondContact O-CA 3.22Å; V772-H775 WeakPolarHBondContact O-CB 3.46Å; V772-H775 PolarHBondContact O-N 2.95Å; V772-T776 HydrophobicContact CG1-CG2 3.93Å; V772-T776 PolarHBondContact O-N 3.04Å
773	R	76.5	Confident	72.7	Confident	73 Å²	73	83.3 Å²	83.3	28%	0.275	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-17.7	173.8	-69.7	170.4	175.2	166.8	0.8	114.9	N769 H771 H775 T776 K777 E778 I791	N769-R773 WeakPolarHBondContact O-CB 3.41Å; N769-R773 WeakPolarHBondContact O-CD 3.44Å; N769-R773 WeakPolarHBondContact O-CG 3.47Å; N769-R773 PolarHBondContact O-N 3.01Å; N769-R773 VanDerWaalsContact O-N 3.1Å; H771-R773 PolarHBondContact O-N 3.4Å; R773-H775 VanDerWaalsContact C-N 3.32Å; R773-T776 WeakPolarHBondContact CA-OG1 3.07Å; R773-K777 PolarHBondContact O-N 3.27Å; R773-E778 HydrophobicContact CG-CB 4.14Å; R773-E778 IonicContact NE-OE2 3.4Å; R773-E778 PolarHBondContact NE-OE2 3.28Å; R773-I791 HydrophobicContact CB-CG2 3.88Å; R773-I791 VanDerWaalsContact O-CD1 3.32Å; R773-I791 WeakPolarHBondContact O-CD1 3.3Å
774	T	71.1	Confident	73	Confident	80 Å²	80	82.7 Å²	82.7	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-77.2	-18.1	170.5	68.2	0	0	0	0	113.4	H771 V772 I791	H771-T774 PolarHBondContact ND1-OG1 2.92Å; H771-T774 WeakPolarHBondContact O-CA 3.35Å; H771-T774 WeakPolarHBondContact O-CB 3.35Å; H771-T774 PolarHBondContact O-N 3.45Å; H771-T774 PolarHBondContact O-OG1 3.13Å; V772-T774 PolarHBondContact O-N 3.43Å; V772-T774 VanDerWaalsContact O-N 3.11Å; T774-I791 HydrophobicContact CG2-CD1 4.04Å
775	H	72.8	Confident	72.9	Confident	65 Å²	65	82.9 Å²	82.9	30%	0.301	41%	0.408	S	S	.	.	H	α-helix	trans	-94.9	-48.2	172.3	-58.7	-74.5	0	0	0	111.7	Y757 C758 H771 V772 R773 K777	Y757-H775 HydrophobicContact CD1-CB 4.01Å; Y757-H775 HydrophobicContact CD2-CB 3.78Å; Y757-H775 AromaticContact CD2-CD2 3.97Å; Y757-H775 HydrophobicContact CE1-CB 4.48Å; Y757-H775 HydrophobicContact CE2-CB 4.29Å; Y757-H775 HydrophobicContact CG-CB 3.64Å; Y757-H775 AromaticContact CG-CD2 3.95Å; Y757-H775 AromaticContact CG-CG 3.75Å; C758-H775 PolarHBondContact SG-NE2 2.93Å; C758-H775 VanDerWaalsContact SG-NE2 3.38Å; H771-H775 AromaticContact CE1-CD2 3.86Å; H771-H775 AromaticContact CE1-CE1 3.97Å; H771-H775 AromaticContact CE1-NE2 3.15Å; H771-H775 PolarHBondContact CE1-NE2 3.31Å; H771-H775 AromaticContact NE2-CD2 3.89Å; H771-H775 AromaticContact NE2-NE2 3.13Å; H771-H775 PolarHBondContact NE2-NE2 3.29Å; H771-H775 VanDerWaalsContact NE2-NE2 3.13Å; V772-H775 WeakPolarHBondContact O-CA 3.22Å; V772-H775 WeakPolarHBondContact O-CB 3.46Å; V772-H775 PolarHBondContact O-N 2.95Å; R773-H775 VanDerWaalsContact C-N 3.32Å; H775-K777 PolarHBondContact O-N 2.85Å
776	T	70.2	Confident	73.2	Confident	48 Å²	48	78.1 Å²	78.1	29%	0.294	39%	0.393	S	S	.	.	H	α-helix	trans	-71.4	-13.8	-178.9	65.3	0	0	0	0	113.8	Y757 V772 R773 E778	Y757-T776 HydrophobicContact CE2-CG2 4.06Å; V772-T776 HydrophobicContact CG1-CG2 3.93Å; V772-T776 PolarHBondContact O-N 3.04Å; R773-T776 WeakPolarHBondContact CA-OG1 3.07Å; T776-E778 VanDerWaalsContact CB-OE1 3.28Å; T776-E778 WeakPolarHBondContact CB-OE1 3.49Å; T776-E778 PolarHBondContact O-N 2.86Å; T776-E778 VanDerWaalsContact OG1-CD 3.29Å; T776-E778 WeakPolarHBondContact OG1-CG 3.29Å; T776-E778 PolarHBondContact OG1-OE1 3.47Å
777	K	63.3	Low	73.3	Confident	144 Å²	144	79.2 Å²	79.2	63%	0.626	41%	0.406	S	S	*	.			trans	60.1	16.4	-176.6	-49.9	169.2	-170	160.7	0	114.3	R773 H775 H779	R773-K777 PolarHBondContact O-N 3.27Å; H775-K777 PolarHBondContact O-N 2.85Å; K777-H779 PolarHBondContact O-CE1 3.02Å; K777-H779 PolarHBondContact O-N 3.21Å; K777-H779 VanDerWaalsContact O-N 3.09Å; K777-H779 PolarHBondContact O-ND1 3.06Å
778	E	62.5	Low	73.6	Confident	88 Å²	88	78 Å²	78	41%	0.411	40%	0.397	S	S	.	.			trans	-55.9	115.4	173	-77.3	158.1	-119.5	0	0	111.2	R773 T776 L780	R773-E778 HydrophobicContact CG-CB 4.14Å; R773-E778 IonicContact NE-OE2 3.4Å; R773-E778 PolarHBondContact NE-OE2 3.28Å; T776-E778 VanDerWaalsContact CB-OE1 3.28Å; T776-E778 WeakPolarHBondContact CB-OE1 3.49Å; T776-E778 PolarHBondContact O-N 2.86Å; T776-E778 VanDerWaalsContact OG1-CD 3.29Å; T776-E778 WeakPolarHBondContact OG1-CG 3.29Å; T776-E778 PolarHBondContact OG1-OE1 3.47Å; E778-L780 HydrophobicContact CB-CD1 4.25Å
779	H	65.4	Low	73.4	Confident	58 Å²	58	76.8 Å²	76.8	27%	0.269	40%	0.396	S	S	.	.			trans	-112.1	67.7	-171.5	-74.9	-12.9	0	0	0	111.7	K777 H781 Y782 S789 S790 I791	K777-H779 PolarHBondContact O-CE1 3.02Å; K777-H779 PolarHBondContact O-N 3.21Å; K777-H779 VanDerWaalsContact O-N 3.09Å; K777-H779 PolarHBondContact O-ND1 3.06Å; H779-H781 PolarHBondContact O-N 2.93Å; H779-Y782 WeakPolarHBondContact O-CE2 3.34Å; H779-Y782 VanDerWaalsContact O-CZ 3.32Å; H779-S789 VanDerWaalsContact CB-CB 3.48Å; H779-S789 VanDerWaalsContact CB-OG 3.27Å; H779-S789 WeakPolarHBondContact CB-OG 3.39Å; H779-S789 PolarHBondContact CD2-OG 2.82Å; H779-S790 CarbonylContact C-O 3.56Å; H779-I791 WeakPolarHBondContact ND1-CG1 3.4Å
780	L	66.8	Low	73.5	Confident	81 Å²	81	74.3 Å²	74.3	42%	0.424	38%	0.383	S	S	.	.			trans	-53.3	-8.6	-176.4	-65.7	94.1	0	0	0	116.1	E778	E778-L780 HydrophobicContact CB-CD1 4.25Å
781	H	73.5	Confident	73.3	Confident	63 Å²	63	72.9 Å²	72.9	29%	0.292	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	84	178.8	-58.8	-46.2	0	0	0	111.2	H779 S790 T792 K793 L796	H779-H781 PolarHBondContact O-N 2.93Å; H781-S790 WeakPolarHBondContact CB-O 3.41Å; H781-S790 PolarHBondContact N-O 3.39Å; H781-S790 PolarHBondContact O-N 3.39Å; H781-S790 PolarHBondContact O-OG 3.04Å; H781-T792 VanDerWaalsContact CD2-C 3.43Å; H781-K793 PolarHBondContact CD2-N 3.14Å; H781-L796 HydrophobicContact CB-CB 4.12Å; H781-L796 HydrophobicContact CB-CD2 3.9Å
782	Y	79.1	Confident	73.1	Confident	165 Å²	165	74.4 Å²	74.4	65%	0.647	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	150.8	171.3	-54.7	-91.2	0	0	0	112	H779 S789 L796	H779-Y782 WeakPolarHBondContact O-CE2 3.34Å; H779-Y782 VanDerWaalsContact O-CZ 3.32Å; Y782-S789 VanDerWaalsContact CD1-CB 3.44Å; Y782-L796 WeakPolarHBondContact O-CD2 3.42Å
783	C	82.3	Confident	72.9	Confident	11 Å²	11	80 Å²	80	7%	0.074	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.4	172.1	-167.3	0	0	0	0	111	K785 C786 Y788 L796 H799 H804	C783-K785 PolarHBondContact O-N 2.83Å; C783-C786 WeakPolarHBondContact CB-O 3.19Å; C783-C786 PolarHBondContact O-N 3.38Å; C783-Y788 VanDerWaalsContact CB-O 3.26Å; C783-Y788 WeakPolarHBondContact CB-O 3.39Å; C783-Y788 PolarHBondContact N-O 2.87Å; C783-L796 HydrophobicContact CB-CD1 3.6Å; C783-H799 PolarHBondContact SG-NE2 2.96Å; C783-H804 PolarHBondContact SG-CD2 2.95Å; C783-H804 PolarHBondContact SG-NE2 3.48Å
784	S	75.9	Confident	72.7	Confident	111 Å²	111	80.8 Å²	80.8	78%	0.776	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	2.5	174.6	52.3	0	0	0	0	115.1
785	K	70.8	Confident	72.9	Confident	147 Å²	147	78.5 Å²	78.5	64%	0.639	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	2	-179	-70	-171.9	167.8	-165.1	0	114.6	C783 H804	C783-K785 PolarHBondContact O-N 2.83Å; K785-H804 HydrophobicContact CB-CB 4.33Å; K785-H804 WeakPolarHBondContact CB-ND1 3.31Å; K785-H804 HydrophobicContact CD-CB 3.91Å; K785-H804 PolarHBondContact O-CE1 3.24Å
786	C	78.7	Confident	73.3	Confident	51 Å²	51	76.1 Å²	76.1	35%	0.345	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	170.3	164.5	70	0	0	0	0	111.8	C783 Y788 H799 H804	C783-C786 WeakPolarHBondContact CB-O 3.19Å; C783-C786 PolarHBondContact O-N 3.38Å; C786-Y788 PolarHBondContact O-N 2.9Å; C786-H799 PolarHBondContact SG-CE1 3.45Å; C786-H799 PolarHBondContact SG-NE2 3.05Å; C786-H804 PolarHBondContact SG-NE2 3.1Å
787	S	76	Confident	73.6	Confident	128 Å²	128	79.9 Å²	79.9	90%	0.895	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	14.3	176	55.7	0	0	0	0	116.5
788	Y	77.8	Confident	74.2	Confident	91 Å²	91	80 Å²	80	36%	0.357	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.5	169.4	-178.5	-95	0	0	0	110.8	C783 C786 H799	C783-Y788 VanDerWaalsContact CB-O 3.26Å; C783-Y788 WeakPolarHBondContact CB-O 3.39Å; C783-Y788 PolarHBondContact N-O 2.87Å; C786-Y788 PolarHBondContact O-N 2.9Å; Y788-H799 HydrophobicContact CD1-CB 3.57Å; Y788-H799 AromaticContact CD1-CD2 3.44Å; Y788-H799 VanDerWaalsContact CD1-CD2 3.44Å; Y788-H799 WeakPolarHBondContact CD1-CD2 3.38Å; Y788-H799 AromaticContact CD1-CG 3.22Å; Y788-H799 AromaticContact CD1-ND1 3.73Å; Y788-H799 HydrophobicContact CE1-CB 3.45Å; Y788-H799 VanDerWaalsContact CE1-CB 3.45Å; Y788-H799 AromaticContact CE1-CG 3.68Å; Y788-H799 HydrophobicContact CG-CB 4.3Å; Y788-H799 AromaticContact CG-CD2 3.84Å; Y788-H799 AromaticContact CG-CG 3.6Å; Y788-H799 AromaticContact CG-ND1 3.57Å
789	S	75.1	Confident	75.1	Confident	29 Å²	29	77.4 Å²	77.4	20%	0.203	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156	175.6	61.9	0	0	0	0	110.3	H779 Y782	H779-S789 VanDerWaalsContact CB-CB 3.48Å; H779-S789 VanDerWaalsContact CB-OG 3.27Å; H779-S789 WeakPolarHBondContact CB-OG 3.39Å; H779-S789 PolarHBondContact CD2-OG 2.82Å; Y782-S789 VanDerWaalsContact CD1-CB 3.44Å
790	S	75.8	Confident	75.7	Confident	5 Å²	5	77.6 Å²	77.6	4%	0.035	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	156.9	-174.9	67.7	0	0	0	0	113.8	H779 H781 T792 L796	H779-S790 CarbonylContact C-O 3.56Å; H781-S790 WeakPolarHBondContact CB-O 3.41Å; H781-S790 PolarHBondContact N-O 3.39Å; H781-S790 PolarHBondContact O-N 3.39Å; H781-S790 PolarHBondContact O-OG 3.04Å; S790-T792 VanDerWaalsContact C-N 3.3Å; S790-T792 PolarHBondContact O-N 2.95Å; S790-T792 PolarHBondContact OG-O 3.01Å; S790-L796 PolarHBondContact OG-N 2.77Å
791	I	71.3	Confident	76.1	Confident	43 Å²	43	78.3 Å²	78.3	22%	0.221	40%	0.401	C	S	.	.	S	Bend	trans	-75	-18.9	179.3	-49.4	171.3	0	0	0	111.7	R773 T774 H779	R773-I791 HydrophobicContact CB-CG2 3.88Å; R773-I791 VanDerWaalsContact O-CD1 3.32Å; R773-I791 WeakPolarHBondContact O-CD1 3.3Å; T774-I791 HydrophobicContact CG2-CD1 4.04Å; H779-I791 WeakPolarHBondContact ND1-CG1 3.4Å
792	T	72.4	Confident	76	Confident	60 Å²	60	78.3 Å²	78.3	37%	0.368	40%	0.401	S	S	.	.	S	Bend	trans	-136.9	131.9	-172.9	52.7	0	0	0	0	113.3	H781 S790 S794 S795 L796	H781-T792 VanDerWaalsContact CD2-C 3.43Å; S790-T792 VanDerWaalsContact C-N 3.3Å; S790-T792 PolarHBondContact O-N 2.95Å; S790-T792 PolarHBondContact OG-O 3.01Å; T792-S794 PolarHBondContact O-N 3.05Å; T792-S795 WeakPolarHBondContact O-CA 3.49Å; T792-S795 WeakPolarHBondContact O-CB 3.43Å; T792-S795 PolarHBondContact O-N 2.87Å; T792-S795 PolarHBondContact OG1-OG 3.48Å; T792-L796 PolarHBondContact O-N 3.47Å
793	K	74.6	Confident	75.4	Confident	139 Å²	139	77.9 Å²	77.9	60%	0.604	40%	0.403	S	S	*	.	H	α-helix	trans	-55.9	-28.3	-178.9	-163.9	166.7	-173.5	168.3	0	113	H781 K797	H781-K793 PolarHBondContact CD2-N 3.14Å; K793-K797 WeakPolarHBondContact O-CB 3.35Å; K793-K797 WeakPolarHBondContact O-CG 3.4Å; K793-K797 PolarHBondContact O-N 2.86Å
794	S	70.5	Confident	75.1	Confident	90 Å²	90	79.8 Å²	79.8	63%	0.629	41%	0.411	S	S	*	.	H	α-helix	trans	-66.5	-35.2	172.9	-48.4	0	0	0	0	113.5	T792 R798	T792-S794 PolarHBondContact O-N 3.05Å; S794-R798 PolarHBondContact O-N 3.35Å; S794-R798 VanDerWaalsContact O-N 3.11Å
795	S	75.7	Confident	74.8	Confident	31 Å²	31	76.7 Å²	76.7	22%	0.217	39%	0.389	C	S	.	.	H	α-helix	trans	-76.1	-42.8	177.5	-58.3	0	0	0	0	110.8	T792 K797 R798 H799	T792-S795 WeakPolarHBondContact O-CA 3.49Å; T792-S795 WeakPolarHBondContact O-CB 3.43Å; T792-S795 PolarHBondContact O-N 2.87Å; T792-S795 PolarHBondContact OG1-OG 3.48Å; S795-K797 PolarHBondContact O-N 3.18Å; S795-R798 PolarHBondContact O-N 2.98Å; S795-H799 PolarHBondContact O-N 3.38Å
796	L	81.5	Confident	74.4	Confident	16 Å²	16	72.9 Å²	72.9	8%	0.084	39%	0.392	C	S	.	.	H	α-helix	trans	-55.7	-48.5	169.6	175.5	60.3	0	0	0	111.5	H781 Y782 C783 S790 T792 R798 H799 Q800	H781-L796 HydrophobicContact CB-CB 4.12Å; H781-L796 HydrophobicContact CB-CD2 3.9Å; Y782-L796 WeakPolarHBondContact O-CD2 3.42Å; C783-L796 HydrophobicContact CB-CD1 3.6Å; S790-L796 PolarHBondContact OG-N 2.77Å; T792-L796 PolarHBondContact O-N 3.47Å; L796-R798 VanDerWaalsContact C-N 3.32Å; L796-R798 PolarHBondContact O-N 3.42Å; L796-H799 WeakPolarHBondContact O-CB 3.36Å; L796-H799 PolarHBondContact O-N 3.22Å; L796-H799 VanDerWaalsContact O-N 3.16Å; L796-Q800 HydrophobicContact CD1-CG 3.96Å; L796-Q800 HydrophobicContact CG-CG 4.28Å; L796-Q800 WeakPolarHBondContact O-CB 3.47Å; L796-Q800 WeakPolarHBondContact O-CG 3.45Å; L796-Q800 PolarHBondContact O-N 2.9Å
797	K	76.3	Confident	73.9	Confident	127 Å²	127	76.2 Å²	76.2	55%	0.552	41%	0.405	S	S	*	.	H	α-helix	trans	-59.3	-40	176.8	-80	-170.6	173.1	-163.8	0	112.6	K793 S795 Q800 I801	K793-K797 WeakPolarHBondContact O-CB 3.35Å; K793-K797 WeakPolarHBondContact O-CG 3.4Å; K793-K797 PolarHBondContact O-N 2.86Å; S795-K797 PolarHBondContact O-N 3.18Å; K797-Q800 PolarHBondContact O-N 3.48Å; K797-I801 WeakPolarHBondContact O-CB 3.4Å; K797-I801 WeakPolarHBondContact O-CD1 3.37Å; K797-I801 VanDerWaalsContact O-CG1 3.26Å; K797-I801 WeakPolarHBondContact O-CG1 3.3Å; K797-I801 PolarHBondContact O-N 3.4Å
798	R	77.1	Confident	73.6	Confident	147 Å²	147	75.1 Å²	75.1	56%	0.555	39%	0.389	S	S	*	.	H	α-helix	trans	-63.1	-43.7	175	-172.2	-173.6	-63.3	134.6	-0.4	111.6	S794 S795 L796 I801 Q802	S794-R798 PolarHBondContact O-N 3.35Å; S794-R798 VanDerWaalsContact O-N 3.11Å; S795-R798 PolarHBondContact O-N 2.98Å; L796-R798 VanDerWaalsContact C-N 3.32Å; L796-R798 PolarHBondContact O-N 3.42Å; R798-I801 PolarHBondContact O-N 3.23Å; R798-Q802 HydrophobicContact CG-CG 4.45Å; R798-Q802 WeakPolarHBondContact O-CB 3.35Å; R798-Q802 VanDerWaalsContact O-CG 3.31Å; R798-Q802 WeakPolarHBondContact O-CG 3.44Å; R798-Q802 PolarHBondContact O-N 3.1Å
799	H	80	Confident	73.5	Confident	32 Å²	32	74 Å²	74	15%	0.148	39%	0.389	C	S	.	.	H	α-helix	trans	-62.6	-48.3	175	167.3	77.1	0	0	0	112	C783 C786 Y788 S795 L796 I801 Q802 K803 H804	C783-H799 PolarHBondContact SG-NE2 2.96Å; C786-H799 PolarHBondContact SG-CE1 3.45Å; C786-H799 PolarHBondContact SG-NE2 3.05Å; Y788-H799 HydrophobicContact CD1-CB 3.57Å; Y788-H799 AromaticContact CD1-CD2 3.44Å; Y788-H799 VanDerWaalsContact CD1-CD2 3.44Å; Y788-H799 WeakPolarHBondContact CD1-CD2 3.38Å; Y788-H799 AromaticContact CD1-CG 3.22Å; Y788-H799 AromaticContact CD1-ND1 3.73Å; Y788-H799 HydrophobicContact CE1-CB 3.45Å; Y788-H799 VanDerWaalsContact CE1-CB 3.45Å; Y788-H799 AromaticContact CE1-CG 3.68Å; Y788-H799 HydrophobicContact CG-CB 4.3Å; Y788-H799 AromaticContact CG-CD2 3.84Å; Y788-H799 AromaticContact CG-CG 3.6Å; Y788-H799 AromaticContact CG-ND1 3.57Å; S795-H799 PolarHBondContact O-N 3.38Å; L796-H799 WeakPolarHBondContact O-CB 3.36Å; L796-H799 PolarHBondContact O-N 3.22Å; L796-H799 VanDerWaalsContact O-N 3.16Å; H799-I801 VanDerWaalsContact C-N 3.28Å; H799-I801 PolarHBondContact O-N 3.34Å; H799-Q802 CarbonylContact O-C 3.19Å; H799-Q802 PolarHBondContact O-N 3.33Å; H799-Q802 VanDerWaalsContact O-N 3.11Å; H799-K803 PolarHBondContact O-N 3.38Å; H799-H804 AromaticContact CD2-CD2 3.85Å; H799-H804 AromaticContact CD2-NE2 3.94Å; H799-H804 AromaticContact CE1-NE2 3.75Å; H799-H804 AromaticContact NE2-CD2 2.74Å; H799-H804 PolarHBondContact NE2-CD2 3Å; H799-H804 AromaticContact NE2-CE1 3.4Å; H799-H804 PolarHBondContact NE2-CE1 3.15Å; H799-H804 AromaticContact NE2-NE2 2.14Å; H799-H804 PolarHBondContact NE2-NE2 2.74Å
800	Q	79.5	Confident	73.5	Confident	62 Å²	62	76.7 Å²	76.7	29%	0.29	41%	0.405	S	S	.	.	H	α-helix	trans	-55.6	-43.2	175.9	-74.8	172.5	-35.3	0	0	111.7	L796 K797 H804 S805	L796-Q800 HydrophobicContact CD1-CG 3.96Å; L796-Q800 HydrophobicContact CG-CG 4.28Å; L796-Q800 WeakPolarHBondContact O-CB 3.47Å; L796-Q800 WeakPolarHBondContact O-CG 3.45Å; L796-Q800 PolarHBondContact O-N 2.9Å; K797-Q800 PolarHBondContact O-N 3.48Å; Q800-H804 CarbonylContact O-C 3.34Å; Q800-H804 WeakPolarHBondContact O-CA 3.35Å; Q800-H804 PolarHBondContact O-N 2.73Å; Q800-S805 PolarHBondContact O-N 3.49Å
801	I	74.6	Confident	73.5	Confident	96 Å²	96	77.1 Å²	77.1	49%	0.492	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-53.4	173	-68.5	163.8	0	0	0	110.8	K797 R798 H799 K803 S805 P821	K797-I801 WeakPolarHBondContact O-CB 3.4Å; K797-I801 WeakPolarHBondContact O-CD1 3.37Å; K797-I801 VanDerWaalsContact O-CG1 3.26Å; K797-I801 WeakPolarHBondContact O-CG1 3.3Å; K797-I801 PolarHBondContact O-N 3.4Å; R798-I801 PolarHBondContact O-N 3.23Å; H799-I801 VanDerWaalsContact C-N 3.28Å; H799-I801 PolarHBondContact O-N 3.34Å; I801-K803 VanDerWaalsContact C-N 3.31Å; I801-K803 PolarHBondContact O-N 3.33Å; I801-S805 PolarHBondContact O-OG 2.61Å; I801-P821 WeakPolarHBondContact CG2-O 3.45Å
802	Q	70.5	Confident	73.7	Confident	64 Å²	64	80 Å²	80	30%	0.299	43%	0.432	S	S	.	.	H	α-helix	trans	-67.7	-19.8	-175.6	-75.5	177.1	-18.3	0	0	115.5	R798 H799 P821 D822	R798-Q802 HydrophobicContact CG-CG 4.45Å; R798-Q802 WeakPolarHBondContact O-CB 3.35Å; R798-Q802 VanDerWaalsContact O-CG 3.31Å; R798-Q802 WeakPolarHBondContact O-CG 3.44Å; R798-Q802 PolarHBondContact O-N 3.1Å; H799-Q802 CarbonylContact O-C 3.19Å; H799-Q802 PolarHBondContact O-N 3.33Å; H799-Q802 VanDerWaalsContact O-N 3.11Å; Q802-P821 WeakPolarHBondContact O-CG 3.14Å; Q802-D822 HydrophobicContact CG-CB 4.29Å; Q802-D822 PolarHBondContact NE2-OD2 3.18Å
803	K	67.1	Low	73.6	Confident	156 Å²	156	78.4 Å²	78.4	68%	0.678	42%	0.424	S	S	*	.	H	α-helix	trans	-133	-14.8	-172.4	-85.7	-58.8	-162.8	174.6	0	117.2	H799 I801	H799-K803 PolarHBondContact O-N 3.38Å; I801-K803 VanDerWaalsContact C-N 3.31Å; I801-K803 PolarHBondContact O-N 3.33Å
804	H	75.4	Confident	72.9	Confident	51 Å²	51	78.2 Å²	78.2	24%	0.236	44%	0.436	C	S	.	.	H	α-helix	trans	-137.5	2.9	-172.5	-57.6	-63.7	0	0	0	115.1	C783 K785 C786 H799 Q800	C783-H804 PolarHBondContact SG-CD2 2.95Å; C783-H804 PolarHBondContact SG-NE2 3.48Å; K785-H804 HydrophobicContact CB-CB 4.33Å; K785-H804 WeakPolarHBondContact CB-ND1 3.31Å; K785-H804 HydrophobicContact CD-CB 3.91Å; K785-H804 PolarHBondContact O-CE1 3.24Å; C786-H804 PolarHBondContact SG-NE2 3.1Å; H799-H804 AromaticContact CD2-CD2 3.85Å; H799-H804 AromaticContact CD2-NE2 3.94Å; H799-H804 AromaticContact CE1-NE2 3.75Å; H799-H804 AromaticContact NE2-CD2 2.74Å; H799-H804 PolarHBondContact NE2-CD2 3Å; H799-H804 AromaticContact NE2-CE1 3.4Å; H799-H804 PolarHBondContact NE2-CE1 3.15Å; H799-H804 AromaticContact NE2-NE2 2.14Å; H799-H804 PolarHBondContact NE2-NE2 2.74Å; Q800-H804 CarbonylContact O-C 3.34Å; Q800-H804 WeakPolarHBondContact O-CA 3.35Å; Q800-H804 PolarHBondContact O-N 2.73Å
805	S	70.2	Confident	72.5	Confident	45 Å²	45	78 Å²	78	32%	0.315	45%	0.448	S	S	.	.	S	Bend	trans	-84.8	-21.2	179.2	68.2	0	0	0	0	114.2	Q800 I801 L807	Q800-S805 PolarHBondContact O-N 3.49Å; I801-S805 PolarHBondContact O-OG 2.61Å; S805-L807 PolarHBondContact O-N 2.92Å; S805-L807 PolarHBondContact OG-N 3.19Å
806	G	63	Low	72.4	Confident	68 Å²	68	77.7 Å²	77.7	70%	0.701	45%	0.446	S	S	*	.			trans	68.1	-13.6	-171.9	0	0	0	0	0	115.2	L808	G806-L808 VanDerWaalsContact C-N 3.34Å; G806-L808 PolarHBondContact O-N 2.79Å
807	L	68.6	Low	71.9	Confident	120 Å²	120	87.1 Å²	87.1	63%	0.628	49%	0.486	S	S	*	.			trans	-74.2	77.7	-172.9	-63.5	178.4	0	0	0	112.5	S805 L809 P821	S805-L807 PolarHBondContact O-N 2.92Å; S805-L807 PolarHBondContact OG-N 3.19Å; L807-L809 PolarHBondContact O-N 3.42Å; L807-P821 VanDerWaalsContact O-CA 3.3Å; L807-P821 WeakPolarHBondContact O-CA 3.48Å
808	L	69.3	Low	71.7	Confident	106 Å²	106	85.6 Å²	85.6	56%	0.555	48%	0.478	S	S	*	.			trans	-65.5	116.4	167.8	-62.7	-179.2	0	0	0	109.7	G806 P810 P821	G806-L808 VanDerWaalsContact C-N 3.34Å; G806-L808 PolarHBondContact O-N 2.79Å; L808-P810 WeakPolarHBondContact O-CD 3.4Å; L808-P821 HydrophobicContact CD2-CG 4.44Å
809	L	74.5	Confident	71.6	Confident	68 Å²	68	81 Å²	81	36%	0.356	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.1	171.1	-54.8	173.6	0	0	0	108.1	L807 S819 T820 K823 L826	L807-L809 PolarHBondContact O-N 3.42Å; L809-S819 CarbonylContact O-C 3.59Å; L809-S819 VanDerWaalsContact O-CA 3.27Å; L809-S819 WeakPolarHBondContact O-CA 3.4Å; L809-T820 WeakPolarHBondContact CB-O 3.15Å; L809-T820 PolarHBondContact N-O 3.14Å; L809-T820 PolarHBondContact O-N 2.78Å; L809-K823 HydrophobicContact CD1-CB 4.01Å; L809-L826 HydrophobicContact CB-CD2 3.6Å
810	P	74.8	Confident	71.4	Confident	84 Å²	84	80.1 Å²	80.1	55%	0.545	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	156.5	178.1	32.1	-35.6	0	0	0	112	L808 L826	L808-P810 WeakPolarHBondContact O-CD 3.4Å; P810-L826 WeakPolarHBondContact O-CD2 3.37Å
811	C	77.2	Confident	71	Confident	14 Å²	14	78.8 Å²	78.8	10%	0.095	46%	0.461	C	S	.	.			trans	-63.4	138.9	167.9	-164.2	0	0	0	0	110.6	S813 C816 Y818 L826 H829	C811-S813 VanDerWaalsContact C-N 3.32Å; C811-C816 HydrophobicContact CB-CB 4Å; C811-Y818 WeakPolarHBondContact CB-O 3.45Å; C811-Y818 PolarHBondContact N-O 3.3Å; C811-L826 HydrophobicContact CB-CD1 4.33Å; C811-H829 PolarHBondContact SG-NE2 3.45Å
812	S	74.9	Confident	71	Confident	104 Å²	104	75.1 Å²	75.1	73%	0.727	44%	0.443	S	S	*	.	S	Bend	trans	-92.4	8.3	176.9	-46.1	0	0	0	0	113.2
813	S	70.9	Confident	71.1	Confident	27 Å²	27	79.3 Å²	79.3	19%	0.189	46%	0.46	C	S	.	.	S	Bend	trans	-90.2	132.5	175.2	-58.7	0	0	0	0	110	C811 C816	C811-S813 VanDerWaalsContact C-N 3.32Å; S813-C816 PolarHBondContact O-N 3.14Å
814	P	60	Low	71.3	Confident	134 Å²	134	80.5 Å²	80.5	87%	0.87	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	146.4	178.1	25.7	-34	0	0	0	111.3	C816	P814-C816 PolarHBondContact O-N 3.06Å
815	G	62.7	Low	71.2	Confident	85 Å²	85	83.3 Å²	83.3	88%	0.876	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-17.7	-177.1	0	0	0	0	0	116	K817	G815-K817 PolarHBondContact O-N 3.4Å
816	C	72.6	Confident	71.5	Confident	26 Å²	26	82.2 Å²	82.2	18%	0.176	46%	0.464	C	S	.	.			trans	-89	107.7	-173.1	-167.2	0	0	0	0	114.2	C811 S813 P814 Y818 H829 Q833	C811-C816 HydrophobicContact CB-CB 4Å; S813-C816 PolarHBondContact O-N 3.14Å; P814-C816 PolarHBondContact O-N 3.06Å; C816-Y818 PolarHBondContact O-N 3.39Å; C816-Y818 VanDerWaalsContact O-N 3.16Å; C816-H829 PolarHBondContact SG-CE1 2.85Å; C816-H829 PolarHBondContact SG-NE2 3.35Å; C816-Q833 PolarHBondContact SG-OE1 3.43Å
817	K	70.9	Confident	71.9	Confident	213 Å²	213	83.5 Å²	83.5	93%	0.926	45%	0.452	S	S	*	.			trans	-73.7	6.5	177.3	-61.5	-174.6	179	-178.2	0	115.2	G815	G815-K817 PolarHBondContact O-N 3.4Å
818	Y	72.1	Confident	72.1	Confident	96 Å²	96	80.2 Å²	80.2	38%	0.376	44%	0.442	S	S	.	.			trans	-77	129.7	-176	-171.4	-95.3	0	0	0	112.4	C811 C816 T820 L826 H829	C811-Y818 WeakPolarHBondContact CB-O 3.45Å; C811-Y818 PolarHBondContact N-O 3.3Å; C816-Y818 PolarHBondContact O-N 3.39Å; C816-Y818 VanDerWaalsContact O-N 3.16Å; Y818-T820 HydrophobicContact CD1-CG2 4.32Å; Y818-T820 HydrophobicContact CE1-CG2 3.45Å; Y818-T820 VanDerWaalsContact CE1-CG2 3.45Å; Y818-T820 HydrophobicContact CE2-CG2 4.36Å; Y818-T820 VanDerWaalsContact CZ-CG2 3.49Å; Y818-T820 WeakPolarHBondContact OH-CG2 3.48Å; Y818-L826 HydrophobicContact CD1-CD1 4.28Å; Y818-H829 VanDerWaalsContact CB-CE1 3.41Å; Y818-H829 WeakPolarHBondContact CB-CE1 3.35Å; Y818-H829 WeakPolarHBondContact CB-NE2 3.43Å; Y818-H829 HydrophobicContact CD1-CB 3.76Å; Y818-H829 AromaticContact CD1-CD2 3.36Å; Y818-H829 WeakPolarHBondContact CD1-CD2 3.4Å; Y818-H829 AromaticContact CD1-CE1 3.87Å; Y818-H829 AromaticContact CD1-CG 3.22Å; Y818-H829 AromaticContact CD1-ND1 3.58Å; Y818-H829 AromaticContact CD1-NE2 3.77Å; Y818-H829 AromaticContact CD2-ND1 3.95Å; Y818-H829 HydrophobicContact CE1-CB 3.43Å; Y818-H829 VanDerWaalsContact CE1-CB 3.43Å; Y818-H829 AromaticContact CE1-CG 3.46Å; Y818-H829 VanDerWaalsContact CE1-CG 3.46Å; Y818-H829 AromaticContact CE1-ND1 3.93Å; Y818-H829 AromaticContact CG-CD2 3.88Å; Y818-H829 AromaticContact CG-CE1 3.59Å; Y818-H829 AromaticContact CG-CG 3.74Å; Y818-H829 AromaticContact CG-ND1 3.56Å; Y818-H829 AromaticContact CG-NE2 3.8Å
819	S	74.8	Confident	72.5	Confident	49 Å²	49	76.2 Å²	76.2	34%	0.343	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.6	172.2	69.6	0	0	0	0	111.6	L809	L809-S819 CarbonylContact O-C 3.59Å; L809-S819 VanDerWaalsContact O-CA 3.27Å; L809-S819 WeakPolarHBondContact O-CA 3.4Å
820	T	75.5	Confident	72.3	Confident	14 Å²	14	75.3 Å²	75.3	9%	0.086	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.8	177.7	52.2	0	0	0	0	113.1	L809 Y818 D822 K825 L826	L809-T820 WeakPolarHBondContact CB-O 3.15Å; L809-T820 PolarHBondContact N-O 3.14Å; L809-T820 PolarHBondContact O-N 2.78Å; Y818-T820 HydrophobicContact CD1-CG2 4.32Å; Y818-T820 HydrophobicContact CE1-CG2 3.45Å; Y818-T820 VanDerWaalsContact CE1-CG2 3.45Å; Y818-T820 HydrophobicContact CE2-CG2 4.36Å; Y818-T820 VanDerWaalsContact CZ-CG2 3.49Å; Y818-T820 WeakPolarHBondContact OH-CG2 3.48Å; T820-D822 PolarHBondContact O-N 2.93Å; T820-D822 VanDerWaalsContact O-N 3.14Å; T820-D822 PolarHBondContact OG1-O 3.12Å; T820-K825 HydrophobicContact CG2-CB 4.43Å; T820-L826 PolarHBondContact OG1-N 2.76Å
821	P	71.4	Confident	72	Confident	34 Å²	34	78.2 Å²	78.2	22%	0.221	42%	0.415	C	S	.	.	S	Bend	trans	-80.6	16.8	175.4	36	-36	0	0	0	113.3	I801 Q802 L807 L808	I801-P821 WeakPolarHBondContact CG2-O 3.45Å; Q802-P821 WeakPolarHBondContact O-CG 3.14Å; L807-P821 VanDerWaalsContact O-CA 3.3Å; L807-P821 WeakPolarHBondContact O-CA 3.48Å; L808-P821 HydrophobicContact CD2-CG 4.44Å
822	D	74.1	Confident	71.4	Confident	20 Å²	20	80.9 Å²	80.9	11%	0.107	43%	0.431	C	S	.	.			trans	-130.2	106.6	-177.4	-172.4	-19.1	0	0	0	110.2	Q802 T820 Y824 K825 L826	Q802-D822 HydrophobicContact CG-CB 4.29Å; Q802-D822 PolarHBondContact NE2-OD2 3.18Å; T820-D822 PolarHBondContact O-N 2.93Å; T820-D822 VanDerWaalsContact O-N 3.14Å; T820-D822 PolarHBondContact OG1-O 3.12Å; D822-Y824 PolarHBondContact O-N 2.97Å; D822-Y824 VanDerWaalsContact O-N 3.08Å; D822-Y824 WeakPolarHBondContact OD1-CB 3.49Å; D822-Y824 PolarHBondContact OD1-N 3.05Å; D822-K825 HydrophobicContact CB-CB 4.06Å; D822-K825 HydrophobicContact CB-CD 3.94Å; D822-K825 HydrophobicContact CB-CG 3.87Å; D822-K825 WeakPolarHBondContact O-CA 3.07Å; D822-K825 PolarHBondContact O-N 3.44Å; D822-L826 PolarHBondContact O-N 3.11Å
823	K	73.4	Confident	70.7	Confident	151 Å²	151	78.6 Å²	78.6	66%	0.657	41%	0.409	S	S	*	.	H	α-helix	trans	-52.1	-31.6	178.2	-177.2	174.4	179.3	175	0	113.3	L809 Q827	L809-K823 HydrophobicContact CD1-CB 4.01Å; K823-Q827 VanDerWaalsContact O-CB 3.26Å; K823-Q827 WeakPolarHBondContact O-CB 3.19Å; K823-Q827 PolarHBondContact O-N 3.49Å
824	Y	71.6	Confident	70.1	Confident	182 Å²	182	83.1 Å²	83.1	71%	0.714	43%	0.426	S	S	*	.	H	α-helix	trans	-77	-32.4	178.3	-64.7	-82.7	0	0	0	112.2	D822 A828	D822-Y824 PolarHBondContact O-N 2.97Å; D822-Y824 VanDerWaalsContact O-N 3.08Å; D822-Y824 WeakPolarHBondContact OD1-CB 3.49Å; D822-Y824 PolarHBondContact OD1-N 3.05Å; Y824-A828 WeakPolarHBondContact O-CB 3.43Å; Y824-A828 PolarHBondContact O-N 3.38Å
825	K	73.6	Confident	69.8	Low	110 Å²	110	79.4 Å²	79.4	48%	0.478	40%	0.397	S	S	.	.	H	α-helix	trans	-72	-42.9	172.4	-64.7	-176.2	-172.1	178.9	0	111.3	T820 D822 Q827 A828 H829	T820-K825 HydrophobicContact CG2-CB 4.43Å; D822-K825 HydrophobicContact CB-CB 4.06Å; D822-K825 HydrophobicContact CB-CD 3.94Å; D822-K825 HydrophobicContact CB-CG 3.87Å; D822-K825 WeakPolarHBondContact O-CA 3.07Å; D822-K825 PolarHBondContact O-N 3.44Å; K825-Q827 VanDerWaalsContact C-N 3.31Å; K825-Q827 PolarHBondContact O-N 3.2Å; K825-A828 PolarHBondContact O-N 3.5Å; K825-H829 WeakPolarHBondContact O-CB 3.23Å; K825-H829 PolarHBondContact O-N 3.12Å
826	L	76.4	Confident	69.3	Low	21 Å²	21	82.4 Å²	82.4	11%	0.11	39%	0.389	C	S	.	.	H	α-helix	trans	-59.7	-43.9	172.7	-173	65	0	0	0	111.2	L809 P810 C811 Y818 T820 D822 A828 H829 M830	L809-L826 HydrophobicContact CB-CD2 3.6Å; P810-L826 WeakPolarHBondContact O-CD2 3.37Å; C811-L826 HydrophobicContact CB-CD1 4.33Å; Y818-L826 HydrophobicContact CD1-CD1 4.28Å; T820-L826 PolarHBondContact OG1-N 2.76Å; D822-L826 PolarHBondContact O-N 3.11Å; L826-A828 VanDerWaalsContact C-N 3.31Å; L826-A828 PolarHBondContact O-N 2.86Å; L826-H829 PolarHBondContact O-N 3.16Å; L826-M830 HydrophobicContact CD1-CG 4.42Å; L826-M830 HydrophobicContact CG-CG 4.41Å; L826-M830 WeakPolarHBondContact O-CG 3.24Å; L826-M830 PolarHBondContact O-N 3.3Å
827	Q	71.2	Confident	68.3	Low	96 Å²	96	89.8 Å²	89.8	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-65.8	-30.9	176.9	-170.2	176.1	27.2	0	0	113.2	K823 K825 R831	K823-Q827 VanDerWaalsContact O-CB 3.26Å; K823-Q827 WeakPolarHBondContact O-CB 3.19Å; K823-Q827 PolarHBondContact O-N 3.49Å; K825-Q827 VanDerWaalsContact C-N 3.31Å; K825-Q827 PolarHBondContact O-N 3.2Å; Q827-R831 WeakPolarHBondContact O-CG 3.49Å
828	A	73.5	Confident	67.5	Low	51 Å²	51	81.2 Å²	81.2	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-70.5	-45.8	171.1	0	0	0	0	0	111.2	Y824 K825 L826 M830 R831 T832	Y824-A828 WeakPolarHBondContact O-CB 3.43Å; Y824-A828 PolarHBondContact O-N 3.38Å; K825-A828 PolarHBondContact O-N 3.5Å; L826-A828 VanDerWaalsContact C-N 3.31Å; L826-A828 PolarHBondContact O-N 2.86Å; A828-M830 PolarHBondContact O-N 3.33Å; A828-R831 WeakPolarHBondContact O-CB 3.47Å; A828-R831 PolarHBondContact O-N 3.47Å; A828-R831 VanDerWaalsContact O-N 3.15Å; A828-T832 PolarHBondContact O-N 3.36Å; A828-T832 VanDerWaalsContact O-N 3.1Å
829	H	77.1	Confident	67	Low	21 Å²	21	80.2 Å²	80.2	10%	0.097	39%	0.394	C	S	.	.	H	α-helix	trans	-59.7	-45.8	178.1	166.2	76.1	0	0	0	112.6	C811 C816 Y818 K825 L826 R831 T832 Q833	C811-H829 PolarHBondContact SG-NE2 3.45Å; C816-H829 PolarHBondContact SG-CE1 2.85Å; C816-H829 PolarHBondContact SG-NE2 3.35Å; Y818-H829 VanDerWaalsContact CB-CE1 3.41Å; Y818-H829 WeakPolarHBondContact CB-CE1 3.35Å; Y818-H829 WeakPolarHBondContact CB-NE2 3.43Å; Y818-H829 HydrophobicContact CD1-CB 3.76Å; Y818-H829 AromaticContact CD1-CD2 3.36Å; Y818-H829 WeakPolarHBondContact CD1-CD2 3.4Å; Y818-H829 AromaticContact CD1-CE1 3.87Å; Y818-H829 AromaticContact CD1-CG 3.22Å; Y818-H829 AromaticContact CD1-ND1 3.58Å; Y818-H829 AromaticContact CD1-NE2 3.77Å; Y818-H829 AromaticContact CD2-ND1 3.95Å; Y818-H829 HydrophobicContact CE1-CB 3.43Å; Y818-H829 VanDerWaalsContact CE1-CB 3.43Å; Y818-H829 AromaticContact CE1-CG 3.46Å; Y818-H829 VanDerWaalsContact CE1-CG 3.46Å; Y818-H829 AromaticContact CE1-ND1 3.93Å; Y818-H829 AromaticContact CG-CD2 3.88Å; Y818-H829 AromaticContact CG-CE1 3.59Å; Y818-H829 AromaticContact CG-CG 3.74Å; Y818-H829 AromaticContact CG-ND1 3.56Å; Y818-H829 AromaticContact CG-NE2 3.8Å; K825-H829 WeakPolarHBondContact O-CB 3.23Å; K825-H829 PolarHBondContact O-N 3.12Å; L826-H829 PolarHBondContact O-N 3.16Å; H829-R831 PolarHBondContact O-N 3.08Å; H829-T832 VanDerWaalsContact CA-OG1 3.31Å; H829-T832 WeakPolarHBondContact CA-OG1 3.47Å; H829-T832 CarbonylContact O-C 3.3Å; H829-T832 WeakPolarHBondContact O-CA 3.43Å; H829-T832 PolarHBondContact O-N 2.78Å; H829-T832 PolarHBondContact O-OG1 2.82Å; H829-Q833 WeakPolarHBondContact CE1-CG 3.36Å; H829-Q833 WeakPolarHBondContact NE2-CG 3.47Å; H829-Q833 PolarHBondContact O-N 2.81Å
830	M	70.6	Confident	66.8	Low	49 Å²	49	79.1 Å²	79.1	24%	0.241	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-26.7	177.5	-70.5	-161.5	78.6	0	0	112.9	L826 A828 H834	L826-M830 HydrophobicContact CD1-CG 4.42Å; L826-M830 HydrophobicContact CG-CG 4.41Å; L826-M830 WeakPolarHBondContact O-CG 3.24Å; L826-M830 PolarHBondContact O-N 3.3Å; A828-M830 PolarHBondContact O-N 3.33Å; M830-H834 PolarHBondContact O-CD2 3.38Å; M830-H834 PolarHBondContact O-N 2.84Å
831	R	68.1	Low	66.6	Low	145 Å²	145	82.4 Å²	82.4	55%	0.547	41%	0.407	S	S	.	.	H	α-helix	trans	-69.4	-48.2	168.9	-66	167.6	-170.6	177	4.5	110.4	Q827 A828 H829 Q833 H834 E835	Q827-R831 WeakPolarHBondContact O-CG 3.49Å; A828-R831 WeakPolarHBondContact O-CB 3.47Å; A828-R831 PolarHBondContact O-N 3.47Å; A828-R831 VanDerWaalsContact O-N 3.15Å; H829-R831 PolarHBondContact O-N 3.08Å; R831-Q833 PolarHBondContact O-N 3.21Å; R831-H834 CarbonylContact O-C 3.24Å; R831-H834 PolarHBondContact O-N 2.82Å; R831-E835 VanDerWaalsContact O-CG 3.27Å; R831-E835 WeakPolarHBondContact O-CG 3.4Å; R831-E835 PolarHBondContact O-N 2.86Å
832	T	63.1	Low	66.7	Low	70 Å²	70	80.8 Å²	80.8	43%	0.429	40%	0.397	S	S	.	.	H	α-helix	trans	-64.8	-18.4	178.8	56	0	0	0	0	114.8	A828 H829	A828-T832 PolarHBondContact O-N 3.36Å; A828-T832 VanDerWaalsContact O-N 3.1Å; H829-T832 VanDerWaalsContact CA-OG1 3.31Å; H829-T832 WeakPolarHBondContact CA-OG1 3.47Å; H829-T832 CarbonylContact O-C 3.3Å; H829-T832 WeakPolarHBondContact O-CA 3.43Å; H829-T832 PolarHBondContact O-N 2.78Å; H829-T832 PolarHBondContact O-OG1 2.82Å
833	Q	61.7	Low	66.5	Low	57 Å²	57	85 Å²	85	27%	0.266	43%	0.425	S	S	.	.	H	α-helix	trans	-82.2	-44.5	171	-67.1	-71.8	-107.2	0	0	112.1	C816 H829 R831 E835 Q836	C816-Q833 PolarHBondContact SG-OE1 3.43Å; H829-Q833 WeakPolarHBondContact CE1-CG 3.36Å; H829-Q833 WeakPolarHBondContact NE2-CG 3.47Å; H829-Q833 PolarHBondContact O-N 2.81Å; R831-Q833 PolarHBondContact O-N 3.21Å; Q833-E835 PolarHBondContact O-N 3.32Å; Q833-E835 VanDerWaalsContact O-N 3.11Å; Q833-Q836 PolarHBondContact O-N 3.25Å
834	H	57.4	Low	66.3	Low	122 Å²	122	80.9 Å²	80.9	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-64.8	-8.4	168.1	-79.8	-69.1	0	0	0	113.8	M830 R831 S838	M830-H834 PolarHBondContact O-CD2 3.38Å; M830-H834 PolarHBondContact O-N 2.84Å; R831-H834 CarbonylContact O-C 3.24Å; R831-H834 PolarHBondContact O-N 2.82Å; H834-S838 PolarHBondContact O-OG 3.11Å
835	E	53.8	Low	66.4	Low	56 Å²	56	74.2 Å²	74.2	26%	0.262	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-16.5	174.1	-78.4	165.5	-165.7	0	0	114.1	R831 Q833 S838	R831-E835 VanDerWaalsContact O-CG 3.27Å; R831-E835 WeakPolarHBondContact O-CG 3.4Å; R831-E835 PolarHBondContact O-N 2.86Å; Q833-E835 PolarHBondContact O-N 3.32Å; Q833-E835 VanDerWaalsContact O-N 3.11Å; E835-S838 WeakPolarHBondContact CA-OG 3.22Å; E835-S838 CarbonylContact O-C 3.48Å; E835-S838 PolarHBondContact O-N 3.31Å
836	Q	52.7	Low	66.1	Low	148 Å²	148	76.6 Å²	76.6	69%	0.692	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.9	177.1	-74.2	-174.3	-102.1	0	0	113.2	Q833	Q833-Q836 PolarHBondContact O-N 3.25Å
837	E	50.7	Low	65.5	Low	181 Å²	181	83.7 Å²	83.7	85%	0.846	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	1.7	171.6	-63.7	176.3	154.9	0	0	112.8
838	S	55.2	Low	65.4	Low	33 Å²	33	83.3 Å²	83.3	23%	0.231	43%	0.432	C	S	.	.			trans	-127.3	44.6	178.8	59	0	0	0	0	113.3	H834 E835 Q851	H834-S838 PolarHBondContact O-OG 3.11Å; E835-S838 WeakPolarHBondContact CA-OG 3.22Å; E835-S838 CarbonylContact O-C 3.48Å; E835-S838 PolarHBondContact O-N 3.31Å; S838-Q851 WeakPolarHBondContact O-CB 3.33Å; S838-Q851 PolarHBondContact O-N 3.28Å
839	C	61.3	Low	65.2	Low	75 Å²	75	83.4 Å²	83.4	51%	0.507	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	133.6	153.1	-81.7	0	0	0	0	110.1	T848	C839-T848 HydrophobicContact CB-CG2 3.78Å
840	A	70.1	Confident	64.8	Low	26 Å²	26	84.7 Å²	84.7	22%	0.215	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.6	178.8	0	0	0	0	0	109.8	Y849 L854	A840-Y849 PolarHBondContact N-O 3.2Å; A840-Y849 PolarHBondContact O-N 2.99Å; A840-L854 HydrophobicContact CB-CD2 3.46Å; A840-L854 VanDerWaalsContact CB-CD2 3.46Å
841	V	71.8	Confident	64.7	Low	82 Å²	82	87.3 Å²	87.3	50%	0.497	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.7	177.8	177.6	0	0	0	0	109.5	P843 Q846	V841-P843 WeakPolarHBondContact O-CD 3.16Å; V841-Q846 HydrophobicContact CG1-CB 4.4Å; V841-Q846 WeakPolarHBondContact CG1-O 3.45Å
842	C	73.9	Confident	64.3	Low	0 Å²	0	87.3 Å²	87.3	0%	0	45%	0.449	C	S	.	.			trans	-70.1	121.1	170.8	-176.5	0	0	0	0	110.3	I844 Q846 R847 Y849 L854 H857 H862	C842-I844 PolarHBondContact O-N 3.19Å; C842-Q846 WeakPolarHBondContact O-CA 3.35Å; C842-Q846 PolarHBondContact O-N 3.18Å; C842-R847 WeakPolarHBondContact CB-O 3.18Å; C842-R847 PolarHBondContact N-O 3.22Å; C842-Y849 HydrophobicContact CB-CD2 4.12Å; C842-Y849 HydrophobicContact CB-CE2 4.05Å; C842-L854 HydrophobicContact CB-CD1 3.8Å; C842-H857 PolarHBondContact SG-NE2 3.19Å; C842-H862 VanDerWaalsContact SG-CD2 3.5Å
843	P	68.5	Low	64.3	Low	108 Å²	108	92.5 Å²	92.5	70%	0.701	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.6	-177.7	-22.8	34.6	0	0	0	115.6	V841	V841-P843 WeakPolarHBondContact O-CD 3.16Å
844	I	69.4	Low	64.7	Low	66 Å²	66	90.6 Å²	90.6	34%	0.338	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-39.6	-168	-56.2	169	0	0	0	111.9	C842 L858 H862 K865	C842-I844 PolarHBondContact O-N 3.19Å; I844-L858 HydrophobicContact CD1-CD2 4.04Å; I844-H862 HydrophobicContact CB-CB 4.43Å; I844-H862 HydrophobicContact CD1-CB 3.56Å; I844-H862 HydrophobicContact CG2-CB 4.28Å; I844-H862 WeakPolarHBondContact CG2-ND1 3.42Å; I844-K865 HydrophobicContact CD1-CB 3.82Å
845	C	74.9	Confident	65.1	Low	42 Å²	42	92.2 Å²	92.2	28%	0.284	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	5.2	173.5	69.3	0	0	0	0	114.3	R847 H857 H862	C845-R847 PolarHBondContact O-N 3.37Å; C845-H857 PolarHBondContact SG-NE2 3.11Å; C845-H862 WeakPolarHBondContact CB-NE2 3.48Å; C845-H862 PolarHBondContact SG-NE2 2.96Å; C845-H862 VanDerWaalsContact SG-NE2 3.36Å
846	Q	66.6	Low	65.7	Low	160 Å²	160	96 Å²	96	75%	0.748	48%	0.476	S	S	*	.			trans	55.6	6.4	178.1	-56.3	-171.8	10.1	0	0	116.8	V841 C842	V841-Q846 HydrophobicContact CG1-CB 4.4Å; V841-Q846 WeakPolarHBondContact CG1-O 3.45Å; C842-Q846 WeakPolarHBondContact O-CA 3.35Å; C842-Q846 PolarHBondContact O-N 3.18Å
847	R	64.2	Low	66.8	Low	169 Å²	169	89.9 Å²	89.9	64%	0.638	45%	0.447	S	S	*	.			trans	-74.3	137.3	173.7	-67.8	171.4	-178	177.8	-0.4	110.8	C842 C845 Y849	C842-R847 WeakPolarHBondContact CB-O 3.18Å; C842-R847 PolarHBondContact N-O 3.22Å; C845-R847 PolarHBondContact O-N 3.37Å; R847-Y849 HydrophobicContact CB-CD2 4.38Å; R847-Y849 HydrophobicContact CB-CE2 3.51Å; R847-Y849 WeakPolarHBondContact O-CD2 3.27Å; R847-Y849 WeakPolarHBondContact O-CE2 3.31Å
848	T	67.9	Low	67.6	Low	89 Å²	89	82.4 Å²	82.4	55%	0.546	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.4	179.9	-54.5	0	0	0	0	111.3	C839	C839-T848 HydrophobicContact CB-CG2 3.78Å
849	Y	70.4	Confident	68.1	Low	53 Å²	53	83.8 Å²	83.8	21%	0.208	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.3	177.6	-61.5	-80.1	0	0	0	111.4	A840 C842 R847 Q851 L854 H857	A840-Y849 PolarHBondContact N-O 3.2Å; A840-Y849 PolarHBondContact O-N 2.99Å; C842-Y849 HydrophobicContact CB-CD2 4.12Å; C842-Y849 HydrophobicContact CB-CE2 4.05Å; R847-Y849 HydrophobicContact CB-CD2 4.38Å; R847-Y849 HydrophobicContact CB-CE2 3.51Å; R847-Y849 WeakPolarHBondContact O-CD2 3.27Å; R847-Y849 WeakPolarHBondContact O-CE2 3.31Å; Y849-Q851 PolarHBondContact O-N 3.03Å; Y849-L854 HydrophobicContact CD2-CD1 4.14Å; Y849-H857 AromaticContact CD2-CD2 3.55Å; Y849-H857 AromaticContact CE2-CD2 3.14Å; Y849-H857 WeakPolarHBondContact CE2-CD2 3.49Å; Y849-H857 AromaticContact CE2-CE1 3.98Å; Y849-H857 AromaticContact CE2-CG 3.72Å; Y849-H857 AromaticContact CE2-NE2 3.35Å; Y849-H857 WeakPolarHBondContact CE2-NE2 3.2Å; Y849-H857 AromaticContact CZ-CD2 3.75Å; Y849-H857 AromaticContact CZ-CG 3.87Å; Y849-H857 AromaticContact CZ-NE2 3.89Å
850	P	69.4	Low	68	Low	48 Å²	48	81.7 Å²	81.7	31%	0.312	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	138.3	167.6	-23.6	33.5	0	0	0	110.3	H852 R853 L854	P850-H852 PolarHBondContact O-N 3.35Å; P850-R853 CarbonylContact O-C 3.6Å; P850-R853 WeakPolarHBondContact O-CA 3.38Å; P850-R853 PolarHBondContact O-N 3.2Å; P850-L854 PolarHBondContact O-N 2.96Å
851	Q	66.6	Low	67.4	Low	103 Å²	103	82.7 Å²	82.7	48%	0.481	41%	0.406	S	S	.	.	H	α-helix	trans	-53.8	-33.1	-168.2	-163.5	-177.5	84	0	0	114.5	S838 Y849	S838-Q851 WeakPolarHBondContact O-CB 3.33Å; S838-Q851 PolarHBondContact O-N 3.28Å; Y849-Q851 PolarHBondContact O-N 3.03Å
852	H	60.6	Low	67.3	Low	145 Å²	145	80.7 Å²	80.7	67%	0.671	39%	0.391	S	S	*	.	H	α-helix	trans	-67.1	-37.6	174	-172.1	-73.4	0	0	0	113.1	P850	P850-H852 PolarHBondContact O-N 3.35Å
853	R	63.2	Low	66.5	Low	179 Å²	179	82 Å²	82	68%	0.675	40%	0.4	S	S	*	.	H	α-helix	trans	-78.9	-33.2	175	-73.4	-168.7	-180	-168.7	1.7	112.4	P850 K855 H856 H857	P850-R853 CarbonylContact O-C 3.6Å; P850-R853 WeakPolarHBondContact O-CA 3.38Å; P850-R853 PolarHBondContact O-N 3.2Å; R853-K855 VanDerWaalsContact C-N 3.27Å; R853-K855 PolarHBondContact O-N 3.38Å; R853-H856 WeakPolarHBondContact O-CA 3.43Å; R853-H856 WeakPolarHBondContact O-CB 3.26Å; R853-H856 PolarHBondContact O-N 2.98Å; R853-H857 PolarHBondContact O-N 3.19Å
854	L	71	Confident	65.7	Low	18 Å²	18	81.8 Å²	81.8	9%	0.094	39%	0.393	C	S	.	.	H	α-helix	trans	-55.1	-43.5	177.6	177.7	58.2	0	0	0	111.6	A840 C842 Y849 P850 H856 H857 L858	A840-L854 HydrophobicContact CB-CD2 3.46Å; A840-L854 VanDerWaalsContact CB-CD2 3.46Å; C842-L854 HydrophobicContact CB-CD1 3.8Å; Y849-L854 HydrophobicContact CD2-CD1 4.14Å; P850-L854 PolarHBondContact O-N 2.96Å; L854-H856 VanDerWaalsContact C-N 3.28Å; L854-H856 PolarHBondContact O-N 3.4Å; L854-H857 PolarHBondContact O-N 3.17Å; L854-L858 HydrophobicContact CD1-CD1 3.95Å; L854-L858 HydrophobicContact CD1-CG 3.92Å; L854-L858 HydrophobicContact CG-CD1 3.87Å; L854-L858 HydrophobicContact CG-CG 4.33Å; L854-L858 WeakPolarHBondContact O-CB 3.46Å; L854-L858 WeakPolarHBondContact O-CG 3.41Å; L854-L858 PolarHBondContact O-N 3.48Å
855	K	65.8	Low	64.7	Low	155 Å²	155	86.6 Å²	86.6	67%	0.674	41%	0.411	S	S	*	.	H	α-helix	trans	-66.3	-25.6	176.5	-71.6	-176.3	178.3	175.8	0	114.2	R853	R853-K855 VanDerWaalsContact C-N 3.27Å; R853-K855 PolarHBondContact O-N 3.38Å
856	H	66.5	Low	63.3	Low	136 Å²	136	87.6 Å²	87.6	63%	0.63	42%	0.416	S	S	*	.	H	α-helix	trans	-77.3	-50.2	172.3	-176.4	76.1	0	0	0	110.3	R853 L854 L858 K859 S860	R853-H856 WeakPolarHBondContact O-CA 3.43Å; R853-H856 WeakPolarHBondContact O-CB 3.26Å; R853-H856 PolarHBondContact O-N 2.98Å; L854-H856 VanDerWaalsContact C-N 3.28Å; L854-H856 PolarHBondContact O-N 3.4Å; H856-L858 PolarHBondContact O-N 2.94Å; H856-K859 CarbonylContact O-C 3.6Å; H856-K859 WeakPolarHBondContact O-CA 3.43Å; H856-K859 WeakPolarHBondContact O-CB 3.43Å; H856-K859 PolarHBondContact O-N 2.88Å; H856-S860 WeakPolarHBondContact O-CB 3.5Å; H856-S860 PolarHBondContact O-N 3.06Å; H856-S860 PolarHBondContact O-OG 3Å
857	H	74.6	Confident	62	Low	19 Å²	19	85.3 Å²	85.3	9%	0.088	42%	0.415	C	S	.	.	H	α-helix	trans	-57.5	-45.9	177.8	165.3	58.4	0	0	0	113.1	C842 C845 Y849 R853 L854 K859 S860 S861 H862	C842-H857 PolarHBondContact SG-NE2 3.19Å; C845-H857 PolarHBondContact SG-NE2 3.11Å; Y849-H857 AromaticContact CD2-CD2 3.55Å; Y849-H857 AromaticContact CE2-CD2 3.14Å; Y849-H857 WeakPolarHBondContact CE2-CD2 3.49Å; Y849-H857 AromaticContact CE2-CE1 3.98Å; Y849-H857 AromaticContact CE2-CG 3.72Å; Y849-H857 AromaticContact CE2-NE2 3.35Å; Y849-H857 WeakPolarHBondContact CE2-NE2 3.2Å; Y849-H857 AromaticContact CZ-CD2 3.75Å; Y849-H857 AromaticContact CZ-CG 3.87Å; Y849-H857 AromaticContact CZ-NE2 3.89Å; R853-H857 PolarHBondContact O-N 3.19Å; L854-H857 PolarHBondContact O-N 3.17Å; H857-K859 PolarHBondContact O-N 2.92Å; H857-S860 WeakPolarHBondContact CA-OG 3.38Å; H857-S860 PolarHBondContact O-N 3.38Å; H857-S860 VanDerWaalsContact O-N 3.13Å; H857-S861 VanDerWaalsContact CE1-CB 3.47Å; H857-S861 WeakPolarHBondContact CE1-CB 3.35Å; H857-S861 WeakPolarHBondContact ND1-CB 3.46Å; H857-S861 PolarHBondContact ND1-OG 3.49Å; H857-S861 VanDerWaalsContact ND1-OG 3.12Å; H857-S861 VanDerWaalsContact O-CB 3.3Å; H857-S861 WeakPolarHBondContact O-CB 3.11Å; H857-S861 PolarHBondContact O-N 2.93Å; H857-S861 PolarHBondContact O-OG 3.39Å; H857-H862 AromaticContact CE1-CD2 3.68Å; H857-H862 AromaticContact CE1-NE2 3.42Å; H857-H862 PolarHBondContact CE1-NE2 3.14Å; H857-H862 AromaticContact NE2-CD2 3.46Å; H857-H862 PolarHBondContact NE2-CD2 3.37Å; H857-H862 AromaticContact NE2-NE2 3.35Å; H857-H862 PolarHBondContact NE2-NE2 3.31Å
858	L	68.4	Low	61.1	Low	25 Å²	25	84.6 Å²	84.6	13%	0.131	43%	0.429	C	S	.	.	H	α-helix	trans	-56.1	-34.8	172.6	-76.8	168.2	0	0	0	112.1	I844 L854 H856 H862 V866	I844-L858 HydrophobicContact CD1-CD2 4.04Å; L854-L858 HydrophobicContact CD1-CD1 3.95Å; L854-L858 HydrophobicContact CD1-CG 3.92Å; L854-L858 HydrophobicContact CG-CD1 3.87Å; L854-L858 HydrophobicContact CG-CG 4.33Å; L854-L858 WeakPolarHBondContact O-CB 3.46Å; L854-L858 WeakPolarHBondContact O-CG 3.41Å; L854-L858 PolarHBondContact O-N 3.48Å; H856-L858 PolarHBondContact O-N 2.94Å; L858-H862 CarbonylContact O-C 3.6Å; L858-H862 PolarHBondContact O-N 3.29Å; L858-V866 HydrophobicContact CB-CG2 4.06Å
859	K	65.8	Low	59.5	Low	62 Å²	62	84.3 Å²	84.3	27%	0.27	44%	0.444	S	S	.	.	H	α-helix	trans	-83.9	-23	178.8	-156.2	-175.7	-178.5	-159.4	0	113.9	H856 H857 Q876 A878 L889	H856-K859 CarbonylContact O-C 3.6Å; H856-K859 WeakPolarHBondContact O-CA 3.43Å; H856-K859 WeakPolarHBondContact O-CB 3.43Å; H856-K859 PolarHBondContact O-N 2.88Å; H857-K859 PolarHBondContact O-N 2.92Å; K859-Q876 WeakPolarHBondContact CE-O 3.3Å; K859-Q876 PolarHBondContact NZ-O 2.84Å; K859-Q876 VanDerWaalsContact NZ-O 3.13Å; K859-A878 VanDerWaalsContact O-CB 3.25Å; K859-A878 WeakPolarHBondContact O-CB 3.46Å; K859-L889 HydrophobicContact CD-CD2 3.84Å; K859-L889 HydrophobicContact CG-CD2 4.29Å
860	S	58.3	Low	57.7	Low	31 Å²	31	85 Å²	85	22%	0.217	47%	0.467	C	S	.	.	H	α-helix	trans	-108.2	-2.3	-175.9	69.6	0	0	0	0	114.5	H856 H857	H856-S860 WeakPolarHBondContact O-CB 3.5Å; H856-S860 PolarHBondContact O-N 3.06Å; H856-S860 PolarHBondContact O-OG 3Å; H857-S860 WeakPolarHBondContact CA-OG 3.38Å; H857-S860 PolarHBondContact O-N 3.38Å; H857-S860 VanDerWaalsContact O-N 3.13Å
861	S	57.8	Low	56.1	Low	47 Å²	47	90.6 Å²	90.6	33%	0.329	49%	0.487	S	S	.	.	H	α-helix	trans	-142.9	-21	-176.3	-50.6	0	0	0	0	113.6	H857	H857-S861 VanDerWaalsContact CE1-CB 3.47Å; H857-S861 WeakPolarHBondContact CE1-CB 3.35Å; H857-S861 WeakPolarHBondContact ND1-CB 3.46Å; H857-S861 PolarHBondContact ND1-OG 3.49Å; H857-S861 VanDerWaalsContact ND1-OG 3.12Å; H857-S861 VanDerWaalsContact O-CB 3.3Å; H857-S861 WeakPolarHBondContact O-CB 3.11Å; H857-S861 PolarHBondContact O-N 2.93Å; H857-S861 PolarHBondContact O-OG 3.39Å
862	H	69.5	Low	54.4	Low	39 Å²	39	88.3 Å²	88.3	18%	0.181	49%	0.491	C	S	.	.			trans	-138.7	45.5	179.7	-54.6	-55.4	0	0	0	113.9	C842 I844 C845 H857 L858 D864 K865 V866	C842-H862 VanDerWaalsContact SG-CD2 3.5Å; I844-H862 HydrophobicContact CB-CB 4.43Å; I844-H862 HydrophobicContact CD1-CB 3.56Å; I844-H862 HydrophobicContact CG2-CB 4.28Å; I844-H862 WeakPolarHBondContact CG2-ND1 3.42Å; C845-H862 WeakPolarHBondContact CB-NE2 3.48Å; C845-H862 PolarHBondContact SG-NE2 2.96Å; C845-H862 VanDerWaalsContact SG-NE2 3.36Å; H857-H862 AromaticContact CE1-CD2 3.68Å; H857-H862 AromaticContact CE1-NE2 3.42Å; H857-H862 PolarHBondContact CE1-NE2 3.14Å; H857-H862 AromaticContact NE2-CD2 3.46Å; H857-H862 PolarHBondContact NE2-CD2 3.37Å; H857-H862 AromaticContact NE2-NE2 3.35Å; H857-H862 PolarHBondContact NE2-NE2 3.31Å; L858-H862 CarbonylContact O-C 3.6Å; L858-H862 PolarHBondContact O-N 3.29Å; H862-D864 VanDerWaalsContact C-N 3.27Å; H862-D864 PolarHBondContact O-N 3.1Å; H862-D864 VanDerWaalsContact O-N 3.16Å; H862-K865 PolarHBondContact O-N 2.88Å; H862-V866 WeakPolarHBondContact O-CG2 3.11Å
863	P	56.9	Low	53.6	Low	29 Å²	29	87.8 Å²	87.8	19%	0.188	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-59.9	-31.1	-168.9	24.5	-34.1	0	0	0	114.5	A878 Y887	P863-A878 HydrophobicContact CB-CB 4.17Å; P863-A878 HydrophobicContact CG-CB 4.46Å; P863-Y887 HydrophobicContact CG-CD1 3.7Å; P863-Y887 HydrophobicContact CG-CE1 3.9Å; P863-Y887 HydrophobicContact CG-CG 4.3Å
864	D	51.5	Low	52.2	Low	102 Å²	102	86.9 Å²	86.9	55%	0.545	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-86.9	-2.7	-172.4	-57.2	-71.3	0	0	0	115.2	H862 R877	H862-D864 VanDerWaalsContact C-N 3.27Å; H862-D864 PolarHBondContact O-N 3.1Å; H862-D864 VanDerWaalsContact O-N 3.16Å; D864-R877 IonicContact OD1-CZ 3.58Å; D864-R877 IonicContact OD1-NE 3.86Å; D864-R877 IonicContact OD1-NH2 3.89Å; D864-R877 PolarHBondContact OD1-NH2 3.47Å
865	K	48.9	Very low	50.6	Low	167 Å²	167	91.8 Å²	91.8	73%	0.726	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-128	25.3	179.9	-69.7	-171.3	179.3	-177.5	0	114.5	I844 H862 P867	I844-K865 HydrophobicContact CD1-CB 3.82Å; H862-K865 PolarHBondContact O-N 2.88Å; K865-P867 WeakPolarHBondContact O-CD 3.5Å
866	V	44.8	Very low	49.6	Very low	63 Å²	63	88.3 Å²	88.3	38%	0.382	52%	0.522	S	S	.	.			trans	-84.2	118.2	176.1	-172.6	0	0	0	0	111.4	L858 H862	L858-V866 HydrophobicContact CB-CG2 4.06Å; H862-V866 WeakPolarHBondContact O-CG2 3.11Å
867	P	39.7	Very low	48.7	Very low	113 Å²	113	89.7 Å²	89.7	73%	0.734	52%	0.522	S	S	*	.			trans	-64.5	138.1	177.9	-22.4	34.8	0	0	0	112.8	K865 G869	K865-P867 WeakPolarHBondContact O-CD 3.5Å; P867-G869 VanDerWaalsContact C-N 3.29Å; P867-G869 PolarHBondContact O-N 2.77Å
868	V	44.8	Very low	48.1	Very low	154 Å²	154	89.2 Å²	89.2	93%	0.933	52%	0.521	S	S	*	.			trans	-79	69.8	-170.1	-172.6	0	0	0	0	112.5	G870	V868-G870 PolarHBondContact O-N 2.92Å
869	G	35.6	Very low	47.9	Very low	82 Å²	82	90.7 Å²	90.7	85%	0.845	53%	0.527	S	S	*	.			trans	-96.2	75.4	-178	0	0	0	0	0	115.3	P867	P867-G869 VanDerWaalsContact C-N 3.29Å; P867-G869 PolarHBondContact O-N 2.77Å
870	G	32.6	Very low	48.1	Very low	69 Å²	69	92.3 Å²	92.3	71%	0.711	54%	0.535	S	S	*	.	S	Bend	trans	127.5	125.6	164.5	0	0	0	0	0	115.9	V868 G872	V868-G870 PolarHBondContact O-N 2.92Å; G870-G872 PolarHBondContact O-N 2.97Å
871	K	36.4	Very low	49.1	Very low	164 Å²	164	90.9 Å²	90.9	71%	0.713	53%	0.525	S	S	*	.			trans	-84.4	116.3	-166.7	-71.1	176.8	171.6	174	0	114.7	E414	E414-K871 IonicContact OE1-NZ 2.67Å; E414-K871 PolarHBondContact OE1-NZ 3.36Å; E414-K871 IonicContact OE2-NZ 3.85Å; E414-K871 PolarHBondContact OE2-NZ 3.34Å
872	G	29.9	Very low	49.8	Very low	56 Å²	56	93.5 Å²	93.5	58%	0.577	54%	0.541	S	S	*	.			trans	-165.5	105	163.4	0	0	0	0	0	110.8	G870 M874	G870-G872 PolarHBondContact O-N 2.97Å; G872-M874 PolarHBondContact O-N 3.26Å; G872-M874 VanDerWaalsContact O-N 3.15Å
873	P	44.3	Very low	49.9	Very low	133 Å²	133	97.6 Å²	97.6	86%	0.864	56%	0.555	S	S	*	*	S	Bend	trans	-84.4	94.9	-167.6	32	-34.6	0	0	0	113
874	M	33.2	Very low	51	Low	161 Å²	161	98 Å²	98	79%	0.793	56%	0.558	S	S	*	*			trans	-158.6	63.4	145.9	-98.8	-163	84.3	0	0	109	G872 Q876	G872-M874 PolarHBondContact O-N 3.26Å; G872-M874 VanDerWaalsContact O-N 3.15Å; M874-Q876 PolarHBondContact O-N 3.27Å
875	V	37.1	Very low	51.9	Low	120 Å²	120	98.8 Å²	98.8	73%	0.727	56%	0.563	S	S	*	*			trans	-86.1	90.7	166.9	-175.1	0	0	0	0	107.3	R877	V875-R877 PolarHBondContact O-N 3.18Å
876	Q	45.3	Very low	52.8	Low	82 Å²	82	93.2 Å²	93.2	38%	0.383	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-54	121.2	158.1	-74.1	167.2	-54.4	0	0	107.3	K859 M874 L889 K890	K859-Q876 WeakPolarHBondContact CE-O 3.3Å; K859-Q876 PolarHBondContact NZ-O 2.84Å; K859-Q876 VanDerWaalsContact NZ-O 3.13Å; M874-Q876 PolarHBondContact O-N 3.27Å; Q876-L889 HydrophobicContact CB-CB 4.39Å; Q876-K890 PolarHBondContact NE2-O 3.15Å
877	R	47.1	Very low	54.2	Low	165 Å²	165	93 Å²	93	62%	0.623	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-58.9	143.2	170.8	-158.1	169.6	-169.6	150.1	3.8	108.1	D864 V875 K890	D864-R877 IonicContact OD1-CZ 3.58Å; D864-R877 IonicContact OD1-NE 3.86Å; D864-R877 IonicContact OD1-NH2 3.89Å; D864-R877 PolarHBondContact OD1-NH2 3.47Å; V875-R877 PolarHBondContact O-N 3.18Å; R877-K890 PolarHBondContact O-N 3.46Å
878	A	61.2	Low	55.9	Low	9 Å²	9	90 Å²	90	7%	0.074	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.5	173.2	0	0	0	0	0	107.9	K859 P863 F888 L889	K859-A878 VanDerWaalsContact O-CB 3.25Å; K859-A878 WeakPolarHBondContact O-CB 3.46Å; P863-A878 HydrophobicContact CB-CB 4.17Å; P863-A878 HydrophobicContact CG-CB 4.46Å; A878-F888 CarbonylContact C-O 3.49Å; A878-F888 WeakPolarHBondContact CA-O 3.25Å; A878-L889 HydrophobicContact CB-CD2 4.28Å
879	E	65.9	Low	57.4	Low	56 Å²	56	85.2 Å²	85.2	26%	0.262	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.4	173.4	-55.9	-62	172.9	0	0	108.6	Y887 F888 K890 F895	E879-Y887 CarbonylContact O-C 3.08Å; E879-Y887 VanDerWaalsContact O-CA 3.31Å; E879-Y887 WeakPolarHBondContact O-CA 3.28Å; E879-F888 PolarHBondContact N-O 3.48Å; E879-F888 PolarHBondContact O-N 3.45Å; E879-K890 HydrophobicContact CG-CB 4.06Å; E879-K890 HydrophobicContact CG-CD 4.19Å; E879-K890 HydrophobicContact CG-CG 3.94Å; E879-K890 WeakPolarHBondContact OE1-CD 3.49Å; E879-K890 VanDerWaalsContact OE1-CE 3.23Å; E879-K890 WeakPolarHBondContact OE1-CE 3.17Å; E879-K890 IonicContact OE1-NZ 3.62Å; E879-K890 PolarHBondContact OE1-NZ 3.47Å; E879-F895 HydrophobicContact CB-CE1 4.38Å; E879-F895 HydrophobicContact CB-CE2 4.45Å; E879-F895 HydrophobicContact CB-CZ 3.93Å
880	K	70.3	Confident	58.3	Low	96 Å²	96	86.5 Å²	86.5	42%	0.417	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	145.2	170.2	-162.2	-170.4	-179.7	-174.8	0	109	D885 Y887	K880-D885 WeakPolarHBondContact CE-OD1 3.34Å; K880-D885 IonicContact NZ-OD1 2.92Å; K880-D885 PolarHBondContact NZ-OD1 2.91Å; K880-Y887 HydrophobicContact CB-CD1 3.85Å; K880-Y887 HydrophobicContact CB-CE1 3.72Å; K880-Y887 HydrophobicContact CD-CE1 4.46Å; K880-Y887 HydrophobicContact CG-CD1 4.19Å; K880-Y887 HydrophobicContact CG-CE1 3.87Å; K880-Y887 HydrophobicContact CG-CE2 4.34Å
881	C	77.8	Confident	59.5	Low	1 Å²	1	90.1 Å²	90.1	1%	0.007	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	134.6	164.6	-173	0	0	0	0	109.9	Y883 S886 H898	C881-Y883 PolarHBondContact O-N 2.93Å; C881-Y883 VanDerWaalsContact O-N 3.09Å; C881-S886 WeakPolarHBondContact CB-O 3.4Å; C881-S886 PolarHBondContact N-O 3.3Å; C881-H898 VanDerWaalsContact CB-NE2 3.32Å; C881-H898 WeakPolarHBondContact CB-NE2 3.24Å; C881-H898 PolarHBondContact SG-CD2 3.21Å; C881-H898 PolarHBondContact SG-NE2 3.03Å
882	P	73.4	Confident	61.1	Low	103 Å²	103	83.8 Å²	83.8	67%	0.669	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.4	173.6	-25.6	35.5	0	0	0	114
883	Y	71.6	Confident	63	Low	125 Å²	125	85.2 Å²	85.2	49%	0.49	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-2	-169.6	-49.1	-73.9	0	0	0	114.7	C881 I899 H902 Q903	C881-Y883 PolarHBondContact O-N 2.93Å; C881-Y883 VanDerWaalsContact O-N 3.09Å; Y883-I899 HydrophobicContact CE2-CG2 4.43Å; Y883-H902 VanDerWaalsContact CB-CG 3.48Å; Y883-H902 VanDerWaalsContact CB-ND1 3.34Å; Y883-H902 WeakPolarHBondContact CB-ND1 3.43Å; Y883-H902 HydrophobicContact CD2-CB 3.71Å; Y883-H902 HydrophobicContact CE2-CB 4.45Å; Y883-H902 HydrophobicContact CG-CB 3.91Å; Y883-H902 PolarHBondContact O-CE1 2.89Å; Y883-Q903 HydrophobicContact CE2-CG 4.02Å; Y883-Q903 PolarHBondContact OH-NE2 3.29Å
884	C	79.5	Confident	64.4	Low	37 Å²	37	83.3 Å²	83.3	25%	0.25	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	172.2	168.7	73	0	0	0	0	113.3	S886 H898 H902	C884-S886 PolarHBondContact O-N 3.14Å; C884-S886 PolarHBondContact SG-OG 3.36Å; C884-H898 PolarHBondContact SG-CE1 3.3Å; C884-H898 PolarHBondContact SG-NE2 2.89Å; C884-H902 PolarHBondContact SG-NE2 2.99Å; C884-H902 VanDerWaalsContact SG-NE2 3.38Å
885	D	70.1	Confident	66.6	Low	119 Å²	119	77.1 Å²	77.1	64%	0.636	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	23.8	-179.2	-54.8	-63.1	0	0	0	116	K880 Y887	K880-D885 WeakPolarHBondContact CE-OD1 3.34Å; K880-D885 IonicContact NZ-OD1 2.92Å; K880-D885 PolarHBondContact NZ-OD1 2.91Å; D885-Y887 WeakPolarHBondContact O-CD2 3.39Å
886	S	67.4	Low	68.5	Low	49 Å²	49	75.7 Å²	75.7	34%	0.343	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.2	175.1	-62	0	0	0	0	111.1	C881 C884 F888	C881-S886 WeakPolarHBondContact CB-O 3.4Å; C881-S886 PolarHBondContact N-O 3.3Å; C884-S886 PolarHBondContact O-N 3.14Å; C884-S886 PolarHBondContact SG-OG 3.36Å; S886-F888 VanDerWaalsContact CB-CE2 3.4Å
887	Y	74.7	Confident	70.1	Confident	60 Å²	60	74.5 Å²	74.5	24%	0.235	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	134.8	179.5	-58.8	-107.4	0	0	0	111.8	P863 E879 K880 D885	P863-Y887 HydrophobicContact CG-CD1 3.7Å; P863-Y887 HydrophobicContact CG-CE1 3.9Å; P863-Y887 HydrophobicContact CG-CG 4.3Å; E879-Y887 CarbonylContact O-C 3.08Å; E879-Y887 VanDerWaalsContact O-CA 3.31Å; E879-Y887 WeakPolarHBondContact O-CA 3.28Å; K880-Y887 HydrophobicContact CB-CD1 3.85Å; K880-Y887 HydrophobicContact CB-CE1 3.72Å; K880-Y887 HydrophobicContact CD-CE1 4.46Å; K880-Y887 HydrophobicContact CG-CD1 4.19Å; K880-Y887 HydrophobicContact CG-CE1 3.87Å; K880-Y887 HydrophobicContact CG-CE2 4.34Å; D885-Y887 WeakPolarHBondContact O-CD2 3.39Å
888	F	75.9	Confident	71.6	Confident	48 Å²	48	68.3 Å²	68.3	21%	0.211	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	157.7	-176.5	-59.4	-101.4	0	0	0	111.7	A878 E879 S886 K890 D894 F895 H898	A878-F888 CarbonylContact C-O 3.49Å; A878-F888 WeakPolarHBondContact CA-O 3.25Å; E879-F888 PolarHBondContact N-O 3.48Å; E879-F888 PolarHBondContact O-N 3.45Å; S886-F888 VanDerWaalsContact CB-CE2 3.4Å; F888-K890 PolarHBondContact O-N 3.28Å; F888-D894 HydrophobicContact CD1-CB 4.33Å; F888-F895 HydrophobicContact CB-CB 3.58Å; F888-F895 HydrophobicContact CB-CD2 3.57Å; F888-F895 HydrophobicContact CB-CE2 4.49Å; F888-F895 HydrophobicContact CB-CG 3.89Å; F888-F895 AromaticContact CD2-CD2 3.66Å; F888-F895 HydrophobicContact CD2-CD2 3.66Å; F888-F895 HydrophobicContact CD2-CE2 4.32Å; F888-F895 HydrophobicContact CG-CB 4.08Å; F888-F895 AromaticContact CG-CD2 3.83Å; F888-F895 HydrophobicContact CG-CD2 3.83Å; F888-F895 HydrophobicContact CG-CG 4.42Å; F888-H898 AromaticContact CD2-CD2 3.99Å; F888-H898 HydrophobicContact CE1-CB 3.98Å; F888-H898 HydrophobicContact CE2-CB 3.99Å; F888-H898 AromaticContact CE2-CD2 3.13Å; F888-H898 WeakPolarHBondContact CE2-CD2 3.17Å; F888-H898 AromaticContact CE2-CG 3.47Å; F888-H898 VanDerWaalsContact CE2-CG 3.47Å; F888-H898 AromaticContact CE2-NE2 3.55Å; F888-H898 HydrophobicContact CZ-CB 3.56Å; F888-H898 AromaticContact CZ-CD2 3.53Å; F888-H898 AromaticContact CZ-CG 3.3Å; F888-H898 AromaticContact CZ-ND1 3.72Å
889	L	75.1	Confident	72.5	Confident	54 Å²	54	68.8 Å²	68.8	28%	0.283	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	133.2	-179.5	-54	-171.9	0	0	0	110.9	K859 Q876 A878 N891 S892	K859-L889 HydrophobicContact CD-CD2 3.84Å; K859-L889 HydrophobicContact CG-CD2 4.29Å; Q876-L889 HydrophobicContact CB-CB 4.39Å; A878-L889 HydrophobicContact CB-CD2 4.28Å; L889-N891 PolarHBondContact O-N 3.32Å; L889-S892 VanDerWaalsContact O-CB 3.26Å; L889-S892 WeakPolarHBondContact O-CB 3.43Å; L889-S892 PolarHBondContact O-N 3.37Å; L889-S892 PolarHBondContact O-OG 3.38Å
890	K	55.9	Low	73.3	Confident	110 Å²	110	68.6 Å²	68.6	48%	0.478	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	127.8	176.7	-155.8	172.4	-157.8	141	0	110.7	Q876 R877 E879 F888	Q876-K890 PolarHBondContact NE2-O 3.15Å; R877-K890 PolarHBondContact O-N 3.46Å; E879-K890 HydrophobicContact CG-CB 4.06Å; E879-K890 HydrophobicContact CG-CD 4.19Å; E879-K890 HydrophobicContact CG-CG 3.94Å; E879-K890 WeakPolarHBondContact OE1-CD 3.49Å; E879-K890 VanDerWaalsContact OE1-CE 3.23Å; E879-K890 WeakPolarHBondContact OE1-CE 3.17Å; E879-K890 IonicContact OE1-NZ 3.62Å; E879-K890 PolarHBondContact OE1-NZ 3.47Å; F888-K890 PolarHBondContact O-N 3.28Å
891	N	57	Low	73.6	Confident	145 Å²	145	67.2 Å²	67.2	78%	0.775	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	27.2	-174.2	-53.5	12	0	0	0	115.3	L889	L889-N891 PolarHBondContact O-N 3.32Å
892	S	69.7	Low	73.5	Confident	30 Å²	30	71.1 Å²	71.1	21%	0.21	38%	0.376	C	S	.	.			trans	-81.7	144.3	166.3	59.9	0	0	0	0	112.1	L889 D894 F895 Q896	L889-S892 VanDerWaalsContact O-CB 3.26Å; L889-S892 WeakPolarHBondContact O-CB 3.43Å; L889-S892 PolarHBondContact O-N 3.37Å; L889-S892 PolarHBondContact O-OG 3.38Å; S892-D894 PolarHBondContact O-N 3.25Å; S892-F895 PolarHBondContact O-N 3.12Å; S892-F895 WeakPolarHBondContact OG-CB 3.48Å; S892-F895 PolarHBondContact OG-N 3.13Å; S892-Q896 PolarHBondContact O-N 2.87Å
893	S	71.4	Confident	73.4	Confident	87 Å²	87	70.3 Å²	70.3	61%	0.608	36%	0.364	S	S	*	.	H	α-helix	trans	-53.7	-32.8	169.4	41.5	0	0	0	0	112.3	Q896 Q897	S893-Q896 PolarHBondContact O-N 3.08Å; S893-Q897 WeakPolarHBondContact O-CB 3.4Å; S893-Q897 PolarHBondContact O-N 2.86Å
894	D	73.1	Confident	73.5	Confident	92 Å²	92	66.5 Å²	66.5	49%	0.492	36%	0.362	S	S	.	.	H	α-helix	trans	-78.9	-32.6	-168.4	-47.8	-10.5	0	0	0	110.3	F888 S892 H898	F888-D894 HydrophobicContact CD1-CB 4.33Å; S892-D894 PolarHBondContact O-N 3.25Å; D894-H898 WeakPolarHBondContact O-CB 3.43Å; D894-H898 PolarHBondContact O-N 2.82Å
895	F	79.8	Confident	73.1	Confident	32 Å²	32	68.8 Å²	68.8	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-61.9	-49.4	168.1	-172.4	-134.8	0	0	0	111.4	E879 F888 S892 Q897 H898 I899	E879-F895 HydrophobicContact CB-CE1 4.38Å; E879-F895 HydrophobicContact CB-CE2 4.45Å; E879-F895 HydrophobicContact CB-CZ 3.93Å; F888-F895 HydrophobicContact CB-CB 3.58Å; F888-F895 HydrophobicContact CB-CD2 3.57Å; F888-F895 HydrophobicContact CB-CE2 4.49Å; F888-F895 HydrophobicContact CB-CG 3.89Å; F888-F895 AromaticContact CD2-CD2 3.66Å; F888-F895 HydrophobicContact CD2-CD2 3.66Å; F888-F895 HydrophobicContact CD2-CE2 4.32Å; F888-F895 HydrophobicContact CG-CB 4.08Å; F888-F895 AromaticContact CG-CD2 3.83Å; F888-F895 HydrophobicContact CG-CD2 3.83Å; F888-F895 HydrophobicContact CG-CG 4.42Å; S892-F895 PolarHBondContact O-N 3.12Å; S892-F895 WeakPolarHBondContact OG-CB 3.48Å; S892-F895 PolarHBondContact OG-N 3.13Å; F895-Q897 PolarHBondContact O-N 2.77Å; F895-H898 WeakPolarHBondContact O-CB 3.5Å; F895-H898 PolarHBondContact O-N 3.34Å; F895-H898 VanDerWaalsContact O-N 3.17Å; F895-I899 HydrophobicContact CD1-CD1 3.89Å; F895-I899 HydrophobicContact CD2-CD1 4.04Å; F895-I899 HydrophobicContact CD2-CG1 4.41Å; F895-I899 HydrophobicContact CE1-CD1 3.67Å; F895-I899 HydrophobicContact CE2-CD1 3.86Å; F895-I899 HydrophobicContact CE2-CG1 4.35Å; F895-I899 HydrophobicContact CG-CD1 4.09Å; F895-I899 HydrophobicContact CZ-CD1 3.68Å; F895-I899 WeakPolarHBondContact O-CG1 3.45Å; F895-I899 PolarHBondContact O-N 2.84Å
896	Q	76.6	Confident	73.6	Confident	89 Å²	89	68.6 Å²	68.6	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-64.9	-42.4	-179	-160.4	69.2	18	0	0	111.5	S892 S893 H898 I899 W900	S892-Q896 PolarHBondContact O-N 2.87Å; S893-Q896 PolarHBondContact O-N 3.08Å; Q896-H898 VanDerWaalsContact C-N 3.28Å; Q896-H898 PolarHBondContact O-N 2.95Å; Q896-I899 PolarHBondContact O-N 2.71Å; Q896-W900 HydrophobicContact CG-CD2 4.25Å; Q896-W900 HydrophobicContact CG-CH2 4.11Å; Q896-W900 HydrophobicContact CG-CZ2 3.64Å; Q896-W900 WeakPolarHBondContact O-CB 3.49Å; Q896-W900 PolarHBondContact O-N 3.12Å
897	Q	78.1	Confident	74	Confident	58 Å²	58	69 Å²	69	27%	0.271	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-36.2	174.3	-174.8	-168.1	-33.3	0	0	112.4	S893 F895 A901 C918 N919	S893-Q897 WeakPolarHBondContact O-CB 3.4Å; S893-Q897 PolarHBondContact O-N 2.86Å; F895-Q897 PolarHBondContact O-N 2.77Å; Q897-A901 PolarHBondContact O-N 3.13Å; Q897-C918 HydrophobicContact CG-CB 4.37Å; Q897-N919 HydrophobicContact CG-CB 4.35Å; Q897-N919 PolarHBondContact OE1-ND2 3.45Å
898	H	79.8	Confident	74.3	Confident	35 Å²	35	69.4 Å²	69.4	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-72	-43.1	177.2	171.2	72.6	0	0	0	112.1	C881 C884 F888 D894 F895 Q896 W900 A901 H902	C881-H898 VanDerWaalsContact CB-NE2 3.32Å; C881-H898 WeakPolarHBondContact CB-NE2 3.24Å; C881-H898 PolarHBondContact SG-CD2 3.21Å; C881-H898 PolarHBondContact SG-NE2 3.03Å; C884-H898 PolarHBondContact SG-CE1 3.3Å; C884-H898 PolarHBondContact SG-NE2 2.89Å; F888-H898 AromaticContact CD2-CD2 3.99Å; F888-H898 HydrophobicContact CE1-CB 3.98Å; F888-H898 HydrophobicContact CE2-CB 3.99Å; F888-H898 AromaticContact CE2-CD2 3.13Å; F888-H898 WeakPolarHBondContact CE2-CD2 3.17Å; F888-H898 AromaticContact CE2-CG 3.47Å; F888-H898 VanDerWaalsContact CE2-CG 3.47Å; F888-H898 AromaticContact CE2-NE2 3.55Å; F888-H898 HydrophobicContact CZ-CB 3.56Å; F888-H898 AromaticContact CZ-CD2 3.53Å; F888-H898 AromaticContact CZ-CG 3.3Å; F888-H898 AromaticContact CZ-ND1 3.72Å; D894-H898 WeakPolarHBondContact O-CB 3.43Å; D894-H898 PolarHBondContact O-N 2.82Å; F895-H898 WeakPolarHBondContact O-CB 3.5Å; F895-H898 PolarHBondContact O-N 3.34Å; F895-H898 VanDerWaalsContact O-N 3.17Å; Q896-H898 VanDerWaalsContact C-N 3.28Å; Q896-H898 PolarHBondContact O-N 2.95Å; H898-W900 VanDerWaalsContact C-N 3.3Å; H898-W900 PolarHBondContact O-N 2.9Å; H898-A901 WeakPolarHBondContact O-CA 3.41Å; H898-A901 VanDerWaalsContact O-CB 3.31Å; H898-A901 WeakPolarHBondContact O-CB 3.41Å; H898-A901 PolarHBondContact O-N 2.71Å; H898-H902 AromaticContact CE1-CD2 3.62Å; H898-H902 AromaticContact CE1-NE2 3.21Å; H898-H902 PolarHBondContact CE1-NE2 3.06Å; H898-H902 AromaticContact NE2-CD2 3.62Å; H898-H902 AromaticContact NE2-NE2 3.38Å; H898-H902 PolarHBondContact NE2-NE2 2.9Å; H898-H902 PolarHBondContact O-CD2 3.25Å; H898-H902 PolarHBondContact O-N 3.14Å
899	I	79.3	Confident	74.4	Confident	18 Å²	18	70.2 Å²	70.2	9%	0.092	38%	0.377	C	S	.	.	H	α-helix	trans	-59	-43.4	172.3	-71.4	167.4	0	0	0	110.5	Y883 F895 Q896 A901 H902 Q903	Y883-I899 HydrophobicContact CE2-CG2 4.43Å; F895-I899 HydrophobicContact CD1-CD1 3.89Å; F895-I899 HydrophobicContact CD2-CD1 4.04Å; F895-I899 HydrophobicContact CD2-CG1 4.41Å; F895-I899 HydrophobicContact CE1-CD1 3.67Å; F895-I899 HydrophobicContact CE2-CD1 3.86Å; F895-I899 HydrophobicContact CE2-CG1 4.35Å; F895-I899 HydrophobicContact CG-CD1 4.09Å; F895-I899 HydrophobicContact CZ-CD1 3.68Å; F895-I899 WeakPolarHBondContact O-CG1 3.45Å; F895-I899 PolarHBondContact O-N 2.84Å; Q896-I899 PolarHBondContact O-N 2.71Å; I899-A901 PolarHBondContact O-N 3.15Å; I899-H902 PolarHBondContact O-N 2.98Å; I899-Q903 VanDerWaalsContact CG2-CD 3.49Å; I899-Q903 HydrophobicContact CG2-CG 4.18Å; I899-Q903 PolarHBondContact O-N 2.78Å
900	W	83.8	Confident	74.7	Confident	52 Å²	52	68.1 Å²	68.1	20%	0.197	37%	0.366	C	S	.	.	H	α-helix	trans	-59.8	-26	173	-70.7	-20.4	0	0	0	113.9	Q896 H898 G904 L905 P907 Y908 C918	Q896-W900 HydrophobicContact CG-CD2 4.25Å; Q896-W900 HydrophobicContact CG-CH2 4.11Å; Q896-W900 HydrophobicContact CG-CZ2 3.64Å; Q896-W900 WeakPolarHBondContact O-CB 3.49Å; Q896-W900 PolarHBondContact O-N 3.12Å; H898-W900 VanDerWaalsContact C-N 3.3Å; H898-W900 PolarHBondContact O-N 2.9Å; W900-G904 CarbonylContact O-C 3.29Å; W900-G904 PolarHBondContact O-N 3.34Å; W900-L905 HydrophobicContact CB-CB 4.22Å; W900-L905 HydrophobicContact CG-CB 4.14Å; W900-L905 PolarHBondContact O-N 2.92Å; W900-P907 HydrophobicContact CD2-CG 3.87Å; W900-P907 HydrophobicContact CE3-CG 3.71Å; W900-P907 HydrophobicContact CH2-CG 3.8Å; W900-P907 HydrophobicContact CZ2-CG 3.91Å; W900-P907 HydrophobicContact CZ3-CG 3.7Å; W900-Y908 AromaticContact CZ3-CE2 3.96Å; W900-Y908 HydrophobicContact CZ3-CE2 3.96Å; W900-C918 HydrophobicContact CB-CB 4.11Å
901	A	76.8	Confident	75.7	Confident	68 Å²	68	68.3 Å²	68.3	56%	0.562	38%	0.382	S	S	*	.	H	α-helix	trans	-74.1	-34	173.9	0	0	0	0	0	112.5	Q897 H898 I899	Q897-A901 PolarHBondContact O-N 3.13Å; H898-A901 WeakPolarHBondContact O-CA 3.41Å; H898-A901 VanDerWaalsContact O-CB 3.31Å; H898-A901 WeakPolarHBondContact O-CB 3.41Å; H898-A901 PolarHBondContact O-N 2.71Å; I899-A901 PolarHBondContact O-N 3.15Å
902	H	74.4	Confident	76.6	Confident	83 Å²	83	65.8 Å²	65.8	38%	0.384	37%	0.371	S	S	.	.	H	α-helix	trans	-74.8	-43.7	173.3	-76.1	-82	0	0	0	112.4	Y883 C884 H898 I899 G904	Y883-H902 VanDerWaalsContact CB-CG 3.48Å; Y883-H902 VanDerWaalsContact CB-ND1 3.34Å; Y883-H902 WeakPolarHBondContact CB-ND1 3.43Å; Y883-H902 HydrophobicContact CD2-CB 3.71Å; Y883-H902 HydrophobicContact CE2-CB 4.45Å; Y883-H902 HydrophobicContact CG-CB 3.91Å; Y883-H902 PolarHBondContact O-CE1 2.89Å; C884-H902 PolarHBondContact SG-NE2 2.99Å; C884-H902 VanDerWaalsContact SG-NE2 3.38Å; H898-H902 AromaticContact CE1-CD2 3.62Å; H898-H902 AromaticContact CE1-NE2 3.21Å; H898-H902 PolarHBondContact CE1-NE2 3.06Å; H898-H902 AromaticContact NE2-CD2 3.62Å; H898-H902 AromaticContact NE2-NE2 3.38Å; H898-H902 PolarHBondContact NE2-NE2 2.9Å; H898-H902 PolarHBondContact O-CD2 3.25Å; H898-H902 PolarHBondContact O-N 3.14Å; I899-H902 PolarHBondContact O-N 2.98Å; H902-G904 PolarHBondContact O-N 2.96Å
903	Q	72.5	Confident	77.2	Confident	86 Å²	86	66.4 Å²	66.4	40%	0.402	38%	0.375	S	S	.	.	S	Bend	trans	-80	4.5	-179.4	-64.4	176.8	-21.1	0	0	113.5	Y883 I899 L905	Y883-Q903 HydrophobicContact CE2-CG 4.02Å; Y883-Q903 PolarHBondContact OH-NE2 3.29Å; I899-Q903 VanDerWaalsContact CG2-CD 3.49Å; I899-Q903 HydrophobicContact CG2-CG 4.18Å; I899-Q903 PolarHBondContact O-N 2.78Å; Q903-L905 HydrophobicContact CB-CD1 4.13Å; Q903-L905 HydrophobicContact CB-CG 3.95Å; Q903-L905 PolarHBondContact O-N 2.88Å
904	G	72.7	Confident	77.4	Confident	44 Å²	44	68.3 Å²	68.3	45%	0.454	39%	0.388	S	S	.	.			trans	66.5	-3.9	-177.4	0	0	0	0	0	116.1	W900 H902 K906	W900-G904 CarbonylContact O-C 3.29Å; W900-G904 PolarHBondContact O-N 3.34Å; H902-G904 PolarHBondContact O-N 2.96Å; G904-K906 WeakPolarHBondContact O-CG 3.47Å
905	L	71.9	Confident	77.7	Confident	86 Å²	86	68.4 Å²	68.4	45%	0.45	38%	0.382	S	S	.	.			trans	-64.3	129.3	-172.9	-63.6	179.8	0	0	0	112.3	W900 Q903 P907	W900-L905 HydrophobicContact CB-CB 4.22Å; W900-L905 HydrophobicContact CG-CB 4.14Å; W900-L905 PolarHBondContact O-N 2.92Å; Q903-L905 HydrophobicContact CB-CD1 4.13Å; Q903-L905 HydrophobicContact CB-CG 3.95Å; Q903-L905 PolarHBondContact O-N 2.88Å; L905-P907 VanDerWaalsContact C-CD 3.44Å; L905-P907 WeakPolarHBondContact O-CD 3.32Å
906	K	79.6	Confident	77.7	Confident	115 Å²	115	68.6 Å²	68.6	50%	0.5	39%	0.388	S	S	.	.			trans	-127.5	63.4	-174.1	-72.4	162.9	-167.4	164.8	0	111.6	G904 Y908 S916 S917	G904-K906 WeakPolarHBondContact O-CG 3.47Å; K906-Y908 PolarHBondContact O-N 3.38Å; K906-S916 VanDerWaalsContact CB-OG 3.29Å; K906-S916 WeakPolarHBondContact CB-OG 3.5Å; K906-S916 VanDerWaalsContact CD-OG 3.26Å; K906-S916 WeakPolarHBondContact CD-OG 3.47Å; K906-S917 CarbonylContact C-O 3.45Å; K906-S917 VanDerWaalsContact C-O 3.22Å; K906-S917 WeakPolarHBondContact CA-O 3.45Å
907	P	75.6	Confident	77.9	Confident	57 Å²	57	64.7 Å²	64.7	37%	0.37	37%	0.37	S	S	.	.			trans	-62.2	-10.4	-171.4	24.2	-35.9	0	0	0	115.8	W900 L905	W900-P907 HydrophobicContact CD2-CG 3.87Å; W900-P907 HydrophobicContact CE3-CG 3.71Å; W900-P907 HydrophobicContact CH2-CG 3.8Å; W900-P907 HydrophobicContact CZ2-CG 3.91Å; W900-P907 HydrophobicContact CZ3-CG 3.7Å; L905-P907 VanDerWaalsContact C-CD 3.44Å; L905-P907 WeakPolarHBondContact O-CD 3.32Å
908	Y	81.1	Confident	77.7	Confident	68 Å²	68	63.3 Å²	63.3	27%	0.267	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	84.6	176	-55.9	-73.1	0	0	0	110.6	W900 K906 S917 R920	W900-Y908 AromaticContact CZ3-CE2 3.96Å; W900-Y908 HydrophobicContact CZ3-CE2 3.96Å; K906-Y908 PolarHBondContact O-N 3.38Å; Y908-S917 WeakPolarHBondContact CB-O 3.34Å; Y908-S917 PolarHBondContact N-O 3.21Å; Y908-S917 PolarHBondContact O-N 3.3Å; Y908-S917 PolarHBondContact O-OG 2.9Å; Y908-R920 HydrophobicContact CD1-CB 3.87Å; Y908-R920 HydrophobicContact CD1-CG 4.29Å; Y908-R920 HydrophobicContact CD2-CB 4.46Å; Y908-R920 HydrophobicContact CE1-CB 3.73Å; Y908-R920 HydrophobicContact CE1-CG 4.26Å; Y908-R920 HydrophobicContact CE2-CB 4.29Å; Y908-R920 HydrophobicContact CG-CB 4.23Å
909	V	79.2	Confident	77.7	Confident	66 Å²	66	63.4 Å²	63.4	40%	0.4	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	148.8	177	-170.2	0	0	0	0	111.4	L923	V909-L923 WeakPolarHBondContact O-CD1 3.3Å; V909-L923 VanDerWaalsContact O-CD2 3.31Å; V909-L923 WeakPolarHBondContact O-CD2 3.48Å
910	C	81.6	Confident	77.7	Confident	9 Å²	9	70.7 Å²	70.7	6%	0.061	40%	0.395	C	S	.	.			trans	-88.6	129.6	175	169.1	0	0	0	0	112.2	V912 C913 Y915 L923 M927 H930	C910-V912 PolarHBondContact O-N 3.38Å; C910-V912 VanDerWaalsContact O-N 3.15Å; C910-V912 PolarHBondContact SG-N 3.5Å; C910-V912 VanDerWaalsContact SG-N 3.39Å; C910-C913 VanDerWaalsContact CB-O 3.29Å; C910-C913 WeakPolarHBondContact CB-O 3.13Å; C910-C913 PolarHBondContact SG-N 3.3Å; C910-Y915 WeakPolarHBondContact CB-O 3.44Å; C910-Y915 PolarHBondContact N-O 3.4Å; C910-L923 HydrophobicContact CB-CD1 3.85Å; C910-M927 HydrophobicContact CB-CE 3.74Å; C910-M927 WeakPolarHBondContact SG-CE 3.3Å; C910-H930 PolarHBondContact SG-CD2 3.47Å; C910-H930 PolarHBondContact SG-NE2 3.29Å
911	S	75.6	Confident	77.4	Confident	115 Å²	115	71.7 Å²	71.7	80%	0.804	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	11.9	179.2	61.9	0	0	0	0	114.9
912	V	76.4	Confident	77.6	Confident	91 Å²	91	71.8 Å²	71.8	55%	0.552	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	-9	-174.5	-165.4	0	0	0	0	112.7	C910 H930	C910-V912 PolarHBondContact O-N 3.38Å; C910-V912 VanDerWaalsContact O-N 3.15Å; C910-V912 PolarHBondContact SG-N 3.5Å; C910-V912 VanDerWaalsContact SG-N 3.39Å; V912-H930 HydrophobicContact CB-CB 4.25Å; V912-H930 HydrophobicContact CG1-CB 4.15Å; V912-H930 HydrophobicContact CG2-CB 4.29Å
913	C	82.1	Confident	77.9	Confident	44 Å²	44	68.9 Å²	68.9	30%	0.297	39%	0.388	S	S	.	.	S	Bend	trans	-168.8	160.9	171	72.7	0	0	0	0	109.4	C910 Y915 H926 H930	C910-C913 VanDerWaalsContact CB-O 3.29Å; C910-C913 WeakPolarHBondContact CB-O 3.13Å; C910-C913 PolarHBondContact SG-N 3.3Å; C913-Y915 PolarHBondContact O-N 3.2Å; C913-H926 PolarHBondContact SG-NE2 3.27Å; C913-H930 PolarHBondContact SG-CE1 2.81Å; C913-H930 PolarHBondContact SG-NE2 3.17Å
914	S	74.8	Confident	78.2	Confident	126 Å²	126	71.8 Å²	71.8	88%	0.881	40%	0.399	S	S	*	.	S	Bend	trans	-62.5	11	-175.9	-30.7	0	0	0	0	116.7	S916	S914-S916 PolarHBondContact O-N 3.43Å
915	Y	79.5	Confident	78.2	Confident	94 Å²	94	74.2 Å²	74.2	37%	0.369	41%	0.405	S	S	.	.			trans	-72.2	125.7	174.5	179.6	-91.7	0	0	0	111.5	C910 C913 H926	C910-Y915 WeakPolarHBondContact CB-O 3.44Å; C910-Y915 PolarHBondContact N-O 3.4Å; C913-Y915 PolarHBondContact O-N 3.2Å; Y915-H926 WeakPolarHBondContact CB-CE1 3.37Å; Y915-H926 HydrophobicContact CD1-CB 3.93Å; Y915-H926 AromaticContact CD1-CD2 3.77Å; Y915-H926 AromaticContact CD1-CE1 3.45Å; Y915-H926 VanDerWaalsContact CD1-CE1 3.45Å; Y915-H926 WeakPolarHBondContact CD1-CE1 3.48Å; Y915-H926 AromaticContact CD1-CG 3.35Å; Y915-H926 AromaticContact CD1-ND1 3.14Å; Y915-H926 WeakPolarHBondContact CD1-ND1 3.45Å; Y915-H926 AromaticContact CD1-NE2 3.85Å; Y915-H926 AromaticContact CD2-CE1 3.78Å; Y915-H926 AromaticContact CD2-ND1 3.74Å; Y915-H926 HydrophobicContact CE1-CB 3.74Å; Y915-H926 AromaticContact CE1-CG 3.65Å; Y915-H926 AromaticContact CE1-ND1 3.48Å; Y915-H926 WeakPolarHBondContact CE1-ND1 3.39Å; Y915-H926 AromaticContact CG-CE1 3.18Å; Y915-H926 AromaticContact CG-CG 3.94Å; Y915-H926 AromaticContact CG-ND1 3.28Å; Y915-H926 VanDerWaalsContact CG-ND1 3.28Å; Y915-H926 AromaticContact CG-NE2 3.81Å; Y915-H926 AromaticContact CZ-ND1 3.93Å
916	S	80.6	Confident	78.5	Confident	37 Å²	37	70.8 Å²	70.8	26%	0.259	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.1	175.7	61.1	0	0	0	0	110.8	K906 S914	K906-S916 VanDerWaalsContact CB-OG 3.29Å; K906-S916 WeakPolarHBondContact CB-OG 3.5Å; K906-S916 VanDerWaalsContact CD-OG 3.26Å; K906-S916 WeakPolarHBondContact CD-OG 3.47Å; S914-S916 PolarHBondContact O-N 3.43Å
917	S	79.9	Confident	78.1	Confident	6 Å²	6	68 Å²	68	4%	0.042	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.8	-177.4	63.9	0	0	0	0	113.3	K906 Y908 N919 L923	K906-S917 CarbonylContact C-O 3.45Å; K906-S917 VanDerWaalsContact C-O 3.22Å; K906-S917 WeakPolarHBondContact CA-O 3.45Å; Y908-S917 WeakPolarHBondContact CB-O 3.34Å; Y908-S917 PolarHBondContact N-O 3.21Å; Y908-S917 PolarHBondContact O-N 3.3Å; Y908-S917 PolarHBondContact O-OG 2.9Å; S917-N919 VanDerWaalsContact C-N 3.33Å; S917-N919 PolarHBondContact OG-O 3.06Å; S917-L923 PolarHBondContact OG-N 3.28Å
918	C	75.1	Confident	77.9	Confident	29 Å²	29	68.2 Å²	68.2	20%	0.196	37%	0.374	C	S	.	.	S	Bend	trans	-80.5	-4.8	177.3	60.5	0	0	0	0	114.4	Q897 W900	Q897-C918 HydrophobicContact CG-CB 4.37Å; W900-C918 HydrophobicContact CB-CB 4.11Å
919	N	79.8	Confident	77.3	Confident	37 Å²	37	72.2 Å²	72.2	20%	0.198	39%	0.389	C	S	.	.	S	Bend	trans	-138.6	130.8	179.2	-172.9	-36.9	0	0	0	112.3	Q897 S917 S921 N922 L923	Q897-N919 HydrophobicContact CG-CB 4.35Å; Q897-N919 PolarHBondContact OE1-ND2 3.45Å; S917-N919 VanDerWaalsContact C-N 3.33Å; S917-N919 PolarHBondContact OG-O 3.06Å; N919-S921 PolarHBondContact O-N 2.88Å; N919-S921 VanDerWaalsContact O-N 3.08Å; N919-S921 WeakPolarHBondContact OD1-CB 3.42Å; N919-S921 PolarHBondContact OD1-N 3.05Å; N919-S921 PolarHBondContact OD1-OG 3.48Å; N919-N922 WeakPolarHBondContact O-CA 3.22Å; N919-N922 WeakPolarHBondContact O-CB 3.45Å; N919-N922 PolarHBondContact O-N 2.71Å; N919-L923 PolarHBondContact O-N 3.3Å; N919-L923 VanDerWaalsContact O-N 3.08Å
920	R	78.3	Confident	76.7	Confident	172 Å²	172	71.9 Å²	71.9	65%	0.649	38%	0.383	S	S	*	.	H	α-helix	trans	-52.4	-29.5	175.4	-169.8	174.3	-179.7	80.6	-1	113.8	Y908 K924	Y908-R920 HydrophobicContact CD1-CB 3.87Å; Y908-R920 HydrophobicContact CD1-CG 4.29Å; Y908-R920 HydrophobicContact CD2-CB 4.46Å; Y908-R920 HydrophobicContact CE1-CB 3.73Å; Y908-R920 HydrophobicContact CE1-CG 4.26Å; Y908-R920 HydrophobicContact CE2-CB 4.29Å; Y908-R920 HydrophobicContact CG-CB 4.23Å; R920-K924 VanDerWaalsContact O-CB 3.32Å; R920-K924 WeakPolarHBondContact O-CB 3.25Å; R920-K924 PolarHBondContact O-N 3.01Å
921	S	78.1	Confident	75.7	Confident	73 Å²	73	73.4 Å²	73.4	51%	0.51	39%	0.394	S	S	.	.	H	α-helix	trans	-68.2	-42.4	175.2	-50.9	0	0	0	0	111.6	N919 K924 T925	N919-S921 PolarHBondContact O-N 2.88Å; N919-S921 VanDerWaalsContact O-N 3.08Å; N919-S921 WeakPolarHBondContact OD1-CB 3.42Å; N919-S921 PolarHBondContact OD1-N 3.05Å; N919-S921 PolarHBondContact OD1-OG 3.48Å; S921-K924 PolarHBondContact O-N 3.13Å; S921-T925 PolarHBondContact O-N 3.21Å; S921-T925 PolarHBondContact O-OG1 3.44Å
922	N	80.9	Confident	74.8	Confident	69 Å²	69	72.7 Å²	72.7	37%	0.369	39%	0.389	S	S	.	.	H	α-helix	trans	-68.1	-44.1	177.6	-64.1	6.3	0	0	0	110	N919 K924 T925 H926	N919-N922 WeakPolarHBondContact O-CA 3.22Å; N919-N922 WeakPolarHBondContact O-CB 3.45Å; N919-N922 PolarHBondContact O-N 2.71Å; N922-K924 VanDerWaalsContact C-N 3.31Å; N922-K924 PolarHBondContact O-N 3.39Å; N922-T925 WeakPolarHBondContact CA-OG1 3.38Å; N922-T925 PolarHBondContact O-N 3.16Å; N922-T925 PolarHBondContact O-OG1 3.32Å; N922-H926 WeakPolarHBondContact O-CB 3.48Å; N922-H926 PolarHBondContact O-N 3.15Å
923	L	80.1	Confident	73.8	Confident	23 Å²	23	74.2 Å²	74.2	12%	0.12	39%	0.39	C	S	.	.	H	α-helix	trans	-56.4	-45.2	169.8	-179.8	64.4	0	0	0	111.3	V909 C910 S917 N919 T925 H926 M927	V909-L923 WeakPolarHBondContact O-CD1 3.3Å; V909-L923 VanDerWaalsContact O-CD2 3.31Å; V909-L923 WeakPolarHBondContact O-CD2 3.48Å; C910-L923 HydrophobicContact CB-CD1 3.85Å; S917-L923 PolarHBondContact OG-N 3.28Å; N919-L923 PolarHBondContact O-N 3.3Å; N919-L923 VanDerWaalsContact O-N 3.08Å; L923-T925 PolarHBondContact O-N 3.27Å; L923-H926 CarbonylContact O-C 3.51Å; L923-H926 WeakPolarHBondContact O-CA 2.82Å; L923-H926 WeakPolarHBondContact O-CB 3.49Å; L923-H926 PolarHBondContact O-N 3.43Å; L923-M927 HydrophobicContact CD1-CE 3.6Å; L923-M927 HydrophobicContact CG-CE 4.24Å; L923-M927 WeakPolarHBondContact O-CG 3.43Å; L923-M927 PolarHBondContact O-N 3.18Å
924	K	78.6	Confident	72.6	Confident	147 Å²	147	77.1 Å²	77.1	64%	0.639	40%	0.398	S	S	*	.	H	α-helix	trans	-64.5	-38	178.6	-173.6	171.2	-178.5	174.7	0	112.8	R920 S921 N922 H926 M927 N928	R920-K924 VanDerWaalsContact O-CB 3.32Å; R920-K924 WeakPolarHBondContact O-CB 3.25Å; R920-K924 PolarHBondContact O-N 3.01Å; S921-K924 PolarHBondContact O-N 3.13Å; N922-K924 VanDerWaalsContact C-N 3.31Å; N922-K924 PolarHBondContact O-N 3.39Å; K924-H926 VanDerWaalsContact C-N 3.26Å; K924-H926 PolarHBondContact O-N 3.45Å; K924-M927 PolarHBondContact O-N 3.5Å; K924-N928 PolarHBondContact O-OD1 2.97Å
925	T	73.9	Confident	72	Confident	94 Å²	94	77 Å²	77	58%	0.577	38%	0.383	S	S	*	.	H	α-helix	trans	-66.9	-30.1	170.8	46.3	0	0	0	0	112.4	S921 N922 L923 N928	S921-T925 PolarHBondContact O-N 3.21Å; S921-T925 PolarHBondContact O-OG1 3.44Å; N922-T925 WeakPolarHBondContact CA-OG1 3.38Å; N922-T925 PolarHBondContact O-N 3.16Å; N922-T925 PolarHBondContact O-OG1 3.32Å; L923-T925 PolarHBondContact O-N 3.27Å; T925-N928 WeakPolarHBondContact O-CB 3.31Å; T925-N928 PolarHBondContact O-N 3.44Å
926	H	77.4	Confident	71.4	Confident	14 Å²	14	75.4 Å²	75.4	7%	0.065	38%	0.378	C	S	.	.	H	α-helix	trans	-73.5	-34.5	173.6	-175.7	100.2	0	0	0	112.9	C913 Y915 N922 L923 K924 N928 R929 H930	C913-H926 PolarHBondContact SG-NE2 3.27Å; Y915-H926 WeakPolarHBondContact CB-CE1 3.37Å; Y915-H926 HydrophobicContact CD1-CB 3.93Å; Y915-H926 AromaticContact CD1-CD2 3.77Å; Y915-H926 AromaticContact CD1-CE1 3.45Å; Y915-H926 VanDerWaalsContact CD1-CE1 3.45Å; Y915-H926 WeakPolarHBondContact CD1-CE1 3.48Å; Y915-H926 AromaticContact CD1-CG 3.35Å; Y915-H926 AromaticContact CD1-ND1 3.14Å; Y915-H926 WeakPolarHBondContact CD1-ND1 3.45Å; Y915-H926 AromaticContact CD1-NE2 3.85Å; Y915-H926 AromaticContact CD2-CE1 3.78Å; Y915-H926 AromaticContact CD2-ND1 3.74Å; Y915-H926 HydrophobicContact CE1-CB 3.74Å; Y915-H926 AromaticContact CE1-CG 3.65Å; Y915-H926 AromaticContact CE1-ND1 3.48Å; Y915-H926 WeakPolarHBondContact CE1-ND1 3.39Å; Y915-H926 AromaticContact CG-CE1 3.18Å; Y915-H926 AromaticContact CG-CG 3.94Å; Y915-H926 AromaticContact CG-ND1 3.28Å; Y915-H926 VanDerWaalsContact CG-ND1 3.28Å; Y915-H926 AromaticContact CG-NE2 3.81Å; Y915-H926 AromaticContact CZ-ND1 3.93Å; N922-H926 WeakPolarHBondContact O-CB 3.48Å; N922-H926 PolarHBondContact O-N 3.15Å; L923-H926 CarbonylContact O-C 3.51Å; L923-H926 WeakPolarHBondContact O-CA 2.82Å; L923-H926 WeakPolarHBondContact O-CB 3.49Å; L923-H926 PolarHBondContact O-N 3.43Å; K924-H926 VanDerWaalsContact C-N 3.26Å; K924-H926 PolarHBondContact O-N 3.45Å; H926-N928 PolarHBondContact O-N 2.92Å; H926-R929 PolarHBondContact CE1-NH2 2.88Å; H926-R929 WeakPolarHBondContact O-CA 3.3Å; H926-R929 WeakPolarHBondContact O-CB 3.45Å; H926-R929 PolarHBondContact O-N 3.09Å; H926-H930 AromaticContact CD2-CD2 3.69Å; H926-H930 AromaticContact CD2-NE2 3.5Å; H926-H930 PolarHBondContact CD2-NE2 2.9Å; H926-H930 AromaticContact NE2-CD2 3.63Å; H926-H930 AromaticContact NE2-CE1 3.99Å; H926-H930 AromaticContact NE2-NE2 2.93Å; H926-H930 PolarHBondContact NE2-NE2 2.74Å
927	M	72.4	Confident	71.2	Confident	57 Å²	57	78 Å²	78	28%	0.281	39%	0.389	S	S	.	.	H	α-helix	trans	-55.9	-36.2	171.6	-64.4	-63.7	88.1	0	0	111.6	C910 L923 K924 R929 H930 S931	C910-M927 HydrophobicContact CB-CE 3.74Å; C910-M927 WeakPolarHBondContact SG-CE 3.3Å; L923-M927 HydrophobicContact CD1-CE 3.6Å; L923-M927 HydrophobicContact CG-CE 4.24Å; L923-M927 WeakPolarHBondContact O-CG 3.43Å; L923-M927 PolarHBondContact O-N 3.18Å; K924-M927 PolarHBondContact O-N 3.5Å; M927-R929 PolarHBondContact O-N 3.25Å; M927-R929 VanDerWaalsContact O-N 3.14Å; M927-H930 PolarHBondContact O-N 2.83Å; M927-S931 PolarHBondContact O-N 2.8Å
928	N	70.1	Confident	71.2	Confident	61 Å²	61	77.8 Å²	77.8	33%	0.326	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-17.7	174.5	-53.9	-23.6	0	0	0	112.7	K924 T925 H926 K946	K924-N928 PolarHBondContact O-OD1 2.97Å; T925-N928 WeakPolarHBondContact O-CB 3.31Å; T925-N928 PolarHBondContact O-N 3.44Å; H926-N928 PolarHBondContact O-N 2.92Å; N928-K946 WeakPolarHBondContact O-CD 3.45Å; N928-K946 WeakPolarHBondContact O-CE 3.37Å
929	R	68.1	Low	71.1	Confident	152 Å²	152	82.1 Å²	82.1	57%	0.574	41%	0.409	S	S	*	.	H	α-helix	trans	-73.7	-33.8	172.7	-162.5	171.7	75.3	156.8	6.7	111.5	H926 M927 K946	H926-R929 PolarHBondContact CE1-NH2 2.88Å; H926-R929 WeakPolarHBondContact O-CA 3.3Å; H926-R929 WeakPolarHBondContact O-CB 3.45Å; H926-R929 PolarHBondContact O-N 3.09Å; M927-R929 PolarHBondContact O-N 3.25Å; M927-R929 VanDerWaalsContact O-N 3.14Å; R929-K946 PolarHBondContact O-NZ 3.2Å
930	H	68.1	Low	70.7	Confident	60 Å²	60	86 Å²	86	28%	0.278	43%	0.426	S	S	.	.	H	α-helix	trans	-86.6	-31.9	177.3	-62	-62.4	0	0	0	113.4	C910 V912 C913 H926 M927 S932	C910-H930 PolarHBondContact SG-CD2 3.47Å; C910-H930 PolarHBondContact SG-NE2 3.29Å; V912-H930 HydrophobicContact CB-CB 4.25Å; V912-H930 HydrophobicContact CG1-CB 4.15Å; V912-H930 HydrophobicContact CG2-CB 4.29Å; C913-H930 PolarHBondContact SG-CE1 2.81Å; C913-H930 PolarHBondContact SG-NE2 3.17Å; H926-H930 AromaticContact CD2-CD2 3.69Å; H926-H930 AromaticContact CD2-NE2 3.5Å; H926-H930 PolarHBondContact CD2-NE2 2.9Å; H926-H930 AromaticContact NE2-CD2 3.63Å; H926-H930 AromaticContact NE2-CE1 3.99Å; H926-H930 AromaticContact NE2-NE2 2.93Å; H926-H930 PolarHBondContact NE2-NE2 2.74Å; M927-H930 PolarHBondContact O-N 2.83Å; H930-S932 PolarHBondContact O-N 3.24Å
931	S	60.8	Low	70.5	Confident	40 Å²	40	80 Å²	80	28%	0.28	41%	0.41	S	S	.	.			trans	-58.1	114.6	166.3	178.4	0	0	0	0	109.7	M927 E933 K946	M927-S931 PolarHBondContact O-N 2.8Å; S931-E933 VanDerWaalsContact C-N 3.25Å; S931-K946 WeakPolarHBondContact O-CE 3.3Å; S931-K946 PolarHBondContact O-NZ 2.84Å
932	S	55.5	Low	70.1	Confident	101 Å²	101	78.8 Å²	78.8	71%	0.706	41%	0.408	S	S	*	.			trans	-73.2	-20.1	173.2	50.8	0	0	0	0	112.1	H930 K934	H930-S932 PolarHBondContact O-N 3.24Å; S932-K934 PolarHBondContact O-N 3.38Å
933	E	55.5	Low	69.7	Low	122 Å²	122	81.6 Å²	81.6	57%	0.57	42%	0.417	S	S	*	.			trans	-70.4	78.5	-174.5	-51.7	-179.3	122.1	0	0	113.1	S931 H935	S931-E933 VanDerWaalsContact C-N 3.25Å; E933-H935 VanDerWaalsContact CB-CE1 3.44Å; E933-H935 WeakPolarHBondContact CB-CE1 3.45Å; E933-H935 WeakPolarHBondContact CB-ND1 3.39Å; E933-H935 PolarHBondContact O-N 3.37Å; E933-H935 PolarHBondContact O-ND1 3.28Å; E933-H935 IonicContact OE2-CE1 3.33Å; E933-H935 PolarHBondContact OE2-CE1 3.47Å
934	K	56.4	Low	69.4	Low	106 Å²	106	87 Å²	87	46%	0.461	44%	0.44	S	S	.	.			trans	-72.9	67.5	176.3	-64.1	165.9	174.9	179.1	0	112.2	S932 H936 K944 F945 K946	S932-K934 PolarHBondContact O-N 3.38Å; K934-H936 PolarHBondContact O-N 3.12Å; K934-K944 HydrophobicContact CB-CB 3.71Å; K934-K944 HydrophobicContact CD-CB 3.72Å; K934-K944 WeakPolarHBondContact CD-O 3.14Å; K934-K944 HydrophobicContact CG-CB 4.32Å; K934-F945 CarbonylContact C-O 3.53Å; K934-F945 WeakPolarHBondContact CA-O 3.37Å; K934-K946 HydrophobicContact CG-CG 3.87Å
935	H	62.5	Low	69.3	Low	123 Å²	123	82 Å²	82	57%	0.569	42%	0.418	S	S	*	.			trans	-58	-3.8	-176.4	-74.5	86.1	0	0	0	116.9	E933	E933-H935 VanDerWaalsContact CB-CE1 3.44Å; E933-H935 WeakPolarHBondContact CB-CE1 3.45Å; E933-H935 WeakPolarHBondContact CB-ND1 3.39Å; E933-H935 PolarHBondContact O-N 3.37Å; E933-H935 PolarHBondContact O-ND1 3.28Å; E933-H935 IonicContact OE2-CE1 3.33Å; E933-H935 PolarHBondContact OE2-CE1 3.47Å
936	H	66.7	Low	69	Low	60 Å²	60	81.5 Å²	81.5	28%	0.278	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	95.1	-166.9	-67.6	-40.7	0	0	0	112.3	K934 F945 K948 L951	K934-H936 PolarHBondContact O-N 3.12Å; H936-F945 HydrophobicContact CB-CB 4.28Å; H936-F945 PolarHBondContact N-O 3.39Å; H936-F945 WeakPolarHBondContact O-CA 3.35Å; H936-F945 WeakPolarHBondContact O-CB 3.16Å; H936-F945 PolarHBondContact O-N 2.84Å; H936-K948 PolarHBondContact CD2-N 3.05Å; H936-L951 HydrophobicContact CB-CB 4.22Å; H936-L951 HydrophobicContact CB-CD2 3.84Å
937	L	76.4	Confident	68.7	Low	93 Å²	93	82.2 Å²	82.2	49%	0.487	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	148.1	177.2	-71.2	159.7	0	0	0	112.5	G942 K944 L951 R955	L937-G942 WeakPolarHBondContact CD2-O 3.35Å; L937-K944 HydrophobicContact CD2-CD 4.43Å; L937-K944 HydrophobicContact CD2-CG 3.5Å; L937-L951 WeakPolarHBondContact O-CD1 3.25Å; L937-L951 WeakPolarHBondContact O-CD2 3.42Å; L937-R955 PolarHBondContact O-NH2 2.94Å
938	C	80.6	Confident	68.9	Low	1 Å²	1	86.3 Å²	86.3	1%	0.007	43%	0.431	C	S	.	.			trans	-96.4	111.6	164.9	-170	0	0	0	0	110.4	H940 C941 G942 K943 F945 L951	C938-H940 PolarHBondContact O-N 2.86Å; C938-H940 VanDerWaalsContact O-N 3.09Å; C938-C941 PolarHBondContact O-N 3.34Å; C938-C941 VanDerWaalsContact O-N 3.1Å; C938-G942 PolarHBondContact O-N 3.12Å; C938-K943 PolarHBondContact N-O 2.88Å; C938-F945 HydrophobicContact CB-CE2 4.05Å; C938-L951 HydrophobicContact CB-CD1 3.72Å
939	D	73.2	Confident	69	Low	120 Å²	120	90 Å²	90	64%	0.642	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22	-173.5	-43.2	-15	0	0	0	112.8	R955	D939-R955 IonicContact OD1-CZ 2.61Å; D939-R955 IonicContact OD1-NH1 3.3Å; D939-R955 IonicContact OD1-NH2 2.78Å; D939-R955 PolarHBondContact OD1-NH2 3.46Å; D939-R955 IonicContact OD2-CZ 2.97Å; D939-R955 IonicContact OD2-NH1 2.93Å; D939-R955 PolarHBondContact OD2-NH1 2.99Å; D939-R955 IonicContact OD2-NH2 3.45Å; D939-R955 PolarHBondContact OD2-NH2 3.35Å
940	H	70.2	Confident	69.3	Low	119 Å²	119	86.1 Å²	86.1	55%	0.551	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-11.8	179.5	-57.2	-80.1	0	0	0	114.8	C938 H958	C938-H940 PolarHBondContact O-N 2.86Å; C938-H940 VanDerWaalsContact O-N 3.09Å; H940-H958 HydrophobicContact CB-CB 4.13Å
941	C	75.4	Confident	69.8	Low	46 Å²	46	83.9 Å²	83.9	31%	0.311	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.1	11.6	-174.4	73.5	0	0	0	0	115.9	C938 K943 H954 H958	C938-C941 PolarHBondContact O-N 3.34Å; C938-C941 VanDerWaalsContact O-N 3.1Å; C941-K943 PolarHBondContact O-N 3.17Å; C941-H954 PolarHBondContact SG-NE2 2.96Å; C941-H958 PolarHBondContact SG-NE2 2.97Å
942	G	70.2	Confident	70.5	Confident	47 Å²	47	88.5 Å²	88.5	49%	0.485	45%	0.448	S	S	.	.			trans	66.7	-11.8	179.2	0	0	0	0	0	116.5	L937 C938 K944	L937-G942 WeakPolarHBondContact CD2-O 3.35Å; C938-G942 PolarHBondContact O-N 3.12Å; G942-K944 PolarHBondContact O-N 3.13Å
943	K	72.4	Confident	71.4	Confident	127 Å²	127	86.1 Å²	86.1	55%	0.552	43%	0.431	S	S	*	.			trans	-58.9	125.5	-172.5	-71.3	175.1	-176.5	174	0	111	C938 C941 F945	C938-K943 PolarHBondContact N-O 2.88Å; C941-K943 PolarHBondContact O-N 3.17Å; K943-F945 HydrophobicContact CB-CE2 3.6Å; K943-F945 HydrophobicContact CB-CZ 3.93Å; K943-F945 WeakPolarHBondContact O-CD2 3.37Å; K943-F945 WeakPolarHBondContact O-CE2 3.39Å
944	K	73.9	Confident	72.4	Confident	138 Å²	138	81.7 Å²	81.7	60%	0.6	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	116	-172.9	-72.9	175.1	179.6	174.6	0	110.9	K934 L937 G942	K934-K944 HydrophobicContact CB-CB 3.71Å; K934-K944 HydrophobicContact CD-CB 3.72Å; K934-K944 WeakPolarHBondContact CD-O 3.14Å; K934-K944 HydrophobicContact CG-CB 4.32Å; L937-K944 HydrophobicContact CD2-CD 4.43Å; L937-K944 HydrophobicContact CD2-CG 3.5Å; G942-K944 PolarHBondContact O-N 3.13Å
945	F	75.9	Confident	73.2	Confident	41 Å²	41	79.7 Å²	79.7	18%	0.18	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	149.2	-175.9	-67.6	-87.6	0	0	0	114.3	K934 H936 C938 K943 L951 H954	K934-F945 CarbonylContact C-O 3.53Å; K934-F945 WeakPolarHBondContact CA-O 3.37Å; H936-F945 HydrophobicContact CB-CB 4.28Å; H936-F945 PolarHBondContact N-O 3.39Å; H936-F945 WeakPolarHBondContact O-CA 3.35Å; H936-F945 WeakPolarHBondContact O-CB 3.16Å; H936-F945 PolarHBondContact O-N 2.84Å; C938-F945 HydrophobicContact CB-CE2 4.05Å; K943-F945 HydrophobicContact CB-CE2 3.6Å; K943-F945 HydrophobicContact CB-CZ 3.93Å; K943-F945 WeakPolarHBondContact O-CD2 3.37Å; K943-F945 WeakPolarHBondContact O-CE2 3.39Å; F945-L951 HydrophobicContact CB-CB 4.11Å; F945-L951 HydrophobicContact CD2-CB 4.35Å; F945-L951 HydrophobicContact CD2-CD1 3.78Å; F945-L951 HydrophobicContact CE2-CD1 4.31Å; F945-L951 HydrophobicContact CG-CB 4.28Å; F945-H954 HydrophobicContact CE1-CB 3.83Å; F945-H954 AromaticContact CE1-CG 3.96Å; F945-H954 HydrophobicContact CE2-CB 4.05Å; F945-H954 AromaticContact CE2-CD2 3.22Å; F945-H954 WeakPolarHBondContact CE2-CD2 3.16Å; F945-H954 AromaticContact CE2-CG 3.73Å; F945-H954 AromaticContact CE2-NE2 3.93Å; F945-H954 HydrophobicContact CZ-CB 3.54Å; F945-H954 AromaticContact CZ-CD2 3.16Å; F945-H954 WeakPolarHBondContact CZ-CD2 3.23Å; F945-H954 AromaticContact CZ-CG 3.21Å; F945-H954 AromaticContact CZ-ND1 3.85Å; F945-H954 AromaticContact CZ-NE2 3.74Å
946	K	67	Low	73.7	Confident	83 Å²	83	77.6 Å²	77.6	36%	0.361	39%	0.393	S	S	.	.	S	Bend	trans	-83.5	-4.2	178.9	-67.3	176.9	147.7	-174.6	0	114.2	N928 R929 S931 K934	N928-K946 WeakPolarHBondContact O-CD 3.45Å; N928-K946 WeakPolarHBondContact O-CE 3.37Å; R929-K946 PolarHBondContact O-NZ 3.2Å; S931-K946 WeakPolarHBondContact O-CE 3.3Å; S931-K946 PolarHBondContact O-NZ 2.84Å; K934-K946 HydrophobicContact CG-CG 3.87Å
947	S	71.6	Confident	73.7	Confident	30 Å²	30	78.7 Å²	78.7	21%	0.21	40%	0.401	C	S	.	.			trans	-156.8	152.7	174.7	86	0	0	0	0	112.9	L949 T950 L951	S947-L949 PolarHBondContact O-N 3.49Å; S947-L949 PolarHBondContact OG-N 3.43Å; S947-T950 PolarHBondContact N-OG1 2.85Å; S947-T950 PolarHBondContact O-N 2.97Å; S947-T950 PolarHBondContact O-OG1 2.93Å; S947-T950 PolarHBondContact OG-N 3.33Å; S947-T950 PolarHBondContact OG-OG1 3.44Å; S947-L951 WeakPolarHBondContact O-CB 3.45Å; S947-L951 PolarHBondContact O-N 2.93Å
948	K	75.7	Confident	73.3	Confident	142 Å²	142	77.4 Å²	77.4	62%	0.617	39%	0.392	S	S	*	.	H	α-helix	trans	-68	-17.7	174.9	-165.7	161.8	-173.1	160.9	0	113.1	H936 K952	H936-K948 PolarHBondContact CD2-N 3.05Å; K948-K952 WeakPolarHBondContact O-CB 3.37Å; K948-K952 WeakPolarHBondContact O-CG 3.31Å; K948-K952 PolarHBondContact O-N 3.09Å
949	L	72.8	Confident	72.6	Confident	140 Å²	140	79.5 Å²	79.5	73%	0.733	41%	0.405	S	S	*	.	H	α-helix	trans	-82.8	-45.3	177	-163.7	72.3	0	0	0	111.3	S947 L951 K952 S953	S947-L949 PolarHBondContact O-N 3.49Å; S947-L949 PolarHBondContact OG-N 3.43Å; L949-L951 VanDerWaalsContact C-N 3.35Å; L949-K952 WeakPolarHBondContact O-CB 3.48Å; L949-K952 PolarHBondContact O-N 2.83Å; L949-S953 PolarHBondContact O-N 3.17Å
950	T	73.6	Confident	71.8	Confident	69 Å²	69	79.5 Å²	79.5	42%	0.423	41%	0.405	S	S	.	.	H	α-helix	trans	-66.2	-36.7	172.9	49.8	0	0	0	0	111.9	S947 S953 H954	S947-T950 PolarHBondContact N-OG1 2.85Å; S947-T950 PolarHBondContact O-N 2.97Å; S947-T950 PolarHBondContact O-OG1 2.93Å; S947-T950 PolarHBondContact OG-N 3.33Å; S947-T950 PolarHBondContact OG-OG1 3.44Å; T950-S953 PolarHBondContact O-N 2.68Å; T950-H954 WeakPolarHBondContact O-CB 3.2Å; T950-H954 PolarHBondContact O-N 3.21Å
951	L	79.9	Confident	71	Confident	13 Å²	13	82.8 Å²	82.8	7%	0.068	42%	0.42	C	S	.	.	H	α-helix	trans	-58.7	-45.4	168.7	173.8	61.1	0	0	0	112.1	H936 L937 C938 F945 S947 L949 H954 R955	H936-L951 HydrophobicContact CB-CB 4.22Å; H936-L951 HydrophobicContact CB-CD2 3.84Å; L937-L951 WeakPolarHBondContact O-CD1 3.25Å; L937-L951 WeakPolarHBondContact O-CD2 3.42Å; C938-L951 HydrophobicContact CB-CD1 3.72Å; F945-L951 HydrophobicContact CB-CB 4.11Å; F945-L951 HydrophobicContact CD2-CB 4.35Å; F945-L951 HydrophobicContact CD2-CD1 3.78Å; F945-L951 HydrophobicContact CE2-CD1 4.31Å; F945-L951 HydrophobicContact CG-CB 4.28Å; S947-L951 WeakPolarHBondContact O-CB 3.45Å; S947-L951 PolarHBondContact O-N 2.93Å; L949-L951 VanDerWaalsContact C-N 3.35Å; L951-H954 PolarHBondContact O-N 2.91Å; L951-R955 HydrophobicContact CD1-CG 4.16Å; L951-R955 WeakPolarHBondContact O-CG 3.19Å; L951-R955 PolarHBondContact O-N 3.09Å
952	K	76	Confident	69.8	Low	138 Å²	138	81.5 Å²	81.5	60%	0.6	42%	0.415	S	S	*	.	H	α-helix	trans	-61.9	-44.2	176.3	-88.9	-173.9	166.8	-157.1	0	112.3	K948 L949 H954 R955 L956	K948-K952 WeakPolarHBondContact O-CB 3.37Å; K948-K952 WeakPolarHBondContact O-CG 3.31Å; K948-K952 PolarHBondContact O-N 3.09Å; L949-K952 WeakPolarHBondContact O-CB 3.48Å; L949-K952 PolarHBondContact O-N 2.83Å; K952-H954 VanDerWaalsContact C-N 3.31Å; K952-H954 PolarHBondContact O-N 3.5Å; K952-R955 PolarHBondContact O-N 3.03Å; K952-L956 PolarHBondContact O-N 2.76Å
953	S	73.3	Confident	69	Low	50 Å²	50	88.7 Å²	88.7	35%	0.35	43%	0.433	S	S	.	.	H	α-helix	trans	-57.5	-47.8	175	-152.3	0	0	0	0	110.1	L949 T950 R955 L956 F976	L949-S953 PolarHBondContact O-N 3.17Å; T950-S953 PolarHBondContact O-N 2.68Å; S953-R955 PolarHBondContact O-N 3.47Å; S953-L956 WeakPolarHBondContact O-CB 3.29Å; S953-L956 PolarHBondContact O-N 2.94Å; S953-F976 WeakPolarHBondContact O-CZ 3.5Å; S953-F976 WeakPolarHBondContact OG-CE1 3.39Å
954	H	77.6	Confident	68.5	Low	30 Å²	30	88.7 Å²	88.7	14%	0.139	43%	0.429	C	S	.	.	H	α-helix	trans	-65.8	-35.2	179.2	-178.9	60.4	0	0	0	113.8	C941 F945 T950 L951 K952 L956 N957 H958	C941-H954 PolarHBondContact SG-NE2 2.96Å; F945-H954 HydrophobicContact CE1-CB 3.83Å; F945-H954 AromaticContact CE1-CG 3.96Å; F945-H954 HydrophobicContact CE2-CB 4.05Å; F945-H954 AromaticContact CE2-CD2 3.22Å; F945-H954 WeakPolarHBondContact CE2-CD2 3.16Å; F945-H954 AromaticContact CE2-CG 3.73Å; F945-H954 AromaticContact CE2-NE2 3.93Å; F945-H954 HydrophobicContact CZ-CB 3.54Å; F945-H954 AromaticContact CZ-CD2 3.16Å; F945-H954 WeakPolarHBondContact CZ-CD2 3.23Å; F945-H954 AromaticContact CZ-CG 3.21Å; F945-H954 AromaticContact CZ-ND1 3.85Å; F945-H954 AromaticContact CZ-NE2 3.74Å; T950-H954 WeakPolarHBondContact O-CB 3.2Å; T950-H954 PolarHBondContact O-N 3.21Å; L951-H954 PolarHBondContact O-N 2.91Å; K952-H954 VanDerWaalsContact C-N 3.31Å; K952-H954 PolarHBondContact O-N 3.5Å; H954-L956 PolarHBondContact O-N 2.94Å; H954-N957 WeakPolarHBondContact O-CB 3.39Å; H954-N957 PolarHBondContact O-N 2.88Å; H954-H958 AromaticContact CD2-NE2 3.62Å; H954-H958 AromaticContact CE1-NE2 3.35Å; H954-H958 PolarHBondContact CE1-NE2 2.56Å; H954-H958 AromaticContact NE2-CD2 3.81Å; H954-H958 AromaticContact NE2-CE1 3.99Å; H954-H958 AromaticContact NE2-NE2 2.96Å; H954-H958 PolarHBondContact NE2-NE2 3.33Å; H954-H958 PolarHBondContact O-CD2 3.48Å
955	R	72.7	Confident	68.3	Low	64 Å²	64	86.3 Å²	86.3	24%	0.242	42%	0.419	C	S	.	.	H	α-helix	trans	-62.2	-28	174.5	-75.9	-179.3	-169.3	-131.7	1.5	112.8	L937 D939 L951 K952 S953 N957 H958 T959	L937-R955 PolarHBondContact O-NH2 2.94Å; D939-R955 IonicContact OD1-CZ 2.61Å; D939-R955 IonicContact OD1-NH1 3.3Å; D939-R955 IonicContact OD1-NH2 2.78Å; D939-R955 PolarHBondContact OD1-NH2 3.46Å; D939-R955 IonicContact OD2-CZ 2.97Å; D939-R955 IonicContact OD2-NH1 2.93Å; D939-R955 PolarHBondContact OD2-NH1 2.99Å; D939-R955 IonicContact OD2-NH2 3.45Å; D939-R955 PolarHBondContact OD2-NH2 3.35Å; L951-R955 HydrophobicContact CD1-CG 4.16Å; L951-R955 WeakPolarHBondContact O-CG 3.19Å; L951-R955 PolarHBondContact O-N 3.09Å; K952-R955 PolarHBondContact O-N 3.03Å; S953-R955 PolarHBondContact O-N 3.47Å; R955-N957 PolarHBondContact O-N 2.9Å; R955-H958 PolarHBondContact O-N 3.22Å; R955-T959 PolarHBondContact O-N 3.43Å; R955-T959 PolarHBondContact O-OG1 2.84Å
956	L	71.9	Confident	68	Low	79 Å²	79	91.1 Å²	91.1	41%	0.414	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.3	172.6	-62.9	169.3	0	0	0	113.4	K952 S953 H954 H958 V975	K952-L956 PolarHBondContact O-N 2.76Å; S953-L956 WeakPolarHBondContact O-CB 3.29Å; S953-L956 PolarHBondContact O-N 2.94Å; H954-L956 PolarHBondContact O-N 2.94Å; L956-H958 VanDerWaalsContact C-N 3.31Å; L956-V975 HydrophobicContact CB-CG1 3.65Å; L956-V975 WeakPolarHBondContact O-CG1 3.44Å
957	N	66.8	Low	68.3	Low	83 Å²	83	87.5 Å²	87.5	44%	0.444	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-9	170.1	-64.6	24.4	0	0	0	113.1	H954 R955 F976	H954-N957 WeakPolarHBondContact O-CB 3.39Å; H954-N957 PolarHBondContact O-N 2.88Å; R955-N957 PolarHBondContact O-N 2.9Å; N957-F976 WeakPolarHBondContact OD1-CE2 3.17Å; N957-F976 WeakPolarHBondContact OD1-CZ 3.48Å
958	H	68.3	Low	68.4	Low	66 Å²	66	90.7 Å²	90.7	31%	0.306	45%	0.45	S	S	.	.	S	Bend	trans	-112.7	6	178.1	-59	-78	0	0	0	112.3	H940 C941 H954 R955 L956	H940-H958 HydrophobicContact CB-CB 4.13Å; C941-H958 PolarHBondContact SG-NE2 2.97Å; H954-H958 AromaticContact CD2-NE2 3.62Å; H954-H958 AromaticContact CE1-NE2 3.35Å; H954-H958 PolarHBondContact CE1-NE2 2.56Å; H954-H958 AromaticContact NE2-CD2 3.81Å; H954-H958 AromaticContact NE2-CE1 3.99Å; H954-H958 AromaticContact NE2-NE2 2.96Å; H954-H958 PolarHBondContact NE2-NE2 3.33Å; H954-H958 PolarHBondContact O-CD2 3.48Å; R955-H958 PolarHBondContact O-N 3.22Å; L956-H958 VanDerWaalsContact C-N 3.31Å
959	T	65.3	Low	67.9	Low	44 Å²	44	89.7 Å²	89.7	27%	0.27	45%	0.447	S	S	.	.			trans	-137.3	106.3	-177	59.9	0	0	0	0	110	R955 E961 G962	R955-T959 PolarHBondContact O-N 3.43Å; R955-T959 PolarHBondContact O-OG1 2.84Å; T959-E961 PolarHBondContact O-N 2.9Å; T959-E961 VanDerWaalsContact O-N 3.11Å; T959-G962 PolarHBondContact O-N 3.12Å
960	D	57.7	Low	67.9	Low	120 Å²	120	85.3 Å²	85.3	64%	0.642	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-8.3	-176	-63.4	-65.1	0	0	0	114.7	G962 R964	D960-G962 PolarHBondContact O-N 2.87Å; D960-G962 VanDerWaalsContact O-N 3.13Å; D960-R964 IonicContact OD1-CZ 3.76Å; D960-R964 IonicContact OD1-NE 3.98Å; D960-R964 IonicContact OD1-NH2 3.51Å; D960-R964 PolarHBondContact OD1-NH2 3.29Å
961	E	52.4	Low	67.4	Low	188 Å²	188	88.1 Å²	88.1	88%	0.879	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.4	171	-54.8	-175.7	157.8	0	0	113.9	T959 K963	T959-E961 PolarHBondContact O-N 2.9Å; T959-E961 VanDerWaalsContact O-N 3.11Å; E961-K963 PolarHBondContact O-N 3.44Å
962	G	50.8	Low	66.9	Low	20 Å²	20	91.3 Å²	91.3	21%	0.206	46%	0.461	C	S	.	.	S	Bend	trans	-77	110	175.3	0	0	0	0	0	111.7	T959 D960 R964	T959-G962 PolarHBondContact O-N 3.12Å; D960-G962 PolarHBondContact O-N 2.87Å; D960-G962 VanDerWaalsContact O-N 3.13Å; G962-R964 PolarHBondContact O-N 2.9Å
963	K	53.7	Low	66.6	Low	198 Å²	198	87.7 Å²	87.7	86%	0.861	45%	0.45	S	S	*	.			trans	-43.2	103.3	174.6	-74.7	-161.9	174.5	-159.9	0	111.5	E961	E961-K963 PolarHBondContact O-N 3.44Å
964	R	62.4	Low	66.6	Low	126 Å²	126	85.8 Å²	85.8	48%	0.475	44%	0.437	S	S	.	.			trans	-69.3	136.5	-179.9	-60.7	-174.8	177.6	-165.5	3.6	109.6	D960 G962 Q966 T973	D960-R964 IonicContact OD1-CZ 3.76Å; D960-R964 IonicContact OD1-NE 3.98Å; D960-R964 IonicContact OD1-NH2 3.51Å; D960-R964 PolarHBondContact OD1-NH2 3.29Å; G962-R964 PolarHBondContact O-N 2.9Å; R964-Q966 PolarHBondContact O-N 3.4Å; R964-T973 PolarHBondContact NH1-OG1 3.08Å
965	F	68.6	Low	66.2	Low	88 Å²	88	86.1 Å²	86.1	39%	0.386	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	100.5	171.2	-63.3	-85.6	0	0	0	108	S974 K977 L980	F965-S974 WeakPolarHBondContact CB-O 3.13Å; F965-S974 PolarHBondContact N-O 3.32Å; F965-S974 PolarHBondContact O-N 3.16Å; F965-K977 HydrophobicContact CD1-CB 4.1Å; F965-K977 HydrophobicContact CD1-CG 4.47Å; F965-K977 HydrophobicContact CD2-CB 4.29Å; F965-K977 HydrophobicContact CE1-CB 3.95Å; F965-K977 HydrophobicContact CE1-CD 4.39Å; F965-K977 HydrophobicContact CE1-CG 4.47Å; F965-K977 HydrophobicContact CE2-CB 4.15Å; F965-K977 HydrophobicContact CG-CB 4.27Å; F965-K977 HydrophobicContact CZ-CB 3.98Å; F965-L980 HydrophobicContact CB-CB 3.94Å; F965-L980 HydrophobicContact CB-CD2 3.69Å; F965-L980 HydrophobicContact CB-CG 4.39Å
966	Q	69.5	Low	66.1	Low	143 Å²	143	85.8 Å²	85.8	67%	0.668	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	149.4	173.9	72	-165.1	53	0	0	111.6	R964 F972 T973 L980	R964-Q966 PolarHBondContact O-N 3.4Å; Q966-F972 WeakPolarHBondContact CA-O 3.26Å; Q966-T973 HydrophobicContact CB-CG2 4Å; Q966-L980 WeakPolarHBondContact O-CD2 3.39Å
967	C	74.4	Confident	66.2	Low	7 Å²	7	87.8 Å²	87.8	5%	0.047	45%	0.447	C	S	.	.			trans	-73.3	154.9	165.5	-167.8	0	0	0	0	111.1	E969 C970 F972 L980 H987	C967-E969 PolarHBondContact SG-N 3.22Å; C967-E969 VanDerWaalsContact SG-N 3.38Å; C967-C970 WeakPolarHBondContact CB-O 3.37Å; C967-F972 HydrophobicContact CB-CB 4.47Å; C967-F972 PolarHBondContact N-O 3.02Å; C967-L980 HydrophobicContact CB-CD1 3.83Å; C967-H987 PolarHBondContact SG-CD2 2.95Å
968	S	72.4	Confident	66.5	Low	97 Å²	97	88.4 Å²	88.4	68%	0.678	46%	0.455	S	S	*	.	S	Bend	trans	-86.7	-16	171.7	45.4	0	0	0	0	113.3	M984	S968-M984 VanDerWaalsContact OG-CE 3.24Å; S968-M984 WeakPolarHBondContact OG-CE 3.33Å
969	E	65.1	Low	66.7	Low	121 Å²	121	87 Å²	87	57%	0.565	45%	0.453	S	S	*	.	S	Bend	trans	-116.8	-8.9	-169.5	-68.9	168.3	-95.9	0	0	113	C967 H987	C967-E969 PolarHBondContact SG-N 3.22Å; C967-E969 VanDerWaalsContact SG-N 3.38Å; E969-H987 HydrophobicContact CB-CB 4.45Å
970	C	73.8	Confident	67.2	Low	47 Å²	47	85.7 Å²	85.7	32%	0.318	44%	0.444	S	S	.	.	S	Bend	trans	-159.7	172.3	170.4	94.3	0	0	0	0	111.7	C967 F972 H983	C967-C970 WeakPolarHBondContact CB-O 3.37Å; C970-F972 PolarHBondContact O-N 3.04Å; C970-H983 PolarHBondContact SG-CE1 2.84Å; C970-H983 PolarHBondContact SG-NE2 2.67Å
971	P	63.6	Low	67.9	Low	128 Å²	128	84 Å²	84	83%	0.831	44%	0.435	S	S	*	.	S	Bend	trans	-74.6	9.5	-175	31.2	-36.3	0	0	0	115.6	T973	P971-T973 PolarHBondContact O-N 2.91Å
972	F	67.9	Low	68.6	Low	80 Å²	80	83 Å²	83	35%	0.351	42%	0.423	S	S	.	.			trans	-64.2	122.8	179.8	-178.5	-97	0	0	0	111.9	Q966 C967 C970 L980 H983	Q966-F972 WeakPolarHBondContact CA-O 3.26Å; C967-F972 HydrophobicContact CB-CB 4.47Å; C967-F972 PolarHBondContact N-O 3.02Å; C970-F972 PolarHBondContact O-N 3.04Å; F972-L980 HydrophobicContact CD1-CD1 4.29Å; F972-H983 WeakPolarHBondContact CB-NE2 3.47Å; F972-H983 HydrophobicContact CD1-CB 3.59Å; F972-H983 AromaticContact CD1-CD2 3.34Å; F972-H983 WeakPolarHBondContact CD1-CD2 3.2Å; F972-H983 AromaticContact CD1-CG 3.29Å; F972-H983 HydrophobicContact CE1-CB 3.49Å; F972-H983 VanDerWaalsContact CE1-CB 3.49Å; F972-H983 AromaticContact CE1-CG 3.73Å; F972-H983 HydrophobicContact CG-CB 4.32Å; F972-H983 AromaticContact CG-CD2 3.66Å; F972-H983 AromaticContact CG-CG 3.63Å; F972-H983 AromaticContact CG-ND1 3.89Å; F972-H983 AromaticContact CG-NE2 3.93Å; F972-H983 HydrophobicContact CZ-CB 4.18Å
973	T	69.5	Low	69.6	Low	62 Å²	62	82.7 Å²	82.7	38%	0.38	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.5	175.7	64.9	0	0	0	0	111.5	R964 Q966 P971	R964-T973 PolarHBondContact NH1-OG1 3.08Å; Q966-T973 HydrophobicContact CB-CG2 4Å; P971-T973 PolarHBondContact O-N 2.91Å
974	S	73.3	Confident	70	Confident	10 Å²	10	75.9 Å²	75.9	7%	0.07	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.2	-175.2	168.6	0	0	0	0	112.4	F965 F976 S979	F965-S974 WeakPolarHBondContact CB-O 3.13Å; F965-S974 PolarHBondContact N-O 3.32Å; F965-S974 PolarHBondContact O-N 3.16Å; S974-F976 PolarHBondContact O-N 3.44Å; S974-F976 PolarHBondContact OG-N 2.82Å; S974-F976 VanDerWaalsContact OG-N 3.08Å; S974-F976 PolarHBondContact OG-O 3.39Å; S974-S979 VanDerWaalsContact OG-CB 3.26Å; S974-S979 WeakPolarHBondContact OG-CB 3.42Å
975	V	70.3	Confident	70.2	Confident	37 Å²	37	72.3 Å²	72.3	22%	0.224	38%	0.377	C	S	.	.	S	Bend	trans	-64.7	-21.8	173.1	-179	0	0	0	0	112.3	L956	L956-V975 HydrophobicContact CB-CG1 3.65Å; L956-V975 WeakPolarHBondContact O-CG1 3.44Å
976	F	71.3	Confident	69.8	Low	57 Å²	57	74.5 Å²	74.5	25%	0.25	39%	0.388	C	S	.	.	S	Bend	trans	-125.5	133.9	-176.4	-50.5	-59.9	0	0	0	113.3	S953 N957 S974 S979 L980	S953-F976 WeakPolarHBondContact O-CZ 3.5Å; S953-F976 WeakPolarHBondContact OG-CE1 3.39Å; N957-F976 WeakPolarHBondContact OD1-CE2 3.17Å; N957-F976 WeakPolarHBondContact OD1-CZ 3.48Å; S974-F976 PolarHBondContact O-N 3.44Å; S974-F976 PolarHBondContact OG-N 2.82Å; S974-F976 VanDerWaalsContact OG-N 3.08Å; S974-F976 PolarHBondContact OG-O 3.39Å; F976-S979 PolarHBondContact O-N 2.84Å; F976-L980 PolarHBondContact O-N 3.03Å
977	K	73.8	Confident	69.5	Low	122 Å²	122	70.3 Å²	70.3	53%	0.53	37%	0.368	S	S	.	.	H	α-helix	trans	-56.1	-42.3	175.6	-175.6	168.5	-178.6	170.3	0	114.1	F965 S979 L980 L981	F965-K977 HydrophobicContact CD1-CB 4.1Å; F965-K977 HydrophobicContact CD1-CG 4.47Å; F965-K977 HydrophobicContact CD2-CB 4.29Å; F965-K977 HydrophobicContact CE1-CB 3.95Å; F965-K977 HydrophobicContact CE1-CD 4.39Å; F965-K977 HydrophobicContact CE1-CG 4.47Å; F965-K977 HydrophobicContact CE2-CB 4.15Å; F965-K977 HydrophobicContact CG-CB 4.27Å; F965-K977 HydrophobicContact CZ-CB 3.98Å; K977-S979 VanDerWaalsContact C-N 3.27Å; K977-S979 PolarHBondContact O-N 3.47Å; K977-L980 PolarHBondContact O-N 3.21Å; K977-L981 HydrophobicContact CG-CD1 4.22Å; K977-L981 HydrophobicContact CG-CG 4.37Å; K977-L981 WeakPolarHBondContact O-CG 3.21Å; K977-L981 PolarHBondContact O-N 2.72Å
978	P	73.6	Confident	68.8	Low	95 Å²	95	71.7 Å²	71.7	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-62.4	-31.9	174.8	-25.1	36	0	0	0	113.7	L981 R982	P978-L981 PolarHBondContact O-N 2.95Å; P978-R982 WeakPolarHBondContact O-CB 3.43Å; P978-R982 PolarHBondContact O-N 2.9Å
979	S	72.3	Confident	67.9	Low	37 Å²	37	77.4 Å²	77.4	26%	0.259	39%	0.393	S	S	.	.	H	α-helix	trans	-77.8	-25.9	175.9	-64.7	0	0	0	0	112.8	S974 F976 K977 H983	S974-S979 VanDerWaalsContact OG-CB 3.26Å; S974-S979 WeakPolarHBondContact OG-CB 3.42Å; F976-S979 PolarHBondContact O-N 2.84Å; K977-S979 VanDerWaalsContact C-N 3.27Å; K977-S979 PolarHBondContact O-N 3.47Å; S979-H983 PolarHBondContact O-N 3.36Å
980	L	75.8	Confident	67.3	Low	17 Å²	17	79.7 Å²	79.7	9%	0.089	40%	0.401	C	S	.	.	H	α-helix	trans	-70.7	-45.3	164.7	175.4	63.4	0	0	0	111.2	F965 Q966 C967 F972 F976 K977 R982 H983 M984	F965-L980 HydrophobicContact CB-CB 3.94Å; F965-L980 HydrophobicContact CB-CD2 3.69Å; F965-L980 HydrophobicContact CB-CG 4.39Å; Q966-L980 WeakPolarHBondContact O-CD2 3.39Å; C967-L980 HydrophobicContact CB-CD1 3.83Å; F972-L980 HydrophobicContact CD1-CD1 4.29Å; F976-L980 PolarHBondContact O-N 3.03Å; K977-L980 PolarHBondContact O-N 3.21Å; L980-R982 VanDerWaalsContact C-N 3.3Å; L980-R982 PolarHBondContact O-N 3.21Å; L980-H983 CarbonylContact O-C 3.59Å; L980-H983 WeakPolarHBondContact O-CA 3.32Å; L980-H983 WeakPolarHBondContact O-CB 3.28Å; L980-H983 PolarHBondContact O-N 3.24Å; L980-M984 HydrophobicContact CD1-CG 3.95Å; L980-M984 HydrophobicContact CD1-SD 4.29Å; L980-M984 HydrophobicContact CD2-SD 4.18Å; L980-M984 HydrophobicContact CG-CG 4.11Å; L980-M984 HydrophobicContact CG-SD 4.06Å; L980-M984 PolarHBondContact O-N 3.29Å
981	L	70.6	Confident	66.9	Low	85 Å²	85	81.7 Å²	81.7	45%	0.445	41%	0.405	S	S	.	.	H	α-helix	trans	-57.4	-46.1	178.5	-71.5	169.9	0	0	0	110.7	K977 P978 H983 M984 E985	K977-L981 HydrophobicContact CG-CD1 4.22Å; K977-L981 HydrophobicContact CG-CG 4.37Å; K977-L981 WeakPolarHBondContact O-CG 3.21Å; K977-L981 PolarHBondContact O-N 2.72Å; P978-L981 PolarHBondContact O-N 2.95Å; L981-H983 PolarHBondContact O-N 2.86Å; L981-M984 CarbonylContact O-C 3.45Å; L981-M984 PolarHBondContact O-N 3.42Å; L981-M984 VanDerWaalsContact O-N 3.08Å; L981-E985 WeakPolarHBondContact O-CB 3.47Å; L981-E985 VanDerWaalsContact O-CG 3.23Å; L981-E985 WeakPolarHBondContact O-CG 3.45Å; L981-E985 PolarHBondContact O-N 3.46Å
982	R	67.6	Low	66.6	Low	165 Å²	165	78.5 Å²	78.5	62%	0.623	38%	0.384	S	S	*	.	H	α-helix	trans	-60.3	-15.9	172.8	-158.7	-167.7	64.6	-174.2	-1.2	115.2	P978 L980 E985	P978-R982 WeakPolarHBondContact O-CB 3.43Å; P978-R982 PolarHBondContact O-N 2.9Å; L980-R982 VanDerWaalsContact C-N 3.3Å; L980-R982 PolarHBondContact O-N 3.21Å; R982-E985 VanDerWaalsContact CA-CD 3.46Å; R982-E985 WeakPolarHBondContact CA-OE2 3.43Å; R982-E985 PolarHBondContact N-OE1 2.91Å
983	H	71.8	Confident	66.3	Low	14 Å²	14	77.8 Å²	77.8	7%	0.065	38%	0.381	C	S	.	.	H	α-helix	trans	-95.1	-40	172.5	168.7	65.7	0	0	0	111.8	C970 F972 S979 L980 L981 E985 Q986 H987	C970-H983 PolarHBondContact SG-CE1 2.84Å; C970-H983 PolarHBondContact SG-NE2 2.67Å; F972-H983 WeakPolarHBondContact CB-NE2 3.47Å; F972-H983 HydrophobicContact CD1-CB 3.59Å; F972-H983 AromaticContact CD1-CD2 3.34Å; F972-H983 WeakPolarHBondContact CD1-CD2 3.2Å; F972-H983 AromaticContact CD1-CG 3.29Å; F972-H983 HydrophobicContact CE1-CB 3.49Å; F972-H983 VanDerWaalsContact CE1-CB 3.49Å; F972-H983 AromaticContact CE1-CG 3.73Å; F972-H983 HydrophobicContact CG-CB 4.32Å; F972-H983 AromaticContact CG-CD2 3.66Å; F972-H983 AromaticContact CG-CG 3.63Å; F972-H983 AromaticContact CG-ND1 3.89Å; F972-H983 AromaticContact CG-NE2 3.93Å; F972-H983 HydrophobicContact CZ-CB 4.18Å; S979-H983 PolarHBondContact O-N 3.36Å; L980-H983 CarbonylContact O-C 3.59Å; L980-H983 WeakPolarHBondContact O-CA 3.32Å; L980-H983 WeakPolarHBondContact O-CB 3.28Å; L980-H983 PolarHBondContact O-N 3.24Å; L981-H983 PolarHBondContact O-N 2.86Å; H983-E985 PolarHBondContact O-N 3.36Å; H983-Q986 PolarHBondContact ND1-OE1 3.19Å; H983-Q986 WeakPolarHBondContact O-CA 3.45Å; H983-Q986 WeakPolarHBondContact O-CB 3.35Å; H983-Q986 WeakPolarHBondContact O-CG 3.48Å; H983-Q986 PolarHBondContact O-N 3.37Å; H983-H987 AromaticContact CE1-NE2 3.39Å; H983-H987 PolarHBondContact CE1-NE2 3.28Å; H983-H987 AromaticContact NE2-CD2 3.73Å; H983-H987 AromaticContact NE2-NE2 3.02Å; H983-H987 PolarHBondContact NE2-NE2 3.35Å
984	M	63.3	Low	66.1	Low	55 Å²	55	84 Å²	84	27%	0.271	40%	0.397	S	S	.	.	H	α-helix	trans	-64	-26	171.1	-62.7	-170.2	76.1	0	0	112.3	S968 L980 L981 Q986 H987 A988	S968-M984 VanDerWaalsContact OG-CE 3.24Å; S968-M984 WeakPolarHBondContact OG-CE 3.33Å; L980-M984 HydrophobicContact CD1-CG 3.95Å; L980-M984 HydrophobicContact CD1-SD 4.29Å; L980-M984 HydrophobicContact CD2-SD 4.18Å; L980-M984 HydrophobicContact CG-CG 4.11Å; L980-M984 HydrophobicContact CG-SD 4.06Å; L980-M984 PolarHBondContact O-N 3.29Å; L981-M984 CarbonylContact O-C 3.45Å; L981-M984 PolarHBondContact O-N 3.42Å; L981-M984 VanDerWaalsContact O-N 3.08Å; M984-Q986 PolarHBondContact O-N 3.16Å; M984-Q986 VanDerWaalsContact O-N 3.16Å; M984-H987 PolarHBondContact O-N 3.28Å; M984-H987 VanDerWaalsContact O-N 3.12Å; M984-A988 PolarHBondContact O-N 2.83Å
985	E	66.8	Low	66.1	Low	52 Å²	52	84.1 Å²	84.1	24%	0.243	40%	0.398	C	S	.	.	H	α-helix	trans	-57.7	-16.9	165.5	-78.2	160.2	-140.8	0	0	113.6	L981 R982 H983 N1003 I1004	L981-E985 WeakPolarHBondContact O-CB 3.47Å; L981-E985 VanDerWaalsContact O-CG 3.23Å; L981-E985 WeakPolarHBondContact O-CG 3.45Å; L981-E985 PolarHBondContact O-N 3.46Å; R982-E985 VanDerWaalsContact CA-CD 3.46Å; R982-E985 WeakPolarHBondContact CA-OE2 3.43Å; R982-E985 PolarHBondContact N-OE1 2.91Å; H983-E985 PolarHBondContact O-N 3.36Å; E985-N1003 WeakPolarHBondContact CA-ND2 3.5Å; E985-N1003 WeakPolarHBondContact CB-ND2 3.21Å; E985-N1003 PolarHBondContact O-ND2 2.66Å; E985-I1004 WeakPolarHBondContact OE2-CD1 3.46Å
986	Q	59.6	Low	65.7	Low	134 Å²	134	87 Å²	87	63%	0.626	43%	0.425	S	S	*	.	H	α-helix	trans	-84.5	-33.2	174.4	-53.8	-179.6	-92.2	0	0	112.1	H983 M984	H983-Q986 PolarHBondContact ND1-OE1 3.19Å; H983-Q986 WeakPolarHBondContact O-CA 3.45Å; H983-Q986 WeakPolarHBondContact O-CB 3.35Å; H983-Q986 WeakPolarHBondContact O-CG 3.48Å; H983-Q986 PolarHBondContact O-N 3.37Å; M984-Q986 PolarHBondContact O-N 3.16Å; M984-Q986 VanDerWaalsContact O-N 3.16Å
987	H	63.4	Low	65.2	Low	54 Å²	54	88.3 Å²	88.3	25%	0.25	43%	0.432	C	S	.	.	H	α-helix	trans	-79.8	-20.7	178.1	-59.8	-55.9	0	0	0	113.3	C967 E969 H983 M984 K989	C967-H987 PolarHBondContact SG-CD2 2.95Å; E969-H987 HydrophobicContact CB-CB 4.45Å; H983-H987 AromaticContact CE1-NE2 3.39Å; H983-H987 PolarHBondContact CE1-NE2 3.28Å; H983-H987 AromaticContact NE2-CD2 3.73Å; H983-H987 AromaticContact NE2-NE2 3.02Å; H983-H987 PolarHBondContact NE2-NE2 3.35Å; M984-H987 PolarHBondContact O-N 3.28Å; M984-H987 VanDerWaalsContact O-N 3.12Å; H987-K989 PolarHBondContact O-N 3.27Å
988	A	59.1	Low	65.1	Low	36 Å²	36	84.9 Å²	84.9	30%	0.298	42%	0.423	S	S	.	.			trans	-60.6	99	178.3	0	0	0	0	0	112.7	M984 F990	M984-A988 PolarHBondContact O-N 2.83Å; A988-F990 PolarHBondContact O-N 3.48Å; A988-F990 VanDerWaalsContact O-N 3.14Å
989	K	53.9	Low	64.1	Low	217 Å²	217	89 Å²	89	94%	0.943	43%	0.433	S	S	*	.	S	Bend	trans	-57.5	-23.9	174.4	-64.1	-177.3	-179	179.2	0	113.2	H987	H987-K989 PolarHBondContact O-N 3.27Å
990	F	52	Low	63.7	Low	170 Å²	170	91.4 Å²	91.4	75%	0.746	44%	0.437	S	S	*	.			trans	-98.9	117.5	175.8	-167.2	-101.6	0	0	0	111.6	A988 P992	A988-F990 PolarHBondContact O-N 3.48Å; A988-F990 VanDerWaalsContact O-N 3.14Å; F990-P992 HydrophobicContact CE1-CB 4.01Å; F990-P992 WeakPolarHBondContact O-CD 3.47Å
991	K	65	Low	63.3	Low	89 Å²	89	92.3 Å²	92.3	39%	0.387	45%	0.445	S	S	.	.			trans	-119.4	91.5	-176.6	-70.3	176.4	178.3	178.8	0	110.2	F993 C1002	K991-F993 VanDerWaalsContact C-N 3.34Å; K991-F993 PolarHBondContact O-N 2.66Å; K991-C1002 CarbonylContact C-O 3.42Å; K991-C1002 VanDerWaalsContact C-O 3.25Å
992	P	58.1	Low	63.2	Low	61 Å²	61	88.7 Å²	88.7	40%	0.396	43%	0.427	S	S	.	.			trans	-70.7	-17	-169.2	24.5	-34.7	0	0	0	116	F990	F990-P992 HydrophobicContact CE1-CB 4.01Å; F990-P992 WeakPolarHBondContact O-CD 3.47Å
993	F	62.2	Low	62.9	Low	65 Å²	65	82.8 Å²	82.8	29%	0.285	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	105.1	179.7	-59	-78	0	0	0	110.1	K991 S1001 C1002 N1003 A1005 L1008	K991-F993 VanDerWaalsContact C-N 3.34Å; K991-F993 PolarHBondContact O-N 2.66Å; F993-S1001 CarbonylContact O-C 3.3Å; F993-S1001 WeakPolarHBondContact O-CA 3.21Å; F993-C1002 PolarHBondContact N-O 3.41Å; F993-C1002 PolarHBondContact O-N 3.08Å; F993-N1003 VanDerWaalsContact CD2-C 3.44Å; F993-N1003 WeakPolarHBondContact CE2-O 3.24Å; F993-A1005 HydrophobicContact CD1-CB 3.9Å; F993-A1005 HydrophobicContact CE1-CB 3.75Å; F993-A1005 HydrophobicContact CE2-CB 4.49Å; F993-A1005 HydrophobicContact CG-CB 4.35Å; F993-A1005 HydrophobicContact CZ-CB 4.06Å; F993-L1008 HydrophobicContact CB-CB 4.27Å; F993-L1008 HydrophobicContact CB-CD2 3.98Å
994	R	65.4	Low	62.6	Low	193 Å²	193	85.6 Å²	85.6	73%	0.728	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	148	174.2	-65.7	-175.4	168.1	-171.3	-5.2	110.3	Y1000 L1008	R994-Y1000 WeakPolarHBondContact CA-O 3.49Å; R994-L1008 VanDerWaalsContact O-CD2 3.24Å; R994-L1008 WeakPolarHBondContact O-CD2 2.99Å
995	C	71.8	Confident	62.8	Low	12 Å²	12	84.4 Å²	84.4	8%	0.081	42%	0.422	C	S	.	.			trans	-71.6	142.7	162.6	-167.1	0	0	0	0	109.1	H997 C998 Y1000 L1008	C995-H997 VanDerWaalsContact C-N 3.31Å; C995-H997 PolarHBondContact SG-N 2.59Å; C995-C998 WeakPolarHBondContact CB-O 3.42Å; C995-Y1000 PolarHBondContact N-O 3.39Å; C995-L1008 HydrophobicContact CB-CD1 3.7Å
996	A	61.8	Low	63.1	Low	96 Å²	96	84.4 Å²	84.4	79%	0.793	44%	0.435	S	S	*	.	S	Bend	trans	-75.9	-24.3	172.5	0	0	0	0	0	112
997	H	61.9	Low	63.6	Low	86 Å²	86	79.2 Å²	79.2	40%	0.398	42%	0.415	S	S	.	.	S	Bend	trans	-105.8	-5.4	-169.1	-52	-110.1	0	0	0	113	C995 F1012 H1016 E1019	C995-H997 VanDerWaalsContact C-N 3.31Å; C995-H997 PolarHBondContact SG-N 2.59Å; H997-F1012 AromaticContact CD2-CE2 3.64Å; H997-F1012 AromaticContact NE2-CE2 3.79Å; H997-H1016 WeakPolarHBondContact CB-CE1 3.49Å; H997-H1016 VanDerWaalsContact CB-ND1 3.33Å; H997-H1016 WeakPolarHBondContact CB-ND1 3.32Å; H997-E1019 IonicContact CE1-OE1 2.59Å; H997-E1019 PolarHBondContact CE1-OE1 2.68Å; H997-E1019 IonicContact CE1-OE2 2.68Å; H997-E1019 IonicContact CG-OE1 3.63Å; H997-E1019 IonicContact CG-OE2 2.66Å; H997-E1019 IonicContact ND1-OE1 2.71Å; H997-E1019 PolarHBondContact ND1-OE1 3.36Å; H997-E1019 IonicContact ND1-OE2 2.66Å; H997-E1019 PolarHBondContact ND1-OE2 3.4Å
998	C	71.2	Confident	64.1	Low	49 Å²	49	77.3 Å²	77.3	33%	0.331	41%	0.407	S	S	.	.	S	Bend	trans	-158.9	171	168.6	79.4	0	0	0	0	112.7	C995 Y1000 H1011	C995-C998 WeakPolarHBondContact CB-O 3.42Å; C998-Y1000 PolarHBondContact O-N 3.01Å; C998-Y1000 PolarHBondContact SG-N 2.71Å; C998-H1011 PolarHBondContact SG-CE1 2.89Å; C998-H1011 PolarHBondContact SG-NE2 3.36Å
999	H	52.6	Low	64.7	Low	182 Å²	182	79.7 Å²	79.7	84%	0.843	41%	0.411	S	S	*	.	S	Bend	trans	-70.7	5.8	-178.5	-60.6	-50.5	0	0	0	116	S1001	H999-S1001 PolarHBondContact O-N 2.86Å
1000	Y	64.2	Low	65.5	Low	87 Å²	87	77.5 Å²	77.5	34%	0.341	40%	0.396	S	S	.	.			trans	-63.5	126.4	177	-175.4	-98.3	0	0	0	111.3	R994 C995 C998 C1002 L1008 H1011	R994-Y1000 WeakPolarHBondContact CA-O 3.49Å; C995-Y1000 PolarHBondContact N-O 3.39Å; C998-Y1000 PolarHBondContact O-N 3.01Å; C998-Y1000 PolarHBondContact SG-N 2.71Å; Y1000-C1002 HydrophobicContact CE1-CB 4.08Å; Y1000-L1008 HydrophobicContact CD1-CD1 4.21Å; Y1000-H1011 WeakPolarHBondContact CB-NE2 3.45Å; Y1000-H1011 HydrophobicContact CD1-CB 3.76Å; Y1000-H1011 AromaticContact CD1-CD2 3.47Å; Y1000-H1011 VanDerWaalsContact CD1-CD2 3.47Å; Y1000-H1011 WeakPolarHBondContact CD1-CD2 3.38Å; Y1000-H1011 AromaticContact CD1-CG 3.41Å; Y1000-H1011 VanDerWaalsContact CD1-CG 3.41Å; Y1000-H1011 AromaticContact CD1-ND1 4Å; Y1000-H1011 HydrophobicContact CE1-CB 3.66Å; Y1000-H1011 AromaticContact CE1-CG 3.86Å; Y1000-H1011 HydrophobicContact CG-CB 4.31Å; Y1000-H1011 AromaticContact CG-CD2 3.77Å; Y1000-H1011 AromaticContact CG-CE1 3.89Å; Y1000-H1011 AromaticContact CG-CG 3.63Å; Y1000-H1011 AromaticContact CG-ND1 3.7Å; Y1000-H1011 AromaticContact CG-NE2 3.93Å
1001	S	66.3	Low	66.6	Low	37 Å²	37	70.8 Å²	70.8	26%	0.259	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.4	179.6	60.1	0	0	0	0	111.7	F993 H999	F993-S1001 CarbonylContact O-C 3.3Å; F993-S1001 WeakPolarHBondContact O-CA 3.21Å; H999-S1001 PolarHBondContact O-N 2.86Å
1002	C	69.4	Low	66.9	Low	8 Å²	8	67.1 Å²	67.1	5%	0.054	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	-178.5	179.8	68.3	0	0	0	0	111.4	K991 F993 Y1000 I1004 A1007 L1008	K991-C1002 CarbonylContact C-O 3.42Å; K991-C1002 VanDerWaalsContact C-O 3.25Å; F993-C1002 PolarHBondContact N-O 3.41Å; F993-C1002 PolarHBondContact O-N 3.08Å; Y1000-C1002 HydrophobicContact CE1-CB 4.08Å; C1002-I1004 PolarHBondContact SG-O 3.4Å; C1002-I1004 VanDerWaalsContact SG-O 3.33Å; C1002-A1007 HydrophobicContact CB-CB 4.36Å; C1002-L1008 PolarHBondContact SG-N 2.85Å; C1002-L1008 VanDerWaalsContact SG-N 3.45Å
1003	N	61.6	Low	67.5	Low	41 Å²	41	68.8 Å²	68.8	22%	0.219	36%	0.357	C	S	.	.	S	Bend	trans	-118	7.8	-176.9	41.5	20.9	0	0	0	113.4	E985 F993	E985-N1003 WeakPolarHBondContact CA-ND2 3.5Å; E985-N1003 WeakPolarHBondContact CB-ND2 3.21Å; E985-N1003 PolarHBondContact O-ND2 2.66Å; F993-N1003 VanDerWaalsContact CD2-C 3.44Å; F993-N1003 WeakPolarHBondContact CE2-O 3.24Å
1004	I	65.9	Low	67.8	Low	73 Å²	73	71.3 Å²	71.3	37%	0.374	37%	0.372	S	S	.	.			trans	-131.6	119.7	171.6	-61.5	-175.5	0	0	0	109.6	E985 C1002 G1006 A1007 L1008	E985-I1004 WeakPolarHBondContact OE2-CD1 3.46Å; C1002-I1004 PolarHBondContact SG-O 3.4Å; C1002-I1004 VanDerWaalsContact SG-O 3.33Å; I1004-G1006 PolarHBondContact O-N 2.9Å; I1004-G1006 VanDerWaalsContact O-N 3.11Å; I1004-A1007 HydrophobicContact CB-CB 4.34Å; I1004-A1007 WeakPolarHBondContact O-CA 3.4Å; I1004-A1007 WeakPolarHBondContact O-CB 3.42Å; I1004-A1007 PolarHBondContact O-N 3.43Å; I1004-L1008 PolarHBondContact O-N 3.5Å
1005	A	66.8	Low	67.8	Low	31 Å²	31	69.3 Å²	69.3	26%	0.256	37%	0.369	S	S	.	.	H	α-helix	trans	-52.2	-35	176.9	0	0	0	0	0	113.9	F993 A1007 L1008 K1009	F993-A1005 HydrophobicContact CD1-CB 3.9Å; F993-A1005 HydrophobicContact CE1-CB 3.75Å; F993-A1005 HydrophobicContact CE2-CB 4.49Å; F993-A1005 HydrophobicContact CG-CB 4.35Å; F993-A1005 HydrophobicContact CZ-CB 4.06Å; A1005-A1007 VanDerWaalsContact C-N 3.32Å; A1005-A1007 PolarHBondContact O-N 2.89Å; A1005-L1008 PolarHBondContact O-N 3.01Å; A1005-K1009 WeakPolarHBondContact O-CB 3.39Å; A1005-K1009 PolarHBondContact O-N 3.11Å
1006	G	72.1	Confident	67.7	Low	52 Å²	52	69.9 Å²	69.9	54%	0.536	37%	0.37	S	S	.	.	H	α-helix	trans	-67.4	-24.7	174.3	0	0	0	0	0	115	I1004 R1010	I1004-G1006 PolarHBondContact O-N 2.9Å; I1004-G1006 VanDerWaalsContact O-N 3.11Å; G1006-R1010 WeakPolarHBondContact O-CB 3.16Å; G1006-R1010 PolarHBondContact O-N 3.04Å
1007	A	71.6	Confident	67.5	Low	24 Å²	24	70.3 Å²	70.3	20%	0.198	37%	0.365	C	S	.	.	H	α-helix	trans	-76.1	-42.9	171.1	0	0	0	0	0	110.6	C1002 I1004 A1005 R1010 H1011	C1002-A1007 HydrophobicContact CB-CB 4.36Å; I1004-A1007 HydrophobicContact CB-CB 4.34Å; I1004-A1007 WeakPolarHBondContact O-CA 3.4Å; I1004-A1007 WeakPolarHBondContact O-CB 3.42Å; I1004-A1007 PolarHBondContact O-N 3.43Å; A1005-A1007 VanDerWaalsContact C-N 3.32Å; A1005-A1007 PolarHBondContact O-N 2.89Å; A1007-R1010 PolarHBondContact O-N 3.15Å; A1007-H1011 PolarHBondContact O-N 3.27Å
1008	L	73.1	Confident	66.9	Low	14 Å²	14	75.4 Å²	75.4	7%	0.073	39%	0.389	C	S	.	.	H	α-helix	trans	-57.9	-52.1	171.8	175.2	59.9	0	0	0	111.4	F993 R994 C995 Y1000 C1002 I1004 A1005 R1010 H1011 F1012	F993-L1008 HydrophobicContact CB-CB 4.27Å; F993-L1008 HydrophobicContact CB-CD2 3.98Å; R994-L1008 VanDerWaalsContact O-CD2 3.24Å; R994-L1008 WeakPolarHBondContact O-CD2 2.99Å; C995-L1008 HydrophobicContact CB-CD1 3.7Å; Y1000-L1008 HydrophobicContact CD1-CD1 4.21Å; C1002-L1008 PolarHBondContact SG-N 2.85Å; C1002-L1008 VanDerWaalsContact SG-N 3.45Å; I1004-L1008 PolarHBondContact O-N 3.5Å; A1005-L1008 PolarHBondContact O-N 3.01Å; L1008-R1010 VanDerWaalsContact C-N 3.3Å; L1008-R1010 PolarHBondContact O-N 3.44Å; L1008-H1011 WeakPolarHBondContact O-CA 3.34Å; L1008-H1011 WeakPolarHBondContact O-CB 3.43Å; L1008-H1011 PolarHBondContact O-N 2.71Å; L1008-F1012 WeakPolarHBondContact O-CB 3.36Å; L1008-F1012 PolarHBondContact O-N 3.39Å
1009	K	70.9	Confident	66.2	Low	87 Å²	87	77.3 Å²	77.3	38%	0.378	39%	0.393	S	S	.	.	H	α-helix	trans	-59.1	-40.1	179.7	-171.6	173.4	-179.4	97	0	112.2	A1005 F1012 N1013 Y1021	A1005-K1009 WeakPolarHBondContact O-CB 3.39Å; A1005-K1009 PolarHBondContact O-N 3.11Å; K1009-F1012 PolarHBondContact O-N 3.18Å; K1009-N1013 WeakPolarHBondContact CG-OD1 3.19Å; K1009-N1013 VanDerWaalsContact O-CB 3.3Å; K1009-N1013 WeakPolarHBondContact O-CB 3.4Å; K1009-N1013 PolarHBondContact O-N 3.15Å; K1009-N1013 PolarHBondContact O-OD1 2.89Å; K1009-Y1021 HydrophobicContact CB-CD2 4.32Å; K1009-Y1021 HydrophobicContact CB-CE1 4.31Å; K1009-Y1021 HydrophobicContact CB-CE2 3.71Å; K1009-Y1021 HydrophobicContact CD-CD1 3.96Å; K1009-Y1021 HydrophobicContact CD-CE1 3.76Å; K1009-Y1021 HydrophobicContact CD-CG 4.44Å; K1009-Y1021 HydrophobicContact CG-CD1 4.15Å; K1009-Y1021 HydrophobicContact CG-CD2 4.02Å; K1009-Y1021 HydrophobicContact CG-CE1 4.01Å; K1009-Y1021 HydrophobicContact CG-CE2 3.88Å; K1009-Y1021 HydrophobicContact CG-CG 4.16Å
1010	R	71.6	Confident	65.9	Low	170 Å²	170	74.2 Å²	74.2	64%	0.642	39%	0.387	S	S	*	.	H	α-helix	trans	-64.5	-39.1	174.3	-178.1	-179.1	61.3	149	2.4	112.4	G1006 A1007 L1008 I1014	G1006-R1010 WeakPolarHBondContact O-CB 3.16Å; G1006-R1010 PolarHBondContact O-N 3.04Å; A1007-R1010 PolarHBondContact O-N 3.15Å; L1008-R1010 VanDerWaalsContact C-N 3.3Å; L1008-R1010 PolarHBondContact O-N 3.44Å; R1010-I1014 HydrophobicContact CG-CD1 3.94Å; R1010-I1014 VanDerWaalsContact O-CD1 3.31Å; R1010-I1014 WeakPolarHBondContact O-CD1 3.38Å; R1010-I1014 VanDerWaalsContact O-CG1 3.23Å; R1010-I1014 WeakPolarHBondContact O-CG1 3.38Å; R1010-I1014 PolarHBondContact O-N 3.43Å
1011	H	75.4	Confident	65.3	Low	29 Å²	29	72.2 Å²	72.2	13%	0.134	38%	0.379	C	S	.	.	H	α-helix	trans	-65.1	-46.8	174.3	153.2	79.8	0	0	0	111.2	C998 Y1000 A1007 L1008 I1014 K1015	C998-H1011 PolarHBondContact SG-CE1 2.89Å; C998-H1011 PolarHBondContact SG-NE2 3.36Å; Y1000-H1011 WeakPolarHBondContact CB-NE2 3.45Å; Y1000-H1011 HydrophobicContact CD1-CB 3.76Å; Y1000-H1011 AromaticContact CD1-CD2 3.47Å; Y1000-H1011 VanDerWaalsContact CD1-CD2 3.47Å; Y1000-H1011 WeakPolarHBondContact CD1-CD2 3.38Å; Y1000-H1011 AromaticContact CD1-CG 3.41Å; Y1000-H1011 VanDerWaalsContact CD1-CG 3.41Å; Y1000-H1011 AromaticContact CD1-ND1 4Å; Y1000-H1011 HydrophobicContact CE1-CB 3.66Å; Y1000-H1011 AromaticContact CE1-CG 3.86Å; Y1000-H1011 HydrophobicContact CG-CB 4.31Å; Y1000-H1011 AromaticContact CG-CD2 3.77Å; Y1000-H1011 AromaticContact CG-CE1 3.89Å; Y1000-H1011 AromaticContact CG-CG 3.63Å; Y1000-H1011 AromaticContact CG-ND1 3.7Å; Y1000-H1011 AromaticContact CG-NE2 3.93Å; A1007-H1011 PolarHBondContact O-N 3.27Å; L1008-H1011 WeakPolarHBondContact O-CA 3.34Å; L1008-H1011 WeakPolarHBondContact O-CB 3.43Å; L1008-H1011 PolarHBondContact O-N 2.71Å; H1011-I1014 PolarHBondContact O-N 3.45Å; H1011-K1015 PolarHBondContact O-N 2.87Å
1012	F	70.8	Confident	64.3	Low	12 Å²	12	78.3 Å²	78.3	5%	0.053	40%	0.403	C	S	.	.	H	α-helix	trans	-56.8	-54.4	177.6	-169.9	-73.3	0	0	0	110.6	H997 L1008 K1009 I1014 K1015 H1016 E1019 Y1021	H997-F1012 AromaticContact CD2-CE2 3.64Å; H997-F1012 AromaticContact NE2-CE2 3.79Å; L1008-F1012 WeakPolarHBondContact O-CB 3.36Å; L1008-F1012 PolarHBondContact O-N 3.39Å; K1009-F1012 PolarHBondContact O-N 3.18Å; F1012-I1014 PolarHBondContact O-N 3.27Å; F1012-K1015 PolarHBondContact O-N 3.38Å; F1012-K1015 VanDerWaalsContact O-N 3.14Å; F1012-H1016 HydrophobicContact CD1-CB 3.97Å; F1012-H1016 HydrophobicContact CD2-CB 4.2Å; F1012-H1016 HydrophobicContact CE1-CB 3.95Å; F1012-H1016 WeakPolarHBondContact CE1-O 3.34Å; F1012-H1016 HydrophobicContact CE2-CB 4.21Å; F1012-H1016 HydrophobicContact CG-CB 4.09Å; F1012-H1016 HydrophobicContact CZ-CB 4.08Å; F1012-H1016 CarbonylContact O-C 3.59Å; F1012-H1016 WeakPolarHBondContact O-CA 3.44Å; F1012-H1016 PolarHBondContact O-N 2.91Å; F1012-E1019 HydrophobicContact CE1-CB 4.28Å; F1012-E1019 WeakPolarHBondContact CE1-O 3.1Å; F1012-E1019 HydrophobicContact CZ-CB 3.87Å; F1012-Y1021 HydrophobicContact CB-CD2 3.97Å; F1012-Y1021 HydrophobicContact CB-CE2 4.47Å; F1012-Y1021 AromaticContact CD1-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD1-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD1-CG 4.42Å; F1012-Y1021 AromaticContact CD2-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD2-CD2 3.96Å; F1012-Y1021 HydrophobicContact CE1-CD2 4.46Å; F1012-Y1021 HydrophobicContact CE2-CD2 4.44Å; F1012-Y1021 AromaticContact CG-CD2 3.7Å; F1012-Y1021 HydrophobicContact CG-CD2 3.7Å
1013	N	70.5	Confident	63.1	Low	96 Å²	96	83.8 Å²	83.8	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-59.9	-3.1	175.6	-81.4	83.9	0	0	0	115.7	K1009	K1009-N1013 WeakPolarHBondContact CG-OD1 3.19Å; K1009-N1013 VanDerWaalsContact O-CB 3.3Å; K1009-N1013 WeakPolarHBondContact O-CB 3.4Å; K1009-N1013 PolarHBondContact O-N 3.15Å; K1009-N1013 PolarHBondContact O-OD1 2.89Å
1014	I	68.9	Low	62.1	Low	118 Å²	118	86.3 Å²	86.3	61%	0.605	46%	0.459	S	S	*	.	H	α-helix	trans	-118.2	-22.6	178.5	-68.2	172.3	0	0	0	112.3	R1010 H1011 F1012	R1010-I1014 HydrophobicContact CG-CD1 3.94Å; R1010-I1014 VanDerWaalsContact O-CD1 3.31Å; R1010-I1014 WeakPolarHBondContact O-CD1 3.38Å; R1010-I1014 VanDerWaalsContact O-CG1 3.23Å; R1010-I1014 WeakPolarHBondContact O-CG1 3.38Å; R1010-I1014 PolarHBondContact O-N 3.43Å; H1011-I1014 PolarHBondContact O-N 3.45Å; F1012-I1014 PolarHBondContact O-N 3.27Å
1015	K	64.6	Low	60.7	Low	151 Å²	151	86.1 Å²	86.1	66%	0.657	47%	0.474	S	S	*	.	H	α-helix	trans	-119.7	-14.3	-177.8	-71.8	-59.9	-169.6	178.8	0	114.9	H1011 F1012 P1017	H1011-K1015 PolarHBondContact O-N 2.87Å; F1012-K1015 PolarHBondContact O-N 3.38Å; F1012-K1015 VanDerWaalsContact O-N 3.14Å; K1015-P1017 VanDerWaalsContact C-CD 3.5Å
1016	H	69.9	Low	59.7	Low	25 Å²	25	92.8 Å²	92.8	12%	0.116	51%	0.505	C	S	.	.			trans	-134.4	60.8	178.9	-60	-78.8	0	0	0	108.9	H997 F1012 E1018 E1019	H997-H1016 WeakPolarHBondContact CB-CE1 3.49Å; H997-H1016 VanDerWaalsContact CB-ND1 3.33Å; H997-H1016 WeakPolarHBondContact CB-ND1 3.32Å; F1012-H1016 HydrophobicContact CD1-CB 3.97Å; F1012-H1016 HydrophobicContact CD2-CB 4.2Å; F1012-H1016 HydrophobicContact CE1-CB 3.95Å; F1012-H1016 WeakPolarHBondContact CE1-O 3.34Å; F1012-H1016 HydrophobicContact CE2-CB 4.21Å; F1012-H1016 HydrophobicContact CG-CB 4.09Å; F1012-H1016 HydrophobicContact CZ-CB 4.08Å; F1012-H1016 CarbonylContact O-C 3.59Å; F1012-H1016 WeakPolarHBondContact O-CA 3.44Å; F1012-H1016 PolarHBondContact O-N 2.91Å; H1016-E1018 VanDerWaalsContact C-N 3.34Å; H1016-E1018 PolarHBondContact O-N 2.92Å; H1016-E1019 WeakPolarHBondContact CB-OE2 3.22Å; H1016-E1019 IonicContact CE1-OE2 2.71Å; H1016-E1019 IonicContact CG-OE2 3.48Å; H1016-E1019 IonicContact ND1-OE2 3.84Å; H1016-E1019 PolarHBondContact ND1-OE2 2.97Å
1017	P	57.1	Low	57.7	Low	104 Å²	104	93.5 Å²	93.5	68%	0.675	51%	0.513	S	S	*	.	S	Bend	trans	-74.3	-21	-170.5	30.3	-35.2	0	0	0	114.3	K1015	K1015-P1017 VanDerWaalsContact C-CD 3.5Å
1018	E	50.3	Low	55.9	Low	194 Å²	194	100.2 Å²	100.2	91%	0.907	54%	0.544	S	S	*	.	S	Bend	trans	-99.5	-7.7	-175.8	-64.1	179.7	171	0	0	113.3	H1016	H1016-E1018 VanDerWaalsContact C-N 3.34Å; H1016-E1018 PolarHBondContact O-N 2.92Å
1019	E	57.5	Low	54.4	Low	89 Å²	89	105.4 Å²	105.4	42%	0.416	58%	0.578	S	S	.	*	S	Bend	trans	-96.9	153.4	-176.2	-61	179.2	107.7	0	0	111.7	H997 F1012 H1016 Y1021	H997-E1019 IonicContact CE1-OE1 2.59Å; H997-E1019 PolarHBondContact CE1-OE1 2.68Å; H997-E1019 IonicContact CE1-OE2 2.68Å; H997-E1019 IonicContact CG-OE1 3.63Å; H997-E1019 IonicContact CG-OE2 2.66Å; H997-E1019 IonicContact ND1-OE1 2.71Å; H997-E1019 PolarHBondContact ND1-OE1 3.36Å; H997-E1019 IonicContact ND1-OE2 2.66Å; H997-E1019 PolarHBondContact ND1-OE2 3.4Å; F1012-E1019 HydrophobicContact CE1-CB 4.28Å; F1012-E1019 WeakPolarHBondContact CE1-O 3.1Å; F1012-E1019 HydrophobicContact CZ-CB 3.87Å; H1016-E1019 WeakPolarHBondContact CB-OE2 3.22Å; H1016-E1019 IonicContact CE1-OE2 2.71Å; H1016-E1019 IonicContact CG-OE2 3.48Å; H1016-E1019 IonicContact ND1-OE2 3.84Å; H1016-E1019 PolarHBondContact ND1-OE2 2.97Å; E1019-Y1021 PolarHBondContact O-N 2.92Å
1020	T	45.7	Very low	52.6	Low	116 Å²	116	106.8 Å²	106.8	71%	0.712	59%	0.59	S	S	*	*			trans	-80.5	113.8	-179.5	40	0	0	0	0	111.9	E1022	T1020-E1022 PolarHBondContact O-N 3.47Å
1021	Y	51.3	Low	50.9	Low	45 Å²	45	103.4 Å²	103.4	18%	0.176	59%	0.593	C	S	.	*			trans	-69.6	98.5	174.4	178.5	-88.8	0	0	0	111.2	K1009 F1012 E1019 N1023	K1009-Y1021 HydrophobicContact CB-CD2 4.32Å; K1009-Y1021 HydrophobicContact CB-CE1 4.31Å; K1009-Y1021 HydrophobicContact CB-CE2 3.71Å; K1009-Y1021 HydrophobicContact CD-CD1 3.96Å; K1009-Y1021 HydrophobicContact CD-CE1 3.76Å; K1009-Y1021 HydrophobicContact CD-CG 4.44Å; K1009-Y1021 HydrophobicContact CG-CD1 4.15Å; K1009-Y1021 HydrophobicContact CG-CD2 4.02Å; K1009-Y1021 HydrophobicContact CG-CE1 4.01Å; K1009-Y1021 HydrophobicContact CG-CE2 3.88Å; K1009-Y1021 HydrophobicContact CG-CG 4.16Å; F1012-Y1021 HydrophobicContact CB-CD2 3.97Å; F1012-Y1021 HydrophobicContact CB-CE2 4.47Å; F1012-Y1021 AromaticContact CD1-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD1-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD1-CG 4.42Å; F1012-Y1021 AromaticContact CD2-CD2 3.96Å; F1012-Y1021 HydrophobicContact CD2-CD2 3.96Å; F1012-Y1021 HydrophobicContact CE1-CD2 4.46Å; F1012-Y1021 HydrophobicContact CE2-CD2 4.44Å; F1012-Y1021 AromaticContact CG-CD2 3.7Å; F1012-Y1021 HydrophobicContact CG-CD2 3.7Å; E1019-Y1021 PolarHBondContact O-N 2.92Å; Y1021-N1023 WeakPolarHBondContact CE1-OD1 3.37Å; Y1021-N1023 PolarHBondContact OH-OD1 3.02Å
1022	E	44.6	Very low	49.1	Very low	166 Å²	166	108.9 Å²	108.9	78%	0.776	62%	0.618	S	S	*	*			trans	-91.3	138	168.4	-61.3	-155.9	155.7	0	0	111.9	T1020 A1024	T1020-E1022 PolarHBondContact O-N 3.47Å; E1022-A1024 PolarHBondContact O-N 3.15Å; E1022-A1024 VanDerWaalsContact O-N 3.15Å
1023	N	44.3	Very low	47.7	Very low	123 Å²	123	113.5 Å²	113.5	66%	0.658	65%	0.647	S	S	*	*			trans	-83.6	87.2	174.8	-82.4	-56.2	0	0	0	110.1	Y1021 G1025	Y1021-N1023 WeakPolarHBondContact CE1-OD1 3.37Å; Y1021-N1023 PolarHBondContact OH-OD1 3.02Å; N1023-G1025 PolarHBondContact O-N 3.46Å
1024	A	41.4	Very low	46.6	Very low	94 Å²	94	115.2 Å²	115.2	78%	0.777	66%	0.656	S	S	*	*			trans	-55.9	113.2	163.2	0	0	0	0	0	109.7	E1022	E1022-A1024 PolarHBondContact O-N 3.15Å; E1022-A1024 VanDerWaalsContact O-N 3.15Å
1025	G	36.7	Very low	45.5	Very low	68 Å²	68	117.9 Å²	117.9	70%	0.701	66%	0.663	S	S	*	*			trans	-71.9	-178.5	177.2	0	0	0	0	0	112.7	N1023 G1027	N1023-G1025 PolarHBondContact O-N 3.46Å; G1025-G1027 VanDerWaalsContact C-N 3.35Å; G1025-G1027 PolarHBondContact O-N 3.4Å
1026	L	44.7	Very low	44.7	Very low	171 Å²	171	119 Å²	119	90%	0.895	67%	0.671	S	S	*	*			trans	-67.4	86.7	178.3	-73.5	166.9	0	0	0	111.8
1027	G	31	Very low	43.5	Very low	68 Å²	68	125.8 Å²	125.8	70%	0.701	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-93.1	122.3	167	0	0	0	0	0	111.5	G1025	G1025-G1027 VanDerWaalsContact C-N 3.35Å; G1025-G1027 PolarHBondContact O-N 3.4Å
1028	L	34.5	Very low	43.3	Very low	165 Å²	165	125 Å²	125	86%	0.864	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-84.3	126.2	159.9	-73.3	167.9	0	0	0	107.8
1029	P	40.3	Very low	43.3	Very low	122 Å²	122	116.9 Å²	116.9	79%	0.792	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-78.8	124.9	176.5	30.3	-32.2	0	0	0	110.8
1030	N	33.4	Very low	43.2	Very low	117 Å²	117	116.7 Å²	116.7	63%	0.626	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-73.1	148.2	167.6	-79.6	0.7	0	0	0	110.5	E1032	N1030-E1032 PolarHBondContact O-N 2.85Å; N1030-E1032 VanDerWaalsContact O-N 3.15Å
1031	S	35.9	Very low	43.6	Very low	99 Å²	99	117.1 Å²	117.1	69%	0.692	67%	0.674	S	S	*	*	S	Bend	trans	-71.1	-5.9	-175.3	-171.8	0	0	0	0	115.1
1032	E	37.2	Very low	44.1	Very low	143 Å²	143	115 Å²	115	67%	0.668	67%	0.665	S	S	*	*	S	Bend	trans	-96.6	-33.3	-161.3	-63.7	177.2	129.1	0	0	113.6	N1030 L1034 K1035	N1030-E1032 PolarHBondContact O-N 2.85Å; N1030-E1032 VanDerWaalsContact O-N 3.15Å; E1032-L1034 PolarHBondContact O-N 3.26Å; E1032-K1035 PolarHBondContact O-N 2.89Å
1033	T	42.3	Very low	44.6	Very low	109 Å²	109	112.4 Å²	112.4	67%	0.669	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-65.7	-23.3	177.6	46	0	0	0	0	113	K1035	T1033-K1035 PolarHBondContact O-N 3.42Å
1034	L	46.8	Very low	45.1	Very low	133 Å²	133	112.1 Å²	112.1	70%	0.696	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-77	-1.8	179.2	-137.4	141.5	0	0	0	113.5	E1032	E1032-L1034 PolarHBondContact O-N 3.26Å
1035	K	45.8	Very low	46.2	Very low	174 Å²	174	110.2 Å²	110.2	76%	0.757	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-92.8	-9.9	175.4	-67.4	-176.4	178.7	177.4	0	114.4	E1032 T1033	E1032-K1035 PolarHBondContact O-N 2.89Å; T1033-K1035 PolarHBondContact O-N 3.42Å
1036	Q	48.8	Very low	47.1	Very low	173 Å²	173	113.4 Å²	113.4	81%	0.808	64%	0.635	S	S	*	*	S	Bend	trans	-102.2	0.8	-172.8	-70.2	-178	-19.5	0	0	114.4
1037	Q	44.8	Very low	47.7	Very low	168 Å²	168	111.5 Å²	111.5	79%	0.785	62%	0.62	S	S	*	*	S	Bend	trans	-118	125.6	168.9	-67.9	179.8	-15.5	0	0	108	G1039	Q1037-G1039 PolarHBondContact O-N 3.37Å
1038	G	52.8	Low	49	Very low	87 Å²	87	111.5 Å²	111.5	90%	0.897	61%	0.606	S	S	*	*			trans	-69.8	86.5	-161.5	0	0	0	0	0	115
1039	G	48.7	Very low	50.7	Low	24 Å²	24	105.7 Å²	105.7	25%	0.247	57%	0.573	C	S	.	*	P	Polyproline II helix	trans	-76.4	151.9	173	0	0	0	0	0	113.7	Q1037 V1048 Y1049	Q1037-G1039 PolarHBondContact O-N 3.37Å; G1039-V1048 WeakPolarHBondContact O-CG1 3.5Å; G1039-Y1049 CarbonylContact C-O 3.55Å; G1039-Y1049 WeakPolarHBondContact CA-O 3.41Å
1040	M	55.3	Low	51.2	Low	86 Å²	86	102.2 Å²	102.2	42%	0.424	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85	135.7	176.1	-75.2	160.4	-81.5	0	0	110.7	Y1049 K1052 L1055	M1040-Y1049 PolarHBondContact N-O 3.02Å; M1040-Y1049 PolarHBondContact O-N 3.5Å; M1040-K1052 HydrophobicContact CE-CB 3.9Å; M1040-K1052 HydrophobicContact SD-CB 4.37Å; M1040-L1055 HydrophobicContact CB-CD2 3.94Å
1041	K	55.7	Low	52.5	Low	124 Å²	124	99.8 Å²	99.8	54%	0.539	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	144.2	176.5	-60.3	-160.5	178	-174.6	0	111.9	E1046 F1047 V1048	K1041-E1046 IonicContact NZ-OE1 3.69Å; K1041-F1047 CarbonylContact C-O 3.6Å; K1041-F1047 WeakPolarHBondContact CA-O 3.27Å; K1041-V1048 HydrophobicContact CG-CG2 4.18Å
1042	C	60.5	Low	53.5	Low	0 Å²	0	102.3 Å²	102.3	0%	0	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-74.6	128.1	162.9	-177.8	0	0	0	0	110.1	E1044 C1045 E1046 F1047 Y1049 L1055 H1058 L1059	C1042-E1044 VanDerWaalsContact C-N 3.32Å; C1042-E1044 PolarHBondContact O-N 3.49Å; C1042-C1045 VanDerWaalsContact CB-SG 3.53Å; C1042-E1046 WeakPolarHBondContact O-CA 3.46Å; C1042-E1046 PolarHBondContact O-N 3.32Å; C1042-F1047 PolarHBondContact N-O 2.94Å; C1042-Y1049 HydrophobicContact CB-CD2 4.45Å; C1042-Y1049 HydrophobicContact CB-CE2 4.07Å; C1042-L1055 HydrophobicContact CB-CD1 3.65Å; C1042-H1058 PolarHBondContact SG-NE2 3.44Å; C1042-H1058 VanDerWaalsContact SG-NE2 3.43Å; C1042-L1059 VanDerWaalsContact SG-CD2 3.59Å
1043	P	56.6	Low	54.6	Low	112 Å²	112	103.1 Å²	103.1	73%	0.727	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-21.9	-176.6	28	-34.9	0	0	0	114.1
1044	E	54	Low	55.5	Low	118 Å²	118	101.9 Å²	101.9	55%	0.551	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-20.9	-178.5	-74.6	-175.3	-140.7	0	0	114.6	C1042 H1063 L1065	C1042-E1044 VanDerWaalsContact C-N 3.32Å; C1042-E1044 PolarHBondContact O-N 3.49Å; E1044-H1063 IonicContact OE2-CE1 2.81Å; E1044-H1063 IonicContact OE2-CG 3.27Å; E1044-H1063 IonicContact OE2-ND1 3.8Å; E1044-H1063 PolarHBondContact OE2-ND1 3.39Å; E1044-L1065 WeakPolarHBondContact OE1-CD1 3.47Å
1045	C	65.2	Low	56.4	Low	54 Å²	54	96.6 Å²	96.6	37%	0.365	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.7	5.9	-177.4	75.6	0	0	0	0	114.2	C1042 F1047 H1058	C1042-C1045 VanDerWaalsContact CB-SG 3.53Å; C1045-F1047 PolarHBondContact O-N 2.88Å; C1045-H1058 PolarHBondContact SG-NE2 3.34Å
1046	E	55.4	Low	56.9	Low	135 Å²	135	90.2 Å²	90.2	63%	0.631	48%	0.479	S	S	*	.			trans	53.4	-1.3	-175.4	-65	-148.5	102	0	0	117.2	K1041 C1042	K1041-E1046 IonicContact NZ-OE1 3.69Å; C1042-E1046 WeakPolarHBondContact O-CA 3.46Å; C1042-E1046 PolarHBondContact O-N 3.32Å
1047	F	57.5	Low	57.8	Low	130 Å²	130	88.8 Å²	88.8	57%	0.57	47%	0.466	S	S	*	.			trans	-67.8	139.3	-175	-153.1	-86.3	0	0	0	111.5	K1041 C1042 C1045 Y1049	K1041-F1047 CarbonylContact C-O 3.6Å; K1041-F1047 WeakPolarHBondContact CA-O 3.27Å; C1042-F1047 PolarHBondContact N-O 2.94Å; C1045-F1047 PolarHBondContact O-N 2.88Å; F1047-Y1049 HydrophobicContact CB-CE2 3.94Å; F1047-Y1049 HydrophobicContact CD1-CE1 4.02Å; F1047-Y1049 AromaticContact CD1-CE2 3.95Å; F1047-Y1049 HydrophobicContact CD1-CE2 3.95Å; F1047-Y1049 AromaticContact CD1-CZ 3.59Å; F1047-Y1049 HydrophobicContact CG-CE2 4.42Å; F1047-Y1049 WeakPolarHBondContact O-CD2 3.34Å; F1047-Y1049 WeakPolarHBondContact O-CE2 3.35Å
1048	V	57.3	Low	59.1	Low	68 Å²	68	81.8 Å²	81.8	41%	0.412	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.7	-170.5	-159.1	0	0	0	0	110.5	G1039 K1041	G1039-V1048 WeakPolarHBondContact O-CG1 3.5Å; K1041-V1048 HydrophobicContact CG-CG2 4.18Å
1049	Y	69.8	Low	59.8	Low	44 Å²	44	78.2 Å²	78.2	17%	0.173	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.3	-178.9	-66	-79.7	0	0	0	111	G1039 M1040 C1042 F1047 T1051 E1054 L1055 H1058	G1039-Y1049 CarbonylContact C-O 3.55Å; G1039-Y1049 WeakPolarHBondContact CA-O 3.41Å; M1040-Y1049 PolarHBondContact N-O 3.02Å; M1040-Y1049 PolarHBondContact O-N 3.5Å; C1042-Y1049 HydrophobicContact CB-CD2 4.45Å; C1042-Y1049 HydrophobicContact CB-CE2 4.07Å; F1047-Y1049 HydrophobicContact CB-CE2 3.94Å; F1047-Y1049 HydrophobicContact CD1-CE1 4.02Å; F1047-Y1049 AromaticContact CD1-CE2 3.95Å; F1047-Y1049 HydrophobicContact CD1-CE2 3.95Å; F1047-Y1049 AromaticContact CD1-CZ 3.59Å; F1047-Y1049 HydrophobicContact CG-CE2 4.42Å; F1047-Y1049 WeakPolarHBondContact O-CD2 3.34Å; F1047-Y1049 WeakPolarHBondContact O-CE2 3.35Å; Y1049-T1051 VanDerWaalsContact C-N 3.31Å; Y1049-T1051 PolarHBondContact O-N 2.84Å; Y1049-E1054 HydrophobicContact CD1-CB 4.1Å; Y1049-E1054 HydrophobicContact CG-CB 4.47Å; Y1049-L1055 HydrophobicContact CD2-CB 4.34Å; Y1049-L1055 HydrophobicContact CD2-CD1 3.95Å; Y1049-L1055 HydrophobicContact CE2-CD1 4.46Å; Y1049-L1055 HydrophobicContact CG-CB 4.4Å; Y1049-H1058 HydrophobicContact CE1-CB 4.1Å; Y1049-H1058 HydrophobicContact CE2-CB 4.1Å; Y1049-H1058 AromaticContact CE2-CD2 3.34Å; Y1049-H1058 WeakPolarHBondContact CE2-CD2 3.5Å; Y1049-H1058 AromaticContact CE2-CG 3.69Å; Y1049-H1058 AromaticContact CE2-NE2 3.96Å; Y1049-H1058 AromaticContact CZ-CD2 3.6Å; Y1049-H1058 AromaticContact CZ-CG 3.47Å; Y1049-H1058 VanDerWaalsContact CZ-CG 3.47Å; Y1049-H1058 AromaticContact CZ-ND1 3.93Å; Y1049-H1058 PolarHBondContact OH-CE1 3.29Å; Y1049-H1058 VanDerWaalsContact OH-CG 3.3Å; Y1049-H1058 PolarHBondContact OH-ND1 3.48Å
1050	G	50.8	Low	60.3	Low	49 Å²	49	82.2 Å²	82.2	51%	0.505	40%	0.404	S	S	.	.	S	Bend	trans	-66.7	-30.2	-174.4	0	0	0	0	0	113.7
1051	T	61.3	Low	60.7	Low	66 Å²	66	82.2 Å²	82.2	41%	0.405	41%	0.409	S	S	.	.	S	Bend	trans	-127.8	153.2	-179.4	66.4	0	0	0	0	113	Y1049 W1053 E1054 L1055	Y1049-T1051 VanDerWaalsContact C-N 3.31Å; Y1049-T1051 PolarHBondContact O-N 2.84Å; T1051-W1053 PolarHBondContact O-N 3.49Å; T1051-E1054 WeakPolarHBondContact CB-OE2 3.46Å; T1051-E1054 PolarHBondContact N-OE2 3.4Å; T1051-E1054 PolarHBondContact O-N 2.85Å; T1051-E1054 WeakPolarHBondContact OG1-CB 3.38Å; T1051-E1054 VanDerWaalsContact OG1-CD 3.28Å; T1051-E1054 WeakPolarHBondContact OG1-CG 3.09Å; T1051-E1054 PolarHBondContact OG1-N 2.93Å; T1051-E1054 PolarHBondContact OG1-OE2 2.86Å; T1051-L1055 PolarHBondContact O-N 2.83Å
1052	K	56.8	Low	61.1	Low	152 Å²	152	84 Å²	84	66%	0.661	42%	0.417	S	S	*	.	H	α-helix	trans	-58.1	-37.2	175.4	-167.7	174.2	-178.8	178.9	0	111.5	M1040 L1055 T1056	M1040-K1052 HydrophobicContact CE-CB 3.9Å; M1040-K1052 HydrophobicContact SD-CB 4.37Å; K1052-L1055 PolarHBondContact O-N 3.26Å; K1052-T1056 PolarHBondContact O-N 2.86Å; K1052-T1056 PolarHBondContact O-OG1 3.28Å
1053	W	60	Low	61.5	Low	160 Å²	160	86.3 Å²	86.3	61%	0.606	43%	0.428	S	S	*	.	H	α-helix	trans	-65.2	-40.6	178.4	-177.6	89.2	0	0	0	112.8	T1051 T1056 R1057	T1051-W1053 PolarHBondContact O-N 3.49Å; W1053-T1056 PolarHBondContact O-N 2.89Å; W1053-R1057 WeakPolarHBondContact O-CB 3.16Å; W1053-R1057 PolarHBondContact O-N 3.22Å
1054	E	62.3	Low	61.4	Low	83 Å²	83	85.5 Å²	85.5	39%	0.388	42%	0.417	S	S	.	.	H	α-helix	trans	-64.5	-41	174.7	-73.1	165.2	129.2	0	0	111.9	Y1049 T1051 R1057 H1058	Y1049-E1054 HydrophobicContact CD1-CB 4.1Å; Y1049-E1054 HydrophobicContact CG-CB 4.47Å; T1051-E1054 WeakPolarHBondContact CB-OE2 3.46Å; T1051-E1054 PolarHBondContact N-OE2 3.4Å; T1051-E1054 PolarHBondContact O-N 2.85Å; T1051-E1054 WeakPolarHBondContact OG1-CB 3.38Å; T1051-E1054 VanDerWaalsContact OG1-CD 3.28Å; T1051-E1054 WeakPolarHBondContact OG1-CG 3.09Å; T1051-E1054 PolarHBondContact OG1-N 2.93Å; T1051-E1054 PolarHBondContact OG1-OE2 2.86Å; E1054-R1057 PolarHBondContact O-N 3.15Å; E1054-H1058 VanDerWaalsContact O-CB 3.28Å; E1054-H1058 WeakPolarHBondContact O-CB 3.46Å; E1054-H1058 PolarHBondContact O-N 2.83Å
1055	L	64.8	Low	61.4	Low	21 Å²	21	82.2 Å²	82.2	11%	0.11	40%	0.403	C	S	.	.	H	α-helix	trans	-63.7	-49	174.4	175.1	56.6	0	0	0	111.8	M1040 C1042 Y1049 T1051 K1052 R1057 H1058 L1059	M1040-L1055 HydrophobicContact CB-CD2 3.94Å; C1042-L1055 HydrophobicContact CB-CD1 3.65Å; Y1049-L1055 HydrophobicContact CD2-CB 4.34Å; Y1049-L1055 HydrophobicContact CD2-CD1 3.95Å; Y1049-L1055 HydrophobicContact CE2-CD1 4.46Å; Y1049-L1055 HydrophobicContact CG-CB 4.4Å; T1051-L1055 PolarHBondContact O-N 2.83Å; K1052-L1055 PolarHBondContact O-N 3.26Å; L1055-R1057 VanDerWaalsContact C-N 3.3Å; L1055-R1057 PolarHBondContact O-N 3.25Å; L1055-H1058 PolarHBondContact O-N 3.22Å; L1055-H1058 VanDerWaalsContact O-N 3.16Å; L1055-L1059 HydrophobicContact CD1-CD1 3.96Å; L1055-L1059 HydrophobicContact CD1-CG 4.11Å; L1055-L1059 HydrophobicContact CG-CD1 4.12Å; L1055-L1059 WeakPolarHBondContact O-CG 3.49Å; L1055-L1059 PolarHBondContact O-N 3.17Å
1056	T	56.5	Low	60.3	Low	41 Å²	41	84 Å²	84	25%	0.252	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-37.5	177.1	-55.1	0	0	0	0	111.6	K1052 W1053 K1060 V1067	K1052-T1056 PolarHBondContact O-N 2.86Å; K1052-T1056 PolarHBondContact O-OG1 3.28Å; W1053-T1056 PolarHBondContact O-N 2.89Å; T1056-K1060 WeakPolarHBondContact O-CB 3.4Å; T1056-K1060 PolarHBondContact O-N 3.09Å; T1056-K1060 VanDerWaalsContact O-N 3.08Å; T1056-V1067 HydrophobicContact CG2-CG1 4.18Å
1057	R	67.2	Low	60	Low	143 Å²	143	80.4 Å²	80.4	54%	0.54	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-43.4	172.9	178.9	179.5	177.5	164.1	3.7	111.4	W1053 E1054 L1055 K1060 T1061	W1053-R1057 WeakPolarHBondContact O-CB 3.16Å; W1053-R1057 PolarHBondContact O-N 3.22Å; E1054-R1057 PolarHBondContact O-N 3.15Å; L1055-R1057 VanDerWaalsContact C-N 3.3Å; L1055-R1057 PolarHBondContact O-N 3.25Å; R1057-K1060 PolarHBondContact O-N 3.35Å; R1057-T1061 HydrophobicContact CG-CG2 4.46Å; R1057-T1061 WeakPolarHBondContact O-CB 3.38Å; R1057-T1061 WeakPolarHBondContact O-CG2 3.44Å; R1057-T1061 PolarHBondContact O-N 3.19Å; R1057-T1061 PolarHBondContact O-OG1 2.73Å
1058	H	72.3	Confident	59.2	Low	21 Å²	21	79.2 Å²	79.2	10%	0.097	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-51.8	178.8	164.1	59.6	0	0	0	111.3	C1042 C1045 Y1049 E1054 L1055 K1060 T1061 K1062 H1063	C1042-H1058 PolarHBondContact SG-NE2 3.44Å; C1042-H1058 VanDerWaalsContact SG-NE2 3.43Å; C1045-H1058 PolarHBondContact SG-NE2 3.34Å; Y1049-H1058 HydrophobicContact CE1-CB 4.1Å; Y1049-H1058 HydrophobicContact CE2-CB 4.1Å; Y1049-H1058 AromaticContact CE2-CD2 3.34Å; Y1049-H1058 WeakPolarHBondContact CE2-CD2 3.5Å; Y1049-H1058 AromaticContact CE2-CG 3.69Å; Y1049-H1058 AromaticContact CE2-NE2 3.96Å; Y1049-H1058 AromaticContact CZ-CD2 3.6Å; Y1049-H1058 AromaticContact CZ-CG 3.47Å; Y1049-H1058 VanDerWaalsContact CZ-CG 3.47Å; Y1049-H1058 AromaticContact CZ-ND1 3.93Å; Y1049-H1058 PolarHBondContact OH-CE1 3.29Å; Y1049-H1058 VanDerWaalsContact OH-CG 3.3Å; Y1049-H1058 PolarHBondContact OH-ND1 3.48Å; E1054-H1058 VanDerWaalsContact O-CB 3.28Å; E1054-H1058 WeakPolarHBondContact O-CB 3.46Å; E1054-H1058 PolarHBondContact O-N 2.83Å; L1055-H1058 PolarHBondContact O-N 3.22Å; L1055-H1058 VanDerWaalsContact O-N 3.16Å; H1058-K1060 VanDerWaalsContact C-N 3.29Å; H1058-K1060 PolarHBondContact O-N 3.12Å; H1058-T1061 CarbonylContact O-C 3.38Å; H1058-T1061 PolarHBondContact O-N 3.21Å; H1058-K1062 WeakPolarHBondContact O-CB 3.36Å; H1058-K1062 PolarHBondContact O-N 3.03Å; H1058-H1063 AromaticContact CE1-CD2 3.77Å; H1058-H1063 AromaticContact CE1-NE2 3.55Å; H1058-H1063 AromaticContact NE2-CD2 3.64Å; H1058-H1063 AromaticContact NE2-NE2 3.39Å; H1058-H1063 PolarHBondContact NE2-NE2 2.92Å
1059	L	67	Low	58.5	Low	11 Å²	11	85.6 Å²	85.6	6%	0.058	42%	0.42	C	S	.	.	I	π-helix	trans	-53	-48.7	175	-72.3	166.9	0	0	0	110.7	C1042 L1055 T1061 H1063 N1064 L1065 W1072	C1042-L1059 VanDerWaalsContact SG-CD2 3.59Å; L1055-L1059 HydrophobicContact CD1-CD1 3.96Å; L1055-L1059 HydrophobicContact CD1-CG 4.11Å; L1055-L1059 HydrophobicContact CG-CD1 4.12Å; L1055-L1059 WeakPolarHBondContact O-CG 3.49Å; L1055-L1059 PolarHBondContact O-N 3.17Å; L1059-T1061 VanDerWaalsContact C-N 3.27Å; L1059-T1061 PolarHBondContact O-N 3.43Å; L1059-H1063 HydrophobicContact CD2-CB 4.42Å; L1059-H1063 CarbonylContact O-C 3.58Å; L1059-H1063 VanDerWaalsContact O-C 3.24Å; L1059-H1063 WeakPolarHBondContact O-CA 3.5Å; L1059-H1063 WeakPolarHBondContact O-CB 3.49Å; L1059-H1063 PolarHBondContact O-N 2.86Å; L1059-N1064 PolarHBondContact O-N 2.83Å; L1059-L1065 PolarHBondContact O-N 2.87Å; L1059-W1072 HydrophobicContact CB-CH2 4.46Å; L1059-W1072 HydrophobicContact CB-CZ3 4.08Å; L1059-W1072 HydrophobicContact CD1-CH2 3.5Å; L1059-W1072 HydrophobicContact CD1-CZ2 4.28Å; L1059-W1072 HydrophobicContact CD1-CZ3 3.98Å
1060	K	60.6	Low	57.3	Low	108 Å²	108	86.2 Å²	86.2	47%	0.47	44%	0.44	S	S	.	.	I	π-helix	trans	-70.5	-10	179.4	-168.6	171.9	173.8	-177.5	0	115.7	T1056 R1057 H1058 L1065 K1066	T1056-K1060 WeakPolarHBondContact O-CB 3.4Å; T1056-K1060 PolarHBondContact O-N 3.09Å; T1056-K1060 VanDerWaalsContact O-N 3.08Å; R1057-K1060 PolarHBondContact O-N 3.35Å; H1058-K1060 VanDerWaalsContact C-N 3.29Å; H1058-K1060 PolarHBondContact O-N 3.12Å; K1060-L1065 WeakPolarHBondContact CA-O 3.38Å; K1060-L1065 WeakPolarHBondContact CB-O 3.12Å; K1060-L1065 PolarHBondContact N-O 3.03Å; K1060-K1066 HydrophobicContact CD-CB 4.15Å; K1060-K1066 HydrophobicContact CD-CG 4.18Å; K1060-K1066 HydrophobicContact CG-CB 4.2Å
1061	T	62.6	Low	56.6	Low	86 Å²	86	90.1 Å²	90.1	53%	0.528	45%	0.449	S	S	.	.	I	π-helix	trans	-125.7	-3.5	-177.8	57.7	0	0	0	0	114.9	R1057 H1058 L1059	R1057-T1061 HydrophobicContact CG-CG2 4.46Å; R1057-T1061 WeakPolarHBondContact O-CB 3.38Å; R1057-T1061 WeakPolarHBondContact O-CG2 3.44Å; R1057-T1061 PolarHBondContact O-N 3.19Å; R1057-T1061 PolarHBondContact O-OG1 2.73Å; H1058-T1061 CarbonylContact O-C 3.38Å; H1058-T1061 PolarHBondContact O-N 3.21Å; L1059-T1061 VanDerWaalsContact C-N 3.27Å; L1059-T1061 PolarHBondContact O-N 3.43Å
1062	K	65	Low	55.6	Low	161 Å²	161	91 Å²	91	70%	0.7	45%	0.445	S	S	*	.	I	π-helix	trans	-128.3	-30.3	175.6	-75.1	-63.1	-169.4	179	0	113.8	H1058	H1058-K1062 WeakPolarHBondContact O-CB 3.36Å; H1058-K1062 PolarHBondContact O-N 3.03Å
1063	H	67.9	Low	54.4	Low	50 Å²	50	91.8 Å²	91.8	23%	0.231	45%	0.451	C	S	.	.	I	π-helix	trans	-113.1	-0.1	177.2	-57.2	-99.3	0	0	0	110.9	E1044 H1058 L1059 L1065	E1044-H1063 IonicContact OE2-CE1 2.81Å; E1044-H1063 IonicContact OE2-CG 3.27Å; E1044-H1063 IonicContact OE2-ND1 3.8Å; E1044-H1063 PolarHBondContact OE2-ND1 3.39Å; H1058-H1063 AromaticContact CE1-CD2 3.77Å; H1058-H1063 AromaticContact CE1-NE2 3.55Å; H1058-H1063 AromaticContact NE2-CD2 3.64Å; H1058-H1063 AromaticContact NE2-NE2 3.39Å; H1058-H1063 PolarHBondContact NE2-NE2 2.92Å; L1059-H1063 HydrophobicContact CD2-CB 4.42Å; L1059-H1063 CarbonylContact O-C 3.58Å; L1059-H1063 VanDerWaalsContact O-C 3.24Å; L1059-H1063 WeakPolarHBondContact O-CA 3.5Å; L1059-H1063 WeakPolarHBondContact O-CB 3.49Å; L1059-H1063 PolarHBondContact O-N 2.86Å; H1063-L1065 HydrophobicContact CB-CD1 4.45Å; H1063-L1065 PolarHBondContact O-N 3.28Å
1064	N	55.6	Low	53.2	Low	94 Å²	94	89 Å²	89	50%	0.503	45%	0.451	S	S	.	.			trans	52.9	2.8	-177.3	-67.6	-4	0	0	0	117.5	L1059 K1066 V1074	L1059-N1064 PolarHBondContact O-N 2.83Å; N1064-K1066 PolarHBondContact O-N 3.29Å; N1064-V1074 HydrophobicContact CB-CG1 4.39Å
1065	L	54.1	Low	51.5	Low	49 Å²	49	88.9 Å²	88.9	26%	0.257	47%	0.465	S	S	.	.			trans	-67	125.4	175.3	-64.2	168.7	0	0	0	111.2	E1044 L1059 K1060 H1063 W1072	E1044-L1065 WeakPolarHBondContact OE1-CD1 3.47Å; L1059-L1065 PolarHBondContact O-N 2.87Å; K1060-L1065 WeakPolarHBondContact CA-O 3.38Å; K1060-L1065 WeakPolarHBondContact CB-O 3.12Å; K1060-L1065 PolarHBondContact N-O 3.03Å; H1063-L1065 HydrophobicContact CB-CD1 4.45Å; H1063-L1065 PolarHBondContact O-N 3.28Å; L1065-W1072 VanDerWaalsContact C-CE3 3.46Å; L1065-W1072 HydrophobicContact CB-CB 4.01Å; L1065-W1072 HydrophobicContact CB-CD2 4.01Å; L1065-W1072 HydrophobicContact CB-CE3 3.55Å; L1065-W1072 HydrophobicContact CB-CG 4.24Å; L1065-W1072 HydrophobicContact CB-CZ3 4.25Å; L1065-W1072 HydrophobicContact CD2-CB 3.83Å; L1065-W1072 HydrophobicContact CG-CB 4.48Å
1066	K	42.5	Very low	50	Low	91 Å²	91	97.5 Å²	97.5	40%	0.396	50%	0.504	S	S	.	.			trans	-117	107.2	-179.5	167.7	-169.7	175	-168.6	0	110.3	K1060 N1064 W1072 E1073	K1060-K1066 HydrophobicContact CD-CB 4.15Å; K1060-K1066 HydrophobicContact CD-CG 4.18Å; K1060-K1066 HydrophobicContact CG-CB 4.2Å; N1064-K1066 PolarHBondContact O-N 3.29Å; K1066-W1072 WeakPolarHBondContact O-CA 3.21Å; K1066-E1073 WeakPolarHBondContact CB-O 3.46Å
1067	V	47.9	Very low	49	Very low	61 Å²	61	105 Å²	105	37%	0.37	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	135.2	-175.2	84.3	0	0	0	0	112	T1056 N1071 W1072	T1056-V1067 HydrophobicContact CG2-CG1 4.18Å; V1067-N1071 WeakPolarHBondContact CA-O 3.41Å; V1067-W1072 HydrophobicContact CB-CD2 3.79Å; V1067-W1072 HydrophobicContact CB-CE3 3.57Å; V1067-W1072 HydrophobicContact CB-CH2 3.76Å; V1067-W1072 HydrophobicContact CB-CZ2 3.96Å; V1067-W1072 HydrophobicContact CB-CZ3 3.59Å; V1067-W1072 HydrophobicContact CG1-CZ3 4.48Å; V1067-W1072 HydrophobicContact CG2-CD2 3.89Å; V1067-W1072 HydrophobicContact CG2-CE3 4.19Å; V1067-W1072 HydrophobicContact CG2-CG 4.5Å; V1067-W1072 HydrophobicContact CG2-CH2 4.12Å; V1067-W1072 HydrophobicContact CG2-CZ2 3.79Å; V1067-W1072 HydrophobicContact CG2-CZ3 4.33Å
1068	V	41.8	Very low	47.1	Very low	104 Å²	104	103 Å²	103	63%	0.63	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-133	115.3	160.5	-176.5	0	0	0	0	106.4	G1070 N1071	V1068-G1070 PolarHBondContact O-N 3.09Å; V1068-N1071 PolarHBondContact N-O 2.9Å; V1068-N1071 PolarHBondContact O-N 3.24Å; V1068-N1071 VanDerWaalsContact O-N 3.12Å
1069	E	40.9	Very low	44.9	Very low	203 Å²	203	111.9 Å²	111.9	95%	0.949	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	40.5	34.4	172.1	-55.3	-161.3	140.8	0	0	117.6
1070	G	46	Very low	43.2	Very low	56 Å²	56	115.9 Å²	115.9	58%	0.577	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.6	-13.6	171.5	0	0	0	0	0	115.8	V1068	V1068-G1070 PolarHBondContact O-N 3.09Å
1071	N	36.7	Very low	41.6	Very low	131 Å²	131	120.3 Å²	120.3	70%	0.701	65%	0.649	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-135.2	175.1	174.4	-97.1	-25.9	0	0	0	112.9	V1067 V1068	V1067-N1071 WeakPolarHBondContact CA-O 3.41Å; V1068-N1071 PolarHBondContact N-O 2.9Å; V1068-N1071 PolarHBondContact O-N 3.24Å; V1068-N1071 VanDerWaalsContact O-N 3.12Å
1072	W	38.5	Very low	40	Very low	84 Å²	84	126.1 Å²	126.1	32%	0.318	66%	0.663	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-142.5	122.4	-159.2	-47.1	77.6	0	0	0	113.6	L1059 L1065 K1066 V1067	L1059-W1072 HydrophobicContact CB-CH2 4.46Å; L1059-W1072 HydrophobicContact CB-CZ3 4.08Å; L1059-W1072 HydrophobicContact CD1-CH2 3.5Å; L1059-W1072 HydrophobicContact CD1-CZ2 4.28Å; L1059-W1072 HydrophobicContact CD1-CZ3 3.98Å; L1065-W1072 VanDerWaalsContact C-CE3 3.46Å; L1065-W1072 HydrophobicContact CB-CB 4.01Å; L1065-W1072 HydrophobicContact CB-CD2 4.01Å; L1065-W1072 HydrophobicContact CB-CE3 3.55Å; L1065-W1072 HydrophobicContact CB-CG 4.24Å; L1065-W1072 HydrophobicContact CB-CZ3 4.25Å; L1065-W1072 HydrophobicContact CD2-CB 3.83Å; L1065-W1072 HydrophobicContact CG-CB 4.48Å; K1066-W1072 WeakPolarHBondContact O-CA 3.21Å; V1067-W1072 HydrophobicContact CB-CD2 3.79Å; V1067-W1072 HydrophobicContact CB-CE3 3.57Å; V1067-W1072 HydrophobicContact CB-CH2 3.76Å; V1067-W1072 HydrophobicContact CB-CZ2 3.96Å; V1067-W1072 HydrophobicContact CB-CZ3 3.59Å; V1067-W1072 HydrophobicContact CG1-CZ3 4.48Å; V1067-W1072 HydrophobicContact CG2-CD2 3.89Å; V1067-W1072 HydrophobicContact CG2-CE3 4.19Å; V1067-W1072 HydrophobicContact CG2-CG 4.5Å; V1067-W1072 HydrophobicContact CG2-CH2 4.12Å; V1067-W1072 HydrophobicContact CG2-CZ2 3.79Å; V1067-W1072 HydrophobicContact CG2-CZ3 4.33Å
1073	E	32.1	Very low	38.1	Very low	169 Å²	169	124.7 Å²	124.7	79%	0.79	67%	0.667	S	S	*	*			trans	-145.3	167.7	174.1	-69.5	-167.6	170.5	0	0	113.1	K1066	K1066-E1073 WeakPolarHBondContact CB-O 3.46Å
1074	V	34.2	Very low	36	Very low	101 Å²	101	125.2 Å²	125.2	61%	0.612	68%	0.677	S	S	*	*			trans	-122.5	149.2	-158.4	-165.1	0	0	0	0	113.1	N1064	N1064-V1074 HydrophobicContact CB-CG1 4.39Å
1075	A	28.3	Very low	34.8	Very low	81 Å²	81	124.6 Å²	124.6	67%	0.669	68%	0.676	S	S	*	*			trans	-155.8	162.5	173.1	0	0	0	0	0	112.6
1076	E	32.3	Very low	33.6	Very low	202 Å²	202	126.6 Å²	126.6	94%	0.944	68%	0.684	S	S	*	*			trans	-95.2	-172.9	-157.5	-58.7	-176.2	114.9	0	0	117.5
1077	E	34.8	Very low	33.2	Very low	198 Å²	198	128.5 Å²	128.5	93%	0.925	70%	0.699	S	S	*	*			trans	-112.8	167	-169.9	-56.7	-174.6	131.2	0	0	114.1
1078	A	29.2	Very low	32.4	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	72%	0.721	S	S	*	*			trans	-152.8	153.3	165.6	0	0	0	0	0	111.8
1079	E	25.8	Very low	31.8	Very low	208 Å²	208	137.4 Å²	137.4	97%	0.972	73%	0.729	S	S	*	*			trans	-99.3	-176.7	-169.6	-68.2	-165.4	105.1	0	0	115.6
1080	A	30.5	Very low	31	Very low	94 Å²	94	135.5 Å²	135.5	78%	0.777	72%	0.72	S	S	*	*			trans	-114.9	168.3	-164.1	0	0	0	0	0	114.8
1081	Q	26.4	Very low	30	Very low	201 Å²	201	139.5 Å²	139.5	94%	0.939	73%	0.727	S	S	*	*			trans	-160.9	173.5	151.6	-114.4	167.3	27.2	0	0	114.3
1082	Y	29.8	Very low	29.3	Very low	209 Å²	209	138.5 Å²	138.5	82%	0.82	73%	0.726	S	S	*	*			trans	-160.8	123.3	-160.8	-171.7	-76	0	0	0	111.9
1083	V	25.3	Very low	28.7	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	75%	0.752	S	S	*	*			trans	-146.7	172.2	173.6	-174.9	0	0	0	0	109.9
1084	S	22.9	Very low	28.4	Very low	61 Å²	61	139.4 Å²	139.4	43%	0.427	75%	0.749	S	S	.	*			trans	-142.5	177.2	-175.7	-54.6	0	0	0	0	110.7	C641	C641-S1084 CarbonylContact O-C 3.38Å; C641-S1084 WeakPolarHBondContact O-CB 3.46Å
1085	V	30.5	Very low	28.9	Very low	81 Å²	81	139.8 Å²	139.8	49%	0.491	75%	0.754	S	S	.	*			trans	158.1	146.6	154.9	161	0	0	0	0	114	A640 C641 V642	A640-V1085 HydrophobicContact CB-CG2 3.48Å; A640-V1085 VanDerWaalsContact CB-CG2 3.48Å; C641-V1085 HydrophobicContact CB-CG2 3.93Å; C641-V1085 WeakPolarHBondContact O-CA 3.42Å; C641-V1085 WeakPolarHBondContact O-CG2 3.46Å; C641-V1085 PolarHBondContact O-N 3.5Å; V642-V1085 PolarHBondContact O-N 3.04Å
1086	E	29.4	Very low	28.7	Very low	90 Å²	90	143.7 Å²	143.7	42%	0.421	76%	0.763	S	S	.	*			trans	-49.5	147.9	177.7	-71.9	151.6	132.5	0	0	119.6	C641 V642	C641-E1086 WeakPolarHBondContact CB-OE2 3.38Å; C641-E1086 PolarHBondContact SG-OE2 3.12Å; V642-E1086 HydrophobicContact CB-CG 3.64Å; V642-E1086 HydrophobicContact CG1-CG 3.27Å; V642-E1086 HydrophobicContact CG2-CG 4.4Å
1087	N	35.1	Very low	28.6	Very low	132 Å²	132	138.3 Å²	138.3	71%	0.706	75%	0.752	S	S	*	*				29.3	145.1	119.7	-34.2	-26.9	0	0	0	119.1
1088	E	29.8	Very low	28.4	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	74%	0.744	S	S	*	*			cis	-133.9	172.6	25	-53.8	-176.3	119.1	0	0	112.4
1089	E	28.5	Very low	28.3	Very low	173 Å²	173	137.1 Å²	137.1	81%	0.808	74%	0.742	S	S	*	*				169.2	138	116	-89.3	-176	-158.3	0	0	113.2
1090	H	25.6	Very low	28.5	Very low	162 Å²	162	135.6 Å²	135.6	75%	0.75	74%	0.735	S	S	*	*			trans	24.7	132.1	140.3	-67.9	-114.1	0	0	0	118.8
1091	L	23.8	Very low	28.5	Very low	140 Å²	140	137.6 Å²	137.6	73%	0.733	73%	0.732	S	S	*	*			cis	142.7	169.8	17.7	-119.7	172.3	0	0	0	105.5
1092	T	23.4	Very low	28.6	Very low	111 Å²	111	134.8 Å²	134.8	68%	0.681	72%	0.724	S	S	*	*			trans	69.8	133.1	162	32.1	0	0	0	0	121.9
1093	E	24.7	Very low	28.7	Very low	182 Å²	182	128.5 Å²	128.5	85%	0.85	72%	0.722	S	S	*	*			trans	77.3	106.3	142.1	-72	164.7	-150.5	0	0	122.4
1094	A	26.5	Very low	29	Very low	89 Å²	89	129.2 Å²	129.2	74%	0.736	72%	0.722	S	S	*	*			trans	-73.2	170.5	141.7	0	0	0	0	0	109.2
1095	P	43.7	Very low	29.5	Very low	109 Å²	109	131.8 Å²	131.8	71%	0.708	73%	0.734	S	S	*	*			cis	-147.5	-176.1	29.4	44.5	-23.9	0	0	0	117.8
1096	L	25.1	Very low	29.6	Very low	164 Å²	164	134.6 Å²	134.6	86%	0.859	74%	0.742	S	S	*	*			trans	26.2	123.6	143.7	-63.6	163.8	0	0	0	118.9
1097	A	30.2	Very low	30.1	Very low	88 Å²	88	137.6 Å²	137.6	73%	0.727	76%	0.756	S	S	*	*				171.3	135.9	104.9	0	0	0	0	0	115.4
1098	V	29.5	Very low	30.1	Very low	123 Å²	123	138.2 Å²	138.2	75%	0.745	76%	0.758	S	S	*	*				68.8	103.7	126.7	176.3	0	0	0	0	121
1099	L	27.3	Very low	30.2	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	75%	0.75	S	S	*	*			trans	76.3	159.3	133.7	-61.4	177.9	0	0	0	123
1100	E	30.1	Very low	30.6	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	75%	0.751	S	S	*	*			trans	72	136	168.1	-42.6	-167.6	162.4	0	0	115.5
1101	D	31.1	Very low	30.8	Very low	136 Å²	136	133 Å²	133	73%	0.727	75%	0.751	S	S	*	*			cis	-143.5	161.1	6.1	-149.7	10.5	0	0	0	115.5
1102	N	29	Very low	30.9	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	75%	0.747	S	S	*	*			trans	-47.2	159.2	-174.1	-76.5	-74	0	0	0	120.7
1103	G	31	Very low	31.3	Very low	76 Å²	76	129.9 Å²	129.9	78%	0.784	75%	0.746	S	S	*	*			trans	-179.4	34.2	178.5	0	0	0	0	0	120
1104	N	32.1	Very low	31.8	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	74%	0.743	S	S	*	*			trans	-4.7	148.4	156.4	-80.4	-12.8	0	0	0	120.4
1105	V	33	Very low	32.1	Very low	115 Å²	115	129.7 Å²	129.7	70%	0.697	74%	0.737	S	S	*	*			cis	-172.3	159.2	-8.6	93.8	0	0	0	0	106.5
1106	Q	32.2	Very low	31.5	Very low	140 Å²	140	132.1 Å²	132.1	65%	0.654	74%	0.739	S	S	*	*				179.6	136.7	66.9	-161.3	145.2	-8.8	0	0	114.2
1107	Q	41.1	Very low	31.6	Very low	154 Å²	154	131 Å²	131	72%	0.72	73%	0.734	S	S	*	*			trans	64.2	153.7	149.6	-73.6	172.2	-7.7	0	0	120.6
1108	I	34.5	Very low	31.5	Very low	144 Å²	144	131 Å²	131	74%	0.738	73%	0.734	S	S	*	*			cis	-155	163.2	1.2	-128.5	157.9	0	0	0	112.7
1109	A	32.7	Very low	31.3	Very low	80 Å²	80	132.1 Å²	132.1	66%	0.661	74%	0.74	S	S	*	*			trans	65.5	122.1	168.4	0	0	0	0	0	118.2
1110	E	35.9	Very low	31.2	Very low	177 Å²	177	129.4 Å²	129.4	83%	0.827	74%	0.74	S	S	*	*				84.2	132	58	-77.2	-175.4	-175.1	0	0	113.7
1111	L	30.3	Very low	30.9	Very low	147 Å²	147	126.4 Å²	126.4	77%	0.77	74%	0.739	S	S	*	*			cis	-144.4	169.3	13	-103.6	139.8	0	0	0	113.4
1112	S	25.3	Very low	30.6	Very low	90 Å²	90	126.2 Å²	126.2	63%	0.629	74%	0.742	S	S	*	*			trans	-59.8	174.1	170.2	59.2	0	0	0	0	113.7
1113	S	32.2	Very low	30.3	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	74%	0.741	S	S	*	*			cis	-174.3	161.1	21.3	1.8	0	0	0	0	108.4
1114	E	34.3	Very low	30.1	Very low	167 Å²	167	126 Å²	126	78%	0.78	74%	0.739	S	S	*	*			cis	-169	-161.2	-14.8	-125.8	-178.8	105.7	0	0	112.9
1115	T	33.1	Very low	29.7	Very low	99 Å²	99	128 Å²	128	61%	0.607	75%	0.746	S	S	*	*			trans	-30.9	160.8	168.4	65.1	0	0	0	0	120
1116	H	32.3	Very low	29.6	Very low	160 Å²	160	126.8 Å²	126.8	74%	0.741	75%	0.749	S	S	*	*			cis	-162.3	177.5	-10.2	-116.9	-47	0	0	0	111.8
1117	N	26.3	Very low	29.8	Very low	141 Å²	141	126.2 Å²	126.2	75%	0.754	76%	0.757	S	S	*	*			trans	-39.5	156.7	170	-50.4	-51.5	0	0	0	114.9
1118	A	28.1	Very low	29.2	Very low	89 Å²	89	121.8 Å²	121.8	74%	0.736	75%	0.753	S	S	*	*			cis	-169.6	162.2	42.8	0	0	0	0	0	116
1119	V	25.8	Very low	28.8	Very low	145 Å²	145	120.4 Å²	120.4	88%	0.879	75%	0.751	S	S	*	*			trans	24.9	112.6	144.9	-173.4	0	0	0	0	120
1120	A	24.4	Very low	28.5	Very low	96 Å²	96	121.6 Å²	121.6	79%	0.793	75%	0.75	S	S	*	*			trans	-160.3	164.5	135.8	0	0	0	0	0	111.4
1121	S	25.1	Very low	28	Very low	113 Å²	113	116.6 Å²	116.6	79%	0.79	73%	0.732	S	S	*	*			trans	-111	-179	170.2	-67.7	0	0	0	0	110.9
1122	V	24.8	Very low	27.8	Very low	131 Å²	131	113.4 Å²	113.4	79%	0.794	72%	0.718	S	S	*	*			trans	113.3	124.6	153.6	-178.5	0	0	0	0	115.9
1123	V	22.4	Very low	27.8	Very low	123 Å²	123	114.2 Å²	114.2	75%	0.745	72%	0.719	S	S	*	*			trans	56.9	111.5	161.8	169.7	0	0	0	0	116.7
1124	A	25.9	Very low	27.7	Very low	91 Å²	91	116.7 Å²	116.7	75%	0.752	72%	0.72	S	S	*	*				83	159.6	53.7	0	0	0	0	0	115.1
1125	M	24.8	Very low	27.5	Very low	188 Å²	188	116.1 Å²	116.1	93%	0.926	72%	0.717	S	S	*	*			trans	106.6	150.2	-176.6	-58.9	-72.8	-88.2	0	0	115.5
1126	A	31.2	Very low	27.5	Very low	91 Å²	91	116 Å²	116	75%	0.752	72%	0.717	S	S	*	*			trans	-123	161	176.2	0	0	0	0	0	109
1127	P	36	Very low	27.4	Very low	128 Å²	128	116.3 Å²	116.3	83%	0.831	72%	0.718	S	S	*	*				-128.5	-169.8	60	22	1.8	0	0	0	113.1
1128	G	26.8	Very low	27.6	Very low	61 Å²	61	115.7 Å²	115.7	63%	0.629	72%	0.719	S	S	*	*			cis	120.4	136.6	-6.9	0	0	0	0	0	115.2
1129	T	27.9	Very low	27.8	Very low	115 Å²	115	115.1 Å²	115.1	71%	0.706	71%	0.714	S	S	*	*			trans	57.9	121.1	172.8	40.9	0	0	0	0	116.2	T718	T718-T1129 HydrophobicContact CG2-CG2 4.03Å
1130	V	26.6	Very low	28.1	Very low	105 Å²	105	116.2 Å²	116.2	64%	0.636	71%	0.71	S	S	*	*				158.7	150	68.9	126.5	0	0	0	0	105.5
1131	T	24.8	Very low	28.5	Very low	72 Å²	72	116.9 Å²	116.9	44%	0.442	70%	0.7	S	S	.	*			cis	-163.7	165.2	-6.7	34.8	0	0	0	0	112.1	S716	S716-T1131 VanDerWaalsContact O-CG2 3.24Å; S716-T1131 WeakPolarHBondContact O-CG2 3.27Å; S716-T1131 WeakPolarHBondContact OG-CG2 3.4Å
1132	V	25	Very low	28.7	Very low	79 Å²	79	118.3 Å²	118.3	48%	0.479	69%	0.694	S	S	.	*				18.5	140.5	127.9	-156.6	0	0	0	0	117.8
1133	V	26.2	Very low	29	Very low	108 Å²	108	119.6 Å²	119.6	66%	0.655	69%	0.691	S	S	*	*				-160.1	170	53.7	-150.5	0	0	0	0	115.1
1134	Q	30.3	Very low	29.4	Very low	148 Å²	148	119.6 Å²	119.6	69%	0.692	69%	0.691	S	S	*	*			trans	75	148.3	148.5	-105.8	121.2	-3.2	0	0	118.3
1135	Q	29.6	Very low	29.6	Very low	155 Å²	155	118.6 Å²	118.6	72%	0.724	69%	0.69	S	S	*	*			cis	160.8	169.2	-12.7	-111.9	-170.5	-24.6	0	0	106.1
1136	V	33.3	Very low	30	Very low	98 Å²	98	117 Å²	117	59%	0.594	69%	0.685	S	S	*	*			cis	-162.7	-161.8	-12.7	69.2	0	0	0	0	108.8
1137	Q	30.4	Very low	29.9	Very low	166 Å²	166	117.6 Å²	117.6	78%	0.776	68%	0.683	S	S	*	*			trans	87	139.7	161.7	-86.5	134.1	5.3	0	0	119.2
1138	V	31.4	Very low	29.7	Very low	128 Å²	128	116.4 Å²	116.4	78%	0.776	68%	0.677	S	S	*	*			cis	-170.9	173.6	-27	108.1	0	0	0	0	111.4
1139	A	30.8	Very low	30	Very low	76 Å²	76	119.8 Å²	119.8	63%	0.628	68%	0.681	S	S	*	*			trans	76.3	147.5	163.5	0	0	0	0	0	117.7
1140	Q	31.9	Very low	30.6	Very low	168 Å²	168	121.5 Å²	121.5	79%	0.785	68%	0.681	S	S	*	*			cis	-171.6	170.1	-6.5	-111.7	-172.3	-66.8	0	0	108.5
1141	D	33.1	Very low	30.7	Very low	110 Å²	110	122.9 Å²	122.9	59%	0.588	68%	0.684	S	S	*	*			cis	-167	-179.5	-16.5	-146.7	-50.2	0	0	0	109.6
1142	H	29.8	Very low	30.8	Very low	143 Å²	143	126.8 Å²	126.8	66%	0.662	70%	0.699	S	S	*	*			trans	68.7	152.4	158.3	-68.2	20.9	0	0	0	118.8
1143	E	31.9	Very low	31	Very low	158 Å²	158	128.3 Å²	128.3	74%	0.738	71%	0.709	S	S	*	*			cis	-171.2	173.1	-12.6	-102.6	-173.6	113.3	0	0	107.6
1144	V	30.3	Very low	31.1	Very low	123 Å²	123	129.7 Å²	129.7	75%	0.745	72%	0.717	S	S	*	*			cis	-167.2	146.3	-43	70.3	0	0	0	0	110.8
1145	G	29.6	Very low	31	Very low	70 Å²	70	128 Å²	128	72%	0.722	71%	0.712	S	S	*	*			trans	69.7	166.1	163.4	0	0	0	0	0	118.7
1146	D	32.3	Very low	31.1	Very low	154 Å²	154	125 Å²	125	82%	0.824	71%	0.714	S	S	*	*			cis	-163.1	-174.6	-20.6	-154.2	27.7	0	0	0	106.4
1147	C	29.6	Very low	30.8	Very low	104 Å²	104	125.1 Å²	125.1	70%	0.703	71%	0.712	S	S	*	*			cis	-153.2	-154.4	8.4	-164.6	0	0	0	0	109.7
1148	S	32.7	Very low	30.9	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	71%	0.712	S	S	*	*			trans	-153.1	176.3	-175.8	-170.9	0	0	0	0	113.6
1149	N	33.7	Very low	30.8	Very low	132 Å²	132	121.9 Å²	121.9	71%	0.706	70%	0.704	S	S	*	*			trans	150.1	162.5	154.6	-78.7	-24.3	0	0	0	112.4
1150	Q	38.7	Very low	30.8	Very low	151 Å²	151	126.5 Å²	126.5	71%	0.706	72%	0.717	S	S	*	*			cis	-174.8	170.4	-18	-96.8	-179.8	33.3	0	0	106
1151	L	29.2	Very low	30.6	Very low	135 Å²	135	126 Å²	126	71%	0.707	72%	0.72	S	S	*	*			cis	-159.7	-166.4	-9	-103.7	172.9	0	0	0	106
1152	M	26.6	Very low	30.5	Very low	153 Å²	153	124.3 Å²	124.3	75%	0.754	73%	0.728	S	S	*	*				-161.3	159.8	-95.3	-135.6	169.6	57.9	0	0	112.3
1153	V	29.8	Very low	30.3	Very low	112 Å²	112	122.5 Å²	122.5	68%	0.679	72%	0.723	S	S	*	*			trans	75	151.6	158.6	-178.3	0	0	0	0	114.2
1154	V	28.3	Very low	30.2	Very low	137 Å²	137	124.3 Å²	124.3	83%	0.83	73%	0.732	S	S	*	*			cis	-138.1	160.7	39.1	-151.7	0	0	0	0	115.1
1155	N	28.2	Very low	30.2	Very low	111 Å²	111	124 Å²	124	59%	0.594	73%	0.73	S	S	*	*			trans	-95.5	157.4	179.1	-51.7	-8.6	0	0	0	113.6	S690	S690-N1155 PolarHBondContact OG-ND2 3.21Å
1156	A	30.7	Very low	29.9	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	74%	0.74	S	S	*	*			trans	-160.9	122.9	143.8	0	0	0	0	0	106.2
1157	D	27.2	Very low	29.8	Very low	100 Å²	100	127.2 Å²	127.2	54%	0.535	73%	0.73	S	S	.	*				84.6	132.1	65.3	-94.2	-51	0	0	0	115.3	S691	S691-D1157 WeakPolarHBondContact CB-OD1 3.49Å; S691-D1157 PolarHBondContact OG-OD1 2.93Å; S691-D1157 PolarHBondContact OG-OD2 3.36Å
1158	E	32.8	Very low	29.9	Very low	169 Å²	169	129 Å²	129	79%	0.79	74%	0.737	S	S	*	*			trans	63.4	132.3	174.2	-54.6	-164.7	143.7	0	0	118.4
1159	G	30.1	Very low	29.7	Very low	58 Å²	58	131.6 Å²	131.6	60%	0.598	74%	0.738	S	S	*	*			trans	-104.1	-177.3	-178.9	0	0	0	0	0	113.6
1160	L	29.7	Very low	29.5	Very low	172 Å²	172	133.3 Å²	133.3	90%	0.901	75%	0.748	S	S	*	*			trans	-168.2	165.4	158.4	-107.6	170.5	0	0	0	109.8
1161	D	27.7	Very low	29.3	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	75%	0.747	S	S	*	*			trans	-74.4	153.6	-177.3	-56.5	-80.6	0	0	0	114.1
1162	G	30.7	Very low	29.4	Very low	74 Å²	74	131.3 Å²	131.3	76%	0.763	75%	0.753	S	S	*	*			trans	121.5	150.2	138.3	0	0	0	0	0	118.4
1163	N	27.3	Very low	29.6	Very low	106 Å²	106	127.4 Å²	127.4	57%	0.567	75%	0.751	S	S	*	*			trans	-50.8	129.6	174.5	-54.9	-48.4	0	0	0	113.5
1164	Q	29.4	Very low	29.5	Very low	195 Å²	195	129.9 Å²	129.9	91%	0.911	76%	0.76	S	S	*	*			trans	-152.5	156.6	135.1	-128.9	156.3	89.2	0	0	114.2
1165	V	29.9	Very low	29.5	Very low	117 Å²	117	131.7 Å²	131.7	71%	0.709	77%	0.765	S	S	*	*			trans	-127	140.7	-174.7	171.4	0	0	0	0	107.4	V1167	V1165-V1167 HydrophobicContact CG1-CG2 3.92Å
1166	M	23.7	Very low	29.5	Very low	189 Å²	189	130.5 Å²	130.5	93%	0.931	77%	0.77	S	S	*	*			trans	-107.7	110.4	158.4	-79.6	-161.6	-69.8	0	0	110
1167	V	29.9	Very low	29.4	Very low	102 Å²	102	133.6 Å²	133.6	62%	0.618	77%	0.773	S	S	*	*			trans	-95.9	142.6	159.4	165.8	0	0	0	0	107.1	V1165 E1169	V1165-V1167 HydrophobicContact CG1-CG2 3.92Å; V1167-E1169 HydrophobicContact CG1-CB 4.37Å; V1167-E1169 HydrophobicContact CG1-CG 3.79Å
1168	V	30.7	Very low	29.5	Very low	141 Å²	141	134.6 Å²	134.6	86%	0.855	78%	0.783	S	S	*	*			trans	-113.6	112.9	161.4	-179.8	0	0	0	0	106.7
1169	E	30	Very low	29.4	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	78%	0.78	S	S	*	*			trans	-108.6	150.6	174.7	-94.7	-175.7	174.8	0	0	110.1	V1167	V1167-E1169 HydrophobicContact CG1-CB 4.37Å; V1167-E1169 HydrophobicContact CG1-CG 3.79Å
1170	D	29.9	Very low	29.4	Very low	168 Å²	168	136.9 Å²	136.9	90%	0.898	79%	0.79	S	S	*	*			trans	-129.4	133.5	158	-87.5	-49.2	0	0	0	107.9
1171	G	32.8	Very low	29.5	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	78%	0.777	S	S	*	*	S	Bend	trans	128.4	-11	151.8	0	0	0	0	0	120.4
1172	H	32.3	Very low	29.7	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.815	78%	0.777	S	S	*	*			trans	51.2	113.3	164.2	-56.8	-65.1	0	0	0	121.5
1173	G	29.7	Very low	29.8	Very low	70 Å²	70	134.2 Å²	134.2	72%	0.722	77%	0.773	S	S	*	*				109.2	142	112.3	0	0	0	0	0	119
1174	L	28.9	Very low	30.3	Very low	164 Å²	164	137.7 Å²	137.7	86%	0.859	79%	0.786	S	S	*	*			cis	-150.9	131.8	-13.2	-86.6	177.2	0	0	0	108.7
1175	D	28.1	Very low	30.5	Very low	175 Å²	175	135 Å²	135	94%	0.936	78%	0.778	S	S	*	*				-166	139	120.3	-114.4	-16.3	0	0	0	109.7
1176	A	27.5	Very low	30.6	Very low	86 Å²	86	135 Å²	135	71%	0.711	78%	0.778	S	S	*	*			trans	-108.3	134	-165.8	0	0	0	0	0	113
1177	L	28.6	Very low	31.2	Very low	158 Å²	158	134 Å²	134	83%	0.827	77%	0.771	S	S	*	*			trans	-129.3	80.2	173.3	-108.6	167.7	0	0	0	110.8	V1179	L1177-V1179 PolarHBondContact O-N 3.38Å
1178	T	29.7	Very low	31.2	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	78%	0.779	S	S	*	*			trans	-70.6	117.1	177.5	-43.2	0	0	0	0	110.5
1179	V	30.5	Very low	31.2	Very low	121 Å²	121	140 Å²	140	73%	0.733	78%	0.775	S	S	*	*			trans	-102.1	107	173.3	-178.1	0	0	0	0	109.4	L1177	L1177-V1179 PolarHBondContact O-N 3.38Å
1180	L	30.4	Very low	31.1	Very low	154 Å²	154	138.7 Å²	138.7	81%	0.806	77%	0.772	S	S	*	*			trans	-75.6	133.6	174	-70.9	164	0	0	0	110.6
1181	T	32.1	Very low	31	Very low	101 Å²	101	136.5 Å²	136.5	62%	0.62	76%	0.764	S	S	*	*			trans	-108.9	107.3	172.7	51.6	0	0	0	0	111
1182	Q	31.6	Very low	30.8	Very low	182 Å²	182	142.9 Å²	142.9	85%	0.85	77%	0.769	S	S	*	*			trans	-147.2	149.4	165.2	-84.3	-173.4	-28.6	0	0	108.6
1183	G	32.4	Very low	30.6	Very low	66 Å²	66	141 Å²	141	68%	0.68	76%	0.764	S	S	*	*			trans	124.4	113.6	176.9	0	0	0	0	0	112.5
1184	E	38.5	Very low	30.6	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	77%	0.766	S	S	*	*			trans	-84.4	146.4	173.2	-57.3	-177.5	125.9	0	0	111
1185	N	33.9	Very low	30.6	Very low	139 Å²	139	146.5 Å²	146.5	74%	0.743	77%	0.766	S	S	*	*	S	Bend	trans	70.1	147.6	168.5	-58.3	-62.5	0	0	0	118.7
1186	T	31.9	Very low	30.7	Very low	117 Å²	117	145.7 Å²	145.7	72%	0.718	76%	0.757	S	S	*	*			trans	65.2	102.9	166.1	55.2	0	0	0	0	120.4
1187	H	34.8	Very low	30.9	Very low	168 Å²	168	148.1 Å²	148.1	78%	0.778	76%	0.763	S	S	*	*	S	Bend	trans	40.7	114.6	134.7	-63.1	-71.3	0	0	0	122
1188	H	30.7	Very low	30.8	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.787	76%	0.762	S	S	*	*			trans	80.3	117.9	165	-53.3	95.2	0	0	0	117.3
1189	Y	30.1	Very low	31	Very low	197 Å²	197	149 Å²	149	77%	0.773	76%	0.763	S	S	*	*			trans	-122.1	136.1	154.8	-68.5	-80.1	0	0	0	109
1190	I	29.2	Very low	30.9	Very low	132 Å²	132	150.4 Å²	150.4	68%	0.677	77%	0.765	S	S	*	*			trans	-111.7	115.8	174	-59.3	174.1	0	0	0	107	Y1192	I1190-Y1192 HydrophobicContact CG2-CD2 3.78Å; I1190-Y1192 HydrophobicContact CG2-CE2 3.63Å
1191	V	28.1	Very low	31	Very low	122 Å²	122	154 Å²	154	74%	0.739	79%	0.785	S	S	*	*			trans	-96	110	169.6	-177.4	0	0	0	0	107.8	I1193	V1191-I1193 HydrophobicContact CG1-CG1 4.24Å
1192	Y	26.9	Very low	31	Very low	202 Å²	202	156.7 Å²	156.7	79%	0.792	79%	0.793	S	S	*	*			trans	-81.5	124.1	167.6	-79.9	-87.9	0	0	0	109.2	I1190	I1190-Y1192 HydrophobicContact CG2-CD2 3.78Å; I1190-Y1192 HydrophobicContact CG2-CE2 3.63Å
1193	I	29.1	Very low	30.9	Very low	138 Å²	138	155.3 Å²	155.3	71%	0.708	79%	0.79	S	S	*	*			trans	-119.4	119.7	158.2	-61.3	-179	0	0	0	106.4	V1191	V1191-I1193 HydrophobicContact CG1-CG1 4.24Å
1194	Q	28.7	Very low	30.9	Very low	163 Å²	163	160.3 Å²	160.3	76%	0.762	80%	0.796	S	S	*	*			trans	-104.6	90.1	-173	-179.3	178.8	-13.7	0	0	109	Q1196	Q1194-Q1196 PolarHBondContact O-N 3.5Å
1195	E	29.8	Very low	30.4	Very low	185 Å²	185	159.2 Å²	159.2	86%	0.864	79%	0.794	S	S	*	*			trans	-68.2	96.8	171.9	-70.8	-172.5	151.7	0	0	109.9
1196	Q	30.1	Very low	30.2	Very low	159 Å²	159	160.4 Å²	160.4	74%	0.743	80%	0.797	S	S	*	*			trans	-69.9	126.8	164.5	-86.2	-174.3	-36.7	0	0	109.6	Q1194 V1198	Q1194-Q1196 PolarHBondContact O-N 3.5Å; Q1196-V1198 PolarHBondContact O-N 2.81Å
1197	T	31.3	Very low	30.1	Very low	136 Å²	136	163.3 Å²	163.3	83%	0.834	80%	0.802	S	S	*	*			trans	-69.2	117.7	167.7	49.3	0	0	0	0	110.2
1198	V	27.6	Very low	29.8	Very low	133 Å²	133	163 Å²	163	81%	0.806	80%	0.804	S	S	*	*			trans	-111.9	109	160.1	-179.7	0	0	0	0	107.1	Q1196	Q1196-V1198 PolarHBondContact O-N 2.81Å
1199	E	33.4	Very low	29.7	Very low	166 Å²	166	162.5 Å²	162.5	78%	0.776	81%	0.805	S	S	*	*			trans	-79.3	179.3	165.8	-62	-173.6	133.1	0	0	109.9
1200	I	29.4	Very low	29.6	Very low	149 Å²	149	159.6 Å²	159.6	76%	0.764	81%	0.808	S	S	*	*			trans	80.2	115.9	172.3	-49.4	167.6	0	0	0	112.2
1201	N	32.2	Very low	29.7	Very low	230 Å²	230	162.1 Å²	162.1	100%	1.23	82%	0.82	S	S	*	*			cis	-134.5	0	4.5	-97.1	-43.5	0	0	0	111.4

Retrieved 1,201 of 1,201 residues in 1525.8 ms (Link to these results)

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