A0A077Z1Y6_TRITR Loading...

DNA polymerase theta

AlphaFold DB , UniProt , Accession A0A077Z1Y6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,219 aa.

						>A0A077Z1Y6_TRITR|A0A077Z1Y6
FLHFYWKTDLSGFGLEEDVIKCYADHGIVQLFPWQRDCLCLPGVLQGERNLVYTAPTSAGKTLVAEIILLKRVLETGKRGLFILPFISVAREKMLYLHSIYRNVGIQVQGYMGTLNPAGGMHSWDVAVCTIEKANSLINRLLEEDSMSSLGVIVVDELHLVKDRHRGKLLYHVRQQQFAYGPSNPIQIIGMSATLPNIEIYGKWLCSEIFRTDFRPVPLTEYLFSNGKFYTKNFELVRSLLCLETVIVGCGVLVFCSTKAWCERLALLIAEAIKELLDCSGSLTARLNALIESEKQKHFLDSFGTIAGVVDPVLRSTLPYAVGFHHAGLTMEERERLENGFRKSLVRVLVATSTLSSGVNLPAKRVISGPCLDSYMYKQMTGRAGRKGLDVQGMAKFYHLYKTDRLKLTYFPKLRKRRNCDAADIRASKETTLPYKLQTWGIQSYQWDPVQQCLFSLTERNFISCSAEGEPTLSHGCFKNLHFAEEISPTQLGCATVSSSMGPDEAVAVFQDLQTAKSAVVLENDLHLVYLVTLSYCQHGVTPLCMLDNLATTISWAQYFSIWQSLDEASRKVGQTVGVEESYLVEKLCSYGRRNVRKREVHLRFFVALALFQLVEEVPLAEVSARFSCNRGYLQSLQQQASTYAAMVISFVDRLGWFSLKNLLSGFAERLAFGVKQDLTELVQIDGIDGLRARRFHEAGLATVSKLAQSKIKEISSSSSKNSWLAGHSELTLVEAATFVRFQARTLLNDKLRQYGVTAKRMDEKEVEEDECNCFCASTAAWLLNPDSGRLHPKELLEIYCPADLPSLRFIPTSLGQASTCCMSSIAMCLVWPHLYELLERMHMLPAFKEIELPAQWAVAQMELTGIGFDSALCSSMCESLKGRIMELEFDSARLAGRQFNMSSPNEVAKVLFHELGLPADSSHLLSRGDAKRYSTSKPVLEKLCSVHPLPRNVLQWRQLSFALSSYVYPLLRTRSNKCFTRIYGKYDWFTATGRVIMHEPNLQNLPKKISLRNLVVARHGCILLSADFSQLELRIIAHLSGDPKLMSLLNDGQDIFAFLASELNSVCLTDVSEVQRSQAKQLLLPFLGVASWMQATVERCRHLGYAITIANRVQIKSSISSERCQAERRAINTTVQGSASDIFKLAVKAVCTRLQGKHYILLIHSVIICNHIDAFRKQCAYSESESHYAMEGAASLKVALVVKIKVGVRWGDMVEISL
					

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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	F	31.8	Very low	46	Very low	255 Å²	255	137.6 Å²	137.6	100%	1.118	63%	0.632	S	S	*	*				0	-22.4	0	-99.3	-89.3	0	0	0	114.8
2	L	32	Very low	48	Very low	166 Å²	166	127.3 Å²	127.3	87%	0.869	59%	0.591	S	S	*	*			trans	-95.5	-3	-175.6	-81.2	156.1	0	0	0	116.5
3	H	33.7	Very low	50	Low	191 Å²	191	118.9 Å²	118.9	88%	0.884	55%	0.552	S	S	*	*	S	Bend	trans	-94	0.2	-172.9	-109.8	-44.7	0	0	0	116.5
4	F	36.1	Very low	51.6	Low	176 Å²	176	114.7 Å²	114.7	77%	0.772	56%	0.557	S	S	*	*			trans	-101.7	-5.9	-174.7	-99.4	-84.1	0	0	0	115.6
5	Y	33.8	Very low	53.4	Low	183 Å²	183	108.1 Å²	108.1	72%	0.718	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	133.5	172.1	-74.8	-89.4	0	0	0	108.8
6	W	38.4	Very low	55.2	Low	228 Å²	228	107.9 Å²	107.9	86%	0.864	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	100	15.8	172.8	-43.4	113	0	0	0	120.4	T8	W6-T8 VanDerWaalsContact C-N 3.29Å; W6-T8 PolarHBondContact O-N 2.62Å
7	K	44.5	Very low	56.7	Low	110 Å²	110	111.5 Å²	111.5	48%	0.478	54%	0.538	S	S	.	.			trans	-83.5	72.1	164.5	-85.1	172.4	158	-156.1	0	111	D9 G12	K7-D9 VanDerWaalsContact C-N 3.31Å; K7-G12 WeakPolarHBondContact CD-O 3.46Å; K7-G12 PolarHBondContact NZ-O 3.08Å
8	T	49.4	Very low	58.3	Low	75 Å²	75	109.8 Å²	109.8	46%	0.46	53%	0.533	S	S	.	.			trans	-80.8	-16.9	170	40.1	0	0	0	0	113	W6	W6-T8 VanDerWaalsContact C-N 3.29Å; W6-T8 PolarHBondContact O-N 2.62Å
9	D	65.2	Low	59.6	Low	73 Å²	73	104.1 Å²	104.1	39%	0.39	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-84.4	148.7	177.8	-173.6	16.8	0	0	0	111.1	K7 S11 G12	K7-D9 VanDerWaalsContact C-N 3.31Å; D9-S11 WeakPolarHBondContact CB-OG 3.35Å; D9-S11 PolarHBondContact O-N 3.41Å; D9-S11 WeakPolarHBondContact OD2-CB 3.48Å; D9-S11 PolarHBondContact OD2-OG 2.78Å; D9-G12 PolarHBondContact O-N 3.07Å
10	L	70.4	Confident	60.8	Low	1 Å²	1	100.5 Å²	100.5	1%	0.005	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-56.5	-30.8	177.6	-81.8	153	0	0	0	112.1	G12 F13 L15 I20 I28 L31 I67	L10-G12 PolarHBondContact O-N 2.96Å; L10-F13 PolarHBondContact O-N 3.36Å; L10-L15 HydrophobicContact CD2-CD1 4.05Å; L10-I20 HydrophobicContact CB-CG1 4.12Å; L10-I20 HydrophobicContact CB-CG2 4.16Å; L10-I28 HydrophobicContact CD1-CG2 4.27Å; L10-I28 WeakPolarHBondContact CD1-O 3.48Å; L10-L31 HydrophobicContact CD2-CD2 4.13Å; L10-L31 HydrophobicContact CD2-CG 4.27Å; L10-I67 HydrophobicContact CD2-CD1 4.14Å
11	S	70.7	Confident	62	Low	56 Å²	56	102 Å²	102	39%	0.392	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-51.7	-24.1	171.4	59.9	0	0	0	0	113.2	D9 F13	D9-S11 WeakPolarHBondContact CB-OG 3.35Å; D9-S11 PolarHBondContact O-N 3.41Å; D9-S11 WeakPolarHBondContact OD2-CB 3.48Å; D9-S11 PolarHBondContact OD2-OG 2.78Å; S11-F13 VanDerWaalsContact C-N 3.27Å; S11-F13 PolarHBondContact O-N 3.05Å
12	G	69.8	Low	64.5	Low	14 Å²	14	90.4 Å²	90.4	14%	0.144	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-61.3	-28.9	179.4	0	0	0	0	0	116	K7 D9 L10	K7-G12 WeakPolarHBondContact CD-O 3.46Å; K7-G12 PolarHBondContact NZ-O 3.08Å; D9-G12 PolarHBondContact O-N 3.07Å; L10-G12 PolarHBondContact O-N 2.96Å
13	F	74.3	Confident	67.1	Low	18 Å²	18	82.5 Å²	82.5	8%	0.079	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-96.5	6.3	-169	-63.9	-88.7	0	0	0	114.1	L10 S11 L15 L31 R36 L39 L45 K71	L10-F13 PolarHBondContact O-N 3.36Å; S11-F13 VanDerWaalsContact C-N 3.27Å; S11-F13 PolarHBondContact O-N 3.05Å; F13-L15 HydrophobicContact CB-CG 4.49Å; F13-L31 HydrophobicContact CD2-CD1 4.05Å; F13-L31 HydrophobicContact CE2-CD1 3.39Å; F13-L31 HydrophobicContact CZ-CD1 3.71Å; F13-R36 HydrophobicContact CZ-CB 4.21Å; F13-R36 HydrophobicContact CZ-CG 3.94Å; F13-L39 HydrophobicContact CD1-CB 4.29Å; F13-L39 HydrophobicContact CD1-CD1 4.12Å; F13-L39 HydrophobicContact CE1-CB 3.71Å; F13-L39 HydrophobicContact CE1-CD1 3.8Å; F13-L39 HydrophobicContact CE1-CG 4.41Å; F13-L39 HydrophobicContact CZ-CD1 4.1Å; F13-L45 HydrophobicContact CD1-CD2 4Å; F13-K71 PolarHBondContact O-NZ 3.23Å
14	G	72.1	Confident	69.5	Low	60 Å²	60	75.5 Å²	75.5	62%	0.619	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	37	-178.8	0	0	0	0	0	112.7
15	L	79.2	Confident	71.7	Confident	16 Å²	16	73 Å²	73	8%	0.084	37%	0.371	C	S	.	.			trans	-86.5	144.4	169.6	-61.7	175.5	0	0	0	108.9	L10 F13 I20 Y23 I67 L70	L10-L15 HydrophobicContact CD2-CD1 4.05Å; F13-L15 HydrophobicContact CB-CG 4.49Å; L15-I20 HydrophobicContact CB-CD1 4.32Å; L15-I20 HydrophobicContact CB-CG1 4.04Å; L15-Y23 HydrophobicContact CD1-CE2 4.49Å; L15-I67 HydrophobicContact CD1-CG1 4.34Å; L15-I67 HydrophobicContact CD1-CG2 4.47Å; L15-I67 HydrophobicContact CD2-CG2 4.41Å; L15-L70 HydrophobicContact CD2-CD2 4.06Å
16	E	81.7	Confident	73.9	Confident	104 Å²	104	68.3 Å²	68.3	49%	0.486	36%	0.356	S	S	.	.			trans	-65.5	149.7	175.3	-67.6	-170.4	176.7	0	0	111.9	D18 V19 I20 V104	E16-D18 VanDerWaalsContact C-N 3.26Å; E16-D18 PolarHBondContact O-N 3.04Å; E16-V19 HydrophobicContact CB-CG2 4.41Å; E16-V19 WeakPolarHBondContact O-CB 3.44Å; E16-V19 PolarHBondContact O-N 3.3Å; E16-V19 VanDerWaalsContact O-N 3.1Å; E16-I20 WeakPolarHBondContact O-CG1 3.13Å; E16-I20 PolarHBondContact O-N 3.06Å; E16-I20 VanDerWaalsContact O-N 3.15Å; E16-V104 HydrophobicContact CB-CG1 4.32Å; E16-V104 VanDerWaalsContact OE2-CG1 3.25Å; E16-V104 WeakPolarHBondContact OE2-CG1 3.4Å
17	E	81.9	Confident	75.7	Confident	169 Å²	169	60.3 Å²	60.3	79%	0.79	34%	0.344	S	S	*	.	H	α-helix	trans	-57.9	-37.7	-176.5	-70.7	-173	172.6	0	0	112.7	V19 I20 K21	E17-V19 VanDerWaalsContact C-N 3.32Å; E17-V19 PolarHBondContact O-N 3.29Å; E17-I20 PolarHBondContact O-N 3.5Å; E17-K21 WeakPolarHBondContact O-CB 3.4Å; E17-K21 PolarHBondContact O-N 2.88Å
18	D	83.9	Confident	77.5	Confident	82 Å²	82	56.8 Å²	56.8	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-37.6	178.6	-74.7	-27.9	0	0	0	112.4	E16 K21 C22 N103	E16-D18 VanDerWaalsContact C-N 3.26Å; E16-D18 PolarHBondContact O-N 3.04Å; D18-K21 PolarHBondContact O-N 3.21Å; D18-C22 PolarHBondContact O-N 2.92Å; D18-C22 PolarHBondContact O-SG 3.04Å; D18-N103 HydrophobicContact CB-CB 4.11Å
19	V	84.2	Confident	78.9	Confident	1 Å²	1	58 Å²	58	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-68.5	-42.5	176	179.4	0	0	0	0	110.5	E16 E17 K21 C22 Y23 L70 I100 V104	E16-V19 HydrophobicContact CB-CG2 4.41Å; E16-V19 WeakPolarHBondContact O-CB 3.44Å; E16-V19 PolarHBondContact O-N 3.3Å; E16-V19 VanDerWaalsContact O-N 3.1Å; E17-V19 VanDerWaalsContact C-N 3.32Å; E17-V19 PolarHBondContact O-N 3.29Å; V19-K21 VanDerWaalsContact C-N 3.28Å; V19-K21 PolarHBondContact O-N 3.08Å; V19-C22 PolarHBondContact O-N 2.72Å; V19-Y23 HydrophobicContact CG1-CD2 3.71Å; V19-Y23 HydrophobicContact CG1-CE2 3.46Å; V19-Y23 VanDerWaalsContact CG1-CE2 3.46Å; V19-Y23 VanDerWaalsContact O-CD2 3.3Å; V19-Y23 WeakPolarHBondContact O-CD2 3.29Å; V19-Y23 PolarHBondContact O-N 3.49Å; V19-L70 HydrophobicContact CB-CD2 4.39Å; V19-L70 HydrophobicContact CG1-CD2 3.53Å; V19-L70 HydrophobicContact CG2-CD2 4.07Å; V19-I100 HydrophobicContact CG1-CG2 4.09Å; V19-V104 HydrophobicContact CG2-CB 4.38Å; V19-V104 HydrophobicContact CG2-CG1 3.25Å; V19-V104 HydrophobicContact CG2-CG2 4.2Å
20	I	83.9	Confident	79.7	Confident	31 Å²	31	60.5 Å²	60.5	16%	0.159	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-43	178.3	-63.4	167.9	0	0	0	109.7	L10 L15 E16 E17 Y23 A24	L10-I20 HydrophobicContact CB-CG1 4.12Å; L10-I20 HydrophobicContact CB-CG2 4.16Å; L15-I20 HydrophobicContact CB-CD1 4.32Å; L15-I20 HydrophobicContact CB-CG1 4.04Å; E16-I20 WeakPolarHBondContact O-CG1 3.13Å; E16-I20 PolarHBondContact O-N 3.06Å; E16-I20 VanDerWaalsContact O-N 3.15Å; E17-I20 PolarHBondContact O-N 3.5Å; I20-Y23 PolarHBondContact O-N 3.38Å; I20-A24 PolarHBondContact O-N 3.33Å
21	K	85	Confident	80.5	Confident	133 Å²	133	60.9 Å²	60.9	58%	0.578	35%	0.348	S	S	*	.	H	α-helix	trans	-61.3	-45.6	174.3	-171.1	177.3	179.6	-179.9	0	111.8	E17 D18 V19 Y23 A24 D25	E17-K21 WeakPolarHBondContact O-CB 3.4Å; E17-K21 PolarHBondContact O-N 2.88Å; D18-K21 PolarHBondContact O-N 3.21Å; V19-K21 VanDerWaalsContact C-N 3.28Å; V19-K21 PolarHBondContact O-N 3.08Å; K21-Y23 VanDerWaalsContact C-N 3.32Å; K21-Y23 PolarHBondContact O-N 2.92Å; K21-A24 WeakPolarHBondContact O-CB 3.3Å; K21-A24 PolarHBondContact O-N 3.02Å; K21-A24 VanDerWaalsContact O-N 3.09Å; K21-D25 PolarHBondContact O-N 3.28Å
22	C	85	Confident	81.3	Confident	11 Å²	11	60.2 Å²	60.2	7%	0.074	34%	0.339	C	S	.	.	H	α-helix	trans	-60.3	-39.8	175	-71.9	0	0	0	0	112.6	D18 V19 D25 H26 I100 N103	D18-C22 PolarHBondContact O-N 2.92Å; D18-C22 PolarHBondContact O-SG 3.04Å; V19-C22 PolarHBondContact O-N 2.72Å; C22-D25 PolarHBondContact O-N 3.31Å; C22-H26 PolarHBondContact O-N 2.93Å; C22-H26 PolarHBondContact O-ND1 2.93Å; C22-I100 HydrophobicContact CB-CG2 4.31Å; C22-N103 PolarHBondContact SG-ND2 3.19Å
23	Y	86	Confident	82.1	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-40.4	173.2	-81.3	-58.1	0	0	0	112	L15 V19 I20 K21 D25 H26 G27 I28 L63 I100	L15-Y23 HydrophobicContact CD1-CE2 4.49Å; V19-Y23 HydrophobicContact CG1-CD2 3.71Å; V19-Y23 HydrophobicContact CG1-CE2 3.46Å; V19-Y23 VanDerWaalsContact CG1-CE2 3.46Å; V19-Y23 VanDerWaalsContact O-CD2 3.3Å; V19-Y23 WeakPolarHBondContact O-CD2 3.29Å; V19-Y23 PolarHBondContact O-N 3.49Å; I20-Y23 PolarHBondContact O-N 3.38Å; K21-Y23 VanDerWaalsContact C-N 3.32Å; K21-Y23 PolarHBondContact O-N 2.92Å; Y23-D25 VanDerWaalsContact C-N 3.34Å; Y23-D25 PolarHBondContact O-N 3.48Å; Y23-H26 CarbonylContact O-C 3.46Å; Y23-H26 WeakPolarHBondContact O-CA 3.38Å; Y23-H26 PolarHBondContact O-N 3.18Å; Y23-H26 VanDerWaalsContact O-N 3.11Å; Y23-G27 PolarHBondContact O-N 3.46Å; Y23-I28 CarbonylContact C-O 3.59Å; Y23-I28 HydrophobicContact CD1-CD1 3.97Å; Y23-I28 WeakPolarHBondContact O-CA 3.28Å; Y23-I28 WeakPolarHBondContact O-CB 3.33Å; Y23-I28 PolarHBondContact O-N 2.87Å; Y23-L63 HydrophobicContact CD1-CD1 4.1Å; Y23-L63 HydrophobicContact CE1-CD1 3.53Å; Y23-I100 HydrophobicContact CD1-CD1 3.94Å; Y23-I100 HydrophobicContact CD1-CG2 4.49Å; Y23-I100 HydrophobicContact CD2-CG2 4.44Å; Y23-I100 HydrophobicContact CE1-CD1 3.65Å; Y23-I100 HydrophobicContact CE1-CG2 4.15Å; Y23-I100 HydrophobicContact CE2-CG2 4.08Å
24	A	84.3	Confident	82.9	Confident	45 Å²	45	62.6 Å²	62.6	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-40.1	176.1	0	0	0	0	0	112	I20 K21 H26 G27 I28	I20-A24 PolarHBondContact O-N 3.33Å; K21-A24 WeakPolarHBondContact O-CB 3.3Å; K21-A24 PolarHBondContact O-N 3.02Å; K21-A24 VanDerWaalsContact O-N 3.09Å; A24-H26 PolarHBondContact O-N 2.99Å; A24-G27 WeakPolarHBondContact O-CA 3.36Å; A24-G27 PolarHBondContact O-N 3.09Å; A24-I28 PolarHBondContact N-O 3.41Å
25	D	82.5	Confident	83.8	Confident	122 Å²	122	59.9 Å²	59.9	65%	0.652	32%	0.323	S	S	*	.	H	α-helix	trans	-62.3	-29.8	174.4	-66.4	-23	0	0	0	112.1	K21 C22 Y23 G27	K21-D25 PolarHBondContact O-N 3.28Å; C22-D25 PolarHBondContact O-N 3.31Å; Y23-D25 VanDerWaalsContact C-N 3.34Å; Y23-D25 PolarHBondContact O-N 3.48Å; D25-G27 VanDerWaalsContact C-N 3.26Å; D25-G27 PolarHBondContact O-N 3.02Å
26	H	79.2	Confident	84.2	Confident	86 Å²	86	63.4 Å²	63.4	40%	0.398	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	9.9	171.8	-67.1	82	0	0	0	113.3	C22 Y23 A24 Y96 S99	C22-H26 PolarHBondContact O-N 2.93Å; C22-H26 PolarHBondContact O-ND1 2.93Å; Y23-H26 CarbonylContact O-C 3.46Å; Y23-H26 WeakPolarHBondContact O-CA 3.38Å; Y23-H26 PolarHBondContact O-N 3.18Å; Y23-H26 VanDerWaalsContact O-N 3.11Å; A24-H26 PolarHBondContact O-N 2.99Å; H26-Y96 AromaticContact CD2-CD2 3.96Å; H26-Y96 AromaticContact CD2-CE2 3.74Å; H26-S99 PolarHBondContact CE1-OG 2.7Å; H26-S99 PolarHBondContact NE2-OG 3.27Å
27	G	77.7	Confident	84.6	Confident	60 Å²	60	61.7 Å²	61.7	62%	0.619	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	17.1	177.2	0	0	0	0	0	114.9	Y23 A24 D25	Y23-G27 PolarHBondContact O-N 3.46Å; A24-G27 WeakPolarHBondContact O-CA 3.36Å; A24-G27 PolarHBondContact O-N 3.09Å; D25-G27 VanDerWaalsContact C-N 3.26Å; D25-G27 PolarHBondContact O-N 3.02Å
28	I	81.9	Confident	85.1	Confident	36 Å²	36	53.7 Å²	53.7	19%	0.185	29%	0.292	C	S	.	.			trans	-104.5	93.7	178.6	-56.1	173.6	0	0	0	108.6	L10 Y23 A24 L63	L10-I28 HydrophobicContact CD1-CG2 4.27Å; L10-I28 WeakPolarHBondContact CD1-O 3.48Å; Y23-I28 CarbonylContact C-O 3.59Å; Y23-I28 HydrophobicContact CD1-CD1 3.97Å; Y23-I28 WeakPolarHBondContact O-CA 3.28Å; Y23-I28 WeakPolarHBondContact O-CB 3.33Å; Y23-I28 PolarHBondContact O-N 2.87Å; A24-I28 PolarHBondContact N-O 3.41Å; I28-L63 HydrophobicContact CD1-CD1 4.09Å; I28-L63 HydrophobicContact CD1-CD2 4.33Å; I28-L63 HydrophobicContact CG2-CD2 3.73Å
29	V	77.6	Confident	85.4	Confident	100 Å²	100	49.8 Å²	49.8	61%	0.606	27%	0.271	S	S	*	.			trans	-98.2	-31.3	178.6	-172.8	0	0	0	0	111.7
30	Q	83.2	Confident	85.7	Confident	125 Å²	125	53.7 Å²	53.7	58%	0.584	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-138.9	142.6	-173.8	161.1	178.7	-7.1	0	0	110.7
31	L	85.7	Confident	86.1	Confident	9 Å²	9	53.9 Å²	53.9	5%	0.047	30%	0.299	C	S	.	.			trans	-78.4	143.7	168.3	-63.9	-177.5	0	0	0	111.9	L10 F13 Q35 L39 L63 I67	L10-L31 HydrophobicContact CD2-CD2 4.13Å; L10-L31 HydrophobicContact CD2-CG 4.27Å; F13-L31 HydrophobicContact CD2-CD1 4.05Å; F13-L31 HydrophobicContact CE2-CD1 3.39Å; F13-L31 HydrophobicContact CZ-CD1 3.71Å; L31-Q35 HydrophobicContact CB-CB 4.33Å; L31-L39 HydrophobicContact CD1-CD1 3.82Å; L31-L63 HydrophobicContact CD2-CD2 3.42Å; L31-L63 VanDerWaalsContact CD2-CD2 3.42Å; L31-L63 HydrophobicContact CD2-CG 4.09Å; L31-I67 HydrophobicContact CD1-CD1 4.32Å; L31-I67 HydrophobicContact CD2-CD1 4.02Å
32	F	87.5	Confident	86.3	Confident	43 Å²	43	52 Å²	52	19%	0.189	30%	0.3	C	S	.	.			trans	-64.2	147.4	167	-64.7	-56	0	0	0	110.3	W34 Q35 R36 A59 F214 P216	F32-W34 PolarHBondContact O-N 3.4Å; F32-W34 VanDerWaalsContact O-N 3.12Å; F32-Q35 HydrophobicContact CB-CG 4.14Å; F32-Q35 WeakPolarHBondContact O-CB 3.3Å; F32-Q35 PolarHBondContact O-N 3.13Å; F32-R36 PolarHBondContact O-N 2.81Å; F32-A59 WeakPolarHBondContact CD2-O 3.23Å; F32-F214 HydrophobicContact CB-CE1 3.96Å; F32-F214 HydrophobicContact CB-CZ 4.28Å; F32-F214 AromaticContact CD1-CE1 3.61Å; F32-F214 HydrophobicContact CD1-CE1 3.61Å; F32-F214 AromaticContact CD1-CZ 3.51Å; F32-F214 HydrophobicContact CD1-CZ 3.51Å; F32-F214 AromaticContact CD2-CE1 3.78Å; F32-F214 HydrophobicContact CD2-CE1 3.78Å; F32-F214 AromaticContact CE1-CE1 3.96Å; F32-F214 HydrophobicContact CE1-CE1 3.96Å; F32-F214 AromaticContact CE1-CZ 3.88Å; F32-F214 HydrophobicContact CE1-CZ 3.88Å; F32-F214 HydrophobicContact CE2-CE1 4.11Å; F32-F214 HydrophobicContact CG-CD1 4.44Å; F32-F214 AromaticContact CG-CE1 3.51Å; F32-F214 HydrophobicContact CG-CE1 3.51Å; F32-F214 AromaticContact CG-CZ 3.88Å; F32-F214 HydrophobicContact CG-CZ 3.88Å; F32-F214 HydrophobicContact CZ-CE1 4.19Å; F32-P216 HydrophobicContact CE1-CB 4.28Å; F32-P216 HydrophobicContact CZ-CB 3.87Å; F32-P216 HydrophobicContact CZ-CG 4.22Å
33	P	86.7	Confident	86.4	Confident	71 Å²	71	51.9 Å²	51.9	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-50.9	-43	-178.5	-29.2	35.1	0	0	0	113.1	Q35 R36 D37	P33-Q35 VanDerWaalsContact C-N 3.34Å; P33-Q35 PolarHBondContact O-N 3.22Å; P33-R36 WeakPolarHBondContact O-CB 3.29Å; P33-R36 PolarHBondContact O-N 3.24Å; P33-D37 PolarHBondContact O-N 2.96Å
34	W	91.7	Very high	86.6	Confident	10 Å²	10	51.9 Å²	51.9	4%	0.038	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-33.9	179	82.5	-94.6	0	0	0	113.3	F32 D37 C38 Y53 A55 A59 K61 V64 F210 T212 F214	F32-W34 PolarHBondContact O-N 3.4Å; F32-W34 VanDerWaalsContact O-N 3.12Å; W34-D37 PolarHBondContact O-N 3.18Å; W34-C38 HydrophobicContact CE3-CB 4.32Å; W34-C38 HydrophobicContact CZ3-CB 4.36Å; W34-C38 VanDerWaalsContact O-CB 3.23Å; W34-C38 WeakPolarHBondContact O-CB 3.49Å; W34-C38 PolarHBondContact O-N 3.46Å; W34-Y53 HydrophobicContact CH2-CD2 4.37Å; W34-Y53 HydrophobicContact CH2-CE2 4.17Å; W34-Y53 HydrophobicContact CZ3-CD2 4.1Å; W34-Y53 HydrophobicContact CZ3-CE2 4.26Å; W34-A55 HydrophobicContact CH2-CB 3.98Å; W34-A55 HydrophobicContact CZ2-CB 4.13Å; W34-A55 HydrophobicContact CZ3-CB 4.32Å; W34-A59 HydrophobicContact CZ2-CB 4.12Å; W34-A59 VanDerWaalsContact CZ2-O 3.28Å; W34-A59 WeakPolarHBondContact CZ2-O 3.42Å; W34-A59 PolarHBondContact NE1-O 3.25Å; W34-A59 VanDerWaalsContact NE1-O 3.17Å; W34-K61 HydrophobicContact CH2-CG 4.26Å; W34-V64 HydrophobicContact CH2-CG2 4.1Å; W34-V64 HydrophobicContact CZ3-CG2 4.16Å; W34-F210 HydrophobicContact CB-CE1 4.16Å; W34-F210 HydrophobicContact CB-CZ 4.25Å; W34-F210 HydrophobicContact CD2-CE1 4.49Å; W34-F210 HydrophobicContact CE3-CD1 4.12Å; W34-F210 AromaticContact CE3-CE1 3.65Å; W34-F210 HydrophobicContact CE3-CE1 3.65Å; W34-F210 HydrophobicContact CZ3-CD1 4.5Å; W34-F210 HydrophobicContact CZ3-CE1 4.44Å; W34-T212 HydrophobicContact CB-CG2 4.27Å; W34-T212 HydrophobicContact CD2-CG2 3.65Å; W34-T212 HydrophobicContact CE3-CG2 3.68Å; W34-T212 HydrophobicContact CG-CG2 3.93Å; W34-T212 HydrophobicContact CZ3-CG2 4.29Å; W34-F214 AromaticContact CD1-CD1 3.21Å; W34-F214 AromaticContact CD1-CE1 3.89Å; W34-F214 AromaticContact CD1-CG 3.57Å; W34-F214 HydrophobicContact CG-CB 4.3Å; W34-F214 HydrophobicContact CG-CD1 4.39Å; W34-F214 HydrophobicContact CG-CG 4.48Å; W34-F214 AromaticContact NE1-CD1 3.36Å; W34-F214 AromaticContact NE1-CE1 3.95Å
35	Q	92	Very high	86.8	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-66.6	-43	178.6	-67.8	171.9	-46	0	0	109.8	L31 F32 P33 C38 L39 G60 V64	L31-Q35 HydrophobicContact CB-CB 4.33Å; F32-Q35 HydrophobicContact CB-CG 4.14Å; F32-Q35 WeakPolarHBondContact O-CB 3.3Å; F32-Q35 PolarHBondContact O-N 3.13Å; P33-Q35 VanDerWaalsContact C-N 3.34Å; P33-Q35 PolarHBondContact O-N 3.22Å; Q35-C38 PolarHBondContact O-N 3.31Å; Q35-L39 WeakPolarHBondContact O-CG 3.26Å; Q35-L39 PolarHBondContact O-N 3.36Å; Q35-G60 PolarHBondContact NE2-O 3.09Å; Q35-V64 HydrophobicContact CB-CG2 3.78Å; Q35-V64 HydrophobicContact CG-CG2 3.85Å
36	R	86.6	Confident	87	Confident	90 Å²	90	50.2 Å²	50.2	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-60.1	-53.2	172.5	174.4	-164.9	72.8	175	3	110.7	F13 F32 P33 C38 L39 C40	F13-R36 HydrophobicContact CZ-CB 4.21Å; F13-R36 HydrophobicContact CZ-CG 3.94Å; F32-R36 PolarHBondContact O-N 2.81Å; P33-R36 WeakPolarHBondContact O-CB 3.29Å; P33-R36 PolarHBondContact O-N 3.24Å; R36-C38 PolarHBondContact O-N 3.39Å; R36-L39 PolarHBondContact O-N 2.93Å; R36-C40 WeakPolarHBondContact O-CB 3.39Å; R36-C40 PolarHBondContact O-N 2.74Å; R36-C40 PolarHBondContact O-SG 3Å
37	D	90.6	Very high	87.3	Confident	69 Å²	69	46.6 Å²	46.6	37%	0.369	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-34.4	-177.2	-58.9	-15.2	0	0	0	111.1	P33 W34 F210	P33-D37 PolarHBondContact O-N 2.96Å; W34-D37 PolarHBondContact O-N 3.18Å; D37-F210 HydrophobicContact CB-CE2 4.1Å; D37-F210 HydrophobicContact CB-CZ 4.22Å
38	C	92.4	Very high	87.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.7	-41.8	173.7	-169.8	0	0	0	0	113	W34 Q35 R36 C40 L41 F210	W34-C38 HydrophobicContact CE3-CB 4.32Å; W34-C38 HydrophobicContact CZ3-CB 4.36Å; W34-C38 VanDerWaalsContact O-CB 3.23Å; W34-C38 WeakPolarHBondContact O-CB 3.49Å; W34-C38 PolarHBondContact O-N 3.46Å; Q35-C38 PolarHBondContact O-N 3.31Å; R36-C38 PolarHBondContact O-N 3.39Å; C38-C40 VanDerWaalsContact C-N 3.32Å; C38-L41 WeakPolarHBondContact O-CB 3.42Å; C38-L41 WeakPolarHBondContact O-CG 3.43Å; C38-L41 PolarHBondContact O-N 2.97Å; C38-F210 HydrophobicContact CB-CB 4.46Å; C38-F210 HydrophobicContact CB-CD1 3.95Å; C38-F210 HydrophobicContact CB-CD2 4.05Å; C38-F210 HydrophobicContact CB-CE1 4.17Å; C38-F210 HydrophobicContact CB-CE2 4.24Å; C38-F210 HydrophobicContact CB-CG 3.89Å; C38-F210 HydrophobicContact CB-CZ 4.29Å
39	L	90.7	Very high	88	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.1	-30.7	176.1	-73.1	168.4	0	0	0	112.1	F13 L31 Q35 R36 L41 L45 V64 I67 I68	F13-L39 HydrophobicContact CD1-CB 4.29Å; F13-L39 HydrophobicContact CD1-CD1 4.12Å; F13-L39 HydrophobicContact CE1-CB 3.71Å; F13-L39 HydrophobicContact CE1-CD1 3.8Å; F13-L39 HydrophobicContact CE1-CG 4.41Å; F13-L39 HydrophobicContact CZ-CD1 4.1Å; L31-L39 HydrophobicContact CD1-CD1 3.82Å; Q35-L39 WeakPolarHBondContact O-CG 3.26Å; Q35-L39 PolarHBondContact O-N 3.36Å; R36-L39 PolarHBondContact O-N 2.93Å; L39-L41 PolarHBondContact O-N 3.47Å; L39-L45 HydrophobicContact CD2-CD1 4.04Å; L39-V64 HydrophobicContact CD2-CG1 3.85Å; L39-V64 HydrophobicContact CG-CG1 4.15Å; L39-I67 HydrophobicContact CD1-CD1 4.1Å; L39-I67 HydrophobicContact CD1-CG2 4.33Å; L39-I67 HydrophobicContact CD2-CB 4.5Å; L39-I67 HydrophobicContact CD2-CG2 4.21Å; L39-I68 HydrophobicContact CD2-CD1 3.97Å; L39-I68 HydrophobicContact CD2-CG1 3.68Å
40	C	89.7	Confident	88.7	Confident	84 Å²	84	51.5 Å²	51.5	57%	0.568	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	3.5	178.9	-67.1	0	0	0	0	113.9	R36 C38	R36-C40 WeakPolarHBondContact O-CB 3.39Å; R36-C40 PolarHBondContact O-N 2.74Å; R36-C40 PolarHBondContact O-SG 3Å; C38-C40 VanDerWaalsContact C-N 3.32Å
41	L	92.9	Very high	89.3	Confident	35 Å²	35	45.6 Å²	45.6	18%	0.183	24%	0.235	C	C	.	.	S	Bend	trans	-60.6	142.4	174.1	-76.2	174.7	0	0	0	111	C38 L39 G43 V44 L51 E208 F210	C38-L41 WeakPolarHBondContact O-CB 3.42Å; C38-L41 WeakPolarHBondContact O-CG 3.43Å; C38-L41 PolarHBondContact O-N 2.97Å; L39-L41 PolarHBondContact O-N 3.47Å; L41-G43 PolarHBondContact O-N 2.93Å; L41-V44 HydrophobicContact CB-CB 4.22Å; L41-V44 HydrophobicContact CB-CG2 3.65Å; L41-V44 PolarHBondContact O-N 3.15Å; L41-L51 HydrophobicContact CD1-CD1 3.77Å; L41-E208 HydrophobicContact CD1-CB 4.21Å; L41-F210 HydrophobicContact CD1-CB 3.97Å; L41-F210 HydrophobicContact CD1-CD2 4.01Å; L41-F210 HydrophobicContact CD1-CG 4.44Å; L41-F210 HydrophobicContact CG-CD2 4.47Å
42	P	88.1	Confident	89.7	Confident	93 Å²	93	45.1 Å²	45.1	60%	0.604	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	125.7	-174.5	-24.3	33.2	0	0	0	112.9	V44	P42-V44 PolarHBondContact O-N 3Å
43	G	87.5	Confident	90.1	Very high	8 Å²	8	43.1 Å²	43.1	8%	0.082	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-5.9	176.2	0	0	0	0	0	115.4	L41 G47 E48 R49	L41-G43 PolarHBondContact O-N 2.93Å; G43-G47 PolarHBondContact O-N 2.92Å; G43-E48 PolarHBondContact O-N 3.29Å; G43-R49 PolarHBondContact O-N 3.5Å
44	V	90.8	Very high	90.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-51.3	-178.1	171	0	0	0	0	110.9	L41 P42 Q46 G47 L51 I68 Q187 E208	L41-V44 HydrophobicContact CB-CB 4.22Å; L41-V44 HydrophobicContact CB-CG2 3.65Å; L41-V44 PolarHBondContact O-N 3.15Å; P42-V44 PolarHBondContact O-N 3Å; V44-Q46 VanDerWaalsContact C-N 3.32Å; V44-Q46 PolarHBondContact O-N 2.86Å; V44-G47 PolarHBondContact O-N 3.49Å; V44-L51 HydrophobicContact CG1-CB 4.11Å; V44-L51 HydrophobicContact CG1-CD1 4.48Å; V44-L51 HydrophobicContact CG1-CD2 3.94Å; V44-L51 HydrophobicContact CG1-CG 4.38Å; V44-L51 HydrophobicContact CG2-CB 4.38Å; V44-L51 HydrophobicContact CG2-CD1 4.2Å; V44-I68 HydrophobicContact CG1-CD1 3.84Å; V44-Q187 PolarHBondContact O-NE2 2.99Å; V44-E208 HydrophobicContact CG2-CB 4.04Å; V44-E208 HydrophobicContact CG2-CG 4.11Å
45	L	87.6	Confident	90.2	Very high	31 Å²	31	39.6 Å²	39.6	16%	0.162	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-28.3	-177.3	-162.6	71.1	0	0	0	112.6	F13 L39 G47 K71	F13-L45 HydrophobicContact CD1-CD2 4Å; L39-L45 HydrophobicContact CD2-CD1 4.04Å; L45-G47 VanDerWaalsContact C-N 3.25Å; L45-K71 HydrophobicContact CD1-CD 3.78Å; L45-K71 HydrophobicContact CD2-CD 4.41Å; L45-K71 HydrophobicContact CG-CD 3.75Å; L45-K71 WeakPolarHBondContact O-CE 3.33Å
46	Q	86.8	Confident	89.7	Confident	101 Å²	101	41 Å²	41	47%	0.472	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.5	175.9	-63.8	76.7	15.6	0	0	112.7	V44 E48 R72	V44-Q46 VanDerWaalsContact C-N 3.32Å; V44-Q46 PolarHBondContact O-N 2.86Å; Q46-E48 VanDerWaalsContact C-N 3.34Å; Q46-E48 HydrophobicContact CB-CG 4Å; Q46-R72 PolarHBondContact O-NH1 3.49Å
47	G	86.3	Confident	89.3	Confident	10 Å²	10	37.9 Å²	37.9	10%	0.103	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	16	-176.5	0	0	0	0	0	114.9	G43 V44 L45	G43-G47 PolarHBondContact O-N 2.92Å; V44-G47 PolarHBondContact O-N 3.49Å; L45-G47 VanDerWaalsContact C-N 3.25Å
48	E	86.8	Confident	88.5	Confident	150 Å²	150	37.3 Å²	37.3	70%	0.701	20%	0.203	S	C	*	.	S	Bend	trans	-81.2	-23.1	177.6	-62.9	172.4	-173.1	0	0	112.2	G43 Q46	G43-E48 PolarHBondContact O-N 3.29Å; Q46-E48 VanDerWaalsContact C-N 3.34Å; Q46-E48 HydrophobicContact CB-CG 4Å
49	R	88	Confident	88	Confident	133 Å²	133	37.3 Å²	37.3	50%	0.502	20%	0.203	S	C	.	.	S	Bend	trans	-131.3	146.2	179	-66.6	-154.9	174.6	-160.8	-2	113.1	G43 Q187 E208	G43-R49 PolarHBondContact O-N 3.5Å; R49-Q187 PolarHBondContact O-NE2 3.18Å; R49-E208 HydrophobicContact CB-CG 4.37Å; R49-E208 WeakPolarHBondContact CD-OE1 3.45Å; R49-E208 IonicContact CZ-OE1 3.72Å; R49-E208 IonicContact NE-OE1 3.92Å; R49-E208 IonicContact NH1-OE1 3.38Å; R49-E208 PolarHBondContact NH1-OE1 3.49Å
50	N	92.1	Very high	87.6	Confident	17 Å²	17	38.7 Å²	38.7	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	159.8	169.2	-64	-25.9	0	0	0	109.9	I188 L205 S207 E208	N50-I188 WeakPolarHBondContact CA-O 3.3Å; N50-I188 HydrophobicContact CB-CB 4.38Å; N50-I188 VanDerWaalsContact CB-O 3.31Å; N50-I188 WeakPolarHBondContact CB-O 3.26Å; N50-I188 PolarHBondContact OD1-N 3.08Å; N50-L205 PolarHBondContact ND2-O 3.41Å; N50-S207 VanDerWaalsContact C-CB 3.44Å; N50-S207 CarbonylContact O-C 3.58Å; N50-S207 VanDerWaalsContact O-CA 3.27Å; N50-S207 WeakPolarHBondContact O-CA 3.44Å; N50-S207 WeakPolarHBondContact O-CB 3.39Å; N50-E208 PolarHBondContact O-N 2.69Å
51	L	95.4	Very high	87.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.5	177.9	177.5	69.9	0	0	0	110.8	L41 V44 Y53 V64 I68 I188 I189 G190 E208	L41-L51 HydrophobicContact CD1-CD1 3.77Å; V44-L51 HydrophobicContact CG1-CB 4.11Å; V44-L51 HydrophobicContact CG1-CD1 4.48Å; V44-L51 HydrophobicContact CG1-CD2 3.94Å; V44-L51 HydrophobicContact CG1-CG 4.38Å; V44-L51 HydrophobicContact CG2-CB 4.38Å; V44-L51 HydrophobicContact CG2-CD1 4.2Å; L51-Y53 HydrophobicContact CD2-CD1 3.59Å; L51-Y53 HydrophobicContact CD2-CE1 3.83Å; L51-Y53 HydrophobicContact CD2-CG 4.43Å; L51-Y53 HydrophobicContact CG-CD1 3.77Å; L51-Y53 HydrophobicContact CG-CE1 4.4Å; L51-V64 HydrophobicContact CD2-CG1 4.2Å; L51-I68 HydrophobicContact CD2-CD1 3.94Å; L51-I188 PolarHBondContact N-O 3.5Å; L51-I189 HydrophobicContact CB-CD1 3.67Å; L51-I189 CarbonylContact O-C 3.01Å; L51-I189 WeakPolarHBondContact O-CA 3.41Å; L51-G190 PolarHBondContact O-N 3.48Å; L51-E208 HydrophobicContact CD1-CB 4.35Å
52	V	94.6	Very high	87.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.4	167.3	176	0	0	0	0	109	L158 G190 L195 I198 L205 S207 E208 I209 F210	V52-L158 HydrophobicContact CB-CD2 4.49Å; V52-L158 HydrophobicContact CG1-CD2 3.66Å; V52-L158 HydrophobicContact CG2-CD2 3.98Å; V52-G190 CarbonylContact C-O 3.55Å; V52-G190 VanDerWaalsContact CA-O 3.28Å; V52-G190 WeakPolarHBondContact CA-O 3.35Å; V52-L195 HydrophobicContact CG1-CD1 4.29Å; V52-I198 HydrophobicContact CG1-CD1 4.09Å; V52-I198 HydrophobicContact CG1-CG1 3.69Å; V52-L205 HydrophobicContact CG2-CD1 3.79Å; V52-S207 WeakPolarHBondContact CB-OG 3.29Å; V52-S207 WeakPolarHBondContact CG2-OG 3.44Å; V52-S207 PolarHBondContact N-OG 2.56Å; V52-E208 PolarHBondContact N-O 2.86Å; V52-I209 VanDerWaalsContact O-CA 3.28Å; V52-I209 WeakPolarHBondContact O-CA 3.32Å; V52-F210 PolarHBondContact O-N 3.22Å; V52-F210 VanDerWaalsContact O-N 3.1Å
53	Y	95.4	Very high	87.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.9	-177.5	67.2	-76.7	0	0	0	114.2	W34 L51 K61 V64 A65 I189 G190 M191 S192 F210	W34-Y53 HydrophobicContact CH2-CD2 4.37Å; W34-Y53 HydrophobicContact CH2-CE2 4.17Å; W34-Y53 HydrophobicContact CZ3-CD2 4.1Å; W34-Y53 HydrophobicContact CZ3-CE2 4.26Å; L51-Y53 HydrophobicContact CD2-CD1 3.59Å; L51-Y53 HydrophobicContact CD2-CE1 3.83Å; L51-Y53 HydrophobicContact CD2-CG 4.43Å; L51-Y53 HydrophobicContact CG-CD1 3.77Å; L51-Y53 HydrophobicContact CG-CE1 4.4Å; Y53-K61 HydrophobicContact CE2-CB 4.04Å; Y53-K61 HydrophobicContact CE2-CG 4.16Å; Y53-K61 PolarHBondContact OH-O 2.98Å; Y53-V64 HydrophobicContact CE1-CG1 4.32Å; Y53-V64 HydrophobicContact CE2-CB 4.31Å; Y53-A65 PolarHBondContact OH-N 3.4Å; Y53-I189 HydrophobicContact CE1-CG2 3.89Å; Y53-G190 PolarHBondContact N-O 3.34Å; Y53-M191 HydrophobicContact CD1-CB 4.09Å; Y53-M191 HydrophobicContact CD2-CB 4.34Å; Y53-M191 HydrophobicContact CE1-CB 3.63Å; Y53-M191 HydrophobicContact CE2-CB 3.87Å; Y53-M191 HydrophobicContact CE2-SD 4.36Å; Y53-M191 HydrophobicContact CG-CB 4.44Å; Y53-M191 WeakPolarHBondContact O-CA 3.38Å; Y53-M191 PolarHBondContact OH-SD 3.44Å; Y53-S192 PolarHBondContact O-N 2.98Å; Y53-F210 CarbonylContact C-O 3.44Å; Y53-F210 WeakPolarHBondContact CA-O 3.3Å; Y53-F210 WeakPolarHBondContact CB-O 3.44Å
54	T	91.3	Very high	87.8	Confident	7 Å²	7	31 Å²	31	4%	0.043	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.6	178	-168.7	0	0	0	0	110.5	S192 A193 T194 L195 I198 F210 R211 T212	T54-S192 WeakPolarHBondContact CA-O 3.46Å; T54-S192 PolarHBondContact OG1-O 3.19Å; T54-A193 PolarHBondContact OG1-O 3.02Å; T54-T194 VanDerWaalsContact OG1-CA 3.24Å; T54-T194 WeakPolarHBondContact OG1-CA 3.47Å; T54-L195 PolarHBondContact OG1-N 2.96Å; T54-I198 HydrophobicContact CG2-CD1 3.81Å; T54-F210 PolarHBondContact N-O 3.44Å; T54-R211 HydrophobicContact CG2-CB 3.87Å; T54-R211 HydrophobicContact CG2-CG 3.64Å; T54-T212 PolarHBondContact O-N 3.01Å; T54-T212 VanDerWaalsContact O-N 3.11Å
55	A	89	Confident	87.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.			trans	-149.4	149.7	171.8	0	0	0	0	0	110	W34 A59 K61 S192 A193 T212	W34-A55 HydrophobicContact CH2-CB 3.98Å; W34-A55 HydrophobicContact CZ2-CB 4.13Å; W34-A55 HydrophobicContact CZ3-CB 4.32Å; A55-A59 HydrophobicContact CB-CB 3.89Å; A55-K61 HydrophobicContact CB-CD 4.03Å; A55-K61 HydrophobicContact CB-CG 3.63Å; A55-K61 WeakPolarHBondContact O-CD 3.48Å; A55-K61 WeakPolarHBondContact O-CE 3.29Å; A55-K61 PolarHBondContact O-NZ 2.99Å; A55-S192 PolarHBondContact N-O 3.44Å; A55-A193 CarbonylContact C-O 2.94Å; A55-A193 VanDerWaalsContact O-CA 3.27Å; A55-A193 WeakPolarHBondContact O-CA 3.47Å; A55-T212 HydrophobicContact CB-CG2 3.41Å; A55-T212 VanDerWaalsContact CB-CG2 3.41Å
56	P	81.8	Confident	88.2	Confident	34 Å²	34	29.7 Å²	29.7	22%	0.221	16%	0.158	C	C	.	.			trans	-52.2	152.2	179.4	-28.3	33.5	0	0	0	113.9	S58 A59 K61 T212	P56-S58 PolarHBondContact O-N 2.87Å; P56-A59 WeakPolarHBondContact O-CB 3.4Å; P56-A59 PolarHBondContact O-N 3.35Å; P56-A59 VanDerWaalsContact O-N 3.08Å; P56-K61 VanDerWaalsContact C-NZ 3.31Å; P56-K61 PolarHBondContact O-NZ 3.32Å; P56-T212 WeakPolarHBondContact CD-O 3.44Å
57	T	77.5	Confident	88.4	Confident	23 Å²	23	24.9 Å²	24.9	14%	0.141	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	140.5	166.2	-48.8	0	0	0	0	108.6
58	S	74	Confident	88.8	Confident	57 Å²	57	24.6 Å²	24.6	40%	0.399	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	-5.4	-168.6	75.4	0	0	0	0	117.8	P56 G60 R215 P216	P56-S58 PolarHBondContact O-N 2.87Å; S58-G60 PolarHBondContact O-N 3.47Å; S58-R215 PolarHBondContact OG-NE 2.81Å; S58-P216 WeakPolarHBondContact O-CD 3.36Å; S58-P216 WeakPolarHBondContact O-CG 3.25Å
59	A	81.2	Confident	89.2	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-71.2	-10.1	178.2	0	0	0	0	0	114.4	F32 W34 A55 P56 F214	F32-A59 WeakPolarHBondContact CD2-O 3.23Å; W34-A59 HydrophobicContact CZ2-CB 4.12Å; W34-A59 VanDerWaalsContact CZ2-O 3.28Å; W34-A59 WeakPolarHBondContact CZ2-O 3.42Å; W34-A59 PolarHBondContact NE1-O 3.25Å; W34-A59 VanDerWaalsContact NE1-O 3.17Å; A55-A59 HydrophobicContact CB-CB 3.89Å; P56-A59 WeakPolarHBondContact O-CB 3.4Å; P56-A59 PolarHBondContact O-N 3.35Å; P56-A59 VanDerWaalsContact O-N 3.08Å; A59-F214 WeakPolarHBondContact CB-O 3.46Å
60	G	83	Confident	89.4	Confident	29 Å²	29	11.1 Å²	11.1	30%	0.299	7%	0.074	S	C	.	.			trans	85.1	33.1	-176.4	0	0	0	0	0	114.1	Q35 S58 T62 L63	Q35-G60 PolarHBondContact NE2-O 3.09Å; S58-G60 PolarHBondContact O-N 3.47Å; G60-T62 PolarHBondContact O-N 3.05Å; G60-L63 PolarHBondContact O-N 3.42Å
61	K	88.3	Confident	89.3	Confident	15 Å²	15	11.7 Å²	11.7	7%	0.065	8%	0.076	C	C	.	.	H	α-helix	trans	-50.5	-52.7	-178.8	-73.4	-173.7	-69.2	-67.7	0	113.9	W34 Y53 A55 P56 L63 V64 M191 S192	W34-K61 HydrophobicContact CH2-CG 4.26Å; Y53-K61 HydrophobicContact CE2-CB 4.04Å; Y53-K61 HydrophobicContact CE2-CG 4.16Å; Y53-K61 PolarHBondContact OH-O 2.98Å; A55-K61 HydrophobicContact CB-CD 4.03Å; A55-K61 HydrophobicContact CB-CG 3.63Å; A55-K61 WeakPolarHBondContact O-CD 3.48Å; A55-K61 WeakPolarHBondContact O-CE 3.29Å; A55-K61 PolarHBondContact O-NZ 2.99Å; P56-K61 VanDerWaalsContact C-NZ 3.31Å; P56-K61 PolarHBondContact O-NZ 3.32Å; K61-L63 PolarHBondContact O-N 3.48Å; K61-L63 VanDerWaalsContact O-N 3.08Å; K61-V64 PolarHBondContact O-N 2.99Å; K61-M191 HydrophobicContact CB-CE 4.16Å; K61-M191 HydrophobicContact CB-SD 3.9Å; K61-S192 WeakPolarHBondContact CD-O 3.42Å
62	T	89.6	Confident	89.1	Confident	30 Å²	30	13.8 Å²	13.8	18%	0.184	8%	0.083	C	C	.	.	H	α-helix	trans	-54.5	-37	-169.8	-35.7	0	0	0	0	112.6	G60 V64 A65 E66 F82 K93 M191	G60-T62 PolarHBondContact O-N 3.05Å; T62-V64 VanDerWaalsContact C-N 3.26Å; T62-V64 PolarHBondContact O-N 3.34Å; T62-A65 PolarHBondContact O-N 3.35Å; T62-E66 HydrophobicContact CG2-CG 4.11Å; T62-E66 WeakPolarHBondContact CG2-OE1 3.25Å; T62-E66 VanDerWaalsContact O-CG 3.23Å; T62-E66 WeakPolarHBondContact O-CG 3.34Å; T62-E66 PolarHBondContact O-N 2.99Å; T62-F82 HydrophobicContact CG2-CE2 4.34Å; T62-F82 HydrophobicContact CG2-CZ 3.67Å; T62-K93 HydrophobicContact CG2-CD 4.3Å; T62-M191 HydrophobicContact CG2-CE 3.85Å; T62-M191 WeakPolarHBondContact OG1-CE 3.47Å
63	L	90.7	Very high	89	Confident	14 Å²	14	14.1 Å²	14.1	7%	0.073	9%	0.086	C	C	.	.	H	α-helix	trans	-57.2	-35.8	-179.4	-172.3	61	0	0	0	113.5	Y23 I28 L31 G60 K61 E66 I67	Y23-L63 HydrophobicContact CD1-CD1 4.1Å; Y23-L63 HydrophobicContact CE1-CD1 3.53Å; I28-L63 HydrophobicContact CD1-CD1 4.09Å; I28-L63 HydrophobicContact CD1-CD2 4.33Å; I28-L63 HydrophobicContact CG2-CD2 3.73Å; L31-L63 HydrophobicContact CD2-CD2 3.42Å; L31-L63 VanDerWaalsContact CD2-CD2 3.42Å; L31-L63 HydrophobicContact CD2-CG 4.09Å; G60-L63 PolarHBondContact O-N 3.42Å; K61-L63 PolarHBondContact O-N 3.48Å; K61-L63 VanDerWaalsContact O-N 3.08Å; L63-E66 PolarHBondContact O-N 3.39Å; L63-I67 HydrophobicContact CD1-CD1 4.3Å; L63-I67 HydrophobicContact CD1-CG1 4.45Å; L63-I67 HydrophobicContact CG-CD1 4.08Å; L63-I67 VanDerWaalsContact O-CG1 3.31Å; L63-I67 WeakPolarHBondContact O-CG1 3.48Å; L63-I67 PolarHBondContact O-N 2.92Å
64	V	93.3	Very high	88.8	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-63.4	-45.9	176.4	172.6	0	0	0	0	110.2	W34 Q35 L39 L51 Y53 K61 T62 I68	W34-V64 HydrophobicContact CH2-CG2 4.1Å; W34-V64 HydrophobicContact CZ3-CG2 4.16Å; Q35-V64 HydrophobicContact CB-CG2 3.78Å; Q35-V64 HydrophobicContact CG-CG2 3.85Å; L39-V64 HydrophobicContact CD2-CG1 3.85Å; L39-V64 HydrophobicContact CG-CG1 4.15Å; L51-V64 HydrophobicContact CD2-CG1 4.2Å; Y53-V64 HydrophobicContact CE1-CG1 4.32Å; Y53-V64 HydrophobicContact CE2-CB 4.31Å; K61-V64 PolarHBondContact O-N 2.99Å; T62-V64 VanDerWaalsContact C-N 3.26Å; T62-V64 PolarHBondContact O-N 3.34Å; V64-I68 HydrophobicContact CG1-CD1 4.07Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.31Å; V64-I68 PolarHBondContact O-N 3.04Å
65	A	93.9	Very high	88.7	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-69.4	-36.1	178.2	0	0	0	0	0	112.7	Y53 T62 I68 L69 V154 I189 M191	Y53-A65 PolarHBondContact OH-N 3.4Å; T62-A65 PolarHBondContact O-N 3.35Å; A65-I68 PolarHBondContact O-N 2.63Å; A65-L69 VanDerWaalsContact O-CB 3.24Å; A65-L69 WeakPolarHBondContact O-CB 3.24Å; A65-L69 PolarHBondContact O-N 3.44Å; A65-V154 HydrophobicContact CB-CG1 3.57Å; A65-V154 HydrophobicContact CB-CG2 4.25Å; A65-I189 HydrophobicContact CB-CG2 4Å; A65-M191 HydrophobicContact CB-SD 4.16Å
66	E	93.4	Very high	88.6	Confident	3 Å²	3	24.1 Å²	24.1	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-41.9	176.4	-66.6	167.2	-174.1	0	0	111.5	T62 L63 L70 F82 K93 Y96 L97 Y101	T62-E66 HydrophobicContact CG2-CG 4.11Å; T62-E66 WeakPolarHBondContact CG2-OE1 3.25Å; T62-E66 VanDerWaalsContact O-CG 3.23Å; T62-E66 WeakPolarHBondContact O-CG 3.34Å; T62-E66 PolarHBondContact O-N 2.99Å; L63-E66 PolarHBondContact O-N 3.39Å; E66-L70 WeakPolarHBondContact O-CB 3.46Å; E66-L70 PolarHBondContact O-N 2.75Å; E66-L70 VanDerWaalsContact O-N 3.09Å; E66-F82 HydrophobicContact CG-CE2 4.17Å; E66-K93 IonicContact OE1-NZ 3.3Å; E66-K93 PolarHBondContact OE1-NZ 2.97Å; E66-Y96 WeakPolarHBondContact OE1-CE1 3.37Å; E66-Y96 WeakPolarHBondContact OE2-CE1 3.26Å; E66-Y96 PolarHBondContact OE2-OH 3.42Å; E66-L97 HydrophobicContact CB-CD2 4.47Å; E66-L97 HydrophobicContact CG-CD2 4.01Å; E66-Y101 PolarHBondContact O-OH 2.71Å
67	I	91.9	Very high	88.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-45.4	177.2	-70.5	168.4	0	0	0	111	L10 L15 L31 L39 L63 L70 K71	L10-I67 HydrophobicContact CD2-CD1 4.14Å; L15-I67 HydrophobicContact CD1-CG1 4.34Å; L15-I67 HydrophobicContact CD1-CG2 4.47Å; L15-I67 HydrophobicContact CD2-CG2 4.41Å; L31-I67 HydrophobicContact CD1-CD1 4.32Å; L31-I67 HydrophobicContact CD2-CD1 4.02Å; L39-I67 HydrophobicContact CD1-CD1 4.1Å; L39-I67 HydrophobicContact CD1-CG2 4.33Å; L39-I67 HydrophobicContact CD2-CB 4.5Å; L39-I67 HydrophobicContact CD2-CG2 4.21Å; L63-I67 HydrophobicContact CD1-CD1 4.3Å; L63-I67 HydrophobicContact CD1-CG1 4.45Å; L63-I67 HydrophobicContact CG-CD1 4.08Å; L63-I67 VanDerWaalsContact O-CG1 3.31Å; L63-I67 WeakPolarHBondContact O-CG1 3.48Å; L63-I67 PolarHBondContact O-N 2.92Å; I67-L70 PolarHBondContact O-N 3.4Å; I67-K71 WeakPolarHBondContact O-CB 3.42Å; I67-K71 PolarHBondContact O-N 3.47Å
68	I	94	Very high	89.6	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-44	179.6	-64.2	167.5	0	0	0	110.8	L39 V44 L51 V64 A65 K71 R72 I189	L39-I68 HydrophobicContact CD2-CD1 3.97Å; L39-I68 HydrophobicContact CD2-CG1 3.68Å; V44-I68 HydrophobicContact CG1-CD1 3.84Å; L51-I68 HydrophobicContact CD2-CD1 3.94Å; V64-I68 HydrophobicContact CG1-CD1 4.07Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.31Å; V64-I68 PolarHBondContact O-N 3.04Å; A65-I68 PolarHBondContact O-N 2.63Å; I68-K71 PolarHBondContact O-N 3.32Å; I68-R72 WeakPolarHBondContact O-CB 3.1Å; I68-R72 PolarHBondContact O-N 3.37Å; I68-I189 HydrophobicContact CD1-CD1 3.86Å; I68-I189 HydrophobicContact CD1-CG1 4.5Å; I68-I189 HydrophobicContact CG2-CD1 3.84Å; I68-I189 HydrophobicContact CG2-CG1 3.97Å
69	L	95.2	Very high	90.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-55.6	-54	176.7	173.5	62	0	0	0	111.2	A65 K71 R72 V73 F82 L97 Y101 V126 V152 V154	A65-L69 VanDerWaalsContact O-CB 3.24Å; A65-L69 WeakPolarHBondContact O-CB 3.24Å; A65-L69 PolarHBondContact O-N 3.44Å; L69-K71 PolarHBondContact O-N 3.32Å; L69-R72 PolarHBondContact O-N 3.03Å; L69-V73 HydrophobicContact CD1-CG2 4.19Å; L69-V73 VanDerWaalsContact O-CG2 3.27Å; L69-V73 WeakPolarHBondContact O-CG2 3.47Å; L69-V73 PolarHBondContact O-N 3.08Å; L69-V73 VanDerWaalsContact O-N 3.11Å; L69-F82 HydrophobicContact CD2-CB 4.26Å; L69-F82 HydrophobicContact CD2-CD2 3.62Å; L69-F82 HydrophobicContact CD2-CE2 4.49Å; L69-F82 HydrophobicContact CD2-CG 4.43Å; L69-L97 HydrophobicContact CD2-CD1 4.24Å; L69-Y101 HydrophobicContact CD2-CE2 4.39Å; L69-V126 HydrophobicContact CD1-CG2 4.37Å; L69-V126 HydrophobicContact CD2-CG1 3.91Å; L69-V126 HydrophobicContact CG-CG2 4.44Å; L69-V152 HydrophobicContact CD1-CG1 3.43Å; L69-V152 VanDerWaalsContact CD1-CG1 3.43Å; L69-V154 HydrophobicContact CB-CG2 4.21Å
70	L	92.6	Very high	91.1	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.4	-51.8	179.9	177.2	58.9	0	0	0	111.6	L15 V19 E66 I67 R72 V73 L74 Y101 V104 I106	L15-L70 HydrophobicContact CD2-CD2 4.06Å; V19-L70 HydrophobicContact CB-CD2 4.39Å; V19-L70 HydrophobicContact CG1-CD2 3.53Å; V19-L70 HydrophobicContact CG2-CD2 4.07Å; E66-L70 WeakPolarHBondContact O-CB 3.46Å; E66-L70 PolarHBondContact O-N 2.75Å; E66-L70 VanDerWaalsContact O-N 3.09Å; I67-L70 PolarHBondContact O-N 3.4Å; L70-R72 VanDerWaalsContact C-N 3.33Å; L70-R72 PolarHBondContact O-N 3.41Å; L70-V73 PolarHBondContact O-N 3.47Å; L70-L74 HydrophobicContact CD1-CD1 3.81Å; L70-L74 HydrophobicContact CD1-CG 4.1Å; L70-L74 HydrophobicContact CG-CD1 3.97Å; L70-L74 WeakPolarHBondContact O-CG 3.49Å; L70-L74 PolarHBondContact O-N 3.23Å; L70-Y101 HydrophobicContact CB-CE1 3.78Å; L70-Y101 HydrophobicContact CB-CE2 4.49Å; L70-Y101 HydrophobicContact CD1-CD1 3.81Å; L70-Y101 HydrophobicContact CD1-CD2 4.46Å; L70-Y101 HydrophobicContact CD1-CE1 3.85Å; L70-Y101 HydrophobicContact CD1-CE2 4.48Å; L70-Y101 HydrophobicContact CD1-CG 4.15Å; L70-Y101 HydrophobicContact CD2-CD1 4.12Å; L70-Y101 HydrophobicContact CD2-CE1 3.78Å; L70-Y101 HydrophobicContact CG-CD1 4.4Å; L70-Y101 HydrophobicContact CG-CE1 4.01Å; L70-V104 HydrophobicContact CD1-CG2 4.19Å; L70-I106 HydrophobicContact CD1-CD1 3.33Å
71	K	90.3	Very high	91.6	Very high	29 Å²	29	24.8 Å²	24.8	13%	0.126	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-44.2	-177.5	-173.8	176	-179.4	66.3	0	111.4	F13 L45 I67 I68 L69 V73 L74 E75	F13-K71 PolarHBondContact O-NZ 3.23Å; L45-K71 HydrophobicContact CD1-CD 3.78Å; L45-K71 HydrophobicContact CD2-CD 4.41Å; L45-K71 HydrophobicContact CG-CD 3.75Å; L45-K71 WeakPolarHBondContact O-CE 3.33Å; I67-K71 WeakPolarHBondContact O-CB 3.42Å; I67-K71 PolarHBondContact O-N 3.47Å; I68-K71 PolarHBondContact O-N 3.32Å; L69-K71 PolarHBondContact O-N 3.32Å; K71-V73 PolarHBondContact O-N 2.82Å; K71-L74 PolarHBondContact O-N 3.01Å; K71-E75 WeakPolarHBondContact CE-OE1 3.35Å; K71-E75 HydrophobicContact CG-CG 4.27Å; K71-E75 WeakPolarHBondContact CG-OE1 3.46Å; K71-E75 IonicContact NZ-OE1 2.62Å; K71-E75 PolarHBondContact NZ-OE1 2.96Å; K71-E75 WeakPolarHBondContact O-CB 3.43Å; K71-E75 VanDerWaalsContact O-CG 3.32Å; K71-E75 WeakPolarHBondContact O-CG 3.32Å; K71-E75 PolarHBondContact O-N 3.41Å
72	R	90.9	Very high	92	Very high	44 Å²	44	24 Å²	24	17%	0.166	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-43.1	-179.5	-171.1	72.5	-80.6	175	6.4	111.7	Q46 I68 L69 L70 E75 T76 V152	Q46-R72 PolarHBondContact O-NH1 3.49Å; I68-R72 WeakPolarHBondContact O-CB 3.1Å; I68-R72 PolarHBondContact O-N 3.37Å; L69-R72 PolarHBondContact O-N 3.03Å; L70-R72 VanDerWaalsContact C-N 3.33Å; L70-R72 PolarHBondContact O-N 3.41Å; R72-E75 IonicContact NH2-OE2 2.68Å; R72-E75 PolarHBondContact O-N 3.14Å; R72-T76 WeakPolarHBondContact O-CB 3.37Å; R72-T76 PolarHBondContact O-N 2.72Å; R72-T76 PolarHBondContact O-OG1 3.05Å; R72-V152 HydrophobicContact CB-CB 4.17Å; R72-V152 HydrophobicContact CB-CG1 4.01Å; R72-V152 HydrophobicContact CG-CB 3.98Å; R72-V152 HydrophobicContact CG-CG1 4.12Å
73	V	92.1	Very high	92.1	Very high	8 Å²	8	22.7 Å²	22.7	5%	0.048	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-48.3	178.1	171.9	0	0	0	0	110.4	L69 L70 K71 G77 K78 I106 D125 V126 V152	L69-V73 HydrophobicContact CD1-CG2 4.19Å; L69-V73 VanDerWaalsContact O-CG2 3.27Å; L69-V73 WeakPolarHBondContact O-CG2 3.47Å; L69-V73 PolarHBondContact O-N 3.08Å; L69-V73 VanDerWaalsContact O-N 3.11Å; L70-V73 PolarHBondContact O-N 3.47Å; K71-V73 PolarHBondContact O-N 2.82Å; V73-G77 VanDerWaalsContact O-CA 3.29Å; V73-G77 WeakPolarHBondContact O-CA 3.44Å; V73-G77 PolarHBondContact O-N 3.04Å; V73-K78 WeakPolarHBondContact CA-O 3.38Å; V73-I106 HydrophobicContact CB-CD1 4.37Å; V73-I106 HydrophobicContact CG1-CD1 3.82Å; V73-I106 HydrophobicContact CG1-CG1 4.14Å; V73-D125 HydrophobicContact CG1-CB 4.09Å; V73-V126 HydrophobicContact CG2-CG2 3.97Å; V73-V152 HydrophobicContact CG2-CG1 4.42Å
74	L	90.1	Very high	92.1	Very high	73 Å²	73	22 Å²	22	38%	0.382	12%	0.123	S	C	.	.	H	α-helix	trans	-63.2	-45.3	177.8	-69.2	173.9	0	0	0	112.7	L70 K71 I106	L70-L74 HydrophobicContact CD1-CD1 3.81Å; L70-L74 HydrophobicContact CD1-CG 4.1Å; L70-L74 HydrophobicContact CG-CD1 3.97Å; L70-L74 WeakPolarHBondContact O-CG 3.49Å; L70-L74 PolarHBondContact O-N 3.23Å; K71-L74 PolarHBondContact O-N 3.01Å; L74-I106 HydrophobicContact CD2-CD1 3.7Å; L74-I106 HydrophobicContact CD2-CG1 4.25Å; L74-I106 HydrophobicContact CG-CD1 3.91Å
75	E	89.1	Confident	91.5	Very high	98 Å²	98	22.3 Å²	22.3	46%	0.458	13%	0.125	S	C	.	.	H	α-helix	trans	-77.3	-25.2	-173.8	-72.3	177.8	175.6	0	0	114.2	K71 R72	K71-E75 WeakPolarHBondContact CE-OE1 3.35Å; K71-E75 HydrophobicContact CG-CG 4.27Å; K71-E75 WeakPolarHBondContact CG-OE1 3.46Å; K71-E75 IonicContact NZ-OE1 2.62Å; K71-E75 PolarHBondContact NZ-OE1 2.96Å; K71-E75 WeakPolarHBondContact O-CB 3.43Å; K71-E75 VanDerWaalsContact O-CG 3.32Å; K71-E75 WeakPolarHBondContact O-CG 3.32Å; K71-E75 PolarHBondContact O-N 3.41Å; R72-E75 IonicContact NH2-OE2 2.68Å; R72-E75 PolarHBondContact O-N 3.14Å
76	T	88.4	Confident	90.7	Very high	45 Å²	45	25.9 Å²	25.9	28%	0.276	14%	0.14	S	C	.	.	H	α-helix	trans	-103.9	-18.5	179.1	51.8	0	0	0	0	114.1	R72 K78	R72-T76 WeakPolarHBondContact O-CB 3.37Å; R72-T76 PolarHBondContact O-N 2.72Å; R72-T76 PolarHBondContact O-OG1 3.05Å; T76-K78 HydrophobicContact CG2-CD 4.35Å; T76-K78 PolarHBondContact O-N 2.83Å; T76-K78 VanDerWaalsContact O-N 3.17Å; T76-K78 VanDerWaalsContact OG1-CB 3.24Å; T76-K78 WeakPolarHBondContact OG1-CB 3.31Å; T76-K78 PolarHBondContact OG1-N 3.33Å; T76-K78 VanDerWaalsContact OG1-N 3.07Å
77	G	88.3	Confident	89.8	Confident	69 Å²	69	29.5 Å²	29.5	71%	0.711	16%	0.159	S	C	*	.			trans	60.9	12.9	-162.2	0	0	0	0	0	113.3	V73	V73-G77 VanDerWaalsContact O-CA 3.29Å; V73-G77 WeakPolarHBondContact O-CA 3.44Å; V73-G77 PolarHBondContact O-N 3.04Å
78	K	91	Very high	88.8	Confident	57 Å²	57	31.7 Å²	31.7	25%	0.248	18%	0.175	C	C	.	.			trans	-92.7	157.5	178.4	-66.7	174.2	-176.4	164.7	0	110.6	V73 T76 S149 N184	V73-K78 WeakPolarHBondContact CA-O 3.38Å; T76-K78 HydrophobicContact CG2-CD 4.35Å; T76-K78 PolarHBondContact O-N 2.83Å; T76-K78 VanDerWaalsContact O-N 3.17Å; T76-K78 VanDerWaalsContact OG1-CB 3.24Å; T76-K78 WeakPolarHBondContact OG1-CB 3.31Å; T76-K78 PolarHBondContact OG1-N 3.33Å; T76-K78 VanDerWaalsContact OG1-N 3.07Å; K78-S149 WeakPolarHBondContact CA-O 3.4Å; K78-S149 VanDerWaalsContact CB-O 3.26Å; K78-S149 WeakPolarHBondContact CB-O 3.35Å; K78-N184 PolarHBondContact NZ-OD1 3.36Å
79	R	92.1	Very high	88.1	Confident	29 Å²	29	32.6 Å²	32.6	11%	0.109	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	154.6	-176.6	-62.2	-178.7	-179.3	137.4	0.8	112.4	M121 H122 W124 D125 S149 L150 G151 V152	R79-M121 PolarHBondContact NE-O 2.85Å; R79-M121 VanDerWaalsContact NH1-CE 3.31Å; R79-M121 PolarHBondContact NH1-O 3Å; R79-M121 PolarHBondContact NH2-O 2.82Å; R79-H122 PolarHBondContact NH2-ND1 3Å; R79-W124 HydrophobicContact CB-CE3 4.39Å; R79-W124 HydrophobicContact CB-CH2 4.32Å; R79-W124 HydrophobicContact CB-CZ3 3.77Å; R79-W124 HydrophobicContact CG-CZ3 4.27Å; R79-W124 PolarHBondContact NE-O 3.48Å; R79-D125 CarbonylContact C-O 3.57Å; R79-D125 VanDerWaalsContact CA-O 3.22Å; R79-D125 WeakPolarHBondContact CA-O 3.42Å; R79-S149 PolarHBondContact N-O 2.81Å; R79-S149 PolarHBondContact NH1-OG 3.39Å; R79-L150 HydrophobicContact CB-CD1 4.32Å; R79-G151 PolarHBondContact O-N 3.08Å; R79-V152 PolarHBondContact O-N 3.39Å
80	G	94.2	Very high	87.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.4	176.5	0	0	0	0	0	113	D125 V126 A127 V152	G80-D125 PolarHBondContact N-O 3.05Å; G80-V126 WeakPolarHBondContact O-CA 3.43Å; G80-A127 PolarHBondContact O-N 3.04Å; G80-V152 WeakPolarHBondContact CA-O 3.4Å
81	L	94.3	Very high	87.2	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.7	175.8	-161.3	70.1	0	0	0	110	I83 A127 C129 A134 L137 I138 L150 V152 I153 V154	L81-I83 HydrophobicContact CD2-CD1 3.95Å; L81-I83 HydrophobicContact CD2-CG1 4.01Å; L81-I83 HydrophobicContact CG-CD1 4.38Å; L81-I83 HydrophobicContact CG-CG1 4.03Å; L81-A127 HydrophobicContact CD1-CB 3.84Å; L81-C129 WeakPolarHBondContact CD1-SG 3.39Å; L81-A134 HydrophobicContact CD2-CB 3.96Å; L81-L137 HydrophobicContact CD1-CD1 3.96Å; L81-I138 HydrophobicContact CD2-CD1 4.16Å; L81-I138 HydrophobicContact CD2-CG1 4.25Å; L81-L150 HydrophobicContact CB-CD1 4.24Å; L81-V152 PolarHBondContact N-O 3.17Å; L81-I153 HydrophobicContact CB-CG1 4.21Å; L81-I153 CarbonylContact O-C 3.53Å; L81-I153 WeakPolarHBondContact O-CA 3.47Å; L81-V154 PolarHBondContact O-N 2.91Å
82	F	96.3	Very high	86.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	113	173.6	-157.1	-52	0	0	0	109.7	T62 E66 L69 L84 L97 A127 V128 C129 V154 D156	T62-F82 HydrophobicContact CG2-CE2 4.34Å; T62-F82 HydrophobicContact CG2-CZ 3.67Å; E66-F82 HydrophobicContact CG-CE2 4.17Å; L69-F82 HydrophobicContact CD2-CB 4.26Å; L69-F82 HydrophobicContact CD2-CD2 3.62Å; L69-F82 HydrophobicContact CD2-CE2 4.49Å; L69-F82 HydrophobicContact CD2-CG 4.43Å; F82-L84 HydrophobicContact CD1-CD1 3.35Å; F82-L84 HydrophobicContact CD1-CD2 4.48Å; F82-L84 HydrophobicContact CD1-CG 3.86Å; F82-L84 HydrophobicContact CE1-CD1 3.8Å; F82-L84 HydrophobicContact CE1-CD2 4.09Å; F82-L84 HydrophobicContact CE1-CG 3.88Å; F82-L84 HydrophobicContact CG-CD1 4.29Å; F82-L97 HydrophobicContact CD2-CD1 3.92Å; F82-A127 PolarHBondContact N-O 2.76Å; F82-V128 HydrophobicContact CB-CG2 4.31Å; F82-V128 CarbonylContact O-C 3.31Å; F82-V128 WeakPolarHBondContact O-CA 3.3Å; F82-C129 PolarHBondContact O-N 3.33Å; F82-V154 HydrophobicContact CD1-CB 4.35Å; F82-V154 HydrophobicContact CD1-CG1 4.09Å; F82-V154 HydrophobicContact CD2-CB 4.1Å; F82-V154 HydrophobicContact CD2-CG1 4.07Å; F82-V154 HydrophobicContact CD2-CG2 4.38Å; F82-V154 HydrophobicContact CE1-CG1 3.82Å; F82-V154 HydrophobicContact CE2-CB 4.28Å; F82-V154 HydrophobicContact CE2-CG1 3.77Å; F82-V154 HydrophobicContact CG-CB 4.1Å; F82-V154 HydrophobicContact CG-CG1 4.21Å; F82-V154 HydrophobicContact CZ-CB 4.5Å; F82-V154 HydrophobicContact CZ-CG1 3.62Å; F82-D156 HydrophobicContact CE1-CB 4.26Å
83	I	92.5	Very high	86.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.4	-172.3	-56.8	151.4	0	0	0	109.9	L81 C129 I131 A134 I153 V154 V155 D156 L169	L81-I83 HydrophobicContact CD2-CD1 3.95Å; L81-I83 HydrophobicContact CD2-CG1 4.01Å; L81-I83 HydrophobicContact CG-CD1 4.38Å; L81-I83 HydrophobicContact CG-CG1 4.03Å; I83-C129 WeakPolarHBondContact CA-O 3.46Å; I83-I131 HydrophobicContact CG2-CB 4.28Å; I83-I131 HydrophobicContact CG2-CG1 3.55Å; I83-A134 HydrophobicContact CD1-CB 4.12Å; I83-A134 HydrophobicContact CG1-CB 3.73Å; I83-A134 HydrophobicContact CG2-CB 4.35Å; I83-I153 HydrophobicContact CD1-CG2 3.4Å; I83-I153 VanDerWaalsContact CD1-CG2 3.4Å; I83-V154 WeakPolarHBondContact CB-O 3.43Å; I83-V154 PolarHBondContact N-O 2.87Å; I83-V155 HydrophobicContact CD1-CG2 3.79Å; I83-D156 PolarHBondContact O-N 3.17Å; I83-L169 HydrophobicContact CD1-CD2 3.34Å; I83-L169 HydrophobicContact CG1-CD2 4.29Å
84	L	90.2	Very high	86.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.1	177.5	-63.1	108	0	0	0	110.8	F82 F86 V89 A90 K93 V128 C129 T130 D156	F82-L84 HydrophobicContact CD1-CD1 3.35Å; F82-L84 HydrophobicContact CD1-CD2 4.48Å; F82-L84 HydrophobicContact CD1-CG 3.86Å; F82-L84 HydrophobicContact CE1-CD1 3.8Å; F82-L84 HydrophobicContact CE1-CD2 4.09Å; F82-L84 HydrophobicContact CE1-CG 3.88Å; F82-L84 HydrophobicContact CG-CD1 4.29Å; L84-F86 PolarHBondContact O-N 3.38Å; L84-V89 HydrophobicContact CD2-CB 4.18Å; L84-V89 HydrophobicContact CD2-CG1 3.46Å; L84-V89 VanDerWaalsContact CD2-CG1 3.46Å; L84-A90 HydrophobicContact CB-CB 4.24Å; L84-A90 HydrophobicContact CD1-CB 4.33Å; L84-K93 HydrophobicContact CD1-CB 4.17Å; L84-K93 HydrophobicContact CD2-CB 4.26Å; L84-K93 HydrophobicContact CD2-CG 3.77Å; L84-V128 HydrophobicContact CD1-CG1 3.47Å; L84-V128 VanDerWaalsContact CD1-CG1 3.47Å; L84-C129 PolarHBondContact N-O 3.22Å; L84-T130 WeakPolarHBondContact O-CA 3.41Å; L84-D156 HydrophobicContact CD2-CB 4.43Å; L84-D156 HydrophobicContact CG-CB 4.4Å
85	P	80.3	Confident	86.6	Confident	8 Å²	8	44 Å²	44	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	-77.1	-18.6	-171.1	27.1	-35.1	0	0	0	115.8	E157 L160 R166	P85-E157 HydrophobicContact CG-CB 4.24Å; P85-E157 HydrophobicContact CG-CG 4.26Å; P85-L160 HydrophobicContact CB-CD1 3.26Å; P85-L160 HydrophobicContact CG-CD1 3.92Å; P85-R166 PolarHBondContact O-NH2 3.14Å
86	F	77.6	Confident	86.6	Confident	74 Å²	74	41.5 Å²	41.5	33%	0.325	22%	0.217	S	C	.	.	S	Bend	trans	-134.1	144.4	-173.8	-54.8	-71.7	0	0	0	111.2	L84 S88 V89 A90 S357	L84-F86 PolarHBondContact O-N 3.38Å; F86-S88 VanDerWaalsContact C-N 3.34Å; F86-S88 PolarHBondContact O-N 2.97Å; F86-V89 HydrophobicContact CB-CG2 4.07Å; F86-V89 HydrophobicContact CD2-CG2 4.32Å; F86-V89 PolarHBondContact O-N 2.98Å; F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.48Å; F86-S357 WeakPolarHBondContact CE2-OG 3.44Å; F86-S357 WeakPolarHBondContact CZ-OG 3.46Å
87	I	75.2	Confident	86.8	Confident	80 Å²	80	39.4 Å²	39.4	41%	0.41	20%	0.204	S	C	.	.	H	α-helix	trans	-56	-46.4	179.9	-64.3	173.7	0	0	0	111.3	V89 A90 R91 M112 T130	I87-V89 PolarHBondContact O-N 3.18Å; I87-A90 PolarHBondContact O-N 3.05Å; I87-R91 PolarHBondContact O-N 3.21Å; I87-M112 HydrophobicContact CB-CB 4.42Å; I87-M112 HydrophobicContact CG1-CB 4.25Å; I87-M112 HydrophobicContact CG2-CB 4.03Å; I87-M112 HydrophobicContact CG2-CG 3.84Å; I87-M112 HydrophobicContact CG2-SD 3.7Å; I87-M112 VanDerWaalsContact O-SD 3.4Å; I87-T130 HydrophobicContact CG1-CG2 3.77Å
88	S	70.1	Confident	86.9	Confident	46 Å²	46	39.8 Å²	39.8	32%	0.322	19%	0.187	S	C	.	.	H	α-helix	trans	-59.7	-46.7	-178.6	53.8	0	0	0	0	112.6	F86 A90 R91 E92	F86-S88 VanDerWaalsContact C-N 3.34Å; F86-S88 PolarHBondContact O-N 2.97Å; S88-A90 VanDerWaalsContact C-N 3.32Å; S88-A90 PolarHBondContact O-N 3.24Å; S88-R91 PolarHBondContact O-N 3.37Å; S88-E92 PolarHBondContact O-N 2.95Å
89	V	79.7	Confident	86.8	Confident	22 Å²	22	39.3 Å²	39.3	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-39.3	178.4	-164.3	0	0	0	0	110.5	L84 F86 I87 K93 G358	L84-V89 HydrophobicContact CD2-CB 4.18Å; L84-V89 HydrophobicContact CD2-CG1 3.46Å; L84-V89 VanDerWaalsContact CD2-CG1 3.46Å; F86-V89 HydrophobicContact CB-CG2 4.07Å; F86-V89 HydrophobicContact CD2-CG2 4.32Å; F86-V89 PolarHBondContact O-N 2.98Å; I87-V89 PolarHBondContact O-N 3.18Å; V89-K93 HydrophobicContact CG1-CG 4.5Å; V89-K93 VanDerWaalsContact O-CB 3.26Å; V89-K93 WeakPolarHBondContact O-CB 3.43Å; V89-K93 WeakPolarHBondContact O-CG 3.17Å; V89-K93 PolarHBondContact O-N 2.87Å; V89-G358 VanDerWaalsContact CG2-O 3.26Å; V89-G358 WeakPolarHBondContact CG2-O 3.3Å
90	A	85.9	Confident	86.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-39.1	175.8	0	0	0	0	0	112.1	L84 F86 I87 S88 K93 M94 M112 V128	L84-A90 HydrophobicContact CB-CB 4.24Å; L84-A90 HydrophobicContact CD1-CB 4.33Å; F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.48Å; I87-A90 PolarHBondContact O-N 3.05Å; S88-A90 VanDerWaalsContact C-N 3.32Å; S88-A90 PolarHBondContact O-N 3.24Å; A90-K93 PolarHBondContact O-N 3.16Å; A90-M94 VanDerWaalsContact O-CB 3.31Å; A90-M94 WeakPolarHBondContact O-CB 3.45Å; A90-M94 PolarHBondContact O-N 2.82Å; A90-M112 HydrophobicContact CB-CE 3.69Å; A90-M112 HydrophobicContact CB-SD 4.49Å; A90-V128 HydrophobicContact CB-CG1 4.21Å; A90-V128 WeakPolarHBondContact O-CG1 3.25Å
91	R	82.9	Confident	86.4	Confident	125 Å²	125	38 Å²	38	47%	0.472	19%	0.186	S	C	.	.	H	α-helix	trans	-65.1	-50	176	-160.5	179.7	-174.3	-175.8	5.2	112	I87 S88 K93 M94 L95 M112 D686	I87-R91 PolarHBondContact O-N 3.21Å; S88-R91 PolarHBondContact O-N 3.37Å; R91-K93 VanDerWaalsContact C-N 3.26Å; R91-K93 PolarHBondContact O-N 3.49Å; R91-M94 PolarHBondContact O-N 3.2Å; R91-L95 WeakPolarHBondContact O-CG 3.45Å; R91-L95 PolarHBondContact O-N 3.38Å; R91-L95 VanDerWaalsContact O-N 3.1Å; R91-M112 VanDerWaalsContact CA-CE 3.47Å; R91-M112 HydrophobicContact CB-CE 3.98Å; R91-M112 HydrophobicContact CB-SD 3.58Å; R91-M112 VanDerWaalsContact CB-SD 3.58Å; R91-M112 HydrophobicContact CG-SD 4.08Å; R91-D686 IonicContact NH2-OD1 2.75Å
92	E	81.6	Confident	85.9	Confident	105 Å²	105	46 Å²	46	49%	0.491	22%	0.216	S	C	.	.	H	α-helix	trans	-56.2	-45.7	176.2	-174.3	-176.2	153.1	0	0	110.4	S88 L95 Y96	S88-E92 PolarHBondContact O-N 2.95Å; E92-L95 PolarHBondContact O-N 3.23Å; E92-Y96 WeakPolarHBondContact O-CB 3.24Å; E92-Y96 PolarHBondContact O-N 2.8Å
93	K	89.2	Confident	85.2	Confident	30 Å²	30	50.3 Å²	50.3	13%	0.13	24%	0.24	C	C	.	.	H	α-helix	trans	-70.2	-36.2	-179.6	-77.4	-75.5	164.6	-168.4	0	113.9	T62 E66 L84 V89 A90 R91 Y96 L97 V128	T62-K93 HydrophobicContact CG2-CD 4.3Å; E66-K93 IonicContact OE1-NZ 3.3Å; E66-K93 PolarHBondContact OE1-NZ 2.97Å; L84-K93 HydrophobicContact CD1-CB 4.17Å; L84-K93 HydrophobicContact CD2-CB 4.26Å; L84-K93 HydrophobicContact CD2-CG 3.77Å; V89-K93 HydrophobicContact CG1-CG 4.5Å; V89-K93 VanDerWaalsContact O-CB 3.26Å; V89-K93 WeakPolarHBondContact O-CB 3.43Å; V89-K93 WeakPolarHBondContact O-CG 3.17Å; V89-K93 PolarHBondContact O-N 2.87Å; A90-K93 PolarHBondContact O-N 3.16Å; R91-K93 VanDerWaalsContact C-N 3.26Å; R91-K93 PolarHBondContact O-N 3.49Å; K93-Y96 HydrophobicContact CD-CD1 4.42Å; K93-Y96 PolarHBondContact O-N 2.92Å; K93-L97 WeakPolarHBondContact O-CB 3.45Å; K93-L97 WeakPolarHBondContact O-CG 2.83Å; K93-L97 PolarHBondContact O-N 3.3Å; K93-V128 HydrophobicContact CB-CG1 4.2Å
94	M	91.9	Very high	84.8	Confident	32 Å²	32	51.3 Å²	51.3	16%	0.158	25%	0.246	C	C	.	.	H	α-helix	trans	-58.1	-51.2	172.5	178.6	-159	72.8	0	0	110.8	A90 R91 Y96 L97 H98 V108 G110 V128	A90-M94 VanDerWaalsContact O-CB 3.31Å; A90-M94 WeakPolarHBondContact O-CB 3.45Å; A90-M94 PolarHBondContact O-N 2.82Å; R91-M94 PolarHBondContact O-N 3.2Å; M94-Y96 VanDerWaalsContact C-N 3.34Å; M94-Y96 PolarHBondContact O-N 3.15Å; M94-L97 PolarHBondContact O-N 2.99Å; M94-H98 VanDerWaalsContact O-CB 3.23Å; M94-H98 WeakPolarHBondContact O-CB 3.37Å; M94-H98 PolarHBondContact O-N 2.94Å; M94-V108 HydrophobicContact CG-CG1 4.38Å; M94-G110 WeakPolarHBondContact SD-CA 3.49Å; M94-G110 PolarHBondContact SD-N 3.4Å; M94-V128 HydrophobicContact CB-CB 4.09Å; M94-V128 HydrophobicContact CB-CG1 4.37Å; M94-V128 HydrophobicContact CB-CG2 4.28Å
95	L	88	Confident	84.5	Confident	102 Å²	102	54 Å²	54	53%	0.534	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-41.5	-179	-67.4	172.7	0	0	0	111.8	R91 E92 H98 S99	R91-L95 WeakPolarHBondContact O-CG 3.45Å; R91-L95 PolarHBondContact O-N 3.38Å; R91-L95 VanDerWaalsContact O-N 3.1Å; E92-L95 PolarHBondContact O-N 3.23Å; L95-H98 PolarHBondContact O-N 3.38Å; L95-S99 PolarHBondContact O-N 2.95Å
96	Y	89.5	Confident	84.8	Confident	45 Å²	45	54.2 Å²	54.2	18%	0.176	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-45.7	177.1	172.4	-94.4	0	0	0	112.8	H26 E66 E92 K93 M94 H98 S99 I100	H26-Y96 AromaticContact CD2-CD2 3.96Å; H26-Y96 AromaticContact CD2-CE2 3.74Å; E66-Y96 WeakPolarHBondContact OE1-CE1 3.37Å; E66-Y96 WeakPolarHBondContact OE2-CE1 3.26Å; E66-Y96 PolarHBondContact OE2-OH 3.42Å; E92-Y96 WeakPolarHBondContact O-CB 3.24Å; E92-Y96 PolarHBondContact O-N 2.8Å; K93-Y96 HydrophobicContact CD-CD1 4.42Å; K93-Y96 PolarHBondContact O-N 2.92Å; M94-Y96 VanDerWaalsContact C-N 3.34Å; M94-Y96 PolarHBondContact O-N 3.15Å; Y96-H98 VanDerWaalsContact C-N 3.32Å; Y96-H98 PolarHBondContact O-N 2.96Å; Y96-S99 PolarHBondContact O-N 3.25Å; Y96-S99 PolarHBondContact O-OG 3.36Å; Y96-I100 HydrophobicContact CD1-CD1 4.04Å; Y96-I100 HydrophobicContact CD2-CD1 4.16Å; Y96-I100 HydrophobicContact CE1-CD1 3.42Å; Y96-I100 VanDerWaalsContact CE1-CD1 3.42Å; Y96-I100 HydrophobicContact CE2-CD1 3.58Å; Y96-I100 HydrophobicContact CG-CD1 4.38Å; Y96-I100 WeakPolarHBondContact O-CG1 3.3Å; Y96-I100 PolarHBondContact O-N 3.16Å; Y96-I100 WeakPolarHBondContact OH-CD1 3.49Å
97	L	92.6	Very high	85.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.3	-37.5	176.7	-72.2	-175.9	0	0	0	111.3	E66 L69 F82 K93 M94 S99 I100 Y101 V108 V128	E66-L97 HydrophobicContact CB-CD2 4.47Å; E66-L97 HydrophobicContact CG-CD2 4.01Å; L69-L97 HydrophobicContact CD2-CD1 4.24Å; F82-L97 HydrophobicContact CD2-CD1 3.92Å; K93-L97 WeakPolarHBondContact O-CB 3.45Å; K93-L97 WeakPolarHBondContact O-CG 2.83Å; K93-L97 PolarHBondContact O-N 3.3Å; M94-L97 PolarHBondContact O-N 2.99Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-S99 PolarHBondContact O-N 2.99Å; L97-I100 PolarHBondContact O-N 3.06Å; L97-Y101 HydrophobicContact CB-CD2 4.4Å; L97-Y101 HydrophobicContact CB-CE2 4.34Å; L97-Y101 HydrophobicContact CD1-CE2 4.47Å; L97-Y101 HydrophobicContact CD2-CE1 4.24Å; L97-Y101 HydrophobicContact CD2-CE2 3.98Å; L97-Y101 VanDerWaalsContact O-CB 3.26Å; L97-Y101 WeakPolarHBondContact O-CB 3.42Å; L97-Y101 PolarHBondContact O-N 2.83Å; L97-V108 HydrophobicContact CB-CG1 4.02Å; L97-V108 HydrophobicContact CB-CG2 4.26Å; L97-V128 HydrophobicContact CD1-CG2 3.93Å
98	H	90.2	Very high	86.1	Confident	78 Å²	78	52.5 Å²	52.5	36%	0.361	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-44	174.4	-174	84.5	0	0	0	111.4	M94 L95 Y96 I100 R102 V108	M94-H98 VanDerWaalsContact O-CB 3.23Å; M94-H98 WeakPolarHBondContact O-CB 3.37Å; M94-H98 PolarHBondContact O-N 2.94Å; L95-H98 PolarHBondContact O-N 3.38Å; Y96-H98 VanDerWaalsContact C-N 3.32Å; Y96-H98 PolarHBondContact O-N 2.96Å; H98-I100 VanDerWaalsContact C-N 3.3Å; H98-I100 PolarHBondContact O-N 2.58Å; H98-R102 WeakPolarHBondContact O-CB 3.1Å; H98-R102 PolarHBondContact O-N 2.99Å; H98-R102 VanDerWaalsContact O-N 3.08Å; H98-V108 HydrophobicContact CB-CB 4.12Å
99	S	87.9	Confident	86.9	Confident	47 Å²	47	51.9 Å²	51.9	33%	0.329	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-34.6	179.3	67.8	0	0	0	0	113	H26 L95 Y96 L97	H26-S99 PolarHBondContact CE1-OG 2.7Å; H26-S99 PolarHBondContact NE2-OG 3.27Å; L95-S99 PolarHBondContact O-N 2.95Å; Y96-S99 PolarHBondContact O-N 3.25Å; Y96-S99 PolarHBondContact O-OG 3.36Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-S99 PolarHBondContact O-N 2.99Å
100	I	87.5	Confident	87.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-81.8	-41.9	-178.5	-62.7	174	0	0	0	111.7	V19 C22 Y23 Y96 L97 H98	V19-I100 HydrophobicContact CG1-CG2 4.09Å; C22-I100 HydrophobicContact CB-CG2 4.31Å; Y23-I100 HydrophobicContact CD1-CD1 3.94Å; Y23-I100 HydrophobicContact CD1-CG2 4.49Å; Y23-I100 HydrophobicContact CD2-CG2 4.44Å; Y23-I100 HydrophobicContact CE1-CD1 3.65Å; Y23-I100 HydrophobicContact CE1-CG2 4.15Å; Y23-I100 HydrophobicContact CE2-CG2 4.08Å; Y96-I100 HydrophobicContact CD1-CD1 4.04Å; Y96-I100 HydrophobicContact CD2-CD1 4.16Å; Y96-I100 HydrophobicContact CE1-CD1 3.42Å; Y96-I100 VanDerWaalsContact CE1-CD1 3.42Å; Y96-I100 HydrophobicContact CE2-CD1 3.58Å; Y96-I100 HydrophobicContact CG-CD1 4.38Å; Y96-I100 WeakPolarHBondContact O-CG1 3.3Å; Y96-I100 PolarHBondContact O-N 3.16Å; Y96-I100 WeakPolarHBondContact OH-CD1 3.49Å; L97-I100 PolarHBondContact O-N 3.06Å; H98-I100 VanDerWaalsContact C-N 3.3Å; H98-I100 PolarHBondContact O-N 2.58Å
101	Y	90.5	Very high	87.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-87.7	-12.8	-172.1	-65.1	-5.1	0	0	0	113.7	E66 L69 L70 L97 N103 V104 I106 V108 V126	E66-Y101 PolarHBondContact O-OH 2.71Å; L69-Y101 HydrophobicContact CD2-CE2 4.39Å; L70-Y101 HydrophobicContact CB-CE1 3.78Å; L70-Y101 HydrophobicContact CB-CE2 4.49Å; L70-Y101 HydrophobicContact CD1-CD1 3.81Å; L70-Y101 HydrophobicContact CD1-CD2 4.46Å; L70-Y101 HydrophobicContact CD1-CE1 3.85Å; L70-Y101 HydrophobicContact CD1-CE2 4.48Å; L70-Y101 HydrophobicContact CD1-CG 4.15Å; L70-Y101 HydrophobicContact CD2-CD1 4.12Å; L70-Y101 HydrophobicContact CD2-CE1 3.78Å; L70-Y101 HydrophobicContact CG-CD1 4.4Å; L70-Y101 HydrophobicContact CG-CE1 4.01Å; L97-Y101 HydrophobicContact CB-CD2 4.4Å; L97-Y101 HydrophobicContact CB-CE2 4.34Å; L97-Y101 HydrophobicContact CD1-CE2 4.47Å; L97-Y101 HydrophobicContact CD2-CE1 4.24Å; L97-Y101 HydrophobicContact CD2-CE2 3.98Å; L97-Y101 VanDerWaalsContact O-CB 3.26Å; L97-Y101 WeakPolarHBondContact O-CB 3.42Å; L97-Y101 PolarHBondContact O-N 2.83Å; Y101-N103 VanDerWaalsContact C-N 3.28Å; Y101-N103 PolarHBondContact O-N 3.14Å; Y101-V104 WeakPolarHBondContact O-CG2 3.31Å; Y101-V104 PolarHBondContact O-N 3.17Å; Y101-I106 HydrophobicContact CD2-CG2 3.79Å; Y101-I106 HydrophobicContact CG-CG2 4.23Å; Y101-I106 PolarHBondContact O-N 2.74Å; Y101-V108 HydrophobicContact CD2-CG2 3.76Å; Y101-V108 HydrophobicContact CG-CG2 4.36Å; Y101-V126 HydrophobicContact CD2-CG2 4.39Å; Y101-V126 HydrophobicContact CE2-CG2 4.32Å
102	R	84.4	Confident	86.8	Confident	170 Å²	170	45.6 Å²	45.6	64%	0.642	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-56	-38.9	-177.6	174.8	175.7	-178.3	-178.1	0.8	113.6	H98 V104 G105	H98-R102 WeakPolarHBondContact O-CB 3.1Å; H98-R102 PolarHBondContact O-N 2.99Å; H98-R102 VanDerWaalsContact O-N 3.08Å; R102-V104 VanDerWaalsContact C-N 3.28Å; R102-V104 PolarHBondContact O-N 3.29Å; R102-G105 PolarHBondContact O-N 2.92Å
103	N	81.6	Confident	86.1	Confident	92 Å²	92	41.3 Å²	41.3	49%	0.492	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-73.5	-21.1	-174.8	-67.3	-12	0	0	0	113.1	D18 C22 Y101 G105	D18-N103 HydrophobicContact CB-CB 4.11Å; C22-N103 PolarHBondContact SG-ND2 3.19Å; Y101-N103 VanDerWaalsContact C-N 3.28Å; Y101-N103 PolarHBondContact O-N 3.14Å; N103-G105 VanDerWaalsContact C-N 3.35Å
104	V	84.1	Confident	84.7	Confident	22 Å²	22	42.7 Å²	42.7	13%	0.133	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-96.1	13.8	176.2	-61.7	0	0	0	0	113.2	E16 V19 L70 Y101 R102 I106	E16-V104 HydrophobicContact CB-CG1 4.32Å; E16-V104 VanDerWaalsContact OE2-CG1 3.25Å; E16-V104 WeakPolarHBondContact OE2-CG1 3.4Å; V19-V104 HydrophobicContact CG2-CB 4.38Å; V19-V104 HydrophobicContact CG2-CG1 3.25Å; V19-V104 HydrophobicContact CG2-CG2 4.2Å; L70-V104 HydrophobicContact CD1-CG2 4.19Å; Y101-V104 WeakPolarHBondContact O-CG2 3.31Å; Y101-V104 PolarHBondContact O-N 3.17Å; R102-V104 VanDerWaalsContact C-N 3.28Å; R102-V104 PolarHBondContact O-N 3.29Å; V104-I106 VanDerWaalsContact C-N 3.27Å; V104-I106 HydrophobicContact CG2-CB 4.35Å; V104-I106 HydrophobicContact CG2-CD1 3.99Å; V104-I106 HydrophobicContact CG2-CG1 4.19Å; V104-I106 PolarHBondContact O-N 3.03Å
105	G	82.8	Confident	83.2	Confident	57 Å²	57	45 Å²	45	59%	0.588	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	5.9	175.5	0	0	0	0	0	115.6	R102 N103	R102-G105 PolarHBondContact O-N 2.92Å; N103-G105 VanDerWaalsContact C-N 3.35Å
106	I	88.7	Confident	82.1	Confident	11 Å²	11	44.6 Å²	44.6	6%	0.056	24%	0.239	C	C	.	.			trans	-79.4	126.1	179.4	-75.7	172.5	0	0	0	110.7	L70 V73 L74 Y101 V104 V108 D125 V126	L70-I106 HydrophobicContact CD1-CD1 3.33Å; V73-I106 HydrophobicContact CB-CD1 4.37Å; V73-I106 HydrophobicContact CG1-CD1 3.82Å; V73-I106 HydrophobicContact CG1-CG1 4.14Å; L74-I106 HydrophobicContact CD2-CD1 3.7Å; L74-I106 HydrophobicContact CD2-CG1 4.25Å; L74-I106 HydrophobicContact CG-CD1 3.91Å; Y101-I106 HydrophobicContact CD2-CG2 3.79Å; Y101-I106 HydrophobicContact CG-CG2 4.23Å; Y101-I106 PolarHBondContact O-N 2.74Å; V104-I106 VanDerWaalsContact C-N 3.27Å; V104-I106 HydrophobicContact CG2-CB 4.35Å; V104-I106 HydrophobicContact CG2-CD1 3.99Å; V104-I106 HydrophobicContact CG2-CG1 4.19Å; V104-I106 PolarHBondContact O-N 3.03Å; I106-V108 HydrophobicContact CG2-CG2 4.2Å; I106-D125 HydrophobicContact CG2-CB 4.04Å; I106-V126 HydrophobicContact CG2-CB 4.49Å; I106-V126 HydrophobicContact CG2-CG2 3.88Å
107	Q	87.9	Confident	80.7	Confident	107 Å²	107	44.2 Å²	44.2	50%	0.5	24%	0.241	S	C	.	.			trans	-88.6	112.6	177.7	-62.5	-171	-1.3	0	0	111	S123 D125 V126	Q107-S123 PolarHBondContact OE1-O 3.19Å; Q107-D125 PolarHBondContact N-OD2 3.21Å; Q107-D125 PolarHBondContact O-N 2.99Å; Q107-V126 PolarHBondContact O-N 3.16Å
108	V	91.5	Very high	78.7	Confident	12 Å²	12	46 Å²	46	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.2	175.9	-174.1	0	0	0	0	110.3	M94 L97 H98 Y101 I106 V126 V128	M94-V108 HydrophobicContact CG-CG1 4.38Å; L97-V108 HydrophobicContact CB-CG1 4.02Å; L97-V108 HydrophobicContact CB-CG2 4.26Å; H98-V108 HydrophobicContact CB-CB 4.12Å; Y101-V108 HydrophobicContact CD2-CG2 3.76Å; Y101-V108 HydrophobicContact CG-CG2 4.36Å; I106-V108 HydrophobicContact CG2-CG2 4.2Å; V108-V126 CarbonylContact C-O 3.55Å; V108-V126 WeakPolarHBondContact CA-O 3.5Å; V108-V126 HydrophobicContact CG1-CG1 4.34Å; V108-V126 HydrophobicContact CG2-CB 4.21Å; V108-V128 HydrophobicContact CG1-CG2 3.95Å
109	Q	87.4	Confident	77	Confident	33 Å²	33	44.6 Å²	44.6	15%	0.154	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.5	176.8	-73.6	-165.7	-13.1	0	0	111.9	Y111 P117 S123 W124 V126 A127 V128	Q109-Y111 HydrophobicContact CB-CE2 4.17Å; Q109-Y111 PolarHBondContact OE1-OH 3.41Å; Q109-P117 HydrophobicContact CB-CB 4.44Å; Q109-P117 HydrophobicContact CB-CG 3.83Å; Q109-P117 HydrophobicContact CG-CB 4.36Å; Q109-P117 HydrophobicContact CG-CG 4.28Å; Q109-S123 PolarHBondContact NE2-O 3.24Å; Q109-S123 VanDerWaalsContact NE2-O 3.09Å; Q109-S123 PolarHBondContact NE2-OG 3.47Å; Q109-S123 VanDerWaalsContact NE2-OG 3.16Å; Q109-S123 PolarHBondContact OE1-OG 3.35Å; Q109-S123 VanDerWaalsContact OE1-OG 3.08Å; Q109-W124 HydrophobicContact CB-CB 3.83Å; Q109-W124 HydrophobicContact CB-CG 4.35Å; Q109-W124 HydrophobicContact CG-CB 3.75Å; Q109-W124 VanDerWaalsContact OE1-CD1 3.31Å; Q109-V126 PolarHBondContact N-O 2.9Å; Q109-A127 CarbonylContact O-C 3.56Å; Q109-A127 WeakPolarHBondContact O-CA 3.29Å; Q109-V128 PolarHBondContact O-N 3.45Å
110	G	87.3	Confident	75.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130	-179.1	0	0	0	0	0	113.2	M94 P117 V128	M94-G110 WeakPolarHBondContact SD-CA 3.49Å; M94-G110 PolarHBondContact SD-N 3.4Å; G110-P117 WeakPolarHBondContact O-CD 3.4Å; G110-P117 WeakPolarHBondContact O-CG 3.4Å; G110-V128 CarbonylContact C-O 3.59Å; G110-V128 VanDerWaalsContact CA-O 3.29Å; G110-V128 WeakPolarHBondContact CA-O 3.35Å
111	Y	84.2	Confident	74.7	Confident	7 Å²	7	44.9 Å²	44.9	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	97.7	176.8	-69.5	-97.6	0	0	0	110	Q109 P117 W124 A127 V128 C129 T130 K133 L137	Q109-Y111 HydrophobicContact CB-CE2 4.17Å; Q109-Y111 PolarHBondContact OE1-OH 3.41Å; Y111-P117 HydrophobicContact CD2-CG 4.33Å; Y111-P117 HydrophobicContact CE1-CG 4.19Å; Y111-P117 HydrophobicContact CE2-CG 3.94Å; Y111-W124 HydrophobicContact CE2-CG 4.46Å; Y111-W124 AromaticContact CE2-NE1 3.89Å; Y111-W124 AromaticContact CZ-NE1 3.74Å; Y111-W124 PolarHBondContact OH-NE1 3.45Å; Y111-A127 HydrophobicContact CD2-CB 3.81Å; Y111-A127 HydrophobicContact CE2-CB 3.85Å; Y111-V128 PolarHBondContact N-O 2.99Å; Y111-C129 VanDerWaalsContact O-CA 3.24Å; Y111-C129 WeakPolarHBondContact O-CA 3.26Å; Y111-T130 PolarHBondContact O-N 2.9Å; Y111-T130 VanDerWaalsContact O-N 3.09Å; Y111-K133 WeakPolarHBondContact O-CB 3Å; Y111-K133 WeakPolarHBondContact O-CG 3.33Å; Y111-L137 HydrophobicContact CD1-CD1 4.13Å; Y111-L137 HydrophobicContact CD1-CD2 4.13Å; Y111-L137 HydrophobicContact CD1-CG 4.39Å; Y111-L137 HydrophobicContact CD2-CD1 3.9Å; Y111-L137 HydrophobicContact CE1-CD2 3.87Å; Y111-L137 HydrophobicContact CE2-CD1 4.31Å; Y111-L137 HydrophobicContact CG-CD1 3.8Å
112	M	74.8	Confident	73.7	Confident	7 Å²	7	50.9 Å²	50.9	3%	0.034	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-150.3	138.6	-172.7	66.6	-173.7	67.9	0	0	111.7	I87 A90 R91 T114 L115 T130	I87-M112 HydrophobicContact CB-CB 4.42Å; I87-M112 HydrophobicContact CG1-CB 4.25Å; I87-M112 HydrophobicContact CG2-CB 4.03Å; I87-M112 HydrophobicContact CG2-CG 3.84Å; I87-M112 HydrophobicContact CG2-SD 3.7Å; I87-M112 VanDerWaalsContact O-SD 3.4Å; A90-M112 HydrophobicContact CB-CE 3.69Å; A90-M112 HydrophobicContact CB-SD 4.49Å; R91-M112 VanDerWaalsContact CA-CE 3.47Å; R91-M112 HydrophobicContact CB-CE 3.98Å; R91-M112 HydrophobicContact CB-SD 3.58Å; R91-M112 VanDerWaalsContact CB-SD 3.58Å; R91-M112 HydrophobicContact CG-SD 4.08Å; M112-T114 PolarHBondContact O-N 3.39Å; M112-T114 VanDerWaalsContact O-N 3.15Å; M112-L115 HydrophobicContact CG-CB 4.06Å; M112-L115 HydrophobicContact CG-CD2 4.06Å; M112-L115 PolarHBondContact N-O 3.48Å; M112-L115 WeakPolarHBondContact O-CA 3.37Å; M112-L115 WeakPolarHBondContact O-CB 3.23Å; M112-L115 PolarHBondContact O-N 3.41Å; M112-L115 HydrophobicContact SD-CD2 4.46Å; M112-T130 HydrophobicContact CB-CG2 4.01Å
113	G	67	Low	73.2	Confident	14 Å²	14	43.6 Å²	43.6	14%	0.144	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	-121.8	-179.8	0	0	0	0	0	112.1	K133	G113-K133 WeakPolarHBondContact O-CE 3.32Å; G113-K133 PolarHBondContact O-NZ 3.3Å
114	T	58.2	Low	73.4	Confident	60 Å²	60	39.3 Å²	39.3	37%	0.368	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-13.3	174.2	51.2	0	0	0	0	114	M112 N116 S642 A672	M112-T114 PolarHBondContact O-N 3.39Å; M112-T114 VanDerWaalsContact O-N 3.15Å; T114-N116 PolarHBondContact O-N 3.02Å; T114-N116 VanDerWaalsContact O-N 3.11Å; T114-S642 WeakPolarHBondContact CG2-OG 3.42Å; T114-A672 HydrophobicContact CG2-CB 3.91Å
115	L	62.1	Low	73.8	Confident	81 Å²	81	40.9 Å²	40.9	42%	0.424	26%	0.258	S	S	.	.	B	Isolated β-bridge	trans	-68.1	109.7	179.7	-169	75.2	0	0	0	110.2	M112	M112-L115 HydrophobicContact CG-CB 4.06Å; M112-L115 HydrophobicContact CG-CD2 4.06Å; M112-L115 PolarHBondContact N-O 3.48Å; M112-L115 WeakPolarHBondContact O-CA 3.37Å; M112-L115 WeakPolarHBondContact O-CB 3.23Å; M112-L115 PolarHBondContact O-N 3.41Å; M112-L115 HydrophobicContact SD-CD2 4.46Å
116	N	63.6	Low	74.3	Confident	93 Å²	93	38.2 Å²	38.2	50%	0.497	23%	0.23	S	C	.	.			trans	-123.5	104	165.9	-62.9	-49.4	0	0	0	107.2	T114 K133	T114-N116 PolarHBondContact O-N 3.02Å; T114-N116 VanDerWaalsContact O-N 3.11Å; N116-K133 PolarHBondContact ND2-NZ 3.02Å; N116-K133 PolarHBondContact OD1-NZ 3.5Å
117	P	60.4	Low	74.6	Confident	36 Å²	36	37.7 Å²	37.7	23%	0.234	23%	0.227	C	C	.	.			trans	-60.9	142.2	178	16.7	-23.9	0	0	0	110.6	Q109 G110 Y111	Q109-P117 HydrophobicContact CB-CB 4.44Å; Q109-P117 HydrophobicContact CB-CG 3.83Å; Q109-P117 HydrophobicContact CG-CB 4.36Å; Q109-P117 HydrophobicContact CG-CG 4.28Å; G110-P117 WeakPolarHBondContact O-CD 3.4Å; G110-P117 WeakPolarHBondContact O-CG 3.4Å; Y111-P117 HydrophobicContact CD2-CG 4.33Å; Y111-P117 HydrophobicContact CE1-CG 4.19Å; Y111-P117 HydrophobicContact CE2-CG 3.94Å
118	A	50.9	Low	74.9	Confident	39 Å²	39	32.6 Å²	32.6	32%	0.322	20%	0.204	S	C	.	.	S	Bend	trans	-75.6	161.1	178	0	0	0	0	0	111.6	S123 D750	A118-S123 PolarHBondContact O-OG 3.43Å; A118-D750 HydrophobicContact CB-CB 3.71Å; A118-D750 WeakPolarHBondContact CB-OD2 3.4Å
119	G	53.8	Low	74.8	Confident	48 Å²	48	32 Å²	32	50%	0.495	20%	0.2	S	C	.	.	S	Bend	trans	109.4	-6.6	-177.7	0	0	0	0	0	114.7
120	G	63.3	Low	74.7	Confident	42 Å²	42	30.8 Å²	30.8	43%	0.433	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	69.4	-154.3	176.7	0	0	0	0	0	112.2	H122 S123	G120-H122 VanDerWaalsContact C-N 3.31Å; G120-H122 PolarHBondContact O-N 2.89Å; G120-S123 PolarHBondContact O-OG 3.05Å
121	M	64.6	Low	74.4	Confident	10 Å²	10	31.2 Å²	31.2	5%	0.049	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-75.5	-19.8	-173.2	-151.5	169	69	0	0	113.6	R79 W124 L141 E144 S146	R79-M121 PolarHBondContact NE-O 2.85Å; R79-M121 VanDerWaalsContact NH1-CE 3.31Å; R79-M121 PolarHBondContact NH1-O 3Å; R79-M121 PolarHBondContact NH2-O 2.82Å; M121-W124 HydrophobicContact CG-CZ2 4.18Å; M121-L141 HydrophobicContact CE-CD2 3.62Å; M121-L141 HydrophobicContact CG-CD2 4.36Å; M121-L141 HydrophobicContact SD-CD2 3.23Å; M121-L141 WeakPolarHBondContact SD-CD2 3.4Å; M121-L141 HydrophobicContact SD-CG 3.71Å; M121-E144 VanDerWaalsContact CE-OE2 3.3Å; M121-E144 WeakPolarHBondContact CE-OE2 3.23Å; M121-S146 WeakPolarHBondContact CE-OG 3.39Å
122	H	69.3	Low	74	Confident	126 Å²	126	34.6 Å²	34.6	58%	0.583	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-89	-1.7	-177	-63.6	-86.8	0	0	0	114.7	R79 G120	R79-H122 PolarHBondContact NH2-ND1 3Å; G120-H122 VanDerWaalsContact C-N 3.31Å; G120-H122 PolarHBondContact O-N 2.89Å
123	S	73.9	Confident	74.3	Confident	18 Å²	18	36 Å²	36	13%	0.126	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-91.3	6.5	-177.6	61.7	0	0	0	0	114.7	Q107 Q109 A118 G120	Q107-S123 PolarHBondContact OE1-O 3.19Å; Q109-S123 PolarHBondContact NE2-O 3.24Å; Q109-S123 VanDerWaalsContact NE2-O 3.09Å; Q109-S123 PolarHBondContact NE2-OG 3.47Å; Q109-S123 VanDerWaalsContact NE2-OG 3.16Å; Q109-S123 PolarHBondContact OE1-OG 3.35Å; Q109-S123 VanDerWaalsContact OE1-OG 3.08Å; A118-S123 PolarHBondContact O-OG 3.43Å; G120-S123 PolarHBondContact O-OG 3.05Å
124	W	86	Confident	75.1	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.008	21%	0.212	C	C	.	.			trans	-148.4	144.6	-178	58.1	-88.7	0	0	0	112	R79 Q109 Y111 M121 A127 L137	R79-W124 HydrophobicContact CB-CE3 4.39Å; R79-W124 HydrophobicContact CB-CH2 4.32Å; R79-W124 HydrophobicContact CB-CZ3 3.77Å; R79-W124 HydrophobicContact CG-CZ3 4.27Å; R79-W124 PolarHBondContact NE-O 3.48Å; Q109-W124 HydrophobicContact CB-CB 3.83Å; Q109-W124 HydrophobicContact CB-CG 4.35Å; Q109-W124 HydrophobicContact CG-CB 3.75Å; Q109-W124 VanDerWaalsContact OE1-CD1 3.31Å; Y111-W124 HydrophobicContact CE2-CG 4.46Å; Y111-W124 AromaticContact CE2-NE1 3.89Å; Y111-W124 AromaticContact CZ-NE1 3.74Å; Y111-W124 PolarHBondContact OH-NE1 3.45Å; M121-W124 HydrophobicContact CG-CZ2 4.18Å; W124-A127 HydrophobicContact CD2-CB 3.75Å; W124-A127 HydrophobicContact CE3-CB 3.47Å; W124-A127 VanDerWaalsContact CE3-CB 3.47Å; W124-A127 HydrophobicContact CH2-CB 3.72Å; W124-A127 HydrophobicContact CZ2-CB 4Å; W124-A127 HydrophobicContact CZ3-CB 3.43Å; W124-A127 VanDerWaalsContact CZ3-CB 3.43Å; W124-L137 HydrophobicContact CZ2-CD2 4.33Å
125	D	91.6	Very high	76.1	Confident	55 Å²	55	33.2 Å²	33.2	29%	0.294	20%	0.199	S	C	.	.	S	Bend	trans	-97	-33.8	169.8	-55.7	-58	0	0	0	109.9	V73 R79 G80 I106 Q107	V73-D125 HydrophobicContact CG1-CB 4.09Å; R79-D125 CarbonylContact C-O 3.57Å; R79-D125 VanDerWaalsContact CA-O 3.22Å; R79-D125 WeakPolarHBondContact CA-O 3.42Å; G80-D125 PolarHBondContact N-O 3.05Å; I106-D125 HydrophobicContact CG2-CB 4.04Å; Q107-D125 PolarHBondContact N-OD2 3.21Å; Q107-D125 PolarHBondContact O-N 2.99Å
126	V	94.8	Very high	76.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.6	176.6	175.4	0	0	0	0	111	L69 V73 G80 Y101 I106 Q107 V108 Q109 V128	L69-V126 HydrophobicContact CD1-CG2 4.37Å; L69-V126 HydrophobicContact CD2-CG1 3.91Å; L69-V126 HydrophobicContact CG-CG2 4.44Å; V73-V126 HydrophobicContact CG2-CG2 3.97Å; G80-V126 WeakPolarHBondContact O-CA 3.43Å; Y101-V126 HydrophobicContact CD2-CG2 4.39Å; Y101-V126 HydrophobicContact CE2-CG2 4.32Å; I106-V126 HydrophobicContact CG2-CB 4.49Å; I106-V126 HydrophobicContact CG2-CG2 3.88Å; Q107-V126 PolarHBondContact O-N 3.16Å; V108-V126 CarbonylContact C-O 3.55Å; V108-V126 WeakPolarHBondContact CA-O 3.5Å; V108-V126 HydrophobicContact CG1-CG1 4.34Å; V108-V126 HydrophobicContact CG2-CB 4.21Å; Q109-V126 PolarHBondContact N-O 2.9Å; V126-V128 HydrophobicContact CG1-CG2 4.5Å
127	A	93.6	Very high	77.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.6	173.9	0	0	0	0	0	111.6	G80 L81 F82 Q109 Y111 W124 C129 L137	G80-A127 PolarHBondContact O-N 3.04Å; L81-A127 HydrophobicContact CD1-CB 3.84Å; F82-A127 PolarHBondContact N-O 2.76Å; Q109-A127 CarbonylContact O-C 3.56Å; Q109-A127 WeakPolarHBondContact O-CA 3.29Å; Y111-A127 HydrophobicContact CD2-CB 3.81Å; Y111-A127 HydrophobicContact CE2-CB 3.85Å; W124-A127 HydrophobicContact CD2-CB 3.75Å; W124-A127 HydrophobicContact CE3-CB 3.47Å; W124-A127 VanDerWaalsContact CE3-CB 3.47Å; W124-A127 HydrophobicContact CH2-CB 3.72Å; W124-A127 HydrophobicContact CZ2-CB 4Å; W124-A127 HydrophobicContact CZ3-CB 3.43Å; W124-A127 VanDerWaalsContact CZ3-CB 3.43Å; A127-C129 PolarHBondContact O-SG 3.36Å; A127-L137 HydrophobicContact CB-CD1 4.28Å
128	V	94.8	Very high	78.6	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115.5	174.9	-174.5	0	0	0	0	109.6	F82 L84 A90 K93 M94 L97 V108 Q109 G110 Y111 V126	F82-V128 HydrophobicContact CB-CG2 4.31Å; F82-V128 CarbonylContact O-C 3.31Å; F82-V128 WeakPolarHBondContact O-CA 3.3Å; L84-V128 HydrophobicContact CD1-CG1 3.47Å; L84-V128 VanDerWaalsContact CD1-CG1 3.47Å; A90-V128 HydrophobicContact CB-CG1 4.21Å; A90-V128 WeakPolarHBondContact O-CG1 3.25Å; K93-V128 HydrophobicContact CB-CG1 4.2Å; M94-V128 HydrophobicContact CB-CB 4.09Å; M94-V128 HydrophobicContact CB-CG1 4.37Å; M94-V128 HydrophobicContact CB-CG2 4.28Å; L97-V128 HydrophobicContact CD1-CG2 3.93Å; V108-V128 HydrophobicContact CG1-CG2 3.95Å; Q109-V128 PolarHBondContact O-N 3.45Å; G110-V128 CarbonylContact C-O 3.59Å; G110-V128 VanDerWaalsContact CA-O 3.29Å; G110-V128 WeakPolarHBondContact CA-O 3.35Å; Y111-V128 PolarHBondContact N-O 2.99Å; V126-V128 HydrophobicContact CG1-CG2 4.5Å
129	C	89.7	Confident	79.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.6	-162	-46.3	0	0	0	0	113.4	L81 F82 I83 L84 Y111 A127 K133 A134 L137	L81-C129 WeakPolarHBondContact CD1-SG 3.39Å; F82-C129 PolarHBondContact O-N 3.33Å; I83-C129 WeakPolarHBondContact CA-O 3.46Å; L84-C129 PolarHBondContact N-O 3.22Å; Y111-C129 VanDerWaalsContact O-CA 3.24Å; Y111-C129 WeakPolarHBondContact O-CA 3.26Å; A127-C129 PolarHBondContact O-SG 3.36Å; C129-K133 HydrophobicContact CB-CB 4.34Å; C129-A134 HydrophobicContact CB-CB 4.1Å; C129-L137 WeakPolarHBondContact SG-CD1 3.11Å
130	T	85.9	Confident	81	Confident	7 Å²	7	25.7 Å²	25.7	4%	0.043	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	161.1	154.5	62.5	0	0	0	0	111	L84 I87 Y111 M112 E132 K133 A134	L84-T130 WeakPolarHBondContact O-CA 3.41Å; I87-T130 HydrophobicContact CG1-CG2 3.77Å; Y111-T130 PolarHBondContact O-N 2.9Å; Y111-T130 VanDerWaalsContact O-N 3.09Å; M112-T130 HydrophobicContact CB-CG2 4.01Å; T130-E132 WeakPolarHBondContact CB-OE2 3.19Å; T130-E132 PolarHBondContact O-N 3.39Å; T130-E132 PolarHBondContact OG1-OE2 3.08Å; T130-K133 PolarHBondContact O-N 3.03Å; T130-K133 VanDerWaalsContact O-N 3.11Å; T130-K133 WeakPolarHBondContact OG1-CG 3.45Å; T130-A134 WeakPolarHBondContact O-CB 3.25Å; T130-A134 PolarHBondContact O-N 2.88Å
131	I	80.2	Confident	81.8	Confident	11 Å²	11	23.8 Å²	23.8	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-59.1	-39.4	-176.5	-61.6	163	0	0	0	111.4	I83 A134 N135 R166	I83-I131 HydrophobicContact CG2-CB 4.28Å; I83-I131 HydrophobicContact CG2-CG1 3.55Å; I131-A134 WeakPolarHBondContact O-CB 3.2Å; I131-A134 PolarHBondContact O-N 2.93Å; I131-N135 PolarHBondContact O-N 3.09Å; I131-N135 PolarHBondContact O-ND2 2.86Å; I131-R166 HydrophobicContact CB-CG 4.23Å; I131-R166 HydrophobicContact CD1-CB 4.01Å; I131-R166 HydrophobicContact CD1-CG 3.82Å; I131-R166 HydrophobicContact CG2-CB 3.79Å; I131-R166 HydrophobicContact CG2-CG 3.86Å
132	E	75.7	Confident	82.3	Confident	77 Å²	77	25.2 Å²	25.2	36%	0.36	12%	0.124	S	C	.	.	H	α-helix	trans	-65.6	-40.1	179.1	-54.5	79.4	-171.7	0	0	111	T130 N135 S136 R166	T130-E132 WeakPolarHBondContact CB-OE2 3.19Å; T130-E132 PolarHBondContact O-N 3.39Å; T130-E132 PolarHBondContact OG1-OE2 3.08Å; E132-N135 PolarHBondContact O-N 3.43Å; E132-S136 PolarHBondContact O-N 2.89Å; E132-R166 IonicContact OE1-CZ 2.66Å; E132-R166 IonicContact OE1-NE 3.79Å; E132-R166 PolarHBondContact OE1-NE 3.37Å; E132-R166 IonicContact OE1-NH2 3.73Å; E132-R166 PolarHBondContact OE1-NH2 3.43Å
133	K	79.9	Confident	82.3	Confident	37 Å²	37	24.1 Å²	24.1	16%	0.161	12%	0.119	C	C	.	.	H	α-helix	trans	-73.5	-34.6	176.7	-70.8	-70.7	-175.4	171.6	0	112.7	Y111 G113 N116 C129 T130 N135 S136 L137	Y111-K133 WeakPolarHBondContact O-CB 3Å; Y111-K133 WeakPolarHBondContact O-CG 3.33Å; G113-K133 WeakPolarHBondContact O-CE 3.32Å; G113-K133 PolarHBondContact O-NZ 3.3Å; N116-K133 PolarHBondContact ND2-NZ 3.02Å; N116-K133 PolarHBondContact OD1-NZ 3.5Å; C129-K133 HydrophobicContact CB-CB 4.34Å; T130-K133 PolarHBondContact O-N 3.03Å; T130-K133 VanDerWaalsContact O-N 3.11Å; T130-K133 WeakPolarHBondContact OG1-CG 3.45Å; K133-N135 VanDerWaalsContact C-N 3.34Å; K133-S136 PolarHBondContact O-N 3.45Å; K133-L137 WeakPolarHBondContact O-CG 3.35Å; K133-L137 PolarHBondContact O-N 2.93Å
134	A	85.4	Confident	82.4	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.3	-44.2	171.7	0	0	0	0	0	111.2	L81 I83 C129 T130 I131 S136 L137 I138 L169	L81-A134 HydrophobicContact CD2-CB 3.96Å; I83-A134 HydrophobicContact CD1-CB 4.12Å; I83-A134 HydrophobicContact CG1-CB 3.73Å; I83-A134 HydrophobicContact CG2-CB 4.35Å; C129-A134 HydrophobicContact CB-CB 4.1Å; T130-A134 WeakPolarHBondContact O-CB 3.25Å; T130-A134 PolarHBondContact O-N 2.88Å; I131-A134 WeakPolarHBondContact O-CB 3.2Å; I131-A134 PolarHBondContact O-N 2.93Å; A134-S136 VanDerWaalsContact C-N 3.34Å; A134-S136 PolarHBondContact O-N 3.37Å; A134-L137 PolarHBondContact O-N 3.45Å; A134-I138 WeakPolarHBondContact O-CG1 3.48Å; A134-I138 PolarHBondContact O-N 3.15Å; A134-L169 HydrophobicContact CB-CD1 3.91Å; A134-L169 HydrophobicContact CB-CD2 3.9Å
135	N	78.7	Confident	81.9	Confident	16 Å²	16	31 Å²	31	9%	0.086	15%	0.153	C	C	.	.	H	α-helix	trans	-58.1	-47.4	174.1	-78.9	-36	0	0	0	111	I131 E132 K133 L137 I138 N139 L169	I131-N135 PolarHBondContact O-N 3.09Å; I131-N135 PolarHBondContact O-ND2 2.86Å; E132-N135 PolarHBondContact O-N 3.43Å; K133-N135 VanDerWaalsContact C-N 3.34Å; N135-L137 PolarHBondContact O-N 3.09Å; N135-I138 PolarHBondContact O-N 2.76Å; N135-N139 WeakPolarHBondContact O-CB 3.22Å; N135-N139 PolarHBondContact O-N 3.2Å; N135-N139 PolarHBondContact O-ND2 3.1Å; N135-N139 PolarHBondContact O-OD1 3.29Å; N135-L169 HydrophobicContact CB-CD1 4.26Å; N135-L169 VanDerWaalsContact OD1-CA 3.25Å; N135-L169 WeakPolarHBondContact OD1-CA 3.33Å; N135-L169 WeakPolarHBondContact OD1-CB 3.36Å; N135-L169 WeakPolarHBondContact OD1-CD1 3.4Å
136	S	76.7	Confident	81.4	Confident	38 Å²	38	29.3 Å²	29.3	27%	0.266	15%	0.146	S	C	.	.	H	α-helix	trans	-61.2	-41.2	178.2	-178.8	0	0	0	0	112.9	E132 K133 A134 R140	E132-S136 PolarHBondContact O-N 2.89Å; K133-S136 PolarHBondContact O-N 3.45Å; A134-S136 VanDerWaalsContact C-N 3.34Å; A134-S136 PolarHBondContact O-N 3.37Å; S136-R140 WeakPolarHBondContact O-CB 3.4Å; S136-R140 PolarHBondContact O-N 3.23Å
137	L	81	Confident	80.7	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-67	-41.7	177.4	-75.7	168.9	0	0	0	112.4	L81 Y111 W124 A127 C129 K133 A134 N135 R140 L141	L81-L137 HydrophobicContact CD1-CD1 3.96Å; Y111-L137 HydrophobicContact CD1-CD1 4.13Å; Y111-L137 HydrophobicContact CD1-CD2 4.13Å; Y111-L137 HydrophobicContact CD1-CG 4.39Å; Y111-L137 HydrophobicContact CD2-CD1 3.9Å; Y111-L137 HydrophobicContact CE1-CD2 3.87Å; Y111-L137 HydrophobicContact CE2-CD1 4.31Å; Y111-L137 HydrophobicContact CG-CD1 3.8Å; W124-L137 HydrophobicContact CZ2-CD2 4.33Å; A127-L137 HydrophobicContact CB-CD1 4.28Å; C129-L137 WeakPolarHBondContact SG-CD1 3.11Å; K133-L137 WeakPolarHBondContact O-CG 3.35Å; K133-L137 PolarHBondContact O-N 2.93Å; A134-L137 PolarHBondContact O-N 3.45Å; N135-L137 PolarHBondContact O-N 3.09Å; L137-R140 PolarHBondContact O-N 3.2Å; L137-L141 WeakPolarHBondContact O-CG 3.49Å; L137-L141 PolarHBondContact O-N 3.44Å
138	I	80.9	Confident	80.2	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-43.6	177.2	-66.9	-175.2	0	0	0	110.6	L81 A134 N135 R140 L141 L142 M147 I153 L169 V173	L81-I138 HydrophobicContact CD2-CD1 4.16Å; L81-I138 HydrophobicContact CD2-CG1 4.25Å; A134-I138 WeakPolarHBondContact O-CG1 3.48Å; A134-I138 PolarHBondContact O-N 3.15Å; N135-I138 PolarHBondContact O-N 2.76Å; I138-R140 PolarHBondContact O-N 3.22Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 3.26Å; I138-L141 VanDerWaalsContact O-N 3.12Å; I138-L142 HydrophobicContact CG2-CD1 4.09Å; I138-L142 HydrophobicContact CG2-CG 4.34Å; I138-L142 VanDerWaalsContact O-CG 3.29Å; I138-L142 WeakPolarHBondContact O-CG 3.14Å; I138-L142 PolarHBondContact O-N 2.9Å; I138-M147 HydrophobicContact CG2-CE 3.93Å; I138-M147 HydrophobicContact CG2-SD 4.38Å; I138-I153 HydrophobicContact CD1-CD1 4.05Å; I138-L169 HydrophobicContact CD1-CD1 3.43Å; I138-L169 VanDerWaalsContact CD1-CD1 3.43Å; I138-L169 HydrophobicContact CD1-CG 4.08Å; I138-L169 HydrophobicContact CG1-CD1 4.22Å; I138-V173 HydrophobicContact CD1-CG2 3.5Å
139	N	77.3	Confident	79.8	Confident	15 Å²	15	34 Å²	34	8%	0.08	18%	0.178	C	C	.	.	H	α-helix	trans	-59.4	-39.6	175.7	-69	-11.1	0	0	0	111.1	N135 L142 E143 V497	N135-N139 WeakPolarHBondContact O-CB 3.22Å; N135-N139 PolarHBondContact O-N 3.2Å; N135-N139 PolarHBondContact O-ND2 3.1Å; N135-N139 PolarHBondContact O-OD1 3.29Å; N139-L142 PolarHBondContact O-N 3.25Å; N139-E143 WeakPolarHBondContact O-CB 3.21Å; N139-E143 VanDerWaalsContact O-CG 3.27Å; N139-E143 WeakPolarHBondContact O-CG 3.33Å; N139-E143 PolarHBondContact O-N 2.94Å; N139-V497 PolarHBondContact ND2-O 3.45Å
140	R	77.4	Confident	79.8	Confident	80 Å²	80	34 Å²	34	30%	0.302	18%	0.178	S	C	.	.	H	α-helix	trans	-63.4	-47.9	172.5	-167.2	-178.8	-57.6	126.7	8.5	112.2	S136 L137 I138 L142 E143 E144	S136-R140 WeakPolarHBondContact O-CB 3.4Å; S136-R140 PolarHBondContact O-N 3.23Å; L137-R140 PolarHBondContact O-N 3.2Å; I138-R140 PolarHBondContact O-N 3.22Å; R140-L142 PolarHBondContact O-N 3.35Å; R140-E143 PolarHBondContact O-N 2.89Å; R140-E143 VanDerWaalsContact O-N 3.12Å; R140-E144 HydrophobicContact CG-CG 4.25Å; R140-E144 WeakPolarHBondContact CG-OE1 3.39Å; R140-E144 VanDerWaalsContact O-CG 3.28Å; R140-E144 WeakPolarHBondContact O-CG 3.42Å; R140-E144 PolarHBondContact O-N 3.38Å
141	L	79.6	Confident	80	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-55.5	-37	176	-77.1	162.5	0	0	0	112.3	M121 L137 I138 D145 S146 M147 L150	M121-L141 HydrophobicContact CE-CD2 3.62Å; M121-L141 HydrophobicContact CG-CD2 4.36Å; M121-L141 HydrophobicContact SD-CD2 3.23Å; M121-L141 WeakPolarHBondContact SD-CD2 3.4Å; M121-L141 HydrophobicContact SD-CG 3.71Å; L137-L141 WeakPolarHBondContact O-CG 3.49Å; L137-L141 PolarHBondContact O-N 3.44Å; I138-L141 WeakPolarHBondContact O-CB 3.29Å; I138-L141 PolarHBondContact O-N 3.26Å; I138-L141 VanDerWaalsContact O-N 3.12Å; L141-D145 PolarHBondContact O-N 3.49Å; L141-S146 PolarHBondContact O-N 3.28Å; L141-S146 PolarHBondContact O-OG 2.93Å; L141-M147 HydrophobicContact CB-SD 4.03Å; L141-M147 HydrophobicContact CD1-SD 4.3Å; L141-M147 PolarHBondContact O-N 2.88Å; L141-L150 HydrophobicContact CD1-CB 4.47Å; L141-L150 HydrophobicContact CD1-CD2 4.19Å
142	L	75.4	Confident	80.7	Confident	40 Å²	40	33.3 Å²	33.3	21%	0.209	18%	0.175	C	C	.	.	H	α-helix	trans	-71.9	-43.2	176.1	-67.3	175	0	0	0	112.6	I138 N139 R140 E144 D145 M147 Q176	I138-L142 HydrophobicContact CG2-CD1 4.09Å; I138-L142 HydrophobicContact CG2-CG 4.34Å; I138-L142 VanDerWaalsContact O-CG 3.29Å; I138-L142 WeakPolarHBondContact O-CG 3.14Å; I138-L142 PolarHBondContact O-N 2.9Å; N139-L142 PolarHBondContact O-N 3.25Å; R140-L142 PolarHBondContact O-N 3.35Å; L142-E144 VanDerWaalsContact C-N 3.26Å; L142-E144 PolarHBondContact O-N 2.85Å; L142-D145 PolarHBondContact O-N 2.96Å; L142-M147 HydrophobicContact CD2-CB 4.04Å; L142-M147 HydrophobicContact CD2-CG 3.97Å; L142-M147 HydrophobicContact CD2-SD 4.33Å; L142-Q176 HydrophobicContact CD1-CG 4.45Å; L142-Q176 VanDerWaalsContact CD2-CD 3.43Å; L142-Q176 HydrophobicContact CD2-CG 3.67Å
143	E	70.8	Confident	81.5	Confident	103 Å²	103	29.7 Å²	29.7	48%	0.481	16%	0.158	S	C	.	.	H	α-helix	trans	-63	-33.5	176.1	-73.7	172.4	-172.8	0	0	112.2	N139 R140 D145 S498	N139-E143 WeakPolarHBondContact O-CB 3.21Å; N139-E143 VanDerWaalsContact O-CG 3.27Å; N139-E143 WeakPolarHBondContact O-CG 3.33Å; N139-E143 PolarHBondContact O-N 2.94Å; R140-E143 PolarHBondContact O-N 2.89Å; R140-E143 VanDerWaalsContact O-N 3.12Å; E143-D145 VanDerWaalsContact C-N 3.34Å; E143-S498 PolarHBondContact OE1-OG 3.1Å
144	E	75.4	Confident	82.3	Confident	57 Å²	57	27.9 Å²	27.9	27%	0.266	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	6.5	179	-56.9	-171.1	-174.9	0	0	113.8	M121 R140 L142 S146 S814	M121-E144 VanDerWaalsContact CE-OE2 3.3Å; M121-E144 WeakPolarHBondContact CE-OE2 3.23Å; R140-E144 HydrophobicContact CG-CG 4.25Å; R140-E144 WeakPolarHBondContact CG-OE1 3.39Å; R140-E144 VanDerWaalsContact O-CG 3.28Å; R140-E144 WeakPolarHBondContact O-CG 3.42Å; R140-E144 PolarHBondContact O-N 3.38Å; L142-E144 VanDerWaalsContact C-N 3.26Å; L142-E144 PolarHBondContact O-N 2.85Å; E144-S146 PolarHBondContact O-N 2.83Å; E144-S814 VanDerWaalsContact CG-CB 3.43Å
145	D	74.4	Confident	82.6	Confident	107 Å²	107	28.3 Å²	28.3	57%	0.572	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.4	36.6	-173.8	-163.8	29.9	0	0	0	113.7	L141 L142 E143 Y180	L141-D145 PolarHBondContact O-N 3.49Å; L142-D145 PolarHBondContact O-N 2.96Å; E143-D145 VanDerWaalsContact C-N 3.34Å; D145-Y180 PolarHBondContact OD1-OH 2.96Å
146	S	80.9	Confident	83.1	Confident	21 Å²	21	28.5 Å²	28.5	15%	0.147	15%	0.154	C	C	.	.			trans	-116.7	14.6	-172.3	62	0	0	0	0	112	M121 L141 E144 S148 S149	M121-S146 WeakPolarHBondContact CE-OG 3.39Å; L141-S146 PolarHBondContact O-N 3.28Å; L141-S146 PolarHBondContact O-OG 2.93Å; E144-S146 PolarHBondContact O-N 2.83Å; S146-S148 PolarHBondContact O-N 2.92Å; S146-S148 VanDerWaalsContact O-N 3.12Å; S146-S149 VanDerWaalsContact O-CB 3.25Å; S146-S149 WeakPolarHBondContact O-CB 3.48Å; S146-S149 PolarHBondContact O-N 3.07Å; S146-S149 PolarHBondContact O-OG 3.24Å
147	M	80.8	Confident	83.6	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.025	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-57	-27.9	176.2	-166.3	58.5	169.8	0	0	112.2	I138 L141 L142 S149 L150 V173 I186	I138-M147 HydrophobicContact CG2-CE 3.93Å; I138-M147 HydrophobicContact CG2-SD 4.38Å; L141-M147 HydrophobicContact CB-SD 4.03Å; L141-M147 HydrophobicContact CD1-SD 4.3Å; L141-M147 PolarHBondContact O-N 2.88Å; L142-M147 HydrophobicContact CD2-CB 4.04Å; L142-M147 HydrophobicContact CD2-CG 3.97Å; L142-M147 HydrophobicContact CD2-SD 4.33Å; M147-S149 PolarHBondContact O-N 3.36Å; M147-L150 HydrophobicContact CE-CD2 4.17Å; M147-L150 WeakPolarHBondContact O-CB 3.32Å; M147-L150 PolarHBondContact O-N 2.72Å; M147-L150 VanDerWaalsContact O-N 3.09Å; M147-L150 HydrophobicContact SD-CD2 4.24Å; M147-V173 HydrophobicContact CE-CG2 4.14Å; M147-I186 HydrophobicContact CE-CD1 3.49Å; M147-I186 VanDerWaalsContact CE-CD1 3.49Å; M147-I186 HydrophobicContact CG-CD1 4.09Å; M147-I186 HydrophobicContact SD-CD1 4.15Å
148	S	83.2	Confident	83.8	Confident	64 Å²	64	28 Å²	28	45%	0.448	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-60.5	-20.3	173.2	58.9	0	0	0	0	114.5	S146 L150 N184	S146-S148 PolarHBondContact O-N 2.92Å; S146-S148 VanDerWaalsContact O-N 3.12Å; S148-L150 VanDerWaalsContact C-N 3.34Å; S148-N184 VanDerWaalsContact CA-ND2 3.25Å; S148-N184 WeakPolarHBondContact CA-ND2 3.5Å; S148-N184 WeakPolarHBondContact CB-ND2 3.34Å; S148-N184 PolarHBondContact O-ND2 3.49Å
149	S	87.5	Confident	83.8	Confident	30 Å²	30	29.3 Å²	29.3	21%	0.21	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-79.3	-14.3	175.9	73.7	0	0	0	0	113.6	K78 R79 S146 M147	K78-S149 WeakPolarHBondContact CA-O 3.4Å; K78-S149 VanDerWaalsContact CB-O 3.26Å; K78-S149 WeakPolarHBondContact CB-O 3.35Å; R79-S149 PolarHBondContact N-O 2.81Å; R79-S149 PolarHBondContact NH1-OG 3.39Å; S146-S149 VanDerWaalsContact O-CB 3.25Å; S146-S149 WeakPolarHBondContact O-CB 3.48Å; S146-S149 PolarHBondContact O-N 3.07Å; S146-S149 PolarHBondContact O-OG 3.24Å; M147-S149 PolarHBondContact O-N 3.36Å
150	L	89.1	Confident	83.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130	177	-169.1	67.5	0	0	0	109.4	R79 L81 L141 M147 S148 I153 I186	R79-L150 HydrophobicContact CB-CD1 4.32Å; L81-L150 HydrophobicContact CB-CD1 4.24Å; L141-L150 HydrophobicContact CD1-CB 4.47Å; L141-L150 HydrophobicContact CD1-CD2 4.19Å; M147-L150 HydrophobicContact CE-CD2 4.17Å; M147-L150 WeakPolarHBondContact O-CB 3.32Å; M147-L150 PolarHBondContact O-N 2.72Å; M147-L150 VanDerWaalsContact O-N 3.09Å; M147-L150 HydrophobicContact SD-CD2 4.24Å; S148-L150 VanDerWaalsContact C-N 3.34Å; L150-I153 HydrophobicContact CD2-CD1 3.66Å; L150-I153 HydrophobicContact CD2-CG1 3.74Å; L150-I153 HydrophobicContact CG-CG1 4.34Å; L150-I186 HydrophobicContact CB-CD1 4.34Å; L150-I186 HydrophobicContact CB-CG1 4.39Å; L150-I186 HydrophobicContact CD2-CD1 4.2Å; L150-I186 HydrophobicContact CD2-CG2 4.42Å; L150-I186 HydrophobicContact CG-CG2 4.43Å; L150-I186 WeakPolarHBondContact O-CG1 3.41Å
151	G	90.4	Very high	83.3	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.031	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-28.4	-177	0	0	0	0	0	114	R79 Q187	R79-G151 PolarHBondContact O-N 3.08Å; G151-Q187 PolarHBondContact O-N 3.32Å
152	V	93.5	Very high	82.5	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	143	-176.4	55.3	0	0	0	0	112.5	L69 R72 V73 R79 G80 L81 V154 Q187 I189	L69-V152 HydrophobicContact CD1-CG1 3.43Å; L69-V152 VanDerWaalsContact CD1-CG1 3.43Å; R72-V152 HydrophobicContact CB-CB 4.17Å; R72-V152 HydrophobicContact CB-CG1 4.01Å; R72-V152 HydrophobicContact CG-CB 3.98Å; R72-V152 HydrophobicContact CG-CG1 4.12Å; V73-V152 HydrophobicContact CG2-CG1 4.42Å; R79-V152 PolarHBondContact O-N 3.39Å; G80-V152 WeakPolarHBondContact CA-O 3.4Å; L81-V152 PolarHBondContact N-O 3.17Å; V152-V154 HydrophobicContact CG2-CG2 4.32Å; V152-Q187 CarbonylContact C-O 3.17Å; V152-Q187 VanDerWaalsContact CA-O 3.26Å; V152-Q187 WeakPolarHBondContact CA-O 3.48Å; V152-Q187 HydrophobicContact CG2-CB 4.45Å; V152-I189 HydrophobicContact CG2-CG1 4.32Å
153	I	93.7	Very high	81.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.1	172.9	-60.3	179.4	0	0	0	109	L81 I83 I138 L150 V155 V173 I186 Q187 I188 I189	L81-I153 HydrophobicContact CB-CG1 4.21Å; L81-I153 CarbonylContact O-C 3.53Å; L81-I153 WeakPolarHBondContact O-CA 3.47Å; I83-I153 HydrophobicContact CD1-CG2 3.4Å; I83-I153 VanDerWaalsContact CD1-CG2 3.4Å; I138-I153 HydrophobicContact CD1-CD1 4.05Å; L150-I153 HydrophobicContact CD2-CD1 3.66Å; L150-I153 HydrophobicContact CD2-CG1 3.74Å; L150-I153 HydrophobicContact CG-CG1 4.34Å; I153-V155 HydrophobicContact CG2-CG2 4.13Å; I153-V173 HydrophobicContact CD1-CB 4.27Å; I153-V173 HydrophobicContact CD1-CG1 3.79Å; I153-V173 HydrophobicContact CD1-CG2 3.48Å; I153-V173 VanDerWaalsContact CD1-CG2 3.48Å; I153-I186 HydrophobicContact CD1-CG2 3.93Å; I153-I186 HydrophobicContact CG1-CG2 3.75Å; I153-Q187 PolarHBondContact N-O 3.48Å; I153-I188 WeakPolarHBondContact O-CA 3.29Å; I153-I189 PolarHBondContact O-N 3.39Å
154	V	95.5	Very high	81.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.7	172.5	179.6	0	0	0	0	109.2	A65 L69 L81 F82 I83 V152 I189	A65-V154 HydrophobicContact CB-CG1 3.57Å; A65-V154 HydrophobicContact CB-CG2 4.25Å; L69-V154 HydrophobicContact CB-CG2 4.21Å; L81-V154 PolarHBondContact O-N 2.91Å; F82-V154 HydrophobicContact CD1-CB 4.35Å; F82-V154 HydrophobicContact CD1-CG1 4.09Å; F82-V154 HydrophobicContact CD2-CB 4.1Å; F82-V154 HydrophobicContact CD2-CG1 4.07Å; F82-V154 HydrophobicContact CD2-CG2 4.38Å; F82-V154 HydrophobicContact CE1-CG1 3.82Å; F82-V154 HydrophobicContact CE2-CB 4.28Å; F82-V154 HydrophobicContact CE2-CG1 3.77Å; F82-V154 HydrophobicContact CG-CB 4.1Å; F82-V154 HydrophobicContact CG-CG1 4.21Å; F82-V154 HydrophobicContact CZ-CB 4.5Å; F82-V154 HydrophobicContact CZ-CG1 3.62Å; I83-V154 WeakPolarHBondContact CB-O 3.43Å; I83-V154 PolarHBondContact N-O 2.87Å; V152-V154 HydrophobicContact CG2-CG2 4.32Å; V154-I189 CarbonylContact C-O 3.58Å; V154-I189 WeakPolarHBondContact CA-O 3.04Å; V154-I189 HydrophobicContact CG2-CB 4.2Å
155	V	92	Very high	80.1	Confident	9 Å²	9	40.8 Å²	40.8	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	106.6	173.4	-173.7	0	0	0	0	109.1	I83 I153 L158 L170 I189 M191	I83-V155 HydrophobicContact CD1-CG2 3.79Å; I153-V155 HydrophobicContact CG2-CG2 4.13Å; V155-L158 HydrophobicContact CB-CD1 4.08Å; V155-L158 HydrophobicContact CG1-CD1 4.03Å; V155-L170 HydrophobicContact CG2-CD2 4.03Å; V155-I189 PolarHBondContact N-O 3.21Å; V155-M191 PolarHBondContact O-N 3.12Å
156	D	90.6	Very high	79.4	Confident	20 Å²	20	38 Å²	38	11%	0.107	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	146.4	165.8	-160.5	-0.5	0	0	0	110	F82 I83 L84 M191	F82-D156 HydrophobicContact CE1-CB 4.26Å; I83-D156 PolarHBondContact O-N 3.17Å; L84-D156 HydrophobicContact CD2-CB 4.43Å; L84-D156 HydrophobicContact CG-CB 4.4Å; D156-M191 HydrophobicContact CB-CE 3.89Å; D156-M191 HydrophobicContact CB-CG 4.47Å; D156-M191 WeakPolarHBondContact OD1-CE 3.42Å; D156-M191 VanDerWaalsContact OD2-CE 3.24Å; D156-M191 WeakPolarHBondContact OD2-CE 3.48Å
157	E	86.3	Confident	78.4	Confident	31 Å²	31	37.8 Å²	37.8	15%	0.145	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	50.1	-174.6	-64.1	-60.8	176.3	0	0	113.9	P85 H159 L160 M191 S192 Y375	P85-E157 HydrophobicContact CG-CB 4.24Å; P85-E157 HydrophobicContact CG-CG 4.26Å; E157-H159 PolarHBondContact O-N 3.34Å; E157-H159 PolarHBondContact O-ND1 3Å; E157-H159 IonicContact OE2-CE1 3.45Å; E157-H159 PolarHBondContact OE2-CE1 3.41Å; E157-H159 IonicContact OE2-ND1 3.32Å; E157-H159 PolarHBondContact OE2-ND1 3.45Å; E157-H159 VanDerWaalsContact OE2-ND1 3.17Å; E157-L160 HydrophobicContact CB-CD1 3.77Å; E157-L160 HydrophobicContact CB-CG 4.22Å; E157-L160 WeakPolarHBondContact O-CB 3.43Å; E157-L160 WeakPolarHBondContact O-CG 3.38Å; E157-L160 PolarHBondContact O-N 3.01Å; E157-M191 CarbonylContact C-O 3Å; E157-M191 WeakPolarHBondContact CA-O 3.46Å; E157-M191 PolarHBondContact N-O 3.25Å; E157-S192 PolarHBondContact OE2-OG 3.27Å; E157-Y375 PolarHBondContact OE2-OH 3.16Å
158	L	86.3	Confident	77.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-48.1	-28	-178.4	-174.4	71.9	0	0	0	114.7	V52 V155 L160 V161 L170 M191 L195 Y201	V52-L158 HydrophobicContact CB-CD2 4.49Å; V52-L158 HydrophobicContact CG1-CD2 3.66Å; V52-L158 HydrophobicContact CG2-CD2 3.98Å; V155-L158 HydrophobicContact CB-CD1 4.08Å; V155-L158 HydrophobicContact CG1-CD1 4.03Å; L158-L160 PolarHBondContact O-N 3.46Å; L158-L160 VanDerWaalsContact O-N 3.11Å; L158-V161 HydrophobicContact CD1-CG2 3.95Å; L158-V161 HydrophobicContact CG-CG2 4.48Å; L158-V161 VanDerWaalsContact O-CB 3.25Å; L158-V161 WeakPolarHBondContact O-CB 3.12Å; L158-V161 WeakPolarHBondContact O-CG2 3.36Å; L158-V161 PolarHBondContact O-N 3.15Å; L158-L170 HydrophobicContact CD1-CD1 3.54Å; L158-M191 PolarHBondContact N-O 3.44Å; L158-L195 HydrophobicContact CB-CD1 4.38Å; L158-L195 HydrophobicContact CD2-CD1 4.24Å; L158-Y201 HydrophobicContact CD2-CD1 3.95Å; L158-Y201 HydrophobicContact CD2-CG 4.21Å; L158-Y201 HydrophobicContact CG-CD1 4.24Å; L158-Y201 HydrophobicContact CG-CE1 4.43Å
159	H	79.1	Confident	76.9	Confident	28 Å²	28	38.3 Å²	38.3	13%	0.13	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.2	-21.8	177.8	73.5	-80.3	0	0	0	113	E157 V161 K162 S192 L195 Y375	E157-H159 PolarHBondContact O-N 3.34Å; E157-H159 PolarHBondContact O-ND1 3Å; E157-H159 IonicContact OE2-CE1 3.45Å; E157-H159 PolarHBondContact OE2-CE1 3.41Å; E157-H159 IonicContact OE2-ND1 3.32Å; E157-H159 PolarHBondContact OE2-ND1 3.45Å; E157-H159 VanDerWaalsContact OE2-ND1 3.17Å; H159-V161 PolarHBondContact O-N 3.21Å; H159-K162 WeakPolarHBondContact O-CG 3.45Å; H159-K162 PolarHBondContact O-N 3.18Å; H159-K162 VanDerWaalsContact O-N 3.17Å; H159-S192 PolarHBondContact ND1-OG 2.65Å; H159-L195 HydrophobicContact CB-CD2 3.87Å; H159-Y375 AromaticContact CD2-CE1 3.81Å; H159-Y375 AromaticContact CD2-CZ 3.84Å; H159-Y375 AromaticContact CE1-CE1 3.76Å; H159-Y375 AromaticContact CE1-CE2 3.86Å; H159-Y375 AromaticContact CE1-CZ 3.16Å; H159-Y375 PolarHBondContact CE1-OH 3.45Å; H159-Y375 AromaticContact ND1-CE2 3.99Å; H159-Y375 AromaticContact ND1-CZ 3.74Å; H159-Y375 AromaticContact NE2-CE1 3.24Å; H159-Y375 WeakPolarHBondContact NE2-CE1 3.49Å; H159-Y375 AromaticContact NE2-CZ 3.18Å; H159-Y375 PolarHBondContact NE2-OH 3.46Å; H159-Y375 VanDerWaalsContact NE2-OH 3.16Å
160	L	74.4	Confident	75.8	Confident	36 Å²	36	37 Å²	37	19%	0.188	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-66.2	-11.5	176	-65.8	173.3	0	0	0	113.3	P85 E157 L158 K162 D163	P85-L160 HydrophobicContact CB-CD1 3.26Å; P85-L160 HydrophobicContact CG-CD1 3.92Å; E157-L160 HydrophobicContact CB-CD1 3.77Å; E157-L160 HydrophobicContact CB-CG 4.22Å; E157-L160 WeakPolarHBondContact O-CB 3.43Å; E157-L160 WeakPolarHBondContact O-CG 3.38Å; E157-L160 PolarHBondContact O-N 3.01Å; L158-L160 PolarHBondContact O-N 3.46Å; L158-L160 VanDerWaalsContact O-N 3.11Å; L160-K162 PolarHBondContact O-N 3.4Å; L160-K162 VanDerWaalsContact O-N 3.16Å; L160-D163 WeakPolarHBondContact O-CB 3.36Å; L160-D163 PolarHBondContact O-N 3.19Å
161	V	70	Confident	74.8	Confident	26 Å²	26	43.2 Å²	43.2	16%	0.158	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-60.1	-21.2	170.4	173.3	0	0	0	0	112	L158 H159 D163 G167 L170 Y201 W204	L158-V161 HydrophobicContact CD1-CG2 3.95Å; L158-V161 HydrophobicContact CG-CG2 4.48Å; L158-V161 VanDerWaalsContact O-CB 3.25Å; L158-V161 WeakPolarHBondContact O-CB 3.12Å; L158-V161 WeakPolarHBondContact O-CG2 3.36Å; L158-V161 PolarHBondContact O-N 3.15Å; H159-V161 PolarHBondContact O-N 3.21Å; V161-D163 PolarHBondContact O-N 3.26Å; V161-G167 WeakPolarHBondContact O-CA 3.38Å; V161-L170 HydrophobicContact CG1-CD1 4.3Å; V161-L170 HydrophobicContact CG2-CD1 3.47Å; V161-L170 VanDerWaalsContact CG2-CD1 3.47Å; V161-L170 HydrophobicContact CG2-CG 4.43Å; V161-Y201 HydrophobicContact CB-CE1 4.44Å; V161-W204 HydrophobicContact CG1-CH2 3.79Å; V161-W204 HydrophobicContact CG1-CZ3 3.86Å
162	K	63.9	Low	73.7	Confident	135 Å²	135	46.1 Å²	46.1	59%	0.587	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-67.1	-19.9	172.8	-66	-177.1	178.7	-176.5	0	113.2	H159 L160 Y201	H159-K162 WeakPolarHBondContact O-CG 3.45Å; H159-K162 PolarHBondContact O-N 3.18Å; H159-K162 VanDerWaalsContact O-N 3.17Å; L160-K162 PolarHBondContact O-N 3.4Å; L160-K162 VanDerWaalsContact O-N 3.16Å; K162-Y201 VanDerWaalsContact CE-OH 3.23Å; K162-Y201 WeakPolarHBondContact CE-OH 3.39Å; K162-Y201 WeakPolarHBondContact CG-OH 3.23Å
163	D	62.5	Low	72.5	Confident	68 Å²	68	46.1 Å²	46.1	36%	0.364	21%	0.207	S	C	.	.	S	Bend	trans	-71.4	129.5	176.7	-174.6	-54.5	0	0	0	109.6	L160 V161 H165 R166 G167	L160-D163 WeakPolarHBondContact O-CB 3.36Å; L160-D163 PolarHBondContact O-N 3.19Å; V161-D163 PolarHBondContact O-N 3.26Å; D163-H165 PolarHBondContact O-N 3.04Å; D163-H165 VanDerWaalsContact O-N 3.15Å; D163-H165 IonicContact OD1-CD2 3.98Å; D163-H165 PolarHBondContact OD1-N 3.11Å; D163-R166 HydrophobicContact CB-CB 4.11Å; D163-R166 HydrophobicContact CB-CG 4.47Å; D163-R166 PolarHBondContact O-N 3.4Å; D163-R166 VanDerWaalsContact O-N 3.11Å; D163-G167 PolarHBondContact O-N 3.41Å
164	R	53.2	Low	71.4	Confident	195 Å²	195	48 Å²	48	74%	0.736	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.5	-174.1	-70.8	-172.6	177.4	-156.7	0.9	113.3
165	H	54.7	Low	69.9	Low	78 Å²	78	52.2 Å²	52.2	36%	0.361	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-32	-179.5	-59.9	-82.3	0	0	0	111.8	D163 E505	D163-H165 PolarHBondContact O-N 3.04Å; D163-H165 VanDerWaalsContact O-N 3.15Å; D163-H165 IonicContact OD1-CD2 3.98Å; D163-H165 PolarHBondContact OD1-N 3.11Å; H165-E505 IonicContact CE1-OE1 3.57Å; H165-E505 PolarHBondContact CE1-OE1 3.02Å; H165-E505 VanDerWaalsContact CE1-OE1 3.3Å; H165-E505 IonicContact ND1-OE1 2.76Å
166	R	60.9	Low	68.5	Low	49 Å²	49	54.1 Å²	54.1	19%	0.185	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-23.1	-171.9	-67.8	171	166.1	-156.2	-9.8	113.6	P85 I131 E132 D163 K168	P85-R166 PolarHBondContact O-NH2 3.14Å; I131-R166 HydrophobicContact CB-CG 4.23Å; I131-R166 HydrophobicContact CD1-CB 4.01Å; I131-R166 HydrophobicContact CD1-CG 3.82Å; I131-R166 HydrophobicContact CG2-CB 3.79Å; I131-R166 HydrophobicContact CG2-CG 3.86Å; E132-R166 IonicContact OE1-CZ 2.66Å; E132-R166 IonicContact OE1-NE 3.79Å; E132-R166 PolarHBondContact OE1-NE 3.37Å; E132-R166 IonicContact OE1-NH2 3.73Å; E132-R166 PolarHBondContact OE1-NH2 3.43Å; D163-R166 HydrophobicContact CB-CB 4.11Å; D163-R166 HydrophobicContact CB-CG 4.47Å; D163-R166 PolarHBondContact O-N 3.4Å; D163-R166 VanDerWaalsContact O-N 3.11Å; R166-K168 VanDerWaalsContact C-N 3.31Å; R166-K168 PolarHBondContact O-N 3.47Å
167	G	58.9	Low	67.3	Low	16 Å²	16	54.5 Å²	54.5	17%	0.165	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.1	-176.9	0	0	0	0	0	115.9	V161 D163 L169	V161-G167 WeakPolarHBondContact O-CA 3.38Å; D163-G167 PolarHBondContact O-N 3.41Å; G167-L169 VanDerWaalsContact C-N 3.26Å; G167-L169 PolarHBondContact O-N 3.09Å
168	K	65.8	Low	66	Low	75 Å²	75	59.5 Å²	59.5	33%	0.326	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-31.6	-176.1	-63.9	-179.3	-177.3	176.1	0	113.1	R166 Y171 H172 M501	R166-K168 VanDerWaalsContact C-N 3.31Å; R166-K168 PolarHBondContact O-N 3.47Å; K168-Y171 WeakPolarHBondContact O-CB 3.3Å; K168-Y171 PolarHBondContact O-N 2.96Å; K168-H172 PolarHBondContact O-N 3.46Å; K168-H172 VanDerWaalsContact O-N 3.13Å; K168-H172 PolarHBondContact O-ND1 3.01Å; K168-M501 PolarHBondContact NZ-O 3.35Å
169	L	67.7	Low	64.5	Low	6 Å²	6	63.3 Å²	63.3	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-56.4	-172.6	-173	76.2	0	0	0	112.9	I83 A134 N135 I138 G167 Y171 H172 V173	I83-L169 HydrophobicContact CD1-CD2 3.34Å; I83-L169 HydrophobicContact CG1-CD2 4.29Å; A134-L169 HydrophobicContact CB-CD1 3.91Å; A134-L169 HydrophobicContact CB-CD2 3.9Å; N135-L169 HydrophobicContact CB-CD1 4.26Å; N135-L169 VanDerWaalsContact OD1-CA 3.25Å; N135-L169 WeakPolarHBondContact OD1-CA 3.33Å; N135-L169 WeakPolarHBondContact OD1-CB 3.36Å; N135-L169 WeakPolarHBondContact OD1-CD1 3.4Å; I138-L169 HydrophobicContact CD1-CD1 3.43Å; I138-L169 VanDerWaalsContact CD1-CD1 3.43Å; I138-L169 HydrophobicContact CD1-CG 4.08Å; I138-L169 HydrophobicContact CG1-CD1 4.22Å; G167-L169 VanDerWaalsContact C-N 3.26Å; G167-L169 PolarHBondContact O-N 3.09Å; L169-Y171 PolarHBondContact O-N 3.3Å; L169-H172 PolarHBondContact O-N 3.25Å; L169-V173 WeakPolarHBondContact O-CG2 3.36Å; L169-V173 PolarHBondContact O-N 2.97Å
170	L	64.1	Low	63.4	Low	2 Å²	2	66.8 Å²	66.8	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-67.1	-29.4	-177.4	-75.1	177.8	0	0	0	112.2	V155 L158 V161 R174 I188 W204 L205	V155-L170 HydrophobicContact CG2-CD2 4.03Å; L158-L170 HydrophobicContact CD1-CD1 3.54Å; V161-L170 HydrophobicContact CG1-CD1 4.3Å; V161-L170 HydrophobicContact CG2-CD1 3.47Å; V161-L170 VanDerWaalsContact CG2-CD1 3.47Å; V161-L170 HydrophobicContact CG2-CG 4.43Å; L170-R174 WeakPolarHBondContact O-CB 3.4Å; L170-R174 PolarHBondContact O-N 3.37Å; L170-I188 HydrophobicContact CD2-CD1 4.5Å; L170-I188 HydrophobicContact CD2-CG2 3.87Å; L170-W204 HydrophobicContact CB-CH2 3.45Å; L170-W204 VanDerWaalsContact CB-CH2 3.45Å; L170-W204 HydrophobicContact CB-CZ2 4.13Å; L170-W204 HydrophobicContact CB-CZ3 4.12Å; L170-W204 HydrophobicContact CD1-CH2 3.98Å; L170-W204 HydrophobicContact CD1-CZ3 3.83Å; L170-W204 HydrophobicContact CG-CH2 4.4Å; L170-L205 HydrophobicContact CD1-CD1 4.48Å
171	Y	67.5	Low	62.5	Low	130 Å²	130	66.3 Å²	66.3	51%	0.51	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-45.9	174.3	-171.3	-90.3	0	0	0	111.3	K168 L169 R174 Q175	K168-Y171 WeakPolarHBondContact O-CB 3.3Å; K168-Y171 PolarHBondContact O-N 2.96Å; L169-Y171 PolarHBondContact O-N 3.3Å; Y171-R174 PolarHBondContact O-N 2.99Å; Y171-Q175 HydrophobicContact CD1-CG 4.03Å; Y171-Q175 HydrophobicContact CE1-CG 3.67Å; Y171-Q175 VanDerWaalsContact CZ-NE2 3.31Å; Y171-Q175 WeakPolarHBondContact O-CG 3.24Å; Y171-Q175 PolarHBondContact O-N 3.12Å; Y171-Q175 PolarHBondContact OH-NE2 3.38Å
172	H	66.2	Low	61.9	Low	64 Å²	64	71 Å²	71	30%	0.296	34%	0.343	S	S	.	.	H	α-helix	trans	-61.3	-48.2	177.2	-74.1	80.4	0	0	0	111.5	K168 L169 R174 Q175 Q176	K168-H172 PolarHBondContact O-N 3.46Å; K168-H172 VanDerWaalsContact O-N 3.13Å; K168-H172 PolarHBondContact O-ND1 3.01Å; L169-H172 PolarHBondContact O-N 3.25Å; H172-R174 VanDerWaalsContact C-N 3.27Å; H172-R174 PolarHBondContact O-N 2.94Å; H172-Q175 PolarHBondContact O-N 2.89Å; H172-Q176 VanDerWaalsContact O-CG 3.25Å; H172-Q176 WeakPolarHBondContact O-CG 3.47Å; H172-Q176 PolarHBondContact O-N 3.33Å; H172-Q176 VanDerWaalsContact O-N 3.1Å
173	V	68.9	Low	61.5	Low	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-58.3	-42.1	177.8	177.9	0	0	0	0	111.2	I138 M147 I153 L169 Q176 Q177 I186 I188	I138-V173 HydrophobicContact CD1-CG2 3.5Å; M147-V173 HydrophobicContact CE-CG2 4.14Å; I153-V173 HydrophobicContact CD1-CB 4.27Å; I153-V173 HydrophobicContact CD1-CG1 3.79Å; I153-V173 HydrophobicContact CD1-CG2 3.48Å; I153-V173 VanDerWaalsContact CD1-CG2 3.48Å; L169-V173 WeakPolarHBondContact O-CG2 3.36Å; L169-V173 PolarHBondContact O-N 2.97Å; V173-Q176 PolarHBondContact O-N 3.4Å; V173-Q177 PolarHBondContact O-N 3.27Å; V173-Q177 VanDerWaalsContact O-N 3.1Å; V173-I186 HydrophobicContact CG1-CD1 4.35Å; V173-I186 HydrophobicContact CG1-CG2 4.42Å; V173-I188 HydrophobicContact CG1-CD1 3.9Å; V173-I188 HydrophobicContact CG1-CG1 4.36Å
174	R	70.2	Confident	61.5	Low	41 Å²	41	68.2 Å²	68.2	16%	0.155	34%	0.343	C	S	.	.	H	α-helix	trans	-66.7	-42.6	-179.4	-170.9	66.9	-176.8	109.4	5.4	112.1	L170 Y171 H172 Q176 Q177 F178 C206	L170-R174 WeakPolarHBondContact O-CB 3.4Å; L170-R174 PolarHBondContact O-N 3.37Å; Y171-R174 PolarHBondContact O-N 2.99Å; H172-R174 VanDerWaalsContact C-N 3.27Å; H172-R174 PolarHBondContact O-N 2.94Å; R174-Q176 PolarHBondContact O-N 3.49Å; R174-Q177 PolarHBondContact O-N 2.97Å; R174-F178 HydrophobicContact CG-CD2 4.38Å; R174-F178 HydrophobicContact CG-CE2 4.21Å; R174-F178 WeakPolarHBondContact O-CD2 3.47Å; R174-F178 PolarHBondContact O-N 2.9Å; R174-C206 PolarHBondContact NH2-SG 3.36Å
175	Q	64.1	Low	62.5	Low	87 Å²	87	62.5 Å²	62.5	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-60.7	-36.4	176.4	-71.2	-66	10.4	0	0	111.7	Y171 H172 F178 A179	Y171-Q175 HydrophobicContact CD1-CG 4.03Å; Y171-Q175 HydrophobicContact CE1-CG 3.67Å; Y171-Q175 VanDerWaalsContact CZ-NE2 3.31Å; Y171-Q175 WeakPolarHBondContact O-CG 3.24Å; Y171-Q175 PolarHBondContact O-N 3.12Å; Y171-Q175 PolarHBondContact OH-NE2 3.38Å; H172-Q175 PolarHBondContact O-N 2.89Å; Q175-F178 WeakPolarHBondContact O-CB 3.3Å; Q175-F178 PolarHBondContact O-N 3.14Å; Q175-A179 PolarHBondContact O-N 3.28Å
176	Q	64.1	Low	64	Low	49 Å²	49	59.1 Å²	59.1	23%	0.229	32%	0.316	C	S	.	.	H	α-helix	trans	-70.4	-36.5	178.3	-64.6	-66.4	-9	0	0	112.9	L142 H172 V173 R174 F178 A179 Y180	L142-Q176 HydrophobicContact CD1-CG 4.45Å; L142-Q176 VanDerWaalsContact CD2-CD 3.43Å; L142-Q176 HydrophobicContact CD2-CG 3.67Å; H172-Q176 VanDerWaalsContact O-CG 3.25Å; H172-Q176 WeakPolarHBondContact O-CG 3.47Å; H172-Q176 PolarHBondContact O-N 3.33Å; H172-Q176 VanDerWaalsContact O-N 3.1Å; V173-Q176 PolarHBondContact O-N 3.4Å; R174-Q176 PolarHBondContact O-N 3.49Å; Q176-F178 PolarHBondContact O-N 2.97Å; Q176-A179 PolarHBondContact O-N 3.02Å; Q176-A179 VanDerWaalsContact O-N 3.16Å; Q176-Y180 HydrophobicContact CB-CD2 4.37Å; Q176-Y180 WeakPolarHBondContact O-CD2 3.23Å; Q176-Y180 PolarHBondContact O-N 3.46Å
177	Q	64.7	Low	65.5	Low	28 Å²	28	57 Å²	57	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-31.6	170.4	-74.5	179.4	-17.9	0	0	112.9	V173 R174 I186	V173-Q177 PolarHBondContact O-N 3.27Å; V173-Q177 VanDerWaalsContact O-N 3.1Å; R174-Q177 PolarHBondContact O-N 2.97Å; Q177-I186 PolarHBondContact NE2-O 2.86Å
178	F	58.2	Low	67.1	Low	137 Å²	137	56.3 Å²	56.3	60%	0.601	30%	0.301	S	S	*	.	H	α-helix	trans	-72.7	-39.3	173.8	-85.5	-76.4	0	0	0	111.9	R174 Q175 Q176	R174-F178 HydrophobicContact CG-CD2 4.38Å; R174-F178 HydrophobicContact CG-CE2 4.21Å; R174-F178 WeakPolarHBondContact O-CD2 3.47Å; R174-F178 PolarHBondContact O-N 2.9Å; Q175-F178 WeakPolarHBondContact O-CB 3.3Å; Q175-F178 PolarHBondContact O-N 3.14Å; Q176-F178 PolarHBondContact O-N 2.97Å
179	A	55.4	Low	68.5	Low	79 Å²	79	52.7 Å²	52.7	65%	0.653	29%	0.285	S	S	*	.	H	α-helix	trans	-71.7	-46.5	-177.4	0	0	0	0	0	113.7	Q175 Q176 G181	Q175-A179 PolarHBondContact O-N 3.28Å; Q176-A179 PolarHBondContact O-N 3.02Å; Q176-A179 VanDerWaalsContact O-N 3.16Å; A179-G181 VanDerWaalsContact C-N 3.31Å; A179-G181 PolarHBondContact O-N 3.4Å
180	Y	56.1	Low	69.7	Low	102 Å²	102	52.4 Å²	52.4	40%	0.4	28%	0.284	S	S	.	.	S	Bend	trans	-83.3	-5	-177.3	-70.9	-80.6	0	0	0	113.9	D145 Q176 S183	D145-Y180 PolarHBondContact OD1-OH 2.96Å; Q176-Y180 HydrophobicContact CB-CD2 4.37Å; Q176-Y180 WeakPolarHBondContact O-CD2 3.23Å; Q176-Y180 PolarHBondContact O-N 3.46Å; Y180-S183 PolarHBondContact O-OG 2.93Å
181	G	55.5	Low	71	Confident	25 Å²	25	52.3 Å²	52.3	26%	0.258	28%	0.283	S	S	.	.			trans	70.3	-177.6	180	0	0	0	0	0	114.5	A179 S183	A179-G181 VanDerWaalsContact C-N 3.31Å; A179-G181 PolarHBondContact O-N 3.4Å; G181-S183 PolarHBondContact O-N 3.01Å
182	P	56.7	Low	72	Confident	124 Å²	124	46.1 Å²	46.1	81%	0.805	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.2	-173	29.2	-35	0	0	0	114.7	N184 P185	P182-N184 PolarHBondContact O-N 3.46Å; P182-P185 WeakPolarHBondContact O-CD 3.37Å
183	S	56.9	Low	72.7	Confident	107 Å²	107	43.3 Å²	43.3	75%	0.748	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.8	-176.8	51.8	0	0	0	0	113.3	Y180 G181	Y180-S183 PolarHBondContact O-OG 2.93Å; G181-S183 PolarHBondContact O-N 3.01Å
184	N	61.3	Low	73.1	Confident	38 Å²	38	44.6 Å²	44.6	20%	0.203	25%	0.254	C	S	.	.	S	Bend	trans	-147.9	69.1	-179.6	-162.7	-3.6	0	0	0	113.8	K78 S148 P182 I186	K78-N184 PolarHBondContact NZ-OD1 3.36Å; S148-N184 VanDerWaalsContact CA-ND2 3.25Å; S148-N184 WeakPolarHBondContact CA-ND2 3.5Å; S148-N184 WeakPolarHBondContact CB-ND2 3.34Å; S148-N184 PolarHBondContact O-ND2 3.49Å; P182-N184 PolarHBondContact O-N 3.46Å; N184-I186 PolarHBondContact O-N 3.43Å
185	P	73.9	Confident	73.5	Confident	75 Å²	75	42.9 Å²	42.9	49%	0.487	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-79.7	121.4	-175.4	31	-30.6	0	0	0	111.4	P182 Q187	P182-P185 WeakPolarHBondContact O-CD 3.37Å; P185-Q187 PolarHBondContact O-N 3.07Å
186	I	88	Confident	73.9	Confident	8 Å²	8	43.2 Å²	43.2	4%	0.041	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-69.5	122.3	166.2	-64	159.8	0	0	0	108.6	M147 L150 I153 V173 Q177 N184	M147-I186 HydrophobicContact CE-CD1 3.49Å; M147-I186 VanDerWaalsContact CE-CD1 3.49Å; M147-I186 HydrophobicContact CG-CD1 4.09Å; M147-I186 HydrophobicContact SD-CD1 4.15Å; L150-I186 HydrophobicContact CB-CD1 4.34Å; L150-I186 HydrophobicContact CB-CG1 4.39Å; L150-I186 HydrophobicContact CD2-CD1 4.2Å; L150-I186 HydrophobicContact CD2-CG2 4.42Å; L150-I186 HydrophobicContact CG-CG2 4.43Å; L150-I186 WeakPolarHBondContact O-CG1 3.41Å; I153-I186 HydrophobicContact CD1-CG2 3.93Å; I153-I186 HydrophobicContact CG1-CG2 3.75Å; V173-I186 HydrophobicContact CG1-CD1 4.35Å; V173-I186 HydrophobicContact CG1-CG2 4.42Å; Q177-I186 PolarHBondContact NE2-O 2.86Å; N184-I186 PolarHBondContact O-N 3.43Å
187	Q	92	Very high	74.5	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.019	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	128	176.3	-169.2	-178.1	22.1	0	0	111	V44 R49 G151 V152 I153 P185 I189	V44-Q187 PolarHBondContact O-NE2 2.99Å; R49-Q187 PolarHBondContact O-NE2 3.18Å; G151-Q187 PolarHBondContact O-N 3.32Å; V152-Q187 CarbonylContact C-O 3.17Å; V152-Q187 VanDerWaalsContact CA-O 3.26Å; V152-Q187 WeakPolarHBondContact CA-O 3.48Å; V152-Q187 HydrophobicContact CG2-CB 4.45Å; I153-Q187 PolarHBondContact N-O 3.48Å; P185-Q187 PolarHBondContact O-N 3.07Å; Q187-I189 HydrophobicContact CG-CD1 4.07Å
188	I	91.6	Very high	75.5	Confident	1 Å²	1	43 Å²	43	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.7	178.4	-55.7	174.6	0	0	0	109.7	N50 L51 I153 L170 V173 L205	N50-I188 WeakPolarHBondContact CA-O 3.3Å; N50-I188 HydrophobicContact CB-CB 4.38Å; N50-I188 VanDerWaalsContact CB-O 3.31Å; N50-I188 WeakPolarHBondContact CB-O 3.26Å; N50-I188 PolarHBondContact OD1-N 3.08Å; L51-I188 PolarHBondContact N-O 3.5Å; I153-I188 WeakPolarHBondContact O-CA 3.29Å; L170-I188 HydrophobicContact CD2-CD1 4.5Å; L170-I188 HydrophobicContact CD2-CG2 3.87Å; V173-I188 HydrophobicContact CG1-CD1 3.9Å; V173-I188 HydrophobicContact CG1-CG1 4.36Å; I188-L205 HydrophobicContact CD1-CD2 4.22Å; I188-L205 HydrophobicContact CG2-CD1 4.25Å
189	I	94.7	Very high	76.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	114.8	176.4	-51.8	-64.1	0	0	0	108.7	L51 Y53 A65 I68 V152 I153 V154 V155 Q187	L51-I189 HydrophobicContact CB-CD1 3.67Å; L51-I189 CarbonylContact O-C 3.01Å; L51-I189 WeakPolarHBondContact O-CA 3.41Å; Y53-I189 HydrophobicContact CE1-CG2 3.89Å; A65-I189 HydrophobicContact CB-CG2 4Å; I68-I189 HydrophobicContact CD1-CD1 3.86Å; I68-I189 HydrophobicContact CD1-CG1 4.5Å; I68-I189 HydrophobicContact CG2-CD1 3.84Å; I68-I189 HydrophobicContact CG2-CG1 3.97Å; V152-I189 HydrophobicContact CG2-CG1 4.32Å; I153-I189 PolarHBondContact O-N 3.39Å; V154-I189 CarbonylContact C-O 3.58Å; V154-I189 WeakPolarHBondContact CA-O 3.04Å; V154-I189 HydrophobicContact CG2-CB 4.2Å; V155-I189 PolarHBondContact N-O 3.21Å; Q187-I189 HydrophobicContact CG-CD1 4.07Å
190	G	93.2	Very high	78.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.4	178.7	0	0	0	0	0	111.7	L51 V52 Y53	L51-G190 PolarHBondContact O-N 3.48Å; V52-G190 CarbonylContact C-O 3.55Å; V52-G190 VanDerWaalsContact CA-O 3.28Å; V52-G190 WeakPolarHBondContact CA-O 3.35Å; Y53-G190 PolarHBondContact N-O 3.34Å
191	M	92.1	Very high	79.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	150.6	178	68.5	-177.3	-149.3	0	0	112.5	Y53 K61 T62 A65 V155 D156 E157 L158	Y53-M191 HydrophobicContact CD1-CB 4.09Å; Y53-M191 HydrophobicContact CD2-CB 4.34Å; Y53-M191 HydrophobicContact CE1-CB 3.63Å; Y53-M191 HydrophobicContact CE2-CB 3.87Å; Y53-M191 HydrophobicContact CE2-SD 4.36Å; Y53-M191 HydrophobicContact CG-CB 4.44Å; Y53-M191 WeakPolarHBondContact O-CA 3.38Å; Y53-M191 PolarHBondContact OH-SD 3.44Å; K61-M191 HydrophobicContact CB-CE 4.16Å; K61-M191 HydrophobicContact CB-SD 3.9Å; T62-M191 HydrophobicContact CG2-CE 3.85Å; T62-M191 WeakPolarHBondContact OG1-CE 3.47Å; A65-M191 HydrophobicContact CB-SD 4.16Å; V155-M191 PolarHBondContact O-N 3.12Å; D156-M191 HydrophobicContact CB-CE 3.89Å; D156-M191 HydrophobicContact CB-CG 4.47Å; D156-M191 WeakPolarHBondContact OD1-CE 3.42Å; D156-M191 VanDerWaalsContact OD2-CE 3.24Å; D156-M191 WeakPolarHBondContact OD2-CE 3.48Å; E157-M191 CarbonylContact C-O 3Å; E157-M191 WeakPolarHBondContact CA-O 3.46Å; E157-M191 PolarHBondContact N-O 3.25Å; L158-M191 PolarHBondContact N-O 3.44Å
192	S	88.6	Confident	80.8	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	163.1	168.1	-170.4	0	0	0	0	111.6	Y53 T54 A55 K61 E157 H159 T194	Y53-S192 PolarHBondContact O-N 2.98Å; T54-S192 WeakPolarHBondContact CA-O 3.46Å; T54-S192 PolarHBondContact OG1-O 3.19Å; A55-S192 PolarHBondContact N-O 3.44Å; K61-S192 WeakPolarHBondContact CD-O 3.42Å; E157-S192 PolarHBondContact OE2-OG 3.27Å; H159-S192 PolarHBondContact ND1-OG 2.65Å; S192-T194 VanDerWaalsContact C-N 3.3Å
193	A	81.7	Confident	82	Confident	5 Å²	5	39.9 Å²	39.9	4%	0.041	22%	0.219	C	C	.	.	S	Bend	trans	-60.3	-43	174.3	0	0	0	0	0	111.9	T54 A55	T54-A193 PolarHBondContact OG1-O 3.02Å; A55-A193 CarbonylContact C-O 2.94Å; A55-A193 VanDerWaalsContact O-CA 3.27Å; A55-A193 WeakPolarHBondContact O-CA 3.47Å
194	T	75.7	Confident	82.9	Confident	26 Å²	26	38.7 Å²	38.7	16%	0.16	20%	0.199	C	C	.	.			trans	-147.6	129	175.6	58.3	0	0	0	0	112.3	T54 S192 Y375 K378	T54-T194 VanDerWaalsContact OG1-CA 3.24Å; T54-T194 WeakPolarHBondContact OG1-CA 3.47Å; S192-T194 VanDerWaalsContact C-N 3.3Å; T194-Y375 VanDerWaalsContact OG1-CD2 3.29Å; T194-Y375 WeakPolarHBondContact OG1-CD2 3.32Å; T194-K378 HydrophobicContact CG2-CB 4.41Å; T194-K378 HydrophobicContact CG2-CD 3.37Å
195	L	80.1	Confident	83.9	Confident	5 Å²	5	37 Å²	37	3%	0.026	19%	0.189	C	C	.	.			trans	-127.1	98.2	170.9	-79.6	150	0	0	0	108.6	V52 T54 L158 H159 N197 I198 Y201	V52-L195 HydrophobicContact CG1-CD1 4.29Å; T54-L195 PolarHBondContact OG1-N 2.96Å; L158-L195 HydrophobicContact CB-CD1 4.38Å; L158-L195 HydrophobicContact CD2-CD1 4.24Å; H159-L195 HydrophobicContact CB-CD2 3.87Å; L195-N197 PolarHBondContact O-N 2.82Å; L195-I198 HydrophobicContact CB-CB 3.97Å; L195-I198 HydrophobicContact CB-CG1 4.22Å; L195-I198 PolarHBondContact O-N 2.99Å; L195-Y201 HydrophobicContact CD2-CD2 3.79Å; L195-Y201 HydrophobicContact CD2-CE2 3.47Å; L195-Y201 VanDerWaalsContact CD2-CE2 3.47Å
196	P	72.3	Confident	84.4	Confident	94 Å²	94	37 Å²	37	61%	0.61	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.6	-178.4	24.7	-32.5	0	0	0	113.1
197	N	77	Confident	84.4	Confident	73 Å²	73	37.1 Å²	37.1	39%	0.39	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	40	179.6	-60.9	-11.3	0	0	0	110.9	L195 E199 I200 Y201	L195-N197 PolarHBondContact O-N 2.82Å; N197-E199 PolarHBondContact O-N 3.03Å; N197-E199 VanDerWaalsContact O-N 3.15Å; N197-I200 HydrophobicContact CB-CB 4.4Å; N197-I200 HydrophobicContact CB-CD1 3.86Å; N197-I200 HydrophobicContact CB-CG1 4.11Å; N197-I200 WeakPolarHBondContact O-CB 3.29Å; N197-I200 PolarHBondContact O-N 2.77Å; N197-Y201 VanDerWaalsContact O-CD2 3.32Å; N197-Y201 WeakPolarHBondContact O-CD2 3.41Å
198	I	85.5	Confident	84.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-58	-30.3	-173.6	-164.3	170.2	0	0	0	111.9	V52 T54 L195 I200 Y201 G202 I209	V52-I198 HydrophobicContact CG1-CD1 4.09Å; V52-I198 HydrophobicContact CG1-CG1 3.69Å; T54-I198 HydrophobicContact CG2-CD1 3.81Å; L195-I198 HydrophobicContact CB-CB 3.97Å; L195-I198 HydrophobicContact CB-CG1 4.22Å; L195-I198 PolarHBondContact O-N 2.99Å; I198-I200 VanDerWaalsContact C-N 3.29Å; I198-I200 PolarHBondContact O-N 2.86Å; I198-Y201 PolarHBondContact O-N 3.06Å; I198-G202 PolarHBondContact O-N 2.81Å; I198-I209 HydrophobicContact CB-CG2 4.43Å; I198-I209 HydrophobicContact CD1-CG2 3.64Å; I198-I209 HydrophobicContact CG1-CG2 3.78Å; I198-I209 HydrophobicContact CG2-CG2 3.87Å
199	E	86.8	Confident	84.6	Confident	98 Å²	98	42.1 Å²	42.1	46%	0.458	22%	0.217	S	C	.	.	H	α-helix	trans	-63.6	-33.3	177.2	-58.7	76.1	-165.8	0	0	112.4	N197 K203	N197-E199 PolarHBondContact O-N 3.03Å; N197-E199 VanDerWaalsContact O-N 3.15Å; E199-K203 WeakPolarHBondContact O-CB 3.36Å; E199-K203 WeakPolarHBondContact O-CG 3.46Å; E199-K203 PolarHBondContact O-N 2.68Å
200	I	81.8	Confident	84.6	Confident	108 Å²	108	43.8 Å²	43.8	55%	0.554	22%	0.224	S	C	*	.	H	α-helix	trans	-69.2	-44.6	176.1	-57.9	-176.6	0	0	0	109.8	N197 I198 K203 W204	N197-I200 HydrophobicContact CB-CB 4.4Å; N197-I200 HydrophobicContact CB-CD1 3.86Å; N197-I200 HydrophobicContact CB-CG1 4.11Å; N197-I200 WeakPolarHBondContact O-CB 3.29Å; N197-I200 PolarHBondContact O-N 2.77Å; I198-I200 VanDerWaalsContact C-N 3.29Å; I198-I200 PolarHBondContact O-N 2.86Å; I200-K203 PolarHBondContact O-N 3.28Å; I200-W204 VanDerWaalsContact O-CB 3.27Å; I200-W204 WeakPolarHBondContact O-CB 3.44Å; I200-W204 PolarHBondContact O-N 2.95Å
201	Y	82	Confident	84.5	Confident	18 Å²	18	50.7 Å²	50.7	7%	0.071	25%	0.25	C	S	.	.	H	α-helix	trans	-63.7	-43.1	176.4	-69.6	-84.7	0	0	0	111.5	L158 V161 K162 L195 N197 I198 W204 L205	L158-Y201 HydrophobicContact CD2-CD1 3.95Å; L158-Y201 HydrophobicContact CD2-CG 4.21Å; L158-Y201 HydrophobicContact CG-CD1 4.24Å; L158-Y201 HydrophobicContact CG-CE1 4.43Å; V161-Y201 HydrophobicContact CB-CE1 4.44Å; K162-Y201 VanDerWaalsContact CE-OH 3.23Å; K162-Y201 WeakPolarHBondContact CE-OH 3.39Å; K162-Y201 WeakPolarHBondContact CG-OH 3.23Å; L195-Y201 HydrophobicContact CD2-CD2 3.79Å; L195-Y201 HydrophobicContact CD2-CE2 3.47Å; L195-Y201 VanDerWaalsContact CD2-CE2 3.47Å; N197-Y201 VanDerWaalsContact O-CD2 3.32Å; N197-Y201 WeakPolarHBondContact O-CD2 3.41Å; I198-Y201 PolarHBondContact O-N 3.06Å; Y201-W204 HydrophobicContact CD1-CE3 4.21Å; Y201-W204 HydrophobicContact CD1-CZ3 4.34Å; Y201-W204 PolarHBondContact O-N 2.98Å; Y201-L205 WeakPolarHBondContact O-CB 3.38Å; Y201-L205 PolarHBondContact O-N 2.8Å
202	G	84.4	Confident	84.4	Confident	4 Å²	4	51.9 Å²	51.9	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-39.7	179.3	0	0	0	0	0	113	I198 C206 S207	I198-G202 PolarHBondContact O-N 2.81Å; G202-C206 CarbonylContact O-C 3.51Å; G202-C206 VanDerWaalsContact O-CA 3.25Å; G202-C206 WeakPolarHBondContact O-CA 3.36Å; G202-C206 PolarHBondContact O-N 2.83Å; G202-S207 VanDerWaalsContact CA-OG 3.29Å; G202-S207 WeakPolarHBondContact CA-OG 3.37Å; G202-S207 PolarHBondContact O-N 2.69Å
203	K	81.6	Confident	84.1	Confident	172 Å²	172	57.8 Å²	57.8	75%	0.748	29%	0.289	S	S	*	.	H	α-helix	trans	-63.6	-44.7	171.3	-75.2	-179.6	-179.6	-175.3	0	112.1	E199 I200 C206	E199-K203 WeakPolarHBondContact O-CB 3.36Å; E199-K203 WeakPolarHBondContact O-CG 3.46Å; E199-K203 PolarHBondContact O-N 2.68Å; I200-K203 PolarHBondContact O-N 3.28Å; K203-C206 PolarHBondContact O-N 3.49Å
204	W	76.9	Confident	84.3	Confident	83 Å²	83	60.8 Å²	60.8	31%	0.314	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-42.9	-178.6	175	49.5	0	0	0	112.9	V161 L170 I200 Y201	V161-W204 HydrophobicContact CG1-CH2 3.79Å; V161-W204 HydrophobicContact CG1-CZ3 3.86Å; L170-W204 HydrophobicContact CB-CH2 3.45Å; L170-W204 VanDerWaalsContact CB-CH2 3.45Å; L170-W204 HydrophobicContact CB-CZ2 4.13Å; L170-W204 HydrophobicContact CB-CZ3 4.12Å; L170-W204 HydrophobicContact CD1-CH2 3.98Å; L170-W204 HydrophobicContact CD1-CZ3 3.83Å; L170-W204 HydrophobicContact CG-CH2 4.4Å; I200-W204 VanDerWaalsContact O-CB 3.27Å; I200-W204 WeakPolarHBondContact O-CB 3.44Å; I200-W204 PolarHBondContact O-N 2.95Å; Y201-W204 HydrophobicContact CD1-CE3 4.21Å; Y201-W204 HydrophobicContact CD1-CZ3 4.34Å; Y201-W204 PolarHBondContact O-N 2.98Å
205	L	82.4	Confident	84.6	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-90.5	1.9	179.9	-62.2	176.7	0	0	0	113.2	N50 V52 L170 I188 Y201 S207	N50-L205 PolarHBondContact ND2-O 3.41Å; V52-L205 HydrophobicContact CG2-CD1 3.79Å; L170-L205 HydrophobicContact CD1-CD1 4.48Å; I188-L205 HydrophobicContact CD1-CD2 4.22Å; I188-L205 HydrophobicContact CG2-CD1 4.25Å; Y201-L205 WeakPolarHBondContact O-CB 3.38Å; Y201-L205 PolarHBondContact O-N 2.8Å; L205-S207 PolarHBondContact O-N 3.17Å
206	C	83.5	Confident	84.4	Confident	75 Å²	75	62.7 Å²	62.7	51%	0.507	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	46	-173.1	-56	0	0	0	0	112.3	R174 G202 K203	R174-C206 PolarHBondContact NH2-SG 3.36Å; G202-C206 CarbonylContact O-C 3.51Å; G202-C206 VanDerWaalsContact O-CA 3.25Å; G202-C206 WeakPolarHBondContact O-CA 3.36Å; G202-C206 PolarHBondContact O-N 2.83Å; K203-C206 PolarHBondContact O-N 3.49Å
207	S	87.8	Confident	84.8	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.084	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	154.1	-172.5	80	0	0	0	0	112.5	N50 V52 G202 L205	N50-S207 VanDerWaalsContact C-CB 3.44Å; N50-S207 CarbonylContact O-C 3.58Å; N50-S207 VanDerWaalsContact O-CA 3.27Å; N50-S207 WeakPolarHBondContact O-CA 3.44Å; N50-S207 WeakPolarHBondContact O-CB 3.39Å; V52-S207 WeakPolarHBondContact CB-OG 3.29Å; V52-S207 WeakPolarHBondContact CG2-OG 3.44Å; V52-S207 PolarHBondContact N-OG 2.56Å; G202-S207 VanDerWaalsContact CA-OG 3.29Å; G202-S207 WeakPolarHBondContact CA-OG 3.37Å; G202-S207 PolarHBondContact O-N 2.69Å; L205-S207 PolarHBondContact O-N 3.17Å
208	E	94.1	Very high	85	Confident	48 Å²	48	58.9 Å²	58.9	22%	0.224	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	151	158.9	-69.1	-54.9	137.9	0	0	110.2	L41 V44 R49 N50 L51 V52	L41-E208 HydrophobicContact CD1-CB 4.21Å; V44-E208 HydrophobicContact CG2-CB 4.04Å; V44-E208 HydrophobicContact CG2-CG 4.11Å; R49-E208 HydrophobicContact CB-CG 4.37Å; R49-E208 WeakPolarHBondContact CD-OE1 3.45Å; R49-E208 IonicContact CZ-OE1 3.72Å; R49-E208 IonicContact NE-OE1 3.92Å; R49-E208 IonicContact NH1-OE1 3.38Å; R49-E208 PolarHBondContact NH1-OE1 3.49Å; N50-E208 PolarHBondContact O-N 2.69Å; L51-E208 HydrophobicContact CD1-CB 4.35Å; V52-E208 PolarHBondContact N-O 2.86Å
209	I	94.1	Very high	84.7	Confident	61 Å²	61	60.9 Å²	60.9	31%	0.313	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.2	-175.7	-58.9	176.6	0	0	0	109.5	V52 I198	V52-I209 VanDerWaalsContact O-CA 3.28Å; V52-I209 WeakPolarHBondContact O-CA 3.32Å; I198-I209 HydrophobicContact CB-CG2 4.43Å; I198-I209 HydrophobicContact CD1-CG2 3.64Å; I198-I209 HydrophobicContact CG1-CG2 3.78Å; I198-I209 HydrophobicContact CG2-CG2 3.87Å
210	F	94.9	Very high	84.5	Confident	35 Å²	35	58.1 Å²	58.1	15%	0.154	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137.2	172.1	-165.1	-89.8	0	0	0	112	W34 D37 C38 L41 V52 Y53 T54 T212	W34-F210 HydrophobicContact CB-CE1 4.16Å; W34-F210 HydrophobicContact CB-CZ 4.25Å; W34-F210 HydrophobicContact CD2-CE1 4.49Å; W34-F210 HydrophobicContact CE3-CD1 4.12Å; W34-F210 AromaticContact CE3-CE1 3.65Å; W34-F210 HydrophobicContact CE3-CE1 3.65Å; W34-F210 HydrophobicContact CZ3-CD1 4.5Å; W34-F210 HydrophobicContact CZ3-CE1 4.44Å; D37-F210 HydrophobicContact CB-CE2 4.1Å; D37-F210 HydrophobicContact CB-CZ 4.22Å; C38-F210 HydrophobicContact CB-CB 4.46Å; C38-F210 HydrophobicContact CB-CD1 3.95Å; C38-F210 HydrophobicContact CB-CD2 4.05Å; C38-F210 HydrophobicContact CB-CE1 4.17Å; C38-F210 HydrophobicContact CB-CE2 4.24Å; C38-F210 HydrophobicContact CB-CG 3.89Å; C38-F210 HydrophobicContact CB-CZ 4.29Å; L41-F210 HydrophobicContact CD1-CB 3.97Å; L41-F210 HydrophobicContact CD1-CD2 4.01Å; L41-F210 HydrophobicContact CD1-CG 4.44Å; L41-F210 HydrophobicContact CG-CD2 4.47Å; V52-F210 PolarHBondContact O-N 3.22Å; V52-F210 VanDerWaalsContact O-N 3.1Å; Y53-F210 CarbonylContact C-O 3.44Å; Y53-F210 WeakPolarHBondContact CA-O 3.3Å; Y53-F210 WeakPolarHBondContact CB-O 3.44Å; T54-F210 PolarHBondContact N-O 3.44Å; F210-T212 HydrophobicContact CE1-CG2 4.03Å
211	R	92.2	Very high	84.3	Confident	145 Å²	145	54.3 Å²	54.3	55%	0.547	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.2	178	177.2	166.2	-177.5	172.8	-1.3	110.5	T54	T54-R211 HydrophobicContact CG2-CB 3.87Å; T54-R211 HydrophobicContact CG2-CG 3.64Å
212	T	89.4	Confident	84.1	Confident	25 Å²	25	54.9 Å²	54.9	15%	0.153	27%	0.272	C	S	.	.			trans	-142.5	150.6	172.3	-177.7	0	0	0	0	110.5	W34 T54 A55 P56 F210 F214	W34-T212 HydrophobicContact CB-CG2 4.27Å; W34-T212 HydrophobicContact CD2-CG2 3.65Å; W34-T212 HydrophobicContact CE3-CG2 3.68Å; W34-T212 HydrophobicContact CG-CG2 3.93Å; W34-T212 HydrophobicContact CZ3-CG2 4.29Å; T54-T212 PolarHBondContact O-N 3.01Å; T54-T212 VanDerWaalsContact O-N 3.11Å; A55-T212 HydrophobicContact CB-CG2 3.41Å; A55-T212 VanDerWaalsContact CB-CG2 3.41Å; P56-T212 WeakPolarHBondContact CD-O 3.44Å; F210-T212 HydrophobicContact CE1-CG2 4.03Å; T212-F214 VanDerWaalsContact OG1-CB 3.27Å; T212-F214 WeakPolarHBondContact OG1-CB 3.47Å; T212-F214 PolarHBondContact OG1-N 2.83Å
213	D	82.6	Confident	83.6	Confident	124 Å²	124	55.3 Å²	55.3	66%	0.663	27%	0.273	S	S	*	.			trans	-106.6	12	169.3	-66.7	-43.5	0	0	0	111.3
214	F	85.9	Confident	83.1	Confident	68 Å²	68	48.9 Å²	48.9	30%	0.298	25%	0.245	S	C	.	.			trans	-58.3	138	-179.6	174.3	-92.2	0	0	0	112	F32 W34 A59 T212	F32-F214 HydrophobicContact CB-CE1 3.96Å; F32-F214 HydrophobicContact CB-CZ 4.28Å; F32-F214 AromaticContact CD1-CE1 3.61Å; F32-F214 HydrophobicContact CD1-CE1 3.61Å; F32-F214 AromaticContact CD1-CZ 3.51Å; F32-F214 HydrophobicContact CD1-CZ 3.51Å; F32-F214 AromaticContact CD2-CE1 3.78Å; F32-F214 HydrophobicContact CD2-CE1 3.78Å; F32-F214 AromaticContact CE1-CE1 3.96Å; F32-F214 HydrophobicContact CE1-CE1 3.96Å; F32-F214 AromaticContact CE1-CZ 3.88Å; F32-F214 HydrophobicContact CE1-CZ 3.88Å; F32-F214 HydrophobicContact CE2-CE1 4.11Å; F32-F214 HydrophobicContact CG-CD1 4.44Å; F32-F214 AromaticContact CG-CE1 3.51Å; F32-F214 HydrophobicContact CG-CE1 3.51Å; F32-F214 AromaticContact CG-CZ 3.88Å; F32-F214 HydrophobicContact CG-CZ 3.88Å; F32-F214 HydrophobicContact CZ-CE1 4.19Å; W34-F214 AromaticContact CD1-CD1 3.21Å; W34-F214 AromaticContact CD1-CE1 3.89Å; W34-F214 AromaticContact CD1-CG 3.57Å; W34-F214 HydrophobicContact CG-CB 4.3Å; W34-F214 HydrophobicContact CG-CD1 4.39Å; W34-F214 HydrophobicContact CG-CG 4.48Å; W34-F214 AromaticContact NE1-CD1 3.36Å; W34-F214 AromaticContact NE1-CE1 3.95Å; A59-F214 WeakPolarHBondContact CB-O 3.46Å; T212-F214 VanDerWaalsContact OG1-CB 3.27Å; T212-F214 WeakPolarHBondContact OG1-CB 3.47Å; T212-F214 PolarHBondContact OG1-N 2.83Å
215	R	81.5	Confident	82.6	Confident	33 Å²	33	46.3 Å²	46.3	13%	0.125	24%	0.24	C	C	.	.			trans	-143.2	134	172.8	-164.3	173.6	-173.5	-131.1	12.1	110.3	S58 V217 G382 A384	S58-R215 PolarHBondContact OG-NE 2.81Å; R215-V217 VanDerWaalsContact C-N 3.27Å; R215-V217 WeakPolarHBondContact CD-O 3.46Å; R215-V217 VanDerWaalsContact CG-O 3.24Å; R215-V217 WeakPolarHBondContact CG-O 3.28Å; R215-V217 PolarHBondContact NE-O 3.18Å; R215-V217 PolarHBondContact NH1-O 2.93Å; R215-V217 PolarHBondContact O-N 3.24Å; R215-G382 PolarHBondContact NH2-O 2.96Å; R215-A384 PolarHBondContact NH1-O 2.95Å; R215-A384 PolarHBondContact NH2-O 3.07Å
216	P	76.7	Confident	81.8	Confident	39 Å²	39	53.1 Å²	53.1	25%	0.253	28%	0.276	S	S	.	.	S	Bend	trans	-65.9	-29.7	178.6	23.8	-32.5	0	0	0	113.1	F32 S58 K387	F32-P216 HydrophobicContact CE1-CB 4.28Å; F32-P216 HydrophobicContact CZ-CB 3.87Å; F32-P216 HydrophobicContact CZ-CG 4.22Å; S58-P216 WeakPolarHBondContact O-CD 3.36Å; S58-P216 WeakPolarHBondContact O-CG 3.25Å; P216-K387 HydrophobicContact CB-CD 4.47Å; P216-K387 HydrophobicContact CG-CD 4.4Å
217	V	80.7	Confident	81	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	28%	0.281	C	S	.	.	S	Bend	trans	-116.1	112.1	174.5	-178.5	0	0	0	0	108.9	R215 L219 K387	R215-V217 VanDerWaalsContact C-N 3.27Å; R215-V217 WeakPolarHBondContact CD-O 3.46Å; R215-V217 VanDerWaalsContact CG-O 3.24Å; R215-V217 WeakPolarHBondContact CG-O 3.28Å; R215-V217 PolarHBondContact NE-O 3.18Å; R215-V217 PolarHBondContact NH1-O 2.93Å; R215-V217 PolarHBondContact O-N 3.24Å; V217-L219 PolarHBondContact O-N 3.4Å; V217-K387 HydrophobicContact CG2-CB 4.39Å
218	P	79.7	Confident	80	Confident	78 Å²	78	56.8 Å²	56.8	51%	0.506	30%	0.299	S	S	.	.			trans	-54.1	138.8	-179.7	-26.2	34	0	0	0	112.2	G393	P218-G393 PolarHBondContact O-N 3.37Å
219	L	80.5	Confident	78.9	Confident	42 Å²	42	54.9 Å²	54.9	22%	0.22	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.1	177.7	-176.1	62.4	0	0	0	110.5	V217 E221 A384 A395	V217-L219 PolarHBondContact O-N 3.4Å; L219-E221 HydrophobicContact CD2-CG 4.18Å; L219-E221 HydrophobicContact CG-CG 4.13Å; L219-A384 HydrophobicContact CD1-CB 3.6Å; L219-A395 HydrophobicContact CD1-CB 3.93Å; L219-A395 HydrophobicContact CG-CB 4.45Å
220	T	81.3	Confident	77.8	Confident	40 Å²	40	55 Å²	55	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.6	170.1	-62.2	0	0	0	0	110.7	Y222 Q392 G393 M394 A395	T220-Y222 HydrophobicContact CG2-CD2 4.38Å; T220-Y222 HydrophobicContact CG2-CE1 4.4Å; T220-Y222 HydrophobicContact CG2-CE2 3.63Å; T220-Q392 VanDerWaalsContact CB-NE2 3.32Å; T220-Q392 PolarHBondContact OG1-NE2 2.9Å; T220-G393 PolarHBondContact N-O 2.95Å; T220-M394 WeakPolarHBondContact O-CA 3.45Å; T220-A395 PolarHBondContact O-N 3.25Å
221	E	78.9	Confident	76.6	Confident	28 Å²	28	54.4 Å²	54.4	13%	0.131	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134	-174.9	-55.4	-177.2	91.7	0	0	109.6	L219 K232 Y377 A395	L219-E221 HydrophobicContact CD2-CG 4.18Å; L219-E221 HydrophobicContact CG-CG 4.13Å; E221-K232 HydrophobicContact CB-CG 4.39Å; E221-K232 WeakPolarHBondContact OE2-CE 3.41Å; E221-K232 IonicContact OE2-NZ 2.7Å; E221-K232 PolarHBondContact OE2-NZ 3.49Å; E221-Y377 WeakPolarHBondContact OE1-CE1 3.5Å; E221-Y377 PolarHBondContact OE1-OH 2.97Å; E221-A395 CarbonylContact C-O 3.53Å; E221-A395 VanDerWaalsContact CA-O 3.3Å; E221-A395 WeakPolarHBondContact CA-O 3.39Å; E221-A395 HydrophobicContact CG-CB 4.22Å
222	Y	76.7	Confident	75.3	Confident	31 Å²	31	52.5 Å²	52.5	12%	0.122	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.2	177.7	-60.1	-90.8	0	0	0	110.2	T220 Y230 T231 V237 M394 A395 K396 F397	T220-Y222 HydrophobicContact CG2-CD2 4.38Å; T220-Y222 HydrophobicContact CG2-CE1 4.4Å; T220-Y222 HydrophobicContact CG2-CE2 3.63Å; Y222-Y230 CarbonylContact C-O 3.56Å; Y222-Y230 WeakPolarHBondContact CA-O 3.28Å; Y222-T231 HydrophobicContact CD1-CG2 4.28Å; Y222-T231 HydrophobicContact CE1-CG2 3.98Å; Y222-V237 HydrophobicContact CE1-CG2 4.1Å; Y222-M394 HydrophobicContact CE2-CE 3.76Å; Y222-M394 HydrophobicContact CE2-CG 4.36Å; Y222-A395 PolarHBondContact N-O 3.4Å; Y222-K396 HydrophobicContact CD2-CG 4.24Å; Y222-K396 CarbonylContact O-C 3.57Å; Y222-K396 WeakPolarHBondContact O-CA 3.45Å; Y222-F397 PolarHBondContact O-N 3.36Å
223	L	73.8	Confident	74.1	Confident	12 Å²	12	57 Å²	57	6%	0.063	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.7	171	176.3	68.1	0	0	0	109	F229 Y230 F234 F397 H399	L223-F229 CarbonylContact O-C 3.51Å; L223-F229 WeakPolarHBondContact O-CA 3.23Å; L223-Y230 PolarHBondContact N-O 2.9Å; L223-Y230 PolarHBondContact O-N 3.39Å; L223-F234 HydrophobicContact CD2-CE1 4.17Å; L223-F397 HydrophobicContact CD1-CD1 3.69Å; L223-F397 HydrophobicContact CD1-CE1 4.43Å; L223-H399 HydrophobicContact CD1-CB 4.11Å
224	F	70.7	Confident	73.1	Confident	38 Å²	38	55.7 Å²	55.7	17%	0.167	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.3	170.8	-175.8	-91.5	0	0	0	110.4	G227 K228 F229 F397 Y398 H399	F224-G227 VanDerWaalsContact CE2-C 3.41Å; F224-K228 WeakPolarHBondContact CA-O 3.28Å; F224-F229 HydrophobicContact CB-CD1 3.92Å; F224-F229 HydrophobicContact CB-CE1 3.72Å; F224-F229 HydrophobicContact CB-CZ 4.41Å; F224-F229 AromaticContact CD2-CD1 3.81Å; F224-F229 HydrophobicContact CD2-CD1 3.81Å; F224-F229 AromaticContact CD2-CD2 3.88Å; F224-F229 HydrophobicContact CD2-CD2 3.88Å; F224-F229 AromaticContact CD2-CE1 3.45Å; F224-F229 HydrophobicContact CD2-CE1 3.45Å; F224-F229 VanDerWaalsContact CD2-CE1 3.45Å; F224-F229 AromaticContact CD2-CE2 3.51Å; F224-F229 HydrophobicContact CD2-CE2 3.51Å; F224-F229 HydrophobicContact CD2-CG 4.01Å; F224-F229 AromaticContact CD2-CZ 3.31Å; F224-F229 HydrophobicContact CD2-CZ 3.31Å; F224-F229 HydrophobicContact CE2-CD2 4.31Å; F224-F229 HydrophobicContact CE2-CE1 4.4Å; F224-F229 AromaticContact CE2-CE2 3.75Å; F224-F229 HydrophobicContact CE2-CE2 3.75Å; F224-F229 AromaticContact CE2-CZ 3.83Å; F224-F229 HydrophobicContact CE2-CZ 3.83Å; F224-F229 HydrophobicContact CG-CD1 4.36Å; F224-F229 AromaticContact CG-CE1 3.98Å; F224-F229 HydrophobicContact CG-CE1 3.98Å; F224-F229 HydrophobicContact CG-CZ 4.18Å; F224-F397 PolarHBondContact N-O 3.22Å; F224-Y398 HydrophobicContact CB-CD2 4.24Å; F224-Y398 AromaticContact CD1-CD2 3.15Å; F224-Y398 HydrophobicContact CD1-CD2 3.15Å; F224-Y398 AromaticContact CD1-CE2 3.25Å; F224-Y398 HydrophobicContact CD1-CE2 3.25Å; F224-Y398 HydrophobicContact CD1-CG 4.3Å; F224-Y398 AromaticContact CE1-CD2 3.68Å; F224-Y398 HydrophobicContact CE1-CD2 3.68Å; F224-Y398 AromaticContact CE1-CE2 3.25Å; F224-Y398 HydrophobicContact CE1-CE2 3.25Å; F224-Y398 AromaticContact CG-CD2 3.95Å; F224-Y398 HydrophobicContact CG-CD2 3.95Å; F224-Y398 HydrophobicContact CG-CE2 4.38Å; F224-Y398 HydrophobicContact CZ-CE2 4.36Å; F224-H399 PolarHBondContact O-N 3.43Å
225	S	66.3	Low	72.2	Confident	29 Å²	29	58 Å²	58	20%	0.203	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	135.1	176.5	-176.4	0	0	0	0	109.9	G227 K228	S225-G227 VanDerWaalsContact C-N 3.35Å; S225-G227 PolarHBondContact O-N 3.32Å; S225-K228 PolarHBondContact N-O 2.89Å; S225-K228 PolarHBondContact O-N 3.23Å; S225-K228 VanDerWaalsContact O-N 3.07Å; S225-K228 VanDerWaalsContact O-O 3.14Å
226	N	66.7	Low	71	Confident	143 Å²	143	60.8 Å²	60.8	77%	0.765	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	46.7	178.1	-63.7	-18.3	0	0	0	114.5	K228	N226-K228 VanDerWaalsContact C-N 3.26Å; N226-K228 PolarHBondContact O-N 2.93Å
227	G	66.1	Low	70.3	Confident	59 Å²	59	61.3 Å²	61.3	61%	0.608	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	1.8	177.5	0	0	0	0	0	115.1	F224 S225	F224-G227 VanDerWaalsContact CE2-C 3.41Å; S225-G227 VanDerWaalsContact C-N 3.35Å; S225-G227 PolarHBondContact O-N 3.32Å
228	K	68.2	Low	69	Low	106 Å²	106	72.4 Å²	72.4	46%	0.461	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	146.5	-169.9	-74.4	177.9	-179.2	-179.4	0	111.8	F224 S225 N226 Y230 L236	F224-K228 WeakPolarHBondContact CA-O 3.28Å; S225-K228 PolarHBondContact N-O 2.89Å; S225-K228 PolarHBondContact O-N 3.23Å; S225-K228 VanDerWaalsContact O-N 3.07Å; S225-K228 VanDerWaalsContact O-O 3.14Å; N226-K228 VanDerWaalsContact C-N 3.26Å; N226-K228 PolarHBondContact O-N 2.93Å; K228-Y230 HydrophobicContact CB-CE2 3.94Å; K228-L236 HydrophobicContact CB-CD1 3.49Å; K228-L236 VanDerWaalsContact CB-CD1 3.49Å; K228-L236 HydrophobicContact CD-CD1 3.68Å; K228-L236 HydrophobicContact CD-CD2 4.26Å; K228-L236 HydrophobicContact CG-CD1 3.73Å
229	F	69.8	Low	67.8	Low	7 Å²	7	70.3 Å²	70.3	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.1	175.3	-66.9	-85.1	0	0	0	111.3	L223 F224 L236 V237 S239 L241 K396	L223-F229 CarbonylContact O-C 3.51Å; L223-F229 WeakPolarHBondContact O-CA 3.23Å; F224-F229 HydrophobicContact CB-CD1 3.92Å; F224-F229 HydrophobicContact CB-CE1 3.72Å; F224-F229 HydrophobicContact CB-CZ 4.41Å; F224-F229 AromaticContact CD2-CD1 3.81Å; F224-F229 HydrophobicContact CD2-CD1 3.81Å; F224-F229 AromaticContact CD2-CD2 3.88Å; F224-F229 HydrophobicContact CD2-CD2 3.88Å; F224-F229 AromaticContact CD2-CE1 3.45Å; F224-F229 HydrophobicContact CD2-CE1 3.45Å; F224-F229 VanDerWaalsContact CD2-CE1 3.45Å; F224-F229 AromaticContact CD2-CE2 3.51Å; F224-F229 HydrophobicContact CD2-CE2 3.51Å; F224-F229 HydrophobicContact CD2-CG 4.01Å; F224-F229 AromaticContact CD2-CZ 3.31Å; F224-F229 HydrophobicContact CD2-CZ 3.31Å; F224-F229 HydrophobicContact CE2-CD2 4.31Å; F224-F229 HydrophobicContact CE2-CE1 4.4Å; F224-F229 AromaticContact CE2-CE2 3.75Å; F224-F229 HydrophobicContact CE2-CE2 3.75Å; F224-F229 AromaticContact CE2-CZ 3.83Å; F224-F229 HydrophobicContact CE2-CZ 3.83Å; F224-F229 HydrophobicContact CG-CD1 4.36Å; F224-F229 AromaticContact CG-CE1 3.98Å; F224-F229 HydrophobicContact CG-CE1 3.98Å; F224-F229 HydrophobicContact CG-CZ 4.18Å; F229-L236 CarbonylContact O-C 3.51Å; F229-L236 WeakPolarHBondContact O-CA 3.26Å; F229-V237 HydrophobicContact CB-CB 4.35Å; F229-V237 PolarHBondContact O-N 3.47Å; F229-S239 WeakPolarHBondContact CD2-O 3.38Å; F229-S239 WeakPolarHBondContact CE2-O 3.4Å; F229-L241 HydrophobicContact CE1-CD1 3.97Å; F229-L241 HydrophobicContact CZ-CD1 3.64Å; F229-K396 HydrophobicContact CD1-CD 4.04Å; F229-K396 HydrophobicContact CD1-CG 4.24Å; F229-K396 HydrophobicContact CE1-CB 4.2Å; F229-K396 HydrophobicContact CE1-CD 3.44Å; F229-K396 VanDerWaalsContact CE1-CD 3.44Å; F229-K396 HydrophobicContact CE1-CG 3.93Å; F229-K396 HydrophobicContact CZ-CD 3.99Å
230	Y	70.4	Confident	66.6	Low	63 Å²	63	73.7 Å²	73.7	25%	0.247	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.7	179.8	-64.2	-88.6	0	0	0	109.9	Y222 L223 K228 E235 L236	Y222-Y230 CarbonylContact C-O 3.56Å; Y222-Y230 WeakPolarHBondContact CA-O 3.28Å; L223-Y230 PolarHBondContact N-O 2.9Å; L223-Y230 PolarHBondContact O-N 3.39Å; K228-Y230 HydrophobicContact CB-CE2 3.94Å; Y230-E235 CarbonylContact C-O 3.42Å; Y230-E235 VanDerWaalsContact CA-O 3.28Å; Y230-E235 WeakPolarHBondContact CA-O 3.35Å; Y230-L236 HydrophobicContact CE1-CD1 4.42Å
231	T	69.6	Low	65.8	Low	23 Å²	23	75 Å²	75	14%	0.141	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	176.5	172.8	65.9	0	0	0	0	111.7	Y222 N233 F234 E235 V237	Y222-T231 HydrophobicContact CD1-CG2 4.28Å; Y222-T231 HydrophobicContact CE1-CG2 3.98Å; T231-N233 PolarHBondContact O-N 3.45Å; T231-N233 VanDerWaalsContact O-N 3.09Å; T231-N233 PolarHBondContact OG1-N 3.27Å; T231-F234 WeakPolarHBondContact O-CA 3.22Å; T231-F234 PolarHBondContact O-N 3.46Å; T231-E235 HydrophobicContact CG2-CB 4.19Å; T231-E235 PolarHBondContact N-O 3.29Å; T231-E235 WeakPolarHBondContact OG1-CB 3.14Å; T231-E235 PolarHBondContact OG1-N 3.01Å; T231-E235 VanDerWaalsContact OG1-N 3.13Å; T231-V237 HydrophobicContact CG2-CG2 3.85Å
232	K	66.2	Low	65.2	Low	106 Å²	106	74.7 Å²	74.7	46%	0.461	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.2	168.3	-70.9	-172.9	177.6	-175.3	0	113.5	E221 F411	E221-K232 HydrophobicContact CB-CG 4.39Å; E221-K232 WeakPolarHBondContact OE2-CE 3.41Å; E221-K232 IonicContact OE2-NZ 2.7Å; E221-K232 PolarHBondContact OE2-NZ 3.49Å; K232-F411 HydrophobicContact CG-CE1 4.25Å
233	N	64.8	Low	65	Low	120 Å²	120	75.2 Å²	75.2	64%	0.642	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	7.4	177.7	-59.4	-11.6	0	0	0	112.5	T231 E235	T231-N233 PolarHBondContact O-N 3.45Å; T231-N233 VanDerWaalsContact O-N 3.09Å; T231-N233 PolarHBondContact OG1-N 3.27Å; N233-E235 VanDerWaalsContact C-N 3.29Å; N233-E235 HydrophobicContact CB-CG 4.41Å; N233-E235 PolarHBondContact O-N 3.47Å
234	F	60.4	Low	64.9	Low	95 Å²	95	78 Å²	78	42%	0.417	39%	0.393	S	S	.	.			trans	63.1	26.2	-176.5	-60.2	-83.8	0	0	0	115.3	L223 T231	L223-F234 HydrophobicContact CD2-CE1 4.17Å; T231-F234 WeakPolarHBondContact O-CA 3.22Å; T231-F234 PolarHBondContact O-N 3.46Å
235	E	66.6	Low	65.2	Low	117 Å²	117	76.4 Å²	76.4	55%	0.547	39%	0.386	S	S	.	.			trans	-79.4	133.9	172.4	-64.6	162.6	-175.4	0	0	110.3	Y230 T231 N233	Y230-E235 CarbonylContact C-O 3.42Å; Y230-E235 VanDerWaalsContact CA-O 3.28Å; Y230-E235 WeakPolarHBondContact CA-O 3.35Å; T231-E235 HydrophobicContact CG2-CB 4.19Å; T231-E235 PolarHBondContact N-O 3.29Å; T231-E235 WeakPolarHBondContact OG1-CB 3.14Å; T231-E235 PolarHBondContact OG1-N 3.01Å; T231-E235 VanDerWaalsContact OG1-N 3.13Å; N233-E235 VanDerWaalsContact C-N 3.29Å; N233-E235 HydrophobicContact CB-CG 4.41Å; N233-E235 PolarHBondContact O-N 3.47Å
236	L	58	Low	65.9	Low	91 Å²	91	75.2 Å²	75.2	48%	0.476	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.3	-177.5	177.4	64.6	0	0	0	111.4	K228 F229 Y230	K228-L236 HydrophobicContact CB-CD1 3.49Å; K228-L236 VanDerWaalsContact CB-CD1 3.49Å; K228-L236 HydrophobicContact CD-CD1 3.68Å; K228-L236 HydrophobicContact CD-CD2 4.26Å; K228-L236 HydrophobicContact CG-CD1 3.73Å; F229-L236 CarbonylContact O-C 3.51Å; F229-L236 WeakPolarHBondContact O-CA 3.26Å; Y230-L236 HydrophobicContact CE1-CD1 4.42Å
237	V	61.4	Low	66.4	Low	50 Å²	50	70 Å²	70	30%	0.303	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.4	176.1	-174.3	0	0	0	0	109.9	Y222 F229 T231	Y222-V237 HydrophobicContact CE1-CG2 4.1Å; F229-V237 HydrophobicContact CB-CB 4.35Å; F229-V237 PolarHBondContact O-N 3.47Å; T231-V237 HydrophobicContact CG2-CG2 3.85Å
238	R	53.6	Low	66.9	Low	243 Å²	243	71.7 Å²	71.7	92%	0.917	35%	0.348	S	S	*	.			trans	-89.4	117.2	170.1	-65.3	-174.1	-173.4	-176.5	2.6	108.6
239	S	54.5	Low	67.3	Low	33 Å²	33	67.7 Å²	67.7	23%	0.231	34%	0.337	C	S	.	.			trans	-159	143.8	174.6	160.3	0	0	0	0	109.7	F229 E244 K396	F229-S239 WeakPolarHBondContact CD2-O 3.38Å; F229-S239 WeakPolarHBondContact CE2-O 3.4Å; S239-E244 PolarHBondContact OG-OE2 2.74Å; S239-K396 PolarHBondContact OG-NZ 3.45Å
240	L	55.2	Low	67.9	Low	114 Å²	114	68 Å²	68	60%	0.597	34%	0.339	S	S	*	.			trans	-75.1	157.4	168.4	-77.4	121.5	0	0	0	111.6	E244 R365 K396	L240-E244 HydrophobicContact CB-CG 4.02Å; L240-E244 WeakPolarHBondContact CB-OE1 3.45Å; L240-E244 PolarHBondContact N-OE1 3.05Å; L240-R365 PolarHBondContact O-NH1 3.43Å; L240-K396 PolarHBondContact O-NZ 2.62Å; L240-K396 VanDerWaalsContact O-NZ 3.16Å
241	L	64.3	Low	68.7	Low	67 Å²	67	65.2 Å²	65.2	35%	0.351	33%	0.33	S	S	.	.	S	Bend	trans	-78.7	-54.3	-166.7	-168.9	69.6	0	0	0	113.7	F229 R365 I367 K396	F229-L241 HydrophobicContact CE1-CD1 3.97Å; F229-L241 HydrophobicContact CZ-CD1 3.64Å; L241-R365 VanDerWaalsContact O-CD 3.3Å; L241-R365 WeakPolarHBondContact O-CD 3.35Å; L241-R365 PolarHBondContact O-NH1 2.94Å; L241-I367 HydrophobicContact CD1-CD1 3.82Å; L241-I367 HydrophobicContact CD1-CG1 3.96Å; L241-I367 HydrophobicContact CD1-CG2 4.24Å; L241-I367 HydrophobicContact CD2-CD1 4.17Å; L241-I367 HydrophobicContact CD2-CG2 4.46Å; L241-I367 HydrophobicContact CG-CD1 3.58Å; L241-I367 HydrophobicContact CG-CG1 4.28Å; L241-K396 HydrophobicContact CD1-CD 3.99Å
242	C	66.1	Low	69.6	Low	21 Å²	21	64.1 Å²	64.1	14%	0.142	32%	0.323	C	S	.	.	S	Bend	trans	-118.4	-45.4	-172.7	-60.6	0	0	0	0	113.9	E244 T245 V246 I367	C242-E244 PolarHBondContact O-N 3.31Å; C242-T245 PolarHBondContact O-N 3.41Å; C242-V246 PolarHBondContact O-N 2.66Å; C242-I367 VanDerWaalsContact SG-CD1 3.51Å
243	L	72.8	Confident	70.6	Confident	43 Å²	43	59.1 Å²	59.1	23%	0.225	30%	0.302	C	S	.	.	H	α-helix	trans	-56	-44.5	-168	-154	91	0	0	0	114	T245 V246 I247 L276 L283	L243-T245 PolarHBondContact O-N 2.85Å; L243-V246 PolarHBondContact O-N 3.39Å; L243-V246 VanDerWaalsContact O-N 3.16Å; L243-I247 HydrophobicContact CD2-CD1 3.7Å; L243-I247 HydrophobicContact CG-CD1 3.84Å; L243-I247 HydrophobicContact CG-CG1 4.45Å; L243-I247 VanDerWaalsContact O-CG1 3.32Å; L243-I247 WeakPolarHBondContact O-CG1 3.47Å; L243-I247 PolarHBondContact O-N 2.9Å; L243-L276 HydrophobicContact CD1-CD1 3.4Å; L243-L276 HydrophobicContact CD2-CD1 4.12Å; L243-L276 HydrophobicContact CG-CD1 4.41Å; L243-L283 HydrophobicContact CD2-CD1 4.16Å; L243-L283 HydrophobicContact CD2-CD2 4.09Å
244	E	72	Confident	71.7	Confident	69 Å²	69	53.8 Å²	53.8	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-55.3	-36	178	-69.3	169.1	-179.8	0	0	112.8	S239 L240 C242 V248 R365	S239-E244 PolarHBondContact OG-OE2 2.74Å; L240-E244 HydrophobicContact CB-CG 4.02Å; L240-E244 WeakPolarHBondContact CB-OE1 3.45Å; L240-E244 PolarHBondContact N-OE1 3.05Å; C242-E244 PolarHBondContact O-N 3.31Å; E244-V248 VanDerWaalsContact O-CG2 3.27Å; E244-V248 WeakPolarHBondContact O-CG2 3.41Å; E244-R365 IonicContact OE2-NH1 3.44Å; E244-R365 IonicContact OE2-NH2 3.7Å
245	T	76.7	Confident	73	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-78.3	-38.9	-177.9	-53.9	0	0	0	0	110.7	C242 L243 V248 C250 V252 K364 R365	C242-T245 PolarHBondContact O-N 3.41Å; L243-T245 PolarHBondContact O-N 2.85Å; T245-V248 PolarHBondContact O-N 3.46Å; T245-C250 HydrophobicContact CG2-CB 3.6Å; T245-C250 WeakPolarHBondContact O-CB 3.31Å; T245-C250 PolarHBondContact O-N 3Å; T245-V252 HydrophobicContact CG2-CG2 3.58Å; T245-K364 HydrophobicContact CG2-CB 4.11Å; T245-K364 HydrophobicContact CG2-CD 4.3Å; T245-K364 HydrophobicContact CG2-CG 4.41Å; T245-R365 HydrophobicContact CG2-CB 4.17Å; T245-R365 PolarHBondContact OG1-NE 3.48Å; T245-R365 VanDerWaalsContact OG1-NE 3.1Å; T245-R365 PolarHBondContact OG1-NH1 3.08Å; T245-R365 PolarHBondContact OG1-NH2 3.39Å
246	V	80	Confident	73.8	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-44	177.1	178.6	0	0	0	0	110.8	C242 L243 V248 G249 V252 L287 L290 R347 V348	C242-V246 PolarHBondContact O-N 2.66Å; L243-V246 PolarHBondContact O-N 3.39Å; L243-V246 VanDerWaalsContact O-N 3.16Å; V246-V248 PolarHBondContact O-N 3.29Å; V246-G249 WeakPolarHBondContact O-CA 3.28Å; V246-G249 PolarHBondContact O-N 3.44Å; V246-V252 HydrophobicContact CG2-CG2 4.29Å; V246-L287 HydrophobicContact CG1-CD2 4.27Å; V246-L290 VanDerWaalsContact O-CD1 3.32Å; V246-L290 WeakPolarHBondContact O-CD1 3.49Å; V246-R347 HydrophobicContact CG1-CB 4.05Å; V246-R347 HydrophobicContact CG1-CG 4.35Å; V246-R347 HydrophobicContact CG2-CB 4.36Å; V246-V348 HydrophobicContact CG2-CG2 3.6Å
247	I	77.6	Confident	74.6	Confident	34 Å²	34	44.8 Å²	44.8	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-28.3	179.5	-67.2	164.4	0	0	0	112.3	L243 G249 L283 L287	L243-I247 HydrophobicContact CD2-CD1 3.7Å; L243-I247 HydrophobicContact CG-CD1 3.84Å; L243-I247 HydrophobicContact CG-CG1 4.45Å; L243-I247 VanDerWaalsContact O-CG1 3.32Å; L243-I247 WeakPolarHBondContact O-CG1 3.47Å; L243-I247 PolarHBondContact O-N 2.9Å; I247-G249 PolarHBondContact O-N 3.1Å; I247-L283 HydrophobicContact CD1-CD1 3.59Å; I247-L283 HydrophobicContact CD1-CD2 4.27Å; I247-L283 HydrophobicContact CD1-CG 3.83Å; I247-L287 HydrophobicContact CG1-CD2 4.08Å
248	V	77.2	Confident	75.5	Confident	94 Å²	94	45.9 Å²	45.9	57%	0.57	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	6.5	173.8	-179.3	0	0	0	0	111.5	E244 T245 V246 C250	E244-V248 VanDerWaalsContact O-CG2 3.27Å; E244-V248 WeakPolarHBondContact O-CG2 3.41Å; T245-V248 PolarHBondContact O-N 3.46Å; V246-V248 PolarHBondContact O-N 3.29Å; V248-C250 VanDerWaalsContact C-N 3.28Å; V248-C250 PolarHBondContact O-N 2.79Å
249	G	76	Confident	76.9	Confident	21 Å²	21	36.8 Å²	36.8	22%	0.216	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	17.6	-178.5	0	0	0	0	0	113.7	V246 I247 R347	V246-G249 WeakPolarHBondContact O-CA 3.28Å; V246-G249 PolarHBondContact O-N 3.44Å; I247-G249 PolarHBondContact O-N 3.1Å; G249-R347 PolarHBondContact O-NH1 2.98Å
250	C	82.5	Confident	78.2	Confident	13 Å²	13	38.3 Å²	38.3	9%	0.088	23%	0.23	C	C	.	.			trans	-102.6	148.4	-176.9	-68	0	0	0	0	112.6	T245 V248 K364	T245-C250 HydrophobicContact CG2-CB 3.6Å; T245-C250 WeakPolarHBondContact O-CB 3.31Å; T245-C250 PolarHBondContact O-N 3Å; V248-C250 VanDerWaalsContact C-N 3.28Å; V248-C250 PolarHBondContact O-N 2.79Å; C250-K364 HydrophobicContact CB-CB 3.8Å; C250-K364 HydrophobicContact CB-CD 3.66Å; C250-K364 HydrophobicContact CB-CG 4.38Å; C250-K364 WeakPolarHBondContact SG-CD 3.33Å
251	G	86.5	Confident	79.6	Confident	5 Å²	5	37.9 Å²	37.9	5%	0.052	22%	0.221	C	C	.	.			trans	-79.7	146.9	178.2	0	0	0	0	0	113.2	R347 K364	G251-R347 CarbonylContact C-O 3.5Å; G251-R347 WeakPolarHBondContact CA-O 3.47Å; G251-K364 PolarHBondContact O-N 3.5Å; G251-K364 VanDerWaalsContact O-N 3.14Å
252	V	88.5	Confident	80.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.9	176.2	-175.6	0	0	0	0	109.9	T245 V246 V254 R347 V348 L349 R365 I367	T245-V252 HydrophobicContact CG2-CG2 3.58Å; V246-V252 HydrophobicContact CG2-CG2 4.29Å; V252-V254 HydrophobicContact CG1-CG2 4.05Å; V252-R347 PolarHBondContact N-O 2.92Å; V252-V348 HydrophobicContact CB-CG2 4.42Å; V252-V348 WeakPolarHBondContact O-CA 3.25Å; V252-L349 PolarHBondContact O-N 2.97Å; V252-R365 WeakPolarHBondContact CA-O 3.39Å; V252-R365 HydrophobicContact CG2-CB 4.5Å; V252-I367 HydrophobicContact CG1-CD1 3.76Å
253	L	88.9	Confident	82	Confident	2 Å²	2	36 Å²	36	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.4	171	-78.4	167	0	0	0	110.1	F255 F341 L349 L355 L361 A363 R365 V366 I367 R383	L253-F255 HydrophobicContact CB-CE2 4.4Å; L253-F341 HydrophobicContact CD2-CZ 4.37Å; L253-F341 HydrophobicContact CG-CE1 4.45Å; L253-F341 HydrophobicContact CG-CZ 4.03Å; L253-L349 WeakPolarHBondContact CA-O 3.44Å; L253-L349 HydrophobicContact CD2-CB 3.95Å; L253-L349 HydrophobicContact CD2-CD2 3.97Å; L253-L349 HydrophobicContact CD2-CG 4.24Å; L253-L355 HydrophobicContact CD2-CD2 3.78Å; L253-L361 WeakPolarHBondContact CD1-O 3.36Å; L253-A363 HydrophobicContact CB-CB 4.17Å; L253-A363 HydrophobicContact CD1-CB 3.58Å; L253-A363 HydrophobicContact CG-CB 3.66Å; L253-R365 PolarHBondContact N-O 3.13Å; L253-V366 HydrophobicContact CB-CG2 4.17Å; L253-V366 HydrophobicContact CD1-CG2 4.41Å; L253-V366 CarbonylContact O-C 3.57Å; L253-V366 WeakPolarHBondContact O-CA 3.47Å; L253-I367 PolarHBondContact O-N 2.65Å; L253-R383 HydrophobicContact CD1-CB 3.97Å
254	V	88	Confident	82.8	Confident	8 Å²	8	41.4 Å²	41.4	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	109.9	-179.7	-174	0	0	0	0	110	V252 L265 V348 L349 V350 A351 I367	V252-V254 HydrophobicContact CG1-CG2 4.05Å; V254-L265 HydrophobicContact CG1-CD2 3.72Å; V254-V348 HydrophobicContact CG2-CG1 4.15Å; V254-L349 PolarHBondContact N-O 2.98Å; V254-V350 HydrophobicContact CB-CG1 4.3Å; V254-V350 HydrophobicContact CB-CG2 4.29Å; V254-V350 HydrophobicContact CG1-CG1 4.42Å; V254-V350 CarbonylContact O-C 3.55Å; V254-V350 VanDerWaalsContact O-CA 3.29Å; V254-V350 WeakPolarHBondContact O-CA 3.48Å; V254-A351 PolarHBondContact O-N 2.69Å; V254-I367 CarbonylContact C-O 3.39Å; V254-I367 WeakPolarHBondContact CA-O 3.31Å; V254-I367 HydrophobicContact CG1-CB 4.32Å; V254-I367 HydrophobicContact CG1-CG2 4.28Å; V254-I367 HydrophobicContact CG2-CB 4.36Å; V254-I367 HydrophobicContact CG2-CD1 4.03Å
255	F	86.8	Confident	83.5	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.1	179.4	-71.3	-80.4	0	0	0	113.1	L253 A351 L355 V366 I367 G369 M380	L253-F255 HydrophobicContact CB-CE2 4.4Å; F255-A351 CarbonylContact C-O 3.58Å; F255-A351 VanDerWaalsContact CA-O 3.23Å; F255-A351 WeakPolarHBondContact CA-O 3.39Å; F255-A351 HydrophobicContact CD1-CB 4.29Å; F255-A351 HydrophobicContact CE1-CB 4.27Å; F255-L355 HydrophobicContact CE1-CB 4.13Å; F255-V366 HydrophobicContact CD2-CG1 3.66Å; F255-V366 HydrophobicContact CE2-CG1 3.73Å; F255-I367 PolarHBondContact N-O 2.95Å; F255-G369 PolarHBondContact O-N 3.29Å; F255-G369 VanDerWaalsContact O-N 3.09Å; F255-M380 HydrophobicContact CB-CG 4.37Å; F255-M380 HydrophobicContact CB-SD 3.34Å; F255-M380 WeakPolarHBondContact CB-SD 3.34Å; F255-M380 HydrophobicContact CD1-CG 3.77Å; F255-M380 HydrophobicContact CD1-SD 3.57Å; F255-M380 VanDerWaalsContact CD1-SD 3.57Å; F255-M380 HydrophobicContact CD2-CB 3.61Å; F255-M380 HydrophobicContact CD2-CG 3.68Å; F255-M380 HydrophobicContact CD2-SD 3.81Å; F255-M380 HydrophobicContact CE1-CG 3.85Å; F255-M380 HydrophobicContact CE1-SD 4.26Å; F255-M380 HydrophobicContact CE2-CB 3.6Å; F255-M380 HydrophobicContact CE2-CG 3.76Å; F255-M380 HydrophobicContact CE2-SD 4.47Å; F255-M380 HydrophobicContact CG-CB 4.13Å; F255-M380 HydrophobicContact CG-CG 3.68Å; F255-M380 HydrophobicContact CG-SD 3.29Å; F255-M380 WeakPolarHBondContact CG-SD 3.33Å; F255-M380 HydrophobicContact CZ-CB 4.11Å; F255-M380 HydrophobicContact CZ-CG 3.84Å
256	C	82.4	Confident	84.3	Confident	13 Å²	13	39.4 Å²	39.4	9%	0.088	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154.7	-179	-68.3	0	0	0	0	111.7	W261 C262 L265 V350 A351	C256-W261 VanDerWaalsContact SG-CD1 3.59Å; C256-C262 HydrophobicContact CB-CB 4.27Å; C256-L265 WeakPolarHBondContact SG-CD2 3.45Å; C256-V350 WeakPolarHBondContact SG-CG1 3.36Å; C256-A351 PolarHBondContact N-O 2.91Å
257	S	75.5	Confident	84.8	Confident	94 Å²	94	41.5 Å²	41.5	66%	0.657	23%	0.228	S	C	*	.	S	Bend	trans	-80.8	-31.7	-179.1	52	0	0	0	0	113.9
258	T	80.9	Confident	85.3	Confident	74 Å²	74	43.8 Å²	43.8	45%	0.454	24%	0.24	S	C	.	.	S	Bend	trans	-126	154.4	-176.3	71.3	0	0	0	0	112.1	W261 C262	T258-W261 PolarHBondContact O-N 2.95Å; T258-W261 WeakPolarHBondContact OG1-CB 3.07Å; T258-W261 PolarHBondContact OG1-N 2.89Å; T258-C262 WeakPolarHBondContact O-CB 3.26Å; T258-C262 PolarHBondContact O-N 3.2Å
259	K	82.7	Confident	85.8	Confident	52 Å²	52	40.6 Å²	40.6	23%	0.226	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-49.8	179.3	-61.4	178	-174.7	175.1	0	111.7	W261 C262 E263 H326 T352	K259-W261 VanDerWaalsContact C-N 3.26Å; K259-W261 PolarHBondContact O-N 3.46Å; K259-C262 WeakPolarHBondContact O-CA 3.46Å; K259-C262 WeakPolarHBondContact O-CB 3.08Å; K259-C262 PolarHBondContact O-N 3.27Å; K259-E263 PolarHBondContact O-N 3.25Å; K259-H326 HydrophobicContact CG-CB 4.23Å; K259-T352 HydrophobicContact CG-CG2 4.24Å
260	A	82.4	Confident	86.5	Confident	64 Å²	64	39.7 Å²	39.7	53%	0.529	21%	0.21	S	C	.	.	H	α-helix	trans	-58.6	-36.6	177.3	0	0	0	0	0	112.9	R264	A260-R264 VanDerWaalsContact O-CB 3.29Å; A260-R264 WeakPolarHBondContact O-CB 3.13Å; A260-R264 PolarHBondContact O-N 3.34Å
261	W	84.4	Confident	86.8	Confident	106 Å²	106	44.1 Å²	44.1	40%	0.402	23%	0.229	S	C	.	.	H	α-helix	trans	-72.4	-35.8	174	-177.3	-118.4	0	0	0	112.3	C256 T258 K259 R264 L265 L268	C256-W261 VanDerWaalsContact SG-CD1 3.59Å; T258-W261 PolarHBondContact O-N 2.95Å; T258-W261 WeakPolarHBondContact OG1-CB 3.07Å; T258-W261 PolarHBondContact OG1-N 2.89Å; K259-W261 VanDerWaalsContact C-N 3.26Å; K259-W261 PolarHBondContact O-N 3.46Å; W261-R264 HydrophobicContact CE3-CB 4.27Å; W261-R264 HydrophobicContact CE3-CG 4.42Å; W261-R264 HydrophobicContact CZ3-CG 4.27Å; W261-R264 PolarHBondContact O-N 2.86Å; W261-L265 HydrophobicContact CD2-CB 4.48Å; W261-L265 HydrophobicContact CZ2-CB 4.33Å; W261-L265 HydrophobicContact CZ2-CD1 4.03Å; W261-L265 WeakPolarHBondContact O-CB 2.91Å; W261-L265 PolarHBondContact O-N 3.39Å; W261-L268 HydrophobicContact CH2-CD1 4.23Å; W261-L268 HydrophobicContact CZ3-CD1 4.41Å
262	C	88.5	Confident	86.6	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.9	-50.2	174.1	-166.9	0	0	0	0	111.2	C256 T258 K259 A266 V350 A351 T352	C256-C262 HydrophobicContact CB-CB 4.27Å; T258-C262 WeakPolarHBondContact O-CB 3.26Å; T258-C262 PolarHBondContact O-N 3.2Å; K259-C262 WeakPolarHBondContact O-CA 3.46Å; K259-C262 WeakPolarHBondContact O-CB 3.08Å; K259-C262 PolarHBondContact O-N 3.27Å; C262-A266 WeakPolarHBondContact O-CB 3.07Å; C262-A266 PolarHBondContact O-N 3.11Å; C262-A266 VanDerWaalsContact O-N 3.08Å; C262-V350 HydrophobicContact CB-CG1 4.45Å; C262-V350 PolarHBondContact SG-O 2.79Å; C262-A351 VanDerWaalsContact SG-CA 3.58Å; C262-T352 HydrophobicContact CB-CG2 4.29Å
263	E	91.5	Very high	86.5	Confident	47 Å²	47	46.6 Å²	46.6	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-51.2	176.6	-68.3	169.1	-139.2	0	0	111.6	K259 L265 A266 L267 V313 F324 H326	K259-E263 PolarHBondContact O-N 3.25Å; E263-L265 PolarHBondContact O-N 2.93Å; E263-A266 PolarHBondContact O-N 3.33Å; E263-L267 PolarHBondContact O-N 3.48Å; E263-V313 HydrophobicContact CB-CG1 4.21Å; E263-V313 HydrophobicContact CB-CG2 4.44Å; E263-F324 HydrophobicContact CG-CD2 3.88Å; E263-F324 HydrophobicContact CG-CE1 4.5Å; E263-F324 HydrophobicContact CG-CE2 3.69Å; E263-F324 HydrophobicContact CG-CG 4.36Å; E263-F324 HydrophobicContact CG-CZ 4.02Å; E263-H326 IonicContact OE1-CE1 2.78Å; E263-H326 IonicContact OE1-NE2 3.18Å; E263-H326 PolarHBondContact OE1-NE2 3.43Å
264	R	90	Very high	86.4	Confident	157 Å²	157	50.8 Å²	50.8	59%	0.592	27%	0.266	S	S	*	.	H	α-helix	trans	-61.4	-42.1	-180	-173	-177.8	-64.3	176.4	-0.8	112.4	A260 W261 A266 L267 L268	A260-R264 VanDerWaalsContact O-CB 3.29Å; A260-R264 WeakPolarHBondContact O-CB 3.13Å; A260-R264 PolarHBondContact O-N 3.34Å; W261-R264 HydrophobicContact CE3-CB 4.27Å; W261-R264 HydrophobicContact CE3-CG 4.42Å; W261-R264 HydrophobicContact CZ3-CG 4.27Å; W261-R264 PolarHBondContact O-N 2.86Å; R264-A266 VanDerWaalsContact C-N 3.33Å; R264-L267 WeakPolarHBondContact O-CB 3.41Å; R264-L267 PolarHBondContact O-N 2.87Å; R264-L268 HydrophobicContact CG-CD1 4.28Å; R264-L268 WeakPolarHBondContact O-CG 3.4Å; R264-L268 PolarHBondContact O-N 3.46Å
265	L	87	Confident	86.1	Confident	32 Å²	32	56.9 Å²	56.9	17%	0.168	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-36.9	179.2	-177.7	61.7	0	0	0	111.2	V254 C256 W261 E263 L267 L268 I269 V350	V254-L265 HydrophobicContact CG1-CD2 3.72Å; C256-L265 WeakPolarHBondContact SG-CD2 3.45Å; W261-L265 HydrophobicContact CD2-CB 4.48Å; W261-L265 HydrophobicContact CZ2-CB 4.33Å; W261-L265 HydrophobicContact CZ2-CD1 4.03Å; W261-L265 WeakPolarHBondContact O-CB 2.91Å; W261-L265 PolarHBondContact O-N 3.39Å; E263-L265 PolarHBondContact O-N 2.93Å; L265-L267 VanDerWaalsContact C-N 3.34Å; L265-L268 PolarHBondContact O-N 2.98Å; L265-I269 HydrophobicContact CD1-CD1 4.16Å; L265-I269 HydrophobicContact CD1-CG1 4.28Å; L265-I269 HydrophobicContact CG-CD1 3.94Å; L265-I269 HydrophobicContact CG-CG1 4.47Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.5Å; L265-I269 PolarHBondContact O-N 3.32Å; L265-V350 HydrophobicContact CB-CG1 4.27Å; L265-V350 HydrophobicContact CD2-CG1 3.97Å; L265-V350 HydrophobicContact CG-CG1 4.33Å
266	A	92.1	Very high	85.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-41.7	173.2	0	0	0	0	0	111.6	C262 E263 R264 I269 A270 T317 V322 F324 V350	C262-A266 WeakPolarHBondContact O-CB 3.07Å; C262-A266 PolarHBondContact O-N 3.11Å; C262-A266 VanDerWaalsContact O-N 3.08Å; E263-A266 PolarHBondContact O-N 3.33Å; R264-A266 VanDerWaalsContact C-N 3.33Å; A266-I269 PolarHBondContact O-N 2.83Å; A266-A270 VanDerWaalsContact O-CB 3.3Å; A266-A270 WeakPolarHBondContact O-CB 3.28Å; A266-A270 PolarHBondContact O-N 2.94Å; A266-T317 HydrophobicContact CB-CG2 4.08Å; A266-V322 HydrophobicContact CB-CG1 4.13Å; A266-F324 HydrophobicContact CB-CB 3.86Å; A266-F324 HydrophobicContact CB-CD1 4.37Å; A266-V350 HydrophobicContact CB-CB 4.32Å; A266-V350 HydrophobicContact CB-CG2 3.99Å
267	L	91.9	Very high	85.9	Confident	50 Å²	50	60.1 Å²	60.1	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-50.1	173.1	-72	167.3	0	0	0	112	E263 R264 L265 I269 A270 E271 V313 T317	E263-L267 PolarHBondContact O-N 3.48Å; R264-L267 WeakPolarHBondContact O-CB 3.41Å; R264-L267 PolarHBondContact O-N 2.87Å; L265-L267 VanDerWaalsContact C-N 3.34Å; L267-I269 VanDerWaalsContact C-N 3.3Å; L267-I269 PolarHBondContact O-N 3.47Å; L267-A270 WeakPolarHBondContact O-CB 3.25Å; L267-A270 PolarHBondContact O-N 3.4Å; L267-A270 VanDerWaalsContact O-N 3.1Å; L267-E271 WeakPolarHBondContact O-CB 3.43Å; L267-E271 WeakPolarHBondContact O-CG 3.31Å; L267-E271 PolarHBondContact O-N 2.85Å; L267-V313 HydrophobicContact CD1-CG1 4.1Å; L267-V313 HydrophobicContact CD1-CG2 4.44Å; L267-V313 HydrophobicContact CD2-CG1 4.02Å; L267-V313 HydrophobicContact CG-CG1 3.8Å; L267-T317 HydrophobicContact CD2-CG2 3.86Å; L267-T317 HydrophobicContact CG-CG2 4.25Å
268	L	88.1	Confident	86.2	Confident	81 Å²	81	61.5 Å²	61.5	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-60.5	-38.9	-179.9	-70.5	171.4	0	0	0	112.6	W261 R264 L265 A272	W261-L268 HydrophobicContact CH2-CD1 4.23Å; W261-L268 HydrophobicContact CZ3-CD1 4.41Å; R264-L268 HydrophobicContact CG-CD1 4.28Å; R264-L268 WeakPolarHBondContact O-CG 3.4Å; R264-L268 PolarHBondContact O-N 3.46Å; L265-L268 PolarHBondContact O-N 2.98Å; L268-A272 WeakPolarHBondContact O-CB 3.17Å; L268-A272 PolarHBondContact O-N 2.65Å
269	I	87.4	Confident	86.1	Confident	27 Å²	27	61.4 Å²	61.4	14%	0.138	31%	0.311	C	S	.	.	H	α-helix	trans	-69.4	-40.3	176.3	-65.6	168.8	0	0	0	110.5	L265 A266 L267 A272 I273 V322 V348 V350	L265-I269 HydrophobicContact CD1-CD1 4.16Å; L265-I269 HydrophobicContact CD1-CG1 4.28Å; L265-I269 HydrophobicContact CG-CD1 3.94Å; L265-I269 HydrophobicContact CG-CG1 4.47Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.5Å; L265-I269 PolarHBondContact O-N 3.32Å; A266-I269 PolarHBondContact O-N 2.83Å; L267-I269 VanDerWaalsContact C-N 3.3Å; L267-I269 PolarHBondContact O-N 3.47Å; I269-A272 PolarHBondContact O-N 3.32Å; I269-I273 HydrophobicContact CG2-CD1 4.05Å; I269-I273 WeakPolarHBondContact O-CG1 3.34Å; I269-I273 PolarHBondContact O-N 2.96Å; I269-V322 HydrophobicContact CB-CG1 4.36Å; I269-V322 HydrophobicContact CG2-CG1 4.29Å; I269-V322 HydrophobicContact CG2-CG2 3.91Å; I269-V348 HydrophobicContact CD1-CG1 4.18Å; I269-V348 HydrophobicContact CG2-CG1 4.34Å; I269-V350 HydrophobicContact CD1-CG2 4.03Å
270	A	90.5	Very high	85.3	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.017	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-43.9	177.3	0	0	0	0	0	111.9	A266 L267 I273 K274 T317 Y320 V322	A266-A270 VanDerWaalsContact O-CB 3.3Å; A266-A270 WeakPolarHBondContact O-CB 3.28Å; A266-A270 PolarHBondContact O-N 2.94Å; L267-A270 WeakPolarHBondContact O-CB 3.25Å; L267-A270 PolarHBondContact O-N 3.4Å; L267-A270 VanDerWaalsContact O-N 3.1Å; A270-I273 PolarHBondContact O-N 3.41Å; A270-K274 WeakPolarHBondContact O-CB 3.46Å; A270-K274 PolarHBondContact O-N 2.9Å; A270-T317 HydrophobicContact CB-CG2 3.95Å; A270-Y320 HydrophobicContact CB-CD2 4.04Å; A270-V322 HydrophobicContact CB-CB 4.21Å; A270-V322 HydrophobicContact CB-CG2 4.29Å
271	E	88.6	Confident	85.1	Confident	106 Å²	106	64.2 Å²	64.2	50%	0.495	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-45.8	174	-75.5	172.2	179.1	0	0	111.4	L267 I273 K274 E275	L267-E271 WeakPolarHBondContact O-CB 3.43Å; L267-E271 WeakPolarHBondContact O-CG 3.31Å; L267-E271 PolarHBondContact O-N 2.85Å; E271-I273 VanDerWaalsContact C-N 3.33Å; E271-I273 PolarHBondContact O-N 3.35Å; E271-K274 WeakPolarHBondContact O-CB 3.2Å; E271-K274 PolarHBondContact O-N 2.91Å; E271-E275 WeakPolarHBondContact O-CG 3.44Å; E271-E275 PolarHBondContact O-N 3.09Å
272	A	82.7	Confident	84.7	Confident	46 Å²	46	63.4 Å²	63.4	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-63.4	-36.8	176.6	0	0	0	0	0	112.9	L268 I269 L276	L268-A272 WeakPolarHBondContact O-CB 3.17Å; L268-A272 PolarHBondContact O-N 2.65Å; I269-A272 PolarHBondContact O-N 3.32Å; A272-L276 VanDerWaalsContact O-CG 3.28Å; A272-L276 WeakPolarHBondContact O-CG 3.14Å; A272-L276 PolarHBondContact O-N 3.34Å
273	I	85.3	Confident	84.1	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-69.8	-40.3	174.7	-70	172	0	0	0	110.5	I269 A270 E271 L276 L277 I291 V322	I269-I273 HydrophobicContact CG2-CD1 4.05Å; I269-I273 WeakPolarHBondContact O-CG1 3.34Å; I269-I273 PolarHBondContact O-N 2.96Å; A270-I273 PolarHBondContact O-N 3.41Å; E271-I273 VanDerWaalsContact C-N 3.33Å; E271-I273 PolarHBondContact O-N 3.35Å; I273-L276 PolarHBondContact O-N 3.2Å; I273-L277 HydrophobicContact CG2-CD1 3.94Å; I273-L277 HydrophobicContact CG2-CG 4.29Å; I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 2.78Å; I273-I291 HydrophobicContact CG2-CD1 3.82Å; I273-V322 HydrophobicContact CD1-CG2 3.63Å
274	K	86.8	Confident	83.5	Confident	91 Å²	91	65.2 Å²	65.2	40%	0.396	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-50.9	174.9	-179.8	-170.2	177.9	-173.2	0	111.2	A270 E271 L276 L277 D278 Y320	A270-K274 WeakPolarHBondContact O-CB 3.46Å; A270-K274 PolarHBondContact O-N 2.9Å; E271-K274 WeakPolarHBondContact O-CB 3.2Å; E271-K274 PolarHBondContact O-N 2.91Å; K274-L276 PolarHBondContact O-N 2.82Å; K274-L277 WeakPolarHBondContact O-CB 3.25Å; K274-L277 PolarHBondContact O-N 3.37Å; K274-D278 PolarHBondContact O-N 3.11Å; K274-Y320 HydrophobicContact CB-CD1 4.07Å; K274-Y320 HydrophobicContact CB-CE1 3.63Å; K274-Y320 HydrophobicContact CB-CE2 4.19Å; K274-Y320 HydrophobicContact CD-CE1 4.42Å; K274-Y320 HydrophobicContact CD-CE2 4.36Å; K274-Y320 VanDerWaalsContact CD-OH 3.28Å; K274-Y320 WeakPolarHBondContact CD-OH 3.48Å; K274-Y320 HydrophobicContact CG-CE1 3.73Å; K274-Y320 HydrophobicContact CG-CE2 4.44Å; K274-Y320 WeakPolarHBondContact CG-OH 3Å
275	E	83.3	Confident	83	Confident	136 Å²	136	60.8 Å²	60.8	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-56.9	-37.3	177.2	-73	178.6	177.1	0	0	112.2	E271 C279	E271-E275 WeakPolarHBondContact O-CG 3.44Å; E271-E275 PolarHBondContact O-N 3.09Å; E275-C279 PolarHBondContact O-N 2.94Å; E275-C279 PolarHBondContact O-SG 3.49Å
276	L	81.7	Confident	82.7	Confident	58 Å²	58	66.6 Å²	66.6	30%	0.304	38%	0.379	S	S	.	.	H	α-helix	trans	-71.9	-32.3	175.8	-70.7	171.3	0	0	0	113.2	L243 A272 I273 K274 C279 T284 L287	L243-L276 HydrophobicContact CD1-CD1 3.4Å; L243-L276 HydrophobicContact CD2-CD1 4.12Å; L243-L276 HydrophobicContact CG-CD1 4.41Å; A272-L276 VanDerWaalsContact O-CG 3.28Å; A272-L276 WeakPolarHBondContact O-CG 3.14Å; A272-L276 PolarHBondContact O-N 3.34Å; I273-L276 PolarHBondContact O-N 3.2Å; K274-L276 PolarHBondContact O-N 2.82Å; L276-C279 PolarHBondContact O-N 2.97Å; L276-T284 PolarHBondContact O-OG1 3.39Å; L276-L287 HydrophobicContact CB-CD1 4.24Å
277	L	82.5	Confident	82.3	Confident	29 Å²	29	66.6 Å²	66.6	15%	0.152	38%	0.379	C	S	.	.	H	α-helix	trans	-72.6	-30.2	175.9	-73.8	172.4	0	0	0	112.4	I273 K274 C279 T284 L287 N288 I291 Y320	I273-L277 HydrophobicContact CG2-CD1 3.94Å; I273-L277 HydrophobicContact CG2-CG 4.29Å; I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 2.78Å; K274-L277 WeakPolarHBondContact O-CB 3.25Å; K274-L277 PolarHBondContact O-N 3.37Å; L277-C279 VanDerWaalsContact C-N 3.26Å; L277-C279 PolarHBondContact O-N 2.84Å; L277-T284 VanDerWaalsContact O-CG2 3.25Å; L277-T284 WeakPolarHBondContact O-CG2 3.3Å; L277-L287 HydrophobicContact CD2-CB 3.71Å; L277-N288 WeakPolarHBondContact CD2-OD1 3.34Å; L277-I291 HydrophobicContact CD1-CD1 4.41Å; L277-Y320 HydrophobicContact CD1-CD1 3.86Å; L277-Y320 HydrophobicContact CD1-CE1 4.34Å
278	D	80.8	Confident	81.9	Confident	122 Å²	122	67.9 Å²	67.9	65%	0.652	39%	0.386	S	S	*	.	H	α-helix	trans	-75	-15.7	175.7	-66.5	-23.3	0	0	0	112.3	K274	K274-D278 PolarHBondContact O-N 3.11Å
279	C	79.5	Confident	81.7	Confident	72 Å²	72	67.6 Å²	67.6	49%	0.486	40%	0.395	S	S	.	.	S	Bend	trans	-83.4	149.8	176.6	-68	0	0	0	0	112.9	E275 L276 L277 T284	E275-C279 PolarHBondContact O-N 2.94Å; E275-C279 PolarHBondContact O-SG 3.49Å; L276-C279 PolarHBondContact O-N 2.97Å; L277-C279 VanDerWaalsContact C-N 3.26Å; L277-C279 PolarHBondContact O-N 2.84Å; C279-T284 VanDerWaalsContact O-CB 3.28Å; C279-T284 WeakPolarHBondContact O-CB 3.28Å; C279-T284 WeakPolarHBondContact O-CG2 3.45Å; C279-T284 PolarHBondContact O-OG1 3.19Å
280	S	67	Low	81.6	Confident	130 Å²	130	68.1 Å²	68.1	91%	0.909	40%	0.398	S	S	*	.			trans	-85.2	127.4	172.7	-45.9	0	0	0	0	112
281	G	77	Confident	81.4	Confident	45 Å²	45	68.2 Å²	68.2	46%	0.464	40%	0.398	S	S	.	.	S	Bend	trans	165.9	173.4	172.3	0	0	0	0	0	116	L283 T284 A285	G281-L283 VanDerWaalsContact C-N 3.26Å; G281-L283 PolarHBondContact O-N 3Å; G281-T284 WeakPolarHBondContact O-CB 3.4Å; G281-T284 PolarHBondContact O-N 3.12Å; G281-A285 PolarHBondContact O-N 2.97Å; G281-A285 VanDerWaalsContact O-N 3.1Å
282	S	77.2	Confident	81.2	Confident	90 Å²	90	67.3 Å²	67.3	63%	0.629	39%	0.394	S	S	*	.	H	α-helix	trans	-59.2	-35.7	177.4	173.8	0	0	0	0	112.9	A285 R286	S282-A285 PolarHBondContact O-N 3.18Å; S282-R286 PolarHBondContact O-N 3.03Å; S282-R286 VanDerWaalsContact O-N 3.12Å
283	L	74.7	Confident	81.4	Confident	70 Å²	70	69.2 Å²	69.2	37%	0.366	41%	0.405	S	S	.	.	H	α-helix	trans	-68.5	-41.6	178.7	-166.5	138.2	0	0	0	111.5	L243 I247 G281 R286 L287	L243-L283 HydrophobicContact CD2-CD1 4.16Å; L243-L283 HydrophobicContact CD2-CD2 4.09Å; I247-L283 HydrophobicContact CD1-CD1 3.59Å; I247-L283 HydrophobicContact CD1-CD2 4.27Å; I247-L283 HydrophobicContact CD1-CG 3.83Å; G281-L283 VanDerWaalsContact C-N 3.26Å; G281-L283 PolarHBondContact O-N 3Å; L283-R286 PolarHBondContact O-N 3.24Å; L283-L287 HydrophobicContact CD2-CD1 3.65Å; L283-L287 HydrophobicContact CD2-CG 4.26Å; L283-L287 WeakPolarHBondContact O-CG 3.43Å; L283-L287 PolarHBondContact O-N 2.83Å
284	T	78.7	Confident	81.6	Confident	15 Å²	15	77 Å²	77	9%	0.092	44%	0.441	C	S	.	.	H	α-helix	trans	-59.4	-46	173	-43.2	0	0	0	0	111.6	L276 L277 C279 G281 R286 L287 N288	L276-T284 PolarHBondContact O-OG1 3.39Å; L277-T284 VanDerWaalsContact O-CG2 3.25Å; L277-T284 WeakPolarHBondContact O-CG2 3.3Å; C279-T284 VanDerWaalsContact O-CB 3.28Å; C279-T284 WeakPolarHBondContact O-CB 3.28Å; C279-T284 WeakPolarHBondContact O-CG2 3.45Å; C279-T284 PolarHBondContact O-OG1 3.19Å; G281-T284 WeakPolarHBondContact O-CB 3.4Å; G281-T284 PolarHBondContact O-N 3.12Å; T284-R286 VanDerWaalsContact C-N 3.32Å; T284-R286 PolarHBondContact O-N 2.86Å; T284-L287 PolarHBondContact O-N 3.08Å; T284-N288 WeakPolarHBondContact O-CB 3.47Å; T284-N288 PolarHBondContact O-N 3.03Å; T284-N288 PolarHBondContact O-ND2 3.27Å
285	A	79.3	Confident	81.8	Confident	63 Å²	63	77.6 Å²	77.6	52%	0.521	44%	0.444	S	S	.	.	H	α-helix	trans	-60.3	-41.4	177.9	0	0	0	0	0	112.1	G281 S282 A289	G281-A285 PolarHBondContact O-N 2.97Å; G281-A285 VanDerWaalsContact O-N 3.1Å; S282-A285 PolarHBondContact O-N 3.18Å; A285-A289 WeakPolarHBondContact O-CB 3.33Å; A285-A289 PolarHBondContact O-N 2.85Å
286	R	81.8	Confident	82.1	Confident	154 Å²	154	71.3 Å²	71.3	58%	0.581	41%	0.414	S	S	*	.	H	α-helix	trans	-66	-41.5	174.3	-74.9	-176.8	178.2	179.1	0.3	112.7	S282 L283 T284 A289 L290	S282-R286 PolarHBondContact O-N 3.03Å; S282-R286 VanDerWaalsContact O-N 3.12Å; L283-R286 PolarHBondContact O-N 3.24Å; T284-R286 VanDerWaalsContact C-N 3.32Å; T284-R286 PolarHBondContact O-N 2.86Å; R286-A289 PolarHBondContact O-N 3.5Å; R286-L290 WeakPolarHBondContact O-CD1 3.47Å; R286-L290 VanDerWaalsContact O-CG 3.27Å; R286-L290 WeakPolarHBondContact O-CG 3.24Å; R286-L290 PolarHBondContact O-N 2.88Å; R286-L290 VanDerWaalsContact O-N 3.17Å
287	L	83.7	Confident	82.5	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-65.1	-43.9	177	-73.6	176.1	0	0	0	111.5	V246 I247 L276 L277 L283 T284 A289 L290 I291	V246-L287 HydrophobicContact CG1-CD2 4.27Å; I247-L287 HydrophobicContact CG1-CD2 4.08Å; L276-L287 HydrophobicContact CB-CD1 4.24Å; L277-L287 HydrophobicContact CD2-CB 3.71Å; L283-L287 HydrophobicContact CD2-CD1 3.65Å; L283-L287 HydrophobicContact CD2-CG 4.26Å; L283-L287 WeakPolarHBondContact O-CG 3.43Å; L283-L287 PolarHBondContact O-N 2.83Å; T284-L287 PolarHBondContact O-N 3.08Å; L287-A289 VanDerWaalsContact C-N 3.33Å; L287-A289 PolarHBondContact O-N 3.25Å; L287-L290 CarbonylContact O-C 3.58Å; L287-L290 PolarHBondContact O-N 2.92Å; L287-I291 WeakPolarHBondContact O-CB 3.43Å; L287-I291 WeakPolarHBondContact O-CG1 3.43Å; L287-I291 PolarHBondContact O-N 2.86Å
288	N	83.7	Confident	82.7	Confident	78 Å²	78	80.6 Å²	80.6	42%	0.417	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-40.2	174.6	-84.3	-37.4	0	0	0	112.4	L277 T284 L290 I291	L277-N288 WeakPolarHBondContact CD2-OD1 3.34Å; T284-N288 WeakPolarHBondContact O-CB 3.47Å; T284-N288 PolarHBondContact O-N 3.03Å; T284-N288 PolarHBondContact O-ND2 3.27Å; N288-L290 PolarHBondContact O-N 2.87Å; N288-I291 CarbonylContact O-C 3.58Å; N288-I291 PolarHBondContact O-N 3.24Å; N288-I291 VanDerWaalsContact O-O 3.11Å
289	A	84.1	Confident	83.2	Confident	74 Å²	74	75.4 Å²	75.4	61%	0.612	43%	0.425	S	S	*	.	H	α-helix	trans	-65.8	-26.7	175.6	0	0	0	0	0	113.1	A285 R286 L287	A285-A289 WeakPolarHBondContact O-CB 3.33Å; A285-A289 PolarHBondContact O-N 2.85Å; R286-A289 PolarHBondContact O-N 3.5Å; L287-A289 VanDerWaalsContact C-N 3.33Å; L287-A289 PolarHBondContact O-N 3.25Å
290	L	84.3	Confident	83.7	Confident	38 Å²	38	73 Å²	73	20%	0.199	41%	0.407	C	S	.	.	H	α-helix	trans	-91.2	-29.6	179.2	-70.3	168.9	0	0	0	113.4	V246 R286 L287 N288	V246-L290 VanDerWaalsContact O-CD1 3.32Å; V246-L290 WeakPolarHBondContact O-CD1 3.49Å; R286-L290 WeakPolarHBondContact O-CD1 3.47Å; R286-L290 VanDerWaalsContact O-CG 3.27Å; R286-L290 WeakPolarHBondContact O-CG 3.24Å; R286-L290 PolarHBondContact O-N 2.88Å; R286-L290 VanDerWaalsContact O-N 3.17Å; L287-L290 CarbonylContact O-C 3.58Å; L287-L290 PolarHBondContact O-N 2.92Å; N288-L290 PolarHBondContact O-N 2.87Å
291	I	86.8	Confident	84.5	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	39%	0.386	C	S	.	.	S	Bend	trans	-109.1	81.9	-179.3	-54.4	174.1	0	0	0	107.3	I273 L277 L287 N288 S293 Q296 A321	I273-I291 HydrophobicContact CG2-CD1 3.82Å; L277-I291 HydrophobicContact CD1-CD1 4.41Å; L287-I291 WeakPolarHBondContact O-CB 3.43Å; L287-I291 WeakPolarHBondContact O-CG1 3.43Å; L287-I291 PolarHBondContact O-N 2.86Å; N288-I291 CarbonylContact O-C 3.58Å; N288-I291 PolarHBondContact O-N 3.24Å; N288-I291 VanDerWaalsContact O-O 3.11Å; I291-S293 PolarHBondContact O-N 2.96Å; I291-Q296 HydrophobicContact CG2-CG 4.1Å; I291-A321 HydrophobicContact CD1-CB 4.39Å; I291-A321 HydrophobicContact CG1-CB 4.02Å; I291-A321 HydrophobicContact CG2-CB 4.29Å
292	E	85.3	Confident	84.8	Confident	87 Å²	87	69.6 Å²	69.6	41%	0.407	37%	0.369	S	S	.	.			trans	-74.9	105.8	178.9	-66.2	173.3	-108.4	0	0	110.4	E294 K295 Q296	E292-E294 VanDerWaalsContact C-N 3.28Å; E292-E294 PolarHBondContact O-N 3.44Å; E292-K295 HydrophobicContact CB-CB 4.09Å; E292-K295 HydrophobicContact CB-CD 4.12Å; E292-K295 HydrophobicContact CB-CG 4.11Å; E292-K295 HydrophobicContact CG-CD 4.49Å; E292-K295 PolarHBondContact O-N 2.81Å; E292-K295 IonicContact OE1-NZ 3.88Å; E292-K295 PolarHBondContact OE1-NZ 3.13Å; E292-K295 WeakPolarHBondContact OE2-CD 3.5Å; E292-K295 WeakPolarHBondContact OE2-CE 3.19Å; E292-K295 IonicContact OE2-NZ 2.93Å; E292-K295 PolarHBondContact OE2-NZ 3.11Å; E292-Q296 PolarHBondContact O-N 3Å
293	S	86.8	Confident	85.1	Confident	87 Å²	87	65.4 Å²	65.4	61%	0.608	34%	0.339	S	S	*	.	H	α-helix	trans	-53.1	-39.5	-174.4	-58.8	0	0	0	0	114	I291 Q296 K297	I291-S293 PolarHBondContact O-N 2.96Å; S293-Q296 PolarHBondContact O-N 3.01Å; S293-K297 WeakPolarHBondContact O-CB 3.15Å; S293-K297 PolarHBondContact O-N 2.78Å
294	E	88.5	Confident	85.1	Confident	173 Å²	173	63.2 Å²	63.2	81%	0.808	33%	0.334	S	S	*	.	H	α-helix	trans	-66.3	-43.3	177.3	-70.3	-159	158.2	0	0	112.6	E292 Q296 K297 H298	E292-E294 VanDerWaalsContact C-N 3.28Å; E292-E294 PolarHBondContact O-N 3.44Å; E294-Q296 VanDerWaalsContact C-N 3.3Å; E294-Q296 PolarHBondContact O-N 3.24Å; E294-K297 PolarHBondContact O-N 3.45Å; E294-H298 WeakPolarHBondContact O-CB 3.12Å; E294-H298 PolarHBondContact O-N 3.47Å
295	K	90.1	Very high	84.7	Confident	104 Å²	104	68.2 Å²	68.2	45%	0.452	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-37.9	176.4	-69.8	-173.9	-178.7	157.5	0	111.2	E292 F299 L345	E292-K295 HydrophobicContact CB-CB 4.09Å; E292-K295 HydrophobicContact CB-CD 4.12Å; E292-K295 HydrophobicContact CB-CG 4.11Å; E292-K295 HydrophobicContact CG-CD 4.49Å; E292-K295 PolarHBondContact O-N 2.81Å; E292-K295 IonicContact OE1-NZ 3.88Å; E292-K295 PolarHBondContact OE1-NZ 3.13Å; E292-K295 WeakPolarHBondContact OE2-CD 3.5Å; E292-K295 WeakPolarHBondContact OE2-CE 3.19Å; E292-K295 IonicContact OE2-NZ 2.93Å; E292-K295 PolarHBondContact OE2-NZ 3.11Å; K295-F299 VanDerWaalsContact O-CB 3.27Å; K295-F299 WeakPolarHBondContact O-CB 3.36Å; K295-F299 PolarHBondContact O-N 3.08Å; K295-L345 HydrophobicContact CB-CD2 4.15Å
296	Q	91.4	Very high	84	Confident	5 Å²	5	69.8 Å²	69.8	2%	0.023	36%	0.363	C	S	.	.	H	α-helix	trans	-67.5	-41.6	176.7	-64.1	-59	-2.2	0	0	112.4	I291 E292 S293 E294 F299 L300 L318 L345	I291-Q296 HydrophobicContact CG2-CG 4.1Å; E292-Q296 PolarHBondContact O-N 3Å; S293-Q296 PolarHBondContact O-N 3.01Å; E294-Q296 VanDerWaalsContact C-N 3.3Å; E294-Q296 PolarHBondContact O-N 3.24Å; Q296-F299 PolarHBondContact O-N 2.96Å; Q296-L300 WeakPolarHBondContact O-CB 3.45Å; Q296-L300 PolarHBondContact O-N 2.92Å; Q296-L318 PolarHBondContact OE1-O 3.39Å; Q296-L345 PolarHBondContact NE2-O 2.92Å; Q296-L345 PolarHBondContact OE1-O 3.25Å
297	K	89.2	Confident	83.2	Confident	140 Å²	140	63.8 Å²	63.8	61%	0.609	35%	0.346	S	S	*	.	H	α-helix	trans	-61.1	-48.9	174.8	-174.3	179	177.5	-177.9	0	111.2	S293 E294 F299 L300 D301	S293-K297 WeakPolarHBondContact O-CB 3.15Å; S293-K297 PolarHBondContact O-N 2.78Å; E294-K297 PolarHBondContact O-N 3.45Å; K297-F299 VanDerWaalsContact C-N 3.29Å; K297-F299 PolarHBondContact O-N 2.88Å; K297-L300 WeakPolarHBondContact O-CB 3.37Å; K297-L300 PolarHBondContact O-N 2.9Å; K297-D301 WeakPolarHBondContact O-CB 3.48Å; K297-D301 VanDerWaalsContact O-CG 3.25Å; K297-D301 PolarHBondContact O-N 3.38Å
298	H	87.7	Confident	82.4	Confident	142 Å²	142	66.7 Å²	66.7	66%	0.657	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-38.4	176.7	-174.2	-86	0	0	0	112.1	E294 S302	E294-H298 WeakPolarHBondContact O-CB 3.12Å; E294-H298 PolarHBondContact O-N 3.47Å; H298-S302 WeakPolarHBondContact O-CB 3.49Å; H298-S302 PolarHBondContact O-N 2.92Å
299	F	90.2	Very high	82.1	Confident	13 Å²	13	66.9 Å²	66.9	6%	0.057	38%	0.38	C	S	.	.	H	α-helix	trans	-64.2	-45.6	174.8	-176.1	-122.3	0	0	0	111.6	K295 Q296 K297 S302 F303 L318 R336 L345 V346	K295-F299 VanDerWaalsContact O-CB 3.27Å; K295-F299 WeakPolarHBondContact O-CB 3.36Å; K295-F299 PolarHBondContact O-N 3.08Å; Q296-F299 PolarHBondContact O-N 2.96Å; K297-F299 VanDerWaalsContact C-N 3.29Å; K297-F299 PolarHBondContact O-N 2.88Å; F299-S302 WeakPolarHBondContact O-CB 3.32Å; F299-S302 PolarHBondContact O-N 3.25Å; F299-S302 PolarHBondContact O-OG 3.43Å; F299-F303 HydrophobicContact CD1-CE2 4.11Å; F299-F303 HydrophobicContact CD2-CE2 4.35Å; F299-F303 AromaticContact CE1-CE2 3.7Å; F299-F303 HydrophobicContact CE1-CE2 3.7Å; F299-F303 HydrophobicContact CE1-CZ 4.14Å; F299-F303 AromaticContact CE2-CE2 3.97Å; F299-F303 HydrophobicContact CE2-CE2 3.97Å; F299-F303 HydrophobicContact CE2-CZ 4.49Å; F299-F303 HydrophobicContact CG-CE2 4.41Å; F299-F303 AromaticContact CZ-CE2 3.61Å; F299-F303 HydrophobicContact CZ-CE2 3.61Å; F299-F303 AromaticContact CZ-CZ 3.88Å; F299-F303 HydrophobicContact CZ-CZ 3.88Å; F299-F303 VanDerWaalsContact O-CD2 3.24Å; F299-F303 WeakPolarHBondContact O-CD2 3.44Å; F299-L318 HydrophobicContact CD1-CD2 4.31Å; F299-L318 HydrophobicContact CE1-CD1 4.4Å; F299-L318 HydrophobicContact CE1-CD2 3.9Å; F299-R336 HydrophobicContact CE2-CG 3.87Å; F299-R336 HydrophobicContact CZ-CG 4.35Å; F299-R336 WeakPolarHBondContact CZ-O 3.36Å; F299-L345 HydrophobicContact CB-CD1 4.22Å; F299-L345 HydrophobicContact CD1-CB 4.33Å; F299-L345 HydrophobicContact CD2-CD1 3.67Å; F299-L345 HydrophobicContact CE2-CD1 4.16Å; F299-L345 HydrophobicContact CG-CB 4.44Å; F299-L345 HydrophobicContact CG-CD1 3.92Å; F299-V346 HydrophobicContact CE1-CG2 3.78Å; F299-V346 HydrophobicContact CZ-CG2 4.3Å
300	L	89.4	Confident	82.1	Confident	21 Å²	21	64.4 Å²	64.4	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-48.8	176.7	178	64.8	0	0	0	112.4	Q296 K297 S302 F303 V310 R315 L318 P319	Q296-L300 WeakPolarHBondContact O-CB 3.45Å; Q296-L300 PolarHBondContact O-N 2.92Å; K297-L300 WeakPolarHBondContact O-CB 3.37Å; K297-L300 PolarHBondContact O-N 2.9Å; L300-S302 PolarHBondContact O-N 3.38Å; L300-S302 VanDerWaalsContact O-N 3.17Å; L300-F303 WeakPolarHBondContact O-CB 3.49Å; L300-F303 PolarHBondContact O-N 3.15Å; L300-V310 HydrophobicContact CD1-CG1 3.7Å; L300-R315 HydrophobicContact CD2-CG 4.35Å; L300-L318 HydrophobicContact CD1-CB 4.31Å; L300-L318 HydrophobicContact CD1-CD1 3.89Å; L300-P319 HydrophobicContact CD2-CG 4.36Å
301	D	85.5	Confident	82.2	Confident	90 Å²	90	63.8 Å²	63.8	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-58.1	-33.2	179.5	-70	-21.1	0	0	0	111.2	K297 F303 G304 T305	K297-D301 WeakPolarHBondContact O-CB 3.48Å; K297-D301 VanDerWaalsContact O-CG 3.25Å; K297-D301 PolarHBondContact O-N 3.38Å; D301-F303 PolarHBondContact O-N 3.43Å; D301-G304 PolarHBondContact O-N 2.77Å; D301-T305 PolarHBondContact O-N 2.92Å; D301-T305 PolarHBondContact O-OG1 2.58Å
302	S	82.9	Confident	82.3	Confident	13 Å²	13	68 Å²	68	9%	0.091	38%	0.382	C	S	.	.	H	α-helix	trans	-69.8	-14.3	178.9	84	0	0	0	0	115.1	H298 F299 L300 R336	H298-S302 WeakPolarHBondContact O-CB 3.49Å; H298-S302 PolarHBondContact O-N 2.92Å; F299-S302 WeakPolarHBondContact O-CB 3.32Å; F299-S302 PolarHBondContact O-N 3.25Å; F299-S302 PolarHBondContact O-OG 3.43Å; L300-S302 PolarHBondContact O-N 3.38Å; L300-S302 VanDerWaalsContact O-N 3.17Å; S302-R336 VanDerWaalsContact OG-CZ 3.28Å; S302-R336 PolarHBondContact OG-NE 3.04Å; S302-R336 PolarHBondContact OG-NH2 3.09Å
303	F	83.4	Confident	82.6	Confident	3 Å²	3	64.8 Å²	64.8	1%	0.013	37%	0.368	C	S	.	.	H	α-helix	trans	-73.3	-40.2	166.9	-75.7	-104.6	0	0	0	111	F299 L300 D301 T305 I306 A307 V310 L314 L318 E333 R336 L337	F299-F303 HydrophobicContact CD1-CE2 4.11Å; F299-F303 HydrophobicContact CD2-CE2 4.35Å; F299-F303 AromaticContact CE1-CE2 3.7Å; F299-F303 HydrophobicContact CE1-CE2 3.7Å; F299-F303 HydrophobicContact CE1-CZ 4.14Å; F299-F303 AromaticContact CE2-CE2 3.97Å; F299-F303 HydrophobicContact CE2-CE2 3.97Å; F299-F303 HydrophobicContact CE2-CZ 4.49Å; F299-F303 HydrophobicContact CG-CE2 4.41Å; F299-F303 AromaticContact CZ-CE2 3.61Å; F299-F303 HydrophobicContact CZ-CE2 3.61Å; F299-F303 AromaticContact CZ-CZ 3.88Å; F299-F303 HydrophobicContact CZ-CZ 3.88Å; F299-F303 VanDerWaalsContact O-CD2 3.24Å; F299-F303 WeakPolarHBondContact O-CD2 3.44Å; L300-F303 WeakPolarHBondContact O-CB 3.49Å; L300-F303 PolarHBondContact O-N 3.15Å; D301-F303 PolarHBondContact O-N 3.43Å; F303-T305 VanDerWaalsContact C-N 3.31Å; F303-T305 PolarHBondContact O-N 2.73Å; F303-I306 PolarHBondContact O-N 2.71Å; F303-A307 PolarHBondContact O-N 3Å; F303-V310 HydrophobicContact CB-CG1 4.21Å; F303-V310 HydrophobicContact CB-CG2 3.93Å; F303-L314 HydrophobicContact CD1-CD1 4.31Å; F303-L314 HydrophobicContact CE1-CD1 4.09Å; F303-L318 HydrophobicContact CD2-CD1 4.03Å; F303-L318 HydrophobicContact CE2-CD1 3.65Å; F303-L318 HydrophobicContact CZ-CD1 4.01Å; F303-E333 HydrophobicContact CD1-CB 4.38Å; F303-E333 HydrophobicContact CD1-CG 4.07Å; F303-E333 HydrophobicContact CE1-CB 4.26Å; F303-E333 HydrophobicContact CE1-CG 4.44Å; F303-R336 HydrophobicContact CE1-CB 4.06Å; F303-R336 HydrophobicContact CE1-CG 4.44Å; F303-R336 HydrophobicContact CE2-CB 4.5Å; F303-R336 HydrophobicContact CE2-CG 4.06Å; F303-R336 HydrophobicContact CZ-CB 3.89Å; F303-R336 HydrophobicContact CZ-CG 3.95Å; F303-L337 HydrophobicContact CE1-CG 4.19Å; F303-L337 HydrophobicContact CZ-CD2 4.21Å; F303-L337 HydrophobicContact CZ-CG 4.04Å
304	G	73.6	Confident	82.9	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-33.7	-178.9	0	0	0	0	0	112.7	D301 I306 G308	D301-G304 PolarHBondContact O-N 2.77Å; G304-I306 VanDerWaalsContact C-N 3.26Å; G304-I306 PolarHBondContact O-N 2.98Å; G304-G308 CarbonylContact O-C 3.53Å; G304-G308 WeakPolarHBondContact O-CA 3.41Å; G304-G308 PolarHBondContact O-N 3.33Å; G304-G308 VanDerWaalsContact O-N 3.1Å
305	T	70.2	Confident	83.1	Confident	120 Å²	120	60.2 Å²	60.2	74%	0.736	33%	0.33	S	S	*	.	H	α-helix	trans	-64.9	-26.5	179.5	-36.8	0	0	0	0	113.7	D301 F303	D301-T305 PolarHBondContact O-N 2.92Å; D301-T305 PolarHBondContact O-OG1 2.58Å; F303-T305 VanDerWaalsContact C-N 3.31Å; F303-T305 PolarHBondContact O-N 2.73Å
306	I	66.4	Low	83.3	Confident	96 Å²	96	58.3 Å²	58.3	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-104.9	-51.4	-173.7	-62.5	171.2	0	0	0	110.9	F303 G304 G308 E332 R336	F303-I306 PolarHBondContact O-N 2.71Å; G304-I306 VanDerWaalsContact C-N 3.26Å; G304-I306 PolarHBondContact O-N 2.98Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 2.96Å; I306-E332 HydrophobicContact CG2-CB 4.09Å; I306-E332 HydrophobicContact CG2-CG 4.2Å; I306-R336 VanDerWaalsContact CD1-NH1 3.28Å
307	A	64	Low	83.4	Confident	28 Å²	28	58 Å²	58	23%	0.231	33%	0.329	C	S	.	.	H	α-helix	trans	-83.4	-6.6	-176.9	0	0	0	0	0	112.9	F303 V309	F303-A307 PolarHBondContact O-N 3Å; A307-V309 WeakPolarHBondContact CB-O 3.47Å; A307-V309 PolarHBondContact O-N 2.88Å
308	G	67.4	Low	83.7	Confident	61 Å²	61	51.4 Å²	51.4	63%	0.629	30%	0.3	S	S	*	.	S	Bend	trans	71.7	-33.7	-172	0	0	0	0	0	113.6	G304 I306	G304-G308 CarbonylContact O-C 3.53Å; G304-G308 WeakPolarHBondContact O-CA 3.41Å; G304-G308 PolarHBondContact O-N 3.33Å; G304-G308 VanDerWaalsContact O-N 3.1Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 2.96Å
309	V	76.4	Confident	84	Confident	82 Å²	82	46.7 Å²	46.7	50%	0.497	28%	0.282	S	S	.	.	S	Bend	trans	-132.7	135.1	-179.1	-178	0	0	0	0	109.3	A307 A621 R631	A307-V309 WeakPolarHBondContact CB-O 3.47Å; A307-V309 PolarHBondContact O-N 2.88Å; V309-A621 HydrophobicContact CG2-CB 4.45Å; V309-R631 PolarHBondContact O-NH1 2.84Å
310	V	83.7	Confident	84	Confident	22 Å²	22	48.8 Å²	48.8	13%	0.133	29%	0.29	C	S	.	.			trans	-90.7	135.6	174	-173.2	0	0	0	0	109.5	L300 F303 R315	L300-V310 HydrophobicContact CD1-CG1 3.7Å; F303-V310 HydrophobicContact CB-CG1 4.21Å; F303-V310 HydrophobicContact CB-CG2 3.93Å; V310-R315 HydrophobicContact CG1-CB 4.42Å
311	D	87.8	Confident	84.2	Confident	24 Å²	24	47.9 Å²	47.9	13%	0.128	29%	0.285	C	S	.	.			trans	-55.9	132.7	174.1	-177	-83	0	0	0	111.4	V313 L314 R315 F324 L329	D311-V313 VanDerWaalsContact C-N 3.27Å; D311-V313 PolarHBondContact O-N 3.37Å; D311-V313 WeakPolarHBondContact OD1-CA 3.48Å; D311-V313 VanDerWaalsContact OD1-CB 3.25Å; D311-V313 WeakPolarHBondContact OD1-CB 3.27Å; D311-V313 PolarHBondContact OD1-N 2.56Å; D311-L314 HydrophobicContact CB-CB 4.04Å; D311-L314 HydrophobicContact CB-CD1 3.98Å; D311-L314 HydrophobicContact CB-CG 3.96Å; D311-L314 PolarHBondContact O-N 3.3Å; D311-L314 PolarHBondContact OD1-N 3.16Å; D311-L314 VanDerWaalsContact OD1-N 3.11Å; D311-R315 WeakPolarHBondContact O-CB 3.18Å; D311-R315 PolarHBondContact O-N 2.92Å; D311-F324 WeakPolarHBondContact OD1-CZ 3.32Å; D311-L329 HydrophobicContact CB-CD2 4.33Å
312	P	88.3	Confident	84.6	Confident	93 Å²	93	43.6 Å²	43.6	60%	0.604	26%	0.262	S	S	*	.	H	α-helix	trans	-64.3	-30.9	-174.8	24.9	-34.2	0	0	0	113.2	S316	P312-S316 PolarHBondContact O-N 3.03Å; P312-S316 PolarHBondContact O-OG 3.1Å
313	V	91.7	Very high	85.1	Confident	20 Å²	20	43 Å²	43	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-72.2	-46.2	175.8	-179	0	0	0	0	109.1	E263 L267 D311 R315 S316 T317 F324	E263-V313 HydrophobicContact CB-CG1 4.21Å; E263-V313 HydrophobicContact CB-CG2 4.44Å; L267-V313 HydrophobicContact CD1-CG1 4.1Å; L267-V313 HydrophobicContact CD1-CG2 4.44Å; L267-V313 HydrophobicContact CD2-CG1 4.02Å; L267-V313 HydrophobicContact CG-CG1 3.8Å; D311-V313 VanDerWaalsContact C-N 3.27Å; D311-V313 PolarHBondContact O-N 3.37Å; D311-V313 WeakPolarHBondContact OD1-CA 3.48Å; D311-V313 VanDerWaalsContact OD1-CB 3.25Å; D311-V313 WeakPolarHBondContact OD1-CB 3.27Å; D311-V313 PolarHBondContact OD1-N 2.56Å; V313-R315 VanDerWaalsContact C-N 3.27Å; V313-R315 PolarHBondContact O-N 3.47Å; V313-S316 PolarHBondContact O-N 3.13Å; V313-T317 HydrophobicContact CG1-CG2 4.17Å; V313-T317 WeakPolarHBondContact O-CG2 2.95Å; V313-T317 PolarHBondContact O-N 3.27Å; V313-T317 PolarHBondContact O-OG1 3.17Å; V313-F324 HydrophobicContact CB-CD1 4.36Å; V313-F324 HydrophobicContact CB-CE1 3.5Å; V313-F324 VanDerWaalsContact CB-CE1 3.5Å; V313-F324 HydrophobicContact CB-CZ 3.99Å; V313-F324 HydrophobicContact CG1-CD1 3.73Å; V313-F324 HydrophobicContact CG1-CE1 3.38Å; V313-F324 HydrophobicContact CG1-CZ 4.2Å
314	L	93.2	Very high	85.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-37.2	176.1	-69.5	-178.9	0	0	0	112.4	F303 D311 S316 T317 L318 F324 L329 L337	F303-L314 HydrophobicContact CD1-CD1 4.31Å; F303-L314 HydrophobicContact CE1-CD1 4.09Å; D311-L314 HydrophobicContact CB-CB 4.04Å; D311-L314 HydrophobicContact CB-CD1 3.98Å; D311-L314 HydrophobicContact CB-CG 3.96Å; D311-L314 PolarHBondContact O-N 3.3Å; D311-L314 PolarHBondContact OD1-N 3.16Å; D311-L314 VanDerWaalsContact OD1-N 3.11Å; L314-S316 PolarHBondContact O-N 3.4Å; L314-T317 PolarHBondContact O-N 2.94Å; L314-L318 HydrophobicContact CB-CD1 4.03Å; L314-L318 HydrophobicContact CB-CG 4.29Å; L314-L318 HydrophobicContact CD2-CG 4.35Å; L314-L318 VanDerWaalsContact O-CB 3.29Å; L314-L318 WeakPolarHBondContact O-CB 3.43Å; L314-L318 WeakPolarHBondContact O-CG 3.44Å; L314-L318 PolarHBondContact O-N 3.47Å; L314-F324 HydrophobicContact CB-CE1 4.41Å; L314-F324 HydrophobicContact CD2-CD1 3.56Å; L314-F324 HydrophobicContact CD2-CE1 3.38Å; L314-F324 HydrophobicContact CD2-CG 4.43Å; L314-F324 HydrophobicContact CD2-CZ 4.15Å; L314-F324 HydrophobicContact CG-CD1 4.22Å; L314-F324 HydrophobicContact CG-CE1 3.5Å; L314-F324 VanDerWaalsContact CG-CE1 3.5Å; L314-F324 HydrophobicContact CG-CZ 3.96Å; L314-L329 HydrophobicContact CD1-CD1 4.37Å; L314-L329 HydrophobicContact CD1-CD2 4.18Å; L314-L337 HydrophobicContact CD1-CD1 4.37Å; L314-L337 HydrophobicContact CD2-CD1 4.32Å; L314-L337 HydrophobicContact CD2-CD2 4.06Å
315	R	92.6	Very high	86.5	Confident	163 Å²	163	41.8 Å²	41.8	62%	0.615	25%	0.246	S	C	*	.	H	α-helix	trans	-59.1	-31.5	174.7	-167.3	-179.6	-174.3	107.7	1.5	112.6	L300 V310 D311 V313 P319	L300-R315 HydrophobicContact CD2-CG 4.35Å; V310-R315 HydrophobicContact CG1-CB 4.42Å; D311-R315 WeakPolarHBondContact O-CB 3.18Å; D311-R315 PolarHBondContact O-N 2.92Å; V313-R315 VanDerWaalsContact C-N 3.27Å; V313-R315 PolarHBondContact O-N 3.47Å; R315-P319 WeakPolarHBondContact O-CD 3.36Å
316	S	93.6	Very high	87.4	Confident	64 Å²	64	36.2 Å²	36.2	45%	0.448	21%	0.211	S	C	.	.	H	α-helix	trans	-88.9	-27.4	-179.8	-53.9	0	0	0	0	112.8	P312 V313 L314 Y320	P312-S316 PolarHBondContact O-N 3.03Å; P312-S316 PolarHBondContact O-OG 3.1Å; V313-S316 PolarHBondContact O-N 3.13Å; L314-S316 PolarHBondContact O-N 3.4Å; S316-Y320 WeakPolarHBondContact O-CD2 3.35Å; S316-Y320 WeakPolarHBondContact O-CE2 3.16Å
317	T	95.3	Very high	88.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-97.7	-38.9	-174.7	66.4	0	0	0	0	114.5	A266 L267 A270 V313 L314 P319 Y320 V322	A266-T317 HydrophobicContact CB-CG2 4.08Å; L267-T317 HydrophobicContact CD2-CG2 3.86Å; L267-T317 HydrophobicContact CG-CG2 4.25Å; A270-T317 HydrophobicContact CB-CG2 3.95Å; V313-T317 HydrophobicContact CG1-CG2 4.17Å; V313-T317 WeakPolarHBondContact O-CG2 2.95Å; V313-T317 PolarHBondContact O-N 3.27Å; V313-T317 PolarHBondContact O-OG1 3.17Å; L314-T317 PolarHBondContact O-N 2.94Å; T317-P319 VanDerWaalsContact C-CD 3.43Å; T317-Y320 PolarHBondContact O-N 2.87Å; T317-V322 CarbonylContact C-O 3.6Å; T317-V322 WeakPolarHBondContact CB-O 3.09Å; T317-V322 PolarHBondContact O-N 3.19Å; T317-V322 VanDerWaalsContact O-O 3.07Å; T317-V322 PolarHBondContact OG1-O 2.98Å
318	L	94.7	Very high	89	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-61.2	-35.1	-174.5	-73	178.3	0	0	0	114.7	Q296 F299 L300 F303 L314 Y320 A321 V322 L337 V346	Q296-L318 PolarHBondContact OE1-O 3.39Å; F299-L318 HydrophobicContact CD1-CD2 4.31Å; F299-L318 HydrophobicContact CE1-CD1 4.4Å; F299-L318 HydrophobicContact CE1-CD2 3.9Å; L300-L318 HydrophobicContact CD1-CB 4.31Å; L300-L318 HydrophobicContact CD1-CD1 3.89Å; F303-L318 HydrophobicContact CD2-CD1 4.03Å; F303-L318 HydrophobicContact CE2-CD1 3.65Å; F303-L318 HydrophobicContact CZ-CD1 4.01Å; L314-L318 HydrophobicContact CB-CD1 4.03Å; L314-L318 HydrophobicContact CB-CG 4.29Å; L314-L318 HydrophobicContact CD2-CG 4.35Å; L314-L318 VanDerWaalsContact O-CB 3.29Å; L314-L318 WeakPolarHBondContact O-CB 3.43Å; L314-L318 WeakPolarHBondContact O-CG 3.44Å; L314-L318 PolarHBondContact O-N 3.47Å; L318-Y320 PolarHBondContact O-N 3.22Å; L318-A321 PolarHBondContact O-N 3.42Å; L318-V322 WeakPolarHBondContact CA-O 3.16Å; L318-V322 PolarHBondContact N-O 2.85Å; L318-L337 HydrophobicContact CD2-CD2 3.98Å; L318-V346 HydrophobicContact CD2-CG2 4.09Å
319	P	93	Very high	90	Very high	43 Å²	43	29.2 Å²	29.2	28%	0.279	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-53.4	-25.6	173	-29.1	37.4	0	0	0	114.1	L300 R315 T317	L300-P319 HydrophobicContact CD2-CG 4.36Å; R315-P319 WeakPolarHBondContact O-CD 3.36Å; T317-P319 VanDerWaalsContact C-CD 3.43Å
320	Y	91.2	Very high	90.4	Very high	58 Å²	58	25.8 Å²	25.8	23%	0.227	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-103.1	18.6	-178.8	-52.4	-68.1	0	0	0	113.1	A270 K274 L277 S316 T317 L318 V322	A270-Y320 HydrophobicContact CB-CD2 4.04Å; K274-Y320 HydrophobicContact CB-CD1 4.07Å; K274-Y320 HydrophobicContact CB-CE1 3.63Å; K274-Y320 HydrophobicContact CB-CE2 4.19Å; K274-Y320 HydrophobicContact CD-CE1 4.42Å; K274-Y320 HydrophobicContact CD-CE2 4.36Å; K274-Y320 VanDerWaalsContact CD-OH 3.28Å; K274-Y320 WeakPolarHBondContact CD-OH 3.48Å; K274-Y320 HydrophobicContact CG-CE1 3.73Å; K274-Y320 HydrophobicContact CG-CE2 4.44Å; K274-Y320 WeakPolarHBondContact CG-OH 3Å; L277-Y320 HydrophobicContact CD1-CD1 3.86Å; L277-Y320 HydrophobicContact CD1-CE1 4.34Å; S316-Y320 WeakPolarHBondContact O-CD2 3.35Å; S316-Y320 WeakPolarHBondContact O-CE2 3.16Å; T317-Y320 PolarHBondContact O-N 2.87Å; L318-Y320 PolarHBondContact O-N 3.22Å; Y320-V322 PolarHBondContact O-N 3.01Å
321	A	92.6	Very high	90.3	Very high	1 Å²	1	27 Å²	27	1%	0.008	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	24.8	-176.6	0	0	0	0	0	114.6	I291 L318 L345 R347 V348	I291-A321 HydrophobicContact CD1-CB 4.39Å; I291-A321 HydrophobicContact CG1-CB 4.02Å; I291-A321 HydrophobicContact CG2-CB 4.29Å; L318-A321 PolarHBondContact O-N 3.42Å; A321-L345 WeakPolarHBondContact CB-O 3.1Å; A321-R347 HydrophobicContact CB-CB 4.17Å; A321-R347 HydrophobicContact CB-CG 3.83Å; A321-R347 PolarHBondContact O-N 3Å; A321-V348 PolarHBondContact O-N 3.43Å
322	V	93.9	Very high	90	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.9	176.5	-175.4	0	0	0	0	109.6	A266 I269 A270 I273 T317 L318 Y320 V348	A266-V322 HydrophobicContact CB-CG1 4.13Å; I269-V322 HydrophobicContact CB-CG1 4.36Å; I269-V322 HydrophobicContact CG2-CG1 4.29Å; I269-V322 HydrophobicContact CG2-CG2 3.91Å; A270-V322 HydrophobicContact CB-CB 4.21Å; A270-V322 HydrophobicContact CB-CG2 4.29Å; I273-V322 HydrophobicContact CD1-CG2 3.63Å; T317-V322 CarbonylContact C-O 3.6Å; T317-V322 WeakPolarHBondContact CB-O 3.09Å; T317-V322 PolarHBondContact O-N 3.19Å; T317-V322 VanDerWaalsContact O-O 3.07Å; T317-V322 PolarHBondContact OG1-O 2.98Å; L318-V322 WeakPolarHBondContact CA-O 3.16Å; L318-V322 PolarHBondContact N-O 2.85Å; Y320-V322 PolarHBondContact O-N 3.01Å; V322-V348 WeakPolarHBondContact CA-O 3.35Å; V322-V348 HydrophobicContact CG1-CB 4.45Å; V322-V348 HydrophobicContact CG2-CB 4.37Å
323	G	94.1	Very high	90	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	165.7	174.2	0	0	0	0	0	111.6	V348 L349 V350	G323-V348 PolarHBondContact N-O 3.37Å; G323-L349 WeakPolarHBondContact O-CA 3.42Å; G323-V350 PolarHBondContact O-N 3.29Å
324	F	94.5	Very high	89.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.5	169.7	70	-85.3	0	0	0	111.6	E263 A266 D311 V313 L314 H326 L329 L337 V350	E263-F324 HydrophobicContact CG-CD2 3.88Å; E263-F324 HydrophobicContact CG-CE1 4.5Å; E263-F324 HydrophobicContact CG-CE2 3.69Å; E263-F324 HydrophobicContact CG-CG 4.36Å; E263-F324 HydrophobicContact CG-CZ 4.02Å; A266-F324 HydrophobicContact CB-CB 3.86Å; A266-F324 HydrophobicContact CB-CD1 4.37Å; D311-F324 WeakPolarHBondContact OD1-CZ 3.32Å; V313-F324 HydrophobicContact CB-CD1 4.36Å; V313-F324 HydrophobicContact CB-CE1 3.5Å; V313-F324 VanDerWaalsContact CB-CE1 3.5Å; V313-F324 HydrophobicContact CB-CZ 3.99Å; V313-F324 HydrophobicContact CG1-CD1 3.73Å; V313-F324 HydrophobicContact CG1-CE1 3.38Å; V313-F324 HydrophobicContact CG1-CZ 4.2Å; L314-F324 HydrophobicContact CB-CE1 4.41Å; L314-F324 HydrophobicContact CD2-CD1 3.56Å; L314-F324 HydrophobicContact CD2-CE1 3.38Å; L314-F324 HydrophobicContact CD2-CG 4.43Å; L314-F324 HydrophobicContact CD2-CZ 4.15Å; L314-F324 HydrophobicContact CG-CD1 4.22Å; L314-F324 HydrophobicContact CG-CE1 3.5Å; L314-F324 VanDerWaalsContact CG-CE1 3.5Å; L314-F324 HydrophobicContact CG-CZ 3.96Å; F324-H326 AromaticContact CD2-CD2 3.87Å; F324-H326 AromaticContact CD2-NE2 3.64Å; F324-H326 AromaticContact CE2-CE1 3.6Å; F324-H326 AromaticContact CE2-NE2 3.48Å; F324-H326 WeakPolarHBondContact CE2-NE2 3.25Å; F324-L329 HydrophobicContact CD2-CD1 4.09Å; F324-L329 HydrophobicContact CE2-CD1 3.78Å; F324-L329 HydrophobicContact CE2-CD2 3.84Å; F324-L329 HydrophobicContact CE2-CG 3.83Å; F324-L329 HydrophobicContact CZ-CD1 4.31Å; F324-L329 HydrophobicContact CZ-CD2 3.91Å; F324-L329 HydrophobicContact CZ-CG 4.38Å; F324-L329 VanDerWaalsContact O-CD1 3.28Å; F324-L329 WeakPolarHBondContact O-CD1 3.31Å; F324-L337 WeakPolarHBondContact O-CD1 3.24Å; F324-V350 CarbonylContact C-O 3.59Å; F324-V350 VanDerWaalsContact C-O 3.31Å; F324-V350 WeakPolarHBondContact CA-O 3.37Å; F324-V350 HydrophobicContact CB-CB 4.44Å
325	H	92.5	Very high	89.4	Confident	3 Å²	3	31.9 Å²	31.9	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	119.6	-177.2	-173.7	-66.9	0	0	0	111.4	E338 L349 V350 A351 T352 L355	H325-E338 IonicContact CD2-OE1 3.19Å; H325-E338 IonicContact CE1-OE1 3.78Å; H325-E338 IonicContact NE2-OE1 2.63Å; H325-E338 PolarHBondContact NE2-OE1 2.75Å; H325-L349 HydrophobicContact CB-CD1 4.08Å; H325-L349 HydrophobicContact CB-CD2 4.42Å; H325-L349 HydrophobicContact CB-CG 4.33Å; H325-V350 PolarHBondContact N-O 3.46Å; H325-A351 HydrophobicContact CB-CB 4Å; H325-A351 CarbonylContact O-C 3.56Å; H325-A351 WeakPolarHBondContact O-CA 3.47Å; H325-T352 PolarHBondContact O-N 2.93Å; H325-L355 HydrophobicContact CB-CD2 4.39Å; H325-L355 VanDerWaalsContact CE1-CD1 3.47Å; H325-L355 WeakPolarHBondContact CE1-CD1 3.29Å; H325-L355 WeakPolarHBondContact NE2-CD1 3.26Å
326	H	89	Confident	89.1	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.009	14%	0.143	C	C	.	.	S	Bend	trans	-161.5	171.3	172.4	59.6	37.2	0	0	0	111.1	K259 E263 F324 G328 L329 T352	K259-H326 HydrophobicContact CG-CB 4.23Å; E263-H326 IonicContact OE1-CE1 2.78Å; E263-H326 IonicContact OE1-NE2 3.18Å; E263-H326 PolarHBondContact OE1-NE2 3.43Å; F324-H326 AromaticContact CD2-CD2 3.87Å; F324-H326 AromaticContact CD2-NE2 3.64Å; F324-H326 AromaticContact CE2-CE1 3.6Å; F324-H326 AromaticContact CE2-NE2 3.48Å; F324-H326 WeakPolarHBondContact CE2-NE2 3.25Å; H326-G328 WeakPolarHBondContact ND1-CA 3.35Å; H326-G328 PolarHBondContact ND1-N 3.03Å; H326-G328 PolarHBondContact O-N 3.17Å; H326-L329 PolarHBondContact O-N 3.09Å; H326-T352 WeakPolarHBondContact CA-OG1 3.39Å; H326-T352 HydrophobicContact CB-CG2 3.83Å; H326-T352 WeakPolarHBondContact CB-OG1 3.34Å
327	A	80.6	Confident	89	Confident	33 Å²	33	25.2 Å²	25.2	27%	0.273	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.3	-179.6	0	0	0	0	0	116.1	L329 T354 G632 Y633	A327-L329 VanDerWaalsContact C-N 3.3Å; A327-T354 HydrophobicContact CB-CG2 4.31Å; A327-G632 CarbonylContact O-C 3.43Å; A327-G632 VanDerWaalsContact O-C 3.24Å; A327-Y633 PolarHBondContact O-N 3.17Å
328	G	83.4	Confident	88.6	Confident	5 Å²	5	25.8 Å²	25.8	5%	0.052	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-18.6	170.1	0	0	0	0	0	114.5	H326 G632	H326-G328 WeakPolarHBondContact ND1-CA 3.35Å; H326-G328 PolarHBondContact ND1-N 3.03Å; H326-G328 PolarHBondContact O-N 3.17Å; G328-G632 WeakPolarHBondContact O-CA 3.49Å; G328-G632 PolarHBondContact O-N 3.33Å
329	L	87.9	Confident	88.2	Confident	1 Å²	1	29 Å²	29	1%	0.005	14%	0.142	C	C	.	.	S	Bend	trans	-89.6	147.8	175.1	-65.3	177.4	0	0	0	110.7	D311 L314 F324 H326 A327 E333 R334 L337 G632	D311-L329 HydrophobicContact CB-CD2 4.33Å; L314-L329 HydrophobicContact CD1-CD1 4.37Å; L314-L329 HydrophobicContact CD1-CD2 4.18Å; F324-L329 HydrophobicContact CD2-CD1 4.09Å; F324-L329 HydrophobicContact CE2-CD1 3.78Å; F324-L329 HydrophobicContact CE2-CD2 3.84Å; F324-L329 HydrophobicContact CE2-CG 3.83Å; F324-L329 HydrophobicContact CZ-CD1 4.31Å; F324-L329 HydrophobicContact CZ-CD2 3.91Å; F324-L329 HydrophobicContact CZ-CG 4.38Å; F324-L329 VanDerWaalsContact O-CD1 3.28Å; F324-L329 WeakPolarHBondContact O-CD1 3.31Å; H326-L329 PolarHBondContact O-N 3.09Å; A327-L329 VanDerWaalsContact C-N 3.3Å; L329-E333 HydrophobicContact CB-CB 4.24Å; L329-R334 HydrophobicContact CB-CG 3.89Å; L329-R334 PolarHBondContact O-NE 3.33Å; L329-L337 HydrophobicContact CD1-CD1 3.54Å; L329-G632 VanDerWaalsContact C-CA 3.43Å; L329-G632 VanDerWaalsContact O-CA 3.28Å; L329-G632 WeakPolarHBondContact O-CA 3.35Å
330	T	85.5	Confident	88.1	Confident	9 Å²	9	27 Å²	27	6%	0.055	13%	0.129	C	C	.	.			trans	-62.7	160.7	174.5	61.4	0	0	0	0	111.3	E332 E333 R334 L620 R631 Q635	T330-E332 VanDerWaalsContact C-N 3.27Å; T330-E332 WeakPolarHBondContact CB-OE2 3.5Å; T330-E332 PolarHBondContact O-N 3.15Å; T330-E333 WeakPolarHBondContact CB-OE2 3.47Å; T330-E333 PolarHBondContact N-OE2 3.35Å; T330-E333 PolarHBondContact O-N 3.01Å; T330-E333 WeakPolarHBondContact OG1-CB 3.08Å; T330-E333 WeakPolarHBondContact OG1-CG 3.48Å; T330-E333 PolarHBondContact OG1-N 2.7Å; T330-E333 PolarHBondContact OG1-OE2 3.32Å; T330-R334 WeakPolarHBondContact O-CG 3.2Å; T330-R334 PolarHBondContact O-N 3.16Å; T330-R334 PolarHBondContact O-NE 3.38Å; T330-L620 HydrophobicContact CG2-CD2 4.33Å; T330-R631 HydrophobicContact CG2-CB 3.79Å; T330-Q635 VanDerWaalsContact CA-OE1 3.32Å
331	M	81.6	Confident	88	Confident	48 Å²	48	24.7 Å²	24.7	24%	0.236	12%	0.12	C	C	.	.	H	α-helix	trans	-58.2	-43.2	178.6	-172.9	69	-173.7	0	0	111.3	R334 E335	M331-R334 PolarHBondContact O-N 2.86Å; M331-R334 VanDerWaalsContact SD-CZ 3.59Å; M331-R334 PolarHBondContact SD-NH1 3.23Å; M331-R334 VanDerWaalsContact SD-NH1 3.36Å; M331-R334 PolarHBondContact SD-NH2 3.27Å; M331-E335 HydrophobicContact CE-CG 4.03Å; M331-E335 WeakPolarHBondContact CE-OE1 3.31Å; M331-E335 WeakPolarHBondContact O-CG 3.11Å; M331-E335 PolarHBondContact O-N 3.07Å
332	E	81.7	Confident	87.6	Confident	84 Å²	84	30.1 Å²	30.1	39%	0.393	14%	0.14	S	C	.	.	H	α-helix	trans	-63.4	-44	-178.8	-60.3	77.9	-174.1	0	0	111.1	I306 T330 R336 Q635	I306-E332 HydrophobicContact CG2-CB 4.09Å; I306-E332 HydrophobicContact CG2-CG 4.2Å; T330-E332 VanDerWaalsContact C-N 3.27Å; T330-E332 WeakPolarHBondContact CB-OE2 3.5Å; T330-E332 PolarHBondContact O-N 3.15Å; E332-R336 WeakPolarHBondContact O-CB 3.44Å; E332-R336 PolarHBondContact O-N 2.79Å; E332-Q635 PolarHBondContact OE1-NE2 3.02Å; E332-Q635 PolarHBondContact OE2-NE2 3.26Å
333	E	88.5	Confident	87.2	Confident	3 Å²	3	36.8 Å²	36.8	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-42.9	175.2	-70.9	170.9	134.1	0	0	111.6	F303 L329 T330 R336 L337 R631	F303-E333 HydrophobicContact CD1-CB 4.38Å; F303-E333 HydrophobicContact CD1-CG 4.07Å; F303-E333 HydrophobicContact CE1-CB 4.26Å; F303-E333 HydrophobicContact CE1-CG 4.44Å; L329-E333 HydrophobicContact CB-CB 4.24Å; T330-E333 WeakPolarHBondContact CB-OE2 3.47Å; T330-E333 PolarHBondContact N-OE2 3.35Å; T330-E333 PolarHBondContact O-N 3.01Å; T330-E333 WeakPolarHBondContact OG1-CB 3.08Å; T330-E333 WeakPolarHBondContact OG1-CG 3.48Å; T330-E333 PolarHBondContact OG1-N 2.7Å; T330-E333 PolarHBondContact OG1-OE2 3.32Å; E333-R336 PolarHBondContact O-N 3.5Å; E333-L337 WeakPolarHBondContact O-CG 3.34Å; E333-L337 PolarHBondContact O-N 3.38Å; E333-R631 IonicContact OE1-CZ 2.68Å; E333-R631 IonicContact OE1-NH1 3.87Å; E333-R631 IonicContact OE1-NH2 2.85Å; E333-R631 PolarHBondContact OE1-NH2 2.85Å; E333-R631 IonicContact OE2-NH2 3.21Å
334	R	87.1	Confident	86.9	Confident	55 Å²	55	38.3 Å²	38.3	21%	0.208	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-49	178.1	-75.2	-174.7	-70.2	112.5	-3.9	111.8	L329 T330 M331 R336 L337 E338	L329-R334 HydrophobicContact CB-CG 3.89Å; L329-R334 PolarHBondContact O-NE 3.33Å; T330-R334 WeakPolarHBondContact O-CG 3.2Å; T330-R334 PolarHBondContact O-N 3.16Å; T330-R334 PolarHBondContact O-NE 3.38Å; M331-R334 PolarHBondContact O-N 2.86Å; M331-R334 VanDerWaalsContact SD-CZ 3.59Å; M331-R334 PolarHBondContact SD-NH1 3.23Å; M331-R334 VanDerWaalsContact SD-NH1 3.36Å; M331-R334 PolarHBondContact SD-NH2 3.27Å; R334-R336 PolarHBondContact O-N 3.33Å; R334-L337 PolarHBondContact O-N 3.13Å; R334-E338 WeakPolarHBondContact O-CB 3.49Å; R334-E338 WeakPolarHBondContact O-CG 3.37Å; R334-E338 PolarHBondContact O-N 3.27Å
335	E	83.9	Confident	86.6	Confident	98 Å²	98	40.1 Å²	40.1	46%	0.458	19%	0.19	S	C	.	.	H	α-helix	trans	-58.8	-36.9	176.8	-76.9	-177	179.1	0	0	111.9	M331 E338 N339	M331-E335 HydrophobicContact CE-CG 4.03Å; M331-E335 WeakPolarHBondContact CE-OE1 3.31Å; M331-E335 WeakPolarHBondContact O-CG 3.11Å; M331-E335 PolarHBondContact O-N 3.07Å; E335-E338 PolarHBondContact O-N 2.75Å; E335-N339 WeakPolarHBondContact O-CB 3.25Å; E335-N339 PolarHBondContact O-N 2.96Å
336	R	86.4	Confident	86.6	Confident	86 Å²	86	40 Å²	40	33%	0.325	19%	0.189	S	C	.	.	H	α-helix	trans	-72.2	-40.2	179	-156	158.2	-165.8	98.8	2.4	112.4	F299 S302 F303 I306 E332 E333 R334 E338 N339 G340	F299-R336 HydrophobicContact CE2-CG 3.87Å; F299-R336 HydrophobicContact CZ-CG 4.35Å; F299-R336 WeakPolarHBondContact CZ-O 3.36Å; S302-R336 VanDerWaalsContact OG-CZ 3.28Å; S302-R336 PolarHBondContact OG-NE 3.04Å; S302-R336 PolarHBondContact OG-NH2 3.09Å; F303-R336 HydrophobicContact CE1-CB 4.06Å; F303-R336 HydrophobicContact CE1-CG 4.44Å; F303-R336 HydrophobicContact CE2-CB 4.5Å; F303-R336 HydrophobicContact CE2-CG 4.06Å; F303-R336 HydrophobicContact CZ-CB 3.89Å; F303-R336 HydrophobicContact CZ-CG 3.95Å; I306-R336 VanDerWaalsContact CD1-NH1 3.28Å; E332-R336 WeakPolarHBondContact O-CB 3.44Å; E332-R336 PolarHBondContact O-N 2.79Å; E333-R336 PolarHBondContact O-N 3.5Å; R334-R336 PolarHBondContact O-N 3.33Å; R336-E338 VanDerWaalsContact C-N 3.32Å; R336-N339 PolarHBondContact O-N 3.37Å; R336-G340 PolarHBondContact O-N 3.32Å
337	L	91.2	Very high	86.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-42.2	170.2	-75.8	163.4	0	0	0	111.7	F303 L314 L318 F324 L329 E333 R334 G340 F341 V346 L349	F303-L337 HydrophobicContact CE1-CG 4.19Å; F303-L337 HydrophobicContact CZ-CD2 4.21Å; F303-L337 HydrophobicContact CZ-CG 4.04Å; L314-L337 HydrophobicContact CD1-CD1 4.37Å; L314-L337 HydrophobicContact CD2-CD1 4.32Å; L314-L337 HydrophobicContact CD2-CD2 4.06Å; L318-L337 HydrophobicContact CD2-CD2 3.98Å; F324-L337 WeakPolarHBondContact O-CD1 3.24Å; L329-L337 HydrophobicContact CD1-CD1 3.54Å; E333-L337 WeakPolarHBondContact O-CG 3.34Å; E333-L337 PolarHBondContact O-N 3.38Å; R334-L337 PolarHBondContact O-N 3.13Å; L337-G340 PolarHBondContact O-N 2.91Å; L337-F341 WeakPolarHBondContact O-CB 3.1Å; L337-F341 PolarHBondContact O-N 3.4Å; L337-V346 HydrophobicContact CD2-CG2 4.34Å; L337-L349 HydrophobicContact CB-CD1 4.47Å; L337-L349 HydrophobicContact CD2-CD1 4.46Å
338	E	88.3	Confident	87.2	Confident	13 Å²	13	40 Å²	40	6%	0.061	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-47.2	176.2	-68.8	166	-160.5	0	0	111.3	H325 R334 E335 R336 F341 R342 L355 V359 L361	H325-E338 IonicContact CD2-OE1 3.19Å; H325-E338 IonicContact CE1-OE1 3.78Å; H325-E338 IonicContact NE2-OE1 2.63Å; H325-E338 PolarHBondContact NE2-OE1 2.75Å; R334-E338 WeakPolarHBondContact O-CB 3.49Å; R334-E338 WeakPolarHBondContact O-CG 3.37Å; R334-E338 PolarHBondContact O-N 3.27Å; E335-E338 PolarHBondContact O-N 2.75Å; R336-E338 VanDerWaalsContact C-N 3.32Å; E338-F341 PolarHBondContact O-N 2.93Å; E338-R342 WeakPolarHBondContact O-CG 3.46Å; E338-R342 PolarHBondContact O-N 3.13Å; E338-R342 IonicContact OE2-NH2 2.72Å; E338-L355 HydrophobicContact CG-CD1 4.35Å; E338-V359 HydrophobicContact CB-CG1 4.45Å; E338-V359 VanDerWaalsContact CD-CG1 3.49Å; E338-V359 HydrophobicContact CG-CG1 3.97Å; E338-V359 WeakPolarHBondContact OE2-CG1 3.3Å; E338-L361 HydrophobicContact CB-CD1 4.15Å; E338-L361 HydrophobicContact CB-CD2 3.99Å; E338-L361 HydrophobicContact CB-CG 4.38Å; E338-L361 HydrophobicContact CG-CD1 3.79Å; E338-L361 HydrophobicContact CG-CD2 4.47Å; E338-L361 HydrophobicContact CG-CG 4.32Å; E338-L361 VanDerWaalsContact O-CD2 3.31Å; E338-L361 WeakPolarHBondContact O-CD2 3.28Å
339	N	86.1	Confident	87.7	Confident	68 Å²	68	39.7 Å²	39.7	36%	0.364	18%	0.179	S	C	.	.	H	α-helix	trans	-65	-40.4	176.2	-164	8.5	0	0	0	111.7	E335 R336 F341 R342 K343	E335-N339 WeakPolarHBondContact O-CB 3.25Å; E335-N339 PolarHBondContact O-N 2.96Å; R336-N339 PolarHBondContact O-N 3.37Å; N339-F341 VanDerWaalsContact C-N 3.3Å; N339-F341 PolarHBondContact O-N 3.25Å; N339-R342 PolarHBondContact O-N 3.37Å; N339-K343 WeakPolarHBondContact O-CB 3.16Å; N339-K343 WeakPolarHBondContact O-CG 3.12Å; N339-K343 PolarHBondContact O-N 2.94Å; N339-K343 VanDerWaalsContact OD1-CE 3.32Å; N339-K343 WeakPolarHBondContact OD1-CE 3.43Å
340	G	89.6	Confident	87.9	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-40	173.2	0	0	0	0	0	112	R336 L337 K343 S344 L345 V346	R336-G340 PolarHBondContact O-N 3.32Å; L337-G340 PolarHBondContact O-N 2.91Å; G340-K343 CarbonylContact O-C 3.51Å; G340-S344 CarbonylContact O-C 3.37Å; G340-S344 PolarHBondContact O-N 3.4Å; G340-L345 WeakPolarHBondContact O-CA 3.36Å; G340-L345 PolarHBondContact O-N 2.9Å; G340-V346 PolarHBondContact O-N 3.2Å; G340-V346 VanDerWaalsContact O-N 3.08Å
341	F	89.6	Confident	88.1	Confident	9 Å²	9	39.2 Å²	39.2	4%	0.039	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-43.5	174.1	-169.2	-93.8	0	0	0	112	L253 L337 E338 N339 K343 S344 V346 L349 L361 A363	L253-F341 HydrophobicContact CD2-CZ 4.37Å; L253-F341 HydrophobicContact CG-CE1 4.45Å; L253-F341 HydrophobicContact CG-CZ 4.03Å; L337-F341 WeakPolarHBondContact O-CB 3.1Å; L337-F341 PolarHBondContact O-N 3.4Å; E338-F341 PolarHBondContact O-N 2.93Å; N339-F341 VanDerWaalsContact C-N 3.3Å; N339-F341 PolarHBondContact O-N 3.25Å; F341-K343 PolarHBondContact O-N 3.39Å; F341-S344 PolarHBondContact O-N 3.31Å; F341-S344 VanDerWaalsContact O-N 3.07Å; F341-V346 HydrophobicContact CB-CB 4.29Å; F341-V346 HydrophobicContact CD2-CB 4.31Å; F341-V346 HydrophobicContact CD2-CG1 4.22Å; F341-V346 VanDerWaalsContact CD2-O 3.24Å; F341-V346 WeakPolarHBondContact CD2-O 3.44Å; F341-L349 HydrophobicContact CB-CD2 4.47Å; F341-L349 HydrophobicContact CD2-CB 3.72Å; F341-L349 HydrophobicContact CD2-CD2 4.39Å; F341-L349 HydrophobicContact CE2-CB 3.95Å; F341-L349 HydrophobicContact CG-CD2 4.45Å; F341-L361 HydrophobicContact CB-CD2 4.32Å; F341-L361 HydrophobicContact CD1-CB 4.26Å; F341-L361 HydrophobicContact CD1-CD1 4.38Å; F341-L361 HydrophobicContact CD1-CD2 4.05Å; F341-L361 HydrophobicContact CD1-CG 4.48Å; F341-A363 HydrophobicContact CE1-CB 3.95Å; F341-A363 HydrophobicContact CZ-CB 3.65Å
342	R	84.2	Confident	88.4	Confident	115 Å²	115	37.4 Å²	37.4	43%	0.434	17%	0.168	S	C	.	.	H	α-helix	trans	-60.8	-44.2	175.1	-67.8	-178	-160.3	101.9	2.2	111.9	E338 N339 S344 N360 L361	E338-R342 WeakPolarHBondContact O-CG 3.46Å; E338-R342 PolarHBondContact O-N 3.13Å; E338-R342 IonicContact OE2-NH2 2.72Å; N339-R342 PolarHBondContact O-N 3.37Å; R342-S344 PolarHBondContact O-N 3.34Å; R342-N360 PolarHBondContact NE-O 3.07Å; R342-L361 HydrophobicContact CG-CD2 3.68Å
343	K	86.3	Confident	88.1	Confident	140 Å²	140	35.5 Å²	35.5	61%	0.609	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	4.6	176	-66.5	-178.2	178.4	-176.7	0	113.5	N339 G340 F341 L345	N339-K343 WeakPolarHBondContact O-CB 3.16Å; N339-K343 WeakPolarHBondContact O-CG 3.12Å; N339-K343 PolarHBondContact O-N 2.94Å; N339-K343 VanDerWaalsContact OD1-CE 3.32Å; N339-K343 WeakPolarHBondContact OD1-CE 3.43Å; G340-K343 CarbonylContact O-C 3.51Å; F341-K343 PolarHBondContact O-N 3.39Å; K343-L345 HydrophobicContact CB-CD1 4.45Å; K343-L345 HydrophobicContact CB-CG 4.34Å; K343-L345 PolarHBondContact O-N 3.25Å; K343-L345 VanDerWaalsContact O-N 3.16Å
344	S	87	Confident	87.5	Confident	32 Å²	32	38.3 Å²	38.3	22%	0.224	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	21.4	179.7	-60.5	0	0	0	0	115.4	G340 F341 R342 R347	G340-S344 CarbonylContact O-C 3.37Å; G340-S344 PolarHBondContact O-N 3.4Å; F341-S344 PolarHBondContact O-N 3.31Å; F341-S344 VanDerWaalsContact O-N 3.07Å; R342-S344 PolarHBondContact O-N 3.34Å; S344-R347 VanDerWaalsContact O-CZ 3.3Å; S344-R347 PolarHBondContact O-NE 3.37Å
345	L	89.2	Confident	87.1	Confident	38 Å²	38	36 Å²	36	20%	0.199	17%	0.173	C	C	.	.	S	Bend	trans	-73.4	-37.1	167.1	-62.4	173	0	0	0	110.3	K295 Q296 F299 A321 G340 K343	K295-L345 HydrophobicContact CB-CD2 4.15Å; Q296-L345 PolarHBondContact NE2-O 2.92Å; Q296-L345 PolarHBondContact OE1-O 3.25Å; F299-L345 HydrophobicContact CB-CD1 4.22Å; F299-L345 HydrophobicContact CD1-CB 4.33Å; F299-L345 HydrophobicContact CD2-CD1 3.67Å; F299-L345 HydrophobicContact CE2-CD1 4.16Å; F299-L345 HydrophobicContact CG-CB 4.44Å; F299-L345 HydrophobicContact CG-CD1 3.92Å; A321-L345 WeakPolarHBondContact CB-O 3.1Å; G340-L345 WeakPolarHBondContact O-CA 3.36Å; G340-L345 PolarHBondContact O-N 2.9Å; K343-L345 HydrophobicContact CB-CD1 4.45Å; K343-L345 HydrophobicContact CB-CG 4.34Å; K343-L345 PolarHBondContact O-N 3.25Å; K343-L345 VanDerWaalsContact O-N 3.16Å
346	V	92.1	Very high	86.3	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.006	15%	0.152	C	C	.	.			trans	-99.3	118.1	169.1	-175.7	0	0	0	0	108.4	F299 L318 L337 G340 F341 V348 L349	F299-V346 HydrophobicContact CE1-CG2 3.78Å; F299-V346 HydrophobicContact CZ-CG2 4.3Å; L318-V346 HydrophobicContact CD2-CG2 4.09Å; L337-V346 HydrophobicContact CD2-CG2 4.34Å; G340-V346 PolarHBondContact O-N 3.2Å; G340-V346 VanDerWaalsContact O-N 3.08Å; F341-V346 HydrophobicContact CB-CB 4.29Å; F341-V346 HydrophobicContact CD2-CB 4.31Å; F341-V346 HydrophobicContact CD2-CG1 4.22Å; F341-V346 VanDerWaalsContact CD2-O 3.24Å; F341-V346 WeakPolarHBondContact CD2-O 3.44Å; V346-V348 WeakPolarHBondContact CG1-O 3.34Å; V346-L349 HydrophobicContact CG1-CB 4.17Å; V346-L349 HydrophobicContact CG1-CD1 4.3Å
347	R	89.1	Confident	85.4	Confident	32 Å²	32	28.8 Å²	28.8	12%	0.121	15%	0.147	C	C	.	.	S	Bend	trans	-95.4	-35.2	-179.7	-61.9	-65.9	-175.5	170.6	-1.8	112	V246 G249 G251 V252 A321 S344	V246-R347 HydrophobicContact CG1-CB 4.05Å; V246-R347 HydrophobicContact CG1-CG 4.35Å; V246-R347 HydrophobicContact CG2-CB 4.36Å; G249-R347 PolarHBondContact O-NH1 2.98Å; G251-R347 CarbonylContact C-O 3.5Å; G251-R347 WeakPolarHBondContact CA-O 3.47Å; V252-R347 PolarHBondContact N-O 2.92Å; A321-R347 HydrophobicContact CB-CB 4.17Å; A321-R347 HydrophobicContact CB-CG 3.83Å; A321-R347 PolarHBondContact O-N 3Å; S344-R347 VanDerWaalsContact O-CZ 3.3Å; S344-R347 PolarHBondContact O-NE 3.37Å
348	V	92	Very high	84.1	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.4	175	-174	0	0	0	0	108.7	V246 V252 V254 I269 A321 V322 G323 V346	V246-V348 HydrophobicContact CG2-CG2 3.6Å; V252-V348 HydrophobicContact CB-CG2 4.42Å; V252-V348 WeakPolarHBondContact O-CA 3.25Å; V254-V348 HydrophobicContact CG2-CG1 4.15Å; I269-V348 HydrophobicContact CD1-CG1 4.18Å; I269-V348 HydrophobicContact CG2-CG1 4.34Å; A321-V348 PolarHBondContact O-N 3.43Å; V322-V348 WeakPolarHBondContact CA-O 3.35Å; V322-V348 HydrophobicContact CG1-CB 4.45Å; V322-V348 HydrophobicContact CG2-CB 4.37Å; G323-V348 PolarHBondContact N-O 3.37Å; V346-V348 WeakPolarHBondContact CG1-O 3.34Å
349	L	93.7	Very high	83.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.9	176	-175.4	66.7	0	0	0	109.3	V252 L253 V254 G323 H325 L337 F341 V346 L355 L361	V252-L349 PolarHBondContact O-N 2.97Å; L253-L349 WeakPolarHBondContact CA-O 3.44Å; L253-L349 HydrophobicContact CD2-CB 3.95Å; L253-L349 HydrophobicContact CD2-CD2 3.97Å; L253-L349 HydrophobicContact CD2-CG 4.24Å; V254-L349 PolarHBondContact N-O 2.98Å; G323-L349 WeakPolarHBondContact O-CA 3.42Å; H325-L349 HydrophobicContact CB-CD1 4.08Å; H325-L349 HydrophobicContact CB-CD2 4.42Å; H325-L349 HydrophobicContact CB-CG 4.33Å; L337-L349 HydrophobicContact CB-CD1 4.47Å; L337-L349 HydrophobicContact CD2-CD1 4.46Å; F341-L349 HydrophobicContact CB-CD2 4.47Å; F341-L349 HydrophobicContact CD2-CB 3.72Å; F341-L349 HydrophobicContact CD2-CD2 4.39Å; F341-L349 HydrophobicContact CE2-CB 3.95Å; F341-L349 HydrophobicContact CG-CD2 4.45Å; V346-L349 HydrophobicContact CG1-CB 4.17Å; V346-L349 HydrophobicContact CG1-CD1 4.3Å; L349-L355 HydrophobicContact CD2-CD2 3.78Å; L349-L355 HydrophobicContact CG-CD2 4.44Å; L349-L361 HydrophobicContact CD2-CD1 3.77Å
350	V	92.4	Very high	82.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.8	174	-168.9	0	0	0	0	108.1	V254 C256 C262 L265 A266 I269 G323 F324 H325	V254-V350 HydrophobicContact CB-CG1 4.3Å; V254-V350 HydrophobicContact CB-CG2 4.29Å; V254-V350 HydrophobicContact CG1-CG1 4.42Å; V254-V350 CarbonylContact O-C 3.55Å; V254-V350 VanDerWaalsContact O-CA 3.29Å; V254-V350 WeakPolarHBondContact O-CA 3.48Å; C256-V350 WeakPolarHBondContact SG-CG1 3.36Å; C262-V350 HydrophobicContact CB-CG1 4.45Å; C262-V350 PolarHBondContact SG-O 2.79Å; L265-V350 HydrophobicContact CB-CG1 4.27Å; L265-V350 HydrophobicContact CD2-CG1 3.97Å; L265-V350 HydrophobicContact CG-CG1 4.33Å; A266-V350 HydrophobicContact CB-CB 4.32Å; A266-V350 HydrophobicContact CB-CG2 3.99Å; I269-V350 HydrophobicContact CD1-CG2 4.03Å; G323-V350 PolarHBondContact O-N 3.29Å; F324-V350 CarbonylContact C-O 3.59Å; F324-V350 VanDerWaalsContact C-O 3.31Å; F324-V350 WeakPolarHBondContact CA-O 3.37Å; F324-V350 HydrophobicContact CB-CB 4.44Å; H325-V350 PolarHBondContact N-O 3.46Å
351	A	90.8	Very high	81.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.9	-175	0	0	0	0	0	113.7	V254 F255 C256 C262 H325 L355	V254-A351 PolarHBondContact O-N 2.69Å; F255-A351 CarbonylContact C-O 3.58Å; F255-A351 VanDerWaalsContact CA-O 3.23Å; F255-A351 WeakPolarHBondContact CA-O 3.39Å; F255-A351 HydrophobicContact CD1-CB 4.29Å; F255-A351 HydrophobicContact CE1-CB 4.27Å; C256-A351 PolarHBondContact N-O 2.91Å; C262-A351 VanDerWaalsContact SG-CA 3.58Å; H325-A351 HydrophobicContact CB-CB 4Å; H325-A351 CarbonylContact O-C 3.56Å; H325-A351 WeakPolarHBondContact O-CA 3.47Å; A351-L355 HydrophobicContact CB-CB 3.71Å; A351-L355 HydrophobicContact CB-CD2 3.39Å; A351-L355 HydrophobicContact CB-CG 4.18Å
352	T	86.6	Confident	80.9	Confident	9 Å²	9	33.1 Å²	33.1	6%	0.055	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	170.2	162.1	52.4	0	0	0	0	110.7	K259 C262 H325 H326 T354 L355	K259-T352 HydrophobicContact CG-CG2 4.24Å; C262-T352 HydrophobicContact CB-CG2 4.29Å; H325-T352 PolarHBondContact O-N 2.93Å; H326-T352 WeakPolarHBondContact CA-OG1 3.39Å; H326-T352 HydrophobicContact CB-CG2 3.83Å; H326-T352 WeakPolarHBondContact CB-OG1 3.34Å; T352-T354 PolarHBondContact O-N 2.59Å; T352-T354 PolarHBondContact OG1-OG1 3.3Å; T352-L355 PolarHBondContact O-N 3.34Å; T352-L355 VanDerWaalsContact O-N 3.14Å
353	S	76.2	Confident	80.8	Confident	45 Å²	45	27.6 Å²	27.6	32%	0.315	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-55.7	-20.1	177.6	55.3	0	0	0	0	114.4	L355 S356 M376	S353-L355 PolarHBondContact O-N 3.38Å; S353-L355 VanDerWaalsContact O-N 3.1Å; S353-S356 WeakPolarHBondContact O-CB 3.5Å; S353-S356 PolarHBondContact O-N 3.13Å; S353-S356 PolarHBondContact O-OG 2.71Å; S353-M376 VanDerWaalsContact CB-SD 3.5Å
354	T	75	Confident	80.6	Confident	62 Å²	62	23.8 Å²	23.8	38%	0.38	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-53	-30.9	174.4	53.8	0	0	0	0	113.8	A327 T352 S356	A327-T354 HydrophobicContact CB-CG2 4.31Å; T352-T354 PolarHBondContact O-N 2.59Å; T352-T354 PolarHBondContact OG1-OG1 3.3Å; T354-S356 VanDerWaalsContact C-N 3.32Å
355	L	79.3	Confident	80.5	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.026	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-76.7	-18.4	177.3	-175	68.8	0	0	0	112.7	L253 F255 H325 E338 L349 A351 T352 S353 S357 V359 L361	L253-L355 HydrophobicContact CD2-CD2 3.78Å; F255-L355 HydrophobicContact CE1-CB 4.13Å; H325-L355 HydrophobicContact CB-CD2 4.39Å; H325-L355 VanDerWaalsContact CE1-CD1 3.47Å; H325-L355 WeakPolarHBondContact CE1-CD1 3.29Å; H325-L355 WeakPolarHBondContact NE2-CD1 3.26Å; E338-L355 HydrophobicContact CG-CD1 4.35Å; L349-L355 HydrophobicContact CD2-CD2 3.78Å; L349-L355 HydrophobicContact CG-CD2 4.44Å; A351-L355 HydrophobicContact CB-CB 3.71Å; A351-L355 HydrophobicContact CB-CD2 3.39Å; A351-L355 HydrophobicContact CB-CG 4.18Å; T352-L355 PolarHBondContact O-N 3.34Å; T352-L355 VanDerWaalsContact O-N 3.14Å; S353-L355 PolarHBondContact O-N 3.38Å; S353-L355 VanDerWaalsContact O-N 3.1Å; L355-S357 PolarHBondContact O-N 3.1Å; L355-V359 HydrophobicContact CD1-CB 4.41Å; L355-V359 HydrophobicContact CD1-CG2 4.43Å; L355-L361 HydrophobicContact CD1-CD1 3.92Å; L355-L361 HydrophobicContact CD2-CD1 4.19Å
356	S	67.9	Low	80.3	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.014	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.6	-178.3	76.5	0	0	0	0	111.9	S353 T354 Q379 R383	S353-S356 WeakPolarHBondContact O-CB 3.5Å; S353-S356 PolarHBondContact O-N 3.13Å; S353-S356 PolarHBondContact O-OG 2.71Å; T354-S356 VanDerWaalsContact C-N 3.32Å; S356-Q379 PolarHBondContact OG-OE1 2.71Å; S356-R383 PolarHBondContact O-NH2 2.87Å
357	S	66.3	Low	79.9	Confident	31 Å²	31	21.6 Å²	21.6	22%	0.217	13%	0.126	C	C	.	.	S	Bend	trans	-97.9	131.8	-178.8	80.9	0	0	0	0	112.4	F86 L355 V359	F86-S357 WeakPolarHBondContact CE2-OG 3.44Å; F86-S357 WeakPolarHBondContact CZ-OG 3.46Å; L355-S357 PolarHBondContact O-N 3.1Å; S357-V359 PolarHBondContact O-N 2.95Å
358	G	63.5	Low	79.3	Confident	24 Å²	24	20.2 Å²	20.2	25%	0.247	12%	0.122	C	C	.	.	S	Bend	trans	78.6	8.1	161.4	0	0	0	0	0	118.5	V89	V89-G358 VanDerWaalsContact CG2-O 3.26Å; V89-G358 WeakPolarHBondContact CG2-O 3.3Å
359	V	67.8	Low	78.3	Confident	18 Å²	18	21 Å²	21	11%	0.109	13%	0.13	C	C	.	.			trans	-130.7	130.5	174.7	-170.6	0	0	0	0	111.5	E338 L355 S357 L361 R383	E338-V359 HydrophobicContact CB-CG1 4.45Å; E338-V359 VanDerWaalsContact CD-CG1 3.49Å; E338-V359 HydrophobicContact CG-CG1 3.97Å; E338-V359 WeakPolarHBondContact OE2-CG1 3.3Å; L355-V359 HydrophobicContact CD1-CB 4.41Å; L355-V359 HydrophobicContact CD1-CG2 4.43Å; S357-V359 PolarHBondContact O-N 2.95Å; V359-L361 HydrophobicContact CG1-CD1 4.49Å; V359-L361 HydrophobicContact CG1-CG 3.87Å; V359-L361 PolarHBondContact O-N 3.09Å; V359-L361 VanDerWaalsContact O-N 3.15Å; V359-R383 PolarHBondContact O-NH1 3.09Å; V359-R383 PolarHBondContact O-NH2 3.04Å
360	N	68.8	Low	76.9	Confident	96 Å²	96	23.2 Å²	23.2	51%	0.513	14%	0.144	S	C	.	.			trans	-82.2	84.9	173.8	-168.9	20.3	0	0	0	111.9	R342	R342-N360 PolarHBondContact NE-O 3.07Å
361	L	78.1	Confident	75.3	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.016	15%	0.15	C	C	.	.			trans	-118.5	83.5	169.9	-68.6	-174.4	0	0	0	111	L253 E338 F341 R342 L349 L355 V359	L253-L361 WeakPolarHBondContact CD1-O 3.36Å; E338-L361 HydrophobicContact CB-CD1 4.15Å; E338-L361 HydrophobicContact CB-CD2 3.99Å; E338-L361 HydrophobicContact CB-CG 4.38Å; E338-L361 HydrophobicContact CG-CD1 3.79Å; E338-L361 HydrophobicContact CG-CD2 4.47Å; E338-L361 HydrophobicContact CG-CG 4.32Å; E338-L361 VanDerWaalsContact O-CD2 3.31Å; E338-L361 WeakPolarHBondContact O-CD2 3.28Å; F341-L361 HydrophobicContact CB-CD2 4.32Å; F341-L361 HydrophobicContact CD1-CB 4.26Å; F341-L361 HydrophobicContact CD1-CD1 4.38Å; F341-L361 HydrophobicContact CD1-CD2 4.05Å; F341-L361 HydrophobicContact CD1-CG 4.48Å; R342-L361 HydrophobicContact CG-CD2 3.68Å; L349-L361 HydrophobicContact CD2-CD1 3.77Å; L355-L361 HydrophobicContact CD1-CD1 3.92Å; L355-L361 HydrophobicContact CD2-CD1 4.19Å; V359-L361 HydrophobicContact CG1-CD1 4.49Å; V359-L361 HydrophobicContact CG1-CG 3.87Å; V359-L361 PolarHBondContact O-N 3.09Å; V359-L361 VanDerWaalsContact O-N 3.15Å
362	P	72.3	Confident	73.9	Confident	41 Å²	41	32.5 Å²	32.5	27%	0.266	19%	0.194	S	C	.	.			trans	-78	131.1	176.9	32.3	-33.4	0	0	0	110	R383 R386	P362-R383 WeakPolarHBondContact CA-O 3.4Å; P362-R386 HydrophobicContact CB-CB 4.4Å; P362-R386 HydrophobicContact CB-CG 3.59Å; P362-R386 HydrophobicContact CG-CG 3.79Å; P362-R386 VanDerWaalsContact O-CD 3.26Å; P362-R386 WeakPolarHBondContact O-CD 3.41Å; P362-R386 VanDerWaalsContact O-CG 3.29Å; P362-R386 WeakPolarHBondContact O-CG 3.42Å
363	A	82.4	Confident	72.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-125.5	146.6	-178.6	0	0	0	0	0	109.3	L253 F341 R365 R383 A384 G385	L253-A363 HydrophobicContact CB-CB 4.17Å; L253-A363 HydrophobicContact CD1-CB 3.58Å; L253-A363 HydrophobicContact CG-CB 3.66Å; F341-A363 HydrophobicContact CE1-CB 3.95Å; F341-A363 HydrophobicContact CZ-CB 3.65Å; A363-R365 PolarHBondContact O-N 2.83Å; A363-R383 PolarHBondContact N-O 2.75Å; A363-A384 CarbonylContact O-C 3.09Å; A363-A384 WeakPolarHBondContact O-CA 3.45Å; A363-G385 PolarHBondContact O-N 3.27Å
364	K	82.5	Confident	72.4	Confident	60 Å²	60	36.3 Å²	36.3	26%	0.261	21%	0.214	S	C	.	.	S	Bend	trans	-60.4	-36.7	-180	-178.4	169.5	-176.8	170.5	0	111.9	T245 C250 G251 D390 M394	T245-K364 HydrophobicContact CG2-CB 4.11Å; T245-K364 HydrophobicContact CG2-CD 4.3Å; T245-K364 HydrophobicContact CG2-CG 4.41Å; C250-K364 HydrophobicContact CB-CB 3.8Å; C250-K364 HydrophobicContact CB-CD 3.66Å; C250-K364 HydrophobicContact CB-CG 4.38Å; C250-K364 WeakPolarHBondContact SG-CD 3.33Å; G251-K364 PolarHBondContact O-N 3.5Å; G251-K364 VanDerWaalsContact O-N 3.14Å; K364-D390 WeakPolarHBondContact CA-OD2 3.35Å; K364-D390 WeakPolarHBondContact CD-OD1 3.5Å; K364-D390 WeakPolarHBondContact CG-OD1 3.14Å; K364-M394 PolarHBondContact O-N 3.34Å; K364-M394 VanDerWaalsContact O-N 3.08Å
365	R	84.3	Confident	72.1	Confident	13 Å²	13	35.4 Å²	35.4	5%	0.049	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.3	-176.9	-171.3	175.7	-72.1	-174.8	4	110.9	L240 L241 E244 T245 V252 L253 A363 I367 M394	L240-R365 PolarHBondContact O-NH1 3.43Å; L241-R365 VanDerWaalsContact O-CD 3.3Å; L241-R365 WeakPolarHBondContact O-CD 3.35Å; L241-R365 PolarHBondContact O-NH1 2.94Å; E244-R365 IonicContact OE2-NH1 3.44Å; E244-R365 IonicContact OE2-NH2 3.7Å; T245-R365 HydrophobicContact CG2-CB 4.17Å; T245-R365 PolarHBondContact OG1-NE 3.48Å; T245-R365 VanDerWaalsContact OG1-NE 3.1Å; T245-R365 PolarHBondContact OG1-NH1 3.08Å; T245-R365 PolarHBondContact OG1-NH2 3.39Å; V252-R365 WeakPolarHBondContact CA-O 3.39Å; V252-R365 HydrophobicContact CG2-CB 4.5Å; L253-R365 PolarHBondContact N-O 3.13Å; A363-R365 PolarHBondContact O-N 2.83Å; R365-I367 HydrophobicContact CG-CG1 4.39Å; R365-M394 CarbonylContact C-O 3.46Å; R365-M394 WeakPolarHBondContact CA-O 3.48Å; R365-M394 HydrophobicContact CG-CB 4.31Å
366	V	85.9	Confident	71.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.8	169.3	175.7	0	0	0	0	108.6	L253 F255 R383 A384 M394 A395 K396	L253-V366 HydrophobicContact CB-CG2 4.17Å; L253-V366 HydrophobicContact CD1-CG2 4.41Å; L253-V366 CarbonylContact O-C 3.57Å; L253-V366 WeakPolarHBondContact O-CA 3.47Å; F255-V366 HydrophobicContact CD2-CG1 3.66Å; F255-V366 HydrophobicContact CE2-CG1 3.73Å; V366-R383 HydrophobicContact CG2-CB 4.02Å; V366-A384 HydrophobicContact CB-CB 4.03Å; V366-A384 HydrophobicContact CG2-CB 3.65Å; V366-M394 PolarHBondContact N-O 3.13Å; V366-A395 CarbonylContact O-C 3.37Å; V366-A395 WeakPolarHBondContact O-CA 3.34Å; V366-K396 PolarHBondContact O-N 2.98Å
367	I	83	Confident	72.1	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.5	173.5	-63.2	153.3	0	0	0	107	L241 C242 V252 L253 V254 F255 R365 K396	L241-I367 HydrophobicContact CD1-CD1 3.82Å; L241-I367 HydrophobicContact CD1-CG1 3.96Å; L241-I367 HydrophobicContact CD1-CG2 4.24Å; L241-I367 HydrophobicContact CD2-CD1 4.17Å; L241-I367 HydrophobicContact CD2-CG2 4.46Å; L241-I367 HydrophobicContact CG-CD1 3.58Å; L241-I367 HydrophobicContact CG-CG1 4.28Å; C242-I367 VanDerWaalsContact SG-CD1 3.51Å; V252-I367 HydrophobicContact CG1-CD1 3.76Å; L253-I367 PolarHBondContact O-N 2.65Å; V254-I367 CarbonylContact C-O 3.39Å; V254-I367 WeakPolarHBondContact CA-O 3.31Å; V254-I367 HydrophobicContact CG1-CB 4.32Å; V254-I367 HydrophobicContact CG1-CG2 4.28Å; V254-I367 HydrophobicContact CG2-CB 4.36Å; V254-I367 HydrophobicContact CG2-CD1 4.03Å; F255-I367 PolarHBondContact N-O 2.95Å; R365-I367 HydrophobicContact CG-CG1 4.39Å; I367-K396 CarbonylContact C-O 3.53Å; I367-K396 WeakPolarHBondContact CA-O 3.47Å; I367-K396 HydrophobicContact CG1-CB 4.2Å
368	S	77.3	Confident	72.6	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.4	178.7	-172.7	0	0	0	0	110	M380 K396 Y398	S368-M380 WeakPolarHBondContact OG-CE 3.36Å; S368-K396 PolarHBondContact N-O 3.42Å; S368-Y398 PolarHBondContact O-N 2.85Å
369	G	70.6	Confident	73.2	Confident	17 Å²	17	40.6 Å²	40.6	18%	0.175	22%	0.217	C	C	.	.			trans	-69.1	-177.6	167.8	0	0	0	0	0	112.7	F255 C371 F397	F255-G369 PolarHBondContact O-N 3.29Å; F255-G369 VanDerWaalsContact O-N 3.09Å; G369-C371 PolarHBondContact O-N 3.46Å; G369-F397 VanDerWaalsContact O-CE2 3.28Å; G369-F397 WeakPolarHBondContact O-CE2 3.16Å
370	P	63.7	Low	73.7	Confident	47 Å²	47	40 Å²	40	31%	0.305	21%	0.213	S	C	.	.			trans	-57	112.5	174.4	22.3	-30.6	0	0	0	109.8	Y398	P370-Y398 WeakPolarHBondContact CD-O 3.4Å
371	C	60.3	Low	74.2	Confident	19 Å²	19	35.7 Å²	35.7	13%	0.128	19%	0.19	C	C	.	.			trans	-92.2	157.3	178.5	-165	0	0	0	0	109.8	G369 M376 M380 Y410	G369-C371 PolarHBondContact O-N 3.46Å; C371-M376 VanDerWaalsContact SG-CB 3.57Å; C371-M380 HydrophobicContact CB-CE 3.97Å; C371-M380 WeakPolarHBondContact SG-CE 3.48Å; C371-Y410 VanDerWaalsContact C-OH 3.29Å; C371-Y410 PolarHBondContact O-OH 2.67Å
372	L	60.9	Low	74.1	Confident	176 Å²	176	36 Å²	36	92%	0.921	20%	0.195	S	C	*	.	S	Bend	trans	-83	-28.7	-179.6	-66.7	169	0	0	0	112.7
373	D	64.7	Low	74.4	Confident	93 Å²	93	35.7 Å²	35.7	50%	0.497	19%	0.188	S	C	.	.			trans	-145	154.1	-175.5	-169.6	16.4	0	0	0	113.6	Y375 Y377 Y410	D373-Y375 VanDerWaalsContact C-N 3.32Å; D373-Y375 PolarHBondContact O-N 2.96Å; D373-Y377 PolarHBondContact O-N 3.37Å; D373-Y410 PolarHBondContact N-OH 3.1Å
374	S	66.4	Low	74.4	Confident	41 Å²	41	35.7 Å²	35.7	29%	0.287	19%	0.188	S	C	.	.	H	α-helix	trans	-59	-38.3	178	-168.4	0	0	0	0	112.7	K378	S374-K378 WeakPolarHBondContact O-CG 3.38Å; S374-K378 PolarHBondContact O-N 3.02Å
375	Y	68.8	Low	74.2	Confident	44 Å²	44	33.1 Å²	33.1	17%	0.173	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-53.2	179.9	172.1	-118.2	0	0	0	112	E157 H159 T194 D373 Y377 K378 Q379	E157-Y375 PolarHBondContact OE2-OH 3.16Å; H159-Y375 AromaticContact CD2-CE1 3.81Å; H159-Y375 AromaticContact CD2-CZ 3.84Å; H159-Y375 AromaticContact CE1-CE1 3.76Å; H159-Y375 AromaticContact CE1-CE2 3.86Å; H159-Y375 AromaticContact CE1-CZ 3.16Å; H159-Y375 PolarHBondContact CE1-OH 3.45Å; H159-Y375 AromaticContact ND1-CE2 3.99Å; H159-Y375 AromaticContact ND1-CZ 3.74Å; H159-Y375 AromaticContact NE2-CE1 3.24Å; H159-Y375 WeakPolarHBondContact NE2-CE1 3.49Å; H159-Y375 AromaticContact NE2-CZ 3.18Å; H159-Y375 PolarHBondContact NE2-OH 3.46Å; H159-Y375 VanDerWaalsContact NE2-OH 3.16Å; T194-Y375 VanDerWaalsContact OG1-CD2 3.29Å; T194-Y375 WeakPolarHBondContact OG1-CD2 3.32Å; D373-Y375 VanDerWaalsContact C-N 3.32Å; D373-Y375 PolarHBondContact O-N 2.96Å; Y375-Y377 VanDerWaalsContact C-N 3.31Å; Y375-Y377 PolarHBondContact O-N 3.3Å; Y375-K378 PolarHBondContact O-N 3Å; Y375-K378 VanDerWaalsContact O-N 3.15Å; Y375-Q379 HydrophobicContact CD2-CG 4.46Å; Y375-Q379 HydrophobicContact CE1-CG 4.39Å; Y375-Q379 HydrophobicContact CE2-CG 3.9Å; Y375-Q379 VanDerWaalsContact CZ-CD 3.44Å; Y375-Q379 PolarHBondContact O-N 3.49Å; Y375-Q379 PolarHBondContact OH-NE2 3.05Å
376	M	72.3	Confident	73.7	Confident	61 Å²	61	34.1 Å²	34.1	30%	0.3	18%	0.182	S	C	.	.	H	α-helix	trans	-61.5	-42	-178.9	-166.6	101	73.6	0	0	110.9	S353 C371 K378 Q379 M380	S353-M376 VanDerWaalsContact CB-SD 3.5Å; C371-M376 VanDerWaalsContact SG-CB 3.57Å; M376-K378 PolarHBondContact O-N 2.91Å; M376-Q379 PolarHBondContact O-N 2.97Å; M376-M380 HydrophobicContact CG-CE 4.19Å; M376-M380 WeakPolarHBondContact O-CE 3.44Å; M376-M380 VanDerWaalsContact O-CG 3.31Å; M376-M380 WeakPolarHBondContact O-CG 3.19Å; M376-M380 PolarHBondContact O-N 2.92Å
377	Y	75.1	Confident	72.8	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.039	21%	0.212	C	C	.	.	H	α-helix	trans	-56.7	-48.6	173.5	173.9	-100.8	0	0	0	112.2	E221 D373 Y375 Q379 M380 T381 F397 Y410	E221-Y377 WeakPolarHBondContact OE1-CE1 3.5Å; E221-Y377 PolarHBondContact OE1-OH 2.97Å; D373-Y377 PolarHBondContact O-N 3.37Å; Y375-Y377 VanDerWaalsContact C-N 3.31Å; Y375-Y377 PolarHBondContact O-N 3.3Å; Y377-Q379 PolarHBondContact O-N 3.07Å; Y377-M380 PolarHBondContact O-N 3.43Å; Y377-T381 HydrophobicContact CD1-CG2 4.43Å; Y377-T381 HydrophobicContact CD2-CG2 4.01Å; Y377-T381 HydrophobicContact CE1-CG2 3.98Å; Y377-T381 HydrophobicContact CE2-CG2 3.5Å; Y377-T381 HydrophobicContact CG-CG2 4.44Å; Y377-T381 VanDerWaalsContact CZ-CG2 3.49Å; Y377-T381 WeakPolarHBondContact O-CG2 3.37Å; Y377-T381 PolarHBondContact O-N 2.73Å; Y377-T381 PolarHBondContact O-OG1 3.33Å; Y377-F397 AromaticContact CD2-CD2 3.83Å; Y377-F397 HydrophobicContact CD2-CD2 3.83Å; Y377-F397 HydrophobicContact CD2-CE2 4.28Å; Y377-F397 HydrophobicContact CE2-CB 4.08Å; Y377-F397 AromaticContact CE2-CD2 3.62Å; Y377-F397 HydrophobicContact CE2-CD2 3.62Å; Y377-F397 HydrophobicContact CE2-CE2 4.47Å; Y377-F397 HydrophobicContact CE2-CG 4.2Å; Y377-Y410 HydrophobicContact CD1-CD1 4Å; Y377-Y410 HydrophobicContact CD1-CE1 4.35Å; Y377-Y410 HydrophobicContact CG-CD1 4.07Å; Y377-Y410 HydrophobicContact CG-CE1 4Å
378	K	75.5	Confident	71.9	Confident	88 Å²	88	44.6 Å²	44.6	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-65.8	-35	179.5	-74	-177	178.1	-172.5	0	113.7	T194 S374 Y375 M376 T381 G382	T194-K378 HydrophobicContact CG2-CB 4.41Å; T194-K378 HydrophobicContact CG2-CD 3.37Å; S374-K378 WeakPolarHBondContact O-CG 3.38Å; S374-K378 PolarHBondContact O-N 3.02Å; Y375-K378 PolarHBondContact O-N 3Å; Y375-K378 VanDerWaalsContact O-N 3.15Å; M376-K378 PolarHBondContact O-N 2.91Å; K378-T381 PolarHBondContact O-OG1 3.33Å; K378-G382 PolarHBondContact O-N 3.42Å
379	Q	77.2	Confident	71.4	Confident	11 Å²	11	50.7 Å²	50.7	5%	0.051	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-45.3	172.4	-79.3	-171.3	69.3	0	0	111.8	S356 Y375 M376 Y377 G382	S356-Q379 PolarHBondContact OG-OE1 2.71Å; Y375-Q379 HydrophobicContact CD2-CG 4.46Å; Y375-Q379 HydrophobicContact CE1-CG 4.39Å; Y375-Q379 HydrophobicContact CE2-CG 3.9Å; Y375-Q379 VanDerWaalsContact CZ-CD 3.44Å; Y375-Q379 PolarHBondContact O-N 3.49Å; Y375-Q379 PolarHBondContact OH-NE2 3.05Å; M376-Q379 PolarHBondContact O-N 2.97Å; Y377-Q379 PolarHBondContact O-N 3.07Å; Q379-G382 PolarHBondContact O-N 2.9Å
380	M	78.3	Confident	71.5	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-51.6	178.8	-70.9	-176.3	-63.4	0	0	111	F255 S368 C371 M376 Y377 G382 R383	F255-M380 HydrophobicContact CB-CG 4.37Å; F255-M380 HydrophobicContact CB-SD 3.34Å; F255-M380 WeakPolarHBondContact CB-SD 3.34Å; F255-M380 HydrophobicContact CD1-CG 3.77Å; F255-M380 HydrophobicContact CD1-SD 3.57Å; F255-M380 VanDerWaalsContact CD1-SD 3.57Å; F255-M380 HydrophobicContact CD2-CB 3.61Å; F255-M380 HydrophobicContact CD2-CG 3.68Å; F255-M380 HydrophobicContact CD2-SD 3.81Å; F255-M380 HydrophobicContact CE1-CG 3.85Å; F255-M380 HydrophobicContact CE1-SD 4.26Å; F255-M380 HydrophobicContact CE2-CB 3.6Å; F255-M380 HydrophobicContact CE2-CG 3.76Å; F255-M380 HydrophobicContact CE2-SD 4.47Å; F255-M380 HydrophobicContact CG-CB 4.13Å; F255-M380 HydrophobicContact CG-CG 3.68Å; F255-M380 HydrophobicContact CG-SD 3.29Å; F255-M380 WeakPolarHBondContact CG-SD 3.33Å; F255-M380 HydrophobicContact CZ-CB 4.11Å; F255-M380 HydrophobicContact CZ-CG 3.84Å; S368-M380 WeakPolarHBondContact OG-CE 3.36Å; C371-M380 HydrophobicContact CB-CE 3.97Å; C371-M380 WeakPolarHBondContact SG-CE 3.48Å; M376-M380 HydrophobicContact CG-CE 4.19Å; M376-M380 WeakPolarHBondContact O-CE 3.44Å; M376-M380 VanDerWaalsContact O-CG 3.31Å; M376-M380 WeakPolarHBondContact O-CG 3.19Å; M376-M380 PolarHBondContact O-N 2.92Å; Y377-M380 PolarHBondContact O-N 3.43Å; M380-G382 VanDerWaalsContact C-N 3.26Å; M380-G382 PolarHBondContact O-N 2.86Å; M380-R383 WeakPolarHBondContact O-CB 3.39Å; M380-R383 PolarHBondContact O-N 2.87Å
381	T	79.5	Confident	71.7	Confident	6 Å²	6	55 Å²	55	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-69.4	-24.4	-179.3	60.4	0	0	0	0	113.2	Y377 K378 R383 A384 A395	Y377-T381 HydrophobicContact CD1-CG2 4.43Å; Y377-T381 HydrophobicContact CD2-CG2 4.01Å; Y377-T381 HydrophobicContact CE1-CG2 3.98Å; Y377-T381 HydrophobicContact CE2-CG2 3.5Å; Y377-T381 HydrophobicContact CG-CG2 4.44Å; Y377-T381 VanDerWaalsContact CZ-CG2 3.49Å; Y377-T381 WeakPolarHBondContact O-CG2 3.37Å; Y377-T381 PolarHBondContact O-N 2.73Å; Y377-T381 PolarHBondContact O-OG1 3.33Å; K378-T381 PolarHBondContact O-OG1 3.33Å; T381-R383 PolarHBondContact O-N 3.34Å; T381-A384 WeakPolarHBondContact O-CB 3.38Å; T381-A384 PolarHBondContact O-N 3.43Å; T381-A395 HydrophobicContact CG2-CB 3.51Å
382	G	75.8	Confident	72.4	Confident	10 Å²	10	58.1 Å²	58.1	10%	0.103	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.9	172.4	0	0	0	0	0	114.4	R215 K378 Q379 M380	R215-G382 PolarHBondContact NH2-O 2.96Å; K378-G382 PolarHBondContact O-N 3.42Å; Q379-G382 PolarHBondContact O-N 2.9Å; M380-G382 VanDerWaalsContact C-N 3.26Å; M380-G382 PolarHBondContact O-N 2.86Å
383	R	78.6	Confident	72.9	Confident	33 Å²	33	49.8 Å²	49.8	13%	0.125	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.7	175.9	-54.5	-62.8	177.4	-175.5	1.5	114.3	L253 S356 V359 P362 A363 V366 M380 T381	L253-R383 HydrophobicContact CD1-CB 3.97Å; S356-R383 PolarHBondContact O-NH2 2.87Å; V359-R383 PolarHBondContact O-NH1 3.09Å; V359-R383 PolarHBondContact O-NH2 3.04Å; P362-R383 WeakPolarHBondContact CA-O 3.4Å; A363-R383 PolarHBondContact N-O 2.75Å; V366-R383 HydrophobicContact CG2-CB 4.02Å; M380-R383 WeakPolarHBondContact O-CB 3.39Å; M380-R383 PolarHBondContact O-N 2.87Å; T381-R383 PolarHBondContact O-N 3.34Å
384	A	81.8	Confident	73.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-81.6	117.5	-175.5	0	0	0	0	0	112.9	R215 L219 A363 V366 T381 G393 M394	R215-A384 PolarHBondContact NH1-O 2.95Å; R215-A384 PolarHBondContact NH2-O 3.07Å; L219-A384 HydrophobicContact CD1-CB 3.6Å; A363-A384 CarbonylContact O-C 3.09Å; A363-A384 WeakPolarHBondContact O-CA 3.45Å; V366-A384 HydrophobicContact CB-CB 4.03Å; V366-A384 HydrophobicContact CG2-CB 3.65Å; T381-A384 WeakPolarHBondContact O-CB 3.38Å; T381-A384 PolarHBondContact O-N 3.43Å; A384-G393 WeakPolarHBondContact O-CA 3.12Å; A384-M394 WeakPolarHBondContact CB-O 3.39Å
385	G	77.8	Confident	73.9	Confident	6 Å²	6	45.2 Å²	45.2	6%	0.062	24%	0.244	C	C	.	.	S	Bend	trans	99.7	119.3	-179	0	0	0	0	0	112.2	A363	A363-G385 PolarHBondContact O-N 3.27Å
386	R	73.7	Confident	74	Confident	34 Å²	34	43.4 Å²	43.4	13%	0.128	24%	0.237	C	C	.	.			trans	-90.8	117.8	178.1	-69.5	179.6	-84.8	-175.1	3.2	111.2	P362 G388 L389 D390	P362-R386 HydrophobicContact CB-CB 4.4Å; P362-R386 HydrophobicContact CB-CG 3.59Å; P362-R386 HydrophobicContact CG-CG 3.79Å; P362-R386 VanDerWaalsContact O-CD 3.26Å; P362-R386 WeakPolarHBondContact O-CD 3.41Å; P362-R386 VanDerWaalsContact O-CG 3.29Å; P362-R386 WeakPolarHBondContact O-CG 3.42Å; R386-G388 PolarHBondContact O-N 3.21Å; R386-L389 HydrophobicContact CB-CB 3.9Å; R386-L389 HydrophobicContact CB-CD1 4.27Å; R386-L389 PolarHBondContact O-N 3.23Å; R386-L389 VanDerWaalsContact O-N 3.1Å; R386-D390 HydrophobicContact CB-CB 4.49Å; R386-D390 VanDerWaalsContact CB-OD2 3.24Å; R386-D390 WeakPolarHBondContact CB-OD2 3.48Å; R386-D390 WeakPolarHBondContact CG-OD2 3.36Å; R386-D390 PolarHBondContact N-OD2 3.27Å; R386-D390 IonicContact NE-OD2 3.88Å; R386-D390 PolarHBondContact NE-OD2 3.34Å; R386-D390 PolarHBondContact O-N 3.08Å
387	K	67.6	Low	73.8	Confident	148 Å²	148	40.8 Å²	40.8	64%	0.643	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	126.4	171.7	-172.4	-175.2	177	-169.1	0	109.2	P216 V217	P216-K387 HydrophobicContact CB-CD 4.47Å; P216-K387 HydrophobicContact CG-CD 4.4Å; V217-K387 HydrophobicContact CG2-CB 4.39Å
388	G	64.3	Low	73.2	Confident	83 Å²	83	44.4 Å²	44.4	86%	0.856	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.3	-13.6	-178.9	0	0	0	0	0	115.6	R386	R386-G388 PolarHBondContact O-N 3.21Å
389	L	66.6	Low	72.3	Confident	131 Å²	131	41.1 Å²	41.1	69%	0.686	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-41.7	-179.7	-72.5	166.5	0	0	0	113	R386	R386-L389 HydrophobicContact CB-CB 3.9Å; R386-L389 HydrophobicContact CB-CD1 4.27Å; R386-L389 PolarHBondContact O-N 3.23Å; R386-L389 VanDerWaalsContact O-N 3.1Å
390	D	72.6	Confident	70.9	Confident	16 Å²	16	45.9 Å²	45.9	9%	0.086	25%	0.25	C	C	.	.			trans	-104.1	133.7	-178.1	-63.7	-52.6	0	0	0	110.5	K364 R386 Q392	K364-D390 WeakPolarHBondContact CA-OD2 3.35Å; K364-D390 WeakPolarHBondContact CD-OD1 3.5Å; K364-D390 WeakPolarHBondContact CG-OD1 3.14Å; R386-D390 HydrophobicContact CB-CB 4.49Å; R386-D390 VanDerWaalsContact CB-OD2 3.24Å; R386-D390 WeakPolarHBondContact CB-OD2 3.48Å; R386-D390 WeakPolarHBondContact CG-OD2 3.36Å; R386-D390 PolarHBondContact N-OD2 3.27Å; R386-D390 IonicContact NE-OD2 3.88Å; R386-D390 PolarHBondContact NE-OD2 3.34Å; R386-D390 PolarHBondContact O-N 3.08Å; D390-Q392 VanDerWaalsContact C-N 3.32Å
391	V	68.7	Low	69.1	Low	140 Å²	140	53.2 Å²	53.2	85%	0.848	28%	0.278	S	S	*	.	S	Bend	trans	-74.3	-27.3	173.5	-168.2	0	0	0	0	111.3
392	Q	73.3	Confident	67.1	Low	84 Å²	84	62.8 Å²	62.8	39%	0.393	32%	0.319	S	S	.	.	S	Bend	trans	-153	140.1	-175.5	-175.3	-175.7	9.8	0	0	110.2	T220 D390	T220-Q392 VanDerWaalsContact CB-NE2 3.32Å; T220-Q392 PolarHBondContact OG1-NE2 2.9Å; D390-Q392 VanDerWaalsContact C-N 3.32Å
393	G	71.5	Confident	65.4	Low	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	143.3	171.6	0	0	0	0	0	111.9	P218 T220 A384	P218-G393 PolarHBondContact O-N 3.37Å; T220-G393 PolarHBondContact N-O 2.95Å; A384-G393 WeakPolarHBondContact O-CA 3.12Å
394	M	78.4	Confident	63.6	Low	38 Å²	38	69.8 Å²	69.8	19%	0.187	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.1	176.5	-65.4	-179.1	126.1	0	0	111.5	T220 Y222 K364 R365 V366 A384	T220-M394 WeakPolarHBondContact O-CA 3.45Å; Y222-M394 HydrophobicContact CE2-CE 3.76Å; Y222-M394 HydrophobicContact CE2-CG 4.36Å; K364-M394 PolarHBondContact O-N 3.34Å; K364-M394 VanDerWaalsContact O-N 3.08Å; R365-M394 CarbonylContact C-O 3.46Å; R365-M394 WeakPolarHBondContact CA-O 3.48Å; R365-M394 HydrophobicContact CG-CB 4.31Å; V366-M394 PolarHBondContact N-O 3.13Å; A384-M394 WeakPolarHBondContact CB-O 3.39Å
395	A	74.9	Confident	61.6	Low	0 Å²	0	78.7 Å²	78.7	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127	169	0	0	0	0	0	110.1	L219 T220 E221 Y222 V366 T381	L219-A395 HydrophobicContact CD1-CB 3.93Å; L219-A395 HydrophobicContact CG-CB 4.45Å; T220-A395 PolarHBondContact O-N 3.25Å; E221-A395 CarbonylContact C-O 3.53Å; E221-A395 VanDerWaalsContact CA-O 3.3Å; E221-A395 WeakPolarHBondContact CA-O 3.39Å; E221-A395 HydrophobicContact CG-CB 4.22Å; Y222-A395 PolarHBondContact N-O 3.4Å; V366-A395 CarbonylContact O-C 3.37Å; V366-A395 WeakPolarHBondContact O-CA 3.34Å; T381-A395 HydrophobicContact CG2-CB 3.51Å
396	K	71.1	Confident	59.7	Low	6 Å²	6	81.2 Å²	81.2	3%	0.026	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117.7	177.2	-70.6	179	167	-164.8	0	108.7	Y222 F229 S239 L240 L241 V366 I367 S368	Y222-K396 HydrophobicContact CD2-CG 4.24Å; Y222-K396 CarbonylContact O-C 3.57Å; Y222-K396 WeakPolarHBondContact O-CA 3.45Å; F229-K396 HydrophobicContact CD1-CD 4.04Å; F229-K396 HydrophobicContact CD1-CG 4.24Å; F229-K396 HydrophobicContact CE1-CB 4.2Å; F229-K396 HydrophobicContact CE1-CD 3.44Å; F229-K396 VanDerWaalsContact CE1-CD 3.44Å; F229-K396 HydrophobicContact CE1-CG 3.93Å; F229-K396 HydrophobicContact CZ-CD 3.99Å; S239-K396 PolarHBondContact OG-NZ 3.45Å; L240-K396 PolarHBondContact O-NZ 2.62Å; L240-K396 VanDerWaalsContact O-NZ 3.16Å; L241-K396 HydrophobicContact CD1-CD 3.99Å; V366-K396 PolarHBondContact O-N 2.98Å; I367-K396 CarbonylContact C-O 3.53Å; I367-K396 WeakPolarHBondContact CA-O 3.47Å; I367-K396 HydrophobicContact CG1-CB 4.2Å; S368-K396 PolarHBondContact N-O 3.42Å
397	F	67.5	Low	58	Low	6 Å²	6	83.3 Å²	83.3	3%	0.026	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.1	175.7	-176.1	-101.5	0	0	0	110.3	Y222 L223 F224 G369 Y377 H399 Y410	Y222-F397 PolarHBondContact O-N 3.36Å; L223-F397 HydrophobicContact CD1-CD1 3.69Å; L223-F397 HydrophobicContact CD1-CE1 4.43Å; F224-F397 PolarHBondContact N-O 3.22Å; G369-F397 VanDerWaalsContact O-CE2 3.28Å; G369-F397 WeakPolarHBondContact O-CE2 3.16Å; Y377-F397 AromaticContact CD2-CD2 3.83Å; Y377-F397 HydrophobicContact CD2-CD2 3.83Å; Y377-F397 HydrophobicContact CD2-CE2 4.28Å; Y377-F397 HydrophobicContact CE2-CB 4.08Å; Y377-F397 AromaticContact CE2-CD2 3.62Å; Y377-F397 HydrophobicContact CE2-CD2 3.62Å; Y377-F397 HydrophobicContact CE2-CE2 4.47Å; Y377-F397 HydrophobicContact CE2-CG 4.2Å; F397-H399 HydrophobicContact CE1-CB 4.21Å; F397-Y410 HydrophobicContact CZ-CD2 4.39Å; F397-Y410 HydrophobicContact CZ-CE2 4.16Å
398	Y	63.6	Low	56.7	Low	87 Å²	87	80.8 Å²	80.8	34%	0.341	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.6	-179.3	-176.8	-97.3	0	0	0	110.8	F224 S368 P370 L400	F224-Y398 HydrophobicContact CB-CD2 4.24Å; F224-Y398 AromaticContact CD1-CD2 3.15Å; F224-Y398 HydrophobicContact CD1-CD2 3.15Å; F224-Y398 AromaticContact CD1-CE2 3.25Å; F224-Y398 HydrophobicContact CD1-CE2 3.25Å; F224-Y398 HydrophobicContact CD1-CG 4.3Å; F224-Y398 AromaticContact CE1-CD2 3.68Å; F224-Y398 HydrophobicContact CE1-CD2 3.68Å; F224-Y398 AromaticContact CE1-CE2 3.25Å; F224-Y398 HydrophobicContact CE1-CE2 3.25Å; F224-Y398 AromaticContact CG-CD2 3.95Å; F224-Y398 HydrophobicContact CG-CD2 3.95Å; F224-Y398 HydrophobicContact CG-CE2 4.38Å; F224-Y398 HydrophobicContact CZ-CE2 4.36Å; S368-Y398 PolarHBondContact O-N 2.85Å; P370-Y398 WeakPolarHBondContact CD-O 3.4Å; Y398-L400 HydrophobicContact CD1-CD1 4.22Å; Y398-L400 HydrophobicContact CD1-CG 4.16Å; Y398-L400 HydrophobicContact CE1-CD1 3.53Å; Y398-L400 HydrophobicContact CE1-CD2 4.07Å; Y398-L400 HydrophobicContact CE1-CG 3.37Å
399	H	55.6	Low	55.7	Low	18 Å²	18	80.8 Å²	80.8	8%	0.083	39%	0.392	C	S	.	.			trans	-110.7	120.7	179.5	-169.7	52.7	0	0	0	111	L223 F224 F397 Y401	L223-H399 HydrophobicContact CD1-CB 4.11Å; F224-H399 PolarHBondContact O-N 3.43Å; F397-H399 HydrophobicContact CE1-CB 4.21Å; H399-Y401 PolarHBondContact CD2-O 3.3Å; H399-Y401 PolarHBondContact NE2-O 2.88Å
400	L	47.4	Very low	54.7	Low	112 Å²	112	75.8 Å²	75.8	59%	0.586	36%	0.364	S	S	*	.			trans	-94	-16.7	-179.2	-97.3	156.8	0	0	0	114.6	Y398	Y398-L400 HydrophobicContact CD1-CD1 4.22Å; Y398-L400 HydrophobicContact CD1-CG 4.16Å; Y398-L400 HydrophobicContact CE1-CD1 3.53Å; Y398-L400 HydrophobicContact CE1-CD2 4.07Å; Y398-L400 HydrophobicContact CE1-CG 3.37Å
401	Y	40.1	Very low	53.4	Low	159 Å²	159	76.9 Å²	76.9	62%	0.624	37%	0.368	S	S	*	.			trans	-102.3	135.4	-168.3	-76	-80.8	0	0	0	113	H399 T403	H399-Y401 PolarHBondContact CD2-O 3.3Å; H399-Y401 PolarHBondContact NE2-O 2.88Å; Y401-T403 PolarHBondContact O-N 2.99Å
402	K	38.6	Very low	52.1	Low	208 Å²	208	74.9 Å²	74.9	90%	0.904	36%	0.358	S	S	*	.	S	Bend	trans	-62.6	-4.5	171.5	-84.8	-177.5	174.7	177.6	0	114.2
403	T	39.3	Very low	50.5	Low	89 Å²	89	80.7 Å²	80.7	55%	0.546	38%	0.382	S	S	.	.			trans	-89.8	125.1	-175.1	35.5	0	0	0	0	112.9	Y401 R405	Y401-T403 PolarHBondContact O-N 2.99Å; T403-R405 PolarHBondContact O-N 3.36Å; T403-R405 VanDerWaalsContact O-N 3.1Å
404	D	41.1	Very low	48.9	Very low	101 Å²	101	83.7 Å²	83.7	54%	0.54	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-7.4	-178.9	-82.4	-41.1	0	0	0	115.1	L406 K407	D404-L406 VanDerWaalsContact C-N 3.31Å; D404-L406 PolarHBondContact O-N 2.86Å; D404-K407 PolarHBondContact O-N 2.71Å; D404-K407 IonicContact OD1-NZ 3.84Å; D404-K407 PolarHBondContact OD1-NZ 3.26Å
405	R	39.3	Very low	46.7	Very low	187 Å²	187	92.6 Å²	92.6	71%	0.706	43%	0.429	S	S	*	.	H	α-helix	trans	-57.6	-36	-174.3	-86.8	-171.1	173.2	-163.7	-3.1	114.1	T403 T409	T403-R405 PolarHBondContact O-N 3.36Å; T403-R405 VanDerWaalsContact O-N 3.1Å; R405-T409 PolarHBondContact O-OG1 2.98Å
406	L	38.4	Very low	44.6	Very low	58 Å²	58	102.3 Å²	102.3	30%	0.304	47%	0.472	S	S	.	.	H	α-helix	trans	-87.6	-18.4	-176.9	-74.6	165.7	0	0	0	114.5	D404 L408 T409 Y410	D404-L406 VanDerWaalsContact C-N 3.31Å; D404-L406 PolarHBondContact O-N 2.86Å; L406-L408 PolarHBondContact O-N 2.84Å; L406-T409 PolarHBondContact O-N 3.5Å; L406-Y410 HydrophobicContact CD2-CD2 4.47Å; L406-Y410 HydrophobicContact CD2-CE2 3.9Å
407	K	39	Very low	42.6	Very low	79 Å²	79	112.6 Å²	112.6	34%	0.343	51%	0.511	S	S	.	.	H	α-helix	trans	-56.2	-38.3	170.9	-77	-178.7	-173.3	155.3	0	110.2	D404 F411 L414	D404-K407 PolarHBondContact O-N 2.71Å; D404-K407 IonicContact OD1-NZ 3.84Å; D404-K407 PolarHBondContact OD1-NZ 3.26Å; K407-F411 PolarHBondContact O-N 3.06Å; K407-L414 HydrophobicContact CB-CD1 4.03Å; K407-L414 WeakPolarHBondContact O-CD1 3.38Å
408	L	40	Very low	40.7	Very low	95 Å²	95	122.9 Å²	122.9	50%	0.497	55%	0.549	S	S	.	.	H	α-helix	trans	-72.2	-31.6	-178.9	-78.9	149.2	0	0	0	114.1	L406 L414	L406-L408 PolarHBondContact O-N 2.84Å; L408-L414 HydrophobicContact CD2-CB 3.63Å; L408-L414 HydrophobicContact CG-CB 4.34Å
409	T	42.8	Very low	38.9	Very low	83 Å²	83	126.6 Å²	126.6	51%	0.509	58%	0.575	S	S	.	*	H	α-helix	trans	-77.7	-38.1	-173.7	-30.2	0	0	0	0	112.8	R405 L406	R405-T409 PolarHBondContact O-OG1 2.98Å; L406-T409 PolarHBondContact O-N 3.5Å
410	Y	44.7	Very low	37.6	Very low	25 Å²	25	130.7 Å²	130.7	10%	0.098	61%	0.605	C	S	.	*	H	α-helix	trans	-92.8	-21.6	-177	-67.6	-77.3	0	0	0	113.8	C371 D373 Y377 F397 L406 P412	C371-Y410 VanDerWaalsContact C-OH 3.29Å; C371-Y410 PolarHBondContact O-OH 2.67Å; D373-Y410 PolarHBondContact N-OH 3.1Å; Y377-Y410 HydrophobicContact CD1-CD1 4Å; Y377-Y410 HydrophobicContact CD1-CE1 4.35Å; Y377-Y410 HydrophobicContact CG-CD1 4.07Å; Y377-Y410 HydrophobicContact CG-CE1 4Å; F397-Y410 HydrophobicContact CZ-CD2 4.39Å; F397-Y410 HydrophobicContact CZ-CE2 4.16Å; L406-Y410 HydrophobicContact CD2-CD2 4.47Å; L406-Y410 HydrophobicContact CD2-CE2 3.9Å; Y410-P412 WeakPolarHBondContact O-CD 3.42Å
411	F	45.4	Very low	36.6	Very low	39 Å²	39	132.9 Å²	132.9	17%	0.171	62%	0.617	C	S	.	*			trans	-120.5	80.5	178.5	-60	-79	0	0	0	111.2	K232 K407 K413 L414	K232-F411 HydrophobicContact CG-CE1 4.25Å; K407-F411 PolarHBondContact O-N 3.06Å; F411-K413 PolarHBondContact O-N 3.31Å; F411-L414 HydrophobicContact CB-CD1 4.24Å; F411-L414 PolarHBondContact O-N 3.01Å; F411-L414 VanDerWaalsContact O-N 3.1Å
412	P	42.6	Very low	36	Very low	98 Å²	98	130 Å²	130	64%	0.636	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-63.6	-14	-171.8	22	-32.5	0	0	0	114.9	Y410 L414 R415	Y410-P412 WeakPolarHBondContact O-CD 3.42Å; P412-L414 PolarHBondContact O-N 3.4Å; P412-R415 WeakPolarHBondContact O-CB 3.25Å; P412-R415 PolarHBondContact O-N 2.97Å
413	K	39.7	Very low	35.4	Very low	206 Å²	206	122.9 Å²	122.9	90%	0.896	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-60.6	-12.4	171.5	-77	-170	176.6	-177.3	0	113.3	F411 R415	F411-K413 PolarHBondContact O-N 3.31Å; K413-R415 VanDerWaalsContact C-N 3.29Å; K413-R415 PolarHBondContact O-N 2.9Å
414	L	38.6	Very low	34.9	Very low	64 Å²	64	126 Å²	126	34%	0.335	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-74.5	-12.9	171.9	-73.6	161.9	0	0	0	114.3	K407 L408 F411 P412 K416	K407-L414 HydrophobicContact CB-CD1 4.03Å; K407-L414 WeakPolarHBondContact O-CD1 3.38Å; L408-L414 HydrophobicContact CD2-CB 3.63Å; L408-L414 HydrophobicContact CG-CB 4.34Å; F411-L414 HydrophobicContact CB-CD1 4.24Å; F411-L414 PolarHBondContact O-N 3.01Å; F411-L414 VanDerWaalsContact O-N 3.1Å; P412-L414 PolarHBondContact O-N 3.4Å; L414-K416 PolarHBondContact O-N 2.91Å; L414-K416 VanDerWaalsContact O-N 3.13Å
415	R	31.3	Very low	34.2	Very low	224 Å²	224	127.3 Å²	127.3	85%	0.845	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-67.5	-14.1	-175.4	-158.4	174.8	167.1	140.2	0.7	114.1	P412 K413 R417	P412-R415 WeakPolarHBondContact O-CB 3.25Å; P412-R415 PolarHBondContact O-N 2.97Å; K413-R415 VanDerWaalsContact C-N 3.29Å; K413-R415 PolarHBondContact O-N 2.9Å; R415-R417 VanDerWaalsContact C-N 3.27Å; R415-R417 PolarHBondContact O-N 3.24Å
416	K	30.3	Very low	33.6	Very low	205 Å²	205	128.8 Å²	128.8	89%	0.891	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-76	-3.4	-178.4	-82.1	-165.1	175.6	-172.8	0	115.4	L414	L414-K416 PolarHBondContact O-N 2.91Å; L414-K416 VanDerWaalsContact O-N 3.13Å
417	R	29.2	Very low	33.1	Very low	222 Å²	222	130.6 Å²	130.6	84%	0.838	65%	0.654	S	S	*	*	S	Bend	trans	-140.3	83.1	178.9	-71	-173.4	176.4	179.8	-1.3	111.3	R415	R415-R417 VanDerWaalsContact C-N 3.27Å; R415-R417 PolarHBondContact O-N 3.24Å
418	R	27.2	Very low	32.6	Very low	221 Å²	221	128.8 Å²	128.8	83%	0.834	65%	0.651	S	S	*	*			trans	160.6	121.3	134.4	-85.6	160.7	-167.2	-166.7	4	109.4	C420	R418-C420 PolarHBondContact O-N 3.19Å
419	N	27.3	Very low	32	Very low	165 Å²	165	130.3 Å²	130.3	88%	0.882	65%	0.654	S	S	*	*			trans	-61.4	107.3	161.3	-68.4	-15.1	0	0	0	107.2
420	C	27.1	Very low	31.4	Very low	105 Å²	105	135.2 Å²	135.2	71%	0.709	67%	0.67	S	S	*	*			trans	-127.9	89.3	173.5	-57	0	0	0	0	107.9	R418	R418-C420 PolarHBondContact O-N 3.19Å
421	D	26	Very low	30.7	Very low	157 Å²	157	139.3 Å²	139.3	84%	0.84	70%	0.698	S	S	*	*			trans	-59.9	157	159.3	-67	-52.6	0	0	0	110.8
422	A	28.4	Very low	29.9	Very low	98 Å²	98	138.9 Å²	138.9	81%	0.81	70%	0.699	S	S	*	*	S	Bend	trans	89.2	-9.4	158.1	0	0	0	0	0	121.8
423	A	26.8	Very low	29.3	Very low	59 Å²	59	140.6 Å²	140.6	49%	0.488	70%	0.702	S	S	.	*	S	Bend	trans	-99.6	-19.8	-178.3	0	0	0	0	0	116.5	I425	A423-I425 VanDerWaalsContact C-N 3.32Å; A423-I425 PolarHBondContact O-N 3.39Å
424	D	27.6	Very low	28.8	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-1.6	-172.6	-84.1	-16.2	0	0	0	115
425	I	27	Very low	28.3	Very low	129 Å²	129	139.6 Å²	139.6	66%	0.662	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-10.1	-176.4	-60.9	176.9	0	0	0	113.2	A423 S428	A423-I425 VanDerWaalsContact C-N 3.32Å; A423-I425 PolarHBondContact O-N 3.39Å; I425-S428 PolarHBondContact O-OG 3.05Å
426	R	26.8	Very low	28.1	Very low	219 Å²	219	133.3 Å²	133.3	83%	0.826	68%	0.681	S	S	*	*	S	Bend	trans	-87.7	-28.3	179.9	-86.6	-175.4	178.9	-176.7	-0.6	115.3
427	A	27.9	Very low	28.1	Very low	96 Å²	96	130.3 Å²	130.3	79%	0.793	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-12.6	179.5	0	0	0	0	0	113.6
428	S	28.3	Very low	28.1	Very low	40 Å²	40	126.6 Å²	126.6	28%	0.28	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	0.3	176.7	68.4	0	0	0	0	114	I425 E430 T431 T432	I425-S428 PolarHBondContact O-OG 3.05Å; S428-E430 PolarHBondContact O-N 3.31Å; S428-T431 PolarHBondContact O-N 2.96Å; S428-T432 VanDerWaalsContact O-CB 3.3Å; S428-T432 WeakPolarHBondContact O-CB 3.41Å; S428-T432 WeakPolarHBondContact O-CG2 3.24Å; S428-T432 PolarHBondContact O-N 2.78Å; S428-T432 PolarHBondContact O-OG1 3.25Å
429	K	27.6	Very low	28.2	Very low	128 Å²	128	120.8 Å²	120.8	56%	0.557	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-18.6	-175.3	-83.1	-167.8	174.7	-171.5	0	115.1	T432 K436	K429-T432 PolarHBondContact O-OG1 2.82Å; K429-K436 PolarHBondContact O-NZ 3.17Å
430	E	30.5	Very low	28.3	Very low	185 Å²	185	122.6 Å²	122.6	86%	0.864	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-26.9	176.1	-72.9	-178.2	169.9	0	0	113.4	S428 T432	S428-E430 PolarHBondContact O-N 3.31Å; E430-T432 VanDerWaalsContact C-N 3.35Å
431	T	29.7	Very low	28.2	Very low	112 Å²	112	121 Å²	121	69%	0.687	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-3.6	173.1	35.2	0	0	0	0	113.9	S428 P434	S428-T431 PolarHBondContact O-N 2.96Å; T431-P434 VanDerWaalsContact O-CD 3.31Å; T431-P434 WeakPolarHBondContact O-CD 3.48Å
432	T	27.4	Very low	28.4	Very low	30 Å²	30	119.5 Å²	119.5	18%	0.184	64%	0.642	C	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	19.1	175.7	44	0	0	0	0	113.3	S428 K429 E430 P434 Y435 K436	S428-T432 VanDerWaalsContact O-CB 3.3Å; S428-T432 WeakPolarHBondContact O-CB 3.41Å; S428-T432 WeakPolarHBondContact O-CG2 3.24Å; S428-T432 PolarHBondContact O-N 2.78Å; S428-T432 PolarHBondContact O-OG1 3.25Å; K429-T432 PolarHBondContact O-OG1 2.82Å; E430-T432 VanDerWaalsContact C-N 3.35Å; T432-P434 VanDerWaalsContact C-CD 3.49Å; T432-P434 VanDerWaalsContact C-N 3.25Å; T432-Y435 CarbonylContact O-C 3.52Å; T432-Y435 PolarHBondContact O-N 2.9Å; T432-K436 WeakPolarHBondContact O-CA 2.92Å; T432-K436 WeakPolarHBondContact O-CB 3.49Å; T432-K436 WeakPolarHBondContact O-CG 3.39Å; T432-K436 PolarHBondContact O-N 2.97Å
433	L	30	Very low	28.4	Very low	134 Å²	134	123.3 Å²	123.3	70%	0.702	64%	0.643	S	S	*	*	H	α-helix	trans	-59.1	-35.5	168	-153.6	73.2	0	0	0	112.4
434	P	30.1	Very low	28.6	Very low	99 Å²	99	124.4 Å²	124.4	64%	0.643	65%	0.647	S	S	*	*	H	α-helix	trans	-71.9	-24.3	169	-16.7	31.8	0	0	0	114.2	T431 T432	T431-P434 VanDerWaalsContact O-CD 3.31Å; T431-P434 WeakPolarHBondContact O-CD 3.48Å; T432-P434 VanDerWaalsContact C-CD 3.49Å; T432-P434 VanDerWaalsContact C-N 3.25Å
435	Y	28.5	Very low	29	Very low	149 Å²	149	124.5 Å²	124.5	58%	0.584	64%	0.637	S	S	*	*	H	α-helix	trans	-98.4	-20.8	-177.2	-126.5	-81.6	0	0	0	114.2	T432 L437 Q438 T439	T432-Y435 CarbonylContact O-C 3.52Å; T432-Y435 PolarHBondContact O-N 2.9Å; Y435-L437 VanDerWaalsContact C-N 3.28Å; Y435-Q438 PolarHBondContact O-N 3.5Å; Y435-Q438 VanDerWaalsContact O-N 3.13Å; Y435-T439 PolarHBondContact O-N 3.32Å; Y435-T439 PolarHBondContact O-OG1 2.87Å
436	K	26.2	Very low	29.5	Very low	93 Å²	93	128.2 Å²	128.2	40%	0.404	65%	0.652	S	S	.	*	H	α-helix	trans	-72.2	-27.3	169.9	-82.4	-179.2	176	168.9	0	110.8	K429 T432 Q438 T439 W440	K429-K436 PolarHBondContact O-NZ 3.17Å; T432-K436 WeakPolarHBondContact O-CA 2.92Å; T432-K436 WeakPolarHBondContact O-CB 3.49Å; T432-K436 WeakPolarHBondContact O-CG 3.39Å; T432-K436 PolarHBondContact O-N 2.97Å; K436-Q438 PolarHBondContact O-N 3.25Å; K436-T439 WeakPolarHBondContact CA-OG1 3.45Å; K436-T439 PolarHBondContact O-N 3.29Å; K436-T439 VanDerWaalsContact O-N 3.11Å; K436-W440 PolarHBondContact O-N 3.28Å; K436-W440 VanDerWaalsContact O-N 3.11Å
437	L	30	Very low	30	Very low	141 Å²	141	122 Å²	122	74%	0.738	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-19.7	166.6	-78.3	165.8	0	0	0	113	Y435	Y435-L437 VanDerWaalsContact C-N 3.28Å
438	Q	30.9	Very low	31.1	Very low	144 Å²	144	121.3 Å²	121.3	67%	0.673	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-16.8	172.3	-100.2	-175.7	-7.7	0	0	114.6	Y435 K436	Y435-Q438 PolarHBondContact O-N 3.5Å; Y435-Q438 VanDerWaalsContact O-N 3.13Å; K436-Q438 PolarHBondContact O-N 3.25Å
439	T	29.3	Very low	32.2	Very low	100 Å²	100	124 Å²	124	61%	0.613	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-9.9	-171.8	41.3	0	0	0	0	115.2	Y435 K436 G441	Y435-T439 PolarHBondContact O-N 3.32Å; Y435-T439 PolarHBondContact O-OG1 2.87Å; K436-T439 WeakPolarHBondContact CA-OG1 3.45Å; K436-T439 PolarHBondContact O-N 3.29Å; K436-T439 VanDerWaalsContact O-N 3.11Å; T439-G441 VanDerWaalsContact C-N 3.32Å; T439-G441 PolarHBondContact O-N 2.83Å; T439-G441 VanDerWaalsContact O-N 3.12Å
440	W	27.6	Very low	33.7	Very low	203 Å²	203	122 Å²	122	77%	0.769	63%	0.626	S	S	*	*	S	Bend	trans	-73.5	99.9	149.9	-77	0.3	0	0	0	106.9	K436 I442	K436-W440 PolarHBondContact O-N 3.28Å; K436-W440 VanDerWaalsContact O-N 3.11Å; W440-I442 HydrophobicContact CB-CD1 4.41Å; W440-I442 HydrophobicContact CB-CG1 4.25Å; W440-I442 PolarHBondContact O-N 3.35Å
441	G	26.5	Very low	35.2	Very low	71 Å²	71	116.8 Å²	116.8	73%	0.732	60%	0.601	S	S	*	*			trans	-63.5	58	173.9	0	0	0	0	0	112.1	T439 Q443	T439-G441 VanDerWaalsContact C-N 3.32Å; T439-G441 PolarHBondContact O-N 2.83Å; T439-G441 VanDerWaalsContact O-N 3.12Å; G441-Q443 PolarHBondContact O-N 2.87Å
442	I	29.4	Very low	36.8	Very low	126 Å²	126	116.5 Å²	116.5	65%	0.646	59%	0.592	S	S	*	*			trans	-78	80.1	165	-55.8	177.7	0	0	0	104.8	W440 S444	W440-I442 HydrophobicContact CB-CD1 4.41Å; W440-I442 HydrophobicContact CB-CG1 4.25Å; W440-I442 PolarHBondContact O-N 3.35Å; I442-S444 WeakPolarHBondContact CG2-O 3.48Å; I442-S444 PolarHBondContact O-N 3.21Å
443	Q	28.5	Very low	38.7	Very low	177 Å²	177	118.5 Å²	118.5	83%	0.827	61%	0.607	S	S	*	*			trans	-49.6	123.6	157.9	-68.4	175.7	-19.7	0	0	107.2	G441	G441-Q443 PolarHBondContact O-N 2.87Å
444	S	31.6	Very low	40.6	Very low	83 Å²	83	114 Å²	114	58%	0.58	58%	0.583	S	S	*	*	S	Bend	trans	64.2	105.5	-173.4	73.7	0	0	0	0	112.5	I442	I442-S444 WeakPolarHBondContact CG2-O 3.48Å; I442-S444 PolarHBondContact O-N 3.21Å
445	Y	35.5	Very low	42.5	Very low	156 Å²	156	112.2 Å²	112.2	61%	0.612	57%	0.565	S	S	*	*				-155.2	113.2	61.3	-74.4	-92.2	0	0	0	108.1	W447 C477	Y445-W447 PolarHBondContact O-N 3.01Å; Y445-C477 WeakPolarHBondContact CE1-SG 3.37Å
446	Q	38	Very low	44.7	Very low	207 Å²	207	107.1 Å²	107.1	97%	0.967	55%	0.551	S	S	*	*			trans	-69.7	100.8	174	-91.5	178	-28.7	0	0	109.2
447	W	36.6	Very low	47.3	Very low	88 Å²	88	104.9 Å²	104.9	33%	0.333	54%	0.544	S	S	.	.			trans	-88.6	132.4	159.2	-67.2	80.7	0	0	0	108	Y445 P449 Q451 Q452 F478	Y445-W447 PolarHBondContact O-N 3.01Å; W447-P449 WeakPolarHBondContact O-CD 3.41Å; W447-Q451 HydrophobicContact CE3-CB 4.5Å; W447-Q452 HydrophobicContact CB-CG 3.7Å; W447-Q452 HydrophobicContact CG-CG 4.34Å; W447-F478 HydrophobicContact CH2-CB 3.59Å; W447-F478 AromaticContact CH2-CD2 3.66Å; W447-F478 HydrophobicContact CH2-CD2 3.66Å; W447-F478 AromaticContact CH2-CG 3.94Å; W447-F478 HydrophobicContact CH2-CG 3.94Å; W447-F478 HydrophobicContact CZ2-CB 4.13Å; W447-F478 HydrophobicContact CZ2-CD2 4.02Å
448	D	51.9	Low	49.6	Very low	82 Å²	82	100.5 Å²	100.5	44%	0.439	52%	0.523	S	S	.	.			trans	-62.1	127.8	166.2	-179.5	-5.3	0	0	0	108.3	V450 Q451 Q452	D448-V450 PolarHBondContact O-N 2.89Å; D448-V450 PolarHBondContact OD1-N 3.04Å; D448-Q451 HydrophobicContact CB-CB 4.33Å; D448-Q451 HydrophobicContact CB-CG 4.1Å; D448-Q451 WeakPolarHBondContact O-CB 3.28Å; D448-Q451 PolarHBondContact O-N 2.93Å; D448-Q452 PolarHBondContact O-N 3.06Å; D448-Q452 VanDerWaalsContact O-N 3.12Å
449	P	50.8	Low	51.9	Low	96 Å²	96	100.5 Å²	100.5	62%	0.623	52%	0.523	S	S	*	.	H	α-helix	trans	-48.1	-29.7	173.5	-29.6	34.9	0	0	0	113.9	W447 C453	W447-P449 WeakPolarHBondContact O-CD 3.41Å; P449-C453 WeakPolarHBondContact O-CB 3.42Å; P449-C453 PolarHBondContact O-N 3.41Å; P449-C453 VanDerWaalsContact O-N 3.09Å
450	V	58.6	Low	54.4	Low	85 Å²	85	100.4 Å²	100.4	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-67.1	-44.8	174.7	-178.5	0	0	0	0	111.4	D448 Q452 C453 L454	D448-V450 PolarHBondContact O-N 2.89Å; D448-V450 PolarHBondContact OD1-N 3.04Å; V450-Q452 PolarHBondContact O-N 3Å; V450-C453 WeakPolarHBondContact O-CB 3.43Å; V450-C453 PolarHBondContact O-N 2.84Å; V450-L454 HydrophobicContact CG1-CD1 4.24Å; V450-L454 WeakPolarHBondContact O-CG 3.46Å; V450-L454 PolarHBondContact O-N 3.43Å
451	Q	61.8	Low	57.1	Low	76 Å²	76	95.7 Å²	95.7	36%	0.355	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-38.7	177.5	-72.2	-177.3	-28.3	0	0	112.1	W447 D448 C453 L454 F455 F483	W447-Q451 HydrophobicContact CE3-CB 4.5Å; D448-Q451 HydrophobicContact CB-CB 4.33Å; D448-Q451 HydrophobicContact CB-CG 4.1Å; D448-Q451 WeakPolarHBondContact O-CB 3.28Å; D448-Q451 PolarHBondContact O-N 2.93Å; Q451-C453 VanDerWaalsContact C-N 3.31Å; Q451-C453 PolarHBondContact O-N 2.72Å; Q451-L454 PolarHBondContact O-N 3.46Å; Q451-F455 WeakPolarHBondContact O-CB 3.38Å; Q451-F455 PolarHBondContact O-N 3.06Å; Q451-F483 HydrophobicContact CB-CE2 4.5Å; Q451-F483 HydrophobicContact CG-CE2 4.25Å
452	Q	63.3	Low	59.8	Low	107 Å²	107	92.7 Å²	92.7	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-63	-39.7	173.6	-67.9	-175.2	-18.5	0	0	111.9	W447 D448 V450 S456	W447-Q452 HydrophobicContact CB-CG 3.7Å; W447-Q452 HydrophobicContact CG-CG 4.34Å; D448-Q452 PolarHBondContact O-N 3.06Å; D448-Q452 VanDerWaalsContact O-N 3.12Å; V450-Q452 PolarHBondContact O-N 3Å; Q452-S456 WeakPolarHBondContact O-CB 3.3Å; Q452-S456 PolarHBondContact O-N 3.43Å
453	C	67.7	Low	62.4	Low	71 Å²	71	87.8 Å²	87.8	48%	0.48	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-49.3	176.7	-170.4	0	0	0	0	111.1	P449 V450 Q451 F455 S456 L457	P449-C453 WeakPolarHBondContact O-CB 3.42Å; P449-C453 PolarHBondContact O-N 3.41Å; P449-C453 VanDerWaalsContact O-N 3.09Å; V450-C453 WeakPolarHBondContact O-CB 3.43Å; V450-C453 PolarHBondContact O-N 2.84Å; Q451-C453 VanDerWaalsContact C-N 3.31Å; Q451-C453 PolarHBondContact O-N 2.72Å; C453-F455 VanDerWaalsContact C-N 3.35Å; C453-F455 PolarHBondContact O-N 2.95Å; C453-S456 PolarHBondContact O-N 2.88Å; C453-L457 VanDerWaalsContact O-CG 3.3Å; C453-L457 WeakPolarHBondContact O-CG 3.39Å; C453-L457 PolarHBondContact O-N 3.4Å
454	L	69.4	Low	64.7	Low	40 Å²	40	81.6 Å²	81.6	21%	0.209	42%	0.419	C	S	.	.	H	α-helix	trans	-58.1	-46.9	177.2	-72.1	172.5	0	0	0	111.3	V450 Q451 S456 L457 T458 I463 F483 I487	V450-L454 HydrophobicContact CG1-CD1 4.24Å; V450-L454 WeakPolarHBondContact O-CG 3.46Å; V450-L454 PolarHBondContact O-N 3.43Å; Q451-L454 PolarHBondContact O-N 3.46Å; L454-S456 PolarHBondContact O-N 3.34Å; L454-L457 PolarHBondContact O-N 3.38Å; L454-L457 VanDerWaalsContact O-N 3.16Å; L454-T458 PolarHBondContact O-N 3.01Å; L454-T458 PolarHBondContact O-OG1 3.5Å; L454-I463 HydrophobicContact CD2-CD1 3.84Å; L454-F483 HydrophobicContact CB-CE1 3.65Å; L454-F483 HydrophobicContact CB-CE2 4.21Å; L454-F483 HydrophobicContact CB-CZ 3.41Å; L454-F483 VanDerWaalsContact CB-CZ 3.41Å; L454-F483 HydrophobicContact CD1-CD1 4.32Å; L454-F483 HydrophobicContact CD1-CD2 4.29Å; L454-F483 HydrophobicContact CD1-CE1 4.1Å; L454-F483 HydrophobicContact CD1-CE2 4.06Å; L454-F483 HydrophobicContact CD1-CG 4.42Å; L454-F483 HydrophobicContact CD1-CZ 3.97Å; L454-F483 HydrophobicContact CG-CE1 4.42Å; L454-F483 HydrophobicContact CG-CZ 4.34Å; L454-I487 HydrophobicContact CD1-CD1 4.39Å; L454-I487 HydrophobicContact CD2-CD1 4.13Å
455	F	69.6	Low	66.6	Low	61 Å²	61	79.6 Å²	79.6	27%	0.268	41%	0.405	S	S	.	.	H	α-helix	trans	-58.1	-47.9	176.9	-177.4	-91.6	0	0	0	112.2	Q451 C453 L457 T458 E459 F478 L481	Q451-F455 WeakPolarHBondContact O-CB 3.38Å; Q451-F455 PolarHBondContact O-N 3.06Å; C453-F455 VanDerWaalsContact C-N 3.35Å; C453-F455 PolarHBondContact O-N 2.95Å; F455-L457 VanDerWaalsContact C-N 3.28Å; F455-L457 PolarHBondContact O-N 3.12Å; F455-T458 PolarHBondContact O-N 2.83Å; F455-E459 WeakPolarHBondContact O-CB 3.38Å; F455-E459 PolarHBondContact O-N 3.19Å; F455-F478 AromaticContact CE2-CE1 3.97Å; F455-F478 HydrophobicContact CE2-CE1 3.97Å; F455-F478 HydrophobicContact CE2-CE2 4.11Å; F455-F478 AromaticContact CE2-CZ 3.67Å; F455-F478 HydrophobicContact CE2-CZ 3.67Å; F455-F478 HydrophobicContact CZ-CE1 4.42Å; F455-F478 HydrophobicContact CZ-CE2 4.03Å; F455-F478 AromaticContact CZ-CZ 3.7Å; F455-F478 HydrophobicContact CZ-CZ 3.7Å; F455-L481 HydrophobicContact CD2-CD1 4.32Å
456	S	75.4	Confident	67.6	Low	42 Å²	42	76.2 Å²	76.2	29%	0.294	40%	0.404	S	S	.	.	H	α-helix	trans	-60.5	-37	177.3	-178.5	0	0	0	0	112.4	Q452 C453 L454 R460	Q452-S456 WeakPolarHBondContact O-CB 3.3Å; Q452-S456 PolarHBondContact O-N 3.43Å; C453-S456 PolarHBondContact O-N 2.88Å; L454-S456 PolarHBondContact O-N 3.34Å; S456-R460 WeakPolarHBondContact O-CB 3.17Å; S456-R460 VanDerWaalsContact O-CG 3.3Å; S456-R460 WeakPolarHBondContact O-CG 3.49Å; S456-R460 PolarHBondContact O-N 3.19Å; S456-R460 VanDerWaalsContact O-N 3.17Å
457	L	80.7	Confident	68.3	Low	46 Å²	46	69.3 Å²	69.3	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-71.2	-38.5	176.6	-69.3	173.1	0	0	0	112.3	C453 L454 F455 N461 F462 I463	C453-L457 VanDerWaalsContact O-CG 3.3Å; C453-L457 WeakPolarHBondContact O-CG 3.39Å; C453-L457 PolarHBondContact O-N 3.4Å; L454-L457 PolarHBondContact O-N 3.38Å; L454-L457 VanDerWaalsContact O-N 3.16Å; F455-L457 VanDerWaalsContact C-N 3.28Å; F455-L457 PolarHBondContact O-N 3.12Å; L457-N461 PolarHBondContact O-N 3.5Å; L457-F462 HydrophobicContact CB-CB 4.29Å; L457-F462 HydrophobicContact CD2-CB 4Å; L457-F462 HydrophobicContact CD2-CD2 3.82Å; L457-F462 HydrophobicContact CD2-CG 4.12Å; L457-F462 PolarHBondContact O-N 2.94Å; L457-I463 HydrophobicContact CB-CD1 3.84Å; L457-I463 HydrophobicContact CB-CG1 3.87Å
458	T	79.4	Confident	68.5	Low	50 Å²	50	75.1 Å²	75.1	31%	0.307	41%	0.413	S	S	.	.	H	α-helix	trans	-67.6	-47	175.5	-51.8	0	0	0	0	111	L454 F455 R460 N461 I463	L454-T458 PolarHBondContact O-N 3.01Å; L454-T458 PolarHBondContact O-OG1 3.5Å; F455-T458 PolarHBondContact O-N 2.83Å; T458-R460 PolarHBondContact O-N 3.39Å; T458-N461 PolarHBondContact O-N 3.16Å; T458-I463 WeakPolarHBondContact OG1-CD1 3.43Å; T458-I463 WeakPolarHBondContact OG1-CG1 3.47Å
459	E	78.6	Confident	68	Low	143 Å²	143	73.8 Å²	73.8	67%	0.668	42%	0.418	S	S	*	.	H	α-helix	trans	-59.3	-36.3	179.3	-171.7	-176.9	-175.5	0	0	111.9	F455 N461	F455-E459 WeakPolarHBondContact O-CB 3.38Å; F455-E459 PolarHBondContact O-N 3.19Å; E459-N461 VanDerWaalsContact C-N 3.29Å; E459-N461 PolarHBondContact O-N 3.4Å
460	R	80.6	Confident	67.5	Low	98 Å²	98	77.2 Å²	77.2	37%	0.37	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	12	177.5	-62.5	176.7	-179.7	-158.4	1.8	113.7	S456 T458 F462 D504	S456-R460 WeakPolarHBondContact O-CB 3.17Å; S456-R460 VanDerWaalsContact O-CG 3.3Å; S456-R460 WeakPolarHBondContact O-CG 3.49Å; S456-R460 PolarHBondContact O-N 3.19Å; S456-R460 VanDerWaalsContact O-N 3.17Å; T458-R460 PolarHBondContact O-N 3.39Å; R460-F462 VanDerWaalsContact C-N 3.29Å; R460-F462 HydrophobicContact CB-CD2 3.62Å; R460-F462 HydrophobicContact CB-CE2 3.55Å; R460-F462 PolarHBondContact O-N 3.44Å; R460-D504 IonicContact CZ-OD1 3.88Å; R460-D504 IonicContact NH1-OD1 2.9Å; R460-D504 PolarHBondContact NH1-OD1 3.13Å; R460-D504 IonicContact NH2-OD1 3.98Å
461	N	85	Confident	66.6	Low	104 Å²	104	77.6 Å²	77.6	56%	0.556	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	33.8	173.8	-158.6	22.1	0	0	0	114.1	L457 T458 E459 T490	L457-N461 PolarHBondContact O-N 3.5Å; T458-N461 PolarHBondContact O-N 3.16Å; E459-N461 VanDerWaalsContact C-N 3.29Å; E459-N461 PolarHBondContact O-N 3.4Å; N461-T490 WeakPolarHBondContact O-CB 3.46Å; N461-T490 WeakPolarHBondContact O-CG2 3.47Å; N461-T490 PolarHBondContact O-OG1 2.85Å
462	F	84.2	Confident	65.4	Low	8 Å²	8	78.8 Å²	78.8	4%	0.035	44%	0.443	C	S	.	.	S	Bend	trans	-87.1	-28.1	171.7	-69	-70.6	0	0	0	112.6	L457 R460 T490 L492 G493 T496 P503 A506 V507	L457-F462 HydrophobicContact CB-CB 4.29Å; L457-F462 HydrophobicContact CD2-CB 4Å; L457-F462 HydrophobicContact CD2-CD2 3.82Å; L457-F462 HydrophobicContact CD2-CG 4.12Å; L457-F462 PolarHBondContact O-N 2.94Å; R460-F462 VanDerWaalsContact C-N 3.29Å; R460-F462 HydrophobicContact CB-CD2 3.62Å; R460-F462 HydrophobicContact CB-CE2 3.55Å; R460-F462 PolarHBondContact O-N 3.44Å; F462-T490 VanDerWaalsContact C-OG1 3.3Å; F462-T490 WeakPolarHBondContact CA-OG1 3.4Å; F462-T490 PolarHBondContact O-N 3.42Å; F462-T490 PolarHBondContact O-OG1 3.06Å; F462-T490 VanDerWaalsContact O-OG1 3.12Å; F462-L492 HydrophobicContact CD1-CD2 4.19Å; F462-L492 HydrophobicContact CD1-CG 4.02Å; F462-L492 HydrophobicContact CE1-CD2 4Å; F462-L492 HydrophobicContact CE1-CG 3.89Å; F462-L492 HydrophobicContact CZ-CD2 4.48Å; F462-G493 WeakPolarHBondContact O-CA 3.35Å; F462-T496 HydrophobicContact CE1-CG2 4.17Å; F462-T496 VanDerWaalsContact CE1-OG1 3.29Å; F462-T496 WeakPolarHBondContact CE1-OG1 3.43Å; F462-P503 HydrophobicContact CE1-CB 4.47Å; F462-P503 HydrophobicContact CE2-CB 3.71Å; F462-P503 HydrophobicContact CZ-CB 3.67Å; F462-P503 WeakPolarHBondContact CZ-O 3.32Å; F462-A506 HydrophobicContact CE1-CB 4.29Å; F462-V507 HydrophobicContact CE2-CG2 4.13Å; F462-V507 HydrophobicContact CZ-CG2 3.74Å
463	I	82.8	Confident	64	Low	23 Å²	23	80.8 Å²	80.8	12%	0.118	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.3	176	62.2	177.4	0	0	0	109.8	L454 L457 T458 I487 S488	L454-I463 HydrophobicContact CD2-CD1 3.84Å; L457-I463 HydrophobicContact CB-CD1 3.84Å; L457-I463 HydrophobicContact CB-CG1 3.87Å; T458-I463 WeakPolarHBondContact OG1-CD1 3.43Å; T458-I463 WeakPolarHBondContact OG1-CG1 3.47Å; I463-I487 HydrophobicContact CB-CG2 4.04Å; I463-I487 HydrophobicContact CD1-CG2 3.97Å; I463-I487 HydrophobicContact CG1-CG2 4.47Å; I463-I487 HydrophobicContact CG2-CG2 4.35Å; I463-S488 CarbonylContact C-O 3.24Å; I463-S488 WeakPolarHBondContact CA-O 3.48Å
464	S	78.1	Confident	62.5	Low	47 Å²	47	80.6 Å²	80.6	33%	0.329	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.8	171.4	42.9	0	0	0	0	110.3	S488	S464-S488 PolarHBondContact N-O 3.02Å; S464-S488 PolarHBondContact O-N 2.94Å; S464-S488 PolarHBondContact OG-O 3.44Å; S464-S488 PolarHBondContact OG-OG 3.24Å
465	C	69.7	Low	61.1	Low	42 Å²	42	87.5 Å²	87.5	28%	0.284	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.4	174.6	-59.7	0	0	0	0	108.1	A467	C465-A467 PolarHBondContact O-N 3.33Å; C465-A467 VanDerWaalsContact O-N 3.1Å
466	S	57.8	Low	59.5	Low	84 Å²	84	88.3 Å²	88.3	59%	0.587	51%	0.512	S	S	*	.			trans	-78.8	21.1	-173.7	50	0	0	0	0	115.4
467	A	51.5	Low	57.5	Low	63 Å²	63	87.9 Å²	87.9	52%	0.521	51%	0.508	S	S	.	.			trans	-87.7	130.1	-177.9	0	0	0	0	0	113	C465 G469 A484	C465-A467 PolarHBondContact O-N 3.33Å; C465-A467 VanDerWaalsContact O-N 3.1Å; A467-G469 PolarHBondContact O-N 2.95Å; A467-A484 HydrophobicContact CB-CB 4.33Å
468	E	40.8	Very low	55.5	Low	210 Å²	210	88.4 Å²	88.4	98%	0.981	51%	0.509	S	S	*	.			trans	-71.7	22.3	173.4	-66.7	-172.8	149.8	0	0	114.7
469	G	42.2	Very low	53.4	Low	53 Å²	53	94.5 Å²	94.5	55%	0.546	53%	0.531	S	S	.	.			trans	-108	112.1	178.4	0	0	0	0	0	111.1	A467 P471	A467-G469 PolarHBondContact O-N 2.95Å; G469-P471 WeakPolarHBondContact O-CD 3.15Å
470	E	39.7	Very low	51.4	Low	169 Å²	169	94.1 Å²	94.1	79%	0.79	53%	0.534	S	S	*	.			trans	-54.1	127	163.9	-82.7	-174.1	162	0	0	108.7	T472	E470-T472 PolarHBondContact O-N 3.2Å; E470-T472 PolarHBondContact O-OG1 3.42Å
471	P	39.8	Very low	49.5	Very low	93 Å²	93	93 Å²	93	60%	0.604	54%	0.535	S	S	*	.			trans	-66.3	88.6	174.3	25.5	-31.1	0	0	0	108.6	G469 L473 F478	G469-P471 WeakPolarHBondContact O-CD 3.15Å; P471-L473 PolarHBondContact O-N 2.67Å; P471-F478 HydrophobicContact CB-CE1 4.32Å
472	T	36.9	Very low	47.7	Very low	101 Å²	101	95.9 Å²	95.9	62%	0.62	54%	0.544	S	S	*	.			trans	-76.8	113.7	-178.5	25.6	0	0	0	0	109.5	E470 S474	E470-T472 PolarHBondContact O-N 3.2Å; E470-T472 PolarHBondContact O-OG1 3.42Å; T472-S474 PolarHBondContact O-N 2.95Å
473	L	35.2	Very low	45.9	Very low	148 Å²	148	98.1 Å²	98.1	78%	0.775	55%	0.554	S	S	*	*			trans	-66	78.2	169.5	-84.6	154.7	0	0	0	109.9	P471 F478	P471-L473 PolarHBondContact O-N 2.67Å; L473-F478 HydrophobicContact CD2-CE2 4.42Å; L473-F478 HydrophobicContact CD2-CZ 4.09Å; L473-F478 HydrophobicContact CG-CZ 4.46Å
474	S	35.3	Very low	44.2	Very low	67 Å²	67	98.2 Å²	98.2	47%	0.469	56%	0.559	S	S	.	*			trans	-99.6	120.9	168.3	64.7	0	0	0	0	109.7	T472 G476 C477	T472-S474 PolarHBondContact O-N 2.95Å; S474-G476 VanDerWaalsContact C-N 3.34Å; S474-G476 PolarHBondContact O-N 3.42Å; S474-C477 PolarHBondContact O-N 2.89Å
475	H	40.1	Very low	42.8	Very low	186 Å²	186	105.9 Å²	105.9	86%	0.861	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.9	30.9	166.9	-61.4	81.2	0	0	0	116.9	C477	H475-C477 PolarHBondContact O-N 3.46Å
476	G	35.8	Very low	42.4	Very low	77 Å²	77	110.8 Å²	110.8	79%	0.794	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	63	14.5	174.6	0	0	0	0	0	114.5	S474	S474-G476 VanDerWaalsContact C-N 3.34Å; S474-G476 PolarHBondContact O-N 3.42Å
477	C	32.7	Very low	42.9	Very low	33 Å²	33	110.4 Å²	110.4	22%	0.223	60%	0.599	C	S	.	*			trans	-138.9	100.6	-171	-158	0	0	0	0	109.3	Y445 S474 H475 K479	Y445-C477 WeakPolarHBondContact CE1-SG 3.37Å; S474-C477 PolarHBondContact O-N 2.89Å; H475-C477 PolarHBondContact O-N 3.46Å; C477-K479 PolarHBondContact O-N 3.11Å
478	F	39.1	Very low	44.1	Very low	58 Å²	58	110.1 Å²	110.1	25%	0.254	59%	0.593	S	S	.	*			trans	-71.6	93.7	173.9	-68.8	-89.3	0	0	0	109.3	W447 F455 P471 L473 L481	W447-F478 HydrophobicContact CH2-CB 3.59Å; W447-F478 AromaticContact CH2-CD2 3.66Å; W447-F478 HydrophobicContact CH2-CD2 3.66Å; W447-F478 AromaticContact CH2-CG 3.94Å; W447-F478 HydrophobicContact CH2-CG 3.94Å; W447-F478 HydrophobicContact CZ2-CB 4.13Å; W447-F478 HydrophobicContact CZ2-CD2 4.02Å; F455-F478 AromaticContact CE2-CE1 3.97Å; F455-F478 HydrophobicContact CE2-CE1 3.97Å; F455-F478 HydrophobicContact CE2-CE2 4.11Å; F455-F478 AromaticContact CE2-CZ 3.67Å; F455-F478 HydrophobicContact CE2-CZ 3.67Å; F455-F478 HydrophobicContact CZ-CE1 4.42Å; F455-F478 HydrophobicContact CZ-CE2 4.03Å; F455-F478 AromaticContact CZ-CZ 3.7Å; F455-F478 HydrophobicContact CZ-CZ 3.7Å; P471-F478 HydrophobicContact CB-CE1 4.32Å; L473-F478 HydrophobicContact CD2-CE2 4.42Å; L473-F478 HydrophobicContact CD2-CZ 4.09Å; L473-F478 HydrophobicContact CG-CZ 4.46Å; F478-L481 HydrophobicContact CB-CD1 4.42Å; F478-L481 HydrophobicContact CD1-CD1 3.91Å; F478-L481 HydrophobicContact CG-CD1 4.36Å
479	K	34.7	Very low	46.1	Very low	177 Å²	177	104.1 Å²	104.1	77%	0.77	57%	0.572	S	S	*	*			trans	-77.7	125.1	162.8	-77.4	-177.2	174.7	179.5	0	107.8	C477	C477-K479 PolarHBondContact O-N 3.11Å
480	N	38	Very low	48.2	Very low	136 Å²	136	102.5 Å²	102.5	73%	0.727	55%	0.552	S	S	*	*			trans	73.8	51.4	161.5	-50.9	-18.7	0	0	0	117.8	H482	N480-H482 PolarHBondContact O-N 3.25Å
481	L	40.8	Very low	50.5	Low	74 Å²	74	99.9 Å²	99.9	39%	0.387	54%	0.539	S	S	.	.			trans	-74.9	80.3	151.4	-90.5	146.7	0	0	0	108.1	F455 F478 F483	F455-L481 HydrophobicContact CD2-CD1 4.32Å; F478-L481 HydrophobicContact CB-CD1 4.42Å; F478-L481 HydrophobicContact CD1-CD1 3.91Å; F478-L481 HydrophobicContact CG-CD1 4.36Å; L481-F483 VanDerWaalsContact C-N 3.26Å; L481-F483 PolarHBondContact O-N 2.97Å
482	H	45.7	Very low	52.9	Low	164 Å²	164	96.4 Å²	96.4	76%	0.759	52%	0.516	S	S	*	.			trans	-61.5	101	152.7	-79.7	-86.9	0	0	0	105.2	N480 A484	N480-H482 PolarHBondContact O-N 3.25Å; H482-A484 PolarHBondContact O-N 3.39Å
483	F	47	Very low	55.3	Low	55 Å²	55	92 Å²	92	24%	0.241	49%	0.49	C	S	.	.			trans	-55.3	120.7	169.4	-82.5	-84.9	0	0	0	106.5	Q451 L454 L481 I487	Q451-F483 HydrophobicContact CB-CE2 4.5Å; Q451-F483 HydrophobicContact CG-CE2 4.25Å; L454-F483 HydrophobicContact CB-CE1 3.65Å; L454-F483 HydrophobicContact CB-CE2 4.21Å; L454-F483 HydrophobicContact CB-CZ 3.41Å; L454-F483 VanDerWaalsContact CB-CZ 3.41Å; L454-F483 HydrophobicContact CD1-CD1 4.32Å; L454-F483 HydrophobicContact CD1-CD2 4.29Å; L454-F483 HydrophobicContact CD1-CE1 4.1Å; L454-F483 HydrophobicContact CD1-CE2 4.06Å; L454-F483 HydrophobicContact CD1-CG 4.42Å; L454-F483 HydrophobicContact CD1-CZ 3.97Å; L454-F483 HydrophobicContact CG-CE1 4.42Å; L454-F483 HydrophobicContact CG-CZ 4.34Å; L481-F483 VanDerWaalsContact C-N 3.26Å; L481-F483 PolarHBondContact O-N 2.97Å; F483-I487 HydrophobicContact CD1-CD1 4.1Å
484	A	48.1	Very low	57.6	Low	26 Å²	26	87 Å²	87	22%	0.215	47%	0.467	C	S	.	.			trans	-49.6	150	175.9	0	0	0	0	0	109.9	A467 H482 E486	A467-A484 HydrophobicContact CB-CB 4.33Å; H482-A484 PolarHBondContact O-N 3.39Å; A484-E486 PolarHBondContact O-N 3.17Å
485	E	49	Very low	60	Low	208 Å²	208	83.8 Å²	83.8	97%	0.972	45%	0.445	S	S	*	.	S	Bend	trans	-57.4	-17	-177.4	-68.3	-176.3	154.5	0	0	113.1
486	E	59.4	Low	62.2	Low	144 Å²	144	75.3 Å²	75.3	67%	0.673	41%	0.406	S	S	*	.			trans	-125	113.9	179.2	-66.6	-175.9	166.6	0	0	112.8	A484	A484-E486 PolarHBondContact O-N 3.17Å
487	I	68.9	Low	64.2	Low	76 Å²	76	75 Å²	75	39%	0.39	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	167.9	-59.6	174.3	0	0	0	107.4	L454 I463 F483	L454-I487 HydrophobicContact CD1-CD1 4.39Å; L454-I487 HydrophobicContact CD2-CD1 4.13Å; I463-I487 HydrophobicContact CB-CG2 4.04Å; I463-I487 HydrophobicContact CD1-CG2 3.97Å; I463-I487 HydrophobicContact CG1-CG2 4.47Å; I463-I487 HydrophobicContact CG2-CG2 4.35Å; F483-I487 HydrophobicContact CD1-CD1 4.1Å
488	S	76.7	Confident	66.1	Low	58 Å²	58	74.3 Å²	74.3	41%	0.406	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.3	177.8	57.7	0	0	0	0	111.6	I463 S464	I463-S488 CarbonylContact C-O 3.24Å; I463-S488 WeakPolarHBondContact CA-O 3.48Å; S464-S488 PolarHBondContact N-O 3.02Å; S464-S488 PolarHBondContact O-N 2.94Å; S464-S488 PolarHBondContact OG-O 3.44Å; S464-S488 PolarHBondContact OG-OG 3.24Å
489	P	82.5	Confident	68	Low	84 Å²	84	71.8 Å²	71.8	55%	0.545	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.1	176	30.4	-33.8	0	0	0	110.4
490	T	87.5	Confident	69.9	Low	18 Å²	18	65.2 Å²	65.2	11%	0.11	35%	0.35	C	S	.	.			trans	-75.9	171	171.9	68.9	0	0	0	0	110.4	N461 F462 L492 G493 C494	N461-T490 WeakPolarHBondContact O-CB 3.46Å; N461-T490 WeakPolarHBondContact O-CG2 3.47Å; N461-T490 PolarHBondContact O-OG1 2.85Å; F462-T490 VanDerWaalsContact C-OG1 3.3Å; F462-T490 WeakPolarHBondContact CA-OG1 3.4Å; F462-T490 PolarHBondContact O-N 3.42Å; F462-T490 PolarHBondContact O-OG1 3.06Å; F462-T490 VanDerWaalsContact O-OG1 3.12Å; T490-L492 PolarHBondContact O-N 3.23Å; T490-L492 PolarHBondContact OG1-N 3.22Å; T490-G493 WeakPolarHBondContact O-CA 3.24Å; T490-G493 PolarHBondContact O-N 3.01Å; T490-G493 VanDerWaalsContact O-N 3.09Å; T490-G493 PolarHBondContact OG1-N 3.28Å; T490-G493 VanDerWaalsContact OG1-N 3.07Å; T490-C494 PolarHBondContact O-N 3.21Å; T490-C494 PolarHBondContact O-SG 3.3Å; T490-C494 VanDerWaalsContact O-SG 3.39Å
491	Q	88.5	Confident	71.7	Confident	114 Å²	114	58.9 Å²	58.9	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-35.7	174.3	-164.8	173.8	9.5	0	0	112.7	A495 R654 L655	Q491-A495 VanDerWaalsContact O-CB 3.28Å; Q491-A495 WeakPolarHBondContact O-CB 3.42Å; Q491-A495 PolarHBondContact O-N 2.85Å; Q491-R654 PolarHBondContact NE2-O 3.02Å; Q491-L655 HydrophobicContact CG-CD2 4.46Å; Q491-L655 PolarHBondContact NE2-O 3.06Å
492	L	89.9	Confident	73.4	Confident	21 Å²	21	55.9 Å²	55.9	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-67.3	-41.5	173.6	-177.7	68	0	0	0	111.2	F462 T490 A495 T496 F510 F651 L655	F462-L492 HydrophobicContact CD1-CD2 4.19Å; F462-L492 HydrophobicContact CD1-CG 4.02Å; F462-L492 HydrophobicContact CE1-CD2 4Å; F462-L492 HydrophobicContact CE1-CG 3.89Å; F462-L492 HydrophobicContact CZ-CD2 4.48Å; T490-L492 PolarHBondContact O-N 3.23Å; T490-L492 PolarHBondContact OG1-N 3.22Å; L492-A495 PolarHBondContact O-N 2.89Å; L492-T496 WeakPolarHBondContact O-CB 3.46Å; L492-T496 PolarHBondContact O-N 3.23Å; L492-T496 PolarHBondContact O-OG1 2.82Å; L492-F510 HydrophobicContact CD1-CB 4.25Å; L492-F510 HydrophobicContact CD1-CD2 3.75Å; L492-F510 HydrophobicContact CD1-CE2 4.33Å; L492-F510 HydrophobicContact CD1-CG 4.08Å; L492-F651 HydrophobicContact CD1-CE2 4.08Å; L492-F651 HydrophobicContact CD1-CZ 3.61Å; L492-L655 HydrophobicContact CD1-CD2 4.45Å
493	G	87	Confident	74.8	Confident	8 Å²	8	50.5 Å²	50.5	8%	0.082	28%	0.283	C	S	.	.	H	α-helix	trans	-56.2	-54.7	172.2	0	0	0	0	0	112.3	F462 T490 A495 T496 V497	F462-G493 WeakPolarHBondContact O-CA 3.35Å; T490-G493 WeakPolarHBondContact O-CA 3.24Å; T490-G493 PolarHBondContact O-N 3.01Å; T490-G493 VanDerWaalsContact O-N 3.09Å; T490-G493 PolarHBondContact OG1-N 3.28Å; T490-G493 VanDerWaalsContact OG1-N 3.07Å; G493-A495 PolarHBondContact O-N 3.34Å; G493-T496 PolarHBondContact O-N 3.43Å; G493-V497 WeakPolarHBondContact O-CG2 3.47Å; G493-V497 PolarHBondContact O-N 2.89Å; G493-V497 VanDerWaalsContact O-N 3.1Å
494	C	83.5	Confident	76.2	Confident	42 Å²	42	50.8 Å²	50.8	28%	0.284	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-49	176	-68.8	0	0	0	0	111.5	T490 T496 V497 S498	T490-C494 PolarHBondContact O-N 3.21Å; T490-C494 PolarHBondContact O-SG 3.3Å; T490-C494 VanDerWaalsContact O-SG 3.39Å; C494-T496 VanDerWaalsContact C-N 3.33Å; C494-T496 PolarHBondContact O-N 3.49Å; C494-V497 PolarHBondContact O-N 2.93Å; C494-S498 WeakPolarHBondContact O-CB 3.41Å; C494-S498 PolarHBondContact O-N 2.97Å; C494-S498 PolarHBondContact O-OG 3.01Å; C494-S498 VanDerWaalsContact O-OG 3.05Å
495	A	86.2	Confident	77.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-41.3	179.5	0	0	0	0	0	112.6	Q491 L492 G493 S499 F651 R654 L655	Q491-A495 VanDerWaalsContact O-CB 3.28Å; Q491-A495 WeakPolarHBondContact O-CB 3.42Å; Q491-A495 PolarHBondContact O-N 2.85Å; L492-A495 PolarHBondContact O-N 2.89Å; G493-A495 PolarHBondContact O-N 3.34Å; A495-S499 VanDerWaalsContact O-CB 3.25Å; A495-S499 WeakPolarHBondContact O-CB 3.37Å; A495-S499 PolarHBondContact O-N 3.39Å; A495-S499 PolarHBondContact O-OG 3Å; A495-F651 HydrophobicContact CB-CD2 3.58Å; A495-F651 HydrophobicContact CB-CE2 3.67Å; A495-F651 HydrophobicContact CB-CG 4.37Å; A495-R654 HydrophobicContact CB-CB 3.84Å; A495-R654 HydrophobicContact CB-CG 4.27Å; A495-L655 HydrophobicContact CB-CD2 3.97Å; A495-L655 HydrophobicContact CB-CG 3.99Å
496	T	84.9	Confident	79.3	Confident	8 Å²	8	40.4 Å²	40.4	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-42.9	179.1	-58.2	0	0	0	0	111.7	F462 L492 G493 C494 S499 S500 M501 A506	F462-T496 HydrophobicContact CE1-CG2 4.17Å; F462-T496 VanDerWaalsContact CE1-OG1 3.29Å; F462-T496 WeakPolarHBondContact CE1-OG1 3.43Å; L492-T496 WeakPolarHBondContact O-CB 3.46Å; L492-T496 PolarHBondContact O-N 3.23Å; L492-T496 PolarHBondContact O-OG1 2.82Å; G493-T496 PolarHBondContact O-N 3.43Å; C494-T496 VanDerWaalsContact C-N 3.33Å; C494-T496 PolarHBondContact O-N 3.49Å; T496-S499 PolarHBondContact O-OG 3.41Å; T496-S500 PolarHBondContact O-N 3.42Å; T496-M501 HydrophobicContact CG2-CB 4.44Å; T496-M501 PolarHBondContact O-N 2.98Å; T496-A506 HydrophobicContact CG2-CB 3.65Å; T496-A506 WeakPolarHBondContact OG1-CB 3.45Å
497	V	77.2	Confident	80.5	Confident	72 Å²	72	35.3 Å²	35.3	44%	0.436	21%	0.212	S	C	.	.	H	α-helix	trans	-70.8	-49.6	178.4	176.6	0	0	0	0	110.9	N139 G493 C494 S499 S500	N139-V497 PolarHBondContact ND2-O 3.45Å; G493-V497 WeakPolarHBondContact O-CG2 3.47Å; G493-V497 PolarHBondContact O-N 2.89Å; G493-V497 VanDerWaalsContact O-N 3.1Å; C494-V497 PolarHBondContact O-N 2.93Å; V497-S499 VanDerWaalsContact C-N 3.27Å; V497-S499 PolarHBondContact O-N 3.32Å; V497-S500 PolarHBondContact O-N 3.36Å
498	S	74.5	Confident	81.2	Confident	18 Å²	18	32.6 Å²	32.6	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-32.6	-179	-55.8	0	0	0	0	112.5	E143 C494 S500	E143-S498 PolarHBondContact OE1-OG 3.1Å; C494-S498 WeakPolarHBondContact O-CB 3.41Å; C494-S498 PolarHBondContact O-N 2.97Å; C494-S498 PolarHBondContact O-OG 3.01Å; C494-S498 VanDerWaalsContact O-OG 3.05Å; S498-S500 VanDerWaalsContact C-N 3.31Å
499	S	79.2	Confident	81.7	Confident	4 Å²	4	30 Å²	30	3%	0.028	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.2	174.9	61	0	0	0	0	114.4	A495 T496 V497 M501 M647	A495-S499 VanDerWaalsContact O-CB 3.25Å; A495-S499 WeakPolarHBondContact O-CB 3.37Å; A495-S499 PolarHBondContact O-N 3.39Å; A495-S499 PolarHBondContact O-OG 3Å; T496-S499 PolarHBondContact O-OG 3.41Å; V497-S499 VanDerWaalsContact C-N 3.27Å; V497-S499 PolarHBondContact O-N 3.32Å; S499-M501 PolarHBondContact O-N 2.93Å; S499-M501 VanDerWaalsContact OG-CG 3.28Å; S499-M501 WeakPolarHBondContact OG-CG 3.29Å; S499-M647 WeakPolarHBondContact CB-O 3.48Å
500	S	73.8	Confident	82.1	Confident	39 Å²	39	28.4 Å²	28.4	27%	0.273	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	25.8	-176	-56.8	0	0	0	0	114.4	T496 V497 S498	T496-S500 PolarHBondContact O-N 3.42Å; V497-S500 PolarHBondContact O-N 3.36Å; S498-S500 VanDerWaalsContact C-N 3.31Å
501	M	76.5	Confident	82.1	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.02	19%	0.186	C	C	.	.			trans	-83.9	158.1	-179.5	-66.8	-176.2	84.8	0	0	112.3	K168 T496 S499 E505 A506 V509 Y644 M647 F651	K168-M501 PolarHBondContact NZ-O 3.35Å; T496-M501 HydrophobicContact CG2-CB 4.44Å; T496-M501 PolarHBondContact O-N 2.98Å; S499-M501 PolarHBondContact O-N 2.93Å; S499-M501 VanDerWaalsContact OG-CG 3.28Å; S499-M501 WeakPolarHBondContact OG-CG 3.29Å; M501-E505 HydrophobicContact CE-CB 3.99Å; M501-A506 HydrophobicContact CB-CB 4.42Å; M501-V509 HydrophobicContact CE-CB 4.07Å; M501-V509 HydrophobicContact CE-CG1 4.48Å; M501-V509 HydrophobicContact CE-CG2 3.51Å; M501-Y644 HydrophobicContact CE-CE2 3.97Å; M501-M647 HydrophobicContact CB-CE 4.46Å; M501-M647 HydrophobicContact CG-CB 4.48Å; M501-M647 HydrophobicContact CG-CE 3.53Å; M501-F651 HydrophobicContact SD-CB 4.27Å; M501-F651 HydrophobicContact SD-CD2 4.22Å; M501-F651 HydrophobicContact SD-CG 4.26Å
502	G	74.5	Confident	82	Confident	10 Å²	10	29.4 Å²	29.4	10%	0.103	17%	0.172	C	C	.	.			trans	-74	154.1	163.7	0	0	0	0	0	112	D504 E505 A506	G502-D504 VanDerWaalsContact C-N 3.32Å; G502-D504 PolarHBondContact O-N 2.84Å; G502-E505 PolarHBondContact N-OE2 3.27Å; G502-E505 PolarHBondContact O-N 3.07Å; G502-A506 WeakPolarHBondContact O-CB 3.35Å; G502-A506 PolarHBondContact O-N 3.49Å
503	P	76.2	Confident	82	Confident	52 Å²	52	28.4 Å²	28.4	34%	0.338	17%	0.167	S	C	.	.	H	α-helix	trans	-55.4	-44.4	174.6	-25.9	34.5	0	0	0	113	F462 E505 A506 V507	F462-P503 HydrophobicContact CE1-CB 4.47Å; F462-P503 HydrophobicContact CE2-CB 3.71Å; F462-P503 HydrophobicContact CZ-CB 3.67Å; F462-P503 WeakPolarHBondContact CZ-O 3.32Å; P503-E505 PolarHBondContact O-N 2.89Å; P503-A506 PolarHBondContact O-N 3.36Å; P503-V507 WeakPolarHBondContact O-CG2 3.42Å; P503-V507 PolarHBondContact O-N 3.01Å
504	D	76	Confident	82.1	Confident	60 Å²	60	33.2 Å²	33.2	32%	0.321	19%	0.187	S	C	.	.	H	α-helix	trans	-64.1	-40.8	178.3	-61.4	-44.4	0	0	0	112	R460 G502 V507 A508 C537	R460-D504 IonicContact CZ-OD1 3.88Å; R460-D504 IonicContact NH1-OD1 2.9Å; R460-D504 PolarHBondContact NH1-OD1 3.13Å; R460-D504 IonicContact NH2-OD1 3.98Å; G502-D504 VanDerWaalsContact C-N 3.32Å; G502-D504 PolarHBondContact O-N 2.84Å; D504-V507 PolarHBondContact O-N 3.03Å; D504-A508 PolarHBondContact O-N 3.15Å; D504-A508 VanDerWaalsContact O-N 3.09Å; D504-C537 HydrophobicContact CB-CB 4.49Å
505	E	77.7	Confident	82.2	Confident	16 Å²	16	35.9 Å²	35.9	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-42.6	177.2	-64.2	169.6	175.2	0	0	111.3	H165 M501 G502 P503 A508 V509 T542	H165-E505 IonicContact CE1-OE1 3.57Å; H165-E505 PolarHBondContact CE1-OE1 3.02Å; H165-E505 VanDerWaalsContact CE1-OE1 3.3Å; H165-E505 IonicContact ND1-OE1 2.76Å; M501-E505 HydrophobicContact CE-CB 3.99Å; G502-E505 PolarHBondContact N-OE2 3.27Å; G502-E505 PolarHBondContact O-N 3.07Å; P503-E505 PolarHBondContact O-N 2.89Å; E505-A508 PolarHBondContact O-N 3Å; E505-V509 WeakPolarHBondContact O-CB 3.17Å; E505-V509 WeakPolarHBondContact O-CG2 3.37Å; E505-V509 PolarHBondContact O-N 3.47Å; E505-T542 HydrophobicContact CG-CG2 4.45Å; E505-T542 WeakPolarHBondContact OE1-CG2 3.45Å
506	A	84.2	Confident	82.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-40.4	178.9	0	0	0	0	0	112.2	F462 T496 M501 G502 P503 F510 F651	F462-A506 HydrophobicContact CE1-CB 4.29Å; T496-A506 HydrophobicContact CG2-CB 3.65Å; T496-A506 WeakPolarHBondContact OG1-CB 3.45Å; M501-A506 HydrophobicContact CB-CB 4.42Å; G502-A506 WeakPolarHBondContact O-CB 3.35Å; G502-A506 PolarHBondContact O-N 3.49Å; P503-A506 PolarHBondContact O-N 3.36Å; A506-F510 WeakPolarHBondContact O-CB 3.4Å; A506-F510 PolarHBondContact O-N 2.98Å; A506-F651 HydrophobicContact CB-CE2 3.88Å; A506-F651 HydrophobicContact CB-CZ 4.16Å
507	V	85.7	Confident	82.2	Confident	37 Å²	37	42.7 Å²	42.7	22%	0.224	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-45.7	174.4	173	0	0	0	0	110.8	F462 P503 D504 F510 Q511	F462-V507 HydrophobicContact CE2-CG2 4.13Å; F462-V507 HydrophobicContact CZ-CG2 3.74Å; P503-V507 WeakPolarHBondContact O-CG2 3.42Å; P503-V507 PolarHBondContact O-N 3.01Å; D504-V507 PolarHBondContact O-N 3.03Å; V507-F510 PolarHBondContact O-N 3.24Å; V507-Q511 HydrophobicContact CG1-CG 4.48Å; V507-Q511 WeakPolarHBondContact O-CG 3.44Å; V507-Q511 PolarHBondContact O-N 3.07Å
508	A	82.9	Confident	82.5	Confident	19 Å²	19	44.1 Å²	44.1	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-47.1	179.1	0	0	0	0	0	111.6	D504 E505 Q511 D512	D504-A508 PolarHBondContact O-N 3.15Å; D504-A508 VanDerWaalsContact O-N 3.09Å; E505-A508 PolarHBondContact O-N 3Å; A508-Q511 PolarHBondContact O-N 3.45Å; A508-D512 PolarHBondContact O-N 2.7Å
509	V	87.7	Confident	82.9	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.024	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-41.6	177.1	168.4	0	0	0	0	111.6	M501 E505 Q511 D512 L513 Y644 V648 F651	M501-V509 HydrophobicContact CE-CB 4.07Å; M501-V509 HydrophobicContact CE-CG1 4.48Å; M501-V509 HydrophobicContact CE-CG2 3.51Å; E505-V509 WeakPolarHBondContact O-CB 3.17Å; E505-V509 WeakPolarHBondContact O-CG2 3.37Å; E505-V509 PolarHBondContact O-N 3.47Å; V509-Q511 VanDerWaalsContact C-N 3.34Å; V509-Q511 PolarHBondContact O-N 2.93Å; V509-D512 PolarHBondContact O-N 2.93Å; V509-L513 HydrophobicContact CG1-CD1 3.47Å; V509-L513 VanDerWaalsContact CG1-CD1 3.47Å; V509-L513 HydrophobicContact CG1-CG 4.07Å; V509-L513 WeakPolarHBondContact O-CB 3.5Å; V509-L513 WeakPolarHBondContact O-CD1 3.38Å; V509-L513 WeakPolarHBondContact O-CG 3.3Å; V509-L513 PolarHBondContact O-N 3.42Å; V509-Y644 WeakPolarHBondContact CG2-OH 3.3Å; V509-V648 HydrophobicContact CG1-CG1 4.32Å; V509-V648 HydrophobicContact CG1-CG2 4.23Å; V509-F651 HydrophobicContact CG1-CD1 3.91Å; V509-F651 HydrophobicContact CG1-CE1 4.03Å
510	F	90.2	Very high	83.3	Confident	51 Å²	51	47.5 Å²	47.5	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-45.4	176.8	-175	-94	0	0	0	111.7	L492 A506 V507 Q514 F651 L655 W657	L492-F510 HydrophobicContact CD1-CB 4.25Å; L492-F510 HydrophobicContact CD1-CD2 3.75Å; L492-F510 HydrophobicContact CD1-CE2 4.33Å; L492-F510 HydrophobicContact CD1-CG 4.08Å; A506-F510 WeakPolarHBondContact O-CB 3.4Å; A506-F510 PolarHBondContact O-N 2.98Å; V507-F510 PolarHBondContact O-N 3.24Å; F510-Q514 WeakPolarHBondContact O-CB 3.46Å; F510-Q514 PolarHBondContact O-N 2.84Å; F510-F651 HydrophobicContact CB-CE1 4.18Å; F510-F651 HydrophobicContact CB-CZ 4.18Å; F510-F651 HydrophobicContact CD2-CE1 4.36Å; F510-F651 HydrophobicContact CD2-CZ 4.38Å; F510-L655 HydrophobicContact CD2-CD1 3.78Å; F510-L655 HydrophobicContact CD2-CD2 4.41Å; F510-L655 HydrophobicContact CE2-CD1 4.04Å; F510-L655 HydrophobicContact CE2-CD2 4.21Å; F510-W657 AromaticContact CD2-CH2 3.72Å; F510-W657 HydrophobicContact CD2-CH2 3.72Å; F510-W657 HydrophobicContact CD2-CZ2 4.19Å; F510-W657 AromaticContact CE2-CH2 3.47Å; F510-W657 HydrophobicContact CE2-CH2 3.47Å; F510-W657 VanDerWaalsContact CE2-CH2 3.47Å; F510-W657 AromaticContact CE2-CZ2 3.49Å; F510-W657 HydrophobicContact CE2-CZ2 3.49Å; F510-W657 VanDerWaalsContact CE2-CZ2 3.49Å; F510-W657 HydrophobicContact CZ-CH2 4.1Å; F510-W657 HydrophobicContact CZ-CZ2 4.04Å
511	Q	87.3	Confident	84.1	Confident	107 Å²	107	46.4 Å²	46.4	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-43.8	177.3	-72.2	175.8	0.5	0	0	112.4	V507 A508 V509 Q514 T515	V507-Q511 HydrophobicContact CG1-CG 4.48Å; V507-Q511 WeakPolarHBondContact O-CG 3.44Å; V507-Q511 PolarHBondContact O-N 3.07Å; A508-Q511 PolarHBondContact O-N 3.45Å; V509-Q511 VanDerWaalsContact C-N 3.34Å; V509-Q511 PolarHBondContact O-N 2.93Å; Q511-Q514 PolarHBondContact O-N 3.09Å; Q511-T515 WeakPolarHBondContact O-CB 3.38Å; Q511-T515 PolarHBondContact O-N 3.31Å; Q511-T515 PolarHBondContact O-OG1 3.39Å
512	D	86.7	Confident	84.7	Confident	45 Å²	45	50.7 Å²	50.7	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-48.3	177.8	-75.9	-15.2	0	0	0	111.3	A508 V509 Q514 T515 A516 S535 R604	A508-D512 PolarHBondContact O-N 2.7Å; V509-D512 PolarHBondContact O-N 2.93Å; D512-Q514 PolarHBondContact O-N 3.41Å; D512-T515 PolarHBondContact O-N 2.91Å; D512-A516 WeakPolarHBondContact O-CB 3.4Å; D512-A516 PolarHBondContact O-N 3.33Å; D512-S535 PolarHBondContact OD2-OG 3.48Å; D512-R604 IonicContact OD1-NH1 3.73Å; D512-R604 IonicContact OD2-CZ 3.03Å; D512-R604 IonicContact OD2-NH1 3.85Å; D512-R604 PolarHBondContact OD2-NH1 3.25Å; D512-R604 IonicContact OD2-NH2 3.24Å; D512-R604 PolarHBondContact OD2-NH2 3.1Å
513	L	89.9	Confident	85.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-34	-179.9	-64.5	169	0	0	0	112.2	V509 A516 K517 L531 V648 F651 V652 W657 L660 L664	V509-L513 HydrophobicContact CG1-CD1 3.47Å; V509-L513 VanDerWaalsContact CG1-CD1 3.47Å; V509-L513 HydrophobicContact CG1-CG 4.07Å; V509-L513 WeakPolarHBondContact O-CB 3.5Å; V509-L513 WeakPolarHBondContact O-CD1 3.38Å; V509-L513 WeakPolarHBondContact O-CG 3.3Å; V509-L513 PolarHBondContact O-N 3.42Å; L513-A516 PolarHBondContact O-N 2.67Å; L513-K517 WeakPolarHBondContact O-CB 3.42Å; L513-K517 PolarHBondContact O-N 2.86Å; L513-L531 HydrophobicContact CD2-CB 4.43Å; L513-V648 HydrophobicContact CD1-CG1 4.22Å; L513-V648 HydrophobicContact CD2-CG1 4.28Å; L513-F651 HydrophobicContact CD1-CD1 4.22Å; L513-F651 HydrophobicContact CD1-CE1 4.46Å; L513-V652 HydrophobicContact CD1-CG2 3.48Å; L513-V652 VanDerWaalsContact CD1-CG2 3.48Å; L513-V652 HydrophobicContact CD2-CG2 4.4Å; L513-W657 HydrophobicContact CB-CZ3 3.72Å; L513-W657 HydrophobicContact CD1-CZ3 4.29Å; L513-L660 HydrophobicContact CB-CD2 4.05Å; L513-L660 HydrophobicContact CD2-CD2 3.79Å; L513-L660 HydrophobicContact CG-CD2 4.36Å; L513-L664 HydrophobicContact CD2-CD1 4.33Å
514	Q	89.4	Confident	86.2	Confident	109 Å²	109	54.7 Å²	54.7	51%	0.509	30%	0.297	S	S	.	.	H	α-helix	trans	-67.3	-39.6	174.7	-172.9	166.2	19.4	0	0	111.5	F510 Q511 D512 K517	F510-Q514 WeakPolarHBondContact O-CB 3.46Å; F510-Q514 PolarHBondContact O-N 2.84Å; Q511-Q514 PolarHBondContact O-N 3.09Å; D512-Q514 PolarHBondContact O-N 3.41Å; Q514-K517 WeakPolarHBondContact O-CB 3.49Å; Q514-K517 PolarHBondContact O-N 2.98Å
515	T	86.4	Confident	87.1	Confident	98 Å²	98	53.6 Å²	53.6	60%	0.601	29%	0.291	S	S	*	.	H	α-helix	trans	-63.2	-47.7	172.7	-54.7	0	0	0	0	110.2	Q511 D512 K517 S518	Q511-T515 WeakPolarHBondContact O-CB 3.38Å; Q511-T515 PolarHBondContact O-N 3.31Å; Q511-T515 PolarHBondContact O-OG1 3.39Å; D512-T515 PolarHBondContact O-N 2.91Å; T515-K517 VanDerWaalsContact C-N 3.29Å; T515-K517 PolarHBondContact O-N 3.12Å; T515-S518 PolarHBondContact O-N 2.58Å; T515-S518 PolarHBondContact O-OG 3.16Å
516	A	85.7	Confident	87.9	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-42.8	177.1	0	0	0	0	0	111.7	D512 L513 S518 A519 V520 L531	D512-A516 WeakPolarHBondContact O-CB 3.4Å; D512-A516 PolarHBondContact O-N 3.33Å; L513-A516 PolarHBondContact O-N 2.67Å; A516-S518 PolarHBondContact O-N 2.95Å; A516-A519 CarbonylContact O-C 3.53Å; A516-A519 PolarHBondContact O-N 3.26Å; A516-V520 HydrophobicContact CB-CG2 4.15Å; A516-V520 WeakPolarHBondContact O-CG2 3.18Å; A516-V520 PolarHBondContact O-N 3.43Å; A516-L531 HydrophobicContact CB-CD1 3.69Å; A516-L531 HydrophobicContact CB-CD2 3.77Å; A516-L531 HydrophobicContact CB-CG 4.38Å
517	K	83.9	Confident	88.4	Confident	146 Å²	146	53.2 Å²	53.2	64%	0.635	29%	0.289	S	S	*	.	H	α-helix	trans	-54.6	-27.4	178.3	-168.5	176.9	176.6	-179.8	0	113.6	L513 Q514 T515	L513-K517 WeakPolarHBondContact O-CB 3.42Å; L513-K517 PolarHBondContact O-N 2.86Å; Q514-K517 WeakPolarHBondContact O-CB 3.49Å; Q514-K517 PolarHBondContact O-N 2.98Å; T515-K517 VanDerWaalsContact C-N 3.29Å; T515-K517 PolarHBondContact O-N 3.12Å
518	S	83.6	Confident	88.7	Confident	102 Å²	102	51.6 Å²	51.6	71%	0.713	28%	0.279	S	S	*	.	H	α-helix	trans	-81.2	-27.7	175	72.6	0	0	0	0	114	T515 A516	T515-S518 PolarHBondContact O-N 2.58Å; T515-S518 PolarHBondContact O-OG 3.16Å; A516-S518 PolarHBondContact O-N 2.95Å
519	A	84.1	Confident	89.2	Confident	52 Å²	52	50.7 Å²	50.7	43%	0.43	27%	0.272	S	S	.	.			trans	-155.8	70.3	-174	0	0	0	0	0	112.7	A516 V521 H527	A516-A519 CarbonylContact O-C 3.53Å; A516-A519 PolarHBondContact O-N 3.26Å; A519-V521 PolarHBondContact O-N 3.02Å; A519-H527 PolarHBondContact O-CE1 3.32Å
520	V	88	Confident	89.4	Confident	42 Å²	42	51.3 Å²	51.3	26%	0.255	27%	0.274	S	S	.	.			trans	-83.7	114.6	172.1	-168.8	0	0	0	0	110.2	A516 L522 L528	A516-V520 HydrophobicContact CB-CG2 4.15Å; A516-V520 WeakPolarHBondContact O-CG2 3.18Å; A516-V520 PolarHBondContact O-N 3.43Å; V520-L522 HydrophobicContact CB-CD2 4.49Å; V520-L522 HydrophobicContact CB-CG 4.36Å; V520-L522 HydrophobicContact CG1-CD2 3.52Å; V520-L522 HydrophobicContact CG1-CG 3.83Å; V520-L522 PolarHBondContact O-N 3.44Å; V520-L528 HydrophobicContact CG1-CD2 4.15Å
521	V	88.9	Confident	89.4	Confident	15 Å²	15	49.1 Å²	49.1	9%	0.091	27%	0.265	C	S	.	.			trans	-72	117.2	163.7	-174.4	0	0	0	0	110.1	A519 E523 H527 V573 T576	A519-V521 PolarHBondContact O-N 3.02Å; V521-E523 HydrophobicContact CG1-CB 4.43Å; V521-H527 HydrophobicContact CB-CB 4.39Å; V521-H527 PolarHBondContact N-ND1 3.01Å; V521-H527 VanDerWaalsContact N-ND1 3.13Å; V521-H527 WeakPolarHBondContact O-CB 3.48Å; V521-V573 HydrophobicContact CB-CG2 4.01Å; V521-V573 HydrophobicContact CG1-CG2 3.77Å; V521-T576 HydrophobicContact CG2-CG2 4.43Å
522	L	89.4	Confident	89.4	Confident	95 Å²	95	44 Å²	44	50%	0.497	24%	0.241	S	C	.	.			trans	-116.6	15.6	-178.3	-65.6	176.3	0	0	0	113.3	V520 N524 L528 L663	V520-L522 HydrophobicContact CB-CD2 4.49Å; V520-L522 HydrophobicContact CB-CG 4.36Å; V520-L522 HydrophobicContact CG1-CD2 3.52Å; V520-L522 HydrophobicContact CG1-CG 3.83Å; V520-L522 PolarHBondContact O-N 3.44Å; L522-N524 PolarHBondContact O-N 2.92Å; L522-L528 HydrophobicContact CD2-CD1 4.13Å; L522-L528 HydrophobicContact CD2-CD2 4.1Å; L522-L528 HydrophobicContact CD2-CG 4.25Å; L522-L663 HydrophobicContact CD1-CD1 4.42Å; L522-L663 HydrophobicContact CD1-CD2 4.3Å; L522-L663 HydrophobicContact CD2-CD1 4.35Å; L522-L663 HydrophobicContact CD2-CD2 4.22Å
523	E	91	Very high	89.3	Confident	116 Å²	116	42 Å²	42	54%	0.542	23%	0.23	S	C	.	.	S	Bend	trans	-63.7	-31.5	177.1	-71.8	171.7	-154.3	0	0	111.8	V521 A569 K572	V521-E523 HydrophobicContact CG1-CB 4.43Å; E523-A569 HydrophobicContact CB-CB 3.95Å; E523-A569 WeakPolarHBondContact OE2-CA 3.46Å; E523-A569 WeakPolarHBondContact OE2-CB 3.4Å; E523-K572 IonicContact OE1-NZ 3.66Å; E523-K572 PolarHBondContact OE1-NZ 3.47Å
524	N	92.3	Very high	88.4	Confident	30 Å²	30	44.2 Å²	44.2	16%	0.16	24%	0.242	C	C	.	.	S	Bend	trans	-147.9	176.9	169.8	64.5	34	0	0	0	109.6	L522 L526 S570 F612	L522-N524 PolarHBondContact O-N 2.92Å; N524-L526 VanDerWaalsContact C-N 3.28Å; N524-L526 PolarHBondContact O-N 3.43Å; N524-L526 WeakPolarHBondContact OD1-CB 3.48Å; N524-L526 PolarHBondContact OD1-N 3.48Å; N524-S570 PolarHBondContact ND2-OG 2.9Å; N524-F612 HydrophobicContact CB-CZ 4.17Å
525	D	93.5	Very high	87.1	Confident	36 Å²	36	39.8 Å²	39.8	19%	0.193	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.2	-175.7	-74.1	-33.4	0	0	0	114.5	H527 L528 V529 F612 F667 R670	D525-H527 VanDerWaalsContact C-N 3.3Å; D525-H527 PolarHBondContact O-N 3.48Å; D525-L528 PolarHBondContact O-N 2.69Å; D525-L528 VanDerWaalsContact O-N 3.09Å; D525-V529 WeakPolarHBondContact O-CG2 3.36Å; D525-V529 PolarHBondContact O-N 2.96Å; D525-F612 HydrophobicContact CB-CD2 4.45Å; D525-F612 HydrophobicContact CB-CE2 4.09Å; D525-F667 HydrophobicContact CB-CE1 4.22Å; D525-F667 HydrophobicContact CB-CZ 3.9Å; D525-R670 IonicContact OD1-NH1 2.91Å; D525-R670 IonicContact OD2-CZ 3.81Å; D525-R670 IonicContact OD2-NH1 3.37Å; D525-R670 PolarHBondContact OD2-NH1 3.13Å; D525-R670 IonicContact OD2-NH2 3.94Å; D525-R670 PolarHBondContact OD2-NH2 3.19Å
526	L	95.3	Very high	85.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-39.4	-173.5	178.4	60.8	0	0	0	112.5	N524 V529 Y530 V573 F605 A608 L609 F612	N524-L526 VanDerWaalsContact C-N 3.28Å; N524-L526 PolarHBondContact O-N 3.43Å; N524-L526 WeakPolarHBondContact OD1-CB 3.48Å; N524-L526 PolarHBondContact OD1-N 3.48Å; L526-V529 PolarHBondContact O-N 3.09Å; L526-Y530 WeakPolarHBondContact O-CB 3.42Å; L526-Y530 PolarHBondContact O-N 3.09Å; L526-V573 HydrophobicContact CB-CG2 4.47Å; L526-V573 HydrophobicContact CD2-CB 4.17Å; L526-V573 HydrophobicContact CD2-CG1 4.35Å; L526-V573 HydrophobicContact CG-CB 4.45Å; L526-V573 HydrophobicContact CG-CG1 4.17Å; L526-F605 HydrophobicContact CD2-CE2 3.97Å; L526-F605 HydrophobicContact CD2-CZ 3.94Å; L526-F605 HydrophobicContact CG-CE2 4.37Å; L526-A608 HydrophobicContact CD1-CB 4.45Å; L526-L609 HydrophobicContact CD1-CD2 3.93Å; L526-L609 HydrophobicContact CD2-CD2 3.75Å; L526-F612 HydrophobicContact CB-CD1 4.18Å; L526-F612 HydrophobicContact CB-CD2 4.02Å; L526-F612 HydrophobicContact CB-CE1 4.31Å; L526-F612 HydrophobicContact CB-CE2 4.16Å; L526-F612 HydrophobicContact CB-CG 4.04Å; L526-F612 HydrophobicContact CB-CZ 4.3Å; L526-F612 HydrophobicContact CD1-CB 3.56Å; L526-F612 HydrophobicContact CD1-CD1 3.97Å; L526-F612 HydrophobicContact CD1-CD2 4.44Å; L526-F612 HydrophobicContact CD1-CG 3.74Å; L526-F612 HydrophobicContact CG-CD1 4.5Å; L526-F612 HydrophobicContact CG-CG 4.45Å
527	H	94	Very high	83.4	Confident	8 Å²	8	38.5 Å²	38.5	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-68.3	-39.1	178.5	-165.5	-167.9	0	0	0	111.6	A519 V521 D525 Y530 L531 V573	A519-H527 PolarHBondContact O-CE1 3.32Å; V521-H527 HydrophobicContact CB-CB 4.39Å; V521-H527 PolarHBondContact N-ND1 3.01Å; V521-H527 VanDerWaalsContact N-ND1 3.13Å; V521-H527 WeakPolarHBondContact O-CB 3.48Å; D525-H527 VanDerWaalsContact C-N 3.3Å; D525-H527 PolarHBondContact O-N 3.48Å; H527-Y530 WeakPolarHBondContact O-CB 3.27Å; H527-Y530 PolarHBondContact O-N 3.12Å; H527-L531 WeakPolarHBondContact O-CG 3.33Å; H527-L531 PolarHBondContact O-N 2.88Å; H527-V573 HydrophobicContact CB-CG1 3.71Å; H527-V573 HydrophobicContact CB-CG2 4.08Å
528	L	93.3	Very high	81.3	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-43.2	175.5	-60.3	-179.5	0	0	0	110.8	V520 L522 D525 Y530 L531 V532 L663 L664 F667	V520-L528 HydrophobicContact CG1-CD2 4.15Å; L522-L528 HydrophobicContact CD2-CD1 4.13Å; L522-L528 HydrophobicContact CD2-CD2 4.1Å; L522-L528 HydrophobicContact CD2-CG 4.25Å; D525-L528 PolarHBondContact O-N 2.69Å; D525-L528 VanDerWaalsContact O-N 3.09Å; L528-Y530 VanDerWaalsContact C-N 3.29Å; L528-Y530 PolarHBondContact O-N 3.02Å; L528-L531 HydrophobicContact CD2-CD1 4.45Å; L528-L531 PolarHBondContact O-N 3.23Å; L528-V532 WeakPolarHBondContact O-CG2 3.48Å; L528-V532 PolarHBondContact O-N 3.28Å; L528-L663 HydrophobicContact CD1-CB 4.46Å; L528-L663 HydrophobicContact CD2-CB 4.36Å; L528-L664 HydrophobicContact CB-CD2 4.31Å; L528-L664 HydrophobicContact CD2-CD2 4.12Å; L528-F667 HydrophobicContact CB-CE1 4.18Å; L528-F667 HydrophobicContact CB-CE2 3.88Å; L528-F667 HydrophobicContact CB-CZ 3.54Å; L528-F667 HydrophobicContact CD1-CE2 3.74Å; L528-F667 HydrophobicContact CD1-CZ 3.86Å; L528-F667 HydrophobicContact CG-CE2 4.46Å; L528-F667 HydrophobicContact CG-CZ 4.35Å
529	V	92.5	Very high	79.3	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-42.6	171.9	174.7	0	0	0	0	110.8	D525 L526 L531 V532 T533 A608 L611 F612 V615 F667	D525-V529 WeakPolarHBondContact O-CG2 3.36Å; D525-V529 PolarHBondContact O-N 2.96Å; L526-V529 PolarHBondContact O-N 3.09Å; V529-L531 PolarHBondContact O-N 2.93Å; V529-V532 CarbonylContact O-C 3.45Å; V529-V532 WeakPolarHBondContact O-CG2 3.45Å; V529-V532 PolarHBondContact O-N 3.04Å; V529-T533 WeakPolarHBondContact O-CB 3Å; V529-T533 PolarHBondContact O-N 2.77Å; V529-T533 PolarHBondContact O-OG1 3.39Å; V529-A608 HydrophobicContact CG1-CB 4.44Å; V529-L611 HydrophobicContact CG1-CB 3.77Å; V529-F612 HydrophobicContact CG1-CB 4.38Å; V529-F612 HydrophobicContact CG2-CB 4.48Å; V529-F612 HydrophobicContact CG2-CD2 4.27Å; V529-V615 HydrophobicContact CG2-CG2 4.43Å; V529-F667 HydrophobicContact CG2-CD1 4.25Å; V529-F667 HydrophobicContact CG2-CE1 3.68Å
530	Y	92.1	Very high	77.1	Confident	16 Å²	16	39.5 Å²	39.5	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-42.9	177.1	176.1	-92.3	0	0	0	112.5	L526 H527 L528 V532 T533 V577 R604 F605 A608	L526-Y530 WeakPolarHBondContact O-CB 3.42Å; L526-Y530 PolarHBondContact O-N 3.09Å; H527-Y530 WeakPolarHBondContact O-CB 3.27Å; H527-Y530 PolarHBondContact O-N 3.12Å; L528-Y530 VanDerWaalsContact C-N 3.29Å; L528-Y530 PolarHBondContact O-N 3.02Å; Y530-V532 VanDerWaalsContact C-N 3.3Å; Y530-V532 PolarHBondContact O-N 3.32Å; Y530-T533 WeakPolarHBondContact O-CB 3.21Å; Y530-T533 PolarHBondContact O-N 3.39Å; Y530-T533 VanDerWaalsContact O-N 3.1Å; Y530-V577 HydrophobicContact CD1-CG1 4.15Å; Y530-V577 HydrophobicContact CD1-CG2 3.74Å; Y530-V577 HydrophobicContact CD2-CG1 4.11Å; Y530-V577 HydrophobicContact CE1-CB 4.29Å; Y530-V577 HydrophobicContact CE1-CG1 3.48Å; Y530-V577 VanDerWaalsContact CE1-CG1 3.48Å; Y530-V577 HydrophobicContact CE1-CG2 3.78Å; Y530-V577 HydrophobicContact CE2-CG1 3.43Å; Y530-V577 VanDerWaalsContact CE2-CG1 3.43Å; Y530-V577 HydrophobicContact CG-CG1 4.44Å; Y530-V577 HydrophobicContact CG-CG2 4.14Å; Y530-V577 WeakPolarHBondContact OH-CG1 3.17Å; Y530-R604 HydrophobicContact CD2-CG 4.04Å; Y530-R604 HydrophobicContact CE2-CB 3.92Å; Y530-R604 HydrophobicContact CE2-CG 3.46Å; Y530-R604 VanDerWaalsContact CE2-CG 3.46Å; Y530-R604 PolarHBondContact O-NE 3.36Å; Y530-R604 PolarHBondContact O-NH2 2.94Å; Y530-R604 WeakPolarHBondContact OH-CD 3.4Å; Y530-R604 PolarHBondContact OH-NH1 3.39Å; Y530-F605 HydrophobicContact CD2-CD2 4.31Å; Y530-F605 HydrophobicContact CE2-CB 4.45Å; Y530-A608 HydrophobicContact CD2-CB 4.02Å
531	L	90.2	Very high	74.7	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-35.1	178.8	-66.1	172.9	0	0	0	112.6	L513 A516 H527 L528 V529 R604	L513-L531 HydrophobicContact CD2-CB 4.43Å; A516-L531 HydrophobicContact CB-CD1 3.69Å; A516-L531 HydrophobicContact CB-CD2 3.77Å; A516-L531 HydrophobicContact CB-CG 4.38Å; H527-L531 WeakPolarHBondContact O-CG 3.33Å; H527-L531 PolarHBondContact O-N 2.88Å; L528-L531 HydrophobicContact CD2-CD1 4.45Å; L528-L531 PolarHBondContact O-N 3.23Å; V529-L531 PolarHBondContact O-N 2.93Å; L531-R604 PolarHBondContact O-NH2 3.44Å
532	V	87.5	Confident	72.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	5.2	174.8	-56.9	0	0	0	0	113.8	L528 V529 Y530 Y644 A645 V648 L664 L671	L528-V532 WeakPolarHBondContact O-CG2 3.48Å; L528-V532 PolarHBondContact O-N 3.28Å; V529-V532 CarbonylContact O-C 3.45Å; V529-V532 WeakPolarHBondContact O-CG2 3.45Å; V529-V532 PolarHBondContact O-N 3.04Å; Y530-V532 VanDerWaalsContact C-N 3.3Å; Y530-V532 PolarHBondContact O-N 3.32Å; V532-Y644 WeakPolarHBondContact O-CD1 3.36Å; V532-A645 HydrophobicContact CB-CB 3.72Å; V532-A645 HydrophobicContact CG1-CB 4.06Å; V532-A645 HydrophobicContact CG2-CB 4.06Å; V532-V648 HydrophobicContact CG1-CG1 4.4Å; V532-L664 HydrophobicContact CG1-CD1 4.44Å; V532-L664 HydrophobicContact CG1-CD2 3.88Å; V532-L671 HydrophobicContact CG2-CD1 3.72Å
533	T	85	Confident	69.9	Low	3 Å²	3	38 Å²	38	2%	0.018	21%	0.207	C	C	.	.	S	Bend	trans	-83.8	126	169.4	-65.3	0	0	0	0	107.9	V529 Y530 S535 R604 V607 A608 L611	V529-T533 WeakPolarHBondContact O-CB 3Å; V529-T533 PolarHBondContact O-N 2.77Å; V529-T533 PolarHBondContact O-OG1 3.39Å; Y530-T533 WeakPolarHBondContact O-CB 3.21Å; Y530-T533 PolarHBondContact O-N 3.39Å; Y530-T533 VanDerWaalsContact O-N 3.1Å; T533-S535 PolarHBondContact O-N 3.12Å; T533-R604 HydrophobicContact CG2-CG 4.03Å; T533-R604 PolarHBondContact O-NE 3.37Å; T533-R604 PolarHBondContact O-NH2 2.9Å; T533-V607 HydrophobicContact CG2-CB 4.2Å; T533-V607 HydrophobicContact CG2-CG1 3.59Å; T533-A608 HydrophobicContact CG2-CB 4.49Å; T533-L611 HydrophobicContact CG2-CD1 4.18Å
534	L	71.4	Confident	67.5	Low	47 Å²	47	34.4 Å²	34.4	25%	0.246	19%	0.191	C	C	.	.			trans	-36.6	117.8	-179	-78.6	146.1	0	0	0	112.7	Q640 Y644	L534-Q640 HydrophobicContact CD1-CB 4.12Å; L534-Y644 HydrophobicContact CD2-CD1 4.37Å; L534-Y644 HydrophobicContact CD2-CD2 3.56Å; L534-Y644 HydrophobicContact CD2-CE2 3.96Å; L534-Y644 HydrophobicContact CD2-CG 3.76Å; L534-Y644 HydrophobicContact CG-CD1 4.17Å; L534-Y644 HydrophobicContact CG-CD2 4.23Å; L534-Y644 HydrophobicContact CG-CG 3.91Å
535	S	60	Low	65	Low	15 Å²	15	36.9 Å²	36.9	11%	0.105	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-86.1	140.9	174.4	-165.3	0	0	0	0	110.5	D512 T533 R604	D512-S535 PolarHBondContact OD2-OG 3.48Å; T533-S535 PolarHBondContact O-N 3.12Å; S535-R604 PolarHBondContact OG-NH1 3.29Å; S535-R604 VanDerWaalsContact OG-NH1 3.17Å
536	Y	52.6	Low	62.5	Low	66 Å²	66	37.7 Å²	37.7	26%	0.259	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-77	136.3	176.9	-177.3	-106.9	0	0	0	110.9	Q538 L544 E600	Y536-Q538 VanDerWaalsContact CE1-CA 3.49Å; Y536-Q538 HydrophobicContact CE1-CG 4.41Å; Y536-L544 HydrophobicContact CD2-CB 4.29Å; Y536-L544 HydrophobicContact CD2-CD1 3.42Å; Y536-L544 VanDerWaalsContact CD2-CD1 3.42Å; Y536-L544 HydrophobicContact CD2-CG 4.49Å; Y536-L544 HydrophobicContact CE2-CD1 4.42Å; Y536-L544 HydrophobicContact CG-CD1 3.92Å; Y536-E600 HydrophobicContact CD1-CG 3.77Å; Y536-E600 WeakPolarHBondContact CD1-OE1 3.44Å; Y536-E600 HydrophobicContact CE1-CG 4.32Å; Y536-E600 WeakPolarHBondContact CE1-OE1 3.41Å; Y536-E600 HydrophobicContact CG-CG 4.09Å
537	C	42.4	Very low	59.9	Low	9 Å²	9	38.2 Å²	38.2	6%	0.061	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-102.5	124.9	164.8	-59.9	0	0	0	0	109.3	D504 H539 T542	D504-C537 HydrophobicContact CB-CB 4.49Å; C537-H539 PolarHBondContact O-N 3.22Å; C537-T542 PolarHBondContact N-OG1 3.37Å
538	Q	39.9	Very low	57.3	Low	129 Å²	129	41.7 Å²	41.7	60%	0.603	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-6.5	-176.3	-82.5	-175.2	-15.4	0	0	117.2	Y536 G540	Y536-Q538 VanDerWaalsContact CE1-CA 3.49Å; Y536-Q538 HydrophobicContact CE1-CG 4.41Å; Q538-G540 PolarHBondContact O-N 3.1Å
539	H	42.1	Very low	55	Low	130 Å²	130	45.5 Å²	45.5	60%	0.602	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	15.7	-172.6	-69.8	60.4	0	0	0	113.8	C537 V541	C537-H539 PolarHBondContact O-N 3.22Å; H539-V541 HydrophobicContact CB-CG2 4.35Å; H539-V541 WeakPolarHBondContact O-CG2 3.48Å; H539-V541 PolarHBondContact O-N 3.17Å
540	G	36.9	Very low	52.6	Low	63 Å²	63	46.2 Å²	46.2	65%	0.649	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	16.7	-175.1	0	0	0	0	0	113.2	Q538	Q538-G540 PolarHBondContact O-N 3.1Å
541	V	39	Very low	50.2	Low	34 Å²	34	45.9 Å²	45.9	21%	0.206	26%	0.26	C	S	.	.			trans	-118.3	78	-173.5	-173.6	0	0	0	0	109	H539	H539-V541 HydrophobicContact CB-CG2 4.35Å; H539-V541 WeakPolarHBondContact O-CG2 3.48Å; H539-V541 PolarHBondContact O-N 3.17Å
542	T	39.4	Very low	48	Very low	21 Å²	21	51 Å²	51	13%	0.129	29%	0.291	C	S	.	.	S	Bend	trans	174.7	140.1	148.9	22.8	0	0	0	0	105.7	E505 C537 L544	E505-T542 HydrophobicContact CG-CG2 4.45Å; E505-T542 WeakPolarHBondContact OE1-CG2 3.45Å; C537-T542 PolarHBondContact N-OG1 3.37Å; T542-L544 PolarHBondContact O-N 2.96Å
543	P	37	Very low	46.3	Very low	65 Å²	65	55.1 Å²	55.1	42%	0.422	32%	0.316	S	S	.	.			trans	-79.6	58.3	-162.6	32.6	-34.1	0	0	0	112.6	C545 M546	P543-C545 VanDerWaalsContact CB-SG 3.6Å; P543-C545 PolarHBondContact O-N 3.06Å; P543-M546 PolarHBondContact O-N 3.35Å
544	L	41	Very low	45.5	Very low	40 Å²	40	55.7 Å²	55.7	21%	0.209	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-2	147.1	-93.5	138.2	0	0	0	111.2	Y536 T542 M546 L547 D548	Y536-L544 HydrophobicContact CD2-CB 4.29Å; Y536-L544 HydrophobicContact CD2-CD1 3.42Å; Y536-L544 VanDerWaalsContact CD2-CD1 3.42Å; Y536-L544 HydrophobicContact CD2-CG 4.49Å; Y536-L544 HydrophobicContact CE2-CD1 4.42Å; Y536-L544 HydrophobicContact CG-CD1 3.92Å; T542-L544 PolarHBondContact O-N 2.96Å; L544-M546 PolarHBondContact O-N 3.4Å; L544-L547 HydrophobicContact CB-CB 4.25Å; L544-L547 HydrophobicContact CD2-CB 3.17Å; L544-L547 HydrophobicContact CD2-CD1 4.06Å; L544-L547 HydrophobicContact CD2-CD2 3.75Å; L544-L547 HydrophobicContact CD2-CG 3.81Å; L544-L547 HydrophobicContact CG-CB 3.94Å; L544-L547 CarbonylContact O-C 3.5Å; L544-L547 VanDerWaalsContact O-CA 3.3Å; L544-L547 WeakPolarHBondContact O-CA 3.18Å; L544-L547 PolarHBondContact O-N 3.11Å; L544-D548 PolarHBondContact O-N 3.15Å
545	C	40.4	Very low	45.7	Very low	82 Å²	82	56 Å²	56	55%	0.554	33%	0.325	S	S	*	.	H	α-helix	trans	-60.6	-22.2	160.9	66.1	0	0	0	0	112.2	P543 D548	P543-C545 VanDerWaalsContact CB-SG 3.6Å; P543-C545 PolarHBondContact O-N 3.06Å; C545-D548 PolarHBondContact O-N 3.27Å
546	M	40.1	Very low	46.8	Very low	53 Å²	53	57.4 Å²	57.4	26%	0.261	33%	0.328	S	S	.	.	H	α-helix	trans	-80.1	-36	167.5	-107.7	-144.6	-88.4	0	0	111.7	P543 L544 D548 N549 L550 Y633	P543-M546 PolarHBondContact O-N 3.35Å; L544-M546 PolarHBondContact O-N 3.4Å; M546-D548 PolarHBondContact O-N 2.99Å; M546-N549 CarbonylContact O-C 3.54Å; M546-N549 WeakPolarHBondContact O-CA 3.31Å; M546-N549 WeakPolarHBondContact O-CB 3.5Å; M546-N549 PolarHBondContact O-N 3.05Å; M546-L550 PolarHBondContact O-N 3.28Å; M546-L550 VanDerWaalsContact O-N 3.12Å; M546-Y633 HydrophobicContact CB-CE2 3.64Å; M546-Y633 HydrophobicContact CG-CD2 4.44Å; M546-Y633 HydrophobicContact CG-CE2 3.84Å; M546-Y633 WeakPolarHBondContact O-CE2 3.48Å; M546-Y633 PolarHBondContact O-OH 3.48Å; M546-Y633 VanDerWaalsContact O-OH 3.12Å; M546-Y633 HydrophobicContact SD-CD2 3.72Å; M546-Y633 HydrophobicContact SD-CE2 3.58Å; M546-Y633 VanDerWaalsContact SD-CE2 3.58Å
547	L	41.7	Very low	48.3	Very low	12 Å²	12	57 Å²	57	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-72.8	-5.7	163.9	-112.4	107	0	0	0	113.4	L544 L550 A551 L603 V607 Y633	L544-L547 HydrophobicContact CB-CB 4.25Å; L544-L547 HydrophobicContact CD2-CB 3.17Å; L544-L547 HydrophobicContact CD2-CD1 4.06Å; L544-L547 HydrophobicContact CD2-CD2 3.75Å; L544-L547 HydrophobicContact CD2-CG 3.81Å; L544-L547 HydrophobicContact CG-CB 3.94Å; L544-L547 CarbonylContact O-C 3.5Å; L544-L547 VanDerWaalsContact O-CA 3.3Å; L544-L547 WeakPolarHBondContact O-CA 3.18Å; L544-L547 PolarHBondContact O-N 3.11Å; L547-L550 HydrophobicContact CB-CB 4.31Å; L547-L550 HydrophobicContact CD2-CB 4.11Å; L547-L550 HydrophobicContact CD2-CD2 4.18Å; L547-L550 HydrophobicContact CG-CB 3.7Å; L547-L550 HydrophobicContact CG-CD2 4.37Å; L547-L550 CarbonylContact O-C 3.58Å; L547-L550 PolarHBondContact O-N 3.17Å; L547-A551 VanDerWaalsContact O-CA 3.3Å; L547-A551 WeakPolarHBondContact O-CA 3.19Å; L547-A551 WeakPolarHBondContact O-CB 3.5Å; L547-A551 PolarHBondContact O-N 3.35Å; L547-L603 HydrophobicContact CD2-CB 4.23Å; L547-L603 HydrophobicContact CD2-CD2 4.47Å; L547-V607 HydrophobicContact CD1-CG2 3.41Å; L547-V607 VanDerWaalsContact CD1-CG2 3.41Å; L547-V607 HydrophobicContact CD2-CG2 3.47Å; L547-V607 VanDerWaalsContact CD2-CG2 3.47Å; L547-V607 HydrophobicContact CG-CG2 3.94Å; L547-Y633 WeakPolarHBondContact CA-OH 3.48Å; L547-Y633 WeakPolarHBondContact CD1-OH 3.37Å; L547-Y633 PolarHBondContact N-OH 3.2Å; L547-Y633 VanDerWaalsContact N-OH 3.16Å
548	D	39.4	Very low	50.4	Low	80 Å²	80	59.7 Å²	59.7	43%	0.428	35%	0.351	S	S	.	.	H	α-helix	trans	-74.9	-28.9	163.7	-83.8	-35.3	0	0	0	107.3	L544 C545 M546 L550 T552	L544-D548 PolarHBondContact O-N 3.15Å; C545-D548 PolarHBondContact O-N 3.27Å; M546-D548 PolarHBondContact O-N 2.99Å; D548-L550 VanDerWaalsContact C-N 3.31Å; D548-T552 WeakPolarHBondContact O-CA 3.35Å; D548-T552 WeakPolarHBondContact O-CB 2.79Å; D548-T552 VanDerWaalsContact O-CG2 3.25Å; D548-T552 WeakPolarHBondContact O-CG2 3.39Å; D548-T552 PolarHBondContact O-N 3Å; D548-T552 PolarHBondContact O-OG1 2.83Å
549	N	43.6	Very low	52.7	Low	84 Å²	84	53.6 Å²	53.6	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-68.7	-29.5	164.1	-60	-51.8	0	0	0	112.3	M546 T553	M546-N549 CarbonylContact O-C 3.54Å; M546-N549 WeakPolarHBondContact O-CA 3.31Å; M546-N549 WeakPolarHBondContact O-CB 3.5Å; M546-N549 PolarHBondContact O-N 3.05Å; N549-T553 WeakPolarHBondContact O-CB 3.26Å; N549-T553 PolarHBondContact O-OG1 3.17Å
550	L	42.9	Very low	55	Low	16 Å²	16	49 Å²	49	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-75.7	-53.9	170.5	-143.5	103.3	0	0	0	110.8	M546 L547 D548 T553 I554 F606 C629 Y633	M546-L550 PolarHBondContact O-N 3.28Å; M546-L550 VanDerWaalsContact O-N 3.12Å; L547-L550 HydrophobicContact CB-CB 4.31Å; L547-L550 HydrophobicContact CD2-CB 4.11Å; L547-L550 HydrophobicContact CD2-CD2 4.18Å; L547-L550 HydrophobicContact CG-CB 3.7Å; L547-L550 HydrophobicContact CG-CD2 4.37Å; L547-L550 CarbonylContact O-C 3.58Å; L547-L550 PolarHBondContact O-N 3.17Å; D548-L550 VanDerWaalsContact C-N 3.31Å; L550-T553 CarbonylContact O-C 3.55Å; L550-T553 WeakPolarHBondContact O-CA 3.44Å; L550-T553 WeakPolarHBondContact O-CB 3.28Å; L550-T553 PolarHBondContact O-N 3.35Å; L550-I554 HydrophobicContact CD2-CD1 3.98Å; L550-I554 HydrophobicContact CD2-CG1 3.91Å; L550-I554 HydrophobicContact CG-CG1 4.29Å; L550-I554 WeakPolarHBondContact O-CG1 3.42Å; L550-I554 PolarHBondContact O-N 3.26Å; L550-F606 HydrophobicContact CD2-CD1 3.85Å; L550-F606 HydrophobicContact CD2-CE1 3.71Å; L550-C629 HydrophobicContact CD1-CB 3.62Å; L550-Y633 HydrophobicContact CB-CE1 4.47Å; L550-Y633 HydrophobicContact CD1-CD1 3.63Å; L550-Y633 HydrophobicContact CD1-CE1 3.25Å; L550-Y633 HydrophobicContact CG-CE1 4.44Å
551	A	41	Very low	57.6	Low	9 Å²	9	48.9 Å²	48.9	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-78.3	-20.2	-171.7	0	0	0	0	0	115.7	L547 I554 L603	L547-A551 VanDerWaalsContact O-CA 3.3Å; L547-A551 WeakPolarHBondContact O-CA 3.19Å; L547-A551 WeakPolarHBondContact O-CB 3.5Å; L547-A551 PolarHBondContact O-N 3.35Å; A551-I554 HydrophobicContact CB-CD1 3.99Å; A551-L603 HydrophobicContact CB-CD1 3.97Å; A551-L603 HydrophobicContact CB-CD2 3.95Å
552	T	45	Very low	60.1	Low	113 Å²	113	47.4 Å²	47.4	69%	0.693	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.9	156.7	59.3	0	0	0	0	111.4	D548	D548-T552 WeakPolarHBondContact O-CA 3.35Å; D548-T552 WeakPolarHBondContact O-CB 2.79Å; D548-T552 VanDerWaalsContact O-CG2 3.25Å; D548-T552 WeakPolarHBondContact O-CG2 3.39Å; D548-T552 PolarHBondContact O-N 3Å; D548-T552 PolarHBondContact O-OG1 2.83Å
553	T	52.1	Low	62.7	Low	86 Å²	86	46.5 Å²	46.5	53%	0.528	28%	0.275	S	S	.	.	S	Bend	trans	-117.1	-1.1	-178.4	-35.6	0	0	0	0	113.2	N549 L550 S555	N549-T553 WeakPolarHBondContact O-CB 3.26Å; N549-T553 PolarHBondContact O-OG1 3.17Å; L550-T553 CarbonylContact O-C 3.55Å; L550-T553 WeakPolarHBondContact O-CA 3.44Å; L550-T553 WeakPolarHBondContact O-CB 3.28Å; L550-T553 PolarHBondContact O-N 3.35Å; T553-S555 PolarHBondContact O-N 3.09Å
554	I	66.7	Low	65.3	Low	15 Å²	15	48.7 Å²	48.7	8%	0.077	28%	0.28	C	S	.	.			trans	-73.3	109.2	-179.3	-74.6	165.4	0	0	0	105.5	L550 A551 W556 L603 F606	L550-I554 HydrophobicContact CD2-CD1 3.98Å; L550-I554 HydrophobicContact CD2-CG1 3.91Å; L550-I554 HydrophobicContact CG-CG1 4.29Å; L550-I554 WeakPolarHBondContact O-CG1 3.42Å; L550-I554 PolarHBondContact O-N 3.26Å; A551-I554 HydrophobicContact CB-CD1 3.99Å; I554-W556 HydrophobicContact CG2-CD2 4.47Å; I554-W556 PolarHBondContact O-N 3.21Å; I554-L603 HydrophobicContact CD1-CD2 3.14Å; I554-F606 HydrophobicContact CD1-CD1 3.87Å; I554-F606 HydrophobicContact CD1-CE1 4.13Å; I554-F606 HydrophobicContact CG1-CD1 4.15Å; I554-F606 HydrophobicContact CG1-CE1 3.88Å; I554-F606 HydrophobicContact CG2-CE1 4.48Å
555	S	75.9	Confident	67.8	Low	54 Å²	54	50.2 Å²	50.2	38%	0.378	29%	0.293	S	S	.	.			trans	-65.6	102.3	162.5	175.5	0	0	0	0	107.4	T553 A557 Q558 Y559	T553-S555 PolarHBondContact O-N 3.09Å; S555-A557 PolarHBondContact O-N 3.02Å; S555-Q558 WeakPolarHBondContact O-CA 3.46Å; S555-Q558 WeakPolarHBondContact O-CB 3.44Å; S555-Q558 PolarHBondContact O-N 3.5Å; S555-Q558 PolarHBondContact OG-N 3.23Å; S555-Q558 VanDerWaalsContact OG-N 3.16Å; S555-Y559 PolarHBondContact O-N 2.75Å
556	W	83.2	Confident	70.3	Confident	44 Å²	44	47.2 Å²	47.2	17%	0.167	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-29.1	172.5	-65.8	102	0	0	0	111.1	I554 Y559 F560 Y583 L584 K587 L588 L603	I554-W556 HydrophobicContact CG2-CD2 4.47Å; I554-W556 PolarHBondContact O-N 3.21Å; W556-Y559 AromaticContact CE3-CD1 3.99Å; W556-Y559 HydrophobicContact CE3-CD1 3.99Å; W556-Y559 AromaticContact CZ3-CD1 3.91Å; W556-Y559 HydrophobicContact CZ3-CD1 3.91Å; W556-Y559 HydrophobicContact CZ3-CE1 4.21Å; W556-Y559 PolarHBondContact O-N 3.15Å; W556-F560 WeakPolarHBondContact O-CB 3.45Å; W556-F560 PolarHBondContact O-N 3.38Å; W556-Y583 HydrophobicContact CH2-CE1 4.47Å; W556-L584 HydrophobicContact CE3-CD2 4.19Å; W556-L584 HydrophobicContact CZ3-CD2 4.18Å; W556-K587 HydrophobicContact CB-CB 4.34Å; W556-K587 HydrophobicContact CD2-CB 3.71Å; W556-K587 HydrophobicContact CD2-CG 4.16Å; W556-K587 HydrophobicContact CE3-CB 4.03Å; W556-K587 HydrophobicContact CE3-CG 4.28Å; W556-K587 HydrophobicContact CG-CB 3.84Å; W556-K587 HydrophobicContact CH2-CG 4.46Å; W556-K587 HydrophobicContact CZ2-CD 4.5Å; W556-K587 HydrophobicContact CZ2-CG 4.32Å; W556-K587 HydrophobicContact CZ3-CG 4.43Å; W556-L588 HydrophobicContact CB-CD2 4.04Å; W556-L603 HydrophobicContact CH2-CD2 4.22Å
557	A	85.2	Confident	72.9	Confident	59 Å²	59	48.5 Å²	48.5	49%	0.488	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-45.3	171.1	0	0	0	0	0	112	S555 F560 S561 L588	S555-A557 PolarHBondContact O-N 3.02Å; A557-F560 PolarHBondContact O-N 2.95Å; A557-S561 WeakPolarHBondContact O-CB 3.39Å; A557-S561 PolarHBondContact O-N 3.28Å; A557-L588 HydrophobicContact CB-CD2 3.95Å
558	Q	85	Confident	75.2	Confident	65 Å²	65	56.2 Å²	56.2	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-42.4	175.8	-169	66.2	16.3	0	0	111.6	S555 S561 I562 R626	S555-Q558 WeakPolarHBondContact O-CA 3.46Å; S555-Q558 WeakPolarHBondContact O-CB 3.44Å; S555-Q558 PolarHBondContact O-N 3.5Å; S555-Q558 PolarHBondContact OG-N 3.23Å; S555-Q558 VanDerWaalsContact OG-N 3.16Å; Q558-S561 WeakPolarHBondContact O-CB 3.08Å; Q558-S561 PolarHBondContact O-N 3.19Å; Q558-I562 HydrophobicContact CG-CD1 4.16Å; Q558-I562 WeakPolarHBondContact O-CG1 3.34Å; Q558-I562 PolarHBondContact O-N 3.48Å; Q558-R626 PolarHBondContact NE2-O 3.44Å
559	Y	89.6	Confident	77.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-46.1	176.5	-172.3	-179	0	0	0	110.9	S555 W556 S561 I562 W563 L584 H602 F605 F606 L609	S555-Y559 PolarHBondContact O-N 2.75Å; W556-Y559 AromaticContact CE3-CD1 3.99Å; W556-Y559 HydrophobicContact CE3-CD1 3.99Å; W556-Y559 AromaticContact CZ3-CD1 3.91Å; W556-Y559 HydrophobicContact CZ3-CD1 3.91Å; W556-Y559 HydrophobicContact CZ3-CE1 4.21Å; W556-Y559 PolarHBondContact O-N 3.15Å; Y559-S561 VanDerWaalsContact C-N 3.32Å; Y559-S561 PolarHBondContact O-N 2.96Å; Y559-I562 PolarHBondContact O-N 3.2Å; Y559-I562 VanDerWaalsContact O-N 3.15Å; Y559-W563 WeakPolarHBondContact O-CB 3.27Å; Y559-W563 PolarHBondContact O-N 3.39Å; Y559-L584 HydrophobicContact CD1-CD2 3.72Å; Y559-L584 HydrophobicContact CE1-CD2 3.7Å; Y559-L584 HydrophobicContact CE2-CD2 4.5Å; Y559-L584 HydrophobicContact CG-CD2 4.17Å; Y559-H602 HydrophobicContact CE1-CB 4.27Å; Y559-H602 WeakPolarHBondContact CE1-O 3.3Å; Y559-H602 PolarHBondContact OH-O 2.72Å; Y559-F605 WeakPolarHBondContact OH-CD1 3.47Å; Y559-F606 HydrophobicContact CD1-CB 4.23Å; Y559-F606 AromaticContact CD1-CD2 3.81Å; Y559-F606 HydrophobicContact CD1-CD2 3.81Å; Y559-F606 HydrophobicContact CD1-CE2 4.45Å; Y559-F606 HydrophobicContact CD1-CG 4.2Å; Y559-F606 AromaticContact CD2-CD2 3.42Å; Y559-F606 HydrophobicContact CD2-CD2 3.42Å; Y559-F606 VanDerWaalsContact CD2-CD2 3.42Å; Y559-F606 AromaticContact CD2-CE2 3.95Å; Y559-F606 HydrophobicContact CD2-CE2 3.95Å; Y559-F606 HydrophobicContact CD2-CG 4.43Å; Y559-F606 HydrophobicContact CE1-CB 3.75Å; Y559-F606 HydrophobicContact CE1-CD2 4.08Å; Y559-F606 HydrophobicContact CE1-CG 4.22Å; Y559-F606 HydrophobicContact CE2-CB 4.26Å; Y559-F606 AromaticContact CE2-CD2 3.78Å; Y559-F606 HydrophobicContact CE2-CD2 3.78Å; Y559-F606 AromaticContact CG-CD2 3.47Å; Y559-F606 HydrophobicContact CG-CD2 3.47Å; Y559-F606 VanDerWaalsContact CG-CD2 3.47Å; Y559-F606 AromaticContact CG-CE2 3.84Å; Y559-F606 HydrophobicContact CG-CE2 3.84Å; Y559-F606 HydrophobicContact CG-CG 4.31Å; Y559-L609 HydrophobicContact CE2-CD1 4.39Å
560	F	90.7	Very high	80.1	Confident	34 Å²	34	49.2 Å²	49.2	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-40.4	177.2	-172.8	-107.5	0	0	0	112.4	W556 A557 W563 Q564 E581 L584 V585 L588	W556-F560 WeakPolarHBondContact O-CB 3.45Å; W556-F560 PolarHBondContact O-N 3.38Å; A557-F560 PolarHBondContact O-N 2.95Å; F560-W563 WeakPolarHBondContact O-CB 3.18Å; F560-W563 PolarHBondContact O-N 3.35Å; F560-Q564 HydrophobicContact CD1-CG 4.46Å; F560-Q564 VanDerWaalsContact CE1-CD 3.49Å; F560-Q564 HydrophobicContact CE1-CG 4.2Å; F560-Q564 HydrophobicContact CZ-CG 4.32Å; F560-Q564 WeakPolarHBondContact O-CG 3.3Å; F560-Q564 PolarHBondContact O-N 2.8Å; F560-E581 HydrophobicContact CE2-CG 4.23Å; F560-L584 HydrophobicContact CD2-CB 3.95Å; F560-L584 HydrophobicContact CD2-CD1 4.45Å; F560-V585 HydrophobicContact CD2-CG2 4.39Å; F560-V585 HydrophobicContact CE2-CG2 3.61Å; F560-V585 HydrophobicContact CZ-CG2 4Å; F560-L588 HydrophobicContact CB-CD1 3.78Å; F560-L588 HydrophobicContact CB-CD2 4.37Å; F560-L588 HydrophobicContact CB-CG 4.42Å; F560-L588 HydrophobicContact CD1-CD1 3.68Å; F560-L588 HydrophobicContact CD2-CD1 4.05Å; F560-L588 HydrophobicContact CE1-CD1 4.22Å; F560-L588 HydrophobicContact CG-CD1 3.57Å
561	S	90.9	Very high	82.5	Confident	61 Å²	61	51.9 Å²	51.9	43%	0.427	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-46.2	172.5	177.5	0	0	0	0	112.2	A557 Q558 Y559 W563 Q564 S565	A557-S561 WeakPolarHBondContact O-CB 3.39Å; A557-S561 PolarHBondContact O-N 3.28Å; Q558-S561 WeakPolarHBondContact O-CB 3.08Å; Q558-S561 PolarHBondContact O-N 3.19Å; Y559-S561 VanDerWaalsContact C-N 3.32Å; Y559-S561 PolarHBondContact O-N 2.96Å; S561-W563 PolarHBondContact O-N 3.44Å; S561-Q564 PolarHBondContact O-N 3.47Å; S561-S565 PolarHBondContact O-N 3.16Å; S561-S565 VanDerWaalsContact O-N 3.1Å
562	I	92.1	Very high	85	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-46.3	175.9	-69.1	166.2	0	0	0	110.4	Q558 Y559 Q564 S565 L566 F606 L609 R626 F627	Q558-I562 HydrophobicContact CG-CD1 4.16Å; Q558-I562 WeakPolarHBondContact O-CG1 3.34Å; Q558-I562 PolarHBondContact O-N 3.48Å; Y559-I562 PolarHBondContact O-N 3.2Å; Y559-I562 VanDerWaalsContact O-N 3.15Å; I562-Q564 VanDerWaalsContact C-N 3.3Å; I562-Q564 PolarHBondContact O-N 2.75Å; I562-S565 WeakPolarHBondContact CA-OG 3.27Å; I562-S565 CarbonylContact O-C 3.58Å; I562-S565 PolarHBondContact O-N 3.4Å; I562-S565 PolarHBondContact O-OG 3.43Å; I562-L566 HydrophobicContact CG2-CD2 4.38Å; I562-L566 WeakPolarHBondContact O-CG 3.4Å; I562-L566 PolarHBondContact O-N 2.83Å; I562-F606 HydrophobicContact CD1-CE2 4.05Å; I562-L609 HydrophobicContact CG2-CD1 4.22Å; I562-R626 HydrophobicContact CD1-CG 4.45Å; I562-F627 HydrophobicContact CD1-CD1 4.06Å; I562-F627 HydrophobicContact CD1-CE1 4.02Å; I562-F627 HydrophobicContact CD1-CG 4.46Å; I562-F627 HydrophobicContact CD1-CZ 4.4Å
563	W	93.1	Very high	87.2	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-56.4	-42.8	177.4	175.8	-98.4	0	0	0	112.2	Y559 F560 S561 S565 L566 R571 Q575 V579 E581 L584 F605	Y559-W563 WeakPolarHBondContact O-CB 3.27Å; Y559-W563 PolarHBondContact O-N 3.39Å; F560-W563 WeakPolarHBondContact O-CB 3.18Å; F560-W563 PolarHBondContact O-N 3.35Å; S561-W563 PolarHBondContact O-N 3.44Å; W563-S565 VanDerWaalsContact C-N 3.29Å; W563-S565 PolarHBondContact O-N 2.92Å; W563-L566 HydrophobicContact CE3-CD1 3.81Å; W563-L566 HydrophobicContact CZ3-CD1 4.26Å; W563-L566 PolarHBondContact O-N 3.33Å; W563-R571 HydrophobicContact CH2-CG 4.14Å; W563-R571 HydrophobicContact CZ2-CG 3.98Å; W563-R571 PolarHBondContact O-NH2 3.32Å; W563-Q575 HydrophobicContact CH2-CG 4.44Å; W563-V579 HydrophobicContact CE3-CG1 3.89Å; W563-V579 HydrophobicContact CH2-CB 3.97Å; W563-V579 HydrophobicContact CH2-CG1 3.67Å; W563-V579 HydrophobicContact CZ2-CG1 4.4Å; W563-V579 HydrophobicContact CZ3-CB 3.89Å; W563-V579 HydrophobicContact CZ3-CG1 3.38Å; W563-E581 PolarHBondContact NE1-OE2 3.17Å; W563-E581 VanDerWaalsContact NE1-OE2 3.12Å; W563-L584 HydrophobicContact CB-CD1 3.9Å; W563-L584 HydrophobicContact CD2-CD1 3.98Å; W563-L584 HydrophobicContact CE3-CD1 4.46Å; W563-L584 HydrophobicContact CG-CD1 3.7Å; W563-F605 HydrophobicContact CE3-CE1 4.16Å; W563-F605 HydrophobicContact CZ3-CD1 4.44Å; W563-F605 AromaticContact CZ3-CE1 3.79Å; W563-F605 HydrophobicContact CZ3-CE1 3.79Å; W563-F605 HydrophobicContact CZ3-CZ 4.46Å
564	Q	92.4	Very high	89.2	Confident	111 Å²	111	46.4 Å²	46.4	52%	0.519	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-34.4	176.6	-74.7	-175	-30.7	0	0	112.4	F560 S561 I562 R571	F560-Q564 HydrophobicContact CD1-CG 4.46Å; F560-Q564 VanDerWaalsContact CE1-CD 3.49Å; F560-Q564 HydrophobicContact CE1-CG 4.2Å; F560-Q564 HydrophobicContact CZ-CG 4.32Å; F560-Q564 WeakPolarHBondContact O-CG 3.3Å; F560-Q564 PolarHBondContact O-N 2.8Å; S561-Q564 PolarHBondContact O-N 3.47Å; I562-Q564 VanDerWaalsContact C-N 3.3Å; I562-Q564 PolarHBondContact O-N 2.75Å; Q564-R571 VanDerWaalsContact CA-NH2 3.33Å; Q564-R571 PolarHBondContact O-NH2 3.29Å; Q564-R571 VanDerWaalsContact O-NH2 3.09Å
565	S	92.7	Very high	90.4	Very high	71 Å²	71	51.4 Å²	51.4	50%	0.497	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.1	179.9	74.7	0	0	0	0	115.8	S561 I562 W563	S561-S565 PolarHBondContact O-N 3.16Å; S561-S565 VanDerWaalsContact O-N 3.1Å; I562-S565 WeakPolarHBondContact CA-OG 3.27Å; I562-S565 CarbonylContact O-C 3.58Å; I562-S565 PolarHBondContact O-N 3.4Å; I562-S565 PolarHBondContact O-OG 3.43Å; W563-S565 VanDerWaalsContact C-N 3.29Å; W563-S565 PolarHBondContact O-N 2.92Å
566	L	93.4	Very high	91	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.099	27%	0.272	C	S	.	.			trans	-67.4	141.6	-180	-67	179	0	0	0	111.4	I562 W563 R571 F605 L609	I562-L566 HydrophobicContact CG2-CD2 4.38Å; I562-L566 WeakPolarHBondContact O-CG 3.4Å; I562-L566 PolarHBondContact O-N 2.83Å; W563-L566 HydrophobicContact CE3-CD1 3.81Å; W563-L566 HydrophobicContact CZ3-CD1 4.26Å; W563-L566 PolarHBondContact O-N 3.33Å; L566-R571 HydrophobicContact CB-CB 4.47Å; L566-F605 HydrophobicContact CD1-CE1 4.12Å; L566-F605 HydrophobicContact CD1-CZ 4.45Å; L566-L609 HydrophobicContact CD1-CD1 4.25Å; L566-L609 HydrophobicContact CD1-CD2 4.25Å; L566-L609 HydrophobicContact CD2-CD1 4.4Å; L566-L609 HydrophobicContact CD2-CD2 3.74Å
567	D	93.4	Very high	91.3	Very high	81 Å²	81	51.3 Å²	51.3	43%	0.433	27%	0.272	S	S	.	.			trans	-64.2	162.8	167.3	63.3	-70.3	0	0	0	111.5	A569 S570 R571	D567-A569 VanDerWaalsContact C-N 3.33Å; D567-A569 PolarHBondContact O-N 3.05Å; D567-A569 WeakPolarHBondContact OD2-CB 3.34Å; D567-A569 PolarHBondContact OD2-N 3.24Å; D567-S570 VanDerWaalsContact CG-OG 3.29Å; D567-S570 PolarHBondContact O-N 3.49Å; D567-S570 WeakPolarHBondContact OD1-CB 3.04Å; D567-S570 PolarHBondContact OD1-OG 3.49Å; D567-S570 PolarHBondContact OD2-N 3.39Å; D567-S570 PolarHBondContact OD2-OG 3.35Å; D567-R571 WeakPolarHBondContact O-CB 3.46Å; D567-R571 PolarHBondContact O-N 2.91Å
568	E	91.4	Very high	91.5	Very high	174 Å²	174	50.1 Å²	50.1	81%	0.813	27%	0.265	S	S	*	.	H	α-helix	trans	-60.2	-41.2	-174.9	-167	175.3	-177.5	0	0	112.4	R571 K572	E568-R571 PolarHBondContact O-N 3.47Å; E568-K572 WeakPolarHBondContact O-CB 3.36Å; E568-K572 PolarHBondContact O-N 2.88Å
569	A	91.6	Very high	91.8	Very high	15 Å²	15	47.4 Å²	47.4	12%	0.124	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-49.6	178.4	0	0	0	0	0	111.2	E523 D567 R571 K572 V573	E523-A569 HydrophobicContact CB-CB 3.95Å; E523-A569 WeakPolarHBondContact OE2-CA 3.46Å; E523-A569 WeakPolarHBondContact OE2-CB 3.4Å; D567-A569 VanDerWaalsContact C-N 3.33Å; D567-A569 PolarHBondContact O-N 3.05Å; D567-A569 WeakPolarHBondContact OD2-CB 3.34Å; D567-A569 PolarHBondContact OD2-N 3.24Å; A569-R571 VanDerWaalsContact C-N 3.33Å; A569-R571 PolarHBondContact O-N 3.37Å; A569-K572 WeakPolarHBondContact O-CB 3.43Å; A569-K572 PolarHBondContact O-N 3.49Å; A569-V573 WeakPolarHBondContact O-CG2 2.98Å; A569-V573 PolarHBondContact O-N 3.24Å; A569-V573 VanDerWaalsContact O-N 3.1Å
570	S	94.2	Very high	91.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-38.1	177.4	-61.4	0	0	0	0	113	N524 D567 V573 G574	N524-S570 PolarHBondContact ND2-OG 2.9Å; D567-S570 VanDerWaalsContact CG-OG 3.29Å; D567-S570 PolarHBondContact O-N 3.49Å; D567-S570 WeakPolarHBondContact OD1-CB 3.04Å; D567-S570 PolarHBondContact OD1-OG 3.49Å; D567-S570 PolarHBondContact OD2-N 3.39Å; D567-S570 PolarHBondContact OD2-OG 3.35Å; S570-V573 PolarHBondContact O-N 2.87Å; S570-G574 PolarHBondContact O-N 3.25Å; S570-G574 VanDerWaalsContact O-N 3.15Å
571	R	93.4	Very high	91.8	Very high	73 Å²	73	53.6 Å²	53.6	28%	0.275	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-39.4	175.9	-176	174.2	-84.2	150.3	1.6	111.7	W563 Q564 L566 D567 E568 A569 V573 G574 Q575	W563-R571 HydrophobicContact CH2-CG 4.14Å; W563-R571 HydrophobicContact CZ2-CG 3.98Å; W563-R571 PolarHBondContact O-NH2 3.32Å; Q564-R571 VanDerWaalsContact CA-NH2 3.33Å; Q564-R571 PolarHBondContact O-NH2 3.29Å; Q564-R571 VanDerWaalsContact O-NH2 3.09Å; L566-R571 HydrophobicContact CB-CB 4.47Å; D567-R571 WeakPolarHBondContact O-CB 3.46Å; D567-R571 PolarHBondContact O-N 2.91Å; E568-R571 PolarHBondContact O-N 3.47Å; A569-R571 VanDerWaalsContact C-N 3.33Å; A569-R571 PolarHBondContact O-N 3.37Å; R571-V573 VanDerWaalsContact C-N 3.34Å; R571-V573 PolarHBondContact O-N 2.95Å; R571-G574 PolarHBondContact O-N 3.28Å; R571-G574 VanDerWaalsContact O-N 3.17Å; R571-Q575 WeakPolarHBondContact O-CG 3.21Å; R571-Q575 PolarHBondContact O-N 3.31Å
572	K	92.1	Very high	91.7	Very high	93 Å²	93	54.6 Å²	54.6	40%	0.404	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-38.9	174.7	-176.8	178.9	176.1	-176	0	112.4	E523 E568 A569 Q575 T576	E523-K572 IonicContact OE1-NZ 3.66Å; E523-K572 PolarHBondContact OE1-NZ 3.47Å; E568-K572 WeakPolarHBondContact O-CB 3.36Å; E568-K572 PolarHBondContact O-N 2.88Å; A569-K572 WeakPolarHBondContact O-CB 3.43Å; A569-K572 PolarHBondContact O-N 3.49Å; K572-Q575 PolarHBondContact O-N 3.17Å; K572-T576 WeakPolarHBondContact O-CB 3.37Å; K572-T576 PolarHBondContact O-N 2.68Å; K572-T576 PolarHBondContact O-OG1 3.35Å
573	V	93.1	Very high	91.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-48.4	171.6	179.9	0	0	0	0	110.5	V521 L526 H527 A569 S570 R571 Q575 T576 V577 F605	V521-V573 HydrophobicContact CB-CG2 4.01Å; V521-V573 HydrophobicContact CG1-CG2 3.77Å; L526-V573 HydrophobicContact CB-CG2 4.47Å; L526-V573 HydrophobicContact CD2-CB 4.17Å; L526-V573 HydrophobicContact CD2-CG1 4.35Å; L526-V573 HydrophobicContact CG-CB 4.45Å; L526-V573 HydrophobicContact CG-CG1 4.17Å; H527-V573 HydrophobicContact CB-CG1 3.71Å; H527-V573 HydrophobicContact CB-CG2 4.08Å; A569-V573 WeakPolarHBondContact O-CG2 2.98Å; A569-V573 PolarHBondContact O-N 3.24Å; A569-V573 VanDerWaalsContact O-N 3.1Å; S570-V573 PolarHBondContact O-N 2.87Å; R571-V573 VanDerWaalsContact C-N 3.34Å; R571-V573 PolarHBondContact O-N 2.95Å; V573-Q575 VanDerWaalsContact C-N 3.34Å; V573-Q575 PolarHBondContact O-N 3.44Å; V573-T576 PolarHBondContact O-N 3.45Å; V573-V577 HydrophobicContact CG1-CG2 4.28Å; V573-V577 WeakPolarHBondContact O-CB 3.28Å; V573-V577 WeakPolarHBondContact O-CG2 3.46Å; V573-V577 PolarHBondContact O-N 2.97Å; V573-F605 HydrophobicContact CB-CE2 4.4Å; V573-F605 HydrophobicContact CG1-CE2 4.05Å
574	G	92.3	Very high	91.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-55.3	-47.9	177.4	0	0	0	0	0	112.6	S570 R571 T576 V577 G578 V579 F605	S570-G574 PolarHBondContact O-N 3.25Å; S570-G574 VanDerWaalsContact O-N 3.15Å; R571-G574 PolarHBondContact O-N 3.28Å; R571-G574 VanDerWaalsContact O-N 3.17Å; G574-T576 PolarHBondContact O-N 3.38Å; G574-V577 PolarHBondContact O-N 3.4Å; G574-G578 PolarHBondContact O-N 3.46Å; G574-G578 VanDerWaalsContact O-N 3.17Å; G574-V579 VanDerWaalsContact O-CB 3.27Å; G574-V579 WeakPolarHBondContact O-CB 3.46Å; G574-V579 WeakPolarHBondContact O-CG2 3.35Å; G574-V579 PolarHBondContact O-N 3.46Å; G574-F605 VanDerWaalsContact CA-CE2 3.41Å
575	Q	92.4	Very high	90.9	Very high	119 Å²	119	52.1 Å²	52.1	56%	0.556	28%	0.282	S	S	*	.	H	α-helix	trans	-62.9	-42	177.3	-69.3	172.1	-7.2	0	0	112.5	W563 R571 K572 V573 V577 G578	W563-Q575 HydrophobicContact CH2-CG 4.44Å; R571-Q575 WeakPolarHBondContact O-CG 3.21Å; R571-Q575 PolarHBondContact O-N 3.31Å; K572-Q575 PolarHBondContact O-N 3.17Å; V573-Q575 VanDerWaalsContact C-N 3.34Å; V573-Q575 PolarHBondContact O-N 3.44Å; Q575-V577 VanDerWaalsContact C-N 3.3Å; Q575-V577 PolarHBondContact O-N 3.34Å; Q575-G578 PolarHBondContact O-N 3.42Å
576	T	89.8	Confident	90.5	Very high	71 Å²	71	51.9 Å²	51.9	44%	0.436	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-38.3	179.4	-56.1	0	0	0	0	111.8	V521 K572 V573 G574 G578	V521-T576 HydrophobicContact CG2-CG2 4.43Å; K572-T576 WeakPolarHBondContact O-CB 3.37Å; K572-T576 PolarHBondContact O-N 2.68Å; K572-T576 PolarHBondContact O-OG1 3.35Å; V573-T576 PolarHBondContact O-N 3.45Å; G574-T576 PolarHBondContact O-N 3.38Å; T576-G578 VanDerWaalsContact C-N 3.33Å
577	V	89	Confident	89.9	Confident	26 Å²	26	52.9 Å²	52.9	16%	0.158	28%	0.276	C	S	.	.	H	α-helix	trans	-77.1	-19	179.7	167.2	0	0	0	0	112.7	Y530 V573 G574 Q575 V601	Y530-V577 HydrophobicContact CD1-CG1 4.15Å; Y530-V577 HydrophobicContact CD1-CG2 3.74Å; Y530-V577 HydrophobicContact CD2-CG1 4.11Å; Y530-V577 HydrophobicContact CE1-CB 4.29Å; Y530-V577 HydrophobicContact CE1-CG1 3.48Å; Y530-V577 VanDerWaalsContact CE1-CG1 3.48Å; Y530-V577 HydrophobicContact CE1-CG2 3.78Å; Y530-V577 HydrophobicContact CE2-CG1 3.43Å; Y530-V577 VanDerWaalsContact CE2-CG1 3.43Å; Y530-V577 HydrophobicContact CG-CG1 4.44Å; Y530-V577 HydrophobicContact CG-CG2 4.14Å; Y530-V577 WeakPolarHBondContact OH-CG1 3.17Å; V573-V577 HydrophobicContact CG1-CG2 4.28Å; V573-V577 WeakPolarHBondContact O-CB 3.28Å; V573-V577 WeakPolarHBondContact O-CG2 3.46Å; V573-V577 PolarHBondContact O-N 2.97Å; G574-V577 PolarHBondContact O-N 3.4Å; Q575-V577 VanDerWaalsContact C-N 3.3Å; Q575-V577 PolarHBondContact O-N 3.34Å; V577-V601 HydrophobicContact CG1-CG1 3.93Å; V577-V601 WeakPolarHBondContact O-CG1 3.43Å
578	G	89	Confident	89.3	Confident	34 Å²	34	52 Å²	52	35%	0.351	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.3	25.5	179.1	0	0	0	0	0	115	G574 Q575 T576	G574-G578 PolarHBondContact O-N 3.46Å; G574-G578 VanDerWaalsContact O-N 3.17Å; Q575-G578 PolarHBondContact O-N 3.42Å; T576-G578 VanDerWaalsContact C-N 3.33Å
579	V	91.5	Very high	88.7	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.042	26%	0.257	C	S	.	.			trans	-76.3	120.8	167.7	-177.3	0	0	0	0	109	W563 G574 F605	W563-V579 HydrophobicContact CE3-CG1 3.89Å; W563-V579 HydrophobicContact CH2-CB 3.97Å; W563-V579 HydrophobicContact CH2-CG1 3.67Å; W563-V579 HydrophobicContact CZ2-CG1 4.4Å; W563-V579 HydrophobicContact CZ3-CB 3.89Å; W563-V579 HydrophobicContact CZ3-CG1 3.38Å; G574-V579 VanDerWaalsContact O-CB 3.27Å; G574-V579 WeakPolarHBondContact O-CB 3.46Å; G574-V579 WeakPolarHBondContact O-CG2 3.35Å; G574-V579 PolarHBondContact O-N 3.46Å; V579-F605 HydrophobicContact CG2-CB 3.58Å; V579-F605 HydrophobicContact CG2-CD1 3.64Å; V579-F605 HydrophobicContact CG2-CD2 4.18Å; V579-F605 HydrophobicContact CG2-CE1 4.34Å; V579-F605 HydrophobicContact CG2-CG 3.53Å
580	E	90.4	Very high	87.5	Confident	73 Å²	73	52 Å²	52	34%	0.341	29%	0.289	S	S	.	.			trans	-109.7	122.7	-178.1	-69.1	176.6	-170.6	0	0	109.9	S582 Y583 L584 K598 H602	E580-S582 PolarHBondContact O-N 2.66Å; E580-Y583 WeakPolarHBondContact O-CB 3.44Å; E580-Y583 PolarHBondContact O-N 3.11Å; E580-L584 PolarHBondContact O-N 3.46Å; E580-K598 WeakPolarHBondContact OE1-CE 3.39Å; E580-K598 IonicContact OE1-NZ 2.62Å; E580-K598 PolarHBondContact OE1-NZ 3.45Å; E580-K598 IonicContact OE2-NZ 2.65Å; E580-K598 PolarHBondContact OE2-NZ 3.09Å; E580-H602 PolarHBondContact N-NE2 3.21Å; E580-H602 PolarHBondContact O-NE2 3.16Å
581	E	89.6	Confident	85.7	Confident	92 Å²	92	60.9 Å²	60.9	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-60	-36.5	177.4	-171.4	166	151.4	0	0	112.2	F560 W563 Y583 L584 V585	F560-E581 HydrophobicContact CE2-CG 4.23Å; W563-E581 PolarHBondContact NE1-OE2 3.17Å; W563-E581 VanDerWaalsContact NE1-OE2 3.12Å; E581-Y583 PolarHBondContact O-N 2.93Å; E581-L584 PolarHBondContact O-N 3.06Å; E581-L584 VanDerWaalsContact O-N 3.17Å; E581-V585 WeakPolarHBondContact O-CG2 3.45Å; E581-V585 PolarHBondContact O-N 3.28Å; E581-V585 VanDerWaalsContact O-N 3.11Å
582	S	88.7	Confident	83.9	Confident	81 Å²	81	59.6 Å²	59.6	57%	0.566	33%	0.333	S	S	*	.	H	α-helix	trans	-57.6	-36	174.8	49.8	0	0	0	0	113.1	E580 E586	E580-S582 PolarHBondContact O-N 2.66Å; S582-E586 WeakPolarHBondContact O-CB 3.1Å; S582-E586 PolarHBondContact O-N 2.84Å
583	Y	87.6	Confident	82.4	Confident	3 Å²	3	65.8 Å²	65.8	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-73.9	-35.3	179.3	-179.2	-96.8	0	0	0	112.1	W556 E580 E581 E586 K587 K598 R599 H602	W556-Y583 HydrophobicContact CH2-CE1 4.47Å; E580-Y583 WeakPolarHBondContact O-CB 3.44Å; E580-Y583 PolarHBondContact O-N 3.11Å; E581-Y583 PolarHBondContact O-N 2.93Å; Y583-E586 PolarHBondContact O-N 3.38Å; Y583-K587 HydrophobicContact CE1-CG 4.09Å; Y583-K587 VanDerWaalsContact CZ-CE 3.44Å; Y583-K587 WeakPolarHBondContact O-CG 3.35Å; Y583-K587 PolarHBondContact O-N 3.44Å; Y583-K587 VanDerWaalsContact O-N 3.15Å; Y583-K587 WeakPolarHBondContact OH-CE 3.43Å; Y583-K598 HydrophobicContact CD2-CB 4.21Å; Y583-K598 HydrophobicContact CD2-CD 4.17Å; Y583-K598 HydrophobicContact CE2-CB 3.98Å; Y583-R599 WeakPolarHBondContact OH-CA 3.45Å; Y583-R599 WeakPolarHBondContact OH-CB 3.38Å; Y583-H602 HydrophobicContact CD1-CB 4.43Å; Y583-H602 AromaticContact CD1-CD2 3.5Å; Y583-H602 VanDerWaalsContact CD1-CD2 3.5Å; Y583-H602 WeakPolarHBondContact CD1-CD2 3.22Å; Y583-H602 AromaticContact CD1-CE1 3.54Å; Y583-H602 AromaticContact CD1-CG 3.6Å; Y583-H602 AromaticContact CD1-ND1 3.62Å; Y583-H602 AromaticContact CD1-NE2 3.45Å; Y583-H602 WeakPolarHBondContact CD1-NE2 3.48Å; Y583-H602 HydrophobicContact CE1-CB 4.27Å; Y583-H602 AromaticContact CE1-CG 3.87Å; Y583-H602 AromaticContact CE1-ND1 3.93Å; Y583-H602 AromaticContact CG-CE1 3.91Å; Y583-H602 AromaticContact CG-NE2 3.92Å
584	L	87.4	Confident	81	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-62.9	-44.8	173.4	-64.6	177.4	0	0	0	110.9	W556 Y559 F560 W563 E580 E581 K587 L588	W556-L584 HydrophobicContact CE3-CD2 4.19Å; W556-L584 HydrophobicContact CZ3-CD2 4.18Å; Y559-L584 HydrophobicContact CD1-CD2 3.72Å; Y559-L584 HydrophobicContact CE1-CD2 3.7Å; Y559-L584 HydrophobicContact CE2-CD2 4.5Å; Y559-L584 HydrophobicContact CG-CD2 4.17Å; F560-L584 HydrophobicContact CD2-CB 3.95Å; F560-L584 HydrophobicContact CD2-CD1 4.45Å; W563-L584 HydrophobicContact CB-CD1 3.9Å; W563-L584 HydrophobicContact CD2-CD1 3.98Å; W563-L584 HydrophobicContact CE3-CD1 4.46Å; W563-L584 HydrophobicContact CG-CD1 3.7Å; E580-L584 PolarHBondContact O-N 3.46Å; E581-L584 PolarHBondContact O-N 3.06Å; E581-L584 VanDerWaalsContact O-N 3.17Å; L584-K587 PolarHBondContact O-N 2.83Å; L584-L588 WeakPolarHBondContact O-CG 3.46Å; L584-L588 PolarHBondContact O-N 3.45Å; L584-L588 VanDerWaalsContact O-N 3.11Å
585	V	86.2	Confident	80.1	Confident	60 Å²	60	80.7 Å²	80.7	36%	0.364	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-43	177.2	178.1	0	0	0	0	111.7	F560 E581 K587 L588 C589	F560-V585 HydrophobicContact CD2-CG2 4.39Å; F560-V585 HydrophobicContact CE2-CG2 3.61Å; F560-V585 HydrophobicContact CZ-CG2 4Å; E581-V585 WeakPolarHBondContact O-CG2 3.45Å; E581-V585 PolarHBondContact O-N 3.28Å; E581-V585 VanDerWaalsContact O-N 3.11Å; V585-K587 VanDerWaalsContact C-N 3.27Å; V585-K587 PolarHBondContact O-N 3.42Å; V585-L588 WeakPolarHBondContact O-CB 3.46Å; V585-L588 PolarHBondContact O-N 2.88Å; V585-L588 VanDerWaalsContact O-N 3.13Å; V585-C589 PolarHBondContact O-N 2.97Å; V585-C589 VanDerWaalsContact O-N 3.14Å
586	E	83.9	Confident	79.1	Confident	66 Å²	66	79 Å²	79	31%	0.308	41%	0.413	S	S	.	.	H	α-helix	trans	-53.4	-45.1	174.3	176.8	-178.8	176.5	0	0	111.2	S582 Y583 C589 S590 Y591 G592	S582-E586 WeakPolarHBondContact O-CB 3.1Å; S582-E586 PolarHBondContact O-N 2.84Å; Y583-E586 PolarHBondContact O-N 3.38Å; E586-C589 PolarHBondContact O-N 3.39Å; E586-S590 PolarHBondContact O-N 3.32Å; E586-Y591 CarbonylContact C-O 3.52Å; E586-Y591 WeakPolarHBondContact CG-O 3.44Å; E586-Y591 PolarHBondContact O-N 2.97Å; E586-G592 WeakPolarHBondContact OE1-CA 3.35Å
587	K	82	Confident	78.4	Confident	40 Å²	40	83.9 Å²	83.9	17%	0.174	42%	0.423	C	S	.	.	H	α-helix	trans	-69.7	-31.5	178.4	-68.3	-65.6	167.6	-136.7	0	114.3	W556 Y583 L584 V585 S590	W556-K587 HydrophobicContact CB-CB 4.34Å; W556-K587 HydrophobicContact CD2-CB 3.71Å; W556-K587 HydrophobicContact CD2-CG 4.16Å; W556-K587 HydrophobicContact CE3-CB 4.03Å; W556-K587 HydrophobicContact CE3-CG 4.28Å; W556-K587 HydrophobicContact CG-CB 3.84Å; W556-K587 HydrophobicContact CH2-CG 4.46Å; W556-K587 HydrophobicContact CZ2-CD 4.5Å; W556-K587 HydrophobicContact CZ2-CG 4.32Å; W556-K587 HydrophobicContact CZ3-CG 4.43Å; Y583-K587 HydrophobicContact CE1-CG 4.09Å; Y583-K587 VanDerWaalsContact CZ-CE 3.44Å; Y583-K587 WeakPolarHBondContact O-CG 3.35Å; Y583-K587 PolarHBondContact O-N 3.44Å; Y583-K587 VanDerWaalsContact O-N 3.15Å; Y583-K587 WeakPolarHBondContact OH-CE 3.43Å; L584-K587 PolarHBondContact O-N 2.83Å; V585-K587 VanDerWaalsContact C-N 3.27Å; V585-K587 PolarHBondContact O-N 3.42Å; K587-S590 PolarHBondContact O-N 3.23Å
588	L	81	Confident	78	Confident	63 Å²	63	86 Å²	86	33%	0.33	43%	0.431	S	S	.	.	H	α-helix	trans	-63.5	-44.2	173.2	-70.5	174.3	0	0	0	112	W556 A557 F560 L584 V585 S590	W556-L588 HydrophobicContact CB-CD2 4.04Å; A557-L588 HydrophobicContact CB-CD2 3.95Å; F560-L588 HydrophobicContact CB-CD1 3.78Å; F560-L588 HydrophobicContact CB-CD2 4.37Å; F560-L588 HydrophobicContact CB-CG 4.42Å; F560-L588 HydrophobicContact CD1-CD1 3.68Å; F560-L588 HydrophobicContact CD2-CD1 4.05Å; F560-L588 HydrophobicContact CE1-CD1 4.22Å; F560-L588 HydrophobicContact CG-CD1 3.57Å; L584-L588 WeakPolarHBondContact O-CG 3.46Å; L584-L588 PolarHBondContact O-N 3.45Å; L584-L588 VanDerWaalsContact O-N 3.11Å; V585-L588 WeakPolarHBondContact O-CB 3.46Å; V585-L588 PolarHBondContact O-N 2.88Å; V585-L588 VanDerWaalsContact O-N 3.13Å; L588-S590 PolarHBondContact O-N 3.26Å; L588-S590 VanDerWaalsContact O-N 3.17Å
589	C	77.6	Confident	77.6	Confident	75 Å²	75	88.9 Å²	88.9	51%	0.507	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	0.1	-179.2	-60.1	0	0	0	0	113	V585 E586 Y591	V585-C589 PolarHBondContact O-N 2.97Å; V585-C589 VanDerWaalsContact O-N 3.14Å; E586-C589 PolarHBondContact O-N 3.39Å; C589-Y591 HydrophobicContact CB-CD2 3.93Å; C589-Y591 VanDerWaalsContact O-CD2 3.22Å; C589-Y591 WeakPolarHBondContact O-CD2 3.48Å; C589-Y591 PolarHBondContact O-N 3.48Å
590	S	67.4	Low	76.9	Confident	115 Å²	115	90.2 Å²	90.2	80%	0.804	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	16.7	-171.9	-63.6	0	0	0	0	114.4	E586 K587 L588	E586-S590 PolarHBondContact O-N 3.32Å; K587-S590 PolarHBondContact O-N 3.23Å; L588-S590 PolarHBondContact O-N 3.26Å; L588-S590 VanDerWaalsContact O-N 3.17Å
591	Y	56.5	Low	76.6	Confident	186 Å²	186	88.4 Å²	88.4	73%	0.729	43%	0.431	S	S	*	.			trans	-86.1	156	169.5	-81.2	-89	0	0	0	109	E586 C589	E586-Y591 CarbonylContact C-O 3.52Å; E586-Y591 WeakPolarHBondContact CG-O 3.44Å; E586-Y591 PolarHBondContact O-N 2.97Å; C589-Y591 HydrophobicContact CB-CD2 3.93Å; C589-Y591 VanDerWaalsContact O-CD2 3.22Å; C589-Y591 WeakPolarHBondContact O-CD2 3.48Å; C589-Y591 PolarHBondContact O-N 3.48Å
592	G	55.4	Low	76.5	Confident	46 Å²	46	84 Å²	84	47%	0.474	41%	0.41	S	S	.	.			trans	127.4	145.8	163	0	0	0	0	0	118.2	E586	E586-G592 WeakPolarHBondContact OE1-CA 3.35Å
593	R	59.5	Low	76.3	Confident	223 Å²	223	80.7 Å²	80.7	84%	0.842	39%	0.386	S	S	*	.			trans	-66.4	149.9	173.4	-70	-178.6	-176	172.9	2.1	109.7	N595	R593-N595 VanDerWaalsContact C-N 3.26Å; R593-N595 PolarHBondContact O-N 3.22Å
594	R	64.4	Low	76.2	Confident	243 Å²	243	81.4 Å²	81.4	92%	0.917	39%	0.389	S	S	*	.			trans	-73	81.7	171.7	-70.1	-176.9	179.5	177	0.1	109.4	V596	R594-V596 PolarHBondContact O-N 3.03Å
595	N	72.9	Confident	76.4	Confident	70 Å²	70	81.4 Å²	81.4	37%	0.374	39%	0.388	S	S	.	.			trans	-84.8	98.6	170.4	-167.5	-26.7	0	0	0	109.4	R593 R597 K598 R599	R593-N595 VanDerWaalsContact C-N 3.26Å; R593-N595 PolarHBondContact O-N 3.22Å; N595-R597 PolarHBondContact OD1-N 3.06Å; N595-K598 HydrophobicContact CB-CB 4.11Å; N595-K598 HydrophobicContact CB-CG 4.43Å; N595-K598 PolarHBondContact OD1-N 3.21Å; N595-R599 WeakPolarHBondContact O-CB 3.42Å; N595-R599 PolarHBondContact O-N 3.36Å
596	V	72.1	Confident	76.5	Confident	85 Å²	85	78.7 Å²	78.7	52%	0.515	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-47.5	-174.6	173.4	0	0	0	0	111.2	R594 R599 E600	R594-V596 PolarHBondContact O-N 3.03Å; V596-R599 WeakPolarHBondContact O-CB 3.5Å; V596-R599 PolarHBondContact O-N 2.91Å; V596-E600 WeakPolarHBondContact CG1-OE1 3.4Å; V596-E600 WeakPolarHBondContact O-CG 3.5Å; V596-E600 PolarHBondContact O-N 3.06Å
597	R	75.5	Confident	76.7	Confident	172 Å²	172	75.9 Å²	75.9	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-65.2	-43.4	-179	-162.3	178	-173.8	172	2.1	112.8	N595 R599 E600 V601	N595-R597 PolarHBondContact OD1-N 3.06Å; R597-R599 VanDerWaalsContact C-N 3.34Å; R597-R599 PolarHBondContact O-N 3.25Å; R597-E600 PolarHBondContact O-N 3.01Å; R597-V601 PolarHBondContact O-N 2.88Å
598	K	80.5	Confident	77.2	Confident	72 Å²	72	74 Å²	74	31%	0.313	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-43.8	174.8	-76.2	-167.4	177.2	-162.9	0	111	E580 Y583 N595 E600 V601 H602	E580-K598 WeakPolarHBondContact OE1-CE 3.39Å; E580-K598 IonicContact OE1-NZ 2.62Å; E580-K598 PolarHBondContact OE1-NZ 3.45Å; E580-K598 IonicContact OE2-NZ 2.65Å; E580-K598 PolarHBondContact OE2-NZ 3.09Å; Y583-K598 HydrophobicContact CD2-CB 4.21Å; Y583-K598 HydrophobicContact CD2-CD 4.17Å; Y583-K598 HydrophobicContact CE2-CB 3.98Å; N595-K598 HydrophobicContact CB-CB 4.11Å; N595-K598 HydrophobicContact CB-CG 4.43Å; N595-K598 PolarHBondContact OD1-N 3.21Å; K598-E600 VanDerWaalsContact C-N 3.3Å; K598-E600 PolarHBondContact O-N 3.35Å; K598-V601 PolarHBondContact O-N 3.25Å; K598-H602 PolarHBondContact O-N 3.11Å; K598-H602 PolarHBondContact O-ND1 3.02Å
599	R	79	Confident	77.8	Confident	94 Å²	94	71.1 Å²	71.1	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-56.7	-44.9	176.7	-171	-180	176.4	-161	-4.9	111.5	Y583 N595 V596 R597 H602 L603	Y583-R599 WeakPolarHBondContact OH-CA 3.45Å; Y583-R599 WeakPolarHBondContact OH-CB 3.38Å; N595-R599 WeakPolarHBondContact O-CB 3.42Å; N595-R599 PolarHBondContact O-N 3.36Å; V596-R599 WeakPolarHBondContact O-CB 3.5Å; V596-R599 PolarHBondContact O-N 2.91Å; R597-R599 VanDerWaalsContact C-N 3.34Å; R597-R599 PolarHBondContact O-N 3.25Å; R599-H602 PolarHBondContact O-N 3.43Å; R599-L603 HydrophobicContact CG-CD1 3.85Å; R599-L603 HydrophobicContact CG-CG 4.15Å; R599-L603 WeakPolarHBondContact O-CB 3.35Å; R599-L603 WeakPolarHBondContact O-CG 3.42Å; R599-L603 PolarHBondContact O-N 3.36Å
600	E	77.7	Confident	78.4	Confident	35 Å²	35	67.8 Å²	67.8	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-49.3	-179.8	-72	157	-166.5	0	0	112.8	Y536 V596 R597 K598 H602 L603 R604	Y536-E600 HydrophobicContact CD1-CG 3.77Å; Y536-E600 WeakPolarHBondContact CD1-OE1 3.44Å; Y536-E600 HydrophobicContact CE1-CG 4.32Å; Y536-E600 WeakPolarHBondContact CE1-OE1 3.41Å; Y536-E600 HydrophobicContact CG-CG 4.09Å; V596-E600 WeakPolarHBondContact CG1-OE1 3.4Å; V596-E600 WeakPolarHBondContact O-CG 3.5Å; V596-E600 PolarHBondContact O-N 3.06Å; R597-E600 PolarHBondContact O-N 3.01Å; K598-E600 VanDerWaalsContact C-N 3.3Å; K598-E600 PolarHBondContact O-N 3.35Å; E600-H602 VanDerWaalsContact C-N 3.31Å; E600-H602 PolarHBondContact O-N 2.89Å; E600-L603 PolarHBondContact O-N 2.88Å; E600-R604 WeakPolarHBondContact O-CB 3.36Å; E600-R604 PolarHBondContact O-N 3.47Å
601	V	84.7	Confident	79.6	Confident	35 Å²	35	62.3 Å²	62.3	21%	0.212	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-45.6	178.6	175.7	0	0	0	0	110.7	V577 R597 K598 R604 F605	V577-V601 HydrophobicContact CG1-CG1 3.93Å; V577-V601 WeakPolarHBondContact O-CG1 3.43Å; R597-V601 PolarHBondContact O-N 2.88Å; K598-V601 PolarHBondContact O-N 3.25Å; V601-R604 PolarHBondContact O-N 3.14Å; V601-F605 WeakPolarHBondContact O-CB 2.99Å; V601-F605 PolarHBondContact O-N 3.27Å
602	H	87.6	Confident	81.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-39.6	-179.7	-71.2	70.7	0	0	0	112.4	Y559 E580 Y583 K598 R599 E600 F606	Y559-H602 HydrophobicContact CE1-CB 4.27Å; Y559-H602 WeakPolarHBondContact CE1-O 3.3Å; Y559-H602 PolarHBondContact OH-O 2.72Å; E580-H602 PolarHBondContact N-NE2 3.21Å; E580-H602 PolarHBondContact O-NE2 3.16Å; Y583-H602 HydrophobicContact CD1-CB 4.43Å; Y583-H602 AromaticContact CD1-CD2 3.5Å; Y583-H602 VanDerWaalsContact CD1-CD2 3.5Å; Y583-H602 WeakPolarHBondContact CD1-CD2 3.22Å; Y583-H602 AromaticContact CD1-CE1 3.54Å; Y583-H602 AromaticContact CD1-CG 3.6Å; Y583-H602 AromaticContact CD1-ND1 3.62Å; Y583-H602 AromaticContact CD1-NE2 3.45Å; Y583-H602 WeakPolarHBondContact CD1-NE2 3.48Å; Y583-H602 HydrophobicContact CE1-CB 4.27Å; Y583-H602 AromaticContact CE1-CG 3.87Å; Y583-H602 AromaticContact CE1-ND1 3.93Å; Y583-H602 AromaticContact CG-CE1 3.91Å; Y583-H602 AromaticContact CG-NE2 3.92Å; K598-H602 PolarHBondContact O-N 3.11Å; K598-H602 PolarHBondContact O-ND1 3.02Å; R599-H602 PolarHBondContact O-N 3.43Å; E600-H602 VanDerWaalsContact C-N 3.31Å; E600-H602 PolarHBondContact O-N 2.89Å; H602-F606 WeakPolarHBondContact O-CB 3.43Å; H602-F606 PolarHBondContact O-N 3.49Å
603	L	83	Confident	83.3	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.052	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-42.8	177.1	-71.3	-179	0	0	0	111.6	L547 A551 I554 W556 R599 E600 F605 F606 V607	L547-L603 HydrophobicContact CD2-CB 4.23Å; L547-L603 HydrophobicContact CD2-CD2 4.47Å; A551-L603 HydrophobicContact CB-CD1 3.97Å; A551-L603 HydrophobicContact CB-CD2 3.95Å; I554-L603 HydrophobicContact CD1-CD2 3.14Å; W556-L603 HydrophobicContact CH2-CD2 4.22Å; R599-L603 HydrophobicContact CG-CD1 3.85Å; R599-L603 HydrophobicContact CG-CG 4.15Å; R599-L603 WeakPolarHBondContact O-CB 3.35Å; R599-L603 WeakPolarHBondContact O-CG 3.42Å; R599-L603 PolarHBondContact O-N 3.36Å; E600-L603 PolarHBondContact O-N 2.88Å; L603-F605 VanDerWaalsContact C-N 3.34Å; L603-F605 PolarHBondContact O-N 3.05Å; L603-F606 WeakPolarHBondContact O-CB 3.47Å; L603-F606 PolarHBondContact O-N 3.04Å; L603-V607 VanDerWaalsContact O-CG2 3.3Å; L603-V607 WeakPolarHBondContact O-CG2 3.14Å; L603-V607 PolarHBondContact O-N 3.12Å
604	R	86.8	Confident	85	Confident	19 Å²	19	43 Å²	43	7%	0.072	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-42.7	176.6	-173.9	179.7	170.3	-170.9	3.2	111	D512 Y530 L531 T533 S535 E600 V601 V607 A608	D512-R604 IonicContact OD1-NH1 3.73Å; D512-R604 IonicContact OD2-CZ 3.03Å; D512-R604 IonicContact OD2-NH1 3.85Å; D512-R604 PolarHBondContact OD2-NH1 3.25Å; D512-R604 IonicContact OD2-NH2 3.24Å; D512-R604 PolarHBondContact OD2-NH2 3.1Å; Y530-R604 HydrophobicContact CD2-CG 4.04Å; Y530-R604 HydrophobicContact CE2-CB 3.92Å; Y530-R604 HydrophobicContact CE2-CG 3.46Å; Y530-R604 VanDerWaalsContact CE2-CG 3.46Å; Y530-R604 PolarHBondContact O-NE 3.36Å; Y530-R604 PolarHBondContact O-NH2 2.94Å; Y530-R604 WeakPolarHBondContact OH-CD 3.4Å; Y530-R604 PolarHBondContact OH-NH1 3.39Å; L531-R604 PolarHBondContact O-NH2 3.44Å; T533-R604 HydrophobicContact CG2-CG 4.03Å; T533-R604 PolarHBondContact O-NE 3.37Å; T533-R604 PolarHBondContact O-NH2 2.9Å; S535-R604 PolarHBondContact OG-NH1 3.29Å; S535-R604 VanDerWaalsContact OG-NH1 3.17Å; E600-R604 WeakPolarHBondContact O-CB 3.36Å; E600-R604 PolarHBondContact O-N 3.47Å; V601-R604 PolarHBondContact O-N 3.14Å; R604-V607 PolarHBondContact O-N 3.2Å; R604-A608 WeakPolarHBondContact O-CB 3.35Å; R604-A608 PolarHBondContact O-N 3.37Å
605	F	90.9	Very high	86.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-41.3	175.5	-171.8	-105.4	0	0	0	112.4	L526 Y530 Y559 W563 L566 V573 G574 V579 V601 L603 V607 A608 L609	L526-F605 HydrophobicContact CD2-CE2 3.97Å; L526-F605 HydrophobicContact CD2-CZ 3.94Å; L526-F605 HydrophobicContact CG-CE2 4.37Å; Y530-F605 HydrophobicContact CD2-CD2 4.31Å; Y530-F605 HydrophobicContact CE2-CB 4.45Å; Y559-F605 WeakPolarHBondContact OH-CD1 3.47Å; W563-F605 HydrophobicContact CE3-CE1 4.16Å; W563-F605 HydrophobicContact CZ3-CD1 4.44Å; W563-F605 AromaticContact CZ3-CE1 3.79Å; W563-F605 HydrophobicContact CZ3-CE1 3.79Å; W563-F605 HydrophobicContact CZ3-CZ 4.46Å; L566-F605 HydrophobicContact CD1-CE1 4.12Å; L566-F605 HydrophobicContact CD1-CZ 4.45Å; V573-F605 HydrophobicContact CB-CE2 4.4Å; V573-F605 HydrophobicContact CG1-CE2 4.05Å; G574-F605 VanDerWaalsContact CA-CE2 3.41Å; V579-F605 HydrophobicContact CG2-CB 3.58Å; V579-F605 HydrophobicContact CG2-CD1 3.64Å; V579-F605 HydrophobicContact CG2-CD2 4.18Å; V579-F605 HydrophobicContact CG2-CE1 4.34Å; V579-F605 HydrophobicContact CG2-CG 3.53Å; V601-F605 WeakPolarHBondContact O-CB 2.99Å; V601-F605 PolarHBondContact O-N 3.27Å; L603-F605 VanDerWaalsContact C-N 3.34Å; L603-F605 PolarHBondContact O-N 3.05Å; F605-V607 VanDerWaalsContact C-N 3.3Å; F605-V607 PolarHBondContact O-N 2.67Å; F605-A608 WeakPolarHBondContact O-CB 3.45Å; F605-A608 PolarHBondContact O-N 3.09Å; F605-L609 HydrophobicContact CD1-CD1 3.92Å; F605-L609 HydrophobicContact CD1-CG 4.21Å; F605-L609 HydrophobicContact CE1-CD1 3.67Å; F605-L609 HydrophobicContact CE1-CD2 4.15Å; F605-L609 HydrophobicContact CE1-CG 3.93Å; F605-L609 HydrophobicContact CZ-CD1 4.43Å; F605-L609 HydrophobicContact CZ-CD2 4.1Å; F605-L609 HydrophobicContact CZ-CG 4.24Å; F605-L609 WeakPolarHBondContact O-CG 3.16Å; F605-L609 PolarHBondContact O-N 3.15Å
606	F	89.3	Confident	87.4	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.013	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-41.8	175.3	-174.2	-109.1	0	0	0	112.5	L550 I554 Y559 I562 H602 L603 L609 A610 F627	L550-F606 HydrophobicContact CD2-CD1 3.85Å; L550-F606 HydrophobicContact CD2-CE1 3.71Å; I554-F606 HydrophobicContact CD1-CD1 3.87Å; I554-F606 HydrophobicContact CD1-CE1 4.13Å; I554-F606 HydrophobicContact CG1-CD1 4.15Å; I554-F606 HydrophobicContact CG1-CE1 3.88Å; I554-F606 HydrophobicContact CG2-CE1 4.48Å; Y559-F606 HydrophobicContact CD1-CB 4.23Å; Y559-F606 AromaticContact CD1-CD2 3.81Å; Y559-F606 HydrophobicContact CD1-CD2 3.81Å; Y559-F606 HydrophobicContact CD1-CE2 4.45Å; Y559-F606 HydrophobicContact CD1-CG 4.2Å; Y559-F606 AromaticContact CD2-CD2 3.42Å; Y559-F606 HydrophobicContact CD2-CD2 3.42Å; Y559-F606 VanDerWaalsContact CD2-CD2 3.42Å; Y559-F606 AromaticContact CD2-CE2 3.95Å; Y559-F606 HydrophobicContact CD2-CE2 3.95Å; Y559-F606 HydrophobicContact CD2-CG 4.43Å; Y559-F606 HydrophobicContact CE1-CB 3.75Å; Y559-F606 HydrophobicContact CE1-CD2 4.08Å; Y559-F606 HydrophobicContact CE1-CG 4.22Å; Y559-F606 HydrophobicContact CE2-CB 4.26Å; Y559-F606 AromaticContact CE2-CD2 3.78Å; Y559-F606 HydrophobicContact CE2-CD2 3.78Å; Y559-F606 AromaticContact CG-CD2 3.47Å; Y559-F606 HydrophobicContact CG-CD2 3.47Å; Y559-F606 VanDerWaalsContact CG-CD2 3.47Å; Y559-F606 AromaticContact CG-CE2 3.84Å; Y559-F606 HydrophobicContact CG-CE2 3.84Å; Y559-F606 HydrophobicContact CG-CG 4.31Å; I562-F606 HydrophobicContact CD1-CE2 4.05Å; H602-F606 WeakPolarHBondContact O-CB 3.43Å; H602-F606 PolarHBondContact O-N 3.49Å; L603-F606 WeakPolarHBondContact O-CB 3.47Å; L603-F606 PolarHBondContact O-N 3.04Å; F606-L609 PolarHBondContact O-N 3.17Å; F606-A610 PolarHBondContact O-N 3.1Å; F606-F627 HydrophobicContact CD2-CD1 4.27Å; F606-F627 HydrophobicContact CD2-CE1 4.27Å; F606-F627 AromaticContact CE1-CD1 3.92Å; F606-F627 HydrophobicContact CE1-CD1 3.92Å; F606-F627 AromaticContact CE2-CD1 3.67Å; F606-F627 HydrophobicContact CE2-CD1 3.67Å; F606-F627 AromaticContact CE2-CE1 3.99Å; F606-F627 HydrophobicContact CE2-CE1 3.99Å; F606-F627 HydrophobicContact CZ-CB 4.39Å; F606-F627 AromaticContact CZ-CD1 3.49Å; F606-F627 HydrophobicContact CZ-CD1 3.49Å; F606-F627 VanDerWaalsContact CZ-CD1 3.49Å; F606-F627 HydrophobicContact CZ-CE1 4.26Å; F606-F627 HydrophobicContact CZ-CG 4.38Å
607	V	87.6	Confident	88.3	Confident	7 Å²	7	29.6 Å²	29.6	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-66.5	-43.6	175.3	169.2	0	0	0	0	111.4	T533 L547 L603 R604 F605 L609 A610 L611 L637	T533-V607 HydrophobicContact CG2-CB 4.2Å; T533-V607 HydrophobicContact CG2-CG1 3.59Å; L547-V607 HydrophobicContact CD1-CG2 3.41Å; L547-V607 VanDerWaalsContact CD1-CG2 3.41Å; L547-V607 HydrophobicContact CD2-CG2 3.47Å; L547-V607 VanDerWaalsContact CD2-CG2 3.47Å; L547-V607 HydrophobicContact CG-CG2 3.94Å; L603-V607 VanDerWaalsContact O-CG2 3.3Å; L603-V607 WeakPolarHBondContact O-CG2 3.14Å; L603-V607 PolarHBondContact O-N 3.12Å; R604-V607 PolarHBondContact O-N 3.2Å; F605-V607 VanDerWaalsContact C-N 3.3Å; F605-V607 PolarHBondContact O-N 2.67Å; V607-L609 VanDerWaalsContact C-N 3.27Å; V607-L609 PolarHBondContact O-N 3.45Å; V607-A610 PolarHBondContact O-N 2.62Å; V607-A610 VanDerWaalsContact O-N 3.13Å; V607-L611 HydrophobicContact CG1-CD1 4.03Å; V607-L611 HydrophobicContact CG1-CG 4.45Å; V607-L611 WeakPolarHBondContact O-CG 3.33Å; V607-L611 PolarHBondContact O-N 3.4Å; V607-L637 HydrophobicContact CG1-CD1 3.94Å; V607-L637 HydrophobicContact CG1-CD2 3.92Å; V607-L637 HydrophobicContact CG1-CG 4.34Å
608	A	91.8	Very high	89.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.1	-38	176.8	0	0	0	0	0	111.5	L526 V529 Y530 T533 R604 F605 A610 L611 F612	L526-A608 HydrophobicContact CD1-CB 4.45Å; V529-A608 HydrophobicContact CG1-CB 4.44Å; Y530-A608 HydrophobicContact CD2-CB 4.02Å; T533-A608 HydrophobicContact CG2-CB 4.49Å; R604-A608 WeakPolarHBondContact O-CB 3.35Å; R604-A608 PolarHBondContact O-N 3.37Å; F605-A608 WeakPolarHBondContact O-CB 3.45Å; F605-A608 PolarHBondContact O-N 3.09Å; A608-A610 PolarHBondContact O-N 2.95Å; A608-L611 PolarHBondContact O-N 3.37Å; A608-F612 WeakPolarHBondContact O-CB 3.06Å; A608-F612 PolarHBondContact O-N 3.31Å
609	L	92.9	Very high	89.6	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-41.6	173.7	-72.8	172.1	0	0	0	112.6	L526 Y559 I562 L566 F605 F606 V607 F612 Q613 F627	L526-L609 HydrophobicContact CD1-CD2 3.93Å; L526-L609 HydrophobicContact CD2-CD2 3.75Å; Y559-L609 HydrophobicContact CE2-CD1 4.39Å; I562-L609 HydrophobicContact CG2-CD1 4.22Å; L566-L609 HydrophobicContact CD1-CD1 4.25Å; L566-L609 HydrophobicContact CD1-CD2 4.25Å; L566-L609 HydrophobicContact CD2-CD1 4.4Å; L566-L609 HydrophobicContact CD2-CD2 3.74Å; F605-L609 HydrophobicContact CD1-CD1 3.92Å; F605-L609 HydrophobicContact CD1-CG 4.21Å; F605-L609 HydrophobicContact CE1-CD1 3.67Å; F605-L609 HydrophobicContact CE1-CD2 4.15Å; F605-L609 HydrophobicContact CE1-CG 3.93Å; F605-L609 HydrophobicContact CZ-CD1 4.43Å; F605-L609 HydrophobicContact CZ-CD2 4.1Å; F605-L609 HydrophobicContact CZ-CG 4.24Å; F605-L609 WeakPolarHBondContact O-CG 3.16Å; F605-L609 PolarHBondContact O-N 3.15Å; F606-L609 PolarHBondContact O-N 3.17Å; V607-L609 VanDerWaalsContact C-N 3.27Å; V607-L609 PolarHBondContact O-N 3.45Å; L609-F612 PolarHBondContact O-N 3.04Å; L609-Q613 PolarHBondContact O-N 3.14Å; L609-Q613 VanDerWaalsContact O-N 3.15Å; L609-F627 HydrophobicContact CB-CE1 3.95Å; L609-F627 HydrophobicContact CB-CZ 3.94Å
610	A	91	Very high	90	Very high	5 Å²	5	20.2 Å²	20.2	4%	0.041	11%	0.107	C	C	.	.	H	α-helix	trans	-66.4	-44.5	177.3	0	0	0	0	0	111.4	F606 V607 A608 Q613 L614 V623 F627 L634	F606-A610 PolarHBondContact O-N 3.1Å; V607-A610 PolarHBondContact O-N 2.62Å; V607-A610 VanDerWaalsContact O-N 3.13Å; A608-A610 PolarHBondContact O-N 2.95Å; A610-Q613 PolarHBondContact O-N 3.41Å; A610-L614 PolarHBondContact O-N 3.11Å; A610-V623 HydrophobicContact CB-CG1 4.21Å; A610-F627 HydrophobicContact CB-CD1 3.88Å; A610-F627 HydrophobicContact CB-CD2 4.15Å; A610-F627 HydrophobicContact CB-CE1 3.87Å; A610-F627 HydrophobicContact CB-CE2 4.13Å; A610-F627 HydrophobicContact CB-CG 4.03Å; A610-F627 HydrophobicContact CB-CZ 4Å; A610-L634 HydrophobicContact CB-CD1 4.28Å
611	L	92.8	Very high	90.4	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-65.3	-38	176.2	-69.7	174.6	0	0	0	112.2	V529 T533 V607 A608 Q613 L614 V615 L637 Q638 A641 L671	V529-L611 HydrophobicContact CG1-CB 3.77Å; T533-L611 HydrophobicContact CG2-CD1 4.18Å; V607-L611 HydrophobicContact CG1-CD1 4.03Å; V607-L611 HydrophobicContact CG1-CG 4.45Å; V607-L611 WeakPolarHBondContact O-CG 3.33Å; V607-L611 PolarHBondContact O-N 3.4Å; A608-L611 PolarHBondContact O-N 3.37Å; L611-Q613 PolarHBondContact O-N 3.13Å; L611-L614 HydrophobicContact CD2-CD1 4.38Å; L611-L614 WeakPolarHBondContact O-CB 3.42Å; L611-L614 PolarHBondContact O-N 3.28Å; L611-V615 WeakPolarHBondContact O-CG2 3.17Å; L611-V615 PolarHBondContact O-N 2.78Å; L611-L637 HydrophobicContact CD2-CG 4.24Å; L611-Q638 HydrophobicContact CD2-CB 4.33Å; L611-A641 HydrophobicContact CD1-CB 3.58Å; L611-A641 HydrophobicContact CD2-CB 4.11Å; L611-L671 HydrophobicContact CB-CD2 4.06Å; L611-L671 HydrophobicContact CD2-CD2 4.29Å
612	F	95.4	Very high	90.6	Very high	25 Å²	25	24 Å²	24	11%	0.11	13%	0.127	C	C	.	.	H	α-helix	trans	-62.4	-41.6	177.5	175.2	-116.6	0	0	0	111.5	N524 D525 L526 V529 A608 L609 L614 V615 E616	N524-F612 HydrophobicContact CB-CZ 4.17Å; D525-F612 HydrophobicContact CB-CD2 4.45Å; D525-F612 HydrophobicContact CB-CE2 4.09Å; L526-F612 HydrophobicContact CB-CD1 4.18Å; L526-F612 HydrophobicContact CB-CD2 4.02Å; L526-F612 HydrophobicContact CB-CE1 4.31Å; L526-F612 HydrophobicContact CB-CE2 4.16Å; L526-F612 HydrophobicContact CB-CG 4.04Å; L526-F612 HydrophobicContact CB-CZ 4.3Å; L526-F612 HydrophobicContact CD1-CB 3.56Å; L526-F612 HydrophobicContact CD1-CD1 3.97Å; L526-F612 HydrophobicContact CD1-CD2 4.44Å; L526-F612 HydrophobicContact CD1-CG 3.74Å; L526-F612 HydrophobicContact CG-CD1 4.5Å; L526-F612 HydrophobicContact CG-CG 4.45Å; V529-F612 HydrophobicContact CG1-CB 4.38Å; V529-F612 HydrophobicContact CG2-CB 4.48Å; V529-F612 HydrophobicContact CG2-CD2 4.27Å; A608-F612 WeakPolarHBondContact O-CB 3.06Å; A608-F612 PolarHBondContact O-N 3.31Å; L609-F612 PolarHBondContact O-N 3.04Å; F612-L614 VanDerWaalsContact C-N 3.31Å; F612-L614 PolarHBondContact O-N 2.81Å; F612-V615 PolarHBondContact O-N 2.85Å; F612-V615 VanDerWaalsContact O-N 3.16Å; F612-E616 HydrophobicContact CD2-CG 4.32Å; F612-E616 HydrophobicContact CE1-CG 4.28Å; F612-E616 HydrophobicContact CE2-CG 3.86Å; F612-E616 HydrophobicContact CZ-CG 3.84Å; F612-E616 WeakPolarHBondContact O-CG 3.41Å; F612-E616 PolarHBondContact O-N 2.63Å
613	Q	94.7	Very high	90.8	Very high	19 Å²	19	24 Å²	24	9%	0.089	13%	0.127	C	C	.	.	H	α-helix	trans	-63.3	-36.7	174.4	-73.8	-176.2	34.4	0	0	112.8	L609 A610 L611 E616 E617 V618 V623 R626	L609-Q613 PolarHBondContact O-N 3.14Å; L609-Q613 VanDerWaalsContact O-N 3.15Å; A610-Q613 PolarHBondContact O-N 3.41Å; L611-Q613 PolarHBondContact O-N 3.13Å; Q613-E616 CarbonylContact O-C 3.54Å; Q613-E616 PolarHBondContact O-N 3.37Å; Q613-E617 PolarHBondContact O-N 3.31Å; Q613-V618 HydrophobicContact CB-CB 4.18Å; Q613-V618 HydrophobicContact CB-CG2 4.1Å; Q613-V618 VanDerWaalsContact O-CB 3.25Å; Q613-V618 WeakPolarHBondContact O-CB 3.41Å; Q613-V618 WeakPolarHBondContact O-CG2 3.21Å; Q613-V618 PolarHBondContact O-N 3.37Å; Q613-V623 HydrophobicContact CB-CG1 4.48Å; Q613-V623 HydrophobicContact CB-CG2 3.86Å; Q613-R626 VanDerWaalsContact CD-NH1 3.31Å; Q613-R626 VanDerWaalsContact NE2-CZ 3.28Å; Q613-R626 VanDerWaalsContact OE1-NH1 3.17Å
614	L	93.7	Very high	91	Very high	6 Å²	6	24.1 Å²	24.1	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-64.7	-41.6	173.4	-63.8	174.4	0	0	0	111.4	A610 L611 F612 E616 E617 L620 V623 L634 Q638 G674	A610-L614 PolarHBondContact O-N 3.11Å; L611-L614 HydrophobicContact CD2-CD1 4.38Å; L611-L614 WeakPolarHBondContact O-CB 3.42Å; L611-L614 PolarHBondContact O-N 3.28Å; F612-L614 VanDerWaalsContact C-N 3.31Å; F612-L614 PolarHBondContact O-N 2.81Å; L614-E616 PolarHBondContact O-N 2.87Å; L614-E617 PolarHBondContact O-N 3.42Å; L614-L620 HydrophobicContact CD2-CB 4.19Å; L614-L620 HydrophobicContact CD2-CG 4.5Å; L614-V623 HydrophobicContact CD2-CB 4.16Å; L614-V623 HydrophobicContact CD2-CG1 4.49Å; L614-V623 HydrophobicContact CD2-CG2 3.83Å; L614-V623 HydrophobicContact CG-CG2 4.38Å; L614-L634 HydrophobicContact CD1-CD1 3.99Å; L614-L634 HydrophobicContact CD1-CD2 4.43Å; L614-L634 HydrophobicContact CD1-CG 4.03Å; L614-L634 HydrophobicContact CD2-CD2 4.4Å; L614-Q638 HydrophobicContact CD1-CB 4.09Å; L614-Q638 HydrophobicContact CD1-CG 4.13Å; L614-G674 CarbonylContact O-C 3.6Å; L614-G674 WeakPolarHBondContact O-CA 3.33Å
615	V	94	Very high	90.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-28.7	176.2	170.9	0	0	0	0	111.9	V529 L611 F612 E617 R670 L671 V675 K676	V529-V615 HydrophobicContact CG2-CG2 4.43Å; L611-V615 WeakPolarHBondContact O-CG2 3.17Å; L611-V615 PolarHBondContact O-N 2.78Å; F612-V615 PolarHBondContact O-N 2.85Å; F612-V615 VanDerWaalsContact O-N 3.16Å; V615-E617 PolarHBondContact O-N 2.91Å; V615-R670 HydrophobicContact CG1-CB 4.48Å; V615-L671 HydrophobicContact CG2-CD2 3.66Å; V615-L671 HydrophobicContact CG2-CG 4.16Å; V615-V675 CarbonylContact O-C 3.57Å; V615-K676 WeakPolarHBondContact O-CG 3.29Å; V615-K676 PolarHBondContact O-N 3.18Å
616	E	93.4	Very high	90.8	Very high	63 Å²	63	31.5 Å²	31.5	29%	0.294	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	14.6	171.4	-71.4	-62.1	128.6	0	0	113.7	F612 Q613 L614 V618 K676	F612-E616 HydrophobicContact CD2-CG 4.32Å; F612-E616 HydrophobicContact CE1-CG 4.28Å; F612-E616 HydrophobicContact CE2-CG 3.86Å; F612-E616 HydrophobicContact CZ-CG 3.84Å; F612-E616 WeakPolarHBondContact O-CG 3.41Å; F612-E616 PolarHBondContact O-N 2.63Å; Q613-E616 CarbonylContact O-C 3.54Å; Q613-E616 PolarHBondContact O-N 3.37Å; L614-E616 PolarHBondContact O-N 2.87Å; E616-V618 VanDerWaalsContact C-N 3.28Å; E616-V618 PolarHBondContact O-N 3.4Å; E616-K676 WeakPolarHBondContact OE2-CE 3.29Å; E616-K676 IonicContact OE2-NZ 2.93Å; E616-K676 PolarHBondContact OE2-NZ 3.38Å
617	E	92.5	Very high	90.7	Very high	52 Å²	52	31.8 Å²	31.8	24%	0.243	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	21.6	176.9	-65.1	165.8	-111.9	0	0	115.2	Q613 L614 V615 K676 R694	Q613-E617 PolarHBondContact O-N 3.31Å; L614-E617 PolarHBondContact O-N 3.42Å; V615-E617 PolarHBondContact O-N 2.91Å; E617-K676 HydrophobicContact CG-CG 4.47Å; E617-K676 WeakPolarHBondContact OE1-CB 3.47Å; E617-K676 VanDerWaalsContact OE1-CD 3.27Å; E617-K676 WeakPolarHBondContact OE1-CD 3.28Å; E617-K676 WeakPolarHBondContact OE1-CG 3.24Å; E617-K676 PolarHBondContact OE1-N 2.87Å; E617-R694 IonicContact OE1-CZ 2.75Å; E617-R694 IonicContact OE1-NE 3.69Å; E617-R694 PolarHBondContact OE1-NE 2.78Å; E617-R694 IonicContact OE1-NH2 2.95Å; E617-R694 PolarHBondContact OE1-NH2 3.4Å; E617-R694 IonicContact OE2-CZ 2.71Å; E617-R694 IonicContact OE2-NE 3.98Å; E617-R694 PolarHBondContact OE2-NE 3.39Å; E617-R694 IonicContact OE2-NH2 2.67Å; E617-R694 PolarHBondContact OE2-NH2 2.89Å
618	V	92.5	Very high	90.3	Very high	42 Å²	42	34.8 Å²	34.8	26%	0.255	19%	0.194	S	C	.	.			trans	-70	128.8	170.3	-176.4	0	0	0	0	109	Q613 E616 L620 E622 V623	Q613-V618 HydrophobicContact CB-CB 4.18Å; Q613-V618 HydrophobicContact CB-CG2 4.1Å; Q613-V618 VanDerWaalsContact O-CB 3.25Å; Q613-V618 WeakPolarHBondContact O-CB 3.41Å; Q613-V618 WeakPolarHBondContact O-CG2 3.21Å; Q613-V618 PolarHBondContact O-N 3.37Å; E616-V618 VanDerWaalsContact C-N 3.28Å; E616-V618 PolarHBondContact O-N 3.4Å; V618-L620 PolarHBondContact O-N 2.84Å; V618-E622 HydrophobicContact CG1-CB 4.05Å; V618-V623 HydrophobicContact CB-CG2 3.8Å; V618-V623 HydrophobicContact CG1-CG2 3.58Å
619	P	89.2	Confident	89.7	Confident	62 Å²	62	35.6 Å²	35.6	40%	0.403	20%	0.2	S	C	.	.			trans	-55.3	137.5	-178.7	-27	34.5	0	0	0	113	A621 E622 V623	P619-A621 PolarHBondContact O-N 2.92Å; P619-E622 HydrophobicContact CB-CG 4.28Å; P619-E622 HydrophobicContact CG-CG 4.5Å; P619-E622 WeakPolarHBondContact O-CB 3.41Å; P619-E622 PolarHBondContact O-N 2.86Å; P619-V623 PolarHBondContact O-N 3.28Å; P619-V623 VanDerWaalsContact O-N 3.13Å
620	L	88.5	Confident	89.2	Confident	38 Å²	38	39.3 Å²	39.3	20%	0.199	22%	0.22	C	C	.	.	H	α-helix	trans	-53.7	-34.9	-177.2	-176.1	148.5	0	0	0	113.2	T330 L614 V618 S624 R631 L634 Q635	T330-L620 HydrophobicContact CG2-CD2 4.33Å; L614-L620 HydrophobicContact CD2-CB 4.19Å; L614-L620 HydrophobicContact CD2-CG 4.5Å; V618-L620 PolarHBondContact O-N 2.84Å; L620-S624 WeakPolarHBondContact O-CB 3.39Å; L620-S624 PolarHBondContact O-N 3.45Å; L620-R631 HydrophobicContact CD2-CB 3.58Å; L620-R631 HydrophobicContact CD2-CG 3.85Å; L620-L634 HydrophobicContact CG-CD2 4.14Å; L620-L634 HydrophobicContact CG-CG 4.44Å; L620-Q635 HydrophobicContact CD1-CB 3.78Å; L620-Q635 HydrophobicContact CD1-CG 4.22Å
621	A	86	Confident	88.9	Confident	29 Å²	29	40.3 Å²	40.3	24%	0.24	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-38.9	177.1	0	0	0	0	0	112.9	V309 P619 A625	V309-A621 HydrophobicContact CG2-CB 4.45Å; P619-A621 PolarHBondContact O-N 2.92Å; A621-A625 PolarHBondContact O-N 3.26Å
622	E	90.1	Very high	88.4	Confident	120 Å²	120	40.4 Å²	40.4	56%	0.561	22%	0.224	S	C	*	.	H	α-helix	trans	-71	-43.3	178.4	-66.5	-178	-167.5	0	0	111.2	V618 P619 S624 A625 R626	V618-E622 HydrophobicContact CG1-CB 4.05Å; P619-E622 HydrophobicContact CB-CG 4.28Å; P619-E622 HydrophobicContact CG-CG 4.5Å; P619-E622 WeakPolarHBondContact O-CB 3.41Å; P619-E622 PolarHBondContact O-N 2.86Å; E622-S624 VanDerWaalsContact C-N 3.33Å; E622-S624 PolarHBondContact O-N 3.05Å; E622-A625 PolarHBondContact O-N 2.92Å; E622-R626 WeakPolarHBondContact O-CB 3.38Å; E622-R626 PolarHBondContact O-N 2.87Å
623	V	90.3	Very high	87.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-44	174.7	-176	0	0	0	0	110.2	A610 Q613 L614 V618 P619 A625 R626 F627 L634	A610-V623 HydrophobicContact CB-CG1 4.21Å; Q613-V623 HydrophobicContact CB-CG1 4.48Å; Q613-V623 HydrophobicContact CB-CG2 3.86Å; L614-V623 HydrophobicContact CD2-CB 4.16Å; L614-V623 HydrophobicContact CD2-CG1 4.49Å; L614-V623 HydrophobicContact CD2-CG2 3.83Å; L614-V623 HydrophobicContact CG-CG2 4.38Å; V618-V623 HydrophobicContact CB-CG2 3.8Å; V618-V623 HydrophobicContact CG1-CG2 3.58Å; P619-V623 PolarHBondContact O-N 3.28Å; P619-V623 VanDerWaalsContact O-N 3.13Å; V623-A625 VanDerWaalsContact C-N 3.34Å; V623-A625 PolarHBondContact O-N 3.02Å; V623-R626 PolarHBondContact O-N 3.33Å; V623-F627 HydrophobicContact CG1-CD2 3.65Å; V623-F627 HydrophobicContact CG1-CE2 3.89Å; V623-F627 WeakPolarHBondContact O-CB 3.49Å; V623-F627 VanDerWaalsContact O-CD2 3.28Å; V623-F627 WeakPolarHBondContact O-CD2 3.42Å; V623-F627 PolarHBondContact O-N 2.84Å; V623-L634 HydrophobicContact CB-CD2 3.74Å; V623-L634 HydrophobicContact CG1-CD1 4.49Å; V623-L634 HydrophobicContact CG1-CD2 3.6Å
624	S	87.3	Confident	87.3	Confident	13 Å²	13	39 Å²	39	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-57.1	-44.3	175.5	167.1	0	0	0	0	112.5	L620 E622 S628 C629 R631	L620-S624 WeakPolarHBondContact O-CB 3.39Å; L620-S624 PolarHBondContact O-N 3.45Å; E622-S624 VanDerWaalsContact C-N 3.33Å; E622-S624 PolarHBondContact O-N 3.05Å; S624-S628 WeakPolarHBondContact O-CA 3.47Å; S624-S628 PolarHBondContact O-N 3.31Å; S624-C629 PolarHBondContact O-N 3Å; S624-C629 PolarHBondContact OG-O 3.1Å; S624-R631 WeakPolarHBondContact OG-CG 3.45Å; S624-R631 PolarHBondContact OG-N 3.32Å
625	A	86	Confident	86.9	Confident	73 Å²	73	39.9 Å²	39.9	60%	0.603	22%	0.222	S	C	*	.	H	α-helix	trans	-66.7	-47.7	176	0	0	0	0	0	112.1	A621 E622 V623 F627 S628	A621-A625 PolarHBondContact O-N 3.26Å; E622-A625 PolarHBondContact O-N 2.92Å; V623-A625 VanDerWaalsContact C-N 3.34Å; V623-A625 PolarHBondContact O-N 3.02Å; A625-F627 VanDerWaalsContact C-N 3.32Å; A625-F627 PolarHBondContact O-N 3.29Å; A625-S628 PolarHBondContact O-N 3.5Å
626	R	88.2	Confident	86.2	Confident	101 Å²	101	42 Å²	42	38%	0.381	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-39.5	-178.3	-176.3	176.8	-178.5	173	5	112.8	Q558 I562 Q613 E622 V623	Q558-R626 PolarHBondContact NE2-O 3.44Å; I562-R626 HydrophobicContact CD1-CG 4.45Å; Q613-R626 VanDerWaalsContact CD-NH1 3.31Å; Q613-R626 VanDerWaalsContact NE2-CZ 3.28Å; Q613-R626 VanDerWaalsContact OE1-NH1 3.17Å; E622-R626 WeakPolarHBondContact O-CB 3.38Å; E622-R626 PolarHBondContact O-N 2.87Å; V623-R626 PolarHBondContact O-N 3.33Å
627	F	86.5	Confident	85.7	Confident	9 Å²	9	39.6 Å²	39.6	4%	0.039	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	4.5	-179.6	-70.3	-98.5	0	0	0	113.4	I562 F606 L609 A610 V623 A625 C629	I562-F627 HydrophobicContact CD1-CD1 4.06Å; I562-F627 HydrophobicContact CD1-CE1 4.02Å; I562-F627 HydrophobicContact CD1-CG 4.46Å; I562-F627 HydrophobicContact CD1-CZ 4.4Å; F606-F627 HydrophobicContact CD2-CD1 4.27Å; F606-F627 HydrophobicContact CD2-CE1 4.27Å; F606-F627 AromaticContact CE1-CD1 3.92Å; F606-F627 HydrophobicContact CE1-CD1 3.92Å; F606-F627 AromaticContact CE2-CD1 3.67Å; F606-F627 HydrophobicContact CE2-CD1 3.67Å; F606-F627 AromaticContact CE2-CE1 3.99Å; F606-F627 HydrophobicContact CE2-CE1 3.99Å; F606-F627 HydrophobicContact CZ-CB 4.39Å; F606-F627 AromaticContact CZ-CD1 3.49Å; F606-F627 HydrophobicContact CZ-CD1 3.49Å; F606-F627 VanDerWaalsContact CZ-CD1 3.49Å; F606-F627 HydrophobicContact CZ-CE1 4.26Å; F606-F627 HydrophobicContact CZ-CG 4.38Å; L609-F627 HydrophobicContact CB-CE1 3.95Å; L609-F627 HydrophobicContact CB-CZ 3.94Å; A610-F627 HydrophobicContact CB-CD1 3.88Å; A610-F627 HydrophobicContact CB-CD2 4.15Å; A610-F627 HydrophobicContact CB-CE1 3.87Å; A610-F627 HydrophobicContact CB-CE2 4.13Å; A610-F627 HydrophobicContact CB-CG 4.03Å; A610-F627 HydrophobicContact CB-CZ 4Å; V623-F627 HydrophobicContact CG1-CD2 3.65Å; V623-F627 HydrophobicContact CG1-CE2 3.89Å; V623-F627 WeakPolarHBondContact O-CB 3.49Å; V623-F627 VanDerWaalsContact O-CD2 3.28Å; V623-F627 WeakPolarHBondContact O-CD2 3.42Å; V623-F627 PolarHBondContact O-N 2.84Å; A625-F627 VanDerWaalsContact C-N 3.32Å; A625-F627 PolarHBondContact O-N 3.29Å; F627-C629 VanDerWaalsContact C-N 3.29Å; F627-C629 PolarHBondContact O-N 2.64Å
628	S	79.7	Confident	85.5	Confident	69 Å²	69	37.9 Å²	37.9	48%	0.483	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	43.5	178.7	-59.6	0	0	0	0	113.5	S624 A625	S624-S628 WeakPolarHBondContact O-CA 3.47Å; S624-S628 PolarHBondContact O-N 3.31Å; A625-S628 PolarHBondContact O-N 3.5Å
629	C	79.4	Confident	85	Confident	17 Å²	17	39.3 Å²	39.3	12%	0.115	22%	0.221	C	C	.	.			trans	-123.8	156.2	-178.2	70.8	0	0	0	0	111.5	L550 S624 F627	L550-C629 HydrophobicContact CD1-CB 3.62Å; S624-C629 PolarHBondContact O-N 3Å; S624-C629 PolarHBondContact OG-O 3.1Å; F627-C629 VanDerWaalsContact C-N 3.29Å; F627-C629 PolarHBondContact O-N 2.64Å
630	N	81.5	Confident	84.5	Confident	81 Å²	81	39.2 Å²	39.2	43%	0.433	22%	0.215	S	C	.	.			trans	-69.6	139.1	178.5	-74.2	-54.6	0	0	0	111.6	G632 Y633 L634	N630-G632 PolarHBondContact O-N 3.39Å; N630-Y633 VanDerWaalsContact O-CB 3.32Å; N630-Y633 WeakPolarHBondContact O-CB 3.39Å; N630-Y633 PolarHBondContact O-N 2.97Å; N630-L634 PolarHBondContact O-N 3.48Å
631	R	86.2	Confident	84.4	Confident	26 Å²	26	37.4 Å²	37.4	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-48.7	-178.6	-69.1	-176.2	-67.6	161	4.7	113.3	V309 T330 E333 L620 S624 Y633 L634 Q635	V309-R631 PolarHBondContact O-NH1 2.84Å; T330-R631 HydrophobicContact CG2-CB 3.79Å; E333-R631 IonicContact OE1-CZ 2.68Å; E333-R631 IonicContact OE1-NH1 3.87Å; E333-R631 IonicContact OE1-NH2 2.85Å; E333-R631 PolarHBondContact OE1-NH2 2.85Å; E333-R631 IonicContact OE2-NH2 3.21Å; L620-R631 HydrophobicContact CD2-CB 3.58Å; L620-R631 HydrophobicContact CD2-CG 3.85Å; S624-R631 WeakPolarHBondContact OG-CG 3.45Å; S624-R631 PolarHBondContact OG-N 3.32Å; R631-Y633 PolarHBondContact O-N 3.17Å; R631-L634 PolarHBondContact O-N 3.02Å; R631-Q635 PolarHBondContact O-N 3.19Å
632	G	82.5	Confident	84.4	Confident	4 Å²	4	36.1 Å²	36.1	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-30.7	177.5	0	0	0	0	0	113.7	A327 G328 L329 N630 S636	A327-G632 CarbonylContact O-C 3.43Å; A327-G632 VanDerWaalsContact O-C 3.24Å; G328-G632 WeakPolarHBondContact O-CA 3.49Å; G328-G632 PolarHBondContact O-N 3.33Å; L329-G632 VanDerWaalsContact C-CA 3.43Å; L329-G632 VanDerWaalsContact O-CA 3.28Å; L329-G632 WeakPolarHBondContact O-CA 3.35Å; N630-G632 PolarHBondContact O-N 3.39Å; G632-S636 WeakPolarHBondContact O-CB 3.26Å; G632-S636 PolarHBondContact O-N 2.87Å
633	Y	78.8	Confident	83.9	Confident	13 Å²	13	33 Å²	33	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-68.2	-48.2	173.6	177.7	-82.3	0	0	0	110.9	A327 M546 L547 L550 N630 R631 Q635 S636 L637	A327-Y633 PolarHBondContact O-N 3.17Å; M546-Y633 HydrophobicContact CB-CE2 3.64Å; M546-Y633 HydrophobicContact CG-CD2 4.44Å; M546-Y633 HydrophobicContact CG-CE2 3.84Å; M546-Y633 WeakPolarHBondContact O-CE2 3.48Å; M546-Y633 PolarHBondContact O-OH 3.48Å; M546-Y633 VanDerWaalsContact O-OH 3.12Å; M546-Y633 HydrophobicContact SD-CD2 3.72Å; M546-Y633 HydrophobicContact SD-CE2 3.58Å; M546-Y633 VanDerWaalsContact SD-CE2 3.58Å; L547-Y633 WeakPolarHBondContact CA-OH 3.48Å; L547-Y633 WeakPolarHBondContact CD1-OH 3.37Å; L547-Y633 PolarHBondContact N-OH 3.2Å; L547-Y633 VanDerWaalsContact N-OH 3.16Å; L550-Y633 HydrophobicContact CB-CE1 4.47Å; L550-Y633 HydrophobicContact CD1-CD1 3.63Å; L550-Y633 HydrophobicContact CD1-CE1 3.25Å; L550-Y633 HydrophobicContact CG-CE1 4.44Å; N630-Y633 VanDerWaalsContact O-CB 3.32Å; N630-Y633 WeakPolarHBondContact O-CB 3.39Å; N630-Y633 PolarHBondContact O-N 2.97Å; R631-Y633 PolarHBondContact O-N 3.17Å; Y633-Q635 VanDerWaalsContact C-N 3.3Å; Y633-Q635 PolarHBondContact O-N 2.85Å; Y633-S636 PolarHBondContact O-N 3.41Å; Y633-S636 VanDerWaalsContact O-N 3.13Å; Y633-L637 HydrophobicContact CE1-CB 4.26Å; Y633-L637 HydrophobicContact CE1-CD2 4.09Å; Y633-L637 WeakPolarHBondContact O-CB 2.98Å; Y633-L637 PolarHBondContact O-N 3.35Å
634	L	86.3	Confident	83.5	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-41.4	178	-177.8	59.3	0	0	0	111.3	A610 L614 L620 V623 N630 R631 L637 Q638	A610-L634 HydrophobicContact CB-CD1 4.28Å; L614-L634 HydrophobicContact CD1-CD1 3.99Å; L614-L634 HydrophobicContact CD1-CD2 4.43Å; L614-L634 HydrophobicContact CD1-CG 4.03Å; L614-L634 HydrophobicContact CD2-CD2 4.4Å; L620-L634 HydrophobicContact CG-CD2 4.14Å; L620-L634 HydrophobicContact CG-CG 4.44Å; V623-L634 HydrophobicContact CB-CD2 3.74Å; V623-L634 HydrophobicContact CG1-CD1 4.49Å; V623-L634 HydrophobicContact CG1-CD2 3.6Å; N630-L634 PolarHBondContact O-N 3.48Å; R631-L634 PolarHBondContact O-N 3.02Å; L634-L637 HydrophobicContact CD1-CD2 4.29Å; L634-L637 WeakPolarHBondContact O-CB 3.38Å; L634-L637 PolarHBondContact O-N 3.04Å; L634-Q638 VanDerWaalsContact O-CB 3.32Å; L634-Q638 WeakPolarHBondContact O-CB 3.28Å; L634-Q638 PolarHBondContact O-N 3.02Å
635	Q	86	Confident	83.6	Confident	25 Å²	25	33 Å²	33	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-62.2	-42.9	173.1	-166.7	-175.2	44.5	0	0	111.8	T330 E332 L620 R631 Y633 Q638 Q639	T330-Q635 VanDerWaalsContact CA-OE1 3.32Å; E332-Q635 PolarHBondContact OE1-NE2 3.02Å; E332-Q635 PolarHBondContact OE2-NE2 3.26Å; L620-Q635 HydrophobicContact CD1-CB 3.78Å; L620-Q635 HydrophobicContact CD1-CG 4.22Å; R631-Q635 PolarHBondContact O-N 3.19Å; Y633-Q635 VanDerWaalsContact C-N 3.3Å; Y633-Q635 PolarHBondContact O-N 2.85Å; Q635-Q638 WeakPolarHBondContact O-CB 3.25Å; Q635-Q638 PolarHBondContact O-N 3.33Å; Q635-Q639 WeakPolarHBondContact O-CG 3.49Å; Q635-Q639 PolarHBondContact O-N 3.35Å
636	S	79.8	Confident	83.5	Confident	45 Å²	45	31.6 Å²	31.6	32%	0.315	17%	0.171	S	C	.	.	H	α-helix	trans	-65.4	-41.1	177.6	-174	0	0	0	0	112	G632 Y633 Q638 Q639 Q640	G632-S636 WeakPolarHBondContact O-CB 3.26Å; G632-S636 PolarHBondContact O-N 2.87Å; Y633-S636 PolarHBondContact O-N 3.41Å; Y633-S636 VanDerWaalsContact O-N 3.13Å; S636-Q638 VanDerWaalsContact C-N 3.34Å; S636-Q639 PolarHBondContact O-N 2.92Å; S636-Q640 WeakPolarHBondContact O-CB 3.5Å; S636-Q640 VanDerWaalsContact O-CG 3.28Å; S636-Q640 WeakPolarHBondContact O-CG 2.9Å; S636-Q640 PolarHBondContact O-N 3.07Å; S636-Q640 PolarHBondContact O-NE2 3.4Å; S636-Q640 PolarHBondContact OG-NE2 2.99Å
637	L	82.6	Confident	83.3	Confident	12 Å²	12	28.9 Å²	28.9	6%	0.063	16%	0.163	C	C	.	.	H	α-helix	trans	-61.2	-43.6	174.4	173.7	64.1	0	0	0	111	V607 L611 Y633 L634 Q640 A641	V607-L637 HydrophobicContact CG1-CD1 3.94Å; V607-L637 HydrophobicContact CG1-CD2 3.92Å; V607-L637 HydrophobicContact CG1-CG 4.34Å; L611-L637 HydrophobicContact CD2-CG 4.24Å; Y633-L637 HydrophobicContact CE1-CB 4.26Å; Y633-L637 HydrophobicContact CE1-CD2 4.09Å; Y633-L637 WeakPolarHBondContact O-CB 2.98Å; Y633-L637 PolarHBondContact O-N 3.35Å; L634-L637 HydrophobicContact CD1-CD2 4.29Å; L634-L637 WeakPolarHBondContact O-CB 3.38Å; L634-L637 PolarHBondContact O-N 3.04Å; L637-Q640 PolarHBondContact O-N 3.09Å; L637-A641 VanDerWaalsContact O-CB 3.29Å; L637-A641 WeakPolarHBondContact O-CB 3.27Å; L637-A641 PolarHBondContact O-N 3.39Å
638	Q	87.7	Confident	83.4	Confident	15 Å²	15	28.5 Å²	28.5	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-57.5	-48.7	174.9	-180	-175.5	17.8	0	0	112	L611 L614 L634 Q635 S636 A641 S642 L671 G674	L611-Q638 HydrophobicContact CD2-CB 4.33Å; L614-Q638 HydrophobicContact CD1-CB 4.09Å; L614-Q638 HydrophobicContact CD1-CG 4.13Å; L634-Q638 VanDerWaalsContact O-CB 3.32Å; L634-Q638 WeakPolarHBondContact O-CB 3.28Å; L634-Q638 PolarHBondContact O-N 3.02Å; Q635-Q638 WeakPolarHBondContact O-CB 3.25Å; Q635-Q638 PolarHBondContact O-N 3.33Å; S636-Q638 VanDerWaalsContact C-N 3.34Å; Q638-A641 PolarHBondContact O-N 3.48Å; Q638-S642 WeakPolarHBondContact O-CB 3.11Å; Q638-S642 PolarHBondContact O-N 3.16Å; Q638-L671 VanDerWaalsContact CD-O 3.23Å; Q638-L671 WeakPolarHBondContact CG-O 3.48Å; Q638-L671 PolarHBondContact NE2-O 2.72Å; Q638-G674 VanDerWaalsContact NE2-N 3.2Å
639	Q	83	Confident	83.8	Confident	72 Å²	72	26.5 Å²	26.5	34%	0.336	15%	0.145	S	C	.	.	H	α-helix	trans	-67.1	-37	178.6	-65.3	-56.4	-39.3	0	0	112.9	Q635 S636 S642 T643 A672	Q635-Q639 WeakPolarHBondContact O-CG 3.49Å; Q635-Q639 PolarHBondContact O-N 3.35Å; S636-Q639 PolarHBondContact O-N 2.92Å; Q639-S642 PolarHBondContact O-N 3.39Å; Q639-T643 PolarHBondContact O-N 2.85Å; Q639-T643 PolarHBondContact O-OG1 2.88Å; Q639-A672 PolarHBondContact NE2-O 2.74Å
640	Q	78.7	Confident	84.1	Confident	60 Å²	60	27.9 Å²	27.9	28%	0.28	16%	0.155	S	C	.	.	H	α-helix	trans	-66.9	-43.4	174.7	-74.3	172.7	64.6	0	0	111.5	L534 S636 L637 S642 T643 Y644	L534-Q640 HydrophobicContact CD1-CB 4.12Å; S636-Q640 WeakPolarHBondContact O-CB 3.5Å; S636-Q640 VanDerWaalsContact O-CG 3.28Å; S636-Q640 WeakPolarHBondContact O-CG 2.9Å; S636-Q640 PolarHBondContact O-N 3.07Å; S636-Q640 PolarHBondContact O-NE2 3.4Å; S636-Q640 PolarHBondContact OG-NE2 2.99Å; L637-Q640 PolarHBondContact O-N 3.09Å; Q640-S642 VanDerWaalsContact C-N 3.32Å; Q640-S642 PolarHBondContact O-N 3.44Å; Q640-T643 PolarHBondContact O-N 3.2Å; Q640-Y644 WeakPolarHBondContact O-CB 3.23Å; Q640-Y644 PolarHBondContact O-N 2.62Å
641	A	85.2	Confident	84.4	Confident	1 Å²	1	24 Å²	24	1%	0.008	14%	0.135	C	C	.	.	H	α-helix	trans	-62.1	-40.4	175.6	0	0	0	0	0	111.5	L611 L637 Q638 Y644 A645 L671	L611-A641 HydrophobicContact CD1-CB 3.58Å; L611-A641 HydrophobicContact CD2-CB 4.11Å; L637-A641 VanDerWaalsContact O-CB 3.29Å; L637-A641 WeakPolarHBondContact O-CB 3.27Å; L637-A641 PolarHBondContact O-N 3.39Å; Q638-A641 PolarHBondContact O-N 3.48Å; A641-Y644 PolarHBondContact O-N 3.47Å; A641-A645 VanDerWaalsContact O-CB 3.28Å; A641-A645 WeakPolarHBondContact O-CB 3.49Å; A641-A645 PolarHBondContact O-N 2.99Å; A641-L671 HydrophobicContact CB-CD1 4.18Å; A641-L671 HydrophobicContact CB-CD2 4.48Å
642	S	86.5	Confident	84.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-47.4	172.7	165.3	0	0	0	0	112.7	T114 Q638 Q639 Q640 Y644 A645 A646 A668 A672	T114-S642 WeakPolarHBondContact CG2-OG 3.42Å; Q638-S642 WeakPolarHBondContact O-CB 3.11Å; Q638-S642 PolarHBondContact O-N 3.16Å; Q639-S642 PolarHBondContact O-N 3.39Å; Q640-S642 VanDerWaalsContact C-N 3.32Å; Q640-S642 PolarHBondContact O-N 3.44Å; S642-Y644 VanDerWaalsContact C-N 3.35Å; S642-Y644 PolarHBondContact O-N 3.44Å; S642-A645 WeakPolarHBondContact O-CB 3.25Å; S642-A645 PolarHBondContact O-N 2.65Å; S642-A646 PolarHBondContact O-N 3.26Å; S642-A668 VanDerWaalsContact CB-O 3.24Å; S642-A668 WeakPolarHBondContact CB-O 3.38Å; S642-A668 PolarHBondContact OG-O 2.99Å; S642-A672 WeakPolarHBondContact OG-CB 3.27Å
643	T	79.3	Confident	84.9	Confident	55 Å²	55	25.6 Å²	25.6	34%	0.337	14%	0.144	S	C	.	.	H	α-helix	trans	-62.9	-43.2	177.6	-56.3	0	0	0	0	111.2	Q639 Q640 A646 M647	Q639-T643 PolarHBondContact O-N 2.85Å; Q639-T643 PolarHBondContact O-OG1 2.88Å; Q640-T643 PolarHBondContact O-N 3.2Å; T643-A646 WeakPolarHBondContact O-CB 3.37Å; T643-A646 PolarHBondContact O-N 3.29Å; T643-M647 WeakPolarHBondContact O-CG 3.28Å; T643-M647 PolarHBondContact O-N 2.98Å; T643-M647 VanDerWaalsContact O-N 3.09Å
644	Y	82.7	Confident	85.3	Confident	13 Å²	13	30.9 Å²	30.9	5%	0.051	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-38.9	177.6	-172.6	-103.8	0	0	0	112.2	M501 V509 V532 L534 Q640 A641 S642 A646 M647 V648	M501-Y644 HydrophobicContact CE-CE2 3.97Å; V509-Y644 WeakPolarHBondContact CG2-OH 3.3Å; V532-Y644 WeakPolarHBondContact O-CD1 3.36Å; L534-Y644 HydrophobicContact CD2-CD1 4.37Å; L534-Y644 HydrophobicContact CD2-CD2 3.56Å; L534-Y644 HydrophobicContact CD2-CE2 3.96Å; L534-Y644 HydrophobicContact CD2-CG 3.76Å; L534-Y644 HydrophobicContact CG-CD1 4.17Å; L534-Y644 HydrophobicContact CG-CD2 4.23Å; L534-Y644 HydrophobicContact CG-CG 3.91Å; Q640-Y644 WeakPolarHBondContact O-CB 3.23Å; Q640-Y644 PolarHBondContact O-N 2.62Å; A641-Y644 PolarHBondContact O-N 3.47Å; S642-Y644 VanDerWaalsContact C-N 3.35Å; S642-Y644 PolarHBondContact O-N 3.44Å; Y644-A646 VanDerWaalsContact C-N 3.29Å; Y644-A646 PolarHBondContact O-N 3.17Å; Y644-M647 WeakPolarHBondContact O-CA 3.28Å; Y644-M647 WeakPolarHBondContact O-CB 3.49Å; Y644-M647 PolarHBondContact O-N 3.26Å; Y644-V648 HydrophobicContact CD1-CG2 3.94Å; Y644-V648 HydrophobicContact CE1-CG2 3.69Å; Y644-V648 WeakPolarHBondContact O-CG2 3.44Å; Y644-V648 PolarHBondContact O-N 3.39Å
645	A	88.7	Confident	85.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.6	-43.9	172.7	0	0	0	0	0	111.1	V532 A641 S642 M647 V648 I649 A668 L671	V532-A645 HydrophobicContact CB-CB 3.72Å; V532-A645 HydrophobicContact CG1-CB 4.06Å; V532-A645 HydrophobicContact CG2-CB 4.06Å; A641-A645 VanDerWaalsContact O-CB 3.28Å; A641-A645 WeakPolarHBondContact O-CB 3.49Å; A641-A645 PolarHBondContact O-N 2.99Å; S642-A645 WeakPolarHBondContact O-CB 3.25Å; S642-A645 PolarHBondContact O-N 2.65Å; A645-M647 VanDerWaalsContact C-N 3.32Å; A645-M647 PolarHBondContact O-N 3.49Å; A645-V648 PolarHBondContact O-N 2.76Å; A645-I649 WeakPolarHBondContact O-CB 3.47Å; A645-I649 WeakPolarHBondContact O-CD1 3.21Å; A645-I649 WeakPolarHBondContact O-CG1 3.45Å; A645-I649 PolarHBondContact O-N 3.05Å; A645-A668 HydrophobicContact CB-CB 4.47Å; A645-L671 HydrophobicContact CB-CD1 3.89Å
646	A	84.3	Confident	85.5	Confident	43 Å²	43	31.5 Å²	31.5	36%	0.355	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-39	174.6	0	0	0	0	0	112.6	S642 T643 Y644 S650 A668	S642-A646 PolarHBondContact O-N 3.26Å; T643-A646 WeakPolarHBondContact O-CB 3.37Å; T643-A646 PolarHBondContact O-N 3.29Å; Y644-A646 VanDerWaalsContact C-N 3.29Å; Y644-A646 PolarHBondContact O-N 3.17Å; A646-S650 WeakPolarHBondContact O-CB 3.29Å; A646-S650 PolarHBondContact O-N 3.34Å; A646-A668 HydrophobicContact CB-CB 3.99Å
647	M	83.8	Confident	86	Confident	45 Å²	45	31.6 Å²	31.6	22%	0.222	17%	0.168	C	C	.	.	H	α-helix	trans	-63.4	-46.1	174.6	-66.1	169	59.3	0	0	111.5	S499 M501 T643 Y644 A645 S650 F651	S499-M647 WeakPolarHBondContact CB-O 3.48Å; M501-M647 HydrophobicContact CB-CE 4.46Å; M501-M647 HydrophobicContact CG-CB 4.48Å; M501-M647 HydrophobicContact CG-CE 3.53Å; T643-M647 WeakPolarHBondContact O-CG 3.28Å; T643-M647 PolarHBondContact O-N 2.98Å; T643-M647 VanDerWaalsContact O-N 3.09Å; Y644-M647 WeakPolarHBondContact O-CA 3.28Å; Y644-M647 WeakPolarHBondContact O-CB 3.49Å; Y644-M647 PolarHBondContact O-N 3.26Å; A645-M647 VanDerWaalsContact C-N 3.32Å; A645-M647 PolarHBondContact O-N 3.49Å; M647-S650 PolarHBondContact O-N 2.97Å; M647-F651 WeakPolarHBondContact O-CB 3.47Å; M647-F651 PolarHBondContact O-N 2.92Å
648	V	88.4	Confident	86.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-42.4	177.8	175.6	0	0	0	0	111.4	V509 L513 V532 Y644 A645 S650 F651 V652 L664	V509-V648 HydrophobicContact CG1-CG1 4.32Å; V509-V648 HydrophobicContact CG1-CG2 4.23Å; L513-V648 HydrophobicContact CD1-CG1 4.22Å; L513-V648 HydrophobicContact CD2-CG1 4.28Å; V532-V648 HydrophobicContact CG1-CG1 4.4Å; Y644-V648 HydrophobicContact CD1-CG2 3.94Å; Y644-V648 HydrophobicContact CE1-CG2 3.69Å; Y644-V648 WeakPolarHBondContact O-CG2 3.44Å; Y644-V648 PolarHBondContact O-N 3.39Å; A645-V648 PolarHBondContact O-N 2.76Å; V648-S650 VanDerWaalsContact C-N 3.35Å; V648-S650 PolarHBondContact O-N 2.9Å; V648-F651 WeakPolarHBondContact O-CB 3.36Å; V648-F651 PolarHBondContact O-N 3.3Å; V648-V652 HydrophobicContact CG1-CG2 4.25Å; V648-V652 WeakPolarHBondContact O-CB 3.4Å; V648-V652 VanDerWaalsContact O-CG2 3.26Å; V648-V652 WeakPolarHBondContact O-CG2 3.49Å; V648-V652 PolarHBondContact O-N 3.43Å; V648-L664 HydrophobicContact CG1-CD1 4.02Å
649	I	88.9	Confident	86.2	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.138	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-45.2	176.4	-67.7	159.6	0	0	0	110.4	A645 F651 V652 D653 K661 L664 A668	A645-I649 WeakPolarHBondContact O-CB 3.47Å; A645-I649 WeakPolarHBondContact O-CD1 3.21Å; A645-I649 WeakPolarHBondContact O-CG1 3.45Å; A645-I649 PolarHBondContact O-N 3.05Å; I649-F651 VanDerWaalsContact C-N 3.34Å; I649-V652 PolarHBondContact O-N 3.48Å; I649-D653 WeakPolarHBondContact O-CB 3.4Å; I649-D653 PolarHBondContact O-N 3.34Å; I649-K661 HydrophobicContact CG2-CG 4.38Å; I649-L664 WeakPolarHBondContact CD1-O 3.47Å; I649-L664 HydrophobicContact CG1-CB 3.83Å; I649-A668 HydrophobicContact CD1-CB 4.46Å
650	S	84.2	Confident	86.5	Confident	47 Å²	47	38.8 Å²	38.8	33%	0.329	21%	0.21	S	C	.	.	H	α-helix	trans	-61.4	-42.5	175.4	-177	0	0	0	0	111.9	A646 M647 V648 D653 R654	A646-S650 WeakPolarHBondContact O-CB 3.29Å; A646-S650 PolarHBondContact O-N 3.34Å; M647-S650 PolarHBondContact O-N 2.97Å; V648-S650 VanDerWaalsContact C-N 3.35Å; V648-S650 PolarHBondContact O-N 2.9Å; S650-D653 PolarHBondContact O-N 2.92Å; S650-R654 PolarHBondContact O-N 3.22Å
651	F	88.8	Confident	87.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-49.6	176.5	-176.1	-105.1	0	0	0	111.9	L492 A495 M501 A506 V509 F510 L513 M647 V648 I649 D653 R654 L655	L492-F651 HydrophobicContact CD1-CE2 4.08Å; L492-F651 HydrophobicContact CD1-CZ 3.61Å; A495-F651 HydrophobicContact CB-CD2 3.58Å; A495-F651 HydrophobicContact CB-CE2 3.67Å; A495-F651 HydrophobicContact CB-CG 4.37Å; M501-F651 HydrophobicContact SD-CB 4.27Å; M501-F651 HydrophobicContact SD-CD2 4.22Å; M501-F651 HydrophobicContact SD-CG 4.26Å; A506-F651 HydrophobicContact CB-CE2 3.88Å; A506-F651 HydrophobicContact CB-CZ 4.16Å; V509-F651 HydrophobicContact CG1-CD1 3.91Å; V509-F651 HydrophobicContact CG1-CE1 4.03Å; F510-F651 HydrophobicContact CB-CE1 4.18Å; F510-F651 HydrophobicContact CB-CZ 4.18Å; F510-F651 HydrophobicContact CD2-CE1 4.36Å; F510-F651 HydrophobicContact CD2-CZ 4.38Å; L513-F651 HydrophobicContact CD1-CD1 4.22Å; L513-F651 HydrophobicContact CD1-CE1 4.46Å; M647-F651 WeakPolarHBondContact O-CB 3.47Å; M647-F651 PolarHBondContact O-N 2.92Å; V648-F651 WeakPolarHBondContact O-CB 3.36Å; V648-F651 PolarHBondContact O-N 3.3Å; I649-F651 VanDerWaalsContact C-N 3.34Å; F651-D653 PolarHBondContact O-N 3.4Å; F651-R654 PolarHBondContact O-N 3.33Å; F651-L655 HydrophobicContact CD1-CD1 3.77Å; F651-L655 HydrophobicContact CE1-CD1 3.45Å; F651-L655 VanDerWaalsContact CE1-CD1 3.45Å; F651-L655 HydrophobicContact CE1-CG 4.41Å; F651-L655 HydrophobicContact CZ-CD1 3.94Å; F651-L655 WeakPolarHBondContact O-CG 3.48Å; F651-L655 PolarHBondContact O-N 3.5Å
652	V	91.2	Very high	87.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-39.4	178.8	172.2	0	0	0	0	112	L513 V648 I649 L655 G656 W657 L660 K661 L664	L513-V652 HydrophobicContact CD1-CG2 3.48Å; L513-V652 VanDerWaalsContact CD1-CG2 3.48Å; L513-V652 HydrophobicContact CD2-CG2 4.4Å; V648-V652 HydrophobicContact CG1-CG2 4.25Å; V648-V652 WeakPolarHBondContact O-CB 3.4Å; V648-V652 VanDerWaalsContact O-CG2 3.26Å; V648-V652 WeakPolarHBondContact O-CG2 3.49Å; V648-V652 PolarHBondContact O-N 3.43Å; I649-V652 PolarHBondContact O-N 3.48Å; V652-L655 PolarHBondContact O-N 2.91Å; V652-G656 PolarHBondContact O-N 3.27Å; V652-W657 HydrophobicContact CG1-CB 3.75Å; V652-W657 WeakPolarHBondContact CG1-O 3.19Å; V652-W657 PolarHBondContact O-N 3.35Å; V652-W657 VanDerWaalsContact O-N 3.1Å; V652-L660 HydrophobicContact CG1-CB 3.83Å; V652-L660 HydrophobicContact CG1-CD2 4.19Å; V652-L660 HydrophobicContact CG1-CG 4.01Å; V652-L660 HydrophobicContact CG2-CD2 4.2Å; V652-K661 HydrophobicContact CG1-CB 4.01Å; V652-L664 HydrophobicContact CG2-CD1 4.25Å
653	D	88.7	Confident	87.4	Confident	63 Å²	63	47.1 Å²	47.1	34%	0.337	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-45	175.5	-166.4	27.3	0	0	0	111.2	I649 S650 F651 L655 G656 K661	I649-D653 WeakPolarHBondContact O-CB 3.4Å; I649-D653 PolarHBondContact O-N 3.34Å; S650-D653 PolarHBondContact O-N 2.92Å; F651-D653 PolarHBondContact O-N 3.4Å; D653-L655 VanDerWaalsContact C-N 3.32Å; D653-L655 PolarHBondContact O-N 3.12Å; D653-G656 WeakPolarHBondContact O-CA 3.02Å; D653-G656 PolarHBondContact O-N 3.41Å; D653-K661 HydrophobicContact CB-CD 3.95Å; D653-K661 HydrophobicContact CB-CG 4.3Å; D653-K661 VanDerWaalsContact OD1-CD 3.28Å; D653-K661 WeakPolarHBondContact OD1-CD 3.11Å; D653-K661 VanDerWaalsContact OD1-CE 3.31Å; D653-K661 WeakPolarHBondContact OD1-CE 3.47Å; D653-K661 IonicContact OD1-NZ 3.12Å; D653-K661 PolarHBondContact OD1-NZ 2.68Å; D653-K661 WeakPolarHBondContact OD2-CE 3.34Å; D653-K661 IonicContact OD2-NZ 3.51Å; D653-K661 PolarHBondContact OD2-NZ 3.37Å
654	R	85.8	Confident	88	Confident	124 Å²	124	44.5 Å²	44.5	47%	0.468	24%	0.238	S	C	.	.	H	α-helix	trans	-70.8	-27.5	-179.5	-151.6	68.7	176	126.4	-6.4	113.5	Q491 A495 S650 F651 G656	Q491-R654 PolarHBondContact NE2-O 3.02Å; A495-R654 HydrophobicContact CB-CB 3.84Å; A495-R654 HydrophobicContact CB-CG 4.27Å; S650-R654 PolarHBondContact O-N 3.22Å; F651-R654 PolarHBondContact O-N 3.33Å; R654-G656 PolarHBondContact O-N 3.22Å
655	L	89.5	Confident	88.2	Confident	10 Å²	10	47.1 Å²	47.1	5%	0.052	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.8	168	-68.3	174.8	0	0	0	113.5	Q491 L492 A495 F510 F651 V652 D653 W657	Q491-L655 HydrophobicContact CG-CD2 4.46Å; Q491-L655 PolarHBondContact NE2-O 3.06Å; L492-L655 HydrophobicContact CD1-CD2 4.45Å; A495-L655 HydrophobicContact CB-CD2 3.97Å; A495-L655 HydrophobicContact CB-CG 3.99Å; F510-L655 HydrophobicContact CD2-CD1 3.78Å; F510-L655 HydrophobicContact CD2-CD2 4.41Å; F510-L655 HydrophobicContact CE2-CD1 4.04Å; F510-L655 HydrophobicContact CE2-CD2 4.21Å; F651-L655 HydrophobicContact CD1-CD1 3.77Å; F651-L655 HydrophobicContact CE1-CD1 3.45Å; F651-L655 VanDerWaalsContact CE1-CD1 3.45Å; F651-L655 HydrophobicContact CE1-CG 4.41Å; F651-L655 HydrophobicContact CZ-CD1 3.94Å; F651-L655 WeakPolarHBondContact O-CG 3.48Å; F651-L655 PolarHBondContact O-N 3.5Å; V652-L655 PolarHBondContact O-N 2.91Å; D653-L655 VanDerWaalsContact C-N 3.32Å; D653-L655 PolarHBondContact O-N 3.12Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 HydrophobicContact CB-CD2 4.02Å; L655-W657 HydrophobicContact CB-CG 4.07Å; L655-W657 HydrophobicContact CD1-CD2 4.2Å; L655-W657 HydrophobicContact CD1-CE3 4.03Å; L655-W657 HydrophobicContact CD1-CH2 3.91Å; L655-W657 HydrophobicContact CD1-CZ2 4.05Å; L655-W657 HydrophobicContact CD1-CZ3 3.88Å; L655-W657 VanDerWaalsContact O-CD1 3.24Å
656	G	88	Confident	88.1	Confident	28 Å²	28	47.7 Å²	47.7	29%	0.289	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	22.5	-178.8	0	0	0	0	0	113.2	V652 D653 R654 F658	V652-G656 PolarHBondContact O-N 3.27Å; D653-G656 WeakPolarHBondContact O-CA 3.02Å; D653-G656 PolarHBondContact O-N 3.41Å; R654-G656 PolarHBondContact O-N 3.22Å; G656-F658 VanDerWaalsContact C-N 3.34Å; G656-F658 VanDerWaalsContact O-CD2 3.28Å; G656-F658 WeakPolarHBondContact O-CD2 3.27Å; G656-F658 WeakPolarHBondContact O-CE2 3.48Å; G656-F658 PolarHBondContact O-N 3.4Å; G656-F658 VanDerWaalsContact O-N 3.17Å
657	W	89.1	Confident	88.3	Confident	48 Å²	48	45.7 Å²	45.7	18%	0.182	25%	0.247	C	C	.	.			trans	-91.7	66.4	-176.7	-67.4	1.2	0	0	0	111.2	F510 L513 V652 L655 S659 L660 K661	F510-W657 AromaticContact CD2-CH2 3.72Å; F510-W657 HydrophobicContact CD2-CH2 3.72Å; F510-W657 HydrophobicContact CD2-CZ2 4.19Å; F510-W657 AromaticContact CE2-CH2 3.47Å; F510-W657 HydrophobicContact CE2-CH2 3.47Å; F510-W657 VanDerWaalsContact CE2-CH2 3.47Å; F510-W657 AromaticContact CE2-CZ2 3.49Å; F510-W657 HydrophobicContact CE2-CZ2 3.49Å; F510-W657 VanDerWaalsContact CE2-CZ2 3.49Å; F510-W657 HydrophobicContact CZ-CH2 4.1Å; F510-W657 HydrophobicContact CZ-CZ2 4.04Å; L513-W657 HydrophobicContact CB-CZ3 3.72Å; L513-W657 HydrophobicContact CD1-CZ3 4.29Å; V652-W657 HydrophobicContact CG1-CB 3.75Å; V652-W657 WeakPolarHBondContact CG1-O 3.19Å; V652-W657 PolarHBondContact O-N 3.35Å; V652-W657 VanDerWaalsContact O-N 3.1Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 HydrophobicContact CB-CD2 4.02Å; L655-W657 HydrophobicContact CB-CG 4.07Å; L655-W657 HydrophobicContact CD1-CD2 4.2Å; L655-W657 HydrophobicContact CD1-CE3 4.03Å; L655-W657 HydrophobicContact CD1-CH2 3.91Å; L655-W657 HydrophobicContact CD1-CZ2 4.05Å; L655-W657 HydrophobicContact CD1-CZ3 3.88Å; L655-W657 VanDerWaalsContact O-CD1 3.24Å; W657-S659 PolarHBondContact O-N 2.9Å; W657-L660 HydrophobicContact CB-CB 4.39Å; W657-L660 HydrophobicContact CE3-CD2 3.95Å; W657-L660 HydrophobicContact CZ3-CD2 4.48Å; W657-L660 PolarHBondContact O-N 2.89Å; W657-L660 VanDerWaalsContact O-N 3.11Å; W657-K661 PolarHBondContact O-N 3.3Å
658	F	87.5	Confident	88.5	Confident	135 Å²	135	44 Å²	44	59%	0.592	24%	0.24	S	C	*	.	H	α-helix	trans	-54.9	-42.4	-171.2	-57.5	-70.9	0	0	0	114.6	G656 L660 K661 N662	G656-F658 VanDerWaalsContact C-N 3.34Å; G656-F658 VanDerWaalsContact O-CD2 3.28Å; G656-F658 WeakPolarHBondContact O-CD2 3.27Å; G656-F658 WeakPolarHBondContact O-CE2 3.48Å; G656-F658 PolarHBondContact O-N 3.4Å; G656-F658 VanDerWaalsContact O-N 3.17Å; F658-L660 PolarHBondContact O-N 3.33Å; F658-K661 PolarHBondContact O-N 3Å; F658-N662 VanDerWaalsContact O-CG 3.24Å; F658-N662 PolarHBondContact O-N 3.24Å
659	S	87.9	Confident	88.5	Confident	98 Å²	98	46.9 Å²	46.9	69%	0.685	25%	0.254	S	S	*	.	H	α-helix	trans	-62.6	-42.6	179.2	-53.6	0	0	0	0	112	W657 N662 L663	W657-S659 PolarHBondContact O-N 2.9Å; S659-N662 PolarHBondContact O-N 3.33Å; S659-L663 WeakPolarHBondContact O-CG 3.35Å; S659-L663 PolarHBondContact O-N 3.17Å; S659-L663 VanDerWaalsContact O-N 3.16Å
660	L	89.4	Confident	88.6	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-73.1	-37.8	179.5	-172.3	59.7	0	0	0	111.4	L513 V652 W657 F658 N662 L663 L664	L513-L660 HydrophobicContact CB-CD2 4.05Å; L513-L660 HydrophobicContact CD2-CD2 3.79Å; L513-L660 HydrophobicContact CG-CD2 4.36Å; V652-L660 HydrophobicContact CG1-CB 3.83Å; V652-L660 HydrophobicContact CG1-CD2 4.19Å; V652-L660 HydrophobicContact CG1-CG 4.01Å; V652-L660 HydrophobicContact CG2-CD2 4.2Å; W657-L660 HydrophobicContact CB-CB 4.39Å; W657-L660 HydrophobicContact CE3-CD2 3.95Å; W657-L660 HydrophobicContact CZ3-CD2 4.48Å; W657-L660 PolarHBondContact O-N 2.89Å; W657-L660 VanDerWaalsContact O-N 3.11Å; F658-L660 PolarHBondContact O-N 3.33Å; L660-N662 VanDerWaalsContact C-N 3.28Å; L660-N662 PolarHBondContact O-N 3.05Å; L660-L663 HydrophobicContact CD1-CD1 4.49Å; L660-L663 PolarHBondContact O-N 3.17Å; L660-L664 HydrophobicContact CD1-CD1 4.37Å; L660-L664 HydrophobicContact CD1-CG 4.37Å; L660-L664 HydrophobicContact CG-CD1 4.12Å; L660-L664 HydrophobicContact CG-CG 4.48Å; L660-L664 WeakPolarHBondContact O-CG 3.16Å; L660-L664 PolarHBondContact O-N 2.97Å
661	K	90.9	Very high	89	Confident	57 Å²	57	43.6 Å²	43.6	25%	0.248	23%	0.232	C	C	.	.	H	α-helix	trans	-55.7	-45.3	171.4	-177.7	-159.4	-176.1	169.9	0	110.9	I649 V652 D653 W657 F658 L663 L664 S665	I649-K661 HydrophobicContact CG2-CG 4.38Å; V652-K661 HydrophobicContact CG1-CB 4.01Å; D653-K661 HydrophobicContact CB-CD 3.95Å; D653-K661 HydrophobicContact CB-CG 4.3Å; D653-K661 VanDerWaalsContact OD1-CD 3.28Å; D653-K661 WeakPolarHBondContact OD1-CD 3.11Å; D653-K661 VanDerWaalsContact OD1-CE 3.31Å; D653-K661 WeakPolarHBondContact OD1-CE 3.47Å; D653-K661 IonicContact OD1-NZ 3.12Å; D653-K661 PolarHBondContact OD1-NZ 2.68Å; D653-K661 WeakPolarHBondContact OD2-CE 3.34Å; D653-K661 IonicContact OD2-NZ 3.51Å; D653-K661 PolarHBondContact OD2-NZ 3.37Å; W657-K661 PolarHBondContact O-N 3.3Å; F658-K661 PolarHBondContact O-N 3Å; K661-L663 PolarHBondContact O-N 3.05Å; K661-L664 CarbonylContact O-C 3.41Å; K661-L664 PolarHBondContact O-N 3.46Å; K661-S665 WeakPolarHBondContact O-CB 3.36Å; K661-S665 PolarHBondContact O-N 3.16Å
662	N	89	Confident	88.9	Confident	113 Å²	113	43.9 Å²	43.9	60%	0.604	24%	0.235	S	C	*	.	H	α-helix	trans	-65.4	-38	-179.9	-71.3	-12	0	0	0	112.2	F658 S659 L660 S665	F658-N662 VanDerWaalsContact O-CG 3.24Å; F658-N662 PolarHBondContact O-N 3.24Å; S659-N662 PolarHBondContact O-N 3.33Å; L660-N662 VanDerWaalsContact C-N 3.28Å; L660-N662 PolarHBondContact O-N 3.05Å; N662-S665 WeakPolarHBondContact O-CB 3.48Å; N662-S665 PolarHBondContact O-N 2.94Å
663	L	90.2	Very high	88.8	Confident	68 Å²	68	47.5 Å²	47.5	36%	0.356	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-38.8	174.3	-69.8	172.6	0	0	0	112.3	L522 L528 S659 L660 K661 S665 F667	L522-L663 HydrophobicContact CD1-CD1 4.42Å; L522-L663 HydrophobicContact CD1-CD2 4.3Å; L522-L663 HydrophobicContact CD2-CD1 4.35Å; L522-L663 HydrophobicContact CD2-CD2 4.22Å; L528-L663 HydrophobicContact CD1-CB 4.46Å; L528-L663 HydrophobicContact CD2-CB 4.36Å; S659-L663 WeakPolarHBondContact O-CG 3.35Å; S659-L663 PolarHBondContact O-N 3.17Å; S659-L663 VanDerWaalsContact O-N 3.16Å; L660-L663 HydrophobicContact CD1-CD1 4.49Å; L660-L663 PolarHBondContact O-N 3.17Å; K661-L663 PolarHBondContact O-N 3.05Å; L663-S665 VanDerWaalsContact C-N 3.34Å; L663-F667 WeakPolarHBondContact O-CE2 3.49Å
664	L	90.7	Very high	88.9	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-84.4	-9.5	179.7	-62.2	179.2	0	0	0	113.2	L513 L528 V532 V648 I649 V652 L660 K661 F667	L513-L664 HydrophobicContact CD2-CD1 4.33Å; L528-L664 HydrophobicContact CB-CD2 4.31Å; L528-L664 HydrophobicContact CD2-CD2 4.12Å; V532-L664 HydrophobicContact CG1-CD1 4.44Å; V532-L664 HydrophobicContact CG1-CD2 3.88Å; V648-L664 HydrophobicContact CG1-CD1 4.02Å; I649-L664 WeakPolarHBondContact CD1-O 3.47Å; I649-L664 HydrophobicContact CG1-CB 3.83Å; V652-L664 HydrophobicContact CG2-CD1 4.25Å; L660-L664 HydrophobicContact CD1-CD1 4.37Å; L660-L664 HydrophobicContact CD1-CG 4.37Å; L660-L664 HydrophobicContact CG-CD1 4.12Å; L660-L664 HydrophobicContact CG-CG 4.48Å; L660-L664 WeakPolarHBondContact O-CG 3.16Å; L660-L664 PolarHBondContact O-N 2.97Å; K661-L664 CarbonylContact O-C 3.41Å; K661-L664 PolarHBondContact O-N 3.46Å; L664-F667 WeakPolarHBondContact O-CB 3.36Å; L664-F667 WeakPolarHBondContact O-CD2 3.46Å; L664-F667 PolarHBondContact O-N 2.63Å
665	S	87.1	Confident	89.2	Confident	67 Å²	67	39 Å²	39	47%	0.469	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	137.9	-177.9	-164	0	0	0	0	110.9	K661 N662 L663 F667	K661-S665 WeakPolarHBondContact O-CB 3.36Å; K661-S665 PolarHBondContact O-N 3.16Å; N662-S665 WeakPolarHBondContact O-CB 3.48Å; N662-S665 PolarHBondContact O-N 2.94Å; L663-S665 VanDerWaalsContact C-N 3.34Å; S665-F667 VanDerWaalsContact C-N 3.27Å; S665-F667 PolarHBondContact O-N 3.11Å
666	G	86.2	Confident	89.4	Confident	12 Å²	12	42.1 Å²	42.1	12%	0.124	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	-14.3	-177.2	0	0	0	0	0	114.9	A668 E669 R670	G666-A668 VanDerWaalsContact C-N 3.25Å; G666-A668 PolarHBondContact O-N 3.11Å; G666-E669 WeakPolarHBondContact CA-OE2 3.27Å; G666-E669 PolarHBondContact O-N 3.22Å; G666-E669 VanDerWaalsContact O-OE2 3.08Å; G666-R670 WeakPolarHBondContact O-CB 3.45Å; G666-R670 WeakPolarHBondContact O-CG 3.45Å; G666-R670 PolarHBondContact O-N 3.46Å
667	F	89.7	Confident	89.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-26.7	-177.5	-89	-88.4	0	0	0	113.7	D525 L528 V529 L663 L664 S665 L671	D525-F667 HydrophobicContact CB-CE1 4.22Å; D525-F667 HydrophobicContact CB-CZ 3.9Å; L528-F667 HydrophobicContact CB-CE1 4.18Å; L528-F667 HydrophobicContact CB-CE2 3.88Å; L528-F667 HydrophobicContact CB-CZ 3.54Å; L528-F667 HydrophobicContact CD1-CE2 3.74Å; L528-F667 HydrophobicContact CD1-CZ 3.86Å; L528-F667 HydrophobicContact CG-CE2 4.46Å; L528-F667 HydrophobicContact CG-CZ 4.35Å; V529-F667 HydrophobicContact CG2-CD1 4.25Å; V529-F667 HydrophobicContact CG2-CE1 3.68Å; L663-F667 WeakPolarHBondContact O-CE2 3.49Å; L664-F667 WeakPolarHBondContact O-CB 3.36Å; L664-F667 WeakPolarHBondContact O-CD2 3.46Å; L664-F667 PolarHBondContact O-N 2.63Å; S665-F667 VanDerWaalsContact C-N 3.27Å; S665-F667 PolarHBondContact O-N 3.11Å; F667-L671 VanDerWaalsContact O-CB 3.24Å; F667-L671 WeakPolarHBondContact O-CB 3.18Å; F667-L671 WeakPolarHBondContact O-CD1 3.45Å; F667-L671 VanDerWaalsContact O-CG 3.29Å; F667-L671 WeakPolarHBondContact O-CG 3.17Å; F667-L671 PolarHBondContact O-N 3.28Å
668	A	88	Confident	89.6	Confident	9 Å²	9	47.5 Å²	47.5	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-45.4	175.3	0	0	0	0	0	111	S642 A645 A646 I649 G666 A672	S642-A668 VanDerWaalsContact CB-O 3.24Å; S642-A668 WeakPolarHBondContact CB-O 3.38Å; S642-A668 PolarHBondContact OG-O 2.99Å; A645-A668 HydrophobicContact CB-CB 4.47Å; A646-A668 HydrophobicContact CB-CB 3.99Å; I649-A668 HydrophobicContact CD1-CB 4.46Å; G666-A668 VanDerWaalsContact C-N 3.25Å; G666-A668 PolarHBondContact O-N 3.11Å; A668-A672 WeakPolarHBondContact O-CB 3.39Å; A668-A672 PolarHBondContact O-N 3.15Å
669	E	86.9	Confident	89.8	Confident	61 Å²	61	41.1 Å²	41.1	29%	0.285	22%	0.224	S	C	.	.	H	α-helix	trans	-72.3	-43.9	177.2	-58.8	84.1	172.1	0	0	111.2	G666 L671 A672 F673 V683	G666-E669 WeakPolarHBondContact CA-OE2 3.27Å; G666-E669 PolarHBondContact O-N 3.22Å; G666-E669 VanDerWaalsContact O-OE2 3.08Å; E669-L671 VanDerWaalsContact C-N 3.34Å; E669-L671 PolarHBondContact O-N 3.46Å; E669-A672 PolarHBondContact O-N 3.22Å; E669-A672 VanDerWaalsContact O-N 3.13Å; E669-F673 WeakPolarHBondContact O-CD2 3.5Å; E669-F673 PolarHBondContact O-N 3.31Å; E669-V683 HydrophobicContact CB-CG2 4.44Å
670	R	92.6	Very high	89.8	Confident	3 Å²	3	37.6 Å²	37.6	1%	0.011	20%	0.198	C	C	.	.	H	α-helix	trans	-57.8	-45.7	177.3	-68.7	173.5	67.5	179.3	5.6	112.1	D525 V615 G666 G674 V675 T680	D525-R670 IonicContact OD1-NH1 2.91Å; D525-R670 IonicContact OD2-CZ 3.81Å; D525-R670 IonicContact OD2-NH1 3.37Å; D525-R670 PolarHBondContact OD2-NH1 3.13Å; D525-R670 IonicContact OD2-NH2 3.94Å; D525-R670 PolarHBondContact OD2-NH2 3.19Å; V615-R670 HydrophobicContact CG1-CB 4.48Å; G666-R670 WeakPolarHBondContact O-CB 3.45Å; G666-R670 WeakPolarHBondContact O-CG 3.45Å; G666-R670 PolarHBondContact O-N 3.46Å; R670-G674 VanDerWaalsContact O-CA 3.23Å; R670-G674 WeakPolarHBondContact O-CA 3.49Å; R670-G674 PolarHBondContact O-N 3.47Å; R670-V675 VanDerWaalsContact CB-O 3.27Å; R670-V675 WeakPolarHBondContact CB-O 3.38Å; R670-V675 HydrophobicContact CG-CG2 4.49Å; R670-V675 WeakPolarHBondContact CG-O 3.3Å; R670-V675 PolarHBondContact NE-O 3.15Å; R670-V675 PolarHBondContact O-N 3Å; R670-T680 HydrophobicContact CG-CG2 3.4Å
671	L	91.1	Very high	89.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-44.7	174.5	-73.9	165	0	0	0	110.5	V532 L611 V615 Q638 A641 A645 F667 E669 F673 G674	V532-L671 HydrophobicContact CG2-CD1 3.72Å; L611-L671 HydrophobicContact CB-CD2 4.06Å; L611-L671 HydrophobicContact CD2-CD2 4.29Å; V615-L671 HydrophobicContact CG2-CD2 3.66Å; V615-L671 HydrophobicContact CG2-CG 4.16Å; Q638-L671 VanDerWaalsContact CD-O 3.23Å; Q638-L671 WeakPolarHBondContact CG-O 3.48Å; Q638-L671 PolarHBondContact NE2-O 2.72Å; A641-L671 HydrophobicContact CB-CD1 4.18Å; A641-L671 HydrophobicContact CB-CD2 4.48Å; A645-L671 HydrophobicContact CB-CD1 3.89Å; F667-L671 VanDerWaalsContact O-CB 3.24Å; F667-L671 WeakPolarHBondContact O-CB 3.18Å; F667-L671 WeakPolarHBondContact O-CD1 3.45Å; F667-L671 VanDerWaalsContact O-CG 3.29Å; F667-L671 WeakPolarHBondContact O-CG 3.17Å; F667-L671 PolarHBondContact O-N 3.28Å; E669-L671 VanDerWaalsContact C-N 3.34Å; E669-L671 PolarHBondContact O-N 3.46Å; L671-F673 VanDerWaalsContact C-N 3.28Å; L671-F673 PolarHBondContact O-N 2.7Å; L671-G674 PolarHBondContact O-N 2.93Å
672	A	87.5	Confident	89.4	Confident	7 Å²	7	38 Å²	38	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-40.9	-177.3	0	0	0	0	0	113.1	T114 Q639 S642 A668 E669	T114-A672 HydrophobicContact CG2-CB 3.91Å; Q639-A672 PolarHBondContact NE2-O 2.74Å; S642-A672 WeakPolarHBondContact OG-CB 3.27Å; A668-A672 WeakPolarHBondContact O-CB 3.39Å; A668-A672 PolarHBondContact O-N 3.15Å; E669-A672 PolarHBondContact O-N 3.22Å; E669-A672 VanDerWaalsContact O-N 3.13Å
673	F	89.1	Confident	89.3	Confident	75 Å²	75	32.8 Å²	32.8	33%	0.329	17%	0.173	S	C	.	.	H	α-helix	trans	-104.1	-12.2	-174.5	-66	-76.8	0	0	0	114.2	E669 L671 V675 V683	E669-F673 WeakPolarHBondContact O-CD2 3.5Å; E669-F673 PolarHBondContact O-N 3.31Å; L671-F673 VanDerWaalsContact C-N 3.28Å; L671-F673 PolarHBondContact O-N 2.7Å; F673-V675 HydrophobicContact CB-CG1 4.09Å; F673-V675 HydrophobicContact CB-CG2 4.19Å; F673-V683 HydrophobicContact CB-CB 4.4Å; F673-V683 HydrophobicContact CB-CG1 4.12Å; F673-V683 HydrophobicContact CD1-CB 4.41Å; F673-V683 HydrophobicContact CD2-CB 3.64Å; F673-V683 HydrophobicContact CD2-CG1 4.3Å; F673-V683 HydrophobicContact CD2-CG2 3.69Å; F673-V683 HydrophobicContact CE2-CB 3.93Å; F673-V683 HydrophobicContact CE2-CG2 4.09Å; F673-V683 HydrophobicContact CG-CB 3.9Å; F673-V683 HydrophobicContact CG-CG1 4.1Å; F673-V683 HydrophobicContact CG-CG2 4.32Å; F673-V683 HydrophobicContact CZ-CB 4.41Å
674	G	90.8	Very high	88.9	Confident	10 Å²	10	33 Å²	33	10%	0.103	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	56.5	-176	0	0	0	0	0	111.3	L614 Q638 R670 L671	L614-G674 CarbonylContact O-C 3.6Å; L614-G674 WeakPolarHBondContact O-CA 3.33Å; Q638-G674 VanDerWaalsContact NE2-N 3.2Å; R670-G674 VanDerWaalsContact O-CA 3.23Å; R670-G674 WeakPolarHBondContact O-CA 3.49Å; R670-G674 PolarHBondContact O-N 3.47Å; L671-G674 PolarHBondContact O-N 2.93Å
675	V	92.6	Very high	88.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.			trans	-133.3	153.3	-174.5	-63.7	0	0	0	0	113.4	V615 R670 F673 L679 V683	V615-V675 CarbonylContact O-C 3.57Å; R670-V675 VanDerWaalsContact CB-O 3.27Å; R670-V675 WeakPolarHBondContact CB-O 3.38Å; R670-V675 HydrophobicContact CG-CG2 4.49Å; R670-V675 WeakPolarHBondContact CG-O 3.3Å; R670-V675 PolarHBondContact NE-O 3.15Å; R670-V675 PolarHBondContact O-N 3Å; F673-V675 HydrophobicContact CB-CG1 4.09Å; F673-V675 HydrophobicContact CB-CG2 4.19Å; V675-L679 HydrophobicContact CB-CB 4.01Å; V675-L679 HydrophobicContact CB-CD1 4.05Å; V675-L679 HydrophobicContact CG1-CB 4.38Å; V675-L679 HydrophobicContact CG1-CD1 3.96Å; V675-L679 HydrophobicContact CG2-CB 4.27Å; V675-V683 HydrophobicContact CG1-CG1 4.19Å; V675-V683 HydrophobicContact CG2-CG1 4.29Å; V675-V683 HydrophobicContact CG2-CG2 4.42Å
676	K	93.7	Very high	87.9	Confident	74 Å²	74	33.7 Å²	33.7	32%	0.322	17%	0.171	S	C	.	.			trans	-69	166.2	168.8	-69.3	179.5	-172.7	-147.3	0	112	V615 E616 E617 D678 L679	V615-K676 WeakPolarHBondContact O-CG 3.29Å; V615-K676 PolarHBondContact O-N 3.18Å; E616-K676 WeakPolarHBondContact OE2-CE 3.29Å; E616-K676 IonicContact OE2-NZ 2.93Å; E616-K676 PolarHBondContact OE2-NZ 3.38Å; E617-K676 HydrophobicContact CG-CG 4.47Å; E617-K676 WeakPolarHBondContact OE1-CB 3.47Å; E617-K676 VanDerWaalsContact OE1-CD 3.27Å; E617-K676 WeakPolarHBondContact OE1-CD 3.28Å; E617-K676 WeakPolarHBondContact OE1-CG 3.24Å; E617-K676 PolarHBondContact OE1-N 2.87Å; K676-D678 VanDerWaalsContact C-N 3.28Å; K676-D678 WeakPolarHBondContact CB-OD1 3.49Å; K676-D678 PolarHBondContact O-N 3.42Å; K676-L679 PolarHBondContact O-N 2.91Å
677	Q	90.2	Very high	87.3	Confident	122 Å²	122	33.7 Å²	33.7	57%	0.57	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-60.7	-34.9	-173.6	-174.6	178.4	3.5	0	0	113.3	L679 T680	Q677-L679 PolarHBondContact O-N 3.16Å; Q677-T680 WeakPolarHBondContact O-CB 3.46Å; Q677-T680 WeakPolarHBondContact O-CG2 3.48Å; Q677-T680 PolarHBondContact O-N 3.31Å; Q677-T680 PolarHBondContact O-OG1 3.28Å
678	D	90.6	Very high	86.9	Confident	68 Å²	68	33.9 Å²	33.9	36%	0.364	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-64.1	-23.1	-179.3	59.8	-23.8	0	0	0	113.9	K676 R694 H697	K676-D678 VanDerWaalsContact C-N 3.28Å; K676-D678 WeakPolarHBondContact CB-OD1 3.49Å; K676-D678 PolarHBondContact O-N 3.42Å; D678-R694 IonicContact OD1-CZ 3.34Å; D678-R694 IonicContact OD1-NH1 2.66Å; D678-R694 IonicContact OD1-NH2 3.75Å; D678-R694 PolarHBondContact OD1-NH2 3.49Å; D678-R694 IonicContact OD2-CZ 3.51Å; D678-R694 IonicContact OD2-NH1 3.7Å; D678-R694 PolarHBondContact OD2-NH1 3.15Å; D678-R694 IonicContact OD2-NH2 3.02Å; D678-R694 PolarHBondContact OD2-NH2 3.41Å; D678-R694 VanDerWaalsContact OD2-NH2 3.15Å; D678-H697 IonicContact OD2-CE1 2.71Å; D678-H697 IonicContact OD2-NE2 3.82Å
679	L	91.3	Very high	86.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-93.4	-5.1	179.5	-58.5	-175.4	0	0	0	114.4	V675 K676 Q677 E681 L682 V683 A693 R694 H697	V675-L679 HydrophobicContact CB-CB 4.01Å; V675-L679 HydrophobicContact CB-CD1 4.05Å; V675-L679 HydrophobicContact CG1-CB 4.38Å; V675-L679 HydrophobicContact CG1-CD1 3.96Å; V675-L679 HydrophobicContact CG2-CB 4.27Å; K676-L679 PolarHBondContact O-N 2.91Å; Q677-L679 PolarHBondContact O-N 3.16Å; L679-E681 PolarHBondContact O-N 2.9Å; L679-E681 VanDerWaalsContact O-N 3.16Å; L679-L682 HydrophobicContact CD2-CD1 4.29Å; L679-L682 PolarHBondContact O-N 3.4Å; L679-V683 PolarHBondContact O-N 3.42Å; L679-A693 HydrophobicContact CB-CB 4.2Å; L679-A693 HydrophobicContact CD1-CB 4.12Å; L679-A693 HydrophobicContact CD2-CB 4.3Å; L679-A693 HydrophobicContact CG-CB 4.44Å; L679-R694 HydrophobicContact CD1-CB 3.97Å; L679-H697 HydrophobicContact CD2-CB 3.62Å
680	T	87.1	Confident	86.4	Confident	25 Å²	25	33.3 Å²	33.3	15%	0.153	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.7	-173.5	49.8	0	0	0	0	113.9	R670 Q677 V683 Q684	R670-T680 HydrophobicContact CG-CG2 3.4Å; Q677-T680 WeakPolarHBondContact O-CB 3.46Å; Q677-T680 WeakPolarHBondContact O-CG2 3.48Å; Q677-T680 PolarHBondContact O-N 3.31Å; Q677-T680 PolarHBondContact O-OG1 3.28Å; T680-V683 WeakPolarHBondContact O-CG2 3.45Å; T680-Q684 WeakPolarHBondContact O-CG 3.39Å; T680-Q684 PolarHBondContact O-NE2 3.28Å
681	E	86	Confident	85.8	Confident	80 Å²	80	39.2 Å²	39.2	37%	0.374	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-39.4	175.8	-62.9	-164.8	170.1	0	0	112.6	L679 Q684 V704	L679-E681 PolarHBondContact O-N 2.9Å; L679-E681 VanDerWaalsContact O-N 3.16Å; E681-Q684 WeakPolarHBondContact O-CB 2.95Å; E681-Q684 PolarHBondContact O-N 3.32Å; E681-V704 HydrophobicContact CB-CG2 3.89Å; E681-V704 WeakPolarHBondContact O-CG2 3.44Å
682	L	86.9	Confident	85.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-71	-39.4	-173.9	-65.4	-176.4	0	0	0	112.1	L679 Q684 I685 A693 F696 H697 L707	L679-L682 HydrophobicContact CD2-CD1 4.29Å; L679-L682 PolarHBondContact O-N 3.4Å; L682-Q684 PolarHBondContact O-N 3.18Å; L682-I685 WeakPolarHBondContact O-CB 3.38Å; L682-I685 PolarHBondContact O-N 3.27Å; L682-I685 VanDerWaalsContact O-N 3.09Å; L682-A693 HydrophobicContact CB-CB 3.88Å; L682-A693 HydrophobicContact CD1-CB 4.29Å; L682-A693 WeakPolarHBondContact CD1-O 3.43Å; L682-F696 HydrophobicContact CD1-CB 4.11Å; L682-H697 HydrophobicContact CD1-CB 4.35Å; L682-L707 HydrophobicContact CD2-CD1 3.39Å
683	V	87.2	Confident	85.4	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.03	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-69.6	-7.5	178.1	-61.3	0	0	0	0	113.5	E669 F673 V675 L679 T680 I685 A693	E669-V683 HydrophobicContact CB-CG2 4.44Å; F673-V683 HydrophobicContact CB-CB 4.4Å; F673-V683 HydrophobicContact CB-CG1 4.12Å; F673-V683 HydrophobicContact CD1-CB 4.41Å; F673-V683 HydrophobicContact CD2-CB 3.64Å; F673-V683 HydrophobicContact CD2-CG1 4.3Å; F673-V683 HydrophobicContact CD2-CG2 3.69Å; F673-V683 HydrophobicContact CE2-CB 3.93Å; F673-V683 HydrophobicContact CE2-CG2 4.09Å; F673-V683 HydrophobicContact CG-CB 3.9Å; F673-V683 HydrophobicContact CG-CG1 4.1Å; F673-V683 HydrophobicContact CG-CG2 4.32Å; F673-V683 HydrophobicContact CZ-CB 4.41Å; V675-V683 HydrophobicContact CG1-CG1 4.19Å; V675-V683 HydrophobicContact CG2-CG1 4.29Å; V675-V683 HydrophobicContact CG2-CG2 4.42Å; L679-V683 PolarHBondContact O-N 3.42Å; T680-V683 WeakPolarHBondContact O-CG2 3.45Å; V683-I685 PolarHBondContact O-N 2.71Å; V683-A693 HydrophobicContact CG1-CB 3.84Å
684	Q	81.5	Confident	85.4	Confident	73 Å²	73	39.8 Å²	39.8	34%	0.341	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-71.8	-17	170.1	-65.2	171.9	7.4	0	0	112.2	T680 E681 L682 L747	T680-Q684 WeakPolarHBondContact O-CG 3.39Å; T680-Q684 PolarHBondContact O-NE2 3.28Å; E681-Q684 WeakPolarHBondContact O-CB 2.95Å; E681-Q684 PolarHBondContact O-N 3.32Å; L682-Q684 PolarHBondContact O-N 3.18Å; Q684-L747 HydrophobicContact CB-CD1 3.86Å
685	I	81.5	Confident	85.1	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	22%	0.224	C	C	.	.	S	Bend	trans	-83.9	125.7	178.7	-60.4	172.3	0	0	0	109.4	L682 V683 G687 I688 V704 L707 V740 Q743 A744	L682-I685 WeakPolarHBondContact O-CB 3.38Å; L682-I685 PolarHBondContact O-N 3.27Å; L682-I685 VanDerWaalsContact O-N 3.09Å; V683-I685 PolarHBondContact O-N 2.71Å; I685-G687 PolarHBondContact O-N 3.26Å; I685-I688 HydrophobicContact CB-CB 4.48Å; I685-I688 HydrophobicContact CB-CD1 3.85Å; I685-I688 HydrophobicContact CB-CG1 4.12Å; I685-I688 HydrophobicContact CD1-CD1 4.02Å; I685-I688 HydrophobicContact CG2-CD1 3.84Å; I685-I688 HydrophobicContact CG2-CG1 4.02Å; I685-I688 PolarHBondContact O-N 2.88Å; I685-I688 VanDerWaalsContact O-N 3.13Å; I685-V704 HydrophobicContact CD1-CG2 4.21Å; I685-V704 HydrophobicContact CG1-CG2 4.47Å; I685-L707 HydrophobicContact CD1-CD1 3.82Å; I685-V740 HydrophobicContact CG2-CG1 4.36Å; I685-Q743 HydrophobicContact CG2-CB 3.85Å; I685-A744 HydrophobicContact CD1-CB 3.95Å
686	D	75.2	Confident	84.9	Confident	77 Å²	77	47.1 Å²	47.1	41%	0.412	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	135.1	177.5	-166.3	23.2	0	0	0	111.6	R91	R91-D686 IonicContact NH2-OD1 2.75Å
687	G	74.2	Confident	84.7	Confident	11 Å²	11	46.4 Å²	46.4	11%	0.113	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-7	-175.6	0	0	0	0	0	115.9	I685 A726	I685-G687 PolarHBondContact O-N 3.26Å; G687-A726 VanDerWaalsContact O-CB 3.27Å; G687-A726 WeakPolarHBondContact O-CB 3.43Å; G687-A726 PolarHBondContact O-N 3.17Å
688	I	81	Confident	84.5	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.228	C	C	.	.			trans	-99.5	111.2	173.2	-55.8	-171.1	0	0	0	109.6	I685 R692 A693 F696 V740	I685-I688 HydrophobicContact CB-CB 4.48Å; I685-I688 HydrophobicContact CB-CD1 3.85Å; I685-I688 HydrophobicContact CB-CG1 4.12Å; I685-I688 HydrophobicContact CD1-CD1 4.02Å; I685-I688 HydrophobicContact CG2-CD1 3.84Å; I685-I688 HydrophobicContact CG2-CG1 4.02Å; I685-I688 PolarHBondContact O-N 2.88Å; I685-I688 VanDerWaalsContact O-N 3.13Å; I688-R692 HydrophobicContact CG2-CB 4.08Å; I688-A693 HydrophobicContact CG2-CB 3.83Å; I688-F696 HydrophobicContact CD1-CD2 4.05Å; I688-F696 HydrophobicContact CD1-CE2 3.89Å; I688-F696 HydrophobicContact CG1-CE2 4.4Å; I688-F696 HydrophobicContact CG2-CD2 4.48Å; I688-V740 HydrophobicContact CD1-CG1 4Å
689	D	80.4	Confident	84.2	Confident	49 Å²	49	47.2 Å²	47.2	26%	0.262	24%	0.235	S	C	.	.			trans	-96	-177.7	170.3	72.5	-13.7	0	0	0	111.7	L691 R692 A693	D689-L691 PolarHBondContact O-N 3.2Å; D689-R692 PolarHBondContact O-N 3.38Å; D689-R692 WeakPolarHBondContact OD1-CB 3.38Å; D689-R692 WeakPolarHBondContact OD1-CD 3.23Å; D689-R692 WeakPolarHBondContact OD1-CG 3.48Å; D689-R692 IonicContact OD1-CZ 2.71Å; D689-R692 PolarHBondContact OD1-N 2.96Å; D689-R692 VanDerWaalsContact OD1-N 3.16Å; D689-R692 IonicContact OD1-NE 2.82Å; D689-R692 IonicContact OD1-NH1 2.8Å; D689-R692 PolarHBondContact OD1-NH1 3.03Å; D689-R692 IonicContact OD2-CZ 3.78Å; D689-R692 IonicContact OD2-NH1 2.67Å; D689-R692 PolarHBondContact OD2-NH1 3.13Å; D689-A693 WeakPolarHBondContact O-CB 3.18Å; D689-A693 PolarHBondContact O-N 3.28Å
690	G	82.9	Confident	83.9	Confident	9 Å²	9	49.5 Å²	49.5	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-45.3	-174.8	0	0	0	0	0	114.6	R692 A693 R694	G690-R692 VanDerWaalsContact C-N 3.32Å; G690-R692 PolarHBondContact O-N 2.95Å; G690-A693 PolarHBondContact O-N 3.49Å; G690-R694 PolarHBondContact O-N 3.49Å
691	L	81.3	Confident	83.8	Confident	127 Å²	127	49 Å²	49	67%	0.665	26%	0.255	S	S	*	.	H	α-helix	trans	-62	-39.6	178	-69.3	172.1	0	0	0	112	D689 R695	D689-L691 PolarHBondContact O-N 3.2Å; L691-R695 WeakPolarHBondContact O-CG 3.25Å; L691-R695 PolarHBondContact O-N 2.85Å
692	R	81.6	Confident	83.8	Confident	55 Å²	55	46.5 Å²	46.5	21%	0.208	25%	0.249	C	C	.	.	H	α-helix	trans	-73.1	-41.2	178.6	-67.9	162.9	176.3	93.6	-0.8	111.7	I688 D689 G690 R694 R695 F696 W724	I688-R692 HydrophobicContact CG2-CB 4.08Å; D689-R692 PolarHBondContact O-N 3.38Å; D689-R692 WeakPolarHBondContact OD1-CB 3.38Å; D689-R692 WeakPolarHBondContact OD1-CD 3.23Å; D689-R692 WeakPolarHBondContact OD1-CG 3.48Å; D689-R692 IonicContact OD1-CZ 2.71Å; D689-R692 PolarHBondContact OD1-N 2.96Å; D689-R692 VanDerWaalsContact OD1-N 3.16Å; D689-R692 IonicContact OD1-NE 2.82Å; D689-R692 IonicContact OD1-NH1 2.8Å; D689-R692 PolarHBondContact OD1-NH1 3.03Å; D689-R692 IonicContact OD2-CZ 3.78Å; D689-R692 IonicContact OD2-NH1 2.67Å; D689-R692 PolarHBondContact OD2-NH1 3.13Å; G690-R692 VanDerWaalsContact C-N 3.32Å; G690-R692 PolarHBondContact O-N 2.95Å; R692-R694 VanDerWaalsContact C-N 3.31Å; R692-R694 PolarHBondContact O-N 3.38Å; R692-R695 PolarHBondContact O-N 2.91Å; R692-F696 VanDerWaalsContact O-CD2 3.31Å; R692-F696 WeakPolarHBondContact O-CD2 3.3Å; R692-F696 PolarHBondContact O-N 3.23Å; R692-W724 WeakPolarHBondContact CD-O 3Å; R692-W724 VanDerWaalsContact CG-O 3.26Å; R692-W724 WeakPolarHBondContact CG-O 2.95Å; R692-W724 PolarHBondContact NE-O 3.16Å
693	A	88.1	Confident	83.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-44.2	175.8	0	0	0	0	0	111.2	L679 L682 V683 I688 D689 G690 R695 F696 H697	L679-A693 HydrophobicContact CB-CB 4.2Å; L679-A693 HydrophobicContact CD1-CB 4.12Å; L679-A693 HydrophobicContact CD2-CB 4.3Å; L679-A693 HydrophobicContact CG-CB 4.44Å; L682-A693 HydrophobicContact CB-CB 3.88Å; L682-A693 HydrophobicContact CD1-CB 4.29Å; L682-A693 WeakPolarHBondContact CD1-O 3.43Å; V683-A693 HydrophobicContact CG1-CB 3.84Å; I688-A693 HydrophobicContact CG2-CB 3.83Å; D689-A693 WeakPolarHBondContact O-CB 3.18Å; D689-A693 PolarHBondContact O-N 3.28Å; G690-A693 PolarHBondContact O-N 3.49Å; A693-R695 PolarHBondContact O-N 3.22Å; A693-F696 PolarHBondContact O-N 3.27Å; A693-H697 WeakPolarHBondContact O-CB 3.47Å; A693-H697 PolarHBondContact O-N 3.45Å
694	R	89.7	Confident	83.9	Confident	41 Å²	41	49.2 Å²	49.2	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-44.1	176.5	-174.9	54.9	62.8	-160.4	-1.7	112.3	E617 D678 L679 G690 R692 F696 H697 E698	E617-R694 IonicContact OE1-CZ 2.75Å; E617-R694 IonicContact OE1-NE 3.69Å; E617-R694 PolarHBondContact OE1-NE 2.78Å; E617-R694 IonicContact OE1-NH2 2.95Å; E617-R694 PolarHBondContact OE1-NH2 3.4Å; E617-R694 IonicContact OE2-CZ 2.71Å; E617-R694 IonicContact OE2-NE 3.98Å; E617-R694 PolarHBondContact OE2-NE 3.39Å; E617-R694 IonicContact OE2-NH2 2.67Å; E617-R694 PolarHBondContact OE2-NH2 2.89Å; D678-R694 IonicContact OD1-CZ 3.34Å; D678-R694 IonicContact OD1-NH1 2.66Å; D678-R694 IonicContact OD1-NH2 3.75Å; D678-R694 PolarHBondContact OD1-NH2 3.49Å; D678-R694 IonicContact OD2-CZ 3.51Å; D678-R694 IonicContact OD2-NH1 3.7Å; D678-R694 PolarHBondContact OD2-NH1 3.15Å; D678-R694 IonicContact OD2-NH2 3.02Å; D678-R694 PolarHBondContact OD2-NH2 3.41Å; D678-R694 VanDerWaalsContact OD2-NH2 3.15Å; L679-R694 HydrophobicContact CD1-CB 3.97Å; G690-R694 PolarHBondContact O-N 3.49Å; R692-R694 VanDerWaalsContact C-N 3.31Å; R692-R694 PolarHBondContact O-N 3.38Å; R694-F696 VanDerWaalsContact C-N 3.34Å; R694-F696 PolarHBondContact O-N 3.43Å; R694-H697 WeakPolarHBondContact O-CB 3.25Å; R694-H697 PolarHBondContact O-N 2.97Å; R694-E698 WeakPolarHBondContact O-CG 3.48Å; R694-E698 PolarHBondContact O-N 3.43Å
695	R	84.9	Confident	84.1	Confident	158 Å²	158	48 Å²	48	60%	0.596	26%	0.264	S	S	*	.	H	α-helix	trans	-59.8	-41.7	174.8	-72.1	178.2	178.8	-176.3	0.5	112.7	L691 R692 A693 E698 A699	L691-R695 WeakPolarHBondContact O-CG 3.25Å; L691-R695 PolarHBondContact O-N 2.85Å; R692-R695 PolarHBondContact O-N 2.91Å; A693-R695 PolarHBondContact O-N 3.22Å; R695-E698 PolarHBondContact O-N 2.64Å; R695-A699 WeakPolarHBondContact O-CB 3.44Å; R695-A699 PolarHBondContact O-N 2.93Å
696	F	87.2	Confident	84.4	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-44	174.7	-84.6	-60.3	0	0	0	111.9	L682 I688 R692 A693 R694 A699 G700 L701 L707 I715 W724	L682-F696 HydrophobicContact CD1-CB 4.11Å; I688-F696 HydrophobicContact CD1-CD2 4.05Å; I688-F696 HydrophobicContact CD1-CE2 3.89Å; I688-F696 HydrophobicContact CG1-CE2 4.4Å; I688-F696 HydrophobicContact CG2-CD2 4.48Å; R692-F696 VanDerWaalsContact O-CD2 3.31Å; R692-F696 WeakPolarHBondContact O-CD2 3.3Å; R692-F696 PolarHBondContact O-N 3.23Å; A693-F696 PolarHBondContact O-N 3.27Å; R694-F696 VanDerWaalsContact C-N 3.34Å; R694-F696 PolarHBondContact O-N 3.43Å; F696-A699 CarbonylContact O-C 3.56Å; F696-A699 PolarHBondContact O-N 3.47Å; F696-G700 PolarHBondContact O-N 3.48Å; F696-L701 HydrophobicContact CB-CB 4.32Å; F696-L701 HydrophobicContact CD1-CB 4.06Å; F696-L701 HydrophobicContact CD1-CD1 3.72Å; F696-L701 HydrophobicContact CE1-CD1 4.02Å; F696-L701 CarbonylContact O-C 3.52Å; F696-L701 WeakPolarHBondContact O-CA 3.25Å; F696-L701 WeakPolarHBondContact O-CB 3.23Å; F696-L701 PolarHBondContact O-N 3.38Å; F696-L707 HydrophobicContact CD1-CD2 4.1Å; F696-L707 HydrophobicContact CE1-CD2 4.09Å; F696-I715 HydrophobicContact CE1-CG2 4.12Å; F696-I715 HydrophobicContact CZ-CG2 4.32Å; F696-W724 AromaticContact CE2-CE3 3.86Å; F696-W724 HydrophobicContact CE2-CE3 3.86Å; F696-W724 AromaticContact CE2-CZ3 3.75Å; F696-W724 HydrophobicContact CE2-CZ3 3.75Å; F696-W724 AromaticContact CZ-CE3 3.64Å; F696-W724 HydrophobicContact CZ-CE3 3.64Å; F696-W724 HydrophobicContact CZ-CH2 4.05Å; F696-W724 AromaticContact CZ-CZ3 3.36Å; F696-W724 HydrophobicContact CZ-CZ3 3.36Å
697	H	89.1	Confident	84.9	Confident	59 Å²	59	49.1 Å²	49.1	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-46.2	176.9	-173.1	-77.5	0	0	0	111.9	D678 L679 L682 A693 R694 A699 G700 A702	D678-H697 IonicContact OD2-CE1 2.71Å; D678-H697 IonicContact OD2-NE2 3.82Å; L679-H697 HydrophobicContact CD2-CB 3.62Å; L682-H697 HydrophobicContact CD1-CB 4.35Å; A693-H697 WeakPolarHBondContact O-CB 3.47Å; A693-H697 PolarHBondContact O-N 3.45Å; R694-H697 WeakPolarHBondContact O-CB 3.25Å; R694-H697 PolarHBondContact O-N 2.97Å; H697-A699 VanDerWaalsContact C-N 3.29Å; H697-A699 PolarHBondContact O-N 2.84Å; H697-G700 PolarHBondContact O-N 3.44Å; H697-A702 WeakPolarHBondContact CD2-CB 3.25Å
698	E	87.2	Confident	85.5	Confident	145 Å²	145	48.8 Å²	48.8	68%	0.678	26%	0.262	S	S	*	.	H	α-helix	trans	-63.8	-31.5	175.7	-72.1	172.8	177.5	0	0	113	R694 R695 G700	R694-E698 WeakPolarHBondContact O-CG 3.48Å; R694-E698 PolarHBondContact O-N 3.43Å; R695-E698 PolarHBondContact O-N 2.64Å; E698-G700 PolarHBondContact O-N 3.01Å
699	A	84.1	Confident	85.7	Confident	61 Å²	61	55.1 Å²	55.1	50%	0.504	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	3	172.7	0	0	0	0	0	113.8	R695 F696 H697 L701	R695-A699 WeakPolarHBondContact O-CB 3.44Å; R695-A699 PolarHBondContact O-N 2.93Å; F696-A699 CarbonylContact O-C 3.56Å; F696-A699 PolarHBondContact O-N 3.47Å; H697-A699 VanDerWaalsContact C-N 3.29Å; H697-A699 PolarHBondContact O-N 2.84Å; A699-L701 VanDerWaalsContact C-N 3.32Å
700	G	84.5	Confident	86	Confident	49 Å²	49	53 Å²	53	51%	0.505	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	7	-178.4	0	0	0	0	0	114.6	F696 H697 E698 A702	F696-G700 PolarHBondContact O-N 3.48Å; H697-G700 PolarHBondContact O-N 3.44Å; E698-G700 PolarHBondContact O-N 3.01Å; G700-A702 VanDerWaalsContact C-N 3.3Å; G700-A702 PolarHBondContact O-N 2.78Å
701	L	85.5	Confident	86.1	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	31%	0.306	C	S	.	.			trans	-95.3	54.6	174.5	-62.5	175	0	0	0	110	F696 A699 T703 K706 L707	F696-L701 HydrophobicContact CB-CB 4.32Å; F696-L701 HydrophobicContact CD1-CB 4.06Å; F696-L701 HydrophobicContact CD1-CD1 3.72Å; F696-L701 HydrophobicContact CE1-CD1 4.02Å; F696-L701 CarbonylContact O-C 3.52Å; F696-L701 WeakPolarHBondContact O-CA 3.25Å; F696-L701 WeakPolarHBondContact O-CB 3.23Å; F696-L701 PolarHBondContact O-N 3.38Å; A699-L701 VanDerWaalsContact C-N 3.32Å; L701-T703 PolarHBondContact O-N 3.21Å; L701-K706 HydrophobicContact CD2-CG 4.07Å; L701-L707 HydrophobicContact CB-CD2 4.22Å; L701-L707 HydrophobicContact CB-CG 4.2Å; L701-L707 HydrophobicContact CD1-CD2 4.1Å
702	A	85.6	Confident	86.1	Confident	29 Å²	29	55.6 Å²	55.6	24%	0.24	29%	0.286	C	S	.	.			trans	-75.3	-20.3	-169.3	0	0	0	0	0	115.5	H697 G700	H697-A702 WeakPolarHBondContact CD2-CB 3.25Å; G700-A702 VanDerWaalsContact C-N 3.3Å; G700-A702 PolarHBondContact O-N 2.78Å
703	T	87.9	Confident	86.1	Confident	60 Å²	60	61.2 Å²	61.2	37%	0.368	31%	0.311	S	S	.	.	S	Bend	trans	-126.3	153.9	-175.6	64	0	0	0	0	111.8	L701 S705 K706 L707	L701-T703 PolarHBondContact O-N 3.21Å; T703-S705 PolarHBondContact O-N 3.38Å; T703-K706 PolarHBondContact O-N 3.44Å; T703-K706 VanDerWaalsContact O-N 3.12Å; T703-K706 WeakPolarHBondContact OG1-CB 3.31Å; T703-K706 PolarHBondContact OG1-N 3.49Å; T703-L707 PolarHBondContact O-N 3.04Å
704	V	87.9	Confident	85.8	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-36.9	176.4	176.8	0	0	0	0	110.8	E681 I685 L707 A708 A744 L747 L748	E681-V704 HydrophobicContact CB-CG2 3.89Å; E681-V704 WeakPolarHBondContact O-CG2 3.44Å; I685-V704 HydrophobicContact CD1-CG2 4.21Å; I685-V704 HydrophobicContact CG1-CG2 4.47Å; V704-L707 PolarHBondContact O-N 2.85Å; V704-A708 WeakPolarHBondContact O-CB 3.18Å; V704-A708 PolarHBondContact O-N 3.26Å; V704-A744 HydrophobicContact CG1-CB 3.85Å; V704-A744 WeakPolarHBondContact CG1-O 3.3Å; V704-L747 HydrophobicContact CB-CD2 4.48Å; V704-L747 HydrophobicContact CG1-CD2 3.89Å; V704-L747 HydrophobicContact CG2-CD2 4.17Å; V704-L748 HydrophobicContact CG1-CG 4.07Å
705	S	86.9	Confident	85.4	Confident	46 Å²	46	63.5 Å²	63.5	32%	0.322	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-45.4	175.6	-176.1	0	0	0	0	112.3	T703 A708 Q709	T703-S705 PolarHBondContact O-N 3.38Å; S705-A708 PolarHBondContact O-N 3.19Å; S705-Q709 WeakPolarHBondContact O-CG 3.33Å; S705-Q709 PolarHBondContact O-N 2.97Å; S705-Q709 VanDerWaalsContact O-N 3.12Å; S705-Q709 PolarHBondContact OG-NE2 3.33Å
706	K	87.5	Confident	84.9	Confident	105 Å²	105	57.2 Å²	57.2	46%	0.457	30%	0.304	S	S	.	.	H	α-helix	trans	-65.9	-41.2	178.1	-169.9	64.6	177.6	179.4	0	111.7	L701 T703 Q709 S710	L701-K706 HydrophobicContact CD2-CG 4.07Å; T703-K706 PolarHBondContact O-N 3.44Å; T703-K706 VanDerWaalsContact O-N 3.12Å; T703-K706 WeakPolarHBondContact OG1-CB 3.31Å; T703-K706 PolarHBondContact OG1-N 3.49Å; K706-Q709 PolarHBondContact O-N 3.25Å; K706-S710 WeakPolarHBondContact O-CB 3.39Å; K706-S710 PolarHBondContact O-N 2.89Å
707	L	85.8	Confident	84	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-45.6	173.3	-89.7	164.3	0	0	0	112.1	L682 I685 F696 L701 T703 V704 Q709 S710 I715 V740 A744	L682-L707 HydrophobicContact CD2-CD1 3.39Å; I685-L707 HydrophobicContact CD1-CD1 3.82Å; F696-L707 HydrophobicContact CD1-CD2 4.1Å; F696-L707 HydrophobicContact CE1-CD2 4.09Å; L701-L707 HydrophobicContact CB-CD2 4.22Å; L701-L707 HydrophobicContact CB-CG 4.2Å; L701-L707 HydrophobicContact CD1-CD2 4.1Å; T703-L707 PolarHBondContact O-N 3.04Å; V704-L707 PolarHBondContact O-N 2.85Å; L707-Q709 VanDerWaalsContact C-N 3.3Å; L707-Q709 PolarHBondContact O-N 3.18Å; L707-S710 PolarHBondContact O-N 2.87Å; L707-S710 PolarHBondContact O-OG 3.47Å; L707-I715 HydrophobicContact CD2-CG1 4.5Å; L707-V740 HydrophobicContact CD2-CG1 4.24Å; L707-A744 HydrophobicContact CB-CB 4.2Å
708	A	85.9	Confident	82.6	Confident	5 Å²	5	61.4 Å²	61.4	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-32.4	-179.8	0	0	0	0	0	113.9	V704 S705 A744 R745 L748	V704-A708 WeakPolarHBondContact O-CB 3.18Å; V704-A708 PolarHBondContact O-N 3.26Å; S705-A708 PolarHBondContact O-N 3.19Å; A708-A744 HydrophobicContact CB-CB 4.04Å; A708-R745 HydrophobicContact CB-CG 3.73Å; A708-R745 PolarHBondContact O-NE 3.28Å; A708-R745 PolarHBondContact O-NH2 3.06Å; A708-L748 HydrophobicContact CB-CD1 3.52Å
709	Q	85.8	Confident	81	Confident	138 Å²	138	55.8 Å²	55.8	65%	0.645	32%	0.318	S	S	*	.	H	α-helix	trans	-85.6	-24.3	178.9	-68.1	175	8.6	0	0	113.4	S705 K706 L707	S705-Q709 WeakPolarHBondContact O-CG 3.33Å; S705-Q709 PolarHBondContact O-N 2.97Å; S705-Q709 VanDerWaalsContact O-N 3.12Å; S705-Q709 PolarHBondContact OG-NE2 3.33Å; K706-Q709 PolarHBondContact O-N 3.25Å; L707-Q709 VanDerWaalsContact C-N 3.3Å; L707-Q709 PolarHBondContact O-N 3.18Å
710	S	85.6	Confident	79.5	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.028	33%	0.333	C	S	.	.	S	Bend	trans	-62.8	151.8	-176.3	67.3	0	0	0	0	113.4	K706 L707 E714 I715 R741	K706-S710 WeakPolarHBondContact O-CB 3.39Å; K706-S710 PolarHBondContact O-N 2.89Å; L707-S710 PolarHBondContact O-N 2.87Å; L707-S710 PolarHBondContact O-OG 3.47Å; S710-E714 WeakPolarHBondContact CB-OE2 3.4Å; S710-I715 VanDerWaalsContact OG-CD1 3.31Å; S710-I715 WeakPolarHBondContact OG-CD1 3.39Å; S710-I715 WeakPolarHBondContact OG-CG1 3.47Å; S710-R741 WeakPolarHBondContact O-CD 3.03Å
711	K	85.3	Confident	78.1	Confident	145 Å²	145	63.8 Å²	63.8	63%	0.63	34%	0.342	S	S	*	.			trans	-74.9	146.6	175.8	-67.9	177.4	-178.8	173.5	0	109.5	K713 E714 I715	K711-K713 PolarHBondContact O-N 2.59Å; K711-K713 VanDerWaalsContact O-N 3.09Å; K711-E714 HydrophobicContact CB-CG 4.2Å; K711-E714 PolarHBondContact N-OE2 3.45Å; K711-E714 VanDerWaalsContact N-OE2 3.07Å; K711-E714 WeakPolarHBondContact O-CB 3.34Å; K711-E714 PolarHBondContact O-N 3.25Å; K711-I715 PolarHBondContact O-N 3.49Å
712	I	82.9	Confident	76.7	Confident	47 Å²	47	63.9 Å²	63.9	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-53.3	-38.1	179.2	-61.4	172.5	0	0	0	111.2	E714 I715 S716 V734 A737	I712-E714 PolarHBondContact O-N 2.73Å; I712-I715 PolarHBondContact O-N 2.89Å; I712-S716 WeakPolarHBondContact O-CB 3.41Å; I712-S716 PolarHBondContact O-N 3.34Å; I712-S716 PolarHBondContact O-OG 3.34Å; I712-V734 HydrophobicContact CG2-CG1 4.11Å; I712-A737 HydrophobicContact CG2-CB 3.9Å
713	K	81.7	Confident	75.4	Confident	173 Å²	173	66.2 Å²	66.2	75%	0.752	36%	0.357	S	S	*	.	H	α-helix	trans	-61	-39.8	176.5	-68.4	-172.5	179.3	-177.7	0	113.2	K711 S716 S717	K711-K713 PolarHBondContact O-N 2.59Å; K711-K713 VanDerWaalsContact O-N 3.09Å; K713-S716 VanDerWaalsContact CA-OG 3.31Å; K713-S716 WeakPolarHBondContact CA-OG 3.33Å; K713-S716 PolarHBondContact O-N 3.43Å; K713-S716 PolarHBondContact O-OG 3.02Å; K713-S717 VanDerWaalsContact O-CB 3.3Å; K713-S717 WeakPolarHBondContact O-CB 3.35Å; K713-S717 PolarHBondContact O-N 3.32Å
714	E	80.8	Confident	74.2	Confident	89 Å²	89	63.8 Å²	63.8	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-66.2	-44.6	179.4	-67.2	164.9	-173.9	0	0	110.4	S710 K711 I712 S716 S717	S710-E714 WeakPolarHBondContact CB-OE2 3.4Å; K711-E714 HydrophobicContact CB-CG 4.2Å; K711-E714 PolarHBondContact N-OE2 3.45Å; K711-E714 VanDerWaalsContact N-OE2 3.07Å; K711-E714 WeakPolarHBondContact O-CB 3.34Å; K711-E714 PolarHBondContact O-N 3.25Å; I712-E714 PolarHBondContact O-N 2.73Å; E714-S716 PolarHBondContact O-N 3.26Å; E714-S717 PolarHBondContact O-N 3.19Å; E714-S717 PolarHBondContact O-OG 3.28Å
715	I	80.5	Confident	73.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-46.4	175.5	-54.5	174.7	0	0	0	110.4	F696 L707 S710 K711 I712 S717 S718 W724 A737 R741	F696-I715 HydrophobicContact CE1-CG2 4.12Å; F696-I715 HydrophobicContact CZ-CG2 4.32Å; L707-I715 HydrophobicContact CD2-CG1 4.5Å; S710-I715 VanDerWaalsContact OG-CD1 3.31Å; S710-I715 WeakPolarHBondContact OG-CD1 3.39Å; S710-I715 WeakPolarHBondContact OG-CG1 3.47Å; K711-I715 PolarHBondContact O-N 3.49Å; I712-I715 PolarHBondContact O-N 2.89Å; I715-S717 VanDerWaalsContact C-N 3.31Å; I715-S717 PolarHBondContact O-N 2.93Å; I715-S718 PolarHBondContact O-N 2.89Å; I715-S718 PolarHBondContact O-OG 2.96Å; I715-W724 HydrophobicContact CG2-CH2 3.97Å; I715-W724 HydrophobicContact CG2-CZ2 4.31Å; I715-A737 HydrophobicContact CB-CB 3.88Å; I715-A737 HydrophobicContact CG2-CB 3.69Å; I715-R741 HydrophobicContact CD1-CB 3.82Å; I715-R741 HydrophobicContact CD1-CG 4.25Å
716	S	75.5	Confident	71.9	Confident	26 Å²	26	63.1 Å²	63.1	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-68.8	-26.4	-179.4	64.3	0	0	0	0	113.8	I712 K713 E714 S718 S719	I712-S716 WeakPolarHBondContact O-CB 3.41Å; I712-S716 PolarHBondContact O-N 3.34Å; I712-S716 PolarHBondContact O-OG 3.34Å; K713-S716 VanDerWaalsContact CA-OG 3.31Å; K713-S716 WeakPolarHBondContact CA-OG 3.33Å; K713-S716 PolarHBondContact O-N 3.43Å; K713-S716 PolarHBondContact O-OG 3.02Å; E714-S716 PolarHBondContact O-N 3.26Å; S716-S718 PolarHBondContact O-N 3.12Å; S716-S718 VanDerWaalsContact O-N 3.16Å; S716-S719 PolarHBondContact O-N 3.15Å
717	S	67.1	Low	70.7	Confident	97 Å²	97	62 Å²	62	68%	0.678	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.6	-178.1	68.7	0	0	0	0	113.7	K713 E714 I715 S719	K713-S717 VanDerWaalsContact O-CB 3.3Å; K713-S717 WeakPolarHBondContact O-CB 3.35Å; K713-S717 PolarHBondContact O-N 3.32Å; E714-S717 PolarHBondContact O-N 3.19Å; E714-S717 PolarHBondContact O-OG 3.28Å; I715-S717 VanDerWaalsContact C-N 3.31Å; I715-S717 PolarHBondContact O-N 2.93Å; S717-S719 PolarHBondContact O-N 2.87Å
718	S	60.2	Low	69.7	Low	55 Å²	55	64.8 Å²	64.8	39%	0.385	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13	178.2	63.7	0	0	0	0	114.6	I715 S716	I715-S718 PolarHBondContact O-N 2.89Å; I715-S718 PolarHBondContact O-OG 2.96Å; S716-S718 PolarHBondContact O-N 3.12Å; S716-S718 VanDerWaalsContact O-N 3.16Å
719	S	54.4	Low	68.5	Low	28 Å²	28	69 Å²	69	20%	0.196	40%	0.398	C	S	.	.			trans	-160.1	148.7	-178.1	-176	0	0	0	0	114.2	S716 S717 K721	S716-S719 PolarHBondContact O-N 3.15Å; S717-S719 PolarHBondContact O-N 2.87Å; S719-K721 PolarHBondContact OG-O 3.27Å
720	S	52.7	Low	67.4	Low	117 Å²	117	71.5 Å²	71.5	82%	0.818	41%	0.41	S	S	*	.	S	Bend	trans	-79.5	-20.1	179.5	59.5	0	0	0	0	114.7
721	K	55.5	Low	66.6	Low	160 Å²	160	73.7 Å²	73.7	70%	0.696	42%	0.421	S	S	*	.	S	Bend	trans	-136.4	154.1	173.2	-75.5	-174.8	177.3	179.5	0	110.2	S719 S723	S719-K721 PolarHBondContact OG-O 3.27Å; K721-S723 PolarHBondContact O-N 2.64Å; K721-S723 PolarHBondContact O-OG 2.91Å
722	N	55.5	Low	66.2	Low	15 Å²	15	70.5 Å²	70.5	8%	0.08	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	39.6	174	-172.8	27.7	0	0	0	113.1	W724 H728 L731 L733 A736	N722-W724 PolarHBondContact O-N 3.12Å; N722-H728 PolarHBondContact ND2-O 3.13Å; N722-L731 WeakPolarHBondContact CB-O 3.25Å; N722-L731 PolarHBondContact ND2-O 3.1Å; N722-L733 HydrophobicContact CB-CD2 4.07Å; N722-L733 HydrophobicContact CB-CG 4.35Å; N722-A736 WeakPolarHBondContact ND2-CB 3.28Å; N722-A736 VanDerWaalsContact OD1-CB 3.29Å; N722-A736 WeakPolarHBondContact OD1-CB 3.23Å
723	S	57	Low	65.8	Low	78 Å²	78	70.6 Å²	70.6	55%	0.545	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-8.2	166	52.1	0	0	0	0	112.1	K721	K721-S723 PolarHBondContact O-N 2.64Å; K721-S723 PolarHBondContact O-OG 2.91Å
724	W	64.4	Low	65.8	Low	10 Å²	10	66.4 Å²	66.4	4%	0.038	40%	0.404	C	S	.	.	S	Bend	trans	-89.6	-14.8	-171.1	70.1	-95.8	0	0	0	114.1	R692 F696 I715 N722 L733 A736 A737 V740	R692-W724 WeakPolarHBondContact CD-O 3Å; R692-W724 VanDerWaalsContact CG-O 3.26Å; R692-W724 WeakPolarHBondContact CG-O 2.95Å; R692-W724 PolarHBondContact NE-O 3.16Å; F696-W724 AromaticContact CE2-CE3 3.86Å; F696-W724 HydrophobicContact CE2-CE3 3.86Å; F696-W724 AromaticContact CE2-CZ3 3.75Å; F696-W724 HydrophobicContact CE2-CZ3 3.75Å; F696-W724 AromaticContact CZ-CE3 3.64Å; F696-W724 HydrophobicContact CZ-CE3 3.64Å; F696-W724 HydrophobicContact CZ-CH2 4.05Å; F696-W724 AromaticContact CZ-CZ3 3.36Å; F696-W724 HydrophobicContact CZ-CZ3 3.36Å; I715-W724 HydrophobicContact CG2-CH2 3.97Å; I715-W724 HydrophobicContact CG2-CZ2 4.31Å; N722-W724 PolarHBondContact O-N 3.12Å; W724-L733 VanDerWaalsContact NE1-CD2 3.32Å; W724-A736 HydrophobicContact CH2-CB 4.23Å; W724-A736 HydrophobicContact CZ2-CB 3.81Å; W724-A737 HydrophobicContact CZ2-CB 4.37Å; W724-V740 HydrophobicContact CH2-CB 4.36Å; W724-V740 HydrophobicContact CH2-CG2 3.87Å; W724-V740 HydrophobicContact CZ3-CG2 3.82Å
725	L	63.8	Low	65.7	Low	3 Å²	3	66.9 Å²	66.9	2%	0.016	41%	0.406	C	S	.	.	S	Bend	trans	-101.5	118.4	173.5	-170.7	63.6	0	0	0	110.9	H728 L731 A736 F739 V740	L725-H728 HydrophobicContact CB-CB 4.38Å; L725-H728 HydrophobicContact CD2-CB 3.61Å; L725-H728 HydrophobicContact CG-CB 3.87Å; L725-H728 PolarHBondContact O-N 3.17Å; L725-L731 HydrophobicContact CD2-CD1 4.28Å; L725-A736 HydrophobicContact CB-CB 4.2Å; L725-A736 HydrophobicContact CD2-CB 3.72Å; L725-F739 HydrophobicContact CD2-CD1 3.86Å; L725-V740 HydrophobicContact CD1-CG2 3.5Å; L725-V740 VanDerWaalsContact CD1-CG2 3.5Å; L725-V740 HydrophobicContact CD2-CG2 4.36Å
726	A	62.3	Low	65.5	Low	30 Å²	30	66.9 Å²	66.9	25%	0.248	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	136.8	-176	0	0	0	0	0	111.5	G687 H728	G687-A726 VanDerWaalsContact O-CB 3.27Å; G687-A726 WeakPolarHBondContact O-CB 3.43Å; G687-A726 PolarHBondContact O-N 3.17Å; A726-H728 PolarHBondContact O-CD2 3.22Å; A726-H728 VanDerWaalsContact O-CD2 3.26Å; A726-H728 PolarHBondContact O-N 2.8Å; A726-H728 VanDerWaalsContact O-N 3.1Å
727	G	61.3	Low	65.9	Low	82 Å²	82	65.7 Å²	65.7	85%	0.845	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	-8.2	178.6	0	0	0	0	0	115.7
728	H	64.8	Low	66.6	Low	58 Å²	58	63.7 Å²	63.7	27%	0.269	38%	0.381	S	S	.	.			trans	-121.7	35.8	-174.1	-67.1	-75.4	0	0	0	112.7	N722 L725 A726 E730 L731	N722-H728 PolarHBondContact ND2-O 3.13Å; L725-H728 HydrophobicContact CB-CB 4.38Å; L725-H728 HydrophobicContact CD2-CB 3.61Å; L725-H728 HydrophobicContact CG-CB 3.87Å; L725-H728 PolarHBondContact O-N 3.17Å; A726-H728 PolarHBondContact O-CD2 3.22Å; A726-H728 VanDerWaalsContact O-CD2 3.26Å; A726-H728 PolarHBondContact O-N 2.8Å; A726-H728 VanDerWaalsContact O-N 3.1Å; H728-E730 PolarHBondContact O-N 3.34Å; H728-E730 VanDerWaalsContact O-N 3.09Å; H728-L731 HydrophobicContact CB-CD1 3.79Å; H728-L731 HydrophobicContact CB-CG 4.11Å; H728-L731 PolarHBondContact O-N 3.29Å; H728-L731 VanDerWaalsContact O-N 3.1Å
729	S	60.8	Low	67.7	Low	94 Å²	94	63.4 Å²	63.4	66%	0.657	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.6	-179.4	52.6	0	0	0	0	114.2
730	E	63.8	Low	69.1	Low	190 Å²	190	62.1 Å²	62.1	89%	0.888	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-20.7	178.3	-57	-174.4	-175.7	0	0	112.7	H728	H728-E730 PolarHBondContact O-N 3.34Å; H728-E730 VanDerWaalsContact O-N 3.09Å
731	L	69.5	Low	70.7	Confident	51 Å²	51	59.1 Å²	59.1	27%	0.267	34%	0.335	S	S	.	.	S	Bend	trans	-71.7	147.2	178.6	-62.6	-178.4	0	0	0	110.7	N722 L725 H728 E735 A736	N722-L731 WeakPolarHBondContact CB-O 3.25Å; N722-L731 PolarHBondContact ND2-O 3.1Å; L725-L731 HydrophobicContact CD2-CD1 4.28Å; H728-L731 HydrophobicContact CB-CD1 3.79Å; H728-L731 HydrophobicContact CB-CG 4.11Å; H728-L731 PolarHBondContact O-N 3.29Å; H728-L731 VanDerWaalsContact O-N 3.1Å; L731-E735 HydrophobicContact CB-CB 4.01Å; L731-E735 HydrophobicContact CD2-CB 4.18Å; L731-E735 HydrophobicContact CG-CB 4.48Å; L731-A736 HydrophobicContact CB-CB 4.3Å
732	T	76.5	Confident	71.9	Confident	78 Å²	78	57.7 Å²	57.7	48%	0.479	33%	0.328	S	S	.	.			trans	-65.8	160.2	165.2	62.7	0	0	0	0	110.5	V734 E735 A736	T732-V734 PolarHBondContact O-N 3.2Å; T732-E735 WeakPolarHBondContact CB-OE2 3.11Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.47Å; T732-E735 PolarHBondContact N-OE2 3.32Å; T732-E735 PolarHBondContact O-N 3.01Å; T732-E735 WeakPolarHBondContact OG1-CB 3.17Å; T732-E735 WeakPolarHBondContact OG1-CG 3.38Å; T732-E735 PolarHBondContact OG1-N 3.35Å; T732-E735 PolarHBondContact OG1-OE2 3.27Å; T732-A736 WeakPolarHBondContact O-CB 2.83Å; T732-A736 PolarHBondContact O-N 3.18Å
733	L	74.9	Confident	73.1	Confident	49 Å²	49	59.6 Å²	59.6	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-53.8	-37.2	176.2	-80.3	168.6	0	0	0	112.5	N722 W724 A737	N722-L733 HydrophobicContact CB-CD2 4.07Å; N722-L733 HydrophobicContact CB-CG 4.35Å; W724-L733 VanDerWaalsContact NE1-CD2 3.32Å; L733-A737 VanDerWaalsContact O-CB 3.28Å; L733-A737 WeakPolarHBondContact O-CB 3.36Å; L733-A737 PolarHBondContact O-N 2.64Å
734	V	80.5	Confident	74.5	Confident	85 Å²	85	55.9 Å²	55.9	52%	0.515	31%	0.311	S	S	.	.	H	α-helix	trans	-72.1	-44.3	-179.6	179.2	0	0	0	0	110.9	I712 T732 A737 T738	I712-V734 HydrophobicContact CG2-CG1 4.11Å; T732-V734 PolarHBondContact O-N 3.2Å; V734-A737 PolarHBondContact O-N 2.99Å; V734-T738 VanDerWaalsContact O-CB 3.31Å; V734-T738 WeakPolarHBondContact O-CB 3.36Å; V734-T738 PolarHBondContact O-N 2.99Å; V734-T738 PolarHBondContact O-OG1 3.47Å
735	E	78.5	Confident	75.3	Confident	99 Å²	99	60.6 Å²	60.6	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-42.8	176.8	-72.8	163.4	153.3	0	0	111.6	L731 T732 T738 F739	L731-E735 HydrophobicContact CB-CB 4.01Å; L731-E735 HydrophobicContact CD2-CB 4.18Å; L731-E735 HydrophobicContact CG-CB 4.48Å; T732-E735 WeakPolarHBondContact CB-OE2 3.11Å; T732-E735 WeakPolarHBondContact CG2-OE2 3.47Å; T732-E735 PolarHBondContact N-OE2 3.32Å; T732-E735 PolarHBondContact O-N 3.01Å; T732-E735 WeakPolarHBondContact OG1-CB 3.17Å; T732-E735 WeakPolarHBondContact OG1-CG 3.38Å; T732-E735 PolarHBondContact OG1-N 3.35Å; T732-E735 PolarHBondContact OG1-OE2 3.27Å; E735-T738 PolarHBondContact O-N 3.29Å; E735-F739 WeakPolarHBondContact O-CB 3.47Å; E735-F739 PolarHBondContact O-N 3.1Å
736	A	77.2	Confident	75.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-45.5	176	0	0	0	0	0	112.2	N722 W724 L725 L731 T732 T738 F739 V740	N722-A736 WeakPolarHBondContact ND2-CB 3.28Å; N722-A736 VanDerWaalsContact OD1-CB 3.29Å; N722-A736 WeakPolarHBondContact OD1-CB 3.23Å; W724-A736 HydrophobicContact CH2-CB 4.23Å; W724-A736 HydrophobicContact CZ2-CB 3.81Å; L725-A736 HydrophobicContact CB-CB 4.2Å; L725-A736 HydrophobicContact CD2-CB 3.72Å; L731-A736 HydrophobicContact CB-CB 4.3Å; T732-A736 WeakPolarHBondContact O-CB 2.83Å; T732-A736 PolarHBondContact O-N 3.18Å; A736-T738 VanDerWaalsContact C-N 3.32Å; A736-T738 PolarHBondContact O-N 3.27Å; A736-F739 PolarHBondContact O-N 3.36Å; A736-V740 WeakPolarHBondContact O-CG2 3.44Å; A736-V740 PolarHBondContact O-N 3.3Å
737	A	82.7	Confident	76.6	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-39.7	175	0	0	0	0	0	112.2	I712 I715 W724 L733 V734 R741	I712-A737 HydrophobicContact CG2-CB 3.9Å; I715-A737 HydrophobicContact CB-CB 3.88Å; I715-A737 HydrophobicContact CG2-CB 3.69Å; W724-A737 HydrophobicContact CZ2-CB 4.37Å; L733-A737 VanDerWaalsContact O-CB 3.28Å; L733-A737 WeakPolarHBondContact O-CB 3.36Å; L733-A737 PolarHBondContact O-N 2.64Å; V734-A737 PolarHBondContact O-N 2.99Å; A737-R741 WeakPolarHBondContact O-CB 3.38Å; A737-R741 PolarHBondContact O-N 3.31Å
738	T	82.7	Confident	77.4	Confident	55 Å²	55	61.3 Å²	61.3	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-66.2	-42.7	177.3	-55.8	0	0	0	0	111.1	V734 E735 A736 R741 F742	V734-T738 VanDerWaalsContact O-CB 3.31Å; V734-T738 WeakPolarHBondContact O-CB 3.36Å; V734-T738 PolarHBondContact O-N 2.99Å; V734-T738 PolarHBondContact O-OG1 3.47Å; E735-T738 PolarHBondContact O-N 3.29Å; A736-T738 VanDerWaalsContact C-N 3.32Å; A736-T738 PolarHBondContact O-N 3.27Å; T738-R741 PolarHBondContact O-N 3.22Å; T738-F742 VanDerWaalsContact O-CB 3.31Å; T738-F742 WeakPolarHBondContact O-CB 3.4Å; T738-F742 PolarHBondContact O-N 3.4Å
739	F	82.9	Confident	77.6	Confident	50 Å²	50	61.8 Å²	61.8	22%	0.219	32%	0.315	C	S	.	.	H	α-helix	trans	-59.7	-51.4	176	176.9	-95.9	0	0	0	111.6	L725 E735 A736 R741 F742 Q743	L725-F739 HydrophobicContact CD2-CD1 3.86Å; E735-F739 WeakPolarHBondContact O-CB 3.47Å; E735-F739 PolarHBondContact O-N 3.1Å; A736-F739 PolarHBondContact O-N 3.36Å; F739-R741 PolarHBondContact O-N 3.41Å; F739-F742 WeakPolarHBondContact O-CB 3.41Å; F739-F742 PolarHBondContact O-N 3.02Å; F739-Q743 HydrophobicContact CD1-CG 4.26Å; F739-Q743 HydrophobicContact CE1-CG 3.88Å; F739-Q743 HydrophobicContact CE2-CG 4.28Å; F739-Q743 HydrophobicContact CZ-CG 3.9Å; F739-Q743 WeakPolarHBondContact O-CG 3.17Å; F739-Q743 PolarHBondContact O-N 3.36Å
740	V	84.2	Confident	77.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.3	-43.7	179.2	167.6	0	0	0	0	111.8	I685 I688 L707 W724 L725 A736 F742 Q743 A744	I685-V740 HydrophobicContact CG2-CG1 4.36Å; I688-V740 HydrophobicContact CD1-CG1 4Å; L707-V740 HydrophobicContact CD2-CG1 4.24Å; W724-V740 HydrophobicContact CH2-CB 4.36Å; W724-V740 HydrophobicContact CH2-CG2 3.87Å; W724-V740 HydrophobicContact CZ3-CG2 3.82Å; L725-V740 HydrophobicContact CD1-CG2 3.5Å; L725-V740 VanDerWaalsContact CD1-CG2 3.5Å; L725-V740 HydrophobicContact CD2-CG2 4.36Å; A736-V740 WeakPolarHBondContact O-CG2 3.44Å; A736-V740 PolarHBondContact O-N 3.3Å; V740-F742 VanDerWaalsContact C-N 3.32Å; V740-F742 PolarHBondContact O-N 3.26Å; V740-Q743 PolarHBondContact O-N 3Å; V740-A744 WeakPolarHBondContact O-CB 3.49Å; V740-A744 PolarHBondContact O-N 2.63Å
741	R	85.5	Confident	77.9	Confident	55 Å²	55	52.9 Å²	52.9	21%	0.208	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-40.5	176.8	-167.9	177.4	72.2	159.1	2.7	111.8	S710 I715 A737 T738 F739 A744 R745	S710-R741 WeakPolarHBondContact O-CD 3.03Å; I715-R741 HydrophobicContact CD1-CB 3.82Å; I715-R741 HydrophobicContact CD1-CG 4.25Å; A737-R741 WeakPolarHBondContact O-CB 3.38Å; A737-R741 PolarHBondContact O-N 3.31Å; T738-R741 PolarHBondContact O-N 3.22Å; F739-R741 PolarHBondContact O-N 3.41Å; R741-A744 PolarHBondContact O-N 2.75Å; R741-R745 WeakPolarHBondContact O-CG 3.36Å; R741-R745 PolarHBondContact O-N 3.21Å
742	F	81.7	Confident	77.7	Confident	129 Å²	129	53.7 Å²	53.7	57%	0.566	27%	0.267	S	S	*	.	H	α-helix	trans	-62.7	-48.3	176	176.9	-97.5	0	0	0	111.1	T738 F739 V740 A744 R745 T746	T738-F742 VanDerWaalsContact O-CB 3.31Å; T738-F742 WeakPolarHBondContact O-CB 3.4Å; T738-F742 PolarHBondContact O-N 3.4Å; F739-F742 WeakPolarHBondContact O-CB 3.41Å; F739-F742 PolarHBondContact O-N 3.02Å; V740-F742 VanDerWaalsContact C-N 3.32Å; V740-F742 PolarHBondContact O-N 3.26Å; F742-A744 VanDerWaalsContact C-N 3.34Å; F742-A744 PolarHBondContact O-N 3.49Å; F742-R745 PolarHBondContact O-N 3.12Å; F742-T746 PolarHBondContact O-N 3.49Å; F742-T746 PolarHBondContact O-OG1 3.3Å
743	Q	80.9	Confident	76.7	Confident	55 Å²	55	57.8 Å²	57.8	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-59	-43.7	176.6	-68.9	-62.8	-14.4	0	0	112.2	I685 F739 V740 R745 T746 L747	I685-Q743 HydrophobicContact CG2-CB 3.85Å; F739-Q743 HydrophobicContact CD1-CG 4.26Å; F739-Q743 HydrophobicContact CE1-CG 3.88Å; F739-Q743 HydrophobicContact CE2-CG 4.28Å; F739-Q743 HydrophobicContact CZ-CG 3.9Å; F739-Q743 WeakPolarHBondContact O-CG 3.17Å; F739-Q743 PolarHBondContact O-N 3.36Å; V740-Q743 PolarHBondContact O-N 3Å; Q743-R745 VanDerWaalsContact C-N 3.34Å; Q743-R745 PolarHBondContact O-N 3.02Å; Q743-T746 PolarHBondContact O-N 3.34Å; Q743-L747 WeakPolarHBondContact O-CB 3.38Å; Q743-L747 PolarHBondContact O-N 3.43Å
744	A	84.8	Confident	75.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-42	176.5	0	0	0	0	0	112.5	I685 V704 L707 A708 V740 R741 F742 L747 L748	I685-A744 HydrophobicContact CD1-CB 3.95Å; V704-A744 HydrophobicContact CG1-CB 3.85Å; V704-A744 WeakPolarHBondContact CG1-O 3.3Å; L707-A744 HydrophobicContact CB-CB 4.2Å; A708-A744 HydrophobicContact CB-CB 4.04Å; V740-A744 WeakPolarHBondContact O-CB 3.49Å; V740-A744 PolarHBondContact O-N 2.63Å; R741-A744 PolarHBondContact O-N 2.75Å; F742-A744 VanDerWaalsContact C-N 3.34Å; F742-A744 PolarHBondContact O-N 3.49Å; A744-L747 PolarHBondContact O-N 3.47Å; A744-L748 PolarHBondContact O-N 3.49Å
745	R	82.6	Confident	74	Confident	109 Å²	109	66.3 Å²	66.3	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-66.4	-42.2	175.9	-74	174.1	179	-165.9	-6.5	112.1	A708 R741 F742 Q743 L748 N749	A708-R745 HydrophobicContact CB-CG 3.73Å; A708-R745 PolarHBondContact O-NE 3.28Å; A708-R745 PolarHBondContact O-NH2 3.06Å; R741-R745 WeakPolarHBondContact O-CG 3.36Å; R741-R745 PolarHBondContact O-N 3.21Å; F742-R745 PolarHBondContact O-N 3.12Å; Q743-R745 VanDerWaalsContact C-N 3.34Å; Q743-R745 PolarHBondContact O-N 3.02Å; R745-L748 PolarHBondContact O-N 3.32Å; R745-N749 WeakPolarHBondContact O-CB 3.32Å; R745-N749 VanDerWaalsContact O-CG 3.24Å; R745-N749 PolarHBondContact O-N 2.98Å; R745-N749 PolarHBondContact O-ND2 3.29Å
746	T	74.4	Confident	72.3	Confident	44 Å²	44	63.2 Å²	63.2	27%	0.27	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-47.7	176	-57.6	0	0	0	0	110.5	F742 Q743 L748 N749 D750	F742-T746 PolarHBondContact O-N 3.49Å; F742-T746 PolarHBondContact O-OG1 3.3Å; Q743-T746 PolarHBondContact O-N 3.34Å; T746-L748 VanDerWaalsContact C-N 3.34Å; T746-L748 PolarHBondContact O-N 3.19Å; T746-N749 PolarHBondContact O-N 3.05Å; T746-D750 WeakPolarHBondContact O-CB 3.48Å; T746-D750 VanDerWaalsContact O-CG 3.24Å; T746-D750 PolarHBondContact O-N 3.12Å
747	L	77.6	Confident	70.7	Confident	39 Å²	39	66.8 Å²	66.8	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-39.2	178.7	-166.4	121.7	0	0	0	112.7	Q684 V704 Q743 A744 D750 K751	Q684-L747 HydrophobicContact CB-CD1 3.86Å; V704-L747 HydrophobicContact CB-CD2 4.48Å; V704-L747 HydrophobicContact CG1-CD2 3.89Å; V704-L747 HydrophobicContact CG2-CD2 4.17Å; Q743-L747 WeakPolarHBondContact O-CB 3.38Å; Q743-L747 PolarHBondContact O-N 3.43Å; A744-L747 PolarHBondContact O-N 3.47Å; L747-D750 PolarHBondContact O-N 2.99Å; L747-K751 HydrophobicContact CD2-CD 4.28Å; L747-K751 WeakPolarHBondContact O-CG 3.49Å; L747-K751 PolarHBondContact O-N 2.99Å
748	L	78.6	Confident	68.7	Low	47 Å²	47	72.6 Å²	72.6	25%	0.246	35%	0.352	C	S	.	.	H	α-helix	trans	-65.2	-47.6	173.2	-80.9	172	0	0	0	112.1	V704 A708 A744 R745 T746 D750 K751 L752	V704-L748 HydrophobicContact CG1-CG 4.07Å; A708-L748 HydrophobicContact CB-CD1 3.52Å; A744-L748 PolarHBondContact O-N 3.49Å; R745-L748 PolarHBondContact O-N 3.32Å; T746-L748 VanDerWaalsContact C-N 3.34Å; T746-L748 PolarHBondContact O-N 3.19Å; L748-D750 PolarHBondContact O-N 3.43Å; L748-K751 PolarHBondContact O-N 3.04Å; L748-L752 WeakPolarHBondContact O-CB 3.24Å; L748-L752 VanDerWaalsContact O-CG 3.27Å; L748-L752 WeakPolarHBondContact O-CG 3.41Å; L748-L752 PolarHBondContact O-N 3.16Å
749	N	69.4	Low	66.6	Low	69 Å²	69	72.8 Å²	72.8	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-36	177.4	-74.3	-21.7	0	0	0	111.3	R745 T746 L752 R753	R745-N749 WeakPolarHBondContact O-CB 3.32Å; R745-N749 VanDerWaalsContact O-CG 3.24Å; R745-N749 PolarHBondContact O-N 2.98Å; R745-N749 PolarHBondContact O-ND2 3.29Å; T746-N749 PolarHBondContact O-N 3.05Å; N749-L752 PolarHBondContact O-N 3.34Å; N749-R753 WeakPolarHBondContact O-CB 3.45Å; N749-R753 VanDerWaalsContact O-CG 3.25Å; N749-R753 WeakPolarHBondContact O-CG 3.25Å; N749-R753 PolarHBondContact O-N 3.3Å
750	D	63.6	Low	64.5	Low	32 Å²	32	79.6 Å²	79.6	17%	0.171	39%	0.389	C	S	.	.	H	α-helix	trans	-71.3	-42.5	176.7	-72	-23.9	0	0	0	112.2	A118 T746 L747 L748 L752 R753 Q754	A118-D750 HydrophobicContact CB-CB 3.71Å; A118-D750 WeakPolarHBondContact CB-OD2 3.4Å; T746-D750 WeakPolarHBondContact O-CB 3.48Å; T746-D750 VanDerWaalsContact O-CG 3.24Å; T746-D750 PolarHBondContact O-N 3.12Å; L747-D750 PolarHBondContact O-N 2.99Å; L748-D750 PolarHBondContact O-N 3.43Å; D750-L752 VanDerWaalsContact C-N 3.29Å; D750-L752 PolarHBondContact O-N 2.65Å; D750-R753 WeakPolarHBondContact O-CB 3.32Å; D750-R753 PolarHBondContact O-N 3.24Å; D750-R753 IonicContact OD1-NH1 2.82Å; D750-Q754 WeakPolarHBondContact O-CG 3.16Å; D750-Q754 PolarHBondContact O-N 2.94Å
751	K	67.9	Low	62.2	Low	65 Å²	65	89.9 Å²	89.9	28%	0.283	43%	0.428	S	S	.	.	H	α-helix	trans	-58.9	-43.3	170.6	-76.1	-179.5	-178.7	174.6	0	110.7	L747 L748 R753 Q754 Y755	L747-K751 HydrophobicContact CD2-CD 4.28Å; L747-K751 WeakPolarHBondContact O-CG 3.49Å; L747-K751 PolarHBondContact O-N 2.99Å; L748-K751 PolarHBondContact O-N 3.04Å; K751-R753 PolarHBondContact O-N 3.02Å; K751-Q754 WeakPolarHBondContact O-CB 3.45Å; K751-Q754 PolarHBondContact O-N 2.8Å; K751-Y755 WeakPolarHBondContact O-CD2 3.3Å; K751-Y755 PolarHBondContact O-N 3.26Å
752	L	63.8	Low	59.7	Low	68 Å²	68	96 Å²	96	36%	0.356	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-41.3	176.1	-74.3	172.3	0	0	0	112.4	L748 N749 D750 Q754 Y755 G756 V757	L748-L752 WeakPolarHBondContact O-CB 3.24Å; L748-L752 VanDerWaalsContact O-CG 3.27Å; L748-L752 WeakPolarHBondContact O-CG 3.41Å; L748-L752 PolarHBondContact O-N 3.16Å; N749-L752 PolarHBondContact O-N 3.34Å; D750-L752 VanDerWaalsContact C-N 3.29Å; D750-L752 PolarHBondContact O-N 2.65Å; L752-Q754 VanDerWaalsContact C-N 3.31Å; L752-Q754 PolarHBondContact O-N 3.49Å; L752-Y755 CarbonylContact O-C 3.6Å; L752-Y755 WeakPolarHBondContact O-CA 3.44Å; L752-Y755 PolarHBondContact O-N 2.82Å; L752-G756 PolarHBondContact O-N 3.2Å; L752-G756 VanDerWaalsContact O-N 3.17Å; L752-V757 CarbonylContact C-O 3.47Å; L752-V757 HydrophobicContact CB-CB 4.11Å; L752-V757 HydrophobicContact CD2-CB 4.24Å; L752-V757 HydrophobicContact CD2-CG1 4.38Å; L752-V757 HydrophobicContact CD2-CG2 4.42Å; L752-V757 PolarHBondContact O-N 3.25Å
753	R	55.5	Low	57.5	Low	164 Å²	164	95.5 Å²	95.5	62%	0.619	46%	0.464	S	S	*	.	H	α-helix	trans	-61.3	-37.7	173	-77.4	169.4	174.6	-171.6	-5.1	112.4	N749 D750 K751 Y755 G756	N749-R753 WeakPolarHBondContact O-CB 3.45Å; N749-R753 VanDerWaalsContact O-CG 3.25Å; N749-R753 WeakPolarHBondContact O-CG 3.25Å; N749-R753 PolarHBondContact O-N 3.3Å; D750-R753 WeakPolarHBondContact O-CB 3.32Å; D750-R753 PolarHBondContact O-N 3.24Å; D750-R753 IonicContact OD1-NH1 2.82Å; K751-R753 PolarHBondContact O-N 3.02Å; R753-Y755 PolarHBondContact O-N 3.01Å; R753-G756 PolarHBondContact O-N 2.88Å
754	Q	48.8	Very low	55.2	Low	125 Å²	125	102.1 Å²	102.1	58%	0.584	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-31.4	173.1	-69.8	176.9	5.4	0	0	112.2	D750 K751 L752 G756	D750-Q754 WeakPolarHBondContact O-CG 3.16Å; D750-Q754 PolarHBondContact O-N 2.94Å; K751-Q754 WeakPolarHBondContact O-CB 3.45Å; K751-Q754 PolarHBondContact O-N 2.8Å; L752-Q754 VanDerWaalsContact C-N 3.31Å; L752-Q754 PolarHBondContact O-N 3.49Å; Q754-G756 VanDerWaalsContact C-N 3.28Å
755	Y	51.6	Low	52.6	Low	187 Å²	187	110.8 Å²	110.8	73%	0.733	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	8.7	172.1	-63.5	-68.4	0	0	0	113.7	K751 L752 R753 V757	K751-Y755 WeakPolarHBondContact O-CD2 3.3Å; K751-Y755 PolarHBondContact O-N 3.26Å; L752-Y755 CarbonylContact O-C 3.6Å; L752-Y755 WeakPolarHBondContact O-CA 3.44Å; L752-Y755 PolarHBondContact O-N 2.82Å; R753-Y755 PolarHBondContact O-N 3.01Å; Y755-V757 PolarHBondContact O-N 3.13Å
756	G	42.9	Very low	50.1	Low	35 Å²	35	115 Å²	115	36%	0.361	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	75	7.6	179.2	0	0	0	0	0	114.8	L752 R753 Q754 T758	L752-G756 PolarHBondContact O-N 3.2Å; L752-G756 VanDerWaalsContact O-N 3.17Å; R753-G756 PolarHBondContact O-N 2.88Å; Q754-G756 VanDerWaalsContact C-N 3.28Å; G756-T758 PolarHBondContact O-N 3.33Å
757	V	42.2	Very low	48.1	Very low	75 Å²	75	118.9 Å²	118.9	46%	0.455	58%	0.58	S	S	.	*			trans	-82.8	94.5	174.9	-176.9	0	0	0	0	108	L752 Y755 A759	L752-V757 CarbonylContact C-O 3.47Å; L752-V757 HydrophobicContact CB-CB 4.11Å; L752-V757 HydrophobicContact CD2-CB 4.24Å; L752-V757 HydrophobicContact CD2-CG1 4.38Å; L752-V757 HydrophobicContact CD2-CG2 4.42Å; L752-V757 PolarHBondContact O-N 3.25Å; Y755-V757 PolarHBondContact O-N 3.13Å; V757-A759 PolarHBondContact O-N 3.38Å; V757-A759 VanDerWaalsContact O-N 3.1Å
758	T	40.8	Very low	45.8	Very low	121 Å²	121	124.9 Å²	124.9	74%	0.742	61%	0.607	S	S	*	*			trans	-71.7	99.3	164.9	35.8	0	0	0	0	108.2	G756 K760	G756-T758 PolarHBondContact O-N 3.33Å; T758-K760 VanDerWaalsContact C-N 3.3Å; T758-K760 PolarHBondContact O-N 2.96Å
759	A	39.7	Very low	43.6	Very low	59 Å²	59	131.7 Å²	131.7	49%	0.488	64%	0.638	S	S	.	*			trans	-60.4	101.4	159	0	0	0	0	0	106.6	V757 R761	V757-A759 PolarHBondContact O-N 3.38Å; V757-A759 VanDerWaalsContact O-N 3.1Å; A759-R761 PolarHBondContact O-N 3.38Å
760	K	38.5	Very low	42	Very low	194 Å²	194	135 Å²	135	84%	0.843	66%	0.656	S	S	*	*			trans	-45.1	130.4	159.2	-112.5	-179.6	176.5	-179.9	0	105.3	T758 M762	T758-K760 VanDerWaalsContact C-N 3.3Å; T758-K760 PolarHBondContact O-N 2.96Å; K760-M762 PolarHBondContact O-N 2.88Å
761	R	35.7	Very low	40.7	Very low	216 Å²	216	140.5 Å²	140.5	82%	0.815	68%	0.68	S	S	*	*			trans	-47.4	113.7	167.4	-90.4	-177.6	173.3	170.3	-2.1	105.4	A759 D763	A759-R761 PolarHBondContact O-N 3.38Å; R761-D763 PolarHBondContact O-N 3.48Å
762	M	32	Very low	39.2	Very low	183 Å²	183	142.2 Å²	142.2	90%	0.901	70%	0.699	S	S	*	*			trans	-69.1	72.9	164.7	-72	178.2	129.6	0	0	105.2	K760 E764	K760-M762 PolarHBondContact O-N 2.88Å; M762-E764 PolarHBondContact O-N 3.1Å
763	D	35.3	Very low	38.3	Very low	118 Å²	118	143.3 Å²	143.3	63%	0.631	71%	0.705	S	S	*	*			trans	-65.3	118.2	156.4	-72.6	-35.4	0	0	0	103.7	R761 K765	R761-D763 PolarHBondContact O-N 3.48Å; D763-K765 PolarHBondContact O-N 3.24Å
764	E	32.7	Very low	37.9	Very low	195 Å²	195	139 Å²	139	91%	0.911	70%	0.7	S	S	*	*	S	Bend	trans	-65.2	26.5	-172.7	-66.3	176.3	153.2	0	0	113.6	M762	M762-E764 PolarHBondContact O-N 3.1Å
765	K	31.4	Very low	38.6	Very low	182 Å²	182	135.8 Å²	135.8	79%	0.791	68%	0.684	S	S	*	*	S	Bend	trans	-100.8	109.4	174.1	-70.6	-168.5	174.9	-174.3	0	109	D763 V767	D763-K765 PolarHBondContact O-N 3.24Å; K765-V767 PolarHBondContact O-N 2.97Å
766	E	29.2	Very low	40	Very low	197 Å²	197	129.2 Å²	129.2	92%	0.921	67%	0.665	S	S	*	*			trans	-25.8	95.5	159.9	-64.3	167.4	158.4	0	0	111.2
767	V	32	Very low	41.9	Very low	126 Å²	126	127.6 Å²	127.6	76%	0.764	65%	0.648	S	S	*	*			trans	-99.1	111.7	159.1	179.2	0	0	0	0	103.8	K765	K765-V767 PolarHBondContact O-N 2.97Å
768	E	31.1	Very low	44	Very low	165 Å²	165	124.4 Å²	124.4	77%	0.771	63%	0.629	S	S	*	*			trans	-35.8	138.1	168.5	-68.4	169.8	149.5	0	0	109.6	D770	E768-D770 PolarHBondContact O-N 2.64Å
769	E	31.2	Very low	46.4	Very low	190 Å²	190	118.6 Å²	118.6	89%	0.888	59%	0.594	S	S	*	*			trans	-63.2	65.6	178.1	-64.1	174.2	154.1	0	0	110.4	E771	E769-E771 VanDerWaalsContact C-N 3.25Å; E769-E771 PolarHBondContact O-N 2.79Å
770	D	35.6	Very low	48.7	Very low	139 Å²	139	115.8 Å²	115.8	74%	0.743	57%	0.57	S	S	*	*			trans	-63.2	100.4	160.4	-85.7	-24.9	0	0	0	104.5	E768 C772	E768-D770 PolarHBondContact O-N 2.64Å; D770-C772 PolarHBondContact O-N 2.88Å
771	E	37.4	Very low	51.1	Low	147 Å²	147	106.6 Å²	106.6	69%	0.687	53%	0.53	S	S	*	.			trans	-58	66.2	175.3	-66	-174.6	148	0	0	110.5	E769 N773	E769-E771 VanDerWaalsContact C-N 3.25Å; E769-E771 PolarHBondContact O-N 2.79Å; E771-N773 PolarHBondContact O-N 3.33Å
772	C	35.8	Very low	53.7	Low	101 Å²	101	96.3 Å²	96.3	68%	0.682	49%	0.492	S	S	*	.			trans	-74.5	49.2	157.4	-144.9	0	0	0	0	107.6	D770 C774	D770-C772 PolarHBondContact O-N 2.88Å; C772-C774 VanDerWaalsContact C-N 3.27Å; C772-C774 PolarHBondContact O-N 2.84Å
773	N	44.1	Very low	56.4	Low	90 Å²	90	87.7 Å²	87.7	48%	0.481	45%	0.449	S	S	.	.			trans	-63.2	98.6	163.6	-82.1	-30.1	0	0	0	104.4	E771 F775	E771-N773 PolarHBondContact O-N 3.33Å; N773-F775 HydrophobicContact CB-CD2 4.44Å; N773-F775 HydrophobicContact CB-CE1 4.19Å; N773-F775 HydrophobicContact CB-CE2 4.04Å; N773-F775 HydrophobicContact CB-CZ 3.93Å; N773-F775 WeakPolarHBondContact O-CD2 3.35Å; N773-F775 WeakPolarHBondContact O-CE2 3.25Å; N773-F775 PolarHBondContact O-N 3.35Å
774	C	47.4	Very low	58.9	Low	75 Å²	75	82.7 Å²	82.7	51%	0.507	42%	0.422	S	S	.	.			trans	-61.2	94	169.8	-58.7	0	0	0	0	106.9	C772	C772-C774 VanDerWaalsContact C-N 3.27Å; C772-C774 PolarHBondContact O-N 2.84Å
775	F	63.8	Low	61.3	Low	56 Å²	56	76.7 Å²	76.7	25%	0.246	40%	0.397	C	S	.	.			trans	-69	167.7	177	-63.2	-78.4	0	0	0	109.8	N773 A777 W832 F848 L853	N773-F775 HydrophobicContact CB-CD2 4.44Å; N773-F775 HydrophobicContact CB-CE1 4.19Å; N773-F775 HydrophobicContact CB-CE2 4.04Å; N773-F775 HydrophobicContact CB-CZ 3.93Å; N773-F775 WeakPolarHBondContact O-CD2 3.35Å; N773-F775 WeakPolarHBondContact O-CE2 3.25Å; N773-F775 PolarHBondContact O-N 3.35Å; F775-A777 PolarHBondContact O-N 3.39Å; F775-W832 HydrophobicContact CB-CH2 3.65Å; F775-W832 HydrophobicContact CB-CZ2 3.98Å; F775-W832 HydrophobicContact CB-CZ3 4.05Å; F775-W832 AromaticContact CD2-CH2 3.99Å; F775-W832 HydrophobicContact CD2-CH2 3.99Å; F775-W832 AromaticContact CD2-CZ2 3.55Å; F775-W832 HydrophobicContact CD2-CZ2 3.55Å; F775-W832 HydrophobicContact CG-CH2 4.26Å; F775-W832 HydrophobicContact CG-CZ2 4.23Å; F775-F848 HydrophobicContact CB-CE1 3.49Å; F775-F848 VanDerWaalsContact CB-CE1 3.49Å; F775-F848 HydrophobicContact CB-CZ 3.51Å; F775-F848 HydrophobicContact CD1-CE1 4.48Å; F775-F848 HydrophobicContact CD2-CE1 4.33Å; F775-F848 AromaticContact CG-CE1 3.88Å; F775-F848 HydrophobicContact CG-CE1 3.88Å; F775-F848 HydrophobicContact CG-CZ 4.37Å; F775-L853 HydrophobicContact CB-CD1 4.02Å; F775-L853 HydrophobicContact CD1-CD1 3.2Å; F775-L853 HydrophobicContact CE1-CD1 3.79Å; F775-L853 HydrophobicContact CG-CD1 3.84Å
776	C	80.2	Confident	63.7	Low	49 Å²	49	68.2 Å²	68.2	33%	0.331	36%	0.36	S	S	.	.			trans	-63.8	99.1	-176.1	-170.8	0	0	0	0	111.6	S778 T779 A780 L853	C776-S778 VanDerWaalsContact C-N 3.25Å; C776-S778 PolarHBondContact O-N 3.37Å; C776-T779 WeakPolarHBondContact CB-OG1 3.45Å; C776-T779 WeakPolarHBondContact O-CB 3.18Å; C776-T779 PolarHBondContact O-N 2.53Å; C776-T779 PolarHBondContact SG-OG1 2.58Å; C776-A780 PolarHBondContact O-N 3.03Å; C776-L853 HydrophobicContact CB-CD2 4.1Å
777	A	84.6	Confident	66	Low	1 Å²	1	63.1 Å²	63.1	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-35.3	178.9	0	0	0	0	0	112.4	F775 T779 A780 A781 L796 M828 L835	F775-A777 PolarHBondContact O-N 3.39Å; A777-T779 VanDerWaalsContact C-N 3.32Å; A777-T779 PolarHBondContact O-N 2.75Å; A777-A780 PolarHBondContact O-N 3.19Å; A777-A781 WeakPolarHBondContact O-CB 3.3Å; A777-A781 PolarHBondContact O-N 3.12Å; A777-L796 HydrophobicContact CB-CD1 4.21Å; A777-M828 HydrophobicContact CB-CE 4.02Å; A777-M828 HydrophobicContact CB-SD 3.58Å; A777-M828 VanDerWaalsContact CB-SD 3.58Å; A777-L835 HydrophobicContact CB-CD1 3.68Å; A777-L835 WeakPolarHBondContact O-CD1 3.42Å
778	S	86.3	Confident	68.2	Low	8 Å²	8	59 Å²	59	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-41.4	173.6	-56.6	0	0	0	0	111.8	C776 W782 L791	C776-S778 VanDerWaalsContact C-N 3.25Å; C776-S778 PolarHBondContact O-N 3.37Å; S778-W782 VanDerWaalsContact O-CB 3.31Å; S778-W782 WeakPolarHBondContact O-CB 3.21Å; S778-W782 PolarHBondContact O-N 3.02Å; S778-L791 PolarHBondContact OG-O 2.61Å
779	T	89.4	Confident	70.6	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.8	-41	175.4	-57	0	0	0	0	111.2	C776 A777 W782 L783 F848 E852 Q856	C776-T779 WeakPolarHBondContact CB-OG1 3.45Å; C776-T779 WeakPolarHBondContact O-CB 3.18Å; C776-T779 PolarHBondContact O-N 2.53Å; C776-T779 PolarHBondContact SG-OG1 2.58Å; A777-T779 VanDerWaalsContact C-N 3.32Å; A777-T779 PolarHBondContact O-N 2.75Å; T779-W782 HydrophobicContact CG2-CE3 4.44Å; T779-L783 VanDerWaalsContact O-CB 3.32Å; T779-L783 WeakPolarHBondContact O-CB 3.28Å; T779-L783 PolarHBondContact O-N 2.99Å; T779-F848 HydrophobicContact CG2-CD2 4.14Å; T779-F848 HydrophobicContact CG2-CE2 3.91Å; T779-E852 HydrophobicContact CG2-CB 4.03Å; T779-Q856 VanDerWaalsContact OG1-CD 3.31Å; T779-Q856 PolarHBondContact OG1-NE2 3.42Å; T779-Q856 PolarHBondContact OG1-OE1 2.91Å
780	A	89.4	Confident	73.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-45.9	177.5	0	0	0	0	0	112.1	C776 A777 L783 L784 W832 L835 L839 F848	C776-A780 PolarHBondContact O-N 3.03Å; A777-A780 PolarHBondContact O-N 3.19Å; A780-L783 WeakPolarHBondContact O-CB 3.46Å; A780-L783 PolarHBondContact O-N 3.28Å; A780-L784 WeakPolarHBondContact O-CG 2.76Å; A780-L784 PolarHBondContact O-N 3.02Å; A780-W832 HydrophobicContact CB-CZ3 3.93Å; A780-L835 HydrophobicContact CB-CB 4.23Å; A780-L835 HydrophobicContact CB-CD1 4.06Å; A780-L839 HydrophobicContact CB-CD1 3.7Å; A780-L839 HydrophobicContact CB-CG 4.47Å; A780-F848 HydrophobicContact CB-CD2 4.2Å; A780-F848 HydrophobicContact CB-CE2 3.69Å; A780-F848 HydrophobicContact CB-CZ 4.1Å
781	A	89.4	Confident	75.4	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.9	-41.5	177.8	0	0	0	0	0	112.4	A777 L783 L784 N785 L791 L796 Y800 L835	A777-A781 WeakPolarHBondContact O-CB 3.3Å; A777-A781 PolarHBondContact O-N 3.12Å; A781-L783 VanDerWaalsContact C-N 3.34Å; A781-L784 WeakPolarHBondContact O-CB 3.49Å; A781-L784 PolarHBondContact O-N 2.97Å; A781-N785 PolarHBondContact O-N 2.95Å; A781-L791 HydrophobicContact CB-CD1 4.06Å; A781-L796 HydrophobicContact CB-CD2 3.28Å; A781-Y800 HydrophobicContact CB-CE2 3.81Å; A781-L835 HydrophobicContact CB-CD1 4.39Å; A781-L835 HydrophobicContact CB-CD2 4Å
782	W	89.9	Confident	77.5	Confident	1 Å²	1	43.7 Å²	43.7	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-38	172.8	165.7	78	0	0	0	112.4	S778 T779 L784 N785 P786 E852 W989 F990 T991	S778-W782 VanDerWaalsContact O-CB 3.31Å; S778-W782 WeakPolarHBondContact O-CB 3.21Å; S778-W782 PolarHBondContact O-N 3.02Å; T779-W782 HydrophobicContact CG2-CE3 4.44Å; W782-L784 VanDerWaalsContact C-N 3.25Å; W782-L784 PolarHBondContact O-N 3.36Å; W782-N785 CarbonylContact O-C 3.57Å; W782-N785 PolarHBondContact O-N 3.12Å; W782-P786 PolarHBondContact NE1-O 3.16Å; W782-P786 WeakPolarHBondContact O-CA 3.43Å; W782-P786 WeakPolarHBondContact O-CD 3.33Å; W782-P786 WeakPolarHBondContact O-CG 3.42Å; W782-E852 HydrophobicContact CZ3-CG 4.31Å; W782-W989 WeakPolarHBondContact CZ2-O 3.49Å; W782-F990 HydrophobicContact CB-CD1 3.52Å; W782-F990 HydrophobicContact CB-CE1 3.97Å; W782-F990 AromaticContact CD1-CD1 3.93Å; W782-F990 HydrophobicContact CD2-CD1 4.02Å; W782-F990 HydrophobicContact CG-CB 4.34Å; W782-F990 AromaticContact CG-CD1 3.52Å; W782-F990 HydrophobicContact CG-CD1 3.52Å; W782-F990 HydrophobicContact CG-CE1 4.32Å; W782-F990 HydrophobicContact CG-CG 4.41Å; W782-F990 VanDerWaalsContact NE1-C 3.31Å; W782-T991 VanDerWaalsContact CZ2-O 3.24Å; W782-T991 WeakPolarHBondContact CZ2-O 3.09Å; W782-T991 PolarHBondContact NE1-O 3.08Å
783	L	87.9	Confident	79.5	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-35.4	176.1	-167.6	66.2	0	0	0	111.6	T779 A780 A781 L839 M844 A847 F848 E852 R1113	T779-L783 VanDerWaalsContact O-CB 3.32Å; T779-L783 WeakPolarHBondContact O-CB 3.28Å; T779-L783 PolarHBondContact O-N 2.99Å; A780-L783 WeakPolarHBondContact O-CB 3.46Å; A780-L783 PolarHBondContact O-N 3.28Å; A781-L783 VanDerWaalsContact C-N 3.34Å; L783-L839 HydrophobicContact CB-CD2 4.45Å; L783-L839 HydrophobicContact CD2-CD2 3.86Å; L783-L839 HydrophobicContact CG-CD2 4.43Å; L783-M844 HydrophobicContact CD2-CB 4.14Å; L783-M844 HydrophobicContact CG-SD 4.2Å; L783-A847 HydrophobicContact CD2-CB 4.39Å; L783-F848 HydrophobicContact CD2-CB 3.74Å; L783-F848 HydrophobicContact CD2-CD2 4.34Å; L783-E852 HydrophobicContact CD1-CG 4.36Å; L783-R1113 HydrophobicContact CD1-CG 3.62Å
784	L	87.4	Confident	81	Confident	14 Å²	14	41 Å²	41	7%	0.073	21%	0.211	C	C	.	.	H	α-helix	trans	-72.6	-33.7	173.6	-70.4	163.3	0	0	0	112.9	A780 A781 W782 Y800 L835 L838 L839 M842 M844	A780-L784 WeakPolarHBondContact O-CG 2.76Å; A780-L784 PolarHBondContact O-N 3.02Å; A781-L784 WeakPolarHBondContact O-CB 3.49Å; A781-L784 PolarHBondContact O-N 2.97Å; W782-L784 VanDerWaalsContact C-N 3.25Å; W782-L784 PolarHBondContact O-N 3.36Å; L784-Y800 HydrophobicContact CD1-CE1 4.4Å; L784-L835 HydrophobicContact CD1-CD2 3.66Å; L784-L838 HydrophobicContact CD1-CB 3.79Å; L784-L838 HydrophobicContact CD1-CD1 4.11Å; L784-L838 HydrophobicContact CD2-CB 3.82Å; L784-L839 HydrophobicContact CD2-CD2 4.27Å; L784-L839 HydrophobicContact CG-CD2 4.08Å; L784-M842 HydrophobicContact CD2-CE 4.45Å; L784-M842 HydrophobicContact CD2-CG 4.48Å; L784-M842 HydrophobicContact CD2-SD 3.74Å; L784-M844 HydrophobicContact CD2-CE 3.5Å; L784-M844 VanDerWaalsContact CD2-CE 3.5Å; L784-M844 HydrophobicContact CG-CE 4.15Å
785	N	84.3	Confident	82.7	Confident	69 Å²	69	41.5 Å²	41.5	37%	0.369	21%	0.206	S	C	.	.			trans	-140.4	84.2	178.1	-174.2	4.6	0	0	0	112.1	A781 W782 D787 S788	A781-N785 PolarHBondContact O-N 2.95Å; W782-N785 CarbonylContact O-C 3.57Å; W782-N785 PolarHBondContact O-N 3.12Å; N785-D787 PolarHBondContact O-N 3.03Å; N785-D787 VanDerWaalsContact O-N 3.13Å; N785-S788 WeakPolarHBondContact O-CB 3.4Å; N785-S788 PolarHBondContact O-N 2.93Å; N785-S788 VanDerWaalsContact O-N 3.08Å; N785-S788 PolarHBondContact O-OG 3.01Å
786	P	80.4	Confident	83.8	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.019	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-64.4	-21.3	-172.9	-26.2	35.3	0	0	0	115.2	W782 S788 Q1115	W782-P786 PolarHBondContact NE1-O 3.16Å; W782-P786 WeakPolarHBondContact O-CA 3.43Å; W782-P786 WeakPolarHBondContact O-CD 3.33Å; W782-P786 WeakPolarHBondContact O-CG 3.42Å; P786-S788 VanDerWaalsContact C-N 3.29Å; P786-Q1115 HydrophobicContact CG-CG 4.39Å
787	D	77.9	Confident	83.9	Confident	91 Å²	91	36.7 Å²	36.7	49%	0.487	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-79.5	-13.6	179.8	-68	-17.2	0	0	0	112.3	N785 G789 A992 Q1115	N785-D787 PolarHBondContact O-N 3.03Å; N785-D787 VanDerWaalsContact O-N 3.13Å; D787-G789 VanDerWaalsContact C-N 3.29Å; D787-G789 PolarHBondContact O-N 2.84Å; D787-A992 WeakPolarHBondContact OD1-CB 3.23Å; D787-Q1115 PolarHBondContact OD1-NE2 2.76Å
788	S	79.8	Confident	83.8	Confident	40 Å²	40	41.2 Å²	41.2	28%	0.28	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-72.5	-18.6	179.1	66.1	0	0	0	0	114.2	N785 P786	N785-S788 WeakPolarHBondContact O-CB 3.4Å; N785-S788 PolarHBondContact O-N 2.93Å; N785-S788 VanDerWaalsContact O-N 3.08Å; N785-S788 PolarHBondContact O-OG 3.01Å; P786-S788 VanDerWaalsContact C-N 3.29Å
789	G	80.9	Confident	83.7	Confident	18 Å²	18	45.3 Å²	45.3	19%	0.186	22%	0.221	C	C	.	.			trans	67	-150.1	-170.7	0	0	0	0	0	112.3	D787 L791	D787-G789 VanDerWaalsContact C-N 3.29Å; D787-G789 PolarHBondContact O-N 2.84Å; G789-L791 PolarHBondContact O-N 3.49Å
790	R	84.1	Confident	83.6	Confident	187 Å²	187	47.1 Å²	47.1	71%	0.706	23%	0.228	S	C	*	.	S	Bend	trans	-85.5	110.2	177.8	-173.6	-178.7	178.3	178.8	-0.2	110.4	F990	R790-F990 HydrophobicContact CB-CB 4.16Å; R790-F990 HydrophobicContact CB-CD1 4.23Å; R790-F990 HydrophobicContact CB-CD2 3.56Å; R790-F990 HydrophobicContact CB-CE2 3.95Å; R790-F990 HydrophobicContact CB-CG 3.72Å; R790-F990 HydrophobicContact CB-CZ 4.45Å; R790-F990 HydrophobicContact CG-CD2 3.85Å; R790-F990 HydrophobicContact CG-CE1 4.41Å; R790-F990 HydrophobicContact CG-CE2 3.67Å; R790-F990 HydrophobicContact CG-CG 4.29Å; R790-F990 HydrophobicContact CG-CZ 3.98Å
791	L	84	Confident	83.3	Confident	15 Å²	15	47.2 Å²	47.2	8%	0.079	23%	0.229	C	C	.	.			trans	-79.9	133.8	175.5	-64.4	171.6	0	0	0	112.2	S778 A781 G789 E795 L796 I799	S778-L791 PolarHBondContact OG-O 2.61Å; A781-L791 HydrophobicContact CB-CD1 4.06Å; G789-L791 PolarHBondContact O-N 3.49Å; L791-E795 HydrophobicContact CB-CB 4.43Å; L791-E795 HydrophobicContact CD2-CB 4.11Å; L791-L796 HydrophobicContact CB-CD2 3.76Å; L791-L796 HydrophobicContact CB-CG 3.97Å; L791-L796 HydrophobicContact CD1-CD2 3.81Å; L791-L796 HydrophobicContact CG-CD2 4.46Å; L791-I799 HydrophobicContact CD1-CD1 3.85Å; L791-I799 HydrophobicContact CD2-CD1 4.16Å
792	H	81	Confident	82.9	Confident	99 Å²	99	51 Å²	51	46%	0.458	25%	0.253	S	S	.	.			trans	-70.7	149.8	170.7	-169.5	-94.1	0	0	0	110.2	K794 E795 L796	H792-K794 PolarHBondContact ND1-N 3.04Å; H792-K794 PolarHBondContact O-N 3.42Å; H792-E795 HydrophobicContact CB-CG 4.31Å; H792-E795 WeakPolarHBondContact CB-OE2 3.48Å; H792-E795 PolarHBondContact N-OE2 3.11Å; H792-E795 WeakPolarHBondContact O-CB 3.46Å; H792-E795 PolarHBondContact O-N 2.98Å; H792-L796 PolarHBondContact O-N 3.15Å
793	P	76.9	Confident	82.3	Confident	17 Å²	17	54.9 Å²	54.9	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-51.8	-31.6	179.2	-31.8	37.7	0	0	0	115.1	L797 A827 M828	P793-L797 PolarHBondContact O-N 3.46Å; P793-L797 VanDerWaalsContact O-N 3.15Å; P793-A827 HydrophobicContact CB-CB 3.93Å; P793-M828 HydrophobicContact CG-CE 4.49Å
794	K	76.6	Confident	81.6	Confident	118 Å²	118	57.4 Å²	57.4	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-46	173.7	-171.1	-173.8	177.3	-157.1	0	112.4	H792 L796 L797 E798	H792-K794 PolarHBondContact ND1-N 3.04Å; H792-K794 PolarHBondContact O-N 3.42Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.21Å; K794-L797 WeakPolarHBondContact O-CB 3.34Å; K794-L797 PolarHBondContact O-N 2.97Å; K794-E798 WeakPolarHBondContact CE-OE1 3.45Å; K794-E798 IonicContact NZ-OE1 3.85Å; K794-E798 WeakPolarHBondContact O-CG 3.19Å; K794-E798 PolarHBondContact O-N 3.49Å
795	E	83.3	Confident	80.7	Confident	84 Å²	84	58.7 Å²	58.7	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-66.7	-36.5	178.4	-61.2	171.1	127.9	0	0	110.7	L791 H792 L797 E798 I799	L791-E795 HydrophobicContact CB-CB 4.43Å; L791-E795 HydrophobicContact CD2-CB 4.11Å; H792-E795 HydrophobicContact CB-CG 4.31Å; H792-E795 WeakPolarHBondContact CB-OE2 3.48Å; H792-E795 PolarHBondContact N-OE2 3.11Å; H792-E795 WeakPolarHBondContact O-CB 3.46Å; H792-E795 PolarHBondContact O-N 2.98Å; E795-L797 VanDerWaalsContact C-N 3.34Å; E795-L797 PolarHBondContact O-N 3.28Å; E795-E798 PolarHBondContact O-N 3.08Å; E795-I799 WeakPolarHBondContact O-CB 3.43Å; E795-I799 WeakPolarHBondContact O-CD1 3.27Å; E795-I799 VanDerWaalsContact O-CG1 3.24Å; E795-I799 WeakPolarHBondContact O-CG1 3.26Å; E795-I799 PolarHBondContact O-N 3.42Å
796	L	85.8	Confident	80	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-44.2	173.2	-71	178.5	0	0	0	112	A777 A781 L791 H792 K794 I799 Y800 M828 V831	A777-L796 HydrophobicContact CB-CD1 4.21Å; A781-L796 HydrophobicContact CB-CD2 3.28Å; L791-L796 HydrophobicContact CB-CD2 3.76Å; L791-L796 HydrophobicContact CB-CG 3.97Å; L791-L796 HydrophobicContact CD1-CD2 3.81Å; L791-L796 HydrophobicContact CG-CD2 4.46Å; H792-L796 PolarHBondContact O-N 3.15Å; K794-L796 VanDerWaalsContact C-N 3.31Å; K794-L796 PolarHBondContact O-N 3.21Å; L796-I799 PolarHBondContact O-N 3.05Å; L796-Y800 HydrophobicContact CD2-CD2 4.22Å; L796-Y800 HydrophobicContact CD2-CE2 4.01Å; L796-Y800 WeakPolarHBondContact O-CB 3.14Å; L796-Y800 WeakPolarHBondContact O-CD2 3.25Å; L796-Y800 PolarHBondContact O-N 3.38Å; L796-M828 HydrophobicContact CD1-CE 4.41Å; L796-M828 HydrophobicContact CD1-SD 4.09Å; L796-V831 HydrophobicContact CB-CG1 4.3Å; L796-V831 HydrophobicContact CB-CG2 4.31Å
797	L	82.2	Confident	79.2	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-43.9	174.6	-77	161.8	0	0	0	112.1	P793 K794 E795 I799 C801 P802 L805 L808 A827 L830 V831	P793-L797 PolarHBondContact O-N 3.46Å; P793-L797 VanDerWaalsContact O-N 3.15Å; K794-L797 WeakPolarHBondContact O-CB 3.34Å; K794-L797 PolarHBondContact O-N 2.97Å; E795-L797 VanDerWaalsContact C-N 3.34Å; E795-L797 PolarHBondContact O-N 3.28Å; L797-I799 PolarHBondContact O-N 3.44Å; L797-C801 HydrophobicContact CD2-CB 4.12Å; L797-C801 CarbonylContact O-C 3.58Å; L797-C801 WeakPolarHBondContact O-CA 3.32Å; L797-C801 PolarHBondContact O-N 3.01Å; L797-P802 VanDerWaalsContact O-N 3.16Å; L797-L805 HydrophobicContact CB-CD1 4.02Å; L797-L805 HydrophobicContact CB-CG 4.29Å; L797-L808 HydrophobicContact CD1-CD1 3.21Å; L797-L808 HydrophobicContact CD2-CD1 3.73Å; L797-L808 HydrophobicContact CG-CD1 4.08Å; L797-A827 HydrophobicContact CD1-CB 3.37Å; L797-A827 HydrophobicContact CD2-CB 4.24Å; L797-A827 HydrophobicContact CG-CB 3.7Å; L797-L830 HydrophobicContact CD2-CB 4.4Å; L797-L830 HydrophobicContact CD2-CD1 4.35Å; L797-V831 HydrophobicContact CD2-CG2 3.84Å; L797-V831 HydrophobicContact CG-CG2 4.1Å
798	E	83.7	Confident	78.4	Confident	95 Å²	95	59.2 Å²	59.2	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-34.9	179.9	-71.7	174.3	-178.5	0	0	112	K794 E795 L805	K794-E798 WeakPolarHBondContact CE-OE1 3.45Å; K794-E798 IonicContact NZ-OE1 3.85Å; K794-E798 WeakPolarHBondContact O-CG 3.19Å; K794-E798 PolarHBondContact O-N 3.49Å; E795-E798 PolarHBondContact O-N 3.08Å; E798-L805 VanDerWaalsContact CA-CD1 3.41Å; E798-L805 HydrophobicContact CB-CD1 4.04Å; E798-L805 HydrophobicContact CG-CD1 3.48Å; E798-L805 VanDerWaalsContact CG-CD1 3.48Å; E798-L805 HydrophobicContact CG-CD2 4.26Å; E798-L805 HydrophobicContact CG-CG 4.49Å
799	I	84.4	Confident	77.5	Confident	95 Å²	95	67.6 Å²	67.6	49%	0.487	34%	0.344	S	S	.	.	H	α-helix	trans	-83.7	-47.1	-178.4	-64.9	164.6	0	0	0	111.9	L791 E795 L796 L797	L791-I799 HydrophobicContact CD1-CD1 3.85Å; L791-I799 HydrophobicContact CD2-CD1 4.16Å; E795-I799 WeakPolarHBondContact O-CB 3.43Å; E795-I799 WeakPolarHBondContact O-CD1 3.27Å; E795-I799 VanDerWaalsContact O-CG1 3.24Å; E795-I799 WeakPolarHBondContact O-CG1 3.26Å; E795-I799 PolarHBondContact O-N 3.42Å; L796-I799 PolarHBondContact O-N 3.05Å; L797-I799 PolarHBondContact O-N 3.44Å
800	Y	86	Confident	76.3	Confident	37 Å²	37	75.5 Å²	75.5	15%	0.145	37%	0.374	C	S	.	.	H	α-helix	trans	-104.8	-25.2	-167.8	-62.9	-76.8	0	0	0	114.3	A781 L784 L796 V831 L835 L838	A781-Y800 HydrophobicContact CB-CE2 3.81Å; L784-Y800 HydrophobicContact CD1-CE1 4.4Å; L796-Y800 HydrophobicContact CD2-CD2 4.22Å; L796-Y800 HydrophobicContact CD2-CE2 4.01Å; L796-Y800 WeakPolarHBondContact O-CB 3.14Å; L796-Y800 WeakPolarHBondContact O-CD2 3.25Å; L796-Y800 PolarHBondContact O-N 3.38Å; Y800-V831 HydrophobicContact CD2-CG1 4.11Å; Y800-V831 HydrophobicContact CG-CG1 4.25Å; Y800-L835 HydrophobicContact CD1-CD2 3.87Å; Y800-L835 HydrophobicContact CD2-CD2 3.87Å; Y800-L835 HydrophobicContact CE1-CD2 3.62Å; Y800-L835 HydrophobicContact CE2-CD2 3.64Å; Y800-L835 HydrophobicContact CG-CD2 3.99Å; Y800-L835 VanDerWaalsContact CZ-CD2 3.5Å; Y800-L838 HydrophobicContact CD1-CD1 3.85Å; Y800-L838 HydrophobicContact CE1-CD1 3.64Å
801	C	83.9	Confident	74.9	Confident	3 Å²	3	68 Å²	68	2%	0.02	35%	0.348	C	S	.	.			trans	-136.7	54.1	-178.8	-56.3	0	0	0	0	112.4	L797 A803 D804 L830 V831 H834	L797-C801 HydrophobicContact CD2-CB 4.12Å; L797-C801 CarbonylContact O-C 3.58Å; L797-C801 WeakPolarHBondContact O-CA 3.32Å; L797-C801 PolarHBondContact O-N 3.01Å; C801-A803 PolarHBondContact O-N 3.38Å; C801-A803 VanDerWaalsContact O-N 3.15Å; C801-D804 HydrophobicContact CB-CB 4.38Å; C801-D804 PolarHBondContact O-N 2.83Å; C801-D804 VanDerWaalsContact O-N 3.09Å; C801-L830 PolarHBondContact SG-O 3.36Å; C801-V831 HydrophobicContact CB-CG2 4.38Å; C801-H834 PolarHBondContact SG-ND1 3.11Å; C801-H834 VanDerWaalsContact SG-ND1 3.43Å
802	P	80.4	Confident	73.4	Confident	79 Å²	79	69.2 Å²	69.2	51%	0.513	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.9	-176.5	25.7	-34.8	0	0	0	113.2	L797 D804	L797-P802 VanDerWaalsContact O-N 3.16Å; P802-D804 VanDerWaalsContact C-N 3.32Å
803	A	77.9	Confident	72	Confident	82 Å²	82	70.3 Å²	70.3	68%	0.678	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-27	177.4	0	0	0	0	0	113.3	C801 P806	C801-A803 PolarHBondContact O-N 3.38Å; C801-A803 VanDerWaalsContact O-N 3.15Å; A803-P806 WeakPolarHBondContact O-CD 3.36Å
804	D	72	Confident	70.8	Confident	55 Å²	55	71.9 Å²	71.9	29%	0.294	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-14.8	-178	-62.7	-63.1	0	0	0	113.1	C801 P802 P806 S807 L808 L830	C801-D804 HydrophobicContact CB-CB 4.38Å; C801-D804 PolarHBondContact O-N 2.83Å; C801-D804 VanDerWaalsContact O-N 3.09Å; P802-D804 VanDerWaalsContact C-N 3.32Å; D804-P806 VanDerWaalsContact C-CD 3.46Å; D804-S807 WeakPolarHBondContact O-CA 3.44Å; D804-S807 VanDerWaalsContact O-CB 3.25Å; D804-S807 WeakPolarHBondContact O-CB 3.4Å; D804-S807 PolarHBondContact O-N 3.48Å; D804-L808 PolarHBondContact O-N 3.42Å; D804-L830 HydrophobicContact CB-CD1 4.07Å
805	L	70	Confident	69.5	Low	41 Å²	41	71.3 Å²	71.3	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-54	-42.6	178.1	-113.1	136	0	0	0	114.4	L797 E798 S807 L808 R809	L797-L805 HydrophobicContact CB-CD1 4.02Å; L797-L805 HydrophobicContact CB-CG 4.29Å; E798-L805 VanDerWaalsContact CA-CD1 3.41Å; E798-L805 HydrophobicContact CB-CD1 4.04Å; E798-L805 HydrophobicContact CG-CD1 3.48Å; E798-L805 VanDerWaalsContact CG-CD1 3.48Å; E798-L805 HydrophobicContact CG-CD2 4.26Å; E798-L805 HydrophobicContact CG-CG 4.49Å; L805-S807 VanDerWaalsContact C-N 3.27Å; L805-S807 PolarHBondContact O-N 3.07Å; L805-L808 PolarHBondContact O-N 3.21Å; L805-R809 PolarHBondContact O-N 3.45Å
806	P	68.6	Low	68.4	Low	75 Å²	75	69.2 Å²	69.2	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-58.7	-38.1	173.7	-23.9	34.6	0	0	0	112.8	A803 D804 L808 R809	A803-P806 WeakPolarHBondContact O-CD 3.36Å; D804-P806 VanDerWaalsContact C-CD 3.46Å; P806-L808 PolarHBondContact O-N 3.09Å; P806-R809 WeakPolarHBondContact O-CB 3.41Å; P806-R809 PolarHBondContact O-N 3.48Å
807	S	63.5	Low	66.8	Low	82 Å²	82	77.3 Å²	77.3	57%	0.573	42%	0.422	S	S	*	.	H	α-helix	trans	-65.7	-28.1	179.3	-49.5	0	0	0	0	112.3	D804 L805	D804-S807 WeakPolarHBondContact O-CA 3.44Å; D804-S807 VanDerWaalsContact O-CB 3.25Å; D804-S807 WeakPolarHBondContact O-CB 3.4Å; D804-S807 PolarHBondContact O-N 3.48Å; L805-S807 VanDerWaalsContact C-N 3.27Å; L805-S807 PolarHBondContact O-N 3.07Å
808	L	62.1	Low	65.5	Low	17 Å²	17	78.9 Å²	78.9	9%	0.089	44%	0.436	C	S	.	.	H	α-helix	trans	-85.4	-13.4	179.2	-62.5	172.6	0	0	0	114.3	L797 D804 L805 P806 F810 I811 I826 L830	L797-L808 HydrophobicContact CD1-CD1 3.21Å; L797-L808 HydrophobicContact CD2-CD1 3.73Å; L797-L808 HydrophobicContact CG-CD1 4.08Å; D804-L808 PolarHBondContact O-N 3.42Å; L805-L808 PolarHBondContact O-N 3.21Å; P806-L808 PolarHBondContact O-N 3.09Å; L808-F810 PolarHBondContact O-N 3.11Å; L808-I811 HydrophobicContact CB-CD1 4.38Å; L808-I811 HydrophobicContact CD2-CD1 3.71Å; L808-I811 WeakPolarHBondContact O-CG1 3.37Å; L808-I811 PolarHBondContact O-N 2.88Å; L808-I826 HydrophobicContact CD2-CB 4.33Å; L808-I826 HydrophobicContact CD2-CG2 3.5Å; L808-I826 VanDerWaalsContact CD2-CG2 3.5Å; L808-L830 HydrophobicContact CD1-CD1 4.31Å; L808-L830 HydrophobicContact CD2-CD1 4.32Å
809	R	59.6	Low	64.4	Low	215 Å²	215	74.6 Å²	74.6	81%	0.811	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.6	174.3	-71	-174.2	178.6	176.2	0.3	112.9	L805 P806 I811	L805-R809 PolarHBondContact O-N 3.45Å; P806-R809 WeakPolarHBondContact O-CB 3.41Å; P806-R809 PolarHBondContact O-N 3.48Å; R809-I811 VanDerWaalsContact C-N 3.29Å; R809-I811 PolarHBondContact O-N 3.37Å
810	F	56.2	Low	63.3	Low	184 Å²	184	73.2 Å²	73.2	81%	0.807	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.2	175.1	-77.6	-83.5	0	0	0	114.5	L808 P812	L808-F810 PolarHBondContact O-N 3.11Å; F810-P812 VanDerWaalsContact O-CD 3.28Å; F810-P812 WeakPolarHBondContact O-CD 3.39Å
811	I	55.9	Low	62.3	Low	31 Å²	31	75.1 Å²	75.1	16%	0.159	43%	0.43	C	S	.	.	S	Bend	trans	-80.3	114.4	176.7	-57.9	173.2	0	0	0	108.9	L808 R809 T813 M823 I826	L808-I811 HydrophobicContact CB-CD1 4.38Å; L808-I811 HydrophobicContact CD2-CD1 3.71Å; L808-I811 WeakPolarHBondContact O-CG1 3.37Å; L808-I811 PolarHBondContact O-N 2.88Å; R809-I811 VanDerWaalsContact C-N 3.29Å; R809-I811 PolarHBondContact O-N 3.37Å; I811-T813 PolarHBondContact O-N 2.81Å; I811-M823 HydrophobicContact CB-CE 3.89Å; I811-M823 HydrophobicContact CD1-CB 4.12Å; I811-M823 HydrophobicContact CD1-CE 4.37Å; I811-M823 HydrophobicContact CD1-CG 4.15Å; I811-M823 HydrophobicContact CG2-CE 4.09Å; I811-I826 HydrophobicContact CD1-CD1 3.83Å
812	P	51.3	Low	61.5	Low	39 Å²	39	77.2 Å²	77.2	25%	0.253	45%	0.445	S	S	.	.			trans	-63.6	127.6	-176.6	-18.6	31.2	0	0	0	111.4	F810 S814 S819	F810-P812 VanDerWaalsContact O-CD 3.28Å; F810-P812 WeakPolarHBondContact O-CD 3.39Å; P812-S814 VanDerWaalsContact CB-OG 3.23Å; P812-S814 WeakPolarHBondContact CB-OG 3.47Å; P812-S814 PolarHBondContact O-N 3.09Å; P812-S819 WeakPolarHBondContact O-CB 3.31Å; P812-S819 PolarHBondContact O-OG 2.93Å; P812-S819 VanDerWaalsContact O-OG 3.11Å
813	T	52.4	Low	60.9	Low	123 Å²	123	76 Å²	76	76%	0.755	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.6	169.6	37.3	0	0	0	0	112.6	I811 L815 G816	I811-T813 PolarHBondContact O-N 2.81Å; T813-L815 VanDerWaalsContact C-N 3.27Å; T813-L815 PolarHBondContact O-N 3.33Å; T813-G816 PolarHBondContact O-N 2.69Å
814	S	51.4	Low	60.6	Low	50 Å²	50	73.6 Å²	73.6	35%	0.35	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-63.7	-22.4	-179	53.7	0	0	0	0	115.4	E144 P812 G816	E144-S814 VanDerWaalsContact CG-CB 3.43Å; P812-S814 VanDerWaalsContact CB-OG 3.23Å; P812-S814 WeakPolarHBondContact CB-OG 3.47Å; P812-S814 PolarHBondContact O-N 3.09Å; S814-G816 PolarHBondContact O-N 3.42Å; S814-G816 VanDerWaalsContact O-N 3.14Å
815	L	49.5	Very low	60.7	Low	105 Å²	105	74.2 Å²	74.2	55%	0.55	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-74.5	5.2	177	-80.7	153.3	0	0	0	113.2	T813 Q817 A818 S819	T813-L815 VanDerWaalsContact C-N 3.27Å; T813-L815 PolarHBondContact O-N 3.33Å; L815-Q817 PolarHBondContact O-N 2.62Å; L815-A818 WeakPolarHBondContact O-CB 3.48Å; L815-A818 PolarHBondContact O-N 3.46Å; L815-A818 VanDerWaalsContact O-N 3.16Å; L815-S819 VanDerWaalsContact CB-CB 3.4Å; L815-S819 PolarHBondContact O-N 3.17Å
816	G	59	Low	61	Low	40 Å²	40	75.8 Å²	75.8	41%	0.412	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-134.5	177	0	0	0	0	0	112.2	T813 S814 A818 S819 T820	T813-G816 PolarHBondContact O-N 2.69Å; S814-G816 PolarHBondContact O-N 3.42Å; S814-G816 VanDerWaalsContact O-N 3.14Å; G816-A818 PolarHBondContact O-N 3.35Å; G816-S819 PolarHBondContact O-N 3.45Å; G816-T820 PolarHBondContact O-N 2.85Å; G816-T820 PolarHBondContact O-OG1 3Å
817	Q	53.7	Low	61.2	Low	171 Å²	171	72.2 Å²	72.2	80%	0.799	40%	0.404	S	S	*	.	H	α-helix	trans	-57.1	-31	178.4	-88.5	176.7	-17.1	0	0	113.5	L815 T820 C821	L815-Q817 PolarHBondContact O-N 2.62Å; Q817-T820 WeakPolarHBondContact CA-OG1 3.36Å; Q817-T820 PolarHBondContact O-N 3.34Å; Q817-T820 PolarHBondContact O-OG1 3.21Å; Q817-C821 PolarHBondContact O-N 3.28Å; Q817-C821 PolarHBondContact O-SG 2.87Å
818	A	53.7	Low	61.8	Low	37 Å²	37	70.5 Å²	70.5	31%	0.306	39%	0.388	S	S	.	.	H	α-helix	trans	-69.7	-38.6	179.8	0	0	0	0	0	111.6	L815 G816 T820 C821 C822	L815-A818 WeakPolarHBondContact O-CB 3.48Å; L815-A818 PolarHBondContact O-N 3.46Å; L815-A818 VanDerWaalsContact O-N 3.16Å; G816-A818 PolarHBondContact O-N 3.35Å; A818-T820 VanDerWaalsContact C-N 3.31Å; A818-T820 PolarHBondContact O-N 3.28Å; A818-C821 PolarHBondContact O-N 3.5Å; A818-C822 PolarHBondContact O-N 3.27Å; A818-C822 PolarHBondContact O-SG 3.25Å; A818-C822 VanDerWaalsContact O-SG 3.35Å
819	S	60	Low	62.6	Low	6 Å²	6	73.3 Å²	73.3	4%	0.042	41%	0.408	C	S	.	.	H	α-helix	trans	-62	-41.5	174.3	124.3	0	0	0	0	111.6	P812 L815 G816 C821 C822 M823	P812-S819 WeakPolarHBondContact O-CB 3.31Å; P812-S819 PolarHBondContact O-OG 2.93Å; P812-S819 VanDerWaalsContact O-OG 3.11Å; L815-S819 VanDerWaalsContact CB-CB 3.4Å; L815-S819 PolarHBondContact O-N 3.17Å; G816-S819 PolarHBondContact O-N 3.45Å; S819-C821 VanDerWaalsContact C-N 3.32Å; S819-C821 PolarHBondContact O-N 2.88Å; S819-C822 PolarHBondContact O-N 3.36Å; S819-M823 WeakPolarHBondContact O-CB 3.36Å; S819-M823 PolarHBondContact O-N 3Å
820	T	63	Low	63.6	Low	66 Å²	66	65.9 Å²	65.9	41%	0.405	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-39.4	178.5	-12	0	0	0	0	111	G816 Q817 A818 S824	G816-T820 PolarHBondContact O-N 2.85Å; G816-T820 PolarHBondContact O-OG1 3Å; Q817-T820 WeakPolarHBondContact CA-OG1 3.36Å; Q817-T820 PolarHBondContact O-N 3.34Å; Q817-T820 PolarHBondContact O-OG1 3.21Å; A818-T820 VanDerWaalsContact C-N 3.31Å; A818-T820 PolarHBondContact O-N 3.28Å; T820-S824 VanDerWaalsContact O-CB 3.3Å; T820-S824 WeakPolarHBondContact O-CB 3.48Å; T820-S824 PolarHBondContact O-N 3.25Å; T820-S824 PolarHBondContact O-OG 2.73Å
821	C	64.7	Low	65	Low	77 Å²	77	57.1 Å²	57.1	52%	0.52	35%	0.345	S	S	.	.	H	α-helix	trans	-67	-48.8	175.6	-65	0	0	0	0	111.9	Q817 A818 S819 M823 S824 S825	Q817-C821 PolarHBondContact O-N 3.28Å; Q817-C821 PolarHBondContact O-SG 2.87Å; A818-C821 PolarHBondContact O-N 3.5Å; S819-C821 VanDerWaalsContact C-N 3.32Å; S819-C821 PolarHBondContact O-N 2.88Å; C821-M823 PolarHBondContact O-N 3.18Å; C821-S824 CarbonylContact O-C 3.58Å; C821-S824 WeakPolarHBondContact O-CA 3.42Å; C821-S824 WeakPolarHBondContact O-CB 3.2Å; C821-S824 PolarHBondContact O-N 3.43Å; C821-S824 VanDerWaalsContact O-N 3.11Å; C821-S825 PolarHBondContact O-N 3.42Å; C821-S825 PolarHBondContact O-OG 3.37Å
822	C	65.8	Low	66.5	Low	47 Å²	47	56.9 Å²	56.9	32%	0.318	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-44	177.9	-69.1	0	0	0	0	112.1	A818 S819 S824 S825 I826	A818-C822 PolarHBondContact O-N 3.27Å; A818-C822 PolarHBondContact O-SG 3.25Å; A818-C822 VanDerWaalsContact O-SG 3.35Å; S819-C822 PolarHBondContact O-N 3.36Å; C822-S824 VanDerWaalsContact C-N 3.28Å; C822-S824 PolarHBondContact O-N 3.03Å; C822-S825 PolarHBondContact O-N 3.31Å; C822-I826 WeakPolarHBondContact O-CG1 3.45Å; C822-I826 PolarHBondContact O-N 2.91Å
823	M	68.9	Low	68.1	Low	54 Å²	54	58.6 Å²	58.6	27%	0.266	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-41	174.4	-173.6	-179.2	-69.8	0	0	110.7	I811 S819 C821 A827	I811-M823 HydrophobicContact CB-CE 3.89Å; I811-M823 HydrophobicContact CD1-CB 4.12Å; I811-M823 HydrophobicContact CD1-CE 4.37Å; I811-M823 HydrophobicContact CD1-CG 4.15Å; I811-M823 HydrophobicContact CG2-CE 4.09Å; S819-M823 WeakPolarHBondContact O-CB 3.36Å; S819-M823 PolarHBondContact O-N 3Å; C821-M823 PolarHBondContact O-N 3.18Å; M823-A827 WeakPolarHBondContact O-CB 3.42Å; M823-A827 PolarHBondContact O-N 3.49Å
824	S	71.4	Confident	69.7	Low	30 Å²	30	56.6 Å²	56.6	21%	0.21	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-43.5	174.4	-59.2	0	0	0	0	111.7	T820 C821 C822 A827 M828	T820-S824 VanDerWaalsContact O-CB 3.3Å; T820-S824 WeakPolarHBondContact O-CB 3.48Å; T820-S824 PolarHBondContact O-N 3.25Å; T820-S824 PolarHBondContact O-OG 2.73Å; C821-S824 CarbonylContact O-C 3.58Å; C821-S824 WeakPolarHBondContact O-CA 3.42Å; C821-S824 WeakPolarHBondContact O-CB 3.2Å; C821-S824 PolarHBondContact O-N 3.43Å; C821-S824 VanDerWaalsContact O-N 3.11Å; C822-S824 VanDerWaalsContact C-N 3.28Å; C822-S824 PolarHBondContact O-N 3.03Å; S824-A827 WeakPolarHBondContact O-CB 3.34Å; S824-A827 PolarHBondContact O-N 2.84Å; S824-M828 WeakPolarHBondContact O-CG 3.36Å; S824-M828 PolarHBondContact O-N 3.35Å
825	S	74.8	Confident	71.5	Confident	69 Å²	69	54.2 Å²	54.2	48%	0.483	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-46.8	177.9	-62.8	0	0	0	0	112.4	C821 C822 A827 M828 C829	C821-S825 PolarHBondContact O-N 3.42Å; C821-S825 PolarHBondContact O-OG 3.37Å; C822-S825 PolarHBondContact O-N 3.31Å; S825-A827 VanDerWaalsContact C-N 3.35Å; S825-M828 PolarHBondContact O-N 3.3Å; S825-C829 PolarHBondContact O-N 3.34Å; S825-C829 PolarHBondContact O-SG 3.3Å
826	I	74.9	Confident	73.4	Confident	73 Å²	73	52.7 Å²	52.7	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-44.2	176.5	-64.3	166.2	0	0	0	110	L808 I811 C822 M828 C829 L830	L808-I826 HydrophobicContact CD2-CB 4.33Å; L808-I826 HydrophobicContact CD2-CG2 3.5Å; L808-I826 VanDerWaalsContact CD2-CG2 3.5Å; I811-I826 HydrophobicContact CD1-CD1 3.83Å; C822-I826 WeakPolarHBondContact O-CG1 3.45Å; C822-I826 PolarHBondContact O-N 2.91Å; I826-M828 VanDerWaalsContact C-N 3.29Å; I826-M828 PolarHBondContact O-N 3.03Å; I826-C829 PolarHBondContact O-N 2.92Å; I826-C829 VanDerWaalsContact O-N 3.16Å; I826-L830 HydrophobicContact CG2-CD1 3.82Å; I826-L830 HydrophobicContact CG2-CG 4.26Å; I826-L830 WeakPolarHBondContact O-CG 3.12Å; I826-L830 PolarHBondContact O-N 2.86Å
827	A	72.9	Confident	74.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-54.5	-47.1	174.4	0	0	0	0	0	111.3	P793 L797 M823 S824 S825 C829 L830 V831	P793-A827 HydrophobicContact CB-CB 3.93Å; L797-A827 HydrophobicContact CD1-CB 3.37Å; L797-A827 HydrophobicContact CD2-CB 4.24Å; L797-A827 HydrophobicContact CG-CB 3.7Å; M823-A827 WeakPolarHBondContact O-CB 3.42Å; M823-A827 PolarHBondContact O-N 3.49Å; S824-A827 WeakPolarHBondContact O-CB 3.34Å; S824-A827 PolarHBondContact O-N 2.84Å; S825-A827 VanDerWaalsContact C-N 3.35Å; A827-C829 PolarHBondContact O-N 3.39Å; A827-L830 PolarHBondContact O-N 2.96Å; A827-V831 VanDerWaalsContact O-CB 3.27Å; A827-V831 WeakPolarHBondContact O-CB 3.21Å; A827-V831 WeakPolarHBondContact O-CG2 3.32Å; A827-V831 PolarHBondContact O-N 3.36Å
828	M	77.4	Confident	76.4	Confident	47 Å²	47	49.3 Å²	49.3	23%	0.232	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-44	177.3	-67.2	-33.4	-151.9	0	0	112	A777 P793 L796 S824 S825 I826 L830 W832	A777-M828 HydrophobicContact CB-CE 4.02Å; A777-M828 HydrophobicContact CB-SD 3.58Å; A777-M828 VanDerWaalsContact CB-SD 3.58Å; P793-M828 HydrophobicContact CG-CE 4.49Å; L796-M828 HydrophobicContact CD1-CE 4.41Å; L796-M828 HydrophobicContact CD1-SD 4.09Å; S824-M828 WeakPolarHBondContact O-CG 3.36Å; S824-M828 PolarHBondContact O-N 3.35Å; S825-M828 PolarHBondContact O-N 3.3Å; I826-M828 VanDerWaalsContact C-N 3.29Å; I826-M828 PolarHBondContact O-N 3.03Å; M828-L830 PolarHBondContact O-N 3.17Å; M828-W832 WeakPolarHBondContact O-CB 3.44Å; M828-W832 PolarHBondContact O-N 3.13Å
829	C	77.9	Confident	78.1	Confident	76 Å²	76	47.6 Å²	47.6	51%	0.514	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-37	179.7	-72.3	0	0	0	0	113.2	S825 I826 A827 P833	S825-C829 PolarHBondContact O-N 3.34Å; S825-C829 PolarHBondContact O-SG 3.3Å; I826-C829 PolarHBondContact O-N 2.92Å; I826-C829 VanDerWaalsContact O-N 3.16Å; A827-C829 PolarHBondContact O-N 3.39Å; C829-P833 VanDerWaalsContact O-CD 3.26Å; C829-P833 WeakPolarHBondContact O-CD 3.4Å
830	L	80.8	Confident	79.4	Confident	58 Å²	58	52.3 Å²	52.3	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-75.8	-40	179.5	-67.5	173.3	0	0	0	112.3	L797 C801 D804 L808 I826 A827 M828 P833 H834	L797-L830 HydrophobicContact CD2-CB 4.4Å; L797-L830 HydrophobicContact CD2-CD1 4.35Å; C801-L830 PolarHBondContact SG-O 3.36Å; D804-L830 HydrophobicContact CB-CD1 4.07Å; L808-L830 HydrophobicContact CD1-CD1 4.31Å; L808-L830 HydrophobicContact CD2-CD1 4.32Å; I826-L830 HydrophobicContact CG2-CD1 3.82Å; I826-L830 HydrophobicContact CG2-CG 4.26Å; I826-L830 WeakPolarHBondContact O-CG 3.12Å; I826-L830 PolarHBondContact O-N 2.86Å; A827-L830 PolarHBondContact O-N 2.96Å; M828-L830 PolarHBondContact O-N 3.17Å; L830-P833 WeakPolarHBondContact O-CD 3.07Å; L830-H834 PolarHBondContact O-ND1 3.28Å
831	V	85	Confident	80.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-77.9	-30.5	-176.5	174.1	0	0	0	0	111.9	L796 L797 Y800 C801 A827 H834 L835	L796-V831 HydrophobicContact CB-CG1 4.3Å; L796-V831 HydrophobicContact CB-CG2 4.31Å; L797-V831 HydrophobicContact CD2-CG2 3.84Å; L797-V831 HydrophobicContact CG-CG2 4.1Å; Y800-V831 HydrophobicContact CD2-CG1 4.11Å; Y800-V831 HydrophobicContact CG-CG1 4.25Å; C801-V831 HydrophobicContact CB-CG2 4.38Å; A827-V831 VanDerWaalsContact O-CB 3.27Å; A827-V831 WeakPolarHBondContact O-CB 3.21Å; A827-V831 WeakPolarHBondContact O-CG2 3.32Å; A827-V831 PolarHBondContact O-N 3.36Å; V831-H834 PolarHBondContact O-N 3.01Å; V831-L835 HydrophobicContact CG1-CD1 3.49Å; V831-L835 VanDerWaalsContact CG1-CD1 3.49Å; V831-L835 HydrophobicContact CG1-CD2 4.38Å; V831-L835 HydrophobicContact CG1-CG 3.61Å; V831-L835 PolarHBondContact O-N 3.39Å
832	W	88.9	Confident	81.4	Confident	26 Å²	26	57.6 Å²	57.6	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-57.2	-47	-173.4	179.7	-111	0	0	0	115	F775 A780 M828 H834 L835 Y836 F848	F775-W832 HydrophobicContact CB-CH2 3.65Å; F775-W832 HydrophobicContact CB-CZ2 3.98Å; F775-W832 HydrophobicContact CB-CZ3 4.05Å; F775-W832 AromaticContact CD2-CH2 3.99Å; F775-W832 HydrophobicContact CD2-CH2 3.99Å; F775-W832 AromaticContact CD2-CZ2 3.55Å; F775-W832 HydrophobicContact CD2-CZ2 3.55Å; F775-W832 HydrophobicContact CG-CH2 4.26Å; F775-W832 HydrophobicContact CG-CZ2 4.23Å; A780-W832 HydrophobicContact CB-CZ3 3.93Å; M828-W832 WeakPolarHBondContact O-CB 3.44Å; M828-W832 PolarHBondContact O-N 3.13Å; W832-H834 VanDerWaalsContact C-N 3.3Å; W832-H834 PolarHBondContact O-N 3.48Å; W832-L835 HydrophobicContact CE3-CB 4.49Å; W832-L835 PolarHBondContact O-N 2.91Å; W832-Y836 HydrophobicContact CH2-CD2 4.43Å; W832-Y836 AromaticContact CZ2-CD2 3.71Å; W832-Y836 HydrophobicContact CZ2-CD2 3.71Å; W832-Y836 WeakPolarHBondContact O-CB 3.43Å; W832-Y836 PolarHBondContact O-N 3.44Å; W832-F848 HydrophobicContact CH2-CD1 4.4Å; W832-F848 AromaticContact CH2-CE1 3.49Å; W832-F848 HydrophobicContact CH2-CE1 3.49Å; W832-F848 VanDerWaalsContact CH2-CE1 3.49Å; W832-F848 AromaticContact CH2-CZ 3.76Å; W832-F848 HydrophobicContact CH2-CZ 3.76Å; W832-F848 HydrophobicContact CZ2-CE1 4.47Å; W832-F848 HydrophobicContact CZ3-CE1 4.15Å; W832-F848 AromaticContact CZ3-CZ 3.92Å; W832-F848 HydrophobicContact CZ3-CZ 3.92Å
833	P	84	Confident	82.4	Confident	75 Å²	75	62.3 Å²	62.3	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-56.7	-41.9	177.4	-26	34.9	0	0	0	113.2	C829 L830 Y836 E837	C829-P833 VanDerWaalsContact O-CD 3.26Å; C829-P833 WeakPolarHBondContact O-CD 3.4Å; L830-P833 WeakPolarHBondContact O-CD 3.07Å; P833-Y836 PolarHBondContact O-N 3.4Å; P833-E837 WeakPolarHBondContact O-CB 3.24Å; P833-E837 PolarHBondContact O-N 2.93Å
834	H	86.4	Confident	83.3	Confident	81 Å²	81	59.7 Å²	59.7	38%	0.375	30%	0.298	S	S	.	.	H	α-helix	trans	-66.5	-44.4	178.2	-67.2	87.5	0	0	0	111.7	C801 L830 V831 W832 L838	C801-H834 PolarHBondContact SG-ND1 3.11Å; C801-H834 VanDerWaalsContact SG-ND1 3.43Å; L830-H834 PolarHBondContact O-ND1 3.28Å; V831-H834 PolarHBondContact O-N 3.01Å; W832-H834 VanDerWaalsContact C-N 3.3Å; W832-H834 PolarHBondContact O-N 3.48Å; H834-L838 VanDerWaalsContact O-CG 3.3Å; H834-L838 WeakPolarHBondContact O-CG 3.29Å; H834-L838 PolarHBondContact O-N 3.41Å
835	L	89.2	Confident	84	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-42.2	176	-70.4	178.1	0	0	0	111.9	A777 A780 A781 L784 Y800 V831 W832 L838 L839	A777-L835 HydrophobicContact CB-CD1 3.68Å; A777-L835 WeakPolarHBondContact O-CD1 3.42Å; A780-L835 HydrophobicContact CB-CB 4.23Å; A780-L835 HydrophobicContact CB-CD1 4.06Å; A781-L835 HydrophobicContact CB-CD1 4.39Å; A781-L835 HydrophobicContact CB-CD2 4Å; L784-L835 HydrophobicContact CD1-CD2 3.66Å; Y800-L835 HydrophobicContact CD1-CD2 3.87Å; Y800-L835 HydrophobicContact CD2-CD2 3.87Å; Y800-L835 HydrophobicContact CE1-CD2 3.62Å; Y800-L835 HydrophobicContact CE2-CD2 3.64Å; Y800-L835 HydrophobicContact CG-CD2 3.99Å; Y800-L835 VanDerWaalsContact CZ-CD2 3.5Å; V831-L835 HydrophobicContact CG1-CD1 3.49Å; V831-L835 VanDerWaalsContact CG1-CD1 3.49Å; V831-L835 HydrophobicContact CG1-CD2 4.38Å; V831-L835 HydrophobicContact CG1-CG 3.61Å; V831-L835 PolarHBondContact O-N 3.39Å; W832-L835 HydrophobicContact CE3-CB 4.49Å; W832-L835 PolarHBondContact O-N 2.91Å; L835-L838 PolarHBondContact O-N 3.06Å; L835-L839 WeakPolarHBondContact O-CB 3.44Å; L835-L839 VanDerWaalsContact O-CG 3.3Å; L835-L839 WeakPolarHBondContact O-CG 3.35Å; L835-L839 PolarHBondContact O-N 3.07Å
836	Y	88.4	Confident	84.6	Confident	73 Å²	73	59.3 Å²	59.3	29%	0.286	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-48.9	178.5	-174.7	-86.3	0	0	0	111.1	W832 P833 L838 L839 E840 L845	W832-Y836 HydrophobicContact CH2-CD2 4.43Å; W832-Y836 AromaticContact CZ2-CD2 3.71Å; W832-Y836 HydrophobicContact CZ2-CD2 3.71Å; W832-Y836 WeakPolarHBondContact O-CB 3.43Å; W832-Y836 PolarHBondContact O-N 3.44Å; P833-Y836 PolarHBondContact O-N 3.4Å; Y836-L838 VanDerWaalsContact C-N 3.32Å; Y836-L838 PolarHBondContact O-N 3.09Å; Y836-L839 PolarHBondContact O-N 3.19Å; Y836-E840 WeakPolarHBondContact O-CB 3.33Å; Y836-E840 PolarHBondContact O-N 3.18Å; Y836-L845 HydrophobicContact CD2-CD2 3.92Å; Y836-L845 HydrophobicContact CE1-CD1 4.27Å; Y836-L845 HydrophobicContact CE2-CD1 4.26Å; Y836-L845 HydrophobicContact CE2-CD2 3.65Å
837	E	87.4	Confident	85.2	Confident	85 Å²	85	56.1 Å²	56.1	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-41.5	177.5	-176.8	177.6	-167.8	0	0	111.8	P833 E840 R841	P833-E837 WeakPolarHBondContact O-CB 3.24Å; P833-E837 PolarHBondContact O-N 2.93Å; E837-E840 PolarHBondContact O-N 3.5Å; E837-R841 HydrophobicContact CG-CG 4.46Å; E837-R841 WeakPolarHBondContact O-CB 3.36Å; E837-R841 VanDerWaalsContact O-CG 3.27Å; E837-R841 WeakPolarHBondContact O-CG 3.41Å; E837-R841 PolarHBondContact O-N 2.91Å; E837-R841 IonicContact OE1-CZ 3.17Å; E837-R841 IonicContact OE1-NE 2.73Å; E837-R841 PolarHBondContact OE1-NE 2.99Å; E837-R841 IonicContact OE1-NH2 3.09Å; E837-R841 PolarHBondContact OE1-NH2 3.49Å
838	L	88.9	Confident	86	Confident	56 Å²	56	56.1 Å²	56.1	29%	0.293	28%	0.276	S	S	.	.	H	α-helix	trans	-66.1	-41.2	176.3	-71.9	173.6	0	0	0	112.5	L784 Y800 H834 L835 Y836 E840 R841 M842	L784-L838 HydrophobicContact CD1-CB 3.79Å; L784-L838 HydrophobicContact CD1-CD1 4.11Å; L784-L838 HydrophobicContact CD2-CB 3.82Å; Y800-L838 HydrophobicContact CD1-CD1 3.85Å; Y800-L838 HydrophobicContact CE1-CD1 3.64Å; H834-L838 VanDerWaalsContact O-CG 3.3Å; H834-L838 WeakPolarHBondContact O-CG 3.29Å; H834-L838 PolarHBondContact O-N 3.41Å; L835-L838 PolarHBondContact O-N 3.06Å; Y836-L838 VanDerWaalsContact C-N 3.32Å; Y836-L838 PolarHBondContact O-N 3.09Å; L838-E840 VanDerWaalsContact C-N 3.3Å; L838-E840 PolarHBondContact O-N 3.04Å; L838-R841 PolarHBondContact O-N 2.56Å; L838-M842 WeakPolarHBondContact O-CB 3.3Å; L838-M842 WeakPolarHBondContact O-CG 3.35Å; L838-M842 PolarHBondContact O-N 3.04Å
839	L	88.6	Confident	86.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-38.7	174.7	-74.4	176.5	0	0	0	111.7	A780 L783 L784 L835 Y836 H843 M844 L845 F848	A780-L839 HydrophobicContact CB-CD1 3.7Å; A780-L839 HydrophobicContact CB-CG 4.47Å; L783-L839 HydrophobicContact CB-CD2 4.45Å; L783-L839 HydrophobicContact CD2-CD2 3.86Å; L783-L839 HydrophobicContact CG-CD2 4.43Å; L784-L839 HydrophobicContact CD2-CD2 4.27Å; L784-L839 HydrophobicContact CG-CD2 4.08Å; L835-L839 WeakPolarHBondContact O-CB 3.44Å; L835-L839 VanDerWaalsContact O-CG 3.3Å; L835-L839 WeakPolarHBondContact O-CG 3.35Å; L835-L839 PolarHBondContact O-N 3.07Å; Y836-L839 PolarHBondContact O-N 3.19Å; L839-H843 PolarHBondContact O-N 3.42Å; L839-M844 HydrophobicContact CD2-CB 3.91Å; L839-M844 HydrophobicContact CD2-CE 4.26Å; L839-M844 PolarHBondContact O-N 2.9Å; L839-L845 HydrophobicContact CB-CD2 3.93Å; L839-L845 HydrophobicContact CB-CG 4.02Å; L839-L845 HydrophobicContact CD1-CD2 4.32Å; L839-L845 PolarHBondContact O-N 3.13Å; L839-F848 HydrophobicContact CD1-CB 4.19Å; L839-F848 HydrophobicContact CD1-CD1 4.09Å; L839-F848 HydrophobicContact CD1-CD2 4.21Å; L839-F848 HydrophobicContact CD1-CG 3.9Å
840	E	87.3	Confident	86.8	Confident	106 Å²	106	59.4 Å²	59.4	50%	0.495	28%	0.282	S	S	.	.	H	α-helix	trans	-68	-49.4	177.5	-169.5	165.2	-147.2	0	0	111.4	Y836 E837 L838 M842 H843 L845	Y836-E840 WeakPolarHBondContact O-CB 3.33Å; Y836-E840 PolarHBondContact O-N 3.18Å; E837-E840 PolarHBondContact O-N 3.5Å; L838-E840 VanDerWaalsContact C-N 3.3Å; L838-E840 PolarHBondContact O-N 3.04Å; E840-M842 VanDerWaalsContact C-N 3.25Å; E840-M842 PolarHBondContact O-N 3.46Å; E840-H843 PolarHBondContact O-N 2.91Å; E840-L845 HydrophobicContact CB-CD1 3.66Å; E840-L845 HydrophobicContact CB-CG 4.33Å; E840-L845 HydrophobicContact CG-CD1 3.87Å
841	R	87.1	Confident	87.1	Confident	177 Å²	177	57.2 Å²	57.2	67%	0.668	27%	0.271	S	S	*	.	H	α-helix	trans	-59.8	-33.4	177.6	-73.9	176.7	-179.7	-158.4	2.3	113	E837 L838	E837-R841 HydrophobicContact CG-CG 4.46Å; E837-R841 WeakPolarHBondContact O-CB 3.36Å; E837-R841 VanDerWaalsContact O-CG 3.27Å; E837-R841 WeakPolarHBondContact O-CG 3.41Å; E837-R841 PolarHBondContact O-N 2.91Å; E837-R841 IonicContact OE1-CZ 3.17Å; E837-R841 IonicContact OE1-NE 2.73Å; E837-R841 PolarHBondContact OE1-NE 2.99Å; E837-R841 IonicContact OE1-NH2 3.09Å; E837-R841 PolarHBondContact OE1-NH2 3.49Å; L838-R841 PolarHBondContact O-N 2.56Å
842	M	83.9	Confident	87.3	Confident	77 Å²	77	57.2 Å²	57.2	38%	0.379	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5	176.4	-66.1	-163.8	-179.7	0	0	113.7	L784 L838 E840 M844	L784-M842 HydrophobicContact CD2-CE 4.45Å; L784-M842 HydrophobicContact CD2-CG 4.48Å; L784-M842 HydrophobicContact CD2-SD 3.74Å; L838-M842 WeakPolarHBondContact O-CB 3.3Å; L838-M842 WeakPolarHBondContact O-CG 3.35Å; L838-M842 PolarHBondContact O-N 3.04Å; E840-M842 VanDerWaalsContact C-N 3.25Å; E840-M842 PolarHBondContact O-N 3.46Å; M842-M844 HydrophobicContact CB-CE 3.79Å; M842-M844 HydrophobicContact CB-CG 4.12Å; M842-M844 HydrophobicContact CG-CE 4.36Å; M842-M844 PolarHBondContact O-N 3.45Å; M842-M844 HydrophobicContact SD-CE 3.73Å
843	H	86.1	Confident	87.3	Confident	145 Å²	145	57.5 Å²	57.5	67%	0.671	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	31.6	-176.8	-57.2	-63.5	0	0	0	114.5	L839 E840	L839-H843 PolarHBondContact O-N 3.42Å; E840-H843 PolarHBondContact O-N 2.91Å
844	M	87.6	Confident	87.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.262	C	S	.	.			trans	-100.6	-1.2	-178.8	-67.3	-163.5	-65.2	0	0	114	L783 L784 L839 M842 A847 F848 V1114	L783-M844 HydrophobicContact CD2-CB 4.14Å; L783-M844 HydrophobicContact CG-SD 4.2Å; L784-M844 HydrophobicContact CD2-CE 3.5Å; L784-M844 VanDerWaalsContact CD2-CE 3.5Å; L784-M844 HydrophobicContact CG-CE 4.15Å; L839-M844 HydrophobicContact CD2-CB 3.91Å; L839-M844 HydrophobicContact CD2-CE 4.26Å; L839-M844 PolarHBondContact O-N 2.9Å; M842-M844 HydrophobicContact CB-CE 3.79Å; M842-M844 HydrophobicContact CB-CG 4.12Å; M842-M844 HydrophobicContact CG-CE 4.36Å; M842-M844 PolarHBondContact O-N 3.45Å; M842-M844 HydrophobicContact SD-CE 3.73Å; M844-A847 PolarHBondContact O-N 3.42Å; M844-F848 PolarHBondContact O-N 3.02Å; M844-V1114 HydrophobicContact CG-CG2 4.38Å; M844-V1114 HydrophobicContact SD-CB 3.85Å; M844-V1114 HydrophobicContact SD-CG2 3.89Å
845	L	86.8	Confident	87.2	Confident	22 Å²	22	51.8 Å²	51.8	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-53.5	-42.9	174.6	-81.9	174.7	0	0	0	113.8	Y836 L839 E840 F848 K849	Y836-L845 HydrophobicContact CD2-CD2 3.92Å; Y836-L845 HydrophobicContact CE1-CD1 4.27Å; Y836-L845 HydrophobicContact CE2-CD1 4.26Å; Y836-L845 HydrophobicContact CE2-CD2 3.65Å; L839-L845 HydrophobicContact CB-CD2 3.93Å; L839-L845 HydrophobicContact CB-CG 4.02Å; L839-L845 HydrophobicContact CD1-CD2 4.32Å; L839-L845 PolarHBondContact O-N 3.13Å; E840-L845 HydrophobicContact CB-CD1 3.66Å; E840-L845 HydrophobicContact CB-CG 4.33Å; E840-L845 HydrophobicContact CG-CD1 3.87Å; L845-F848 PolarHBondContact O-N 2.84Å; L845-K849 WeakPolarHBondContact O-CB 3.36Å; L845-K849 PolarHBondContact O-N 2.91Å
846	P	87.1	Confident	87	Confident	68 Å²	68	53.6 Å²	53.6	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-44.3	175.6	-23.9	35.2	0	0	0	112.7	F848 K849 E850	P846-F848 VanDerWaalsContact C-N 3.27Å; P846-F848 PolarHBondContact O-N 2.91Å; P846-K849 PolarHBondContact O-N 3.36Å; P846-E850 WeakPolarHBondContact O-CA 3.36Å; P846-E850 VanDerWaalsContact O-CB 3.24Å; P846-E850 WeakPolarHBondContact O-CB 3.42Å; P846-E850 PolarHBondContact O-N 2.86Å
847	A	86.9	Confident	86.7	Confident	6 Å²	6	57.6 Å²	57.6	5%	0.05	27%	0.268	C	S	.	.	I	π-helix	trans	-59.6	-40.8	176.1	0	0	0	0	0	111.3	L783 M844 I851 E852	L783-A847 HydrophobicContact CD2-CB 4.39Å; M844-A847 PolarHBondContact O-N 3.42Å; A847-I851 WeakPolarHBondContact O-CB 3.44Å; A847-I851 PolarHBondContact O-N 3.27Å; A847-E852 WeakPolarHBondContact O-CG 3.22Å; A847-E852 PolarHBondContact O-N 2.77Å
848	F	89.6	Confident	86.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-65.7	-55.1	176.3	-178.8	-105.7	0	0	0	113.1	F775 T779 A780 L783 W832 L839 M844 L845 P846 L853	F775-F848 HydrophobicContact CB-CE1 3.49Å; F775-F848 VanDerWaalsContact CB-CE1 3.49Å; F775-F848 HydrophobicContact CB-CZ 3.51Å; F775-F848 HydrophobicContact CD1-CE1 4.48Å; F775-F848 HydrophobicContact CD2-CE1 4.33Å; F775-F848 AromaticContact CG-CE1 3.88Å; F775-F848 HydrophobicContact CG-CE1 3.88Å; F775-F848 HydrophobicContact CG-CZ 4.37Å; T779-F848 HydrophobicContact CG2-CD2 4.14Å; T779-F848 HydrophobicContact CG2-CE2 3.91Å; A780-F848 HydrophobicContact CB-CD2 4.2Å; A780-F848 HydrophobicContact CB-CE2 3.69Å; A780-F848 HydrophobicContact CB-CZ 4.1Å; L783-F848 HydrophobicContact CD2-CB 3.74Å; L783-F848 HydrophobicContact CD2-CD2 4.34Å; W832-F848 HydrophobicContact CH2-CD1 4.4Å; W832-F848 AromaticContact CH2-CE1 3.49Å; W832-F848 HydrophobicContact CH2-CE1 3.49Å; W832-F848 VanDerWaalsContact CH2-CE1 3.49Å; W832-F848 AromaticContact CH2-CZ 3.76Å; W832-F848 HydrophobicContact CH2-CZ 3.76Å; W832-F848 HydrophobicContact CZ2-CE1 4.47Å; W832-F848 HydrophobicContact CZ3-CE1 4.15Å; W832-F848 AromaticContact CZ3-CZ 3.92Å; W832-F848 HydrophobicContact CZ3-CZ 3.92Å; L839-F848 HydrophobicContact CD1-CB 4.19Å; L839-F848 HydrophobicContact CD1-CD1 4.09Å; L839-F848 HydrophobicContact CD1-CD2 4.21Å; L839-F848 HydrophobicContact CD1-CG 3.9Å; M844-F848 PolarHBondContact O-N 3.02Å; L845-F848 PolarHBondContact O-N 2.84Å; P846-F848 VanDerWaalsContact C-N 3.27Å; P846-F848 PolarHBondContact O-N 2.91Å; F848-L853 HydrophobicContact CD1-CD1 3.97Å; F848-L853 HydrophobicContact CE1-CD1 3.52Å; F848-L853 HydrophobicContact CE1-CG 4.2Å; F848-L853 HydrophobicContact CE2-CD1 4.45Å; F848-L853 HydrophobicContact CE2-CD2 4.23Å; F848-L853 HydrophobicContact CE2-CG 4.27Å; F848-L853 HydrophobicContact CZ-CD1 3.82Å; F848-L853 HydrophobicContact CZ-CD2 4.03Å; F848-L853 HydrophobicContact CZ-CG 4.08Å; F848-L853 WeakPolarHBondContact O-CG 3.44Å; F848-L853 PolarHBondContact O-N 2.98Å; F848-L853 VanDerWaalsContact O-N 3.12Å
849	K	87.1	Confident	85.9	Confident	80 Å²	80	51.1 Å²	51.1	35%	0.348	24%	0.237	S	C	.	.	I	π-helix	trans	-76.9	-37.6	-172.5	-70.2	-173	176.3	-178.4	0	113.6	L845 P846 P854	L845-K849 WeakPolarHBondContact O-CB 3.36Å; L845-K849 PolarHBondContact O-N 2.91Å; P846-K849 PolarHBondContact O-N 3.36Å; K849-P854 VanDerWaalsContact O-CD 3.25Å; K849-P854 WeakPolarHBondContact O-CD 3.29Å; K849-P854 WeakPolarHBondContact O-CG 3.42Å
850	E	86.1	Confident	85.6	Confident	112 Å²	112	53 Å²	53	52%	0.523	25%	0.252	S	S	.	.	I	π-helix	trans	-99.4	-24.5	-168.9	-58	179.7	-166.8	0	0	113.5	P846 K1149	P846-E850 WeakPolarHBondContact O-CA 3.36Å; P846-E850 VanDerWaalsContact O-CB 3.24Å; P846-E850 WeakPolarHBondContact O-CB 3.42Å; P846-E850 PolarHBondContact O-N 2.86Å; E850-K1149 WeakPolarHBondContact O-CD 3.24Å; E850-K1149 PolarHBondContact O-NZ 2.78Å
851	I	87.8	Confident	85.1	Confident	12 Å²	12	52 Å²	52	6%	0.062	25%	0.247	C	C	.	.	I	π-helix	trans	-109.7	-62.5	-177.1	-50.4	-178.2	0	0	0	110.6	A847 A855 A1111 K1145 L1146	A847-I851 WeakPolarHBondContact O-CB 3.44Å; A847-I851 PolarHBondContact O-N 3.27Å; I851-A855 WeakPolarHBondContact O-CB 3.46Å; I851-A855 PolarHBondContact O-N 3.07Å; I851-A1111 HydrophobicContact CD1-CB 3.59Å; I851-K1145 HydrophobicContact CG2-CB 3.71Å; I851-K1145 HydrophobicContact CG2-CD 4.17Å; I851-L1146 HydrophobicContact CD1-CD1 4.29Å; I851-L1146 HydrophobicContact CD1-CG 4.36Å; I851-L1146 HydrophobicContact CG1-CD2 3.9Å; I851-L1146 HydrophobicContact CG1-CG 4.15Å; I851-L1146 HydrophobicContact CG2-CG 4.43Å
852	E	88.6	Confident	84.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.217	C	C	.	.	I	π-helix	trans	-70.3	-53.6	-168	-66.1	-61	159	0	0	113.1	T779 W782 L783 A847 A855 Q856 W989 K1145	T779-E852 HydrophobicContact CG2-CB 4.03Å; W782-E852 HydrophobicContact CZ3-CG 4.31Å; L783-E852 HydrophobicContact CD1-CG 4.36Å; A847-E852 WeakPolarHBondContact O-CG 3.22Å; A847-E852 PolarHBondContact O-N 2.77Å; E852-A855 PolarHBondContact O-N 3.39Å; E852-Q856 WeakPolarHBondContact O-CG 3.07Å; E852-Q856 PolarHBondContact O-N 3.13Å; E852-W989 PolarHBondContact OE2-NE1 3.38Å; E852-K1145 IonicContact OE1-NZ 3.55Å; E852-K1145 PolarHBondContact OE1-NZ 3.25Å; E852-K1145 IonicContact OE2-NZ 3.27Å; E852-K1145 PolarHBondContact OE2-NZ 2.97Å
853	L	87.6	Confident	84.5	Confident	31 Å²	31	43.1 Å²	43.1	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-46	-178	-66.8	171.1	0	0	0	113.7	F775 C776 F848 A855 Q856 W857	F775-L853 HydrophobicContact CB-CD1 4.02Å; F775-L853 HydrophobicContact CD1-CD1 3.2Å; F775-L853 HydrophobicContact CE1-CD1 3.79Å; F775-L853 HydrophobicContact CG-CD1 3.84Å; C776-L853 HydrophobicContact CB-CD2 4.1Å; F848-L853 HydrophobicContact CD1-CD1 3.97Å; F848-L853 HydrophobicContact CE1-CD1 3.52Å; F848-L853 HydrophobicContact CE1-CG 4.2Å; F848-L853 HydrophobicContact CE2-CD1 4.45Å; F848-L853 HydrophobicContact CE2-CD2 4.23Å; F848-L853 HydrophobicContact CE2-CG 4.27Å; F848-L853 HydrophobicContact CZ-CD1 3.82Å; F848-L853 HydrophobicContact CZ-CD2 4.03Å; F848-L853 HydrophobicContact CZ-CG 4.08Å; F848-L853 WeakPolarHBondContact O-CG 3.44Å; F848-L853 PolarHBondContact O-N 2.98Å; F848-L853 VanDerWaalsContact O-N 3.12Å; L853-A855 VanDerWaalsContact C-N 3.31Å; L853-A855 PolarHBondContact O-N 3.31Å; L853-Q856 PolarHBondContact O-N 2.94Å; L853-W857 PolarHBondContact O-N 3.37Å
854	P	83.9	Confident	84.2	Confident	36 Å²	36	42.4 Å²	42.4	23%	0.234	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-36.7	178.4	-23.3	36.9	0	0	0	112.2	K849 W857 A858 K1149	K849-P854 VanDerWaalsContact O-CD 3.25Å; K849-P854 WeakPolarHBondContact O-CD 3.29Å; K849-P854 WeakPolarHBondContact O-CG 3.42Å; P854-W857 PolarHBondContact O-N 3.19Å; P854-A858 WeakPolarHBondContact O-CB 3.48Å; P854-A858 PolarHBondContact O-N 2.6Å; P854-K1149 HydrophobicContact CB-CD 3.91Å; P854-K1149 HydrophobicContact CB-CG 4.01Å; P854-K1149 HydrophobicContact CG-CD 4.34Å
855	A	84.5	Confident	83.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-40.5	176.1	0	0	0	0	0	111.5	I851 E852 L853 W857 A858 V859 W989 K1145	I851-A855 WeakPolarHBondContact O-CB 3.46Å; I851-A855 PolarHBondContact O-N 3.07Å; E852-A855 PolarHBondContact O-N 3.39Å; L853-A855 VanDerWaalsContact C-N 3.31Å; L853-A855 PolarHBondContact O-N 3.31Å; A855-W857 VanDerWaalsContact C-N 3.32Å; A855-W857 PolarHBondContact O-N 3.4Å; A855-A858 WeakPolarHBondContact O-CB 3.24Å; A855-A858 PolarHBondContact O-N 2.83Å; A855-V859 WeakPolarHBondContact O-CG2 3.5Å; A855-V859 PolarHBondContact O-N 3.22Å; A855-W989 HydrophobicContact CB-CH2 3.7Å; A855-W989 HydrophobicContact CB-CZ2 3.59Å; A855-W989 VanDerWaalsContact O-CH2 3.3Å; A855-W989 WeakPolarHBondContact O-CH2 3.37Å; A855-K1145 HydrophobicContact CB-CB 3.85Å; A855-K1145 HydrophobicContact CB-CD 4.41Å; A855-K1145 HydrophobicContact CB-CG 4.01Å
856	Q	85.8	Confident	83.4	Confident	38 Å²	38	42.8 Å²	42.8	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-45.1	173.9	-78.7	-176.6	-22.6	0	0	111.7	T779 E852 L853 V859 A860 W989	T779-Q856 VanDerWaalsContact OG1-CD 3.31Å; T779-Q856 PolarHBondContact OG1-NE2 3.42Å; T779-Q856 PolarHBondContact OG1-OE1 2.91Å; E852-Q856 WeakPolarHBondContact O-CG 3.07Å; E852-Q856 PolarHBondContact O-N 3.13Å; L853-Q856 PolarHBondContact O-N 2.94Å; Q856-V859 PolarHBondContact O-N 3.09Å; Q856-A860 WeakPolarHBondContact O-CB 3.23Å; Q856-A860 PolarHBondContact O-N 3.16Å; Q856-W989 HydrophobicContact CB-CZ2 4.36Å; Q856-W989 HydrophobicContact CG-CD2 3.49Å; Q856-W989 VanDerWaalsContact CG-CD2 3.49Å; Q856-W989 HydrophobicContact CG-CE3 4.05Å; Q856-W989 HydrophobicContact CG-CG 3.89Å; Q856-W989 HydrophobicContact CG-CH2 4.19Å; Q856-W989 HydrophobicContact CG-CZ2 3.63Å; Q856-W989 HydrophobicContact CG-CZ3 4.36Å
857	W	81.5	Confident	83.1	Confident	157 Å²	157	39.8 Å²	39.8	60%	0.595	20%	0.197	S	C	*	.	H	α-helix	trans	-62	-46.4	176.8	-178.1	88.5	0	0	0	111.9	L853 P854 A855 V859 A860 Q861	L853-W857 PolarHBondContact O-N 3.37Å; P854-W857 PolarHBondContact O-N 3.19Å; A855-W857 VanDerWaalsContact C-N 3.32Å; A855-W857 PolarHBondContact O-N 3.4Å; W857-V859 VanDerWaalsContact C-N 3.3Å; W857-V859 PolarHBondContact O-N 2.84Å; W857-A860 PolarHBondContact O-N 3.27Å; W857-Q861 HydrophobicContact CD2-CG 4.27Å; W857-Q861 HydrophobicContact CE3-CG 4.31Å; W857-Q861 HydrophobicContact CH2-CG 4Å; W857-Q861 HydrophobicContact CZ2-CG 3.95Å; W857-Q861 HydrophobicContact CZ3-CG 4.18Å; W857-Q861 WeakPolarHBondContact O-CG 3.26Å; W857-Q861 PolarHBondContact O-N 3.09Å; W857-Q861 VanDerWaalsContact O-N 3.08Å
858	A	78.5	Confident	82.8	Confident	2 Å²	2	40 Å²	40	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-54.8	-47.9	176	0	0	0	0	0	111.2	P854 A855 Q861 M862 V1148 C1152	P854-A858 WeakPolarHBondContact O-CB 3.48Å; P854-A858 PolarHBondContact O-N 2.6Å; A855-A858 WeakPolarHBondContact O-CB 3.24Å; A855-A858 PolarHBondContact O-N 2.83Å; A858-Q861 WeakPolarHBondContact O-CB 3.32Å; A858-Q861 PolarHBondContact O-N 2.79Å; A858-M862 HydrophobicContact CB-CE 4.46Å; A858-M862 VanDerWaalsContact O-CG 3.29Å; A858-M862 WeakPolarHBondContact O-CG 3.46Å; A858-M862 PolarHBondContact O-N 2.8Å; A858-V1148 HydrophobicContact CB-CG1 3.82Å; A858-C1152 HydrophobicContact CB-CB 4.16Å; A858-C1152 WeakPolarHBondContact CB-SG 3.33Å
859	V	81.4	Confident	82.6	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-69.5	-36	-179.7	177.4	0	0	0	0	113.1	A855 Q856 W857 Q861 M862 E863 Y987 W989 L1163	A855-V859 WeakPolarHBondContact O-CG2 3.5Å; A855-V859 PolarHBondContact O-N 3.22Å; Q856-V859 PolarHBondContact O-N 3.09Å; W857-V859 VanDerWaalsContact C-N 3.3Å; W857-V859 PolarHBondContact O-N 2.84Å; V859-Q861 PolarHBondContact O-N 3.35Å; V859-M862 HydrophobicContact CG2-CE 4.49Å; V859-M862 HydrophobicContact CG2-SD 4.42Å; V859-M862 CarbonylContact O-C 3.5Å; V859-M862 WeakPolarHBondContact O-CA 3.31Å; V859-M862 VanDerWaalsContact O-CB 3.26Å; V859-M862 WeakPolarHBondContact O-CB 3.33Å; V859-M862 PolarHBondContact O-N 2.95Å; V859-E863 PolarHBondContact O-N 2.88Å; V859-Y987 HydrophobicContact CG1-CD1 4.26Å; V859-Y987 HydrophobicContact CG1-CD2 3.28Å; V859-Y987 HydrophobicContact CG1-CE2 3.87Å; V859-Y987 HydrophobicContact CG1-CG 3.49Å; V859-Y987 VanDerWaalsContact CG1-CG 3.49Å; V859-W989 HydrophobicContact CB-CE3 4.48Å; V859-W989 HydrophobicContact CB-CH2 4.17Å; V859-W989 HydrophobicContact CB-CZ3 3.52Å; V859-W989 HydrophobicContact CG1-CZ3 3.9Å; V859-W989 HydrophobicContact CG2-CH2 3.66Å; V859-W989 HydrophobicContact CG2-CZ3 3.37Å; V859-L1163 HydrophobicContact CB-CD1 4.48Å; V859-L1163 HydrophobicContact CG2-CD1 3.21Å
860	A	82.1	Confident	82.6	Confident	40 Å²	40	38.3 Å²	38.3	33%	0.331	20%	0.195	S	C	.	.	H	α-helix	trans	-58.8	-38.8	172	0	0	0	0	0	111.6	Q856 W857 M862 E863 L864	Q856-A860 WeakPolarHBondContact O-CB 3.23Å; Q856-A860 PolarHBondContact O-N 3.16Å; W857-A860 PolarHBondContact O-N 3.27Å; A860-M862 VanDerWaalsContact C-N 3.29Å; A860-M862 PolarHBondContact O-N 3.24Å; A860-E863 PolarHBondContact O-N 3.45Å; A860-L864 WeakPolarHBondContact O-CG 3.39Å; A860-L864 PolarHBondContact O-N 2.83Å
861	Q	76.6	Confident	82.6	Confident	84 Å²	84	34.9 Å²	34.9	39%	0.393	18%	0.183	S	C	.	.	H	α-helix	trans	-63.6	-35.2	172.4	-65.3	-59.9	-38	0	0	112.2	W857 A858 V859 T865	W857-Q861 HydrophobicContact CD2-CG 4.27Å; W857-Q861 HydrophobicContact CE3-CG 4.31Å; W857-Q861 HydrophobicContact CH2-CG 4Å; W857-Q861 HydrophobicContact CZ2-CG 3.95Å; W857-Q861 HydrophobicContact CZ3-CG 4.18Å; W857-Q861 WeakPolarHBondContact O-CG 3.26Å; W857-Q861 PolarHBondContact O-N 3.09Å; W857-Q861 VanDerWaalsContact O-N 3.08Å; A858-Q861 WeakPolarHBondContact O-CB 3.32Å; A858-Q861 PolarHBondContact O-N 2.79Å; V859-Q861 PolarHBondContact O-N 3.35Å; Q861-T865 WeakPolarHBondContact O-CB 3.34Å; Q861-T865 PolarHBondContact O-N 2.92Å; Q861-T865 VanDerWaalsContact O-N 3.09Å; Q861-T865 PolarHBondContact O-OG1 3Å
862	M	78.6	Confident	82.5	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.02	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-42.4	175.4	-53.3	-172.9	-168.7	0	0	112	A858 V859 A860 T865 G866 Y987 V1148 I1161 L1163	A858-M862 HydrophobicContact CB-CE 4.46Å; A858-M862 VanDerWaalsContact O-CG 3.29Å; A858-M862 WeakPolarHBondContact O-CG 3.46Å; A858-M862 PolarHBondContact O-N 2.8Å; V859-M862 HydrophobicContact CG2-CE 4.49Å; V859-M862 HydrophobicContact CG2-SD 4.42Å; V859-M862 CarbonylContact O-C 3.5Å; V859-M862 WeakPolarHBondContact O-CA 3.31Å; V859-M862 VanDerWaalsContact O-CB 3.26Å; V859-M862 WeakPolarHBondContact O-CB 3.33Å; V859-M862 PolarHBondContact O-N 2.95Å; A860-M862 VanDerWaalsContact C-N 3.29Å; A860-M862 PolarHBondContact O-N 3.24Å; M862-T865 WeakPolarHBondContact O-CB 3.27Å; M862-T865 PolarHBondContact O-N 3.41Å; M862-G866 PolarHBondContact O-N 2.82Å; M862-Y987 HydrophobicContact CB-CE2 4.48Å; M862-V1148 HydrophobicContact CE-CG1 3.67Å; M862-I1161 WeakPolarHBondContact CB-O 3.29Å; M862-I1161 HydrophobicContact CE-CB 3.86Å; M862-I1161 HydrophobicContact CE-CG2 3.42Å; M862-I1161 VanDerWaalsContact CE-CG2 3.42Å; M862-I1161 HydrophobicContact CG-CB 4.18Å; M862-I1161 WeakPolarHBondContact CG-O 3.47Å; M862-I1161 HydrophobicContact SD-CB 4.16Å; M862-I1161 HydrophobicContact SD-CG2 3.86Å; M862-L1163 HydrophobicContact CE-CD1 3.9Å; M862-L1163 HydrophobicContact CE-CD2 4.45Å; M862-L1163 HydrophobicContact CE-CG 3.88Å; M862-L1163 HydrophobicContact SD-CB 4.22Å; M862-L1163 HydrophobicContact SD-CD1 3.67Å; M862-L1163 HydrophobicContact SD-CG 3.47Å; M862-L1163 WeakPolarHBondContact SD-CG 3.29Å
863	E	81.3	Confident	82.5	Confident	64 Å²	64	40.4 Å²	40.4	30%	0.299	22%	0.223	S	C	.	.	H	α-helix	trans	-61	-46.2	175.2	-68.6	-167.9	164.7	0	0	112	V859 A860 T865 Y984 G985 Y987	V859-E863 PolarHBondContact O-N 2.88Å; A860-E863 PolarHBondContact O-N 3.45Å; E863-T865 PolarHBondContact O-N 2.78Å; E863-Y984 VanDerWaalsContact O-CD1 3.25Å; E863-Y984 WeakPolarHBondContact O-CD1 3.12Å; E863-G985 WeakPolarHBondContact CG-O 3.31Å; E863-Y987 HydrophobicContact CG-CD2 3.51Å; E863-Y987 HydrophobicContact CG-CE2 4.05Å; E863-Y987 WeakPolarHBondContact OE1-CB 3.04Å; E863-Y987 PolarHBondContact OE1-N 3.44Å
864	L	78.4	Confident	82.5	Confident	129 Å²	129	38.9 Å²	38.9	68%	0.675	22%	0.215	S	C	*	.	H	α-helix	trans	-67.3	-25.4	179.1	-68.8	173	0	0	0	112.5	A860	A860-L864 WeakPolarHBondContact O-CG 3.39Å; A860-L864 PolarHBondContact O-N 2.83Å
865	T	76.8	Confident	82.8	Confident	25 Å²	25	39.9 Å²	39.9	15%	0.153	22%	0.223	C	C	.	.	H	α-helix	trans	-80.5	-52.1	-178.1	-77.1	0	0	0	0	112.3	Q861 M862 E863 R982 Y1160	Q861-T865 WeakPolarHBondContact O-CB 3.34Å; Q861-T865 PolarHBondContact O-N 2.92Å; Q861-T865 VanDerWaalsContact O-N 3.09Å; Q861-T865 PolarHBondContact O-OG1 3Å; M862-T865 WeakPolarHBondContact O-CB 3.27Å; M862-T865 PolarHBondContact O-N 3.41Å; E863-T865 PolarHBondContact O-N 2.78Å; T865-R982 PolarHBondContact O-NH1 3.46Å; T865-Y1160 HydrophobicContact CG2-CD1 3.12Å; T865-Y1160 HydrophobicContact CG2-CE1 4.1Å; T865-Y1160 HydrophobicContact CG2-CG 3.5Å; T865-Y1160 VanDerWaalsContact CG2-CG 3.5Å
866	G	80.6	Confident	83	Confident	5 Å²	5	43.5 Å²	43.5	5%	0.052	25%	0.248	C	C	.	.			trans	65.4	168.5	-172.7	0	0	0	0	0	114.9	M862 R982 I983	M862-G866 PolarHBondContact O-N 2.82Å; G866-R982 PolarHBondContact O-NH1 3.43Å; G866-I983 CarbonylContact C-O 3.51Å; G866-I983 WeakPolarHBondContact CA-O 3.25Å
867	I	80.5	Confident	83.1	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152.9	-177.7	-164	159.1	0	0	0	112.3	R982 I983 L1003 V1016 L1162 I1169	I867-R982 CarbonylContact O-C 3.52Å; I867-R982 WeakPolarHBondContact O-CA 3.47Å; I867-I983 HydrophobicContact CG2-CB 4.21Å; I867-I983 PolarHBondContact N-O 2.9Å; I867-I983 PolarHBondContact O-N 2.96Å; I867-L1003 HydrophobicContact CG2-CD1 3.9Å; I867-V1016 HydrophobicContact CD1-CG1 3.33Å; I867-V1016 HydrophobicContact CG1-CG1 3.73Å; I867-V1016 HydrophobicContact CG2-CG1 4.29Å; I867-L1162 HydrophobicContact CB-CD1 4.35Å; I867-L1162 HydrophobicContact CB-CD2 4.16Å; I867-L1162 HydrophobicContact CD1-CB 4.09Å; I867-L1162 HydrophobicContact CD1-CD2 3.52Å; I867-L1162 HydrophobicContact CD1-CG 4.35Å; I867-L1162 HydrophobicContact CG1-CD2 4.44Å; I867-L1162 HydrophobicContact CG2-CD1 4.48Å; I867-L1162 HydrophobicContact CG2-CD2 4.1Å; I867-I1169 HydrophobicContact CD1-CG2 4.07Å
868	G	81.6	Confident	83.6	Confident	11 Å²	11	35.9 Å²	35.9	11%	0.113	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.6	177.3	0	0	0	0	0	112.3	V1017	G868-V1017 CarbonylContact C-O 3.5Å; G868-V1017 VanDerWaalsContact CA-O 3.28Å; G868-V1017 WeakPolarHBondContact CA-O 2.96Å; G868-V1017 PolarHBondContact O-N 3.41Å
869	F	85.1	Confident	84.3	Confident	9 Å²	9	41.4 Å²	41.4	4%	0.039	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	129.6	-177	172.1	-122	0	0	0	111.8	S871 C874 L971 T981 I983 L1015	F869-S871 PolarHBondContact O-N 2.9Å; F869-C874 HydrophobicContact CE1-CB 4.45Å; F869-C874 HydrophobicContact CE2-CB 3.74Å; F869-C874 HydrophobicContact CZ-CB 3.4Å; F869-C874 VanDerWaalsContact CZ-CB 3.4Å; F869-L971 WeakPolarHBondContact CE1-O 3.35Å; F869-L971 HydrophobicContact CE2-CB 4.14Å; F869-L971 HydrophobicContact CZ-CB 3.99Å; F869-T981 WeakPolarHBondContact CB-O 3.33Å; F869-T981 PolarHBondContact N-O 3.16Å; F869-T981 WeakPolarHBondContact O-CB 3.44Å; F869-T981 PolarHBondContact O-OG1 3.47Å; F869-I983 HydrophobicContact CB-CD1 3.54Å; F869-I983 HydrophobicContact CB-CG1 3.63Å; F869-I983 HydrophobicContact CD1-CD1 4.1Å; F869-I983 HydrophobicContact CD1-CG1 4.05Å; F869-I983 HydrophobicContact CD2-CD1 3.34Å; F869-I983 HydrophobicContact CD2-CG1 4.17Å; F869-I983 HydrophobicContact CE2-CD1 3.99Å; F869-I983 HydrophobicContact CG-CD1 3.39Å; F869-I983 HydrophobicContact CG-CG1 3.7Å; F869-L1015 WeakPolarHBondContact CA-O 3.39Å; F869-L1015 HydrophobicContact CD2-CB 4.23Å; F869-L1015 HydrophobicContact CE2-CB 4.05Å; F869-L1015 HydrophobicContact CE2-CD1 4.49Å
870	D	87.3	Confident	84.8	Confident	36 Å²	36	44.9 Å²	44.9	19%	0.193	27%	0.27	C	S	.	.			trans	-88.1	87.6	175.9	-167.4	-22.6	0	0	0	110.3	A872 L873 C874 L1015 V1017 R1210	D870-A872 VanDerWaalsContact C-N 3.27Å; D870-A872 PolarHBondContact O-N 2.8Å; D870-A872 PolarHBondContact OD1-N 2.77Å; D870-L873 HydrophobicContact CB-CB 3.98Å; D870-L873 PolarHBondContact O-N 3.07Å; D870-L873 WeakPolarHBondContact OD1-CB 3.47Å; D870-L873 PolarHBondContact OD1-N 2.78Å; D870-C874 PolarHBondContact O-N 3.18Å; D870-L1015 PolarHBondContact N-O 3.41Å; D870-V1017 HydrophobicContact CB-CG1 4.08Å; D870-R1210 IonicContact OD2-CZ 2.71Å; D870-R1210 IonicContact OD2-NH1 3.94Å; D870-R1210 PolarHBondContact OD2-NH1 3.43Å; D870-R1210 IonicContact OD2-NH2 3.29Å; D870-R1210 PolarHBondContact OD2-NH2 3.42Å
871	S	85.5	Confident	85.2	Confident	40 Å²	40	43.6 Å²	43.6	28%	0.28	26%	0.257	S	S	.	.	H	α-helix	trans	-65.5	-31.1	-178.8	-174.5	0	0	0	0	112.7	F869 C874 S875	F869-S871 PolarHBondContact O-N 2.9Å; S871-C874 PolarHBondContact O-N 3.07Å; S871-S875 PolarHBondContact O-N 3.11Å; S871-S875 PolarHBondContact O-OG 3.46Å
872	A	86.6	Confident	86.1	Confident	74 Å²	74	42.5 Å²	42.5	61%	0.612	25%	0.251	S	S	*	.	H	α-helix	trans	-69.6	-45.2	179.5	0	0	0	0	0	110.9	D870 C874 S875 S876	D870-A872 VanDerWaalsContact C-N 3.27Å; D870-A872 PolarHBondContact O-N 2.8Å; D870-A872 PolarHBondContact OD1-N 2.77Å; A872-C874 VanDerWaalsContact C-N 3.3Å; A872-C874 PolarHBondContact O-N 2.93Å; A872-S875 PolarHBondContact O-N 2.83Å; A872-S876 PolarHBondContact O-N 2.62Å
873	L	87.9	Confident	86.9	Confident	54 Å²	54	43.8 Å²	43.8	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-39.6	173.2	-175.9	61.7	0	0	0	111.3	D870 S875 S876 M877 N1014 L1015	D870-L873 HydrophobicContact CB-CB 3.98Å; D870-L873 PolarHBondContact O-N 3.07Å; D870-L873 WeakPolarHBondContact OD1-CB 3.47Å; D870-L873 PolarHBondContact OD1-N 2.78Å; L873-S875 PolarHBondContact O-N 3.17Å; L873-S876 PolarHBondContact O-N 2.96Å; L873-M877 HydrophobicContact CD1-CG 4.39Å; L873-M877 HydrophobicContact CG-CG 4.44Å; L873-M877 HydrophobicContact CG-SD 4.33Å; L873-M877 WeakPolarHBondContact O-CB 3.39Å; L873-M877 WeakPolarHBondContact O-CG 3.31Å; L873-M877 PolarHBondContact O-N 3.15Å; L873-N1014 HydrophobicContact CD2-CB 4.46Å; L873-L1015 HydrophobicContact CB-CD2 4.02Å; L873-L1015 HydrophobicContact CD2-CD2 4Å; L873-L1015 HydrophobicContact CG-CD2 3.75Å
874	C	89	Confident	87.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-44.2	177.3	-165.4	0	0	0	0	112.2	F869 D870 S871 A872 M877 C878 L972 L1015	F869-C874 HydrophobicContact CE1-CB 4.45Å; F869-C874 HydrophobicContact CE2-CB 3.74Å; F869-C874 HydrophobicContact CZ-CB 3.4Å; F869-C874 VanDerWaalsContact CZ-CB 3.4Å; D870-C874 PolarHBondContact O-N 3.18Å; S871-C874 PolarHBondContact O-N 3.07Å; A872-C874 VanDerWaalsContact C-N 3.3Å; A872-C874 PolarHBondContact O-N 2.93Å; C874-M877 PolarHBondContact O-N 3.47Å; C874-C878 WeakPolarHBondContact O-CB 3.1Å; C874-C878 PolarHBondContact O-N 2.99Å; C874-L972 HydrophobicContact CB-CD2 4.01Å; C874-L1015 HydrophobicContact CB-CD1 4.25Å; C874-L1015 HydrophobicContact CB-CD2 3.82Å
875	S	88.8	Confident	88.3	Confident	57 Å²	57	40.8 Å²	40.8	40%	0.399	24%	0.243	S	C	.	.	H	α-helix	trans	-62	-43.2	175.1	-67.2	0	0	0	0	111.9	S871 A872 L873 C878 E879	S871-S875 PolarHBondContact O-N 3.11Å; S871-S875 PolarHBondContact O-OG 3.46Å; A872-S875 PolarHBondContact O-N 2.83Å; L873-S875 PolarHBondContact O-N 3.17Å; S875-C878 WeakPolarHBondContact O-CB 3.14Å; S875-C878 PolarHBondContact O-N 2.82Å; S875-E879 PolarHBondContact O-N 2.91Å
876	S	89.7	Confident	89.2	Confident	76 Å²	76	45.8 Å²	45.8	53%	0.531	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-44.1	176	177.4	0	0	0	0	112.3	A872 L873 C878 E879 S880	A872-S876 PolarHBondContact O-N 2.62Å; L873-S876 PolarHBondContact O-N 2.96Å; S876-C878 VanDerWaalsContact C-N 3.31Å; S876-C878 PolarHBondContact O-N 2.8Å; S876-E879 PolarHBondContact O-N 3.01Å; S876-S880 PolarHBondContact O-N 3.38Å
877	M	88.3	Confident	89.9	Confident	33 Å²	33	51.3 Å²	51.3	16%	0.163	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-36.8	175.3	-72.9	-173.7	77.4	0	0	112.2	L873 C874 S880 L881 I1010 L1012 L1015	L873-M877 HydrophobicContact CD1-CG 4.39Å; L873-M877 HydrophobicContact CG-CG 4.44Å; L873-M877 HydrophobicContact CG-SD 4.33Å; L873-M877 WeakPolarHBondContact O-CB 3.39Å; L873-M877 WeakPolarHBondContact O-CG 3.31Å; L873-M877 PolarHBondContact O-N 3.15Å; C874-M877 PolarHBondContact O-N 3.47Å; M877-S880 PolarHBondContact O-N 2.9Å; M877-L881 WeakPolarHBondContact O-CB 2.86Å; M877-L881 VanDerWaalsContact O-CG 3.23Å; M877-L881 WeakPolarHBondContact O-CG 3.4Å; M877-L881 PolarHBondContact O-N 2.91Å; M877-I1010 VanDerWaalsContact CE-O 3.25Å; M877-I1010 WeakPolarHBondContact CE-O 3.09Å; M877-L1012 HydrophobicContact CE-CD2 3.68Å; M877-L1012 HydrophobicContact CE-CG 4.42Å; M877-L1012 HydrophobicContact SD-CD2 4.38Å; M877-L1015 HydrophobicContact SD-CD1 4.36Å; M877-L1015 HydrophobicContact SD-CD2 3.63Å; M877-L1015 HydrophobicContact SD-CG 4.02Å
878	C	91.6	Very high	90.6	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-58.6	-49.9	176.2	-172.5	0	0	0	0	111.4	C874 S875 S876 L881 K882 V968 L972	C874-C878 WeakPolarHBondContact O-CB 3.1Å; C874-C878 PolarHBondContact O-N 2.99Å; S875-C878 WeakPolarHBondContact O-CB 3.14Å; S875-C878 PolarHBondContact O-N 2.82Å; S876-C878 VanDerWaalsContact C-N 3.31Å; S876-C878 PolarHBondContact O-N 2.8Å; C878-L881 PolarHBondContact O-N 3.39Å; C878-K882 WeakPolarHBondContact O-CG 3.35Å; C878-K882 PolarHBondContact O-N 2.87Å; C878-K882 VanDerWaalsContact SG-CE 3.57Å; C878-V968 HydrophobicContact CB-CG1 3.68Å; C878-L972 HydrophobicContact CB-CD1 3.91Å
879	E	93.1	Very high	91.2	Very high	118 Å²	118	55.1 Å²	55.1	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-66.8	-39.9	179	-63.8	-50.5	127.3	0	0	112.1	S875 S876 L881 K882 G883	S875-E879 PolarHBondContact O-N 2.91Å; S876-E879 PolarHBondContact O-N 3.01Å; E879-L881 PolarHBondContact O-N 2.77Å; E879-K882 PolarHBondContact O-N 3.21Å; E879-K882 IonicContact OE1-NZ 3.89Å; E879-K882 PolarHBondContact OE1-NZ 3.27Å; E879-K882 IonicContact OE2-NZ 3.71Å; E879-G883 PolarHBondContact O-N 3.03Å
880	S	91.5	Very high	91.7	Very high	76 Å²	76	61.7 Å²	61.7	53%	0.531	34%	0.335	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175	-178.5	0	0	0	0	112.6	S876 M877 G883 R884	S876-S880 PolarHBondContact O-N 3.38Å; M877-S880 PolarHBondContact O-N 2.9Å; S880-G883 PolarHBondContact O-N 2.7Å; S880-R884 PolarHBondContact O-N 2.73Å; S880-R884 VanDerWaalsContact O-N 3.08Å
881	L	91.2	Very high	92.1	Very high	13 Å²	13	62 Å²	62	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-66.7	-41.1	178.5	-72.9	172.8	0	0	0	112.1	M877 C878 E879 G883 R884 I885 L960 L964 V968 I1010	M877-L881 WeakPolarHBondContact O-CB 2.86Å; M877-L881 VanDerWaalsContact O-CG 3.23Å; M877-L881 WeakPolarHBondContact O-CG 3.4Å; M877-L881 PolarHBondContact O-N 2.91Å; C878-L881 PolarHBondContact O-N 3.39Å; E879-L881 PolarHBondContact O-N 2.77Å; L881-G883 VanDerWaalsContact C-N 3.35Å; L881-R884 PolarHBondContact O-N 3.38Å; L881-I885 WeakPolarHBondContact O-CB 3.26Å; L881-I885 VanDerWaalsContact O-CG1 3.26Å; L881-I885 WeakPolarHBondContact O-CG1 3.49Å; L881-I885 PolarHBondContact O-N 3.49Å; L881-L960 HydrophobicContact CD2-CB 4.44Å; L881-L960 HydrophobicContact CD2-CD2 3.64Å; L881-L960 HydrophobicContact CD2-CG 4.46Å; L881-L964 HydrophobicContact CB-CD1 4.18Å; L881-L964 HydrophobicContact CD1-CD1 4.4Å; L881-V968 HydrophobicContact CD1-CG2 3.9Å; L881-I1010 HydrophobicContact CD2-CG2 4.12Å
882	K	94.3	Very high	92.5	Very high	60 Å²	60	60.1 Å²	60.1	26%	0.261	32%	0.323	S	S	.	.	H	α-helix	trans	-59.4	-45.9	174.1	-73.9	172.7	-174.5	168.5	0	111.4	C878 E879 R884 I885 M886 L964	C878-K882 WeakPolarHBondContact O-CG 3.35Å; C878-K882 PolarHBondContact O-N 2.87Å; C878-K882 VanDerWaalsContact SG-CE 3.57Å; E879-K882 PolarHBondContact O-N 3.21Å; E879-K882 IonicContact OE1-NZ 3.89Å; E879-K882 PolarHBondContact OE1-NZ 3.27Å; E879-K882 IonicContact OE2-NZ 3.71Å; K882-R884 PolarHBondContact O-N 3.26Å; K882-I885 PolarHBondContact O-N 3.32Å; K882-M886 WeakPolarHBondContact O-CG 3.38Å; K882-M886 PolarHBondContact O-N 3.07Å; K882-L964 HydrophobicContact CG-CD2 3.89Å
883	G	95.2	Very high	92.8	Very high	31 Å²	31	57.6 Å²	57.6	32%	0.32	30%	0.302	S	S	.	.	H	α-helix	trans	-57.4	-49.1	176.8	0	0	0	0	0	112.2	E879 S880 L881 I885 M886 E887	E879-G883 PolarHBondContact O-N 3.03Å; S880-G883 PolarHBondContact O-N 2.7Å; L881-G883 VanDerWaalsContact C-N 3.35Å; G883-I885 VanDerWaalsContact C-N 3.32Å; G883-I885 PolarHBondContact O-N 3.45Å; G883-M886 PolarHBondContact O-N 3.09Å; G883-E887 WeakPolarHBondContact O-CG 3.39Å; G883-E887 PolarHBondContact O-N 3.21Å
884	R	94.8	Very high	93	Very high	115 Å²	115	62.2 Å²	62.2	43%	0.434	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-33.7	177.4	-69.5	-144.4	68.7	-177.3	-4.3	113.8	S880 L881 K882 L888 L960	S880-R884 PolarHBondContact O-N 2.73Å; S880-R884 VanDerWaalsContact O-N 3.08Å; L881-R884 PolarHBondContact O-N 3.38Å; K882-R884 PolarHBondContact O-N 3.26Å; R884-L888 VanDerWaalsContact O-CG 3.31Å; R884-L888 WeakPolarHBondContact O-CG 3.46Å; R884-L888 PolarHBondContact O-N 2.78Å; R884-L888 VanDerWaalsContact O-N 3.09Å; R884-L960 HydrophobicContact CB-CD1 3.9Å
885	I	95.3	Very high	93.2	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.082	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-45.7	174.3	-75.5	168.2	0	0	0	110.1	L881 K882 G883 E887 L888 E889 L960 L964	L881-I885 WeakPolarHBondContact O-CB 3.26Å; L881-I885 VanDerWaalsContact O-CG1 3.26Å; L881-I885 WeakPolarHBondContact O-CG1 3.49Å; L881-I885 PolarHBondContact O-N 3.49Å; K882-I885 PolarHBondContact O-N 3.32Å; G883-I885 VanDerWaalsContact C-N 3.32Å; G883-I885 PolarHBondContact O-N 3.45Å; I885-E887 PolarHBondContact O-N 2.65Å; I885-L888 PolarHBondContact O-N 3Å; I885-E889 WeakPolarHBondContact O-CG 3.27Å; I885-E889 PolarHBondContact O-N 2.9Å; I885-L960 HydrophobicContact CD1-CB 4.11Å; I885-L960 HydrophobicContact CG1-CB 3.84Å; I885-L964 HydrophobicContact CD1-CB 4.43Å; I885-L964 HydrophobicContact CD1-CD2 3.89Å
886	M	95	Very high	93.3	Very high	129 Å²	129	62.4 Å²	62.4	64%	0.635	31%	0.314	S	S	*	.	H	α-helix	trans	-62	-42.2	176.8	-70.8	178.2	176.6	0	0	112.4	K882 G883 L888 E889 F890	K882-M886 WeakPolarHBondContact O-CG 3.38Å; K882-M886 PolarHBondContact O-N 3.07Å; G883-M886 PolarHBondContact O-N 3.09Å; M886-L888 VanDerWaalsContact C-N 3.35Å; M886-L888 PolarHBondContact O-N 3.03Å; M886-E889 PolarHBondContact O-N 3.16Å; M886-F890 WeakPolarHBondContact O-CB 3.4Å; M886-F890 PolarHBondContact O-N 3.39Å
887	E	95.7	Very high	93.2	Very high	122 Å²	122	62.3 Å²	62.3	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-58.2	-46.1	174.4	-72.8	171.1	-176.3	0	0	111.8	G883 I885 F890 D891	G883-E887 WeakPolarHBondContact O-CG 3.39Å; G883-E887 PolarHBondContact O-N 3.21Å; I885-E887 PolarHBondContact O-N 2.65Å; E887-F890 PolarHBondContact O-N 2.85Å; E887-D891 WeakPolarHBondContact O-CB 3.28Å; E887-D891 PolarHBondContact O-N 3.45Å
888	L	95.1	Very high	93.3	Very high	10 Å²	10	65 Å²	65	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-36.6	179	-74.5	169.8	0	0	0	112.4	R884 I885 M886 S892 N953 Q956 W957 L960	R884-L888 VanDerWaalsContact O-CG 3.31Å; R884-L888 WeakPolarHBondContact O-CG 3.46Å; R884-L888 PolarHBondContact O-N 2.78Å; R884-L888 VanDerWaalsContact O-N 3.09Å; I885-L888 PolarHBondContact O-N 3Å; M886-L888 VanDerWaalsContact C-N 3.35Å; M886-L888 PolarHBondContact O-N 3.03Å; L888-S892 WeakPolarHBondContact O-CB 3.47Å; L888-S892 PolarHBondContact O-N 3.33Å; L888-S892 PolarHBondContact O-OG 3.19Å; L888-N953 HydrophobicContact CD2-CB 4.06Å; L888-Q956 HydrophobicContact CD1-CB 3.79Å; L888-Q956 HydrophobicContact CD2-CB 4.36Å; L888-W957 HydrophobicContact CB-CB 4.41Å; L888-W957 HydrophobicContact CD1-CB 4.23Å; L888-L960 HydrophobicContact CD1-CD1 3.97Å
889	E	95	Very high	93.2	Very high	85 Å²	85	73 Å²	73	40%	0.397	37%	0.37	S	S	.	.	H	α-helix	trans	-64.8	-45.3	175.5	-75.5	172.3	177.8	0	0	111.2	I885 M886 S892 A893 M902 W957	I885-E889 WeakPolarHBondContact O-CG 3.27Å; I885-E889 PolarHBondContact O-N 2.9Å; M886-E889 PolarHBondContact O-N 3.16Å; E889-S892 PolarHBondContact O-N 3.44Å; E889-A893 WeakPolarHBondContact O-CB 3.47Å; E889-A893 PolarHBondContact O-N 3.32Å; E889-M902 HydrophobicContact CG-SD 4.34Å; E889-W957 VanDerWaalsContact CG-NE1 3.31Å; E889-W957 PolarHBondContact OE1-NE1 3.42Å
890	F	94.2	Very high	93.1	Very high	148 Å²	148	68.7 Å²	68.7	65%	0.649	35%	0.35	S	S	*	.	H	α-helix	trans	-62.8	-48	176.4	-178.4	-98.2	0	0	0	111.9	M886 E887 S892 A893 R894	M886-F890 WeakPolarHBondContact O-CB 3.4Å; M886-F890 PolarHBondContact O-N 3.39Å; E887-F890 PolarHBondContact O-N 2.85Å; F890-S892 VanDerWaalsContact C-N 3.35Å; F890-S892 PolarHBondContact O-N 3Å; F890-A893 PolarHBondContact O-N 2.73Å; F890-R894 PolarHBondContact O-N 3.26Å
891	D	95.9	Very high	93	Very high	43 Å²	43	68.5 Å²	68.5	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-63.8	-40.5	178.7	-162.4	65.8	0	0	0	111.9	E887 R894 L895 N953	E887-D891 WeakPolarHBondContact O-CB 3.28Å; E887-D891 PolarHBondContact O-N 3.45Å; D891-R894 WeakPolarHBondContact O-CB 3.33Å; D891-R894 PolarHBondContact O-N 2.9Å; D891-R894 IonicContact OD1-CZ 3.03Å; D891-R894 IonicContact OD1-NH1 2.78Å; D891-R894 PolarHBondContact OD1-NH1 2.88Å; D891-R894 IonicContact OD1-NH2 2.62Å; D891-R894 PolarHBondContact OD1-NH2 3.29Å; D891-L895 WeakPolarHBondContact O-CG 3.31Å; D891-L895 PolarHBondContact O-N 2.86Å; D891-N953 PolarHBondContact OD2-ND2 2.95Å
892	S	94.3	Very high	92.9	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-40.7	177.4	-61.4	0	0	0	0	112.3	L888 E889 F890 R894 L895 A896 M902 N953	L888-S892 WeakPolarHBondContact O-CB 3.47Å; L888-S892 PolarHBondContact O-N 3.33Å; L888-S892 PolarHBondContact O-OG 3.19Å; E889-S892 PolarHBondContact O-N 3.44Å; F890-S892 VanDerWaalsContact C-N 3.35Å; F890-S892 PolarHBondContact O-N 3Å; S892-R894 VanDerWaalsContact C-N 3.31Å; S892-R894 PolarHBondContact O-N 2.85Å; S892-L895 PolarHBondContact O-N 2.99Å; S892-A896 VanDerWaalsContact O-CB 3.3Å; S892-A896 WeakPolarHBondContact O-CB 3.42Å; S892-A896 PolarHBondContact O-N 2.91Å; S892-M902 WeakPolarHBondContact OG-CE 3.21Å; S892-N953 WeakPolarHBondContact OG-CB 3.34Å
893	A	92.2	Very high	92.5	Very high	20 Å²	20	68.8 Å²	68.8	17%	0.165	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-38.3	174.6	0	0	0	0	0	111.5	E889 F890 G897 R898 Q899	E889-A893 WeakPolarHBondContact O-CB 3.47Å; E889-A893 PolarHBondContact O-N 3.32Å; F890-A893 PolarHBondContact O-N 2.73Å; A893-G897 PolarHBondContact O-N 2.98Å; A893-R898 WeakPolarHBondContact CA-O 3.39Å; A893-R898 PolarHBondContact O-N 3.19Å; A893-Q899 HydrophobicContact CB-CG 3.96Å
894	R	92.9	Very high	92.2	Very high	152 Å²	152	68.8 Å²	68.8	57%	0.574	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-46.1	174.5	-168.1	178.8	77.3	-114.4	-2.5	111.9	F890 D891 S892 G897	F890-R894 PolarHBondContact O-N 3.26Å; D891-R894 WeakPolarHBondContact O-CB 3.33Å; D891-R894 PolarHBondContact O-N 2.9Å; D891-R894 IonicContact OD1-CZ 3.03Å; D891-R894 IonicContact OD1-NH1 2.78Å; D891-R894 PolarHBondContact OD1-NH1 2.88Å; D891-R894 IonicContact OD1-NH2 2.62Å; D891-R894 PolarHBondContact OD1-NH2 3.29Å; S892-R894 VanDerWaalsContact C-N 3.31Å; S892-R894 PolarHBondContact O-N 2.85Å; R894-G897 PolarHBondContact O-N 3.03Å
895	L	92.7	Very high	91.8	Very high	46 Å²	46	66.8 Å²	66.8	24%	0.241	35%	0.35	C	S	.	.	H	α-helix	trans	-68.7	-30.9	179.2	-71.5	173.5	0	0	0	113.4	D891 S892 P949 L950	D891-L895 WeakPolarHBondContact O-CG 3.31Å; D891-L895 PolarHBondContact O-N 2.86Å; S892-L895 PolarHBondContact O-N 2.99Å; L895-P949 HydrophobicContact CD1-CB 4.13Å; L895-P949 HydrophobicContact CD1-CG 3.97Å; L895-P949 HydrophobicContact CD2-CG 3.91Å; L895-L950 HydrophobicContact CB-CB 4.42Å; L895-L950 HydrophobicContact CB-CD1 4.24Å; L895-L950 HydrophobicContact CD1-CB 4.4Å
896	A	90.3	Very high	91.4	Very high	15 Å²	15	71 Å²	71	12%	0.124	37%	0.372	C	S	.	.	H	α-helix	trans	-84.9	-14	177.8	0	0	0	0	0	113.6	S892 R898 F900 V911 L950	S892-A896 VanDerWaalsContact O-CB 3.3Å; S892-A896 WeakPolarHBondContact O-CB 3.42Å; S892-A896 PolarHBondContact O-N 2.91Å; A896-R898 PolarHBondContact O-N 3.36Å; A896-F900 HydrophobicContact CB-CD1 3.82Å; A896-F900 HydrophobicContact CB-CE1 3.62Å; A896-V911 HydrophobicContact CB-CG1 3.68Å; A896-L950 HydrophobicContact CB-CD2 4.19Å
897	G	88	Confident	91.2	Very high	73 Å²	73	68.1 Å²	68.1	75%	0.753	36%	0.357	S	S	*	.	S	Bend	trans	76	-3.8	-174	0	0	0	0	0	114.9	A893 R894	A893-G897 PolarHBondContact O-N 2.98Å; R894-G897 PolarHBondContact O-N 3.03Å
898	R	90.7	Very high	91	Very high	89 Å²	89	62.3 Å²	62.3	34%	0.336	33%	0.33	S	S	.	.	S	Bend	trans	-153.8	161	174.9	66.3	175.4	-173.7	87.8	-4.3	111	A893 A896 E915	A893-R898 WeakPolarHBondContact CA-O 3.39Å; A893-R898 PolarHBondContact O-N 3.19Å; A896-R898 PolarHBondContact O-N 3.36Å; R898-E915 IonicContact CZ-OE1 3.47Å; R898-E915 IonicContact CZ-OE2 3.44Å; R898-E915 IonicContact NE-OE1 3.36Å; R898-E915 PolarHBondContact NE-OE1 3.39Å; R898-E915 IonicContact NE-OE2 2.81Å; R898-E915 PolarHBondContact NE-OE2 3.33Å; R898-E915 IonicContact NH2-OE1 3.24Å; R898-E915 PolarHBondContact NH2-OE1 3Å; R898-E915 IonicContact NH2-OE2 3.15Å; R898-E915 PolarHBondContact NH2-OE2 2.99Å
899	Q	89.8	Confident	90.6	Very high	172 Å²	172	62.1 Å²	62.1	80%	0.804	33%	0.33	S	S	*	.			trans	-70.4	142.1	167.2	-69.5	-174.7	-5	0	0	110.8	A893	A893-Q899 HydrophobicContact CB-CG 3.96Å
900	F	91.2	Very high	90.3	Very high	28 Å²	28	63.5 Å²	63.5	12%	0.123	34%	0.335	C	S	.	.			trans	-152	157.1	176.5	71.6	-80.9	0	0	0	109.9	A896 M902 V908 V911 L950	A896-F900 HydrophobicContact CB-CD1 3.82Å; A896-F900 HydrophobicContact CB-CE1 3.62Å; F900-M902 HydrophobicContact CD2-CG 4.37Å; F900-M902 HydrophobicContact CE2-CG 3.73Å; F900-M902 HydrophobicContact CZ-CG 3.89Å; F900-M902 PolarHBondContact O-N 2.85Å; F900-V908 HydrophobicContact CE2-CG2 4.03Å; F900-V911 HydrophobicContact CB-CG2 4.01Å; F900-V911 HydrophobicContact CD1-CG2 4.15Å; F900-V911 HydrophobicContact CD2-CG2 3.98Å; F900-V911 HydrophobicContact CE2-CG2 4.5Å; F900-V911 HydrophobicContact CG-CG2 3.79Å; F900-L950 HydrophobicContact CE1-CD1 4.33Å; F900-L950 HydrophobicContact CZ-CD1 4.11Å; F900-L950 HydrophobicContact CZ-CD2 4.32Å
901	N	89.3	Confident	90.1	Very high	72 Å²	72	56.5 Å²	56.5	39%	0.385	30%	0.304	S	S	.	.			trans	-83.5	104.2	-178.3	-175.1	-1.4	0	0	0	111.4	S903 S904 E907	N901-S903 PolarHBondContact ND2-OG 3.26Å; N901-S903 VanDerWaalsContact ND2-OG 3.16Å; N901-S903 PolarHBondContact O-N 3.21Å; N901-S903 VanDerWaalsContact OD1-CB 3.31Å; N901-S903 WeakPolarHBondContact OD1-CB 3.34Å; N901-S903 PolarHBondContact OD1-N 3.44Å; N901-S903 PolarHBondContact OD1-OG 2.83Å; N901-S904 PolarHBondContact O-N 3.49Å; N901-S904 VanDerWaalsContact O-N 3.14Å; N901-E907 WeakPolarHBondContact CB-OE2 3.24Å; N901-E907 PolarHBondContact N-OE2 2.78Å
902	M	88.3	Confident	89.8	Confident	7 Å²	7	54.5 Å²	54.5	3%	0.034	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.6	178.5	-63.6	-177.9	78.8	0	0	113.8	E889 S892 F900 S904 V954 W957	E889-M902 HydrophobicContact CG-SD 4.34Å; S892-M902 WeakPolarHBondContact OG-CE 3.21Å; F900-M902 HydrophobicContact CD2-CG 4.37Å; F900-M902 HydrophobicContact CE2-CG 3.73Å; F900-M902 HydrophobicContact CZ-CG 3.89Å; F900-M902 PolarHBondContact O-N 2.85Å; M902-S904 VanDerWaalsContact C-N 3.33Å; M902-V954 VanDerWaalsContact CE-CA 3.47Å; M902-V954 HydrophobicContact CE-CB 4.11Å; M902-V954 HydrophobicContact CE-CG2 3.69Å; M902-W957 HydrophobicContact CB-CD2 3.7Å; M902-W957 HydrophobicContact CB-CE3 3.63Å; M902-W957 HydrophobicContact CB-CG 4.36Å; M902-W957 HydrophobicContact CB-CH2 4.14Å; M902-W957 HydrophobicContact CB-CZ2 4.14Å; M902-W957 HydrophobicContact CB-CZ3 3.87Å; M902-W957 HydrophobicContact CE-CB 3.53Å; M902-W957 HydrophobicContact CE-CD2 4.28Å; M902-W957 HydrophobicContact CE-CG 3.76Å; M902-W957 HydrophobicContact SD-CB 4.16Å; M902-W957 HydrophobicContact SD-CD2 4.09Å; M902-W957 HydrophobicContact SD-CG 3.74Å
903	S	86	Confident	89.5	Confident	72 Å²	72	55.4 Å²	55.4	50%	0.503	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-26.1	174.1	75.1	0	0	0	0	112.7	N901 P905	N901-S903 PolarHBondContact ND2-OG 3.26Å; N901-S903 VanDerWaalsContact ND2-OG 3.16Å; N901-S903 PolarHBondContact O-N 3.21Å; N901-S903 VanDerWaalsContact OD1-CB 3.31Å; N901-S903 WeakPolarHBondContact OD1-CB 3.34Å; N901-S903 PolarHBondContact OD1-N 3.44Å; N901-S903 PolarHBondContact OD1-OG 2.83Å; S903-P905 VanDerWaalsContact O-CD 3.29Å; S903-P905 WeakPolarHBondContact O-CD 3.16Å
904	S	89.3	Confident	89.2	Confident	30 Å²	30	60.2 Å²	60.2	21%	0.21	32%	0.316	C	S	.	.			trans	-87.8	111.2	-178.1	175.6	0	0	0	0	110.6	N901 M902 N906 E907 V908	N901-S904 PolarHBondContact O-N 3.49Å; N901-S904 VanDerWaalsContact O-N 3.14Å; M902-S904 VanDerWaalsContact C-N 3.33Å; S904-N906 PolarHBondContact O-N 3.43Å; S904-E907 PolarHBondContact O-N 2.89Å; S904-E907 PolarHBondContact OG-N 2.77Å; S904-V908 WeakPolarHBondContact O-CG2 3.35Å; S904-V908 PolarHBondContact O-N 3.28Å; S904-V908 VanDerWaalsContact O-N 3.14Å
905	P	87	Confident	88.9	Confident	73 Å²	73	56.7 Å²	56.7	47%	0.474	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-30.7	177.6	-23.9	35.6	0	0	0	113	S903 A909	S903-P905 VanDerWaalsContact O-CD 3.29Å; S903-P905 WeakPolarHBondContact O-CD 3.16Å; P905-A909 VanDerWaalsContact O-CB 3.31Å; P905-A909 WeakPolarHBondContact O-CB 3.24Å; P905-A909 PolarHBondContact O-N 2.96Å
906	N	87	Confident	88.7	Confident	104 Å²	104	57.3 Å²	57.3	56%	0.556	31%	0.309	S	S	*	.	H	α-helix	trans	-70.8	-41.8	179.8	-70.3	-19.6	0	0	0	112.1	S904 A909 K910	S904-N906 PolarHBondContact O-N 3.43Å; N906-A909 PolarHBondContact O-N 2.95Å; N906-K910 WeakPolarHBondContact O-CB 3.35Å; N906-K910 PolarHBondContact O-N 2.99Å
907	E	90	Very high	88.3	Confident	69 Å²	69	59.2 Å²	59.2	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-42.5	176.1	-77.1	-170	-143.5	0	0	111.5	N901 S904 A909 K910 V911	N901-E907 WeakPolarHBondContact CB-OE2 3.24Å; N901-E907 PolarHBondContact N-OE2 2.78Å; S904-E907 PolarHBondContact O-N 2.89Å; S904-E907 PolarHBondContact OG-N 2.77Å; E907-A909 VanDerWaalsContact C-N 3.3Å; E907-A909 PolarHBondContact O-N 3.16Å; E907-K910 WeakPolarHBondContact O-CB 3.33Å; E907-K910 PolarHBondContact O-N 2.92Å; E907-K910 VanDerWaalsContact O-N 3.15Å; E907-V911 WeakPolarHBondContact O-CG2 3.34Å; E907-V911 PolarHBondContact O-N 2.75Å
908	V	91.1	Very high	88.2	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-45.2	174.1	177.7	0	0	0	0	110.3	F900 S904 K910 V911 L912 T936 V954	F900-V908 HydrophobicContact CE2-CG2 4.03Å; S904-V908 WeakPolarHBondContact O-CG2 3.35Å; S904-V908 PolarHBondContact O-N 3.28Å; S904-V908 VanDerWaalsContact O-N 3.14Å; V908-K910 VanDerWaalsContact C-N 3.34Å; V908-K910 PolarHBondContact O-N 3.46Å; V908-V911 PolarHBondContact O-N 3.09Å; V908-L912 HydrophobicContact CG1-CD1 3.7Å; V908-L912 HydrophobicContact CG1-CG 4.27Å; V908-L912 WeakPolarHBondContact O-CB 3.28Å; V908-L912 VanDerWaalsContact O-CG 3.26Å; V908-L912 WeakPolarHBondContact O-CG 3.19Å; V908-L912 PolarHBondContact O-N 3.17Å; V908-T936 HydrophobicContact CB-CG2 4.24Å; V908-T936 HydrophobicContact CG1-CG2 3.86Å; V908-V954 HydrophobicContact CG1-CG1 4.04Å; V908-V954 HydrophobicContact CG1-CG2 4.23Å
909	A	87.8	Confident	87.7	Confident	6 Å²	6	55.9 Å²	55.9	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-39.1	177.2	0	0	0	0	0	112.3	P905 N906 E907 F913 T936	P905-A909 VanDerWaalsContact O-CB 3.31Å; P905-A909 WeakPolarHBondContact O-CB 3.24Å; P905-A909 PolarHBondContact O-N 2.96Å; N906-A909 PolarHBondContact O-N 2.95Å; E907-A909 VanDerWaalsContact C-N 3.3Å; E907-A909 PolarHBondContact O-N 3.16Å; A909-F913 HydrophobicContact CB-CD2 4.2Å; A909-F913 WeakPolarHBondContact O-CB 3.27Å; A909-F913 VanDerWaalsContact O-CD2 3.3Å; A909-F913 WeakPolarHBondContact O-CD2 3.38Å; A909-F913 PolarHBondContact O-N 2.9Å; A909-T936 HydrophobicContact CB-CG2 3.86Å
910	K	87.7	Confident	86.7	Confident	114 Å²	114	49.6 Å²	49.6	50%	0.496	28%	0.284	S	S	.	.	I	π-helix	trans	-61.8	-49.4	176.1	-170.5	-178.9	175.3	-178.1	0	111	N906 E907 V908 H914 E915	N906-K910 WeakPolarHBondContact O-CB 3.35Å; N906-K910 PolarHBondContact O-N 2.99Å; E907-K910 WeakPolarHBondContact O-CB 3.33Å; E907-K910 PolarHBondContact O-N 2.92Å; E907-K910 VanDerWaalsContact O-N 3.15Å; V908-K910 VanDerWaalsContact C-N 3.34Å; V908-K910 PolarHBondContact O-N 3.46Å; K910-H914 HydrophobicContact CG-CB 4.44Å; K910-H914 WeakPolarHBondContact O-CA 3.42Å; K910-H914 VanDerWaalsContact O-CB 3.29Å; K910-H914 WeakPolarHBondContact O-CB 3.32Å; K910-H914 PolarHBondContact O-N 2.96Å; K910-E915 PolarHBondContact O-N 2.89Å; K910-E915 VanDerWaalsContact O-N 3.08Å
911	V	90.1	Very high	85.6	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	30%	0.301	C	S	.	.	I	π-helix	trans	-61.8	-48.5	178.9	174.7	0	0	0	0	111.3	A896 F900 E907 V908 L916 L950	A896-V911 HydrophobicContact CB-CG1 3.68Å; F900-V911 HydrophobicContact CB-CG2 4.01Å; F900-V911 HydrophobicContact CD1-CG2 4.15Å; F900-V911 HydrophobicContact CD2-CG2 3.98Å; F900-V911 HydrophobicContact CE2-CG2 4.5Å; F900-V911 HydrophobicContact CG-CG2 3.79Å; E907-V911 WeakPolarHBondContact O-CG2 3.34Å; E907-V911 PolarHBondContact O-N 2.75Å; V908-V911 PolarHBondContact O-N 3.09Å; V911-L916 HydrophobicContact CG1-CD1 4.15Å; V911-L916 HydrophobicContact CG1-CG 4.47Å; V911-L916 WeakPolarHBondContact O-CB 3.41Å; V911-L916 WeakPolarHBondContact O-CG 3.35Å; V911-L916 PolarHBondContact O-N 2.78Å; V911-L950 HydrophobicContact CG1-CD2 3.75Å
912	L	89.6	Confident	84.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.315	C	S	.	.	I	π-helix	trans	-68.9	-46.9	-175.2	-67.8	175.8	0	0	0	113.1	V908 L916 G917 L918 L941 L950 P951	V908-L912 HydrophobicContact CG1-CD1 3.7Å; V908-L912 HydrophobicContact CG1-CG 4.27Å; V908-L912 WeakPolarHBondContact O-CB 3.28Å; V908-L912 VanDerWaalsContact O-CG 3.26Å; V908-L912 WeakPolarHBondContact O-CG 3.19Å; V908-L912 PolarHBondContact O-N 3.17Å; L912-L916 HydrophobicContact CD2-CD1 4.42Å; L912-G917 PolarHBondContact O-N 3.11Å; L912-L918 HydrophobicContact CB-CD1 4.15Å; L912-L918 HydrophobicContact CD2-CD1 3.66Å; L912-L918 HydrophobicContact CG-CD1 4.48Å; L912-L918 VanDerWaalsContact O-CB 3.28Å; L912-L918 WeakPolarHBondContact O-CB 3.28Å; L912-L918 VanDerWaalsContact O-CG 3.3Å; L912-L918 WeakPolarHBondContact O-CG 3.44Å; L912-L918 PolarHBondContact O-N 3.48Å; L912-L941 HydrophobicContact CD1-CD2 3.59Å; L912-L950 HydrophobicContact CD2-CB 4.45Å; L912-L950 HydrophobicContact CD2-CD2 3.93Å; L912-L950 HydrophobicContact CD2-CG 4.24Å; L912-P951 HydrophobicContact CD2-CG 3.95Å
913	F	88.5	Confident	82.8	Confident	20 Å²	20	57.6 Å²	57.6	9%	0.088	34%	0.342	C	S	.	.	I	π-helix	trans	-99.2	-32	-169.1	-59.8	-65.8	0	0	0	113.9	A909 A920 Y934 T936 V940 L944	A909-F913 HydrophobicContact CB-CD2 4.2Å; A909-F913 WeakPolarHBondContact O-CB 3.27Å; A909-F913 VanDerWaalsContact O-CD2 3.3Å; A909-F913 WeakPolarHBondContact O-CD2 3.38Å; A909-F913 PolarHBondContact O-N 2.9Å; F913-A920 HydrophobicContact CD1-CB 3.57Å; F913-A920 HydrophobicContact CE1-CB 3.77Å; F913-A920 HydrophobicContact CG-CB 4.34Å; F913-Y934 HydrophobicContact CB-CD2 3.96Å; F913-Y934 HydrophobicContact CB-CE2 4.18Å; F913-Y934 HydrophobicContact CB-CG 4.36Å; F913-Y934 HydrophobicContact CD2-CD1 4.37Å; F913-Y934 AromaticContact CD2-CD2 3.9Å; F913-Y934 HydrophobicContact CD2-CD2 3.9Å; F913-Y934 AromaticContact CD2-CG 3.62Å; F913-Y934 HydrophobicContact CD2-CG 3.62Å; F913-Y934 AromaticContact CE2-CG 4Å; F913-Y934 HydrophobicContact CE2-CG 4Å; F913-Y934 HydrophobicContact CG-CD1 4.44Å; F913-Y934 HydrophobicContact CG-CD2 4.06Å; F913-Y934 AromaticContact CG-CG 3.96Å; F913-Y934 HydrophobicContact CG-CG 3.96Å; F913-T936 HydrophobicContact CE2-CG2 4.48Å; F913-V940 HydrophobicContact CZ-CG1 4.34Å; F913-L944 HydrophobicContact CE1-CD1 3.86Å; F913-L944 HydrophobicContact CZ-CD1 3.8Å
914	H	85.1	Confident	81.7	Confident	120 Å²	120	54.5 Å²	54.5	56%	0.556	32%	0.32	S	S	*	.	I	π-helix	trans	-96.8	-41.7	-177.6	-60.1	74.5	0	0	0	112	K910 Y934	K910-H914 HydrophobicContact CG-CB 4.44Å; K910-H914 WeakPolarHBondContact O-CA 3.42Å; K910-H914 VanDerWaalsContact O-CB 3.29Å; K910-H914 WeakPolarHBondContact O-CB 3.32Å; K910-H914 PolarHBondContact O-N 2.96Å; H914-Y934 AromaticContact CE1-CD2 3.96Å; H914-Y934 AromaticContact CE1-CE2 3.82Å
915	E	87	Confident	80.6	Confident	78 Å²	78	55.4 Å²	55.4	36%	0.364	32%	0.322	S	S	.	.	I	π-helix	trans	-88.6	-47.4	-175	-61.2	171.8	-161.5	0	0	111.9	R898 K910	R898-E915 IonicContact CZ-OE1 3.47Å; R898-E915 IonicContact CZ-OE2 3.44Å; R898-E915 IonicContact NE-OE1 3.36Å; R898-E915 PolarHBondContact NE-OE1 3.39Å; R898-E915 IonicContact NE-OE2 2.81Å; R898-E915 PolarHBondContact NE-OE2 3.33Å; R898-E915 IonicContact NH2-OE1 3.24Å; R898-E915 PolarHBondContact NH2-OE1 3Å; R898-E915 IonicContact NH2-OE2 3.15Å; R898-E915 PolarHBondContact NH2-OE2 2.99Å; K910-E915 PolarHBondContact O-N 2.89Å; K910-E915 VanDerWaalsContact O-N 3.08Å
916	L	88.3	Confident	79.4	Confident	59 Å²	59	57.7 Å²	57.7	31%	0.309	33%	0.33	S	S	.	.	S	Bend	trans	-85.8	-12.7	176.2	-67.5	173.4	0	0	0	113.8	V911 L912 L918 L950	V911-L916 HydrophobicContact CG1-CD1 4.15Å; V911-L916 HydrophobicContact CG1-CG 4.47Å; V911-L916 WeakPolarHBondContact O-CB 3.41Å; V911-L916 WeakPolarHBondContact O-CG 3.35Å; V911-L916 PolarHBondContact O-N 2.78Å; L912-L916 HydrophobicContact CD2-CD1 4.42Å; L916-L918 VanDerWaalsContact C-N 3.31Å; L916-L918 HydrophobicContact CB-CG 4.14Å; L916-L918 PolarHBondContact O-N 3.49Å; L916-L950 HydrophobicContact CD1-CD2 3.69Å
917	G	83.4	Confident	78.1	Confident	56 Å²	56	54.8 Å²	54.8	58%	0.577	32%	0.318	S	S	*	.			trans	64.1	27.6	177.3	0	0	0	0	0	115.2	L912	L912-G917 PolarHBondContact O-N 3.11Å
918	L	86	Confident	76.4	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.084	34%	0.344	C	S	.	.			trans	-64.3	148.1	-179.1	-61.7	178	0	0	0	111.8	L912 L916 A920 L944 V947 H948 P951	L912-L918 HydrophobicContact CB-CD1 4.15Å; L912-L918 HydrophobicContact CD2-CD1 3.66Å; L912-L918 HydrophobicContact CG-CD1 4.48Å; L912-L918 VanDerWaalsContact O-CB 3.28Å; L912-L918 WeakPolarHBondContact O-CB 3.28Å; L912-L918 VanDerWaalsContact O-CG 3.3Å; L912-L918 WeakPolarHBondContact O-CG 3.44Å; L912-L918 PolarHBondContact O-N 3.48Å; L916-L918 VanDerWaalsContact C-N 3.31Å; L916-L918 HydrophobicContact CB-CG 4.14Å; L916-L918 PolarHBondContact O-N 3.49Å; L918-A920 PolarHBondContact O-N 3.4Å; L918-L944 HydrophobicContact CB-CD2 4.34Å; L918-V947 HydrophobicContact CD2-CG1 3.86Å; L918-H948 HydrophobicContact CD1-CB 3.94Å; L918-H948 HydrophobicContact CD2-CB 3.8Å; L918-P951 HydrophobicContact CD1-CG 4.41Å
919	P	79.2	Confident	74.8	Confident	76 Å²	76	64.4 Å²	64.4	49%	0.494	36%	0.364	S	S	.	.			trans	-60.5	126.3	-176.3	22.9	-32.8	0	0	0	111.8	L944 V947	P919-L944 HydrophobicContact CG-CD2 4.43Å; P919-V947 HydrophobicContact CG-CG2 4.4Å
920	A	69	Low	73.2	Confident	39 Å²	39	72.9 Å²	72.9	32%	0.322	41%	0.408	S	S	.	.			trans	-116.8	103.8	178.5	0	0	0	0	0	110.7	F913 L918 Y934	F913-A920 HydrophobicContact CD1-CB 3.57Å; F913-A920 HydrophobicContact CE1-CB 3.77Å; F913-A920 HydrophobicContact CG-CB 4.34Å; L918-A920 PolarHBondContact O-N 3.4Å; A920-Y934 HydrophobicContact CB-CD1 3.69Å; A920-Y934 HydrophobicContact CB-CE1 3.31Å
921	D	67.5	Low	71.8	Confident	92 Å²	92	70.5 Å²	70.5	49%	0.492	41%	0.41	S	S	.	.			trans	-68	156.4	174.3	-73.1	-21.4	0	0	0	111.4	S923 H924	D921-S923 PolarHBondContact O-N 2.94Å; D921-H924 WeakPolarHBondContact O-CB 3.3Å; D921-H924 PolarHBondContact O-N 3.43Å
922	S	59.1	Low	70.5	Confident	96 Å²	96	76.8 Å²	76.8	67%	0.671	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-53	-24.6	171	-56.1	0	0	0	0	113.3	H924	S922-H924 VanDerWaalsContact C-N 3.28Å; S922-H924 PolarHBondContact O-N 3.42Å
923	S	59.8	Low	69.7	Low	87 Å²	87	83.8 Å²	83.8	61%	0.608	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-72.5	-17.3	176.2	68.6	0	0	0	0	114	D921	D921-S923 PolarHBondContact O-N 2.94Å
924	H	64.2	Low	69.3	Low	7 Å²	7	84.8 Å²	84.8	3%	0.032	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-88.6	-9	-179	-57.3	173.1	0	0	0	112.2	D921 S922 L926 Y934 S935 V940	D921-H924 WeakPolarHBondContact O-CB 3.3Å; D921-H924 PolarHBondContact O-N 3.43Å; S922-H924 VanDerWaalsContact C-N 3.28Å; S922-H924 PolarHBondContact O-N 3.42Å; H924-L926 PolarHBondContact O-N 3.01Å; H924-Y934 HydrophobicContact CB-CD1 4.37Å; H924-Y934 CarbonylContact O-C 2.92Å; H924-Y934 WeakPolarHBondContact O-CA 3.31Å; H924-S935 WeakPolarHBondContact O-CB 3.28Å; H924-S935 PolarHBondContact O-N 2.91Å; H924-V940 HydrophobicContact CB-CG1 4.46Å
925	L	65.7	Low	69.2	Low	50 Å²	50	80 Å²	80	26%	0.262	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	120.4	-177.3	-76	161.8	0	0	0	111.7	K932 R933 Y934	L925-K932 HydrophobicContact CD2-CB 3.82Å; L925-K932 HydrophobicContact CD2-CD 4.48Å; L925-K932 HydrophobicContact CD2-CG 4.08Å; L925-R933 WeakPolarHBondContact CA-O 3.49Å; L925-Y934 HydrophobicContact CD2-CD1 3.89Å; L925-Y934 HydrophobicContact CD2-CE1 3.58Å; L925-Y934 HydrophobicContact CG-CD1 4.25Å; L925-Y934 HydrophobicContact CG-CE1 4Å
926	L	61.3	Low	69.1	Low	121 Å²	121	76.8 Å²	76.8	63%	0.634	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	-26.4	174.3	-66.3	171.2	0	0	0	112.5	H924 R933	H924-L926 PolarHBondContact O-N 3.01Å; L926-R933 HydrophobicContact CB-CB 4.35Å; L926-R933 PolarHBondContact N-O 3.39Å
927	S	59	Low	68.9	Low	43 Å²	43	76.3 Å²	76.3	30%	0.301	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	132	-178.2	155.1	0	0	0	0	109.1	G929	S927-G929 PolarHBondContact OG-N 3.49Å
928	R	55.6	Low	69	Low	230 Å²	230	79.5 Å²	79.5	87%	0.868	43%	0.433	S	S	*	.			trans	-92.7	1.8	172.7	-72.7	-170.8	170.4	-173	-2.5	113.6
929	G	57.9	Low	68.9	Low	42 Å²	42	82.6 Å²	82.6	43%	0.433	45%	0.453	S	S	.	.	S	Bend	trans	-71.4	178.4	174.8	0	0	0	0	0	113	S927 A931	S927-G929 PolarHBondContact OG-N 3.49Å; G929-A931 CarbonylContact O-C 3.46Å; G929-A931 PolarHBondContact O-N 3.29Å
930	D	54.3	Low	69.2	Low	183 Å²	183	79.6 Å²	79.6	98%	0.979	43%	0.434	S	S	*	.	S	Bend	trans	-52.1	-32	-173.5	-67.3	-33.7	0	0	0	114.1	K932	D930-K932 PolarHBondContact O-N 3Å
931	A	56.7	Low	70.1	Confident	64 Å²	64	77.7 Å²	77.7	53%	0.529	42%	0.418	S	S	.	.	S	Bend	trans	-92.2	96.2	170	0	0	0	0	0	110.9	G929 R933	G929-A931 CarbonylContact O-C 3.46Å; G929-A931 PolarHBondContact O-N 3.29Å; A931-R933 PolarHBondContact O-N 3.46Å
932	K	63.7	Low	71	Confident	133 Å²	133	78.1 Å²	78.1	58%	0.578	42%	0.417	S	S	*	.			trans	-59.3	108	171.5	-71.2	-178.1	-177.2	175.7	0	109.9	L925 D930 Y934	L925-K932 HydrophobicContact CD2-CB 3.82Å; L925-K932 HydrophobicContact CD2-CD 4.48Å; L925-K932 HydrophobicContact CD2-CG 4.08Å; D930-K932 PolarHBondContact O-N 3Å; K932-Y934 HydrophobicContact CB-CE2 4.22Å
933	R	72.4	Confident	72.2	Confident	147 Å²	147	79.8 Å²	79.8	56%	0.555	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.8	173.9	-70.5	-175.4	-178.6	170.7	1.2	109.8	L925 L926 A931	L925-R933 WeakPolarHBondContact CA-O 3.49Å; L926-R933 HydrophobicContact CB-CB 4.35Å; L926-R933 PolarHBondContact N-O 3.39Å; A931-R933 PolarHBondContact O-N 3.46Å
934	Y	80.8	Confident	73.5	Confident	42 Å²	42	75.9 Å²	75.9	17%	0.165	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.1	180	-61	-81.9	0	0	0	111.6	F913 H914 A920 H924 L925 K932	F913-Y934 HydrophobicContact CB-CD2 3.96Å; F913-Y934 HydrophobicContact CB-CE2 4.18Å; F913-Y934 HydrophobicContact CB-CG 4.36Å; F913-Y934 HydrophobicContact CD2-CD1 4.37Å; F913-Y934 AromaticContact CD2-CD2 3.9Å; F913-Y934 HydrophobicContact CD2-CD2 3.9Å; F913-Y934 AromaticContact CD2-CG 3.62Å; F913-Y934 HydrophobicContact CD2-CG 3.62Å; F913-Y934 AromaticContact CE2-CG 4Å; F913-Y934 HydrophobicContact CE2-CG 4Å; F913-Y934 HydrophobicContact CG-CD1 4.44Å; F913-Y934 HydrophobicContact CG-CD2 4.06Å; F913-Y934 AromaticContact CG-CG 3.96Å; F913-Y934 HydrophobicContact CG-CG 3.96Å; H914-Y934 AromaticContact CE1-CD2 3.96Å; H914-Y934 AromaticContact CE1-CE2 3.82Å; A920-Y934 HydrophobicContact CB-CD1 3.69Å; A920-Y934 HydrophobicContact CB-CE1 3.31Å; H924-Y934 HydrophobicContact CB-CD1 4.37Å; H924-Y934 CarbonylContact O-C 2.92Å; H924-Y934 WeakPolarHBondContact O-CA 3.31Å; L925-Y934 HydrophobicContact CD2-CD1 3.89Å; L925-Y934 HydrophobicContact CD2-CE1 3.58Å; L925-Y934 HydrophobicContact CG-CD1 4.25Å; L925-Y934 HydrophobicContact CG-CE1 4Å; K932-Y934 HydrophobicContact CB-CE2 4.22Å
935	S	82	Confident	74.7	Confident	19 Å²	19	77.6 Å²	77.6	13%	0.133	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-73.5	137	173.4	-176.7	0	0	0	0	109.9	H924 S937 V940	H924-S935 WeakPolarHBondContact O-CB 3.28Å; H924-S935 PolarHBondContact O-N 2.91Å; S935-S937 WeakPolarHBondContact OG-CB 3.31Å; S935-S937 PolarHBondContact OG-N 2.96Å; S935-S937 PolarHBondContact OG-OG 2.82Å; S935-V940 WeakPolarHBondContact O-CG1 3.49Å
936	T	85.6	Confident	75.6	Confident	10 Å²	10	80.4 Å²	80.4	6%	0.061	42%	0.421	C	S	.	.			trans	-115.8	34.4	168.7	58.7	0	0	0	0	110	V908 A909 F913 L941 R958	V908-T936 HydrophobicContact CB-CG2 4.24Å; V908-T936 HydrophobicContact CG1-CG2 3.86Å; A909-T936 HydrophobicContact CB-CG2 3.86Å; F913-T936 HydrophobicContact CE2-CG2 4.48Å; T936-L941 WeakPolarHBondContact O-CD1 3.29Å; T936-R958 PolarHBondContact O-NH1 3.32Å; T936-R958 PolarHBondContact OG1-NH2 3.48Å
937	S	84	Confident	76.9	Confident	50 Å²	50	78.5 Å²	78.5	35%	0.35	41%	0.414	S	S	.	.			trans	-63.7	159.5	176.7	69	0	0	0	0	111.2	S935 V940 L941	S935-S937 WeakPolarHBondContact OG-CB 3.31Å; S935-S937 PolarHBondContact OG-N 2.96Å; S935-S937 PolarHBondContact OG-OG 2.82Å; S937-V940 PolarHBondContact O-N 2.78Å; S937-V940 VanDerWaalsContact O-N 3.08Å; S937-V940 WeakPolarHBondContact OG-CG2 3.22Å; S937-L941 PolarHBondContact O-N 2.86Å
938	K	85.1	Confident	78.5	Confident	123 Å²	123	78.3 Å²	78.3	54%	0.535	41%	0.408	S	S	.	.	H	α-helix	trans	-51.8	-46.9	-178.2	174.8	177.7	173.7	-172.3	0	113.6	V940 L941 E942 L955	K938-V940 VanDerWaalsContact C-N 3.33Å; K938-V940 PolarHBondContact O-N 2.87Å; K938-L941 PolarHBondContact O-N 3.43Å; K938-E942 WeakPolarHBondContact CE-OE1 3.35Å; K938-E942 HydrophobicContact CG-CG 4.3Å; K938-E942 IonicContact NZ-OE1 2.74Å; K938-E942 WeakPolarHBondContact O-CB 3.47Å; K938-E942 WeakPolarHBondContact O-CG 3.46Å; K938-E942 PolarHBondContact O-N 2.97Å; K938-L955 HydrophobicContact CB-CD2 4.17Å; K938-L955 HydrophobicContact CG-CD2 3.92Å
939	P	83.5	Confident	80.2	Confident	80 Å²	80	70.7 Å²	70.7	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-62	-36	177.9	-23.2	33.6	0	0	0	114	K943	P939-K943 PolarHBondContact O-N 3.36Å
940	V	85.2	Confident	81.9	Confident	13 Å²	13	68.7 Å²	68.7	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-68.5	-46.1	178.3	175.9	0	0	0	0	110.2	F913 H924 S935 S937 K938 E942 K943 L944	F913-V940 HydrophobicContact CZ-CG1 4.34Å; H924-V940 HydrophobicContact CB-CG1 4.46Å; S935-V940 WeakPolarHBondContact O-CG1 3.49Å; S937-V940 PolarHBondContact O-N 2.78Å; S937-V940 VanDerWaalsContact O-N 3.08Å; S937-V940 WeakPolarHBondContact OG-CG2 3.22Å; K938-V940 VanDerWaalsContact C-N 3.33Å; K938-V940 PolarHBondContact O-N 2.87Å; V940-E942 VanDerWaalsContact C-N 3.35Å; V940-E942 PolarHBondContact O-N 3.44Å; V940-K943 PolarHBondContact O-N 2.86Å; V940-L944 HydrophobicContact CG1-CD1 4.15Å; V940-L944 WeakPolarHBondContact O-CG 3.31Å; V940-L944 PolarHBondContact O-N 3.1Å; V940-L944 VanDerWaalsContact O-N 3.13Å
941	L	88.5	Confident	83.7	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-38	178	-66.2	177.8	0	0	0	112.1	L912 T936 S937 K938 K943 L944 C945 P951 V954 L955	L912-L941 HydrophobicContact CD1-CD2 3.59Å; T936-L941 WeakPolarHBondContact O-CD1 3.29Å; S937-L941 PolarHBondContact O-N 2.86Å; K938-L941 PolarHBondContact O-N 3.43Å; L941-K943 VanDerWaalsContact C-N 3.33Å; L941-K943 PolarHBondContact O-N 3.24Å; L941-L944 PolarHBondContact O-N 3.45Å; L941-C945 PolarHBondContact O-N 2.85Å; L941-C945 PolarHBondContact O-SG 3.18Å; L941-P951 HydrophobicContact CB-CB 4.47Å; L941-P951 HydrophobicContact CD2-CB 4.3Å; L941-V954 HydrophobicContact CD1-CB 4.44Å; L941-V954 HydrophobicContact CD1-CG1 3.77Å; L941-L955 HydrophobicContact CB-CD1 3.92Å; L941-L955 HydrophobicContact CB-CD2 3.91Å; L941-L955 HydrophobicContact CB-CG 3.81Å; L941-L955 HydrophobicContact CD1-CD2 3.88Å; L941-L955 HydrophobicContact CD1-CG 4.09Å
942	E	87.2	Confident	85.5	Confident	101 Å²	101	64.5 Å²	64.5	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-39.5	176.2	-77.3	173.8	163.9	0	0	111.9	K938 V940 C945 L955	K938-E942 WeakPolarHBondContact CE-OE1 3.35Å; K938-E942 HydrophobicContact CG-CG 4.3Å; K938-E942 IonicContact NZ-OE1 2.74Å; K938-E942 WeakPolarHBondContact O-CB 3.47Å; K938-E942 WeakPolarHBondContact O-CG 3.46Å; K938-E942 PolarHBondContact O-N 2.97Å; V940-E942 VanDerWaalsContact C-N 3.35Å; V940-E942 PolarHBondContact O-N 3.44Å; E942-C945 WeakPolarHBondContact O-CB 3.1Å; E942-C945 PolarHBondContact O-N 3.26Å; E942-L955 HydrophobicContact CG-CD1 3.72Å
943	K	83.8	Confident	86.9	Confident	131 Å²	131	59 Å²	59	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-65.5	-39.2	172.9	-73.4	-177.6	178.8	-174.2	0	112.7	P939 V940 L941 C945 S946	P939-K943 PolarHBondContact O-N 3.36Å; V940-K943 PolarHBondContact O-N 2.86Å; L941-K943 VanDerWaalsContact C-N 3.33Å; L941-K943 PolarHBondContact O-N 3.24Å; K943-C945 VanDerWaalsContact C-N 3.26Å; K943-C945 PolarHBondContact O-N 3.18Å; K943-S946 PolarHBondContact O-OG 3.18Å
944	L	87.2	Confident	87.9	Confident	4 Å²	4	52 Å²	52	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-74.6	-14.8	-179.9	-67.8	173.1	0	0	0	113.4	F913 L918 P919 V940 L941 S946 V947 H948 P951	F913-L944 HydrophobicContact CE1-CD1 3.86Å; F913-L944 HydrophobicContact CZ-CD1 3.8Å; L918-L944 HydrophobicContact CB-CD2 4.34Å; P919-L944 HydrophobicContact CG-CD2 4.43Å; V940-L944 HydrophobicContact CG1-CD1 4.15Å; V940-L944 WeakPolarHBondContact O-CG 3.31Å; V940-L944 PolarHBondContact O-N 3.1Å; V940-L944 VanDerWaalsContact O-N 3.13Å; L941-L944 PolarHBondContact O-N 3.45Å; L944-S946 PolarHBondContact O-N 2.76Å; L944-V947 PolarHBondContact O-N 3.29Å; L944-H948 PolarHBondContact O-N 2.81Å; L944-H948 VanDerWaalsContact O-N 3.08Å; L944-P951 HydrophobicContact CB-CB 4.06Å; L944-P951 HydrophobicContact CB-CG 3.67Å
945	C	89.5	Confident	88.4	Confident	43 Å²	43	51.6 Å²	51.6	29%	0.291	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.6	177.9	-72.2	0	0	0	0	113.4	L941 E942 K943 V947	L941-C945 PolarHBondContact O-N 2.85Å; L941-C945 PolarHBondContact O-SG 3.18Å; E942-C945 WeakPolarHBondContact O-CB 3.1Å; E942-C945 PolarHBondContact O-N 3.26Å; K943-C945 VanDerWaalsContact C-N 3.26Å; K943-C945 PolarHBondContact O-N 3.18Å; C945-V947 VanDerWaalsContact C-N 3.35Å
946	S	85.2	Confident	88.9	Confident	109 Å²	109	53.2 Å²	53.2	76%	0.762	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.6	175.9	57.1	0	0	0	0	113.1	K943 L944	K943-S946 PolarHBondContact O-OG 3.18Å; L944-S946 PolarHBondContact O-N 2.76Å
947	V	88.4	Confident	89.4	Confident	82 Å²	82	53.7 Å²	53.7	50%	0.497	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-38.4	-177.1	-172.6	0	0	0	0	111	L918 P919 L944 C945	L918-V947 HydrophobicContact CD2-CG1 3.86Å; P919-V947 HydrophobicContact CG-CG2 4.4Å; L944-V947 PolarHBondContact O-N 3.29Å; C945-V947 VanDerWaalsContact C-N 3.35Å
948	H	91.6	Very high	89.8	Confident	38 Å²	38	54.3 Å²	54.3	18%	0.176	28%	0.277	C	S	.	.			trans	-145.9	144.8	-176.4	-163.6	-91.5	0	0	0	111.8	L918 L944 L950 P951	L918-H948 HydrophobicContact CD1-CB 3.94Å; L918-H948 HydrophobicContact CD2-CB 3.8Å; L944-H948 PolarHBondContact O-N 2.81Å; L944-H948 VanDerWaalsContact O-N 3.08Å; H948-L950 VanDerWaalsContact CE1-CB 3.46Å; H948-L950 WeakPolarHBondContact CE1-CB 3.39Å; H948-L950 WeakPolarHBondContact ND1-CB 3.25Å; H948-L950 PolarHBondContact ND1-N 3.45Å; H948-P951 VanDerWaalsContact O-CD 3.29Å; H948-P951 WeakPolarHBondContact O-CD 3.44Å
949	P	91.5	Very high	90	Very high	70 Å²	70	52.3 Å²	52.3	46%	0.455	27%	0.269	S	S	.	.	S	Bend	trans	-70	-29.7	178.5	24.5	-33.7	0	0	0	114	L895 R952 N953	L895-P949 HydrophobicContact CD1-CB 4.13Å; L895-P949 HydrophobicContact CD1-CG 3.97Å; L895-P949 HydrophobicContact CD2-CG 3.91Å; P949-R952 VanDerWaalsContact O-CB 3.29Å; P949-R952 WeakPolarHBondContact O-CB 3.38Å; P949-R952 PolarHBondContact O-N 3.47Å; P949-N953 PolarHBondContact O-N 3.2Å
950	L	93	Very high	90.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-54.4	-46.3	-177.2	-175.9	65.7	0	0	0	114.4	L895 A896 F900 V911 L912 L916 H948 R952 N953 V954	L895-L950 HydrophobicContact CB-CB 4.42Å; L895-L950 HydrophobicContact CB-CD1 4.24Å; L895-L950 HydrophobicContact CD1-CB 4.4Å; A896-L950 HydrophobicContact CB-CD2 4.19Å; F900-L950 HydrophobicContact CE1-CD1 4.33Å; F900-L950 HydrophobicContact CZ-CD1 4.11Å; F900-L950 HydrophobicContact CZ-CD2 4.32Å; V911-L950 HydrophobicContact CG1-CD2 3.75Å; L912-L950 HydrophobicContact CD2-CB 4.45Å; L912-L950 HydrophobicContact CD2-CD2 3.93Å; L912-L950 HydrophobicContact CD2-CG 4.24Å; L916-L950 HydrophobicContact CD1-CD2 3.69Å; H948-L950 VanDerWaalsContact CE1-CB 3.46Å; H948-L950 WeakPolarHBondContact CE1-CB 3.39Å; H948-L950 WeakPolarHBondContact ND1-CB 3.25Å; H948-L950 PolarHBondContact ND1-N 3.45Å; L950-R952 PolarHBondContact O-N 3.4Å; L950-N953 WeakPolarHBondContact O-CB 3.46Å; L950-N953 PolarHBondContact O-N 3.4Å; L950-V954 HydrophobicContact CG-CG2 4.39Å; L950-V954 WeakPolarHBondContact O-CG2 3.28Å; L950-V954 PolarHBondContact O-N 3.16Å
951	P	92.6	Very high	90.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-48.8	-38.4	171.4	-30.4	30.8	0	0	0	114.9	L912 L918 L941 L944 H948 V954 L955	L912-P951 HydrophobicContact CD2-CG 3.95Å; L918-P951 HydrophobicContact CD1-CG 4.41Å; L941-P951 HydrophobicContact CB-CB 4.47Å; L941-P951 HydrophobicContact CD2-CB 4.3Å; L944-P951 HydrophobicContact CB-CB 4.06Å; L944-P951 HydrophobicContact CB-CG 3.67Å; H948-P951 VanDerWaalsContact O-CD 3.29Å; H948-P951 WeakPolarHBondContact O-CD 3.44Å; P951-V954 PolarHBondContact O-N 3.4Å; P951-L955 WeakPolarHBondContact O-CG 3.48Å; P951-L955 PolarHBondContact O-N 3.44Å
952	R	93.9	Very high	90.8	Very high	159 Å²	159	55.9 Å²	55.9	60%	0.6	28%	0.281	S	S	*	.	H	α-helix	trans	-67.9	-42	178	-175.3	179.5	179.7	161.2	-0.6	111.3	P949 L950 V954 L955 Q956	P949-R952 VanDerWaalsContact O-CB 3.29Å; P949-R952 WeakPolarHBondContact O-CB 3.38Å; P949-R952 PolarHBondContact O-N 3.47Å; L950-R952 PolarHBondContact O-N 3.4Å; R952-V954 VanDerWaalsContact C-N 3.34Å; R952-L955 PolarHBondContact O-N 2.88Å; R952-Q956 WeakPolarHBondContact O-CG 3.12Å; R952-Q956 PolarHBondContact O-N 2.89Å
953	N	94	Very high	90.9	Very high	16 Å²	16	51.1 Å²	51.1	9%	0.086	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-41.2	174.9	-72.2	3.2	0	0	0	111.2	L888 D891 S892 P949 L950 L955 Q956 W957	L888-N953 HydrophobicContact CD2-CB 4.06Å; D891-N953 PolarHBondContact OD2-ND2 2.95Å; S892-N953 WeakPolarHBondContact OG-CB 3.34Å; P949-N953 PolarHBondContact O-N 3.2Å; L950-N953 WeakPolarHBondContact O-CB 3.46Å; L950-N953 PolarHBondContact O-N 3.4Å; N953-L955 VanDerWaalsContact C-N 3.35Å; N953-L955 PolarHBondContact O-N 3.03Å; N953-Q956 PolarHBondContact O-N 2.68Å; N953-W957 VanDerWaalsContact O-CB 3.24Å; N953-W957 WeakPolarHBondContact O-CB 3.46Å; N953-W957 PolarHBondContact O-N 3.48Å
954	V	93	Very high	91.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-44.5	175.2	175.5	0	0	0	0	111.6	M902 V908 L941 L950 P951 R952 R958	M902-V954 VanDerWaalsContact CE-CA 3.47Å; M902-V954 HydrophobicContact CE-CB 4.11Å; M902-V954 HydrophobicContact CE-CG2 3.69Å; V908-V954 HydrophobicContact CG1-CG1 4.04Å; V908-V954 HydrophobicContact CG1-CG2 4.23Å; L941-V954 HydrophobicContact CD1-CB 4.44Å; L941-V954 HydrophobicContact CD1-CG1 3.77Å; L950-V954 HydrophobicContact CG-CG2 4.39Å; L950-V954 WeakPolarHBondContact O-CG2 3.28Å; L950-V954 PolarHBondContact O-N 3.16Å; P951-V954 PolarHBondContact O-N 3.4Å; R952-V954 VanDerWaalsContact C-N 3.34Å; V954-R958 HydrophobicContact CG1-CG 4.47Å; V954-R958 WeakPolarHBondContact O-CB 3.45Å; V954-R958 VanDerWaalsContact O-CG 3.3Å; V954-R958 WeakPolarHBondContact O-CG 3.42Å; V954-R958 PolarHBondContact O-N 3.06Å
955	L	92.2	Very high	91.3	Very high	35 Å²	35	48 Å²	48	18%	0.183	25%	0.253	C	S	.	.	H	α-helix	trans	-62.7	-45.4	176.9	-76.2	172.3	0	0	0	112.4	K938 L941 E942 P951 R952 N953 Q959	K938-L955 HydrophobicContact CB-CD2 4.17Å; K938-L955 HydrophobicContact CG-CD2 3.92Å; L941-L955 HydrophobicContact CB-CD1 3.92Å; L941-L955 HydrophobicContact CB-CD2 3.91Å; L941-L955 HydrophobicContact CB-CG 3.81Å; L941-L955 HydrophobicContact CD1-CD2 3.88Å; L941-L955 HydrophobicContact CD1-CG 4.09Å; E942-L955 HydrophobicContact CG-CD1 3.72Å; P951-L955 WeakPolarHBondContact O-CG 3.48Å; P951-L955 PolarHBondContact O-N 3.44Å; R952-L955 PolarHBondContact O-N 2.88Å; N953-L955 VanDerWaalsContact C-N 3.35Å; N953-L955 PolarHBondContact O-N 3.03Å; L955-Q959 WeakPolarHBondContact O-CB 3.29Å; L955-Q959 PolarHBondContact O-N 2.88Å
956	Q	92.7	Very high	91.2	Very high	53 Å²	53	48.4 Å²	48.4	25%	0.248	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-46.8	178.1	-71.7	-178.8	39.2	0	0	111.3	L888 R952 N953 R958 Q959 L960	L888-Q956 HydrophobicContact CD1-CB 3.79Å; L888-Q956 HydrophobicContact CD2-CB 4.36Å; R952-Q956 WeakPolarHBondContact O-CG 3.12Å; R952-Q956 PolarHBondContact O-N 2.89Å; N953-Q956 PolarHBondContact O-N 2.68Å; Q956-R958 PolarHBondContact O-N 2.8Å; Q956-Q959 WeakPolarHBondContact O-CB 3.4Å; Q956-Q959 PolarHBondContact O-N 2.86Å; Q956-Q959 VanDerWaalsContact O-N 3.15Å; Q956-L960 WeakPolarHBondContact O-CG 3.42Å; Q956-L960 PolarHBondContact O-N 3.1Å
957	W	94.6	Very high	91.3	Very high	20 Å²	20	44.5 Å²	44.5	8%	0.076	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-46.5	178.9	-178.6	96.6	0	0	0	111	L888 E889 M902 N953 Q959 L960 S961	L888-W957 HydrophobicContact CB-CB 4.41Å; L888-W957 HydrophobicContact CD1-CB 4.23Å; E889-W957 VanDerWaalsContact CG-NE1 3.31Å; E889-W957 PolarHBondContact OE1-NE1 3.42Å; M902-W957 HydrophobicContact CB-CD2 3.7Å; M902-W957 HydrophobicContact CB-CE3 3.63Å; M902-W957 HydrophobicContact CB-CG 4.36Å; M902-W957 HydrophobicContact CB-CH2 4.14Å; M902-W957 HydrophobicContact CB-CZ2 4.14Å; M902-W957 HydrophobicContact CB-CZ3 3.87Å; M902-W957 HydrophobicContact CE-CB 3.53Å; M902-W957 HydrophobicContact CE-CD2 4.28Å; M902-W957 HydrophobicContact CE-CG 3.76Å; M902-W957 HydrophobicContact SD-CB 4.16Å; M902-W957 HydrophobicContact SD-CD2 4.09Å; M902-W957 HydrophobicContact SD-CG 3.74Å; N953-W957 VanDerWaalsContact O-CB 3.24Å; N953-W957 WeakPolarHBondContact O-CB 3.46Å; N953-W957 PolarHBondContact O-N 3.48Å; W957-Q959 VanDerWaalsContact C-N 3.32Å; W957-Q959 PolarHBondContact O-N 3.29Å; W957-L960 PolarHBondContact O-N 2.82Å; W957-S961 WeakPolarHBondContact O-CB 3.12Å; W957-S961 PolarHBondContact O-N 2.66Å
958	R	93.2	Very high	91.4	Very high	62 Å²	62	40.6 Å²	40.6	23%	0.234	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-39.2	177.1	-74.6	-179.9	179.1	175.3	-0.1	112.2	T936 V954 Q956 F962	T936-R958 PolarHBondContact O-NH1 3.32Å; T936-R958 PolarHBondContact OG1-NH2 3.48Å; V954-R958 HydrophobicContact CG1-CG 4.47Å; V954-R958 WeakPolarHBondContact O-CB 3.45Å; V954-R958 VanDerWaalsContact O-CG 3.3Å; V954-R958 WeakPolarHBondContact O-CG 3.42Å; V954-R958 PolarHBondContact O-N 3.06Å; Q956-R958 PolarHBondContact O-N 2.8Å; R958-F962 WeakPolarHBondContact O-CB 3.47Å; R958-F962 PolarHBondContact O-N 3.11Å
959	Q	90.5	Very high	91.3	Very high	82 Å²	82	42.8 Å²	42.8	38%	0.383	21%	0.209	S	C	.	.	H	α-helix	trans	-65.7	-47.6	177.9	-172.9	-175.7	-4.9	0	0	111.8	L955 Q956 W957 A963 I1010	L955-Q959 WeakPolarHBondContact O-CB 3.29Å; L955-Q959 PolarHBondContact O-N 2.88Å; Q956-Q959 WeakPolarHBondContact O-CB 3.4Å; Q956-Q959 PolarHBondContact O-N 2.86Å; Q956-Q959 VanDerWaalsContact O-N 3.15Å; W957-Q959 VanDerWaalsContact C-N 3.32Å; W957-Q959 PolarHBondContact O-N 3.29Å; Q959-A963 WeakPolarHBondContact O-CB 3.17Å; Q959-A963 PolarHBondContact O-N 3.34Å; Q959-I1010 HydrophobicContact CG-CD1 4.04Å
960	L	91.9	Very high	91	Very high	20 Å²	20	41.4 Å²	41.4	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-71.5	-42	-178.8	-60.3	-179.2	0	0	0	111.8	L881 R884 I885 L888 Q956 W957 A963 L964	L881-L960 HydrophobicContact CD2-CB 4.44Å; L881-L960 HydrophobicContact CD2-CD2 3.64Å; L881-L960 HydrophobicContact CD2-CG 4.46Å; R884-L960 HydrophobicContact CB-CD1 3.9Å; I885-L960 HydrophobicContact CD1-CB 4.11Å; I885-L960 HydrophobicContact CG1-CB 3.84Å; L888-L960 HydrophobicContact CD1-CD1 3.97Å; Q956-L960 WeakPolarHBondContact O-CG 3.42Å; Q956-L960 PolarHBondContact O-N 3.1Å; W957-L960 PolarHBondContact O-N 2.82Å; L960-A963 WeakPolarHBondContact O-CB 3.48Å; L960-A963 PolarHBondContact O-N 3.45Å; L960-L964 WeakPolarHBondContact O-CB 3.14Å; L960-L964 PolarHBondContact O-N 3.27Å
961	S	91.5	Very high	90.7	Very high	35 Å²	35	41.4 Å²	41.4	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-42.1	177.7	-177.4	0	0	0	0	111.8	W957 L964 S965	W957-S961 WeakPolarHBondContact O-CB 3.12Å; W957-S961 PolarHBondContact O-N 2.66Å; S961-L964 PolarHBondContact O-N 2.73Å; S961-S965 WeakPolarHBondContact O-CB 3.13Å; S961-S965 PolarHBondContact O-N 3.1Å; S961-S965 PolarHBondContact O-OG 3.26Å
962	F	89.9	Confident	90.3	Very high	113 Å²	113	44.2 Å²	44.2	50%	0.496	21%	0.214	S	C	.	.	H	α-helix	trans	-63.6	-42.9	172.2	-178.1	-104.8	0	0	0	111.9	R958 L964 S965 S966 Y967	R958-F962 WeakPolarHBondContact O-CB 3.47Å; R958-F962 PolarHBondContact O-N 3.11Å; F962-L964 VanDerWaalsContact C-N 3.34Å; F962-L964 PolarHBondContact O-N 3.41Å; F962-S965 PolarHBondContact O-N 3.42Å; F962-S965 PolarHBondContact O-OG 3.06Å; F962-S966 VanDerWaalsContact CD2-OG 3.29Å; F962-S966 WeakPolarHBondContact CD2-OG 3.34Å; F962-S966 WeakPolarHBondContact CE2-OG 3.26Å; F962-S966 VanDerWaalsContact O-CB 3.22Å; F962-S966 WeakPolarHBondContact O-CB 3.26Å; F962-S966 PolarHBondContact O-N 2.87Å; F962-S966 PolarHBondContact O-OG 3.03Å; F962-Y967 AromaticContact CD1-CE2 3.93Å; F962-Y967 HydrophobicContact CD1-CE2 3.93Å; F962-Y967 AromaticContact CE1-CE2 3.51Å; F962-Y967 HydrophobicContact CE1-CE2 3.51Å; F962-Y967 AromaticContact CE1-CZ 3.95Å; F962-Y967 HydrophobicContact CZ-CE2 4.25Å
963	A	89.6	Confident	89.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-44.3	177.9	0	0	0	0	0	112.4	Q959 L960 Y967 V968 I1010 L1012	Q959-A963 WeakPolarHBondContact O-CB 3.17Å; Q959-A963 PolarHBondContact O-N 3.34Å; L960-A963 WeakPolarHBondContact O-CB 3.48Å; L960-A963 PolarHBondContact O-N 3.45Å; A963-Y967 PolarHBondContact O-N 3.05Å; A963-V968 PolarHBondContact O-N 3.24Å; A963-V968 VanDerWaalsContact O-N 3.15Å; A963-I1010 HydrophobicContact CB-CD1 3.38Å; A963-L1012 HydrophobicContact CB-CD1 4.35Å
964	L	90.4	Very high	88.5	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.063	23%	0.227	C	C	.	.	I	π-helix	trans	-65.7	-50.4	179.5	-171.3	69	0	0	0	111.4	L881 K882 I885 L960 S961 F962 V968 Y969	L881-L964 HydrophobicContact CB-CD1 4.18Å; L881-L964 HydrophobicContact CD1-CD1 4.4Å; K882-L964 HydrophobicContact CG-CD2 3.89Å; I885-L964 HydrophobicContact CD1-CB 4.43Å; I885-L964 HydrophobicContact CD1-CD2 3.89Å; L960-L964 WeakPolarHBondContact O-CB 3.14Å; L960-L964 PolarHBondContact O-N 3.27Å; S961-L964 PolarHBondContact O-N 2.73Å; F962-L964 VanDerWaalsContact C-N 3.34Å; F962-L964 PolarHBondContact O-N 3.41Å; L964-V968 HydrophobicContact CD1-CB 4.07Å; L964-V968 HydrophobicContact CD1-CG1 4.02Å; L964-V968 HydrophobicContact CD1-CG2 4.49Å; L964-V968 PolarHBondContact O-N 3.49Å; L964-Y969 HydrophobicContact CD1-CE1 4.28Å; L964-Y969 HydrophobicContact CD2-CE2 4.2Å; L964-Y969 HydrophobicContact CG-CD2 4.49Å; L964-Y969 HydrophobicContact CG-CE1 4.25Å; L964-Y969 HydrophobicContact CG-CE2 3.93Å; L964-Y969 PolarHBondContact O-N 3.39Å
965	S	89.1	Confident	86.8	Confident	58 Å²	58	57.2 Å²	57.2	41%	0.406	27%	0.266	S	S	.	.	I	π-helix	trans	-71.4	-43.5	-175.7	55.7	0	0	0	0	113.9	S961 F962 P970	S961-S965 WeakPolarHBondContact O-CB 3.13Å; S961-S965 PolarHBondContact O-N 3.1Å; S961-S965 PolarHBondContact O-OG 3.26Å; F962-S965 PolarHBondContact O-N 3.42Å; F962-S965 PolarHBondContact O-OG 3.06Å; S965-P970 VanDerWaalsContact O-CD 3.3Å; S965-P970 WeakPolarHBondContact O-CD 3.13Å
966	S	86.3	Confident	84.9	Confident	51 Å²	51	58.2 Å²	58.2	36%	0.357	28%	0.276	S	S	.	.	I	π-helix	trans	-91.2	-18.1	-169.8	-56.2	0	0	0	0	113.8	F962	F962-S966 VanDerWaalsContact CD2-OG 3.29Å; F962-S966 WeakPolarHBondContact CD2-OG 3.34Å; F962-S966 WeakPolarHBondContact CE2-OG 3.26Å; F962-S966 VanDerWaalsContact O-CB 3.22Å; F962-S966 WeakPolarHBondContact O-CB 3.26Å; F962-S966 PolarHBondContact O-N 2.87Å; F962-S966 PolarHBondContact O-OG 3.03Å
967	Y	88.3	Confident	82.7	Confident	26 Å²	26	62.9 Å²	62.9	10%	0.102	30%	0.303	C	S	.	.	I	π-helix	trans	-128.3	-56.1	-178.1	-51.3	-83.3	0	0	0	112.6	F962 A963 Y969 P970 L971 N1005 L1006 P1007 L1012	F962-Y967 AromaticContact CD1-CE2 3.93Å; F962-Y967 HydrophobicContact CD1-CE2 3.93Å; F962-Y967 AromaticContact CE1-CE2 3.51Å; F962-Y967 HydrophobicContact CE1-CE2 3.51Å; F962-Y967 AromaticContact CE1-CZ 3.95Å; F962-Y967 HydrophobicContact CZ-CE2 4.25Å; A963-Y967 PolarHBondContact O-N 3.05Å; Y967-Y969 PolarHBondContact O-N 3.24Å; Y967-P970 WeakPolarHBondContact O-CD 3.35Å; Y967-L971 WeakPolarHBondContact O-CB 3.33Å; Y967-L971 WeakPolarHBondContact O-CD1 3.13Å; Y967-L971 WeakPolarHBondContact O-CG 3.26Å; Y967-L971 PolarHBondContact O-N 3.02Å; Y967-N1005 HydrophobicContact CE1-CB 4.25Å; Y967-N1005 WeakPolarHBondContact CE1-O 3.23Å; Y967-N1005 PolarHBondContact OH-O 3.46Å; Y967-L1006 HydrophobicContact CD1-CD2 3.54Å; Y967-L1006 HydrophobicContact CE1-CD2 4.21Å; Y967-L1006 HydrophobicContact CG-CD2 4.03Å; Y967-P1007 HydrophobicContact CE2-CG 4.24Å; Y967-L1012 HydrophobicContact CD2-CD1 4.45Å; Y967-L1012 HydrophobicContact CG-CD1 4.44Å
968	V	89	Confident	80.3	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.337	C	S	.	.	I	π-helix	trans	-63.4	-48.7	-173.5	179.3	0	0	0	0	111.8	C878 L881 A963 L964 L971 L972 L1012	C878-V968 HydrophobicContact CB-CG1 3.68Å; L881-V968 HydrophobicContact CD1-CG2 3.9Å; A963-V968 PolarHBondContact O-N 3.24Å; A963-V968 VanDerWaalsContact O-N 3.15Å; L964-V968 HydrophobicContact CD1-CB 4.07Å; L964-V968 HydrophobicContact CD1-CG1 4.02Å; L964-V968 HydrophobicContact CD1-CG2 4.49Å; L964-V968 PolarHBondContact O-N 3.49Å; V968-L971 PolarHBondContact O-N 3Å; V968-L972 HydrophobicContact CG1-CD1 3.99Å; V968-L972 HydrophobicContact CG1-CG 4.46Å; V968-L972 WeakPolarHBondContact O-CG 3.47Å; V968-L972 PolarHBondContact O-N 2.96Å; V968-L1012 HydrophobicContact CG2-CD2 3.85Å
969	Y	90	Very high	78.1	Confident	85 Å²	85	73.7 Å²	73.7	33%	0.333	37%	0.367	S	S	.	.	H	α-helix	trans	-62.7	-46.6	177.7	-69.4	-34.3	0	0	0	113.3	L964 Y967 L971 L972 R973	L964-Y969 HydrophobicContact CD1-CE1 4.28Å; L964-Y969 HydrophobicContact CD2-CE2 4.2Å; L964-Y969 HydrophobicContact CG-CD2 4.49Å; L964-Y969 HydrophobicContact CG-CE1 4.25Å; L964-Y969 HydrophobicContact CG-CE2 3.93Å; L964-Y969 PolarHBondContact O-N 3.39Å; Y967-Y969 PolarHBondContact O-N 3.24Å; Y969-L971 VanDerWaalsContact C-N 3.32Å; Y969-L971 PolarHBondContact O-N 2.82Å; Y969-L972 PolarHBondContact O-N 3.27Å; Y969-R973 WeakPolarHBondContact O-CG 3.33Å; Y969-R973 PolarHBondContact O-N 3.46Å; Y969-R973 VanDerWaalsContact O-N 3.14Å
970	P	86.4	Confident	76.1	Confident	40 Å²	40	76.7 Å²	76.7	26%	0.26	38%	0.379	S	S	.	.	H	α-helix	trans	-54.9	-42.8	171.4	-31.3	37.4	0	0	0	114.1	S965 Y967 L972 R973 T974 P1001	S965-P970 VanDerWaalsContact O-CD 3.3Å; S965-P970 WeakPolarHBondContact O-CD 3.13Å; Y967-P970 WeakPolarHBondContact O-CD 3.35Å; P970-L972 PolarHBondContact O-N 2.86Å; P970-R973 PolarHBondContact O-N 2.98Å; P970-T974 PolarHBondContact O-N 3.14Å; P970-P1001 HydrophobicContact CB-CB 4.22Å
971	L	85.6	Confident	75	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-67.9	-31.6	179.1	-68.5	166.7	0	0	0	113.2	F869 Y967 V968 Y969 T974 I983 P1001 L1003 L1015	F869-L971 WeakPolarHBondContact CE1-O 3.35Å; F869-L971 HydrophobicContact CE2-CB 4.14Å; F869-L971 HydrophobicContact CZ-CB 3.99Å; Y967-L971 WeakPolarHBondContact O-CB 3.33Å; Y967-L971 WeakPolarHBondContact O-CD1 3.13Å; Y967-L971 WeakPolarHBondContact O-CG 3.26Å; Y967-L971 PolarHBondContact O-N 3.02Å; V968-L971 PolarHBondContact O-N 3Å; Y969-L971 VanDerWaalsContact C-N 3.32Å; Y969-L971 PolarHBondContact O-N 2.82Å; L971-T974 PolarHBondContact O-OG1 2.98Å; L971-I983 HydrophobicContact CD2-CD1 3.33Å; L971-I983 HydrophobicContact CD2-CG1 4.3Å; L971-P1001 HydrophobicContact CD2-CB 4.03Å; L971-P1001 HydrophobicContact CD2-CG 3.63Å; L971-P1001 HydrophobicContact CG-CB 4.47Å; L971-L1003 HydrophobicContact CD2-CD2 3.76Å; L971-L1015 HydrophobicContact CD1-CD1 4Å
972	L	84	Confident	74.5	Confident	58 Å²	58	78.2 Å²	78.2	30%	0.304	38%	0.383	S	S	.	.	H	α-helix	trans	-76.4	-25	175.2	-73.2	173.7	0	0	0	112.9	C874 C878 V968 Y969 P970	C874-L972 HydrophobicContact CB-CD2 4.01Å; C878-L972 HydrophobicContact CB-CD1 3.91Å; V968-L972 HydrophobicContact CG1-CD1 3.99Å; V968-L972 HydrophobicContact CG1-CG 4.46Å; V968-L972 WeakPolarHBondContact O-CG 3.47Å; V968-L972 PolarHBondContact O-N 2.96Å; Y969-L972 PolarHBondContact O-N 3.27Å; P970-L972 PolarHBondContact O-N 2.86Å
973	R	81.3	Confident	74.1	Confident	187 Å²	187	72.8 Å²	72.8	71%	0.706	36%	0.36	S	S	*	.	H	α-helix	trans	-78	-21.3	178.8	-71.5	178.9	-155.8	173.4	5.8	113.5	Y969 P970 R975	Y969-R973 WeakPolarHBondContact O-CG 3.33Å; Y969-R973 PolarHBondContact O-N 3.46Å; Y969-R973 VanDerWaalsContact O-N 3.14Å; P970-R973 PolarHBondContact O-N 2.98Å; R973-R975 PolarHBondContact O-N 3Å
974	T	69.9	Low	73.8	Confident	40 Å²	40	78.3 Å²	78.3	25%	0.245	38%	0.381	C	S	.	.	S	Bend	trans	-61.6	106.9	176.5	21.9	0	0	0	0	109.9	P970 L971 S976	P970-T974 PolarHBondContact O-N 3.14Å; L971-T974 PolarHBondContact O-OG1 2.98Å; T974-S976 PolarHBondContact O-N 3.1Å
975	R	55.8	Low	73.3	Confident	221 Å²	221	77.9 Å²	77.9	83%	0.834	38%	0.38	S	S	*	.			trans	-64.9	127.9	-176.9	-74.4	-174	177.1	-174.7	-0.5	110.9	R973	R973-R975 PolarHBondContact O-N 3Å
976	S	52.9	Low	73.2	Confident	56 Å²	56	81 Å²	81	39%	0.392	39%	0.386	S	S	.	.			trans	-80.3	116.4	165.4	-170.9	0	0	0	0	109.8	T974 K978 F980	T974-S976 PolarHBondContact O-N 3.1Å; S976-K978 PolarHBondContact OG-O 2.92Å; S976-F980 PolarHBondContact OG-O 3.38Å
977	N	47	Very low	73.2	Confident	152 Å²	152	79.8 Å²	79.8	81%	0.813	37%	0.374	S	S	*	.			trans	-91	0.4	172.9	-91.2	-9.3	0	0	0	113.7
978	K	44.3	Very low	73.1	Confident	178 Å²	178	81.5 Å²	81.5	77%	0.774	39%	0.385	S	S	*	.	S	Bend	trans	-151.6	175.7	-174	-68.5	-169.7	177.9	177.3	0	112.1	S976 F980	S976-K978 PolarHBondContact OG-O 2.92Å; K978-F980 PolarHBondContact O-N 3Å
979	C	45.6	Very low	72.7	Confident	130 Å²	130	82.3 Å²	82.3	88%	0.878	39%	0.388	S	S	*	.	S	Bend	trans	-55.1	-0.8	174.8	-70.4	0	0	0	0	115.5
980	F	49.3	Very low	72.5	Confident	145 Å²	145	79.5 Å²	79.5	64%	0.636	38%	0.378	S	S	*	.	S	Bend	trans	-133.9	126	173.5	-68	-82.9	0	0	0	109.9	S976 K978 R982	S976-F980 PolarHBondContact OG-O 3.38Å; K978-F980 PolarHBondContact O-N 3Å; F980-R982 PolarHBondContact O-N 3.01Å
981	T	69.3	Low	72.4	Confident	45 Å²	45	78.5 Å²	78.5	28%	0.276	37%	0.37	S	S	.	.			trans	-74.5	104.4	171.2	30.8	0	0	0	0	109.2	F869	F869-T981 WeakPolarHBondContact CB-O 3.33Å; F869-T981 PolarHBondContact N-O 3.16Å; F869-T981 WeakPolarHBondContact O-CB 3.44Å; F869-T981 PolarHBondContact O-OG1 3.47Å
982	R	80.2	Confident	72.1	Confident	42 Å²	42	80.2 Å²	80.2	16%	0.158	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.6	169	-72.5	-171.7	174.6	-134.4	-4	110.2	T865 G866 I867 F980 Y984	T865-R982 PolarHBondContact O-NH1 3.46Å; G866-R982 PolarHBondContact O-NH1 3.43Å; I867-R982 CarbonylContact O-C 3.52Å; I867-R982 WeakPolarHBondContact O-CA 3.47Å; F980-R982 PolarHBondContact O-N 3.01Å; R982-Y984 HydrophobicContact CB-CD2 4.5Å; R982-Y984 HydrophobicContact CB-CE2 3.81Å
983	I	81.8	Confident	71.8	Confident	0 Å²	0	79 Å²	79	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.9	168.3	-67.3	162.1	0	0	0	108.5	G866 I867 F869 L971 P1001 L1003	G866-I983 CarbonylContact C-O 3.51Å; G866-I983 WeakPolarHBondContact CA-O 3.25Å; I867-I983 HydrophobicContact CG2-CB 4.21Å; I867-I983 PolarHBondContact N-O 2.9Å; I867-I983 PolarHBondContact O-N 2.96Å; F869-I983 HydrophobicContact CB-CD1 3.54Å; F869-I983 HydrophobicContact CB-CG1 3.63Å; F869-I983 HydrophobicContact CD1-CD1 4.1Å; F869-I983 HydrophobicContact CD1-CG1 4.05Å; F869-I983 HydrophobicContact CD2-CD1 3.34Å; F869-I983 HydrophobicContact CD2-CG1 4.17Å; F869-I983 HydrophobicContact CE2-CD1 3.99Å; F869-I983 HydrophobicContact CG-CD1 3.39Å; F869-I983 HydrophobicContact CG-CG1 3.7Å; L971-I983 HydrophobicContact CD2-CD1 3.33Å; L971-I983 HydrophobicContact CD2-CG1 4.3Å; I983-P1001 HydrophobicContact CG2-CG 3.53Å; I983-L1003 HydrophobicContact CG2-CD1 4.25Å
984	Y	84	Confident	71.7	Confident	116 Å²	116	70.1 Å²	70.1	46%	0.455	35%	0.347	S	S	.	.			trans	-109.7	110	174.5	-60.1	-84.7	0	0	0	107.5	E863 R982	E863-Y984 VanDerWaalsContact O-CD1 3.25Å; E863-Y984 WeakPolarHBondContact O-CD1 3.12Å; R982-Y984 HydrophobicContact CB-CD2 4.5Å; R982-Y984 HydrophobicContact CB-CE2 3.81Å
985	G	78.5	Confident	72.4	Confident	4 Å²	4	72.9 Å²	72.9	4%	0.041	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-87	154.1	173.7	0	0	0	0	0	111.9	E863	E863-G985 WeakPolarHBondContact CG-O 3.31Å
986	K	86.8	Confident	73.8	Confident	122 Å²	122	63.2 Å²	63.2	53%	0.53	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.5	170	-62.9	177.3	-175.2	165.9	0	108.9	M998 H999 E1000	K986-M998 CarbonylContact O-C 3.54Å; K986-M998 WeakPolarHBondContact O-CA 3.4Å; K986-H999 PolarHBondContact N-O 3.38Å; K986-H999 PolarHBondContact O-N 3.1Å; K986-E1000 IonicContact NZ-OE2 3.38Å; K986-E1000 PolarHBondContact NZ-OE2 2.87Å
987	Y	86.8	Confident	75.4	Confident	26 Å²	26	63.3 Å²	63.3	10%	0.102	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135	176.9	-66.5	-82	0	0	0	110.5	V859 M862 E863 V996 I997 M998 L1162 L1163	V859-Y987 HydrophobicContact CG1-CD1 4.26Å; V859-Y987 HydrophobicContact CG1-CD2 3.28Å; V859-Y987 HydrophobicContact CG1-CE2 3.87Å; V859-Y987 HydrophobicContact CG1-CG 3.49Å; V859-Y987 VanDerWaalsContact CG1-CG 3.49Å; M862-Y987 HydrophobicContact CB-CE2 4.48Å; E863-Y987 HydrophobicContact CG-CD2 3.51Å; E863-Y987 HydrophobicContact CG-CE2 4.05Å; E863-Y987 WeakPolarHBondContact OE1-CB 3.04Å; E863-Y987 PolarHBondContact OE1-N 3.44Å; Y987-V996 HydrophobicContact CD1-CG1 3.62Å; Y987-V996 HydrophobicContact CE1-CG1 4.49Å; Y987-V996 HydrophobicContact CG-CG1 4.07Å; Y987-I997 CarbonylContact C-O 3.58Å; Y987-I997 WeakPolarHBondContact CA-O 3.24Å; Y987-M998 HydrophobicContact CD1-CB 3.95Å; Y987-M998 HydrophobicContact CD1-CG 4.24Å; Y987-M998 HydrophobicContact CE1-CB 3.91Å; Y987-M998 HydrophobicContact CE1-CG 4.01Å; Y987-M998 HydrophobicContact CE1-SD 4.39Å; Y987-L1162 WeakPolarHBondContact OH-CD1 3.24Å; Y987-L1163 HydrophobicContact CE1-CB 4.06Å; Y987-L1163 WeakPolarHBondContact CE1-O 3.39Å; Y987-L1163 PolarHBondContact OH-N 3.33Å; Y987-L1163 VanDerWaalsContact OH-N 3.13Å; Y987-L1163 PolarHBondContact OH-O 3.07Å
988	D	85.9	Confident	77.3	Confident	62 Å²	62	56.1 Å²	56.1	33%	0.332	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.6	167	-168.7	-1.7	0	0	0	109.3	F990 I997	D988-F990 PolarHBondContact OD1-N 2.88Å; D988-F990 VanDerWaalsContact OD1-N 3.07Å; D988-I997 PolarHBondContact N-O 2.88Å; D988-I997 PolarHBondContact O-N 3.47Å
989	W	81.6	Confident	79.1	Confident	17 Å²	17	51.6 Å²	51.6	6%	0.064	26%	0.257	C	S	.	.			trans	-95.6	-23.7	-175.7	-150.3	-89.6	0	0	0	112.6	W782 E852 A855 Q856 V859 T991 V996 K1145	W782-W989 WeakPolarHBondContact CZ2-O 3.49Å; E852-W989 PolarHBondContact OE2-NE1 3.38Å; A855-W989 HydrophobicContact CB-CH2 3.7Å; A855-W989 HydrophobicContact CB-CZ2 3.59Å; A855-W989 VanDerWaalsContact O-CH2 3.3Å; A855-W989 WeakPolarHBondContact O-CH2 3.37Å; Q856-W989 HydrophobicContact CB-CZ2 4.36Å; Q856-W989 HydrophobicContact CG-CD2 3.49Å; Q856-W989 VanDerWaalsContact CG-CD2 3.49Å; Q856-W989 HydrophobicContact CG-CE3 4.05Å; Q856-W989 HydrophobicContact CG-CG 3.89Å; Q856-W989 HydrophobicContact CG-CH2 4.19Å; Q856-W989 HydrophobicContact CG-CZ2 3.63Å; Q856-W989 HydrophobicContact CG-CZ3 4.36Å; V859-W989 HydrophobicContact CB-CE3 4.48Å; V859-W989 HydrophobicContact CB-CH2 4.17Å; V859-W989 HydrophobicContact CB-CZ3 3.52Å; V859-W989 HydrophobicContact CG1-CZ3 3.9Å; V859-W989 HydrophobicContact CG2-CH2 3.66Å; V859-W989 HydrophobicContact CG2-CZ3 3.37Å; W989-T991 PolarHBondContact O-N 3.31Å; W989-T991 VanDerWaalsContact O-N 3.13Å; W989-V996 HydrophobicContact CD2-CG2 4.28Å; W989-V996 HydrophobicContact CE3-CG1 4.02Å; W989-V996 HydrophobicContact CE3-CG2 3.89Å; W989-V996 HydrophobicContact CH2-CG2 3.84Å; W989-V996 HydrophobicContact CZ2-CG2 4.25Å; W989-V996 HydrophobicContact CZ3-CG1 3.98Å; W989-V996 HydrophobicContact CZ3-CG2 3.64Å; W989-K1145 HydrophobicContact CZ2-CD 4.19Å
990	F	85.4	Confident	80.7	Confident	27 Å²	27	51.6 Å²	51.6	12%	0.118	24%	0.244	C	C	.	.			trans	-95.1	53.8	-160.3	-61.2	-83.1	0	0	0	112.7	W782 R790 D988	W782-F990 HydrophobicContact CB-CD1 3.52Å; W782-F990 HydrophobicContact CB-CE1 3.97Å; W782-F990 AromaticContact CD1-CD1 3.93Å; W782-F990 HydrophobicContact CD2-CD1 4.02Å; W782-F990 HydrophobicContact CG-CB 4.34Å; W782-F990 AromaticContact CG-CD1 3.52Å; W782-F990 HydrophobicContact CG-CD1 3.52Å; W782-F990 HydrophobicContact CG-CE1 4.32Å; W782-F990 HydrophobicContact CG-CG 4.41Å; W782-F990 VanDerWaalsContact NE1-C 3.31Å; R790-F990 HydrophobicContact CB-CB 4.16Å; R790-F990 HydrophobicContact CB-CD1 4.23Å; R790-F990 HydrophobicContact CB-CD2 3.56Å; R790-F990 HydrophobicContact CB-CE2 3.95Å; R790-F990 HydrophobicContact CB-CG 3.72Å; R790-F990 HydrophobicContact CB-CZ 4.45Å; R790-F990 HydrophobicContact CG-CD2 3.85Å; R790-F990 HydrophobicContact CG-CE1 4.41Å; R790-F990 HydrophobicContact CG-CE2 3.67Å; R790-F990 HydrophobicContact CG-CG 4.29Å; R790-F990 HydrophobicContact CG-CZ 3.98Å; D988-F990 PolarHBondContact OD1-N 2.88Å; D988-F990 VanDerWaalsContact OD1-N 3.07Å
991	T	84.8	Confident	82.2	Confident	18 Å²	18	45 Å²	45	11%	0.11	22%	0.216	C	C	.	.			trans	-99.5	148.7	-178.7	73.6	0	0	0	0	112.1	W782 W989 T993 G994 R995 I997	W782-T991 VanDerWaalsContact CZ2-O 3.24Å; W782-T991 WeakPolarHBondContact CZ2-O 3.09Å; W782-T991 PolarHBondContact NE1-O 3.08Å; W989-T991 PolarHBondContact O-N 3.31Å; W989-T991 VanDerWaalsContact O-N 3.13Å; T991-T993 PolarHBondContact O-N 3.47Å; T991-T993 VanDerWaalsContact O-N 3.1Å; T991-G994 PolarHBondContact O-N 3.31Å; T991-G994 PolarHBondContact OG1-N 3.42Å; T991-R995 WeakPolarHBondContact CG2-O 3.42Å; T991-R995 PolarHBondContact OG1-N 3.3Å; T991-R995 PolarHBondContact OG1-O 2.86Å; T991-I997 HydrophobicContact CG2-CD1 3.39Å; T991-I997 HydrophobicContact CG2-CG1 3.76Å
992	A	78.3	Confident	82.8	Confident	38 Å²	38	44.7 Å²	44.7	31%	0.314	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-33.3	-178.7	0	0	0	0	0	114.1	D787 Q1115	D787-A992 WeakPolarHBondContact OD1-CB 3.23Å; A992-Q1115 PolarHBondContact O-NE2 3.11Å; A992-Q1115 PolarHBondContact O-OE1 3.24Å
993	T	77.8	Confident	82.9	Confident	34 Å²	34	42.7 Å²	42.7	21%	0.209	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-10.7	179.3	55.4	0	0	0	0	113.6	T991 R995 R1113 G1138	T991-T993 PolarHBondContact O-N 3.47Å; T991-T993 VanDerWaalsContact O-N 3.1Å; T993-R995 VanDerWaalsContact C-N 3.33Å; T993-R1113 PolarHBondContact O-NH1 3.5Å; T993-R1113 PolarHBondContact O-NH2 2.99Å; T993-G1138 WeakPolarHBondContact O-CA 3.27Å
994	G	80.8	Confident	82.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.			trans	88.1	-6.6	-172.2	0	0	0	0	0	115	T991 S1141 K1145	T991-G994 PolarHBondContact O-N 3.31Å; T991-G994 PolarHBondContact OG1-N 3.42Å; G994-S1141 PolarHBondContact O-OG 3.3Å; G994-K1145 WeakPolarHBondContact O-CE 3.5Å; G994-K1145 PolarHBondContact O-NZ 3.02Å
995	R	84.5	Confident	82.6	Confident	97 Å²	97	41.6 Å²	41.6	37%	0.366	21%	0.206	S	C	.	.			trans	-65.8	138.2	-179.8	-72.6	-178.2	173.8	174	-0.5	111.4	T991 T993 E1033 S1141	T991-R995 WeakPolarHBondContact CG2-O 3.42Å; T991-R995 PolarHBondContact OG1-N 3.3Å; T991-R995 PolarHBondContact OG1-O 2.86Å; T993-R995 VanDerWaalsContact C-N 3.33Å; R995-E1033 IonicContact CZ-OE1 3.05Å; R995-E1033 IonicContact NH2-OE1 3.66Å; R995-E1033 PolarHBondContact NH2-OE1 3.36Å; R995-S1141 PolarHBondContact N-OG 2.88Å
996	V	85	Confident	82.8	Confident	19 Å²	19	41.6 Å²	41.6	12%	0.115	21%	0.205	C	C	.	.			trans	-82.6	120.4	174.9	-173.8	0	0	0	0	109.2	Y987 W989 Q1004	Y987-V996 HydrophobicContact CD1-CG1 3.62Å; Y987-V996 HydrophobicContact CE1-CG1 4.49Å; Y987-V996 HydrophobicContact CG-CG1 4.07Å; W989-V996 HydrophobicContact CD2-CG2 4.28Å; W989-V996 HydrophobicContact CE3-CG1 4.02Å; W989-V996 HydrophobicContact CE3-CG2 3.89Å; W989-V996 HydrophobicContact CH2-CG2 3.84Å; W989-V996 HydrophobicContact CZ2-CG2 4.25Å; W989-V996 HydrophobicContact CZ3-CG1 3.98Å; W989-V996 HydrophobicContact CZ3-CG2 3.64Å; V996-Q1004 PolarHBondContact O-NE2 3.04Å
997	I	86.2	Confident	82.3	Confident	58 Å²	58	37.4 Å²	37.4	30%	0.297	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	146.8	179.3	-57.3	173.9	0	0	0	109.3	Y987 D988 T991 H999	Y987-I997 CarbonylContact C-O 3.58Å; Y987-I997 WeakPolarHBondContact CA-O 3.24Å; D988-I997 PolarHBondContact N-O 2.88Å; D988-I997 PolarHBondContact O-N 3.47Å; T991-I997 HydrophobicContact CG2-CD1 3.39Å; T991-I997 HydrophobicContact CG2-CG1 3.76Å; I997-H999 WeakPolarHBondContact CG2-NE2 3.43Å
998	M	86	Confident	81.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.4	175.6	-170.5	-170	-173.7	0	0	111.2	K986 Y987 P1001 N1002 L1003 Q1004 L1162	K986-M998 CarbonylContact O-C 3.54Å; K986-M998 WeakPolarHBondContact O-CA 3.4Å; Y987-M998 HydrophobicContact CD1-CB 3.95Å; Y987-M998 HydrophobicContact CD1-CG 4.24Å; Y987-M998 HydrophobicContact CE1-CB 3.91Å; Y987-M998 HydrophobicContact CE1-CG 4.01Å; Y987-M998 HydrophobicContact CE1-SD 4.39Å; M998-P1001 WeakPolarHBondContact CE-O 3.29Å; M998-N1002 WeakPolarHBondContact O-CA 3.27Å; M998-N1002 VanDerWaalsContact O-CB 3.28Å; M998-N1002 WeakPolarHBondContact O-CB 3.37Å; M998-N1002 PolarHBondContact O-ND2 3.31Å; M998-L1003 HydrophobicContact CE-CB 3.97Å; M998-L1003 HydrophobicContact CE-CD1 3.71Å; M998-L1003 HydrophobicContact CE-CG 3.62Å; M998-L1003 HydrophobicContact SD-CB 3.61Å; M998-L1003 HydrophobicContact SD-CD1 4.44Å; M998-L1003 HydrophobicContact SD-CG 3.95Å; M998-L1003 PolarHBondContact SD-N 2.87Å; M998-Q1004 HydrophobicContact CB-CG 3.76Å; M998-L1162 HydrophobicContact CE-CD1 4.45Å
999	H	83.7	Confident	81	Confident	84 Å²	84	49.1 Å²	49.1	39%	0.389	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.8	175.5	-58.9	-75.7	0	0	0	111	K986 I997	K986-H999 PolarHBondContact N-O 3.38Å; K986-H999 PolarHBondContact O-N 3.1Å; I997-H999 WeakPolarHBondContact CG2-NE2 3.43Å
1000	E	78.6	Confident	80.5	Confident	129 Å²	129	49.4 Å²	49.4	60%	0.603	24%	0.242	S	C	*	.	S	Bend	trans	50.8	64.9	171.6	-58.7	-174	160.8	0	0	116.3	K986	K986-E1000 IonicContact NZ-OE2 3.38Å; K986-E1000 PolarHBondContact NZ-OE2 2.87Å
1001	P	79.8	Confident	80.3	Confident	7 Å²	7	51.3 Å²	51.3	5%	0.045	26%	0.258	C	S	.	.	S	Bend	cis	-95.9	154.9	-1.6	35.1	-31.4	0	0	0	112.5	P970 L971 I983 M998 L1003	P970-P1001 HydrophobicContact CB-CB 4.22Å; L971-P1001 HydrophobicContact CD2-CB 4.03Å; L971-P1001 HydrophobicContact CD2-CG 3.63Å; L971-P1001 HydrophobicContact CG-CB 4.47Å; I983-P1001 HydrophobicContact CG2-CG 3.53Å; M998-P1001 WeakPolarHBondContact CE-O 3.29Å; P1001-L1003 HydrophobicContact CG-CD2 4.05Å; P1001-L1003 HydrophobicContact CG-CG 4.37Å; P1001-L1003 PolarHBondContact O-N 3.24Å
1002	N	83.4	Confident	80.3	Confident	38 Å²	38	50.5 Å²	50.5	20%	0.203	25%	0.253	C	S	.	.			trans	-77.8	88.8	174.6	-174.4	-27.4	0	0	0	110.4	M998 Q1004 N1005	M998-N1002 WeakPolarHBondContact O-CA 3.27Å; M998-N1002 VanDerWaalsContact O-CB 3.28Å; M998-N1002 WeakPolarHBondContact O-CB 3.37Å; M998-N1002 PolarHBondContact O-ND2 3.31Å; N1002-Q1004 PolarHBondContact O-N 2.85Å; N1002-Q1004 WeakPolarHBondContact OD1-CA 3.38Å; N1002-Q1004 VanDerWaalsContact OD1-CB 3.28Å; N1002-Q1004 WeakPolarHBondContact OD1-CB 3.37Å; N1002-Q1004 PolarHBondContact OD1-N 3.2Å; N1002-N1005 PolarHBondContact ND2-ND2 2.74Å; N1002-N1005 PolarHBondContact OD1-N 3.33Å
1003	L	82.1	Confident	80.7	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	25%	0.248	C	C	.	.			trans	-73.7	-16	174.9	-58.4	-175	0	0	0	112.7	I867 L971 I983 M998 P1001 N1005 L1006 L1162 I1164 W1211	I867-L1003 HydrophobicContact CG2-CD1 3.9Å; L971-L1003 HydrophobicContact CD2-CD2 3.76Å; I983-L1003 HydrophobicContact CG2-CD1 4.25Å; M998-L1003 HydrophobicContact CE-CB 3.97Å; M998-L1003 HydrophobicContact CE-CD1 3.71Å; M998-L1003 HydrophobicContact CE-CG 3.62Å; M998-L1003 HydrophobicContact SD-CB 3.61Å; M998-L1003 HydrophobicContact SD-CD1 4.44Å; M998-L1003 HydrophobicContact SD-CG 3.95Å; M998-L1003 PolarHBondContact SD-N 2.87Å; P1001-L1003 HydrophobicContact CG-CD2 4.05Å; P1001-L1003 HydrophobicContact CG-CG 4.37Å; P1001-L1003 PolarHBondContact O-N 3.24Å; L1003-N1005 PolarHBondContact O-N 3.44Å; L1003-L1006 HydrophobicContact CD2-CD1 4.22Å; L1003-L1162 HydrophobicContact CD1-CD2 4.08Å; L1003-I1164 HydrophobicContact CB-CD1 4.35Å; L1003-W1211 WeakPolarHBondContact O-CH2 3.45Å
1004	Q	79.4	Confident	81.1	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.061	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-48.2	178	-59.2	178.6	-37.1	0	0	109.8	V996 M998 N1002 L1006 H1165	V996-Q1004 PolarHBondContact O-NE2 3.04Å; M998-Q1004 HydrophobicContact CB-CG 3.76Å; N1002-Q1004 PolarHBondContact O-N 2.85Å; N1002-Q1004 WeakPolarHBondContact OD1-CA 3.38Å; N1002-Q1004 VanDerWaalsContact OD1-CB 3.28Å; N1002-Q1004 WeakPolarHBondContact OD1-CB 3.37Å; N1002-Q1004 PolarHBondContact OD1-N 3.2Å; Q1004-L1006 PolarHBondContact O-N 3.09Å; Q1004-H1165 VanDerWaalsContact C-CD2 3.44Å; Q1004-H1165 PolarHBondContact O-CD2 3.29Å; Q1004-H1165 PolarHBondContact O-NE2 2.97Å
1005	N	79.7	Confident	81.4	Confident	79 Å²	79	51.2 Å²	51.2	42%	0.422	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	21.4	-173	-69.1	-42.4	0	0	0	115.5	Y967 N1002 L1003 P1007 H1165	Y967-N1005 HydrophobicContact CE1-CB 4.25Å; Y967-N1005 WeakPolarHBondContact CE1-O 3.23Å; Y967-N1005 PolarHBondContact OH-O 3.46Å; N1002-N1005 PolarHBondContact ND2-ND2 2.74Å; N1002-N1005 PolarHBondContact OD1-N 3.33Å; L1003-N1005 PolarHBondContact O-N 3.44Å; N1005-P1007 WeakPolarHBondContact O-CD 3.19Å; N1005-H1165 PolarHBondContact OD1-NE2 2.8Å
1006	L	83.5	Confident	81.5	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	23%	0.23	C	C	.	.			trans	-62.7	121.7	-179.3	-73.8	-169.9	0	0	0	112.1	Y967 L1003 Q1004 K1008 L1012 R1013 V1016 W1211	Y967-L1006 HydrophobicContact CD1-CD2 3.54Å; Y967-L1006 HydrophobicContact CE1-CD2 4.21Å; Y967-L1006 HydrophobicContact CG-CD2 4.03Å; L1003-L1006 HydrophobicContact CD2-CD1 4.22Å; Q1004-L1006 PolarHBondContact O-N 3.09Å; L1006-K1008 PolarHBondContact O-N 2.86Å; L1006-L1012 HydrophobicContact CD2-CB 4.47Å; L1006-R1013 HydrophobicContact CB-CG 4.17Å; L1006-R1013 HydrophobicContact CD1-CG 4.48Å; L1006-R1013 PolarHBondContact O-NE 3.36Å; L1006-R1013 PolarHBondContact O-NH2 3.48Å; L1006-V1016 HydrophobicContact CD1-CG2 4.44Å; L1006-W1211 HydrophobicContact CB-CH2 4.44Å; L1006-W1211 HydrophobicContact CB-CZ3 4.31Å; L1006-W1211 HydrophobicContact CD1-CE3 4.18Å; L1006-W1211 HydrophobicContact CD1-CH2 4.47Å; L1006-W1211 HydrophobicContact CD1-CZ3 3.59Å; L1006-W1211 HydrophobicContact CG-CZ3 4.21Å
1007	P	74.3	Confident	81.5	Confident	35 Å²	35	47.1 Å²	47.1	23%	0.227	23%	0.232	C	C	.	.			trans	-68.3	131.2	-175.7	24.4	-31.7	0	0	0	112	Y967 N1005 K1009 I1010 L1012	Y967-P1007 HydrophobicContact CE2-CG 4.24Å; N1005-P1007 WeakPolarHBondContact O-CD 3.19Å; P1007-K1009 VanDerWaalsContact C-N 3.35Å; P1007-K1009 PolarHBondContact O-N 3.4Å; P1007-I1010 HydrophobicContact CG-CD1 4.26Å; P1007-L1012 HydrophobicContact CG-CD1 3.86Å
1008	K	73.6	Confident	81.1	Confident	162 Å²	162	45 Å²	45	70%	0.704	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-65.2	-33	-178.9	-66.8	-177.4	179.2	-177.4	0	113.6	L1006 I1010	L1006-K1008 PolarHBondContact O-N 2.86Å; K1008-I1010 PolarHBondContact O-N 3.25Å
1009	K	71.8	Confident	80.5	Confident	172 Å²	172	50.6 Å²	50.6	75%	0.748	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-75.1	-18.4	-170.3	-67.2	-169.2	177.6	-168.6	0	115.4	P1007	P1007-K1009 VanDerWaalsContact C-N 3.35Å; P1007-K1009 PolarHBondContact O-N 3.4Å
1010	I	72.2	Confident	80	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.118	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-107.3	13.3	-173.6	-49.8	168.7	0	0	0	110.4	M877 L881 Q959 A963 P1007 K1008 L1012	M877-I1010 VanDerWaalsContact CE-O 3.25Å; M877-I1010 WeakPolarHBondContact CE-O 3.09Å; L881-I1010 HydrophobicContact CD2-CG2 4.12Å; Q959-I1010 HydrophobicContact CG-CD1 4.04Å; A963-I1010 HydrophobicContact CB-CD1 3.38Å; P1007-I1010 HydrophobicContact CG-CD1 4.26Å; K1008-I1010 PolarHBondContact O-N 3.25Å; I1010-L1012 HydrophobicContact CB-CG 4.26Å; I1010-L1012 HydrophobicContact CG2-CG 4.24Å; I1010-L1012 PolarHBondContact O-N 3.15Å
1011	S	80.3	Confident	79.6	Confident	67 Å²	67	50.1 Å²	50.1	47%	0.469	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	19.1	-179.3	-54.1	0	0	0	0	115.3	R1013 N1014	S1011-R1013 PolarHBondContact O-N 3.45Å; S1011-R1013 VanDerWaalsContact O-N 3.09Å; S1011-N1014 WeakPolarHBondContact O-CB 3.34Å; S1011-N1014 PolarHBondContact O-N 3.03Å
1012	L	84.9	Confident	79.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.5	-21.8	-179.8	-71.6	177.5	0	0	0	112.8	M877 A963 Y967 V968 L1006 P1007 I1010 N1014 L1015	M877-L1012 HydrophobicContact CE-CD2 3.68Å; M877-L1012 HydrophobicContact CE-CG 4.42Å; M877-L1012 HydrophobicContact SD-CD2 4.38Å; A963-L1012 HydrophobicContact CB-CD1 4.35Å; Y967-L1012 HydrophobicContact CD2-CD1 4.45Å; Y967-L1012 HydrophobicContact CG-CD1 4.44Å; V968-L1012 HydrophobicContact CG2-CD2 3.85Å; L1006-L1012 HydrophobicContact CD2-CB 4.47Å; P1007-L1012 HydrophobicContact CG-CD1 3.86Å; I1010-L1012 HydrophobicContact CB-CG 4.26Å; I1010-L1012 HydrophobicContact CG2-CG 4.24Å; I1010-L1012 PolarHBondContact O-N 3.15Å; L1012-N1014 PolarHBondContact O-N 3.35Å; L1012-L1015 HydrophobicContact CD2-CD1 3.87Å; L1012-L1015 VanDerWaalsContact O-CB 3.29Å; L1012-L1015 WeakPolarHBondContact O-CB 3.17Å; L1012-L1015 WeakPolarHBondContact O-CG 3.49Å; L1012-L1015 PolarHBondContact O-N 3.08Å
1013	R	86.8	Confident	79	Confident	56 Å²	56	49.9 Å²	49.9	21%	0.211	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-62.2	-23.9	173.3	-63.9	-178.2	-178.4	-150.2	-9.1	112.1	L1006 S1011 L1015 V1016 W1211	L1006-R1013 HydrophobicContact CB-CG 4.17Å; L1006-R1013 HydrophobicContact CD1-CG 4.48Å; L1006-R1013 PolarHBondContact O-NE 3.36Å; L1006-R1013 PolarHBondContact O-NH2 3.48Å; S1011-R1013 PolarHBondContact O-N 3.45Å; S1011-R1013 VanDerWaalsContact O-N 3.09Å; R1013-L1015 PolarHBondContact O-N 2.89Å; R1013-V1016 PolarHBondContact O-N 2.88Å; R1013-V1016 VanDerWaalsContact O-N 3.15Å; R1013-W1211 HydrophobicContact CB-CB 4.41Å; R1013-W1211 HydrophobicContact CB-CD2 4.05Å; R1013-W1211 HydrophobicContact CB-CE3 4.06Å; R1013-W1211 HydrophobicContact CB-CG 4.25Å; R1013-W1211 HydrophobicContact CG-CD2 4.1Å; R1013-W1211 HydrophobicContact CG-CE3 4Å; R1013-W1211 HydrophobicContact CG-CH2 4.32Å; R1013-W1211 HydrophobicContact CG-CZ2 4.45Å; R1013-W1211 HydrophobicContact CG-CZ3 4.16Å; R1013-W1211 WeakPolarHBondContact O-CB 3.31Å
1014	N	87.4	Confident	78.9	Confident	31 Å²	31	49.8 Å²	49.8	17%	0.166	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-70.4	-11.4	177.6	-70.9	-0.9	0	0	0	113.6	L873 S1011 L1012 V1016 R1210 G1212 D1213	L873-N1014 HydrophobicContact CD2-CB 4.46Å; S1011-N1014 WeakPolarHBondContact O-CB 3.34Å; S1011-N1014 PolarHBondContact O-N 3.03Å; L1012-N1014 PolarHBondContact O-N 3.35Å; N1014-V1016 VanDerWaalsContact C-N 3.28Å; N1014-R1210 PolarHBondContact O-NH1 3.03Å; N1014-G1212 WeakPolarHBondContact OD1-CA 3.24Å; N1014-G1212 PolarHBondContact OD1-N 3.25Å; N1014-D1213 PolarHBondContact ND2-OD1 2.69Å
1015	L	86.7	Confident	78.8	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-71.9	-23.3	172.3	-60.4	178.1	0	0	0	112.8	F869 D870 L873 C874 M877 L971 L1012 R1013	F869-L1015 WeakPolarHBondContact CA-O 3.39Å; F869-L1015 HydrophobicContact CD2-CB 4.23Å; F869-L1015 HydrophobicContact CE2-CB 4.05Å; F869-L1015 HydrophobicContact CE2-CD1 4.49Å; D870-L1015 PolarHBondContact N-O 3.41Å; L873-L1015 HydrophobicContact CB-CD2 4.02Å; L873-L1015 HydrophobicContact CD2-CD2 4Å; L873-L1015 HydrophobicContact CG-CD2 3.75Å; C874-L1015 HydrophobicContact CB-CD1 4.25Å; C874-L1015 HydrophobicContact CB-CD2 3.82Å; M877-L1015 HydrophobicContact SD-CD1 4.36Å; M877-L1015 HydrophobicContact SD-CD2 3.63Å; M877-L1015 HydrophobicContact SD-CG 4.02Å; L971-L1015 HydrophobicContact CD1-CD1 4Å; L1012-L1015 HydrophobicContact CD2-CD1 3.87Å; L1012-L1015 VanDerWaalsContact O-CB 3.29Å; L1012-L1015 WeakPolarHBondContact O-CB 3.17Å; L1012-L1015 WeakPolarHBondContact O-CG 3.49Å; L1012-L1015 PolarHBondContact O-N 3.08Å; R1013-L1015 PolarHBondContact O-N 2.89Å
1016	V	86.6	Confident	78.8	Confident	2 Å²	2	46 Å²	46	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.7	179.3	-179.9	0	0	0	0	108.9	I867 L1006 R1013 N1014 L1024 W1211	I867-V1016 HydrophobicContact CD1-CG1 3.33Å; I867-V1016 HydrophobicContact CG1-CG1 3.73Å; I867-V1016 HydrophobicContact CG2-CG1 4.29Å; L1006-V1016 HydrophobicContact CD1-CG2 4.44Å; R1013-V1016 PolarHBondContact O-N 2.88Å; R1013-V1016 VanDerWaalsContact O-N 3.15Å; N1014-V1016 VanDerWaalsContact C-N 3.28Å; V1016-L1024 HydrophobicContact CG1-CD1 4.49Å; V1016-W1211 HydrophobicContact CB-CB 4Å; V1016-W1211 HydrophobicContact CB-CE3 3.98Å; V1016-W1211 HydrophobicContact CG1-CB 4.25Å; V1016-W1211 HydrophobicContact CG1-CE3 4.33Å; V1016-W1211 HydrophobicContact CG2-CE3 3.85Å; V1016-W1211 HydrophobicContact CG2-CZ3 4.4Å; V1016-W1211 PolarHBondContact O-N 3.31Å; V1016-W1211 VanDerWaalsContact O-N 3.07Å
1017	V	84.6	Confident	78.6	Confident	27 Å²	27	45.8 Å²	45.8	16%	0.164	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.7	-171	-57.8	0	0	0	0	111.5	G868 D870 R1210	G868-V1017 CarbonylContact C-O 3.5Å; G868-V1017 VanDerWaalsContact CA-O 3.28Å; G868-V1017 WeakPolarHBondContact CA-O 2.96Å; G868-V1017 PolarHBondContact O-N 3.41Å; D870-V1017 HydrophobicContact CB-CG1 4.08Å; V1017-R1210 HydrophobicContact CG1-CG 4.13Å
1018	A	78.7	Confident	79	Confident	13 Å²	13	47.1 Å²	47.1	11%	0.107	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-62.7	156.4	169.4	0	0	0	0	0	111.6	C1022 L1024 N1171 V1209	A1018-C1022 HydrophobicContact CB-CB 4.34Å; A1018-C1022 WeakPolarHBondContact CB-O 3.22Å; A1018-L1024 HydrophobicContact CB-CD2 3.84Å; A1018-L1024 HydrophobicContact CB-CG 3.88Å; A1018-N1171 WeakPolarHBondContact CA-OD1 3.3Å; A1018-V1209 PolarHBondContact N-O 3.17Å
1019	R	73.1	Confident	79.6	Confident	118 Å²	118	39.9 Å²	39.9	45%	0.445	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-58.3	147.1	165.2	179.9	179	173.4	129.3	3	108.9	G1021 C1022 Y1160 N1171	R1019-G1021 PolarHBondContact O-N 3.41Å; R1019-C1022 HydrophobicContact CB-CB 4.21Å; R1019-C1022 WeakPolarHBondContact O-CA 3.47Å; R1019-C1022 VanDerWaalsContact O-CB 3.26Å; R1019-C1022 WeakPolarHBondContact O-CB 3.35Å; R1019-C1022 PolarHBondContact O-N 3Å; R1019-Y1160 PolarHBondContact NH1-OH 2.89Å; R1019-N1171 HydrophobicContact CB-CB 4.43Å; R1019-N1171 PolarHBondContact N-OD1 3.07Å
1020	H	71.7	Confident	80.2	Confident	166 Å²	166	32.6 Å²	32.6	77%	0.769	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	131.9	174.5	-172.2	72.9	0	0	0	111.4	C1022	H1020-C1022 VanDerWaalsContact C-N 3.28Å
1021	G	71.6	Confident	80.9	Confident	38 Å²	38	34.6 Å²	34.6	39%	0.392	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	20.6	-172.3	0	0	0	0	0	113.4	R1019 I1173 D1174	R1019-G1021 PolarHBondContact O-N 3.41Å; G1021-I1173 CarbonylContact O-C 3.43Å; G1021-I1173 WeakPolarHBondContact O-CA 3.34Å; G1021-D1174 WeakPolarHBondContact O-CB 3.28Å; G1021-D1174 PolarHBondContact O-N 3.43Å
1022	C	74.6	Confident	81.3	Confident	16 Å²	16	32.1 Å²	32.1	11%	0.108	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	162	173.9	-57.3	0	0	0	0	113.2	A1018 R1019 H1020 N1171 H1172	A1018-C1022 HydrophobicContact CB-CB 4.34Å; A1018-C1022 WeakPolarHBondContact CB-O 3.22Å; R1019-C1022 HydrophobicContact CB-CB 4.21Å; R1019-C1022 WeakPolarHBondContact O-CA 3.47Å; R1019-C1022 VanDerWaalsContact O-CB 3.26Å; R1019-C1022 WeakPolarHBondContact O-CB 3.35Å; R1019-C1022 PolarHBondContact O-N 3Å; H1020-C1022 VanDerWaalsContact C-N 3.28Å; C1022-N1171 HydrophobicContact CB-CB 4.06Å; C1022-H1172 CarbonylContact C-O 3.46Å; C1022-H1172 WeakPolarHBondContact CA-O 3.49Å; C1022-H1172 WeakPolarHBondContact CB-O 3.41Å
1023	I	75.1	Confident	81.5	Confident	23 Å²	23	35.4 Å²	35.4	12%	0.118	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	153.4	165.8	60.7	174.3	0	0	0	110.5	C1170 N1171 H1172 V1207	I1023-C1170 VanDerWaalsContact O-O 3.04Å; I1023-N1171 WeakPolarHBondContact O-CA 3.44Å; I1023-H1172 HydrophobicContact CG1-CB 4.08Å; I1023-H1172 PolarHBondContact N-O 3.33Å; I1023-H1172 PolarHBondContact O-N 3.21Å; I1023-V1207 HydrophobicContact CD1-CB 4.33Å; I1023-V1207 HydrophobicContact CD1-CG1 4.49Å
1024	L	79.9	Confident	81.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.6	167.5	-58.7	-178.9	0	0	0	108.7	V1016 A1018 I1169 C1170 V1207 G1208 W1211 M1214	V1016-L1024 HydrophobicContact CG1-CD1 4.49Å; A1018-L1024 HydrophobicContact CB-CD2 3.84Å; A1018-L1024 HydrophobicContact CB-CG 3.88Å; L1024-I1169 HydrophobicContact CB-CG2 4.02Å; L1024-I1169 HydrophobicContact CD1-CG2 4.38Å; L1024-I1169 HydrophobicContact CD2-CG2 3.65Å; L1024-I1169 HydrophobicContact CG-CG2 4.22Å; L1024-C1170 WeakPolarHBondContact CA-O 3.18Å; L1024-V1207 VanDerWaalsContact O-CA 3.26Å; L1024-V1207 WeakPolarHBondContact O-CA 3.5Å; L1024-G1208 WeakPolarHBondContact CA-O 3.03Å; L1024-G1208 VanDerWaalsContact CB-O 3.3Å; L1024-G1208 WeakPolarHBondContact CB-O 3.45Å; L1024-G1208 PolarHBondContact N-O 3.07Å; L1024-G1208 PolarHBondContact O-N 3.34Å; L1024-W1211 HydrophobicContact CD1-CB 3.97Å; L1024-M1214 HydrophobicContact CB-SD 4.24Å
1025	L	77.6	Confident	81.8	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.3	168.5	-178.7	154.5	0	0	0	108.8	A1027 I1169 C1170 E1184 I1205 K1206 V1207	L1025-A1027 HydrophobicContact CD2-CB 4.2Å; L1025-I1169 CarbonylContact O-C 3.49Å; L1025-I1169 WeakPolarHBondContact O-CA 3.24Å; L1025-C1170 HydrophobicContact CB-CB 4.5Å; L1025-C1170 PolarHBondContact N-O 2.87Å; L1025-C1170 VanDerWaalsContact N-O 3.08Å; L1025-C1170 PolarHBondContact O-N 2.68Å; L1025-E1184 HydrophobicContact CD1-CB 4.42Å; L1025-E1184 HydrophobicContact CD1-CG 3.65Å; L1025-I1205 HydrophobicContact CD1-CG2 4.45Å; L1025-I1205 HydrophobicContact CG-CG2 4.2Å; L1025-K1206 CarbonylContact C-O 3.52Å; L1025-V1207 HydrophobicContact CB-CG1 4.47Å; L1025-V1207 HydrophobicContact CG-CG1 4.38Å
1026	S	80.5	Confident	82.1	Confident	7 Å²	7	32.3 Å²	32.3	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.2	-179.5	155.6	0	0	0	0	110	V1167 I1168 I1205 K1206	S1026-V1167 WeakPolarHBondContact OG-CG1 3.06Å; S1026-I1168 WeakPolarHBondContact CA-O 3.38Å; S1026-I1205 CarbonylContact O-C 3.6Å; S1026-I1205 WeakPolarHBondContact O-CA 3.25Å; S1026-K1206 PolarHBondContact N-O 2.85Å; S1026-K1206 PolarHBondContact O-N 3.19Å
1027	A	79.5	Confident	82.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.5	175.1	0	0	0	0	0	111	L1025 V1167 I1168 M1191 V1203 I1205	L1025-A1027 HydrophobicContact CD2-CB 4.2Å; A1027-V1167 WeakPolarHBondContact O-CA 3.49Å; A1027-I1168 PolarHBondContact N-O 3.19Å; A1027-I1168 PolarHBondContact O-N 3.48Å; A1027-M1191 HydrophobicContact CB-CE 4.43Å; A1027-M1191 HydrophobicContact CB-SD 3.31Å; A1027-M1191 WeakPolarHBondContact CB-SD 3.37Å; A1027-V1203 HydrophobicContact CB-CG1 4.05Å; A1027-I1205 HydrophobicContact CB-CG1 4.19Å
1028	D	81.8	Confident	82.6	Confident	62 Å²	62	31.9 Å²	31.9	33%	0.332	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.7	-176	-168	12.4	0	0	0	111.1	S1030 S1166 V1167 V1203 K1204	D1028-S1030 PolarHBondContact O-N 3.01Å; D1028-S1166 WeakPolarHBondContact OD1-CB 3.34Å; D1028-V1167 HydrophobicContact CB-CG2 4.09Å; D1028-V1203 WeakPolarHBondContact O-CA 3.41Å; D1028-K1204 PolarHBondContact N-O 3.39Å; D1028-K1204 PolarHBondContact O-N 3.27Å
1029	F	85.6	Confident	83.3	Confident	11 Å²	11	33 Å²	33	5%	0.048	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	126.1	176.6	-74.5	-72.1	0	0	0	111	Q1031 L1032 I1143 F1144 A1147 M1191 A1194 L1201 V1203	F1029-Q1031 PolarHBondContact O-N 3.1Å; F1029-L1032 HydrophobicContact CB-CB 3.72Å; F1029-L1032 HydrophobicContact CB-CD1 4.39Å; F1029-L1032 HydrophobicContact CB-CD2 4.24Å; F1029-L1032 HydrophobicContact CB-CG 4.33Å; F1029-L1032 HydrophobicContact CD1-CD1 4.44Å; F1029-L1032 HydrophobicContact CD2-CD2 3.78Å; F1029-L1032 HydrophobicContact CE2-CD2 4.38Å; F1029-L1032 HydrophobicContact CG-CB 4.39Å; F1029-L1032 HydrophobicContact CG-CD1 4.23Å; F1029-L1032 HydrophobicContact CG-CD2 4.14Å; F1029-L1032 HydrophobicContact CG-CG 4.49Å; F1029-I1143 HydrophobicContact CE2-CG2 4.24Å; F1029-I1143 HydrophobicContact CZ-CG2 4.05Å; F1029-F1144 HydrophobicContact CD2-CD2 4.37Å; F1029-F1144 HydrophobicContact CE2-CD2 4.3Å; F1029-A1147 HydrophobicContact CE2-CB 3.86Å; F1029-A1147 HydrophobicContact CZ-CB 3.86Å; F1029-M1191 HydrophobicContact CD2-CE 3.78Å; F1029-M1191 HydrophobicContact CE1-CB 4.19Å; F1029-M1191 HydrophobicContact CE1-CE 4.38Å; F1029-M1191 VanDerWaalsContact CE1-O 3.28Å; F1029-M1191 WeakPolarHBondContact CE1-O 3.48Å; F1029-M1191 HydrophobicContact CE2-CE 3.56Å; F1029-M1191 HydrophobicContact CG-CE 4.3Å; F1029-M1191 HydrophobicContact CZ-CB 4.04Å; F1029-M1191 HydrophobicContact CZ-CE 3.9Å; F1029-M1191 VanDerWaalsContact CZ-O 3.3Å; F1029-M1191 WeakPolarHBondContact CZ-O 3.08Å; F1029-A1194 HydrophobicContact CZ-CB 4.42Å; F1029-L1201 HydrophobicContact CD1-CB 4.45Å; F1029-L1201 HydrophobicContact CD1-CD2 4.46Å; F1029-L1201 HydrophobicContact CE1-CB 4.18Å; F1029-L1201 HydrophobicContact CE1-CD1 4.05Å; F1029-L1201 HydrophobicContact CE1-CD2 4.46Å; F1029-L1201 HydrophobicContact CE1-CG 4.48Å; F1029-V1203 HydrophobicContact CD1-CG2 3.75Å; F1029-V1203 HydrophobicContact CE1-CG2 3.78Å
1030	S	84.8	Confident	84.2	Confident	18 Å²	18	29.8 Å²	29.8	13%	0.126	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	102.9	174.6	-168.9	0	0	0	0	110	D1028 L1032 R1035 V1202 K1204	D1028-S1030 PolarHBondContact O-N 3.01Å; S1030-L1032 PolarHBondContact O-N 3.03Å; S1030-R1035 PolarHBondContact O-NE 3.47Å; S1030-V1202 WeakPolarHBondContact CB-O 3.1Å; S1030-V1202 PolarHBondContact N-O 3.47Å; S1030-K1204 WeakPolarHBondContact OG-CE 3.45Å
1031	Q	86.7	Confident	85.2	Confident	65 Å²	65	22.8 Å²	22.8	30%	0.304	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	41.9	173.1	-48.9	174.5	6.4	0	0	113.8	F1029 E1033 L1034 R1035	F1029-Q1031 PolarHBondContact O-N 3.1Å; Q1031-E1033 PolarHBondContact O-N 3.29Å; Q1031-L1034 HydrophobicContact CB-CB 4.16Å; Q1031-L1034 WeakPolarHBondContact O-CB 3.12Å; Q1031-L1034 PolarHBondContact O-N 3.16Å; Q1031-R1035 PolarHBondContact O-N 3.45Å
1032	L	89.2	Confident	85.9	Confident	16 Å²	16	22.3 Å²	22.3	8%	0.084	12%	0.122	C	C	.	.	H	α-helix	trans	-49	-49.2	-176.1	-175.8	56.6	0	0	0	114.1	F1029 S1030 L1034 R1035 I1036 A1140 I1143 L1201	F1029-L1032 HydrophobicContact CB-CB 3.72Å; F1029-L1032 HydrophobicContact CB-CD1 4.39Å; F1029-L1032 HydrophobicContact CB-CD2 4.24Å; F1029-L1032 HydrophobicContact CB-CG 4.33Å; F1029-L1032 HydrophobicContact CD1-CD1 4.44Å; F1029-L1032 HydrophobicContact CD2-CD2 3.78Å; F1029-L1032 HydrophobicContact CE2-CD2 4.38Å; F1029-L1032 HydrophobicContact CG-CB 4.39Å; F1029-L1032 HydrophobicContact CG-CD1 4.23Å; F1029-L1032 HydrophobicContact CG-CD2 4.14Å; F1029-L1032 HydrophobicContact CG-CG 4.49Å; S1030-L1032 PolarHBondContact O-N 3.03Å; L1032-L1034 VanDerWaalsContact C-N 3.27Å; L1032-L1034 PolarHBondContact O-N 2.93Å; L1032-R1035 PolarHBondContact O-N 3.4Å; L1032-I1036 HydrophobicContact CD1-CD1 4.14Å; L1032-I1036 HydrophobicContact CD1-CG1 4.43Å; L1032-I1036 HydrophobicContact CG-CD1 3.92Å; L1032-I1036 WeakPolarHBondContact O-CG1 3.16Å; L1032-I1036 PolarHBondContact O-N 3.22Å; L1032-A1140 HydrophobicContact CD2-CB 3.89Å; L1032-A1140 HydrophobicContact CG-CB 4.13Å; L1032-I1143 HydrophobicContact CD1-CD1 4.34Å; L1032-I1143 HydrophobicContact CD1-CG2 4.18Å; L1032-L1201 HydrophobicContact CD1-CD2 3.58Å
1033	E	89.5	Confident	86.7	Confident	68 Å²	68	22.2 Å²	22.2	32%	0.318	12%	0.121	S	C	.	.	H	α-helix	trans	-61.7	-36.2	-179.2	-68.8	-174.3	-172.4	0	0	112.3	R995 Q1031 I1036 I1037 V1136 A1140	R995-E1033 IonicContact CZ-OE1 3.05Å; R995-E1033 IonicContact NH2-OE1 3.66Å; R995-E1033 PolarHBondContact NH2-OE1 3.36Å; Q1031-E1033 PolarHBondContact O-N 3.29Å; E1033-I1036 PolarHBondContact O-N 2.81Å; E1033-I1037 VanDerWaalsContact O-CG1 3.28Å; E1033-I1037 WeakPolarHBondContact O-CG1 3.46Å; E1033-I1037 PolarHBondContact O-N 3.23Å; E1033-V1136 HydrophobicContact CB-CG1 3.75Å; E1033-V1136 HydrophobicContact CG-CG1 4.04Å; E1033-A1140 HydrophobicContact CG-CB 3.99Å
1034	L	88.7	Confident	87.3	Confident	11 Å²	11	25.7 Å²	25.7	6%	0.058	15%	0.145	C	C	.	.	H	α-helix	trans	-70.8	-37.5	177.8	-170.1	57.4	0	0	0	111.5	Q1031 L1032 I1036 I1037 A1038 L1046 L1050 I1056 F1057 L1084	Q1031-L1034 HydrophobicContact CB-CB 4.16Å; Q1031-L1034 WeakPolarHBondContact O-CB 3.12Å; Q1031-L1034 PolarHBondContact O-N 3.16Å; L1032-L1034 VanDerWaalsContact C-N 3.27Å; L1032-L1034 PolarHBondContact O-N 2.93Å; L1034-I1036 VanDerWaalsContact C-N 3.34Å; L1034-I1037 PolarHBondContact O-N 3.35Å; L1034-A1038 WeakPolarHBondContact O-CB 3.34Å; L1034-A1038 PolarHBondContact O-N 2.66Å; L1034-L1046 HydrophobicContact CD1-CD1 4.14Å; L1034-L1046 HydrophobicContact CD1-CD2 4.31Å; L1034-L1046 HydrophobicContact CG-CD1 4.38Å; L1034-L1050 HydrophobicContact CD2-CD2 4.27Å; L1034-L1050 HydrophobicContact CG-CD1 4.36Å; L1034-L1050 HydrophobicContact CG-CD2 4.32Å; L1034-I1056 HydrophobicContact CD2-CB 4.24Å; L1034-I1056 HydrophobicContact CD2-CD1 3.45Å; L1034-I1056 VanDerWaalsContact CD2-CD1 3.45Å; L1034-I1056 HydrophobicContact CD2-CG1 4.44Å; L1034-I1056 HydrophobicContact CD2-CG2 4.13Å; L1034-I1056 HydrophobicContact CG-CD1 4.31Å; L1034-F1057 HydrophobicContact CD2-CZ 4.13Å; L1034-L1084 HydrophobicContact CD1-CD1 3.69Å; L1034-L1084 HydrophobicContact CD1-CD2 3.55Å; L1034-L1084 HydrophobicContact CD1-CG 4.29Å
1035	R	91.3	Very high	87.6	Confident	12 Å²	12	30.1 Å²	30.1	5%	0.045	16%	0.164	C	C	.	.	H	α-helix	trans	-65	-38.3	173.5	-65.6	178.8	-175.5	-76.1	-11.8	112	S1030 Q1031 L1032 A1038 H1039 L1050 V1199 A1200	S1030-R1035 PolarHBondContact O-NE 3.47Å; Q1031-R1035 PolarHBondContact O-N 3.45Å; L1032-R1035 PolarHBondContact O-N 3.4Å; R1035-A1038 PolarHBondContact O-N 3.26Å; R1035-H1039 WeakPolarHBondContact O-CB 3.48Å; R1035-H1039 PolarHBondContact O-N 3.29Å; R1035-L1050 HydrophobicContact CG-CD1 4.18Å; R1035-L1050 HydrophobicContact CG-CD2 3.96Å; R1035-L1050 PolarHBondContact NH1-O 2.98Å; R1035-V1199 HydrophobicContact CB-CG1 4.43Å; R1035-V1199 HydrophobicContact CG-CG1 4.17Å; R1035-A1200 WeakPolarHBondContact CD-O 3.47Å; R1035-A1200 PolarHBondContact NH1-O 3.17Å
1036	I	92.2	Very high	88.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-46.3	172.9	-70.1	164.2	0	0	0	110.6	L1032 E1033 L1034 A1038 H1039 L1040 I1110 V1136 A1140 I1143 L1197	L1032-I1036 HydrophobicContact CD1-CD1 4.14Å; L1032-I1036 HydrophobicContact CD1-CG1 4.43Å; L1032-I1036 HydrophobicContact CG-CD1 3.92Å; L1032-I1036 WeakPolarHBondContact O-CG1 3.16Å; L1032-I1036 PolarHBondContact O-N 3.22Å; E1033-I1036 PolarHBondContact O-N 2.81Å; L1034-I1036 VanDerWaalsContact C-N 3.34Å; I1036-A1038 VanDerWaalsContact C-N 3.31Å; I1036-A1038 PolarHBondContact O-N 3.23Å; I1036-H1039 PolarHBondContact O-N 2.75Å; I1036-L1040 HydrophobicContact CG2-CD1 3.62Å; I1036-L1040 HydrophobicContact CG2-CG 4.22Å; I1036-L1040 WeakPolarHBondContact O-CB 3.23Å; I1036-L1040 VanDerWaalsContact O-CG 3.26Å; I1036-L1040 WeakPolarHBondContact O-CG 3.29Å; I1036-L1040 PolarHBondContact O-N 3.18Å; I1036-I1110 HydrophobicContact CG1-CD1 4.49Å; I1036-I1110 HydrophobicContact CG2-CD1 4.07Å; I1036-V1136 HydrophobicContact CG2-CG1 4.39Å; I1036-A1140 VanDerWaalsContact CD1-CA 3.41Å; I1036-A1140 HydrophobicContact CD1-CB 3.62Å; I1036-A1140 VanDerWaalsContact CD1-N 3.34Å; I1036-I1143 HydrophobicContact CD1-CD1 4.04Å; I1036-I1143 HydrophobicContact CG1-CD1 4.09Å; I1036-L1197 HydrophobicContact CG1-CD1 4.34Å
1037	I	91.5	Very high	88.5	Confident	21 Å²	21	31.3 Å²	31.3	11%	0.108	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-44.2	175.7	-70.3	165.9	0	0	0	110.6	E1033 L1034 L1040 S1041 L1046 L1084 V1090 W1093 V1136	E1033-I1037 VanDerWaalsContact O-CG1 3.28Å; E1033-I1037 WeakPolarHBondContact O-CG1 3.46Å; E1033-I1037 PolarHBondContact O-N 3.23Å; L1034-I1037 PolarHBondContact O-N 3.35Å; I1037-L1040 PolarHBondContact O-N 3.04Å; I1037-S1041 VanDerWaalsContact O-CB 3.23Å; I1037-S1041 WeakPolarHBondContact O-CB 3.29Å; I1037-S1041 PolarHBondContact O-N 3.4Å; I1037-S1041 PolarHBondContact O-OG 3.26Å; I1037-L1046 HydrophobicContact CG2-CD2 4.26Å; I1037-L1084 HydrophobicContact CD1-CD1 3.67Å; I1037-V1090 HydrophobicContact CG2-CB 4.45Å; I1037-V1090 HydrophobicContact CG2-CG1 3.79Å; I1037-V1090 HydrophobicContact CG2-CG2 3.82Å; I1037-W1093 HydrophobicContact CG1-CZ3 4.47Å; I1037-V1136 HydrophobicContact CD1-CG1 4.17Å; I1037-V1136 HydrophobicContact CD1-CG2 4.32Å; I1037-V1136 HydrophobicContact CG1-CG1 3.97Å; I1037-V1136 HydrophobicContact CG1-CG2 3.72Å
1038	A	90.8	Very high	88.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-43	177.1	0	0	0	0	0	112.4	L1034 R1035 I1036 S1041 G1042 L1046 M1047 L1050 V1199	L1034-A1038 WeakPolarHBondContact O-CB 3.34Å; L1034-A1038 PolarHBondContact O-N 2.66Å; R1035-A1038 PolarHBondContact O-N 3.26Å; I1036-A1038 VanDerWaalsContact C-N 3.31Å; I1036-A1038 PolarHBondContact O-N 3.23Å; A1038-S1041 PolarHBondContact O-OG 3.34Å; A1038-G1042 WeakPolarHBondContact O-CA 3.38Å; A1038-G1042 PolarHBondContact O-N 2.82Å; A1038-L1046 HydrophobicContact CB-CD2 3.78Å; A1038-L1046 HydrophobicContact CB-CG 3.79Å; A1038-M1047 HydrophobicContact CB-CG 4.09Å; A1038-L1050 HydrophobicContact CB-CD1 3.42Å; A1038-L1050 VanDerWaalsContact CB-CD1 3.42Å; A1038-V1199 HydrophobicContact CB-CG2 3.82Å
1039	H	93.5	Very high	89.1	Confident	37 Å²	37	31.2 Å²	31.2	17%	0.171	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-45.1	175.5	169.9	70.5	0	0	0	112.8	R1035 I1036 L1197 K1198	R1035-H1039 WeakPolarHBondContact O-CB 3.48Å; R1035-H1039 PolarHBondContact O-N 3.29Å; I1036-H1039 PolarHBondContact O-N 2.75Å; H1039-L1197 HydrophobicContact CB-CB 4.3Å; H1039-L1197 HydrophobicContact CB-CD2 4.38Å; H1039-K1198 PolarHBondContact ND1-N 3.48Å; H1039-K1198 VanDerWaalsContact ND1-N 3.11Å
1040	L	92.3	Very high	89.2	Confident	49 Å²	49	30.9 Å²	30.9	26%	0.257	17%	0.172	S	C	.	.	H	α-helix	trans	-76.1	-38.8	-176	-69.1	174.2	0	0	0	112.9	I1036 I1037 W1093 I1110 T1135	I1036-L1040 HydrophobicContact CG2-CD1 3.62Å; I1036-L1040 HydrophobicContact CG2-CG 4.22Å; I1036-L1040 WeakPolarHBondContact O-CB 3.23Å; I1036-L1040 VanDerWaalsContact O-CG 3.26Å; I1036-L1040 WeakPolarHBondContact O-CG 3.29Å; I1036-L1040 PolarHBondContact O-N 3.18Å; I1037-L1040 PolarHBondContact O-N 3.04Å; L1040-W1093 HydrophobicContact CB-CD2 4.33Å; L1040-W1093 HydrophobicContact CB-CZ2 4.05Å; L1040-W1093 HydrophobicContact CD1-CH2 4.35Å; L1040-W1093 HydrophobicContact CD1-CZ2 3.63Å; L1040-W1093 HydrophobicContact CG-CZ2 4.49Å; L1040-I1110 HydrophobicContact CD2-CD1 4.27Å; L1040-I1110 HydrophobicContact CD2-CG1 3.98Å; L1040-I1110 HydrophobicContact CG-CD1 4.46Å; L1040-T1135 HydrophobicContact CD1-CG2 3.64Å
1041	S	91.7	Very high	89.2	Confident	20 Å²	20	34 Å²	34	14%	0.14	19%	0.186	C	C	.	.	H	α-helix	trans	-74.8	-29.8	176.1	59.9	0	0	0	0	113.1	I1037 A1038 D1043 G1089	I1037-S1041 VanDerWaalsContact O-CB 3.23Å; I1037-S1041 WeakPolarHBondContact O-CB 3.29Å; I1037-S1041 PolarHBondContact O-N 3.4Å; I1037-S1041 PolarHBondContact O-OG 3.26Å; A1038-S1041 PolarHBondContact O-OG 3.34Å; S1041-D1043 PolarHBondContact O-N 3.1Å; S1041-D1043 PolarHBondContact OG-N 2.91Å; S1041-G1089 WeakPolarHBondContact CB-O 3.35Å
1042	G	88.1	Confident	89.1	Confident	27 Å²	27	36.1 Å²	36.1	28%	0.278	20%	0.2	S	C	.	.			trans	63.2	21.5	-173.2	0	0	0	0	0	113.3	A1038 P1044 M1047	A1038-G1042 WeakPolarHBondContact O-CA 3.38Å; A1038-G1042 PolarHBondContact O-N 2.82Å; G1042-P1044 WeakPolarHBondContact O-CD 3.43Å; G1042-M1047 WeakPolarHBondContact O-CE 3.28Å
1043	D	91.4	Very high	88.6	Confident	14 Å²	14	38.5 Å²	38.5	8%	0.075	23%	0.229	C	C	.	.			trans	-68.1	116	-179	-174.4	-77.1	0	0	0	110.7	S1041 K1045 L1046 M1047 G1089	S1041-D1043 PolarHBondContact O-N 3.1Å; S1041-D1043 PolarHBondContact OG-N 2.91Å; D1043-K1045 VanDerWaalsContact C-N 3.34Å; D1043-K1045 PolarHBondContact O-N 3.09Å; D1043-K1045 PolarHBondContact OD1-N 2.93Å; D1043-K1045 VanDerWaalsContact OD1-N 3.12Å; D1043-L1046 HydrophobicContact CB-CB 4.04Å; D1043-L1046 PolarHBondContact O-N 3.18Å; D1043-L1046 PolarHBondContact OD1-N 2.79Å; D1043-M1047 WeakPolarHBondContact O-CB 3.46Å; D1043-M1047 VanDerWaalsContact O-CG 3.23Å; D1043-M1047 WeakPolarHBondContact O-CG 3.48Å; D1043-M1047 PolarHBondContact O-N 2.86Å; D1043-G1089 WeakPolarHBondContact OD2-CA 3.33Å; D1043-G1089 PolarHBondContact OD2-N 3.1Å
1044	P	86.6	Confident	88.1	Confident	96 Å²	96	39.6 Å²	39.6	62%	0.623	23%	0.234	S	C	*	.	H	α-helix	trans	-65.8	-34.3	-171.7	24.8	-33.4	0	0	0	113	G1042 S1048	G1042-P1044 WeakPolarHBondContact O-CD 3.43Å; P1044-S1048 WeakPolarHBondContact O-CB 3.43Å; P1044-S1048 PolarHBondContact O-N 3Å; P1044-S1048 PolarHBondContact O-OG 3.32Å
1045	K	86.1	Confident	87.8	Confident	93 Å²	93	41.8 Å²	41.8	40%	0.404	25%	0.246	S	C	.	.	H	α-helix	trans	-71.4	-42.4	-179.9	-169.2	178.2	-177.8	-178.3	0	110.3	D1043 S1048 L1049 F1059 E1063 F1087	D1043-K1045 VanDerWaalsContact C-N 3.34Å; D1043-K1045 PolarHBondContact O-N 3.09Å; D1043-K1045 PolarHBondContact OD1-N 2.93Å; D1043-K1045 VanDerWaalsContact OD1-N 3.12Å; K1045-S1048 PolarHBondContact O-OG 3.27Å; K1045-L1049 HydrophobicContact CG-CD1 4.36Å; K1045-L1049 WeakPolarHBondContact O-CB 3.48Å; K1045-L1049 WeakPolarHBondContact O-CG 3.25Å; K1045-L1049 PolarHBondContact O-N 3.2Å; K1045-L1049 VanDerWaalsContact O-N 3.09Å; K1045-F1059 VanDerWaalsContact CE-CE1 3.41Å; K1045-F1059 VanDerWaalsContact NZ-CZ 3.34Å; K1045-E1063 IonicContact NZ-OE1 3.76Å; K1045-E1063 PolarHBondContact NZ-OE1 3.47Å; K1045-F1087 HydrophobicContact CB-CD1 4.4Å; K1045-F1087 HydrophobicContact CB-CE1 4.3Å; K1045-F1087 HydrophobicContact CD-CE1 4.26Å; K1045-F1087 HydrophobicContact CG-CE1 4.13Å
1046	L	88.1	Confident	87.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-41.4	175.9	-177.3	59.5	0	0	0	111.8	L1034 I1037 A1038 D1043 L1050 I1056 F1087 V1090	L1034-L1046 HydrophobicContact CD1-CD1 4.14Å; L1034-L1046 HydrophobicContact CD1-CD2 4.31Å; L1034-L1046 HydrophobicContact CG-CD1 4.38Å; I1037-L1046 HydrophobicContact CG2-CD2 4.26Å; A1038-L1046 HydrophobicContact CB-CD2 3.78Å; A1038-L1046 HydrophobicContact CB-CG 3.79Å; D1043-L1046 HydrophobicContact CB-CB 4.04Å; D1043-L1046 PolarHBondContact O-N 3.18Å; D1043-L1046 PolarHBondContact OD1-N 2.79Å; L1046-L1050 HydrophobicContact CD1-CD1 4.26Å; L1046-L1050 HydrophobicContact CG-CD1 4.17Å; L1046-L1050 WeakPolarHBondContact O-CG 3.18Å; L1046-L1050 PolarHBondContact O-N 2.8Å; L1046-L1050 VanDerWaalsContact O-N 3.14Å; L1046-I1056 HydrophobicContact CD1-CD1 4.26Å; L1046-I1056 HydrophobicContact CD1-CG2 4.02Å; L1046-F1087 HydrophobicContact CB-CD1 3.98Å; L1046-F1087 HydrophobicContact CB-CE1 4.1Å; L1046-F1087 HydrophobicContact CB-CG 4.31Å; L1046-F1087 HydrophobicContact CD1-CD2 4.43Å; L1046-F1087 HydrophobicContact CD1-CE1 4.47Å; L1046-F1087 HydrophobicContact CD1-CE2 4.01Å; L1046-F1087 HydrophobicContact CD1-CZ 4.05Å; L1046-V1090 HydrophobicContact CD2-CG2 3.79Å
1047	M	89.2	Confident	87	Confident	38 Å²	38	42.7 Å²	42.7	19%	0.187	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-42.9	177	-69.6	-170.4	-63.5	0	0	112	A1038 G1042 D1043 L1050 N1051 K1198 V1199	A1038-M1047 HydrophobicContact CB-CG 4.09Å; G1042-M1047 WeakPolarHBondContact O-CE 3.28Å; D1043-M1047 WeakPolarHBondContact O-CB 3.46Å; D1043-M1047 VanDerWaalsContact O-CG 3.23Å; D1043-M1047 WeakPolarHBondContact O-CG 3.48Å; D1043-M1047 PolarHBondContact O-N 2.86Å; M1047-L1050 PolarHBondContact O-N 3.38Å; M1047-N1051 WeakPolarHBondContact O-CB 3.15Å; M1047-N1051 PolarHBondContact O-N 2.96Å; M1047-N1051 VanDerWaalsContact O-N 3.11Å; M1047-N1051 PolarHBondContact O-ND2 3.31Å; M1047-K1198 HydrophobicContact SD-CB 4.14Å; M1047-V1199 HydrophobicContact CB-CG2 3.93Å; M1047-V1199 HydrophobicContact CG-CG2 3.5Å; M1047-V1199 HydrophobicContact SD-CG2 4.16Å
1048	S	86.3	Confident	86.6	Confident	51 Å²	51	42.4 Å²	42.4	36%	0.357	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-48.3	177.4	69.5	0	0	0	0	111.3	P1044 K1045 L1050 N1051 D1052	P1044-S1048 WeakPolarHBondContact O-CB 3.43Å; P1044-S1048 PolarHBondContact O-N 3Å; P1044-S1048 PolarHBondContact O-OG 3.32Å; K1045-S1048 PolarHBondContact O-OG 3.27Å; S1048-L1050 VanDerWaalsContact C-N 3.29Å; S1048-L1050 PolarHBondContact O-N 3.36Å; S1048-N1051 PolarHBondContact O-N 2.89Å; S1048-D1052 WeakPolarHBondContact O-CB 3.31Å; S1048-D1052 PolarHBondContact O-N 3.36Å
1049	L	86.9	Confident	86.3	Confident	9 Å²	9	43.9 Å²	43.9	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-57.7	-39	179.1	-70.6	171	0	0	0	112.9	K1045 G1053 Q1054 I1056 F1059 F1087	K1045-L1049 HydrophobicContact CG-CD1 4.36Å; K1045-L1049 WeakPolarHBondContact O-CB 3.48Å; K1045-L1049 WeakPolarHBondContact O-CG 3.25Å; K1045-L1049 PolarHBondContact O-N 3.2Å; K1045-L1049 VanDerWaalsContact O-N 3.09Å; L1049-G1053 PolarHBondContact O-N 3.29Å; L1049-Q1054 HydrophobicContact CD2-CB 4.12Å; L1049-Q1054 PolarHBondContact O-N 2.8Å; L1049-Q1054 VanDerWaalsContact O-N 3.08Å; L1049-I1056 HydrophobicContact CB-CG1 3.91Å; L1049-F1059 HydrophobicContact CD1-CD1 3.72Å; L1049-F1059 HydrophobicContact CD1-CE1 4.08Å; L1049-F1059 HydrophobicContact CD1-CG 4.07Å; L1049-F1059 HydrophobicContact CD2-CD2 4.31Å; L1049-F1059 HydrophobicContact CD2-CG 4.34Å; L1049-F1087 HydrophobicContact CD1-CE1 4.08Å; L1049-F1087 HydrophobicContact CD1-CZ 3.99Å
1050	L	87.4	Confident	85.8	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-72.1	-36.2	178.5	-81	166.4	0	0	0	113.9	L1034 R1035 A1038 L1046 M1047 S1048 I1056 V1199	L1034-L1050 HydrophobicContact CD2-CD2 4.27Å; L1034-L1050 HydrophobicContact CG-CD1 4.36Å; L1034-L1050 HydrophobicContact CG-CD2 4.32Å; R1035-L1050 HydrophobicContact CG-CD1 4.18Å; R1035-L1050 HydrophobicContact CG-CD2 3.96Å; R1035-L1050 PolarHBondContact NH1-O 2.98Å; A1038-L1050 HydrophobicContact CB-CD1 3.42Å; A1038-L1050 VanDerWaalsContact CB-CD1 3.42Å; L1046-L1050 HydrophobicContact CD1-CD1 4.26Å; L1046-L1050 HydrophobicContact CG-CD1 4.17Å; L1046-L1050 WeakPolarHBondContact O-CG 3.18Å; L1046-L1050 PolarHBondContact O-N 2.8Å; L1046-L1050 VanDerWaalsContact O-N 3.14Å; M1047-L1050 PolarHBondContact O-N 3.38Å; S1048-L1050 VanDerWaalsContact C-N 3.29Å; S1048-L1050 PolarHBondContact O-N 3.36Å; L1050-I1056 HydrophobicContact CB-CD1 4.43Å; L1050-I1056 HydrophobicContact CD1-CD1 4.39Å; L1050-I1056 HydrophobicContact CD2-CD1 3.18Å; L1050-I1056 HydrophobicContact CG-CD1 3.38Å; L1050-V1199 HydrophobicContact CB-CG1 3.66Å; L1050-V1199 HydrophobicContact CD1-CG1 4.04Å; L1050-V1199 HydrophobicContact CG-CG1 4.45Å
1051	N	86.3	Confident	85.4	Confident	82 Å²	82	40 Å²	40	44%	0.439	24%	0.238	S	C	.	.	H	α-helix	trans	-77.7	-34	178.9	-73.9	-26	0	0	0	111.3	M1047 S1048 G1053 V1199 A1200	M1047-N1051 WeakPolarHBondContact O-CB 3.15Å; M1047-N1051 PolarHBondContact O-N 2.96Å; M1047-N1051 VanDerWaalsContact O-N 3.11Å; M1047-N1051 PolarHBondContact O-ND2 3.31Å; S1048-N1051 PolarHBondContact O-N 2.89Å; N1051-G1053 PolarHBondContact O-N 3.41Å; N1051-V1199 WeakPolarHBondContact OD1-CG1 3.45Å; N1051-A1200 PolarHBondContact OD1-N 3.24Å
1052	D	84.1	Confident	85	Confident	111 Å²	111	40 Å²	40	59%	0.594	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.5	175.9	-63.5	-19.1	0	0	0	112.9	S1048 Q1054	S1048-D1052 WeakPolarHBondContact O-CB 3.31Å; S1048-D1052 PolarHBondContact O-N 3.36Å; D1052-Q1054 VanDerWaalsContact C-N 3.28Å; D1052-Q1054 HydrophobicContact CB-CG 4.1Å; D1052-Q1054 PolarHBondContact O-N 2.94Å
1053	G	77.7	Confident	84.7	Confident	66 Å²	66	43.8 Å²	43.8	68%	0.68	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	18.6	178.9	0	0	0	0	0	114.7	L1049 N1051	L1049-G1053 PolarHBondContact O-N 3.29Å; N1051-G1053 PolarHBondContact O-N 3.41Å
1054	Q	80.8	Confident	84.2	Confident	91 Å²	91	47.3 Å²	47.3	43%	0.425	27%	0.267	S	S	.	.			trans	-75.9	152.8	-179.1	-63.2	-167.8	4.3	0	0	112.3	L1049 D1052 I1056	L1049-Q1054 HydrophobicContact CD2-CB 4.12Å; L1049-Q1054 PolarHBondContact O-N 2.8Å; L1049-Q1054 VanDerWaalsContact O-N 3.08Å; D1052-Q1054 VanDerWaalsContact C-N 3.28Å; D1052-Q1054 HydrophobicContact CB-CG 4.1Å; D1052-Q1054 PolarHBondContact O-N 2.94Å; Q1054-I1056 PolarHBondContact O-N 3.02Å; Q1054-I1056 VanDerWaalsContact O-N 3.09Å
1055	D	81.5	Confident	84	Confident	57 Å²	57	46.1 Å²	46.1	31%	0.305	26%	0.255	S	S	.	.			trans	-77.4	97.8	175.3	-168.4	-40.9	0	0	0	110.9	F1057 A1058 F1059 R1077	D1055-F1057 PolarHBondContact O-N 3.28Å; D1055-F1057 PolarHBondContact OD1-N 3.46Å; D1055-A1058 HydrophobicContact CB-CB 3.84Å; D1055-A1058 PolarHBondContact O-N 3.23Å; D1055-A1058 PolarHBondContact OD1-N 3.08Å; D1055-F1059 WeakPolarHBondContact O-CB 3.37Å; D1055-F1059 PolarHBondContact O-N 2.89Å; D1055-R1077 IonicContact OD1-NE 3.82Å; D1055-R1077 PolarHBondContact OD1-NE 3.15Å; D1055-R1077 IonicContact OD1-NH2 3.12Å; D1055-R1077 IonicContact OD2-CZ 2.74Å; D1055-R1077 IonicContact OD2-NE 2.74Å; D1055-R1077 PolarHBondContact OD2-NE 3.03Å; D1055-R1077 IonicContact OD2-NH2 3.84Å; D1055-R1077 PolarHBondContact OD2-NH2 3.43Å
1056	I	82.3	Confident	83.8	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-33.8	-177.4	-64.3	149.4	0	0	0	112.3	L1034 L1046 L1049 L1050 Q1054 F1059 L1060 F1087	L1034-I1056 HydrophobicContact CD2-CB 4.24Å; L1034-I1056 HydrophobicContact CD2-CD1 3.45Å; L1034-I1056 VanDerWaalsContact CD2-CD1 3.45Å; L1034-I1056 HydrophobicContact CD2-CG1 4.44Å; L1034-I1056 HydrophobicContact CD2-CG2 4.13Å; L1034-I1056 HydrophobicContact CG-CD1 4.31Å; L1046-I1056 HydrophobicContact CD1-CD1 4.26Å; L1046-I1056 HydrophobicContact CD1-CG2 4.02Å; L1049-I1056 HydrophobicContact CB-CG1 3.91Å; L1050-I1056 HydrophobicContact CB-CD1 4.43Å; L1050-I1056 HydrophobicContact CD1-CD1 4.39Å; L1050-I1056 HydrophobicContact CD2-CD1 3.18Å; L1050-I1056 HydrophobicContact CG-CD1 3.38Å; Q1054-I1056 PolarHBondContact O-N 3.02Å; Q1054-I1056 VanDerWaalsContact O-N 3.09Å; I1056-F1059 PolarHBondContact O-N 2.83Å; I1056-L1060 HydrophobicContact CG2-CD1 3.86Å; I1056-L1060 WeakPolarHBondContact O-CB 3.33Å; I1056-L1060 WeakPolarHBondContact O-CD1 3.48Å; I1056-L1060 WeakPolarHBondContact O-CG 3.43Å; I1056-L1060 PolarHBondContact O-N 3.3Å; I1056-F1087 HydrophobicContact CG2-CE2 4.22Å; I1056-F1087 HydrophobicContact CG2-CZ 4.25Å
1057	F	84.3	Confident	83.7	Confident	29 Å²	29	49.2 Å²	49.2	13%	0.127	29%	0.287	C	S	.	.	H	α-helix	trans	-79.4	-32.8	-179	-58.6	-61.9	0	0	0	111.9	L1034 D1055 F1059 L1060 A1061 R1077 A1080 K1081	L1034-F1057 HydrophobicContact CD2-CZ 4.13Å; D1055-F1057 PolarHBondContact O-N 3.28Å; D1055-F1057 PolarHBondContact OD1-N 3.46Å; F1057-F1059 VanDerWaalsContact C-N 3.33Å; F1057-L1060 HydrophobicContact CD1-CD1 4.17Å; F1057-A1061 WeakPolarHBondContact O-CB 3.38Å; F1057-A1061 PolarHBondContact O-N 3.32Å; F1057-R1077 HydrophobicContact CB-CG 3.88Å; F1057-A1080 HydrophobicContact CB-CB 4.42Å; F1057-A1080 WeakPolarHBondContact O-CB 3.47Å; F1057-K1081 HydrophobicContact CB-CG 4.31Å; F1057-K1081 HydrophobicContact CD1-CB 4.23Å; F1057-K1081 HydrophobicContact CD1-CG 3.8Å; F1057-K1081 HydrophobicContact CD2-CG 3.87Å; F1057-K1081 HydrophobicContact CE1-CB 4.2Å; F1057-K1081 HydrophobicContact CE1-CG 4.02Å; F1057-K1081 HydrophobicContact CE2-CG 4.07Å; F1057-K1081 HydrophobicContact CG-CG 3.71Å; F1057-K1081 HydrophobicContact CZ-CG 4.14Å
1058	A	83.5	Confident	83.4	Confident	15 Å²	15	51 Å²	51	12%	0.124	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-41.5	168.5	0	0	0	0	0	110.5	D1055 A1061 S1062	D1055-A1058 HydrophobicContact CB-CB 3.84Å; D1055-A1058 PolarHBondContact O-N 3.23Å; D1055-A1058 PolarHBondContact OD1-N 3.08Å; A1058-A1061 PolarHBondContact O-N 2.72Å; A1058-S1062 VanDerWaalsContact O-CB 3.3Å; A1058-S1062 WeakPolarHBondContact O-CB 3.44Å; A1058-S1062 PolarHBondContact O-N 3.4Å
1059	F	83.9	Confident	83.2	Confident	31 Å²	31	52.6 Å²	52.6	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-51.7	174.2	-178.6	-90	0	0	0	113.1	K1045 L1049 D1055 I1056 F1057 A1061 S1062 E1063 L1069	K1045-F1059 VanDerWaalsContact CE-CE1 3.41Å; K1045-F1059 VanDerWaalsContact NZ-CZ 3.34Å; L1049-F1059 HydrophobicContact CD1-CD1 3.72Å; L1049-F1059 HydrophobicContact CD1-CE1 4.08Å; L1049-F1059 HydrophobicContact CD1-CG 4.07Å; L1049-F1059 HydrophobicContact CD2-CD2 4.31Å; L1049-F1059 HydrophobicContact CD2-CG 4.34Å; D1055-F1059 WeakPolarHBondContact O-CB 3.37Å; D1055-F1059 PolarHBondContact O-N 2.89Å; I1056-F1059 PolarHBondContact O-N 2.83Å; F1057-F1059 VanDerWaalsContact C-N 3.33Å; F1059-A1061 VanDerWaalsContact C-N 3.29Å; F1059-A1061 PolarHBondContact O-N 3.42Å; F1059-S1062 WeakPolarHBondContact O-CB 3.49Å; F1059-S1062 PolarHBondContact O-N 2.84Å; F1059-E1063 HydrophobicContact CD1-CG 4.38Å; F1059-E1063 HydrophobicContact CE1-CG 3.76Å; F1059-E1063 HydrophobicContact CE2-CG 4.39Å; F1059-E1063 HydrophobicContact CZ-CG 3.74Å; F1059-E1063 VanDerWaalsContact CZ-OE1 3.26Å; F1059-E1063 WeakPolarHBondContact CZ-OE1 3.2Å; F1059-E1063 PolarHBondContact O-N 3.34Å; F1059-L1069 VanDerWaalsContact CA-CD2 3.48Å; F1059-L1069 HydrophobicContact CB-CD2 4.07Å; F1059-L1069 HydrophobicContact CD2-CD2 4.23Å
1060	L	82.9	Confident	82.9	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-58.4	-41.8	174.9	-82.8	155.7	0	0	0	111.9	I1056 F1057 E1063 L1064 A1080 L1083 L1084 P1086 F1087	I1056-L1060 HydrophobicContact CG2-CD1 3.86Å; I1056-L1060 WeakPolarHBondContact O-CB 3.33Å; I1056-L1060 WeakPolarHBondContact O-CD1 3.48Å; I1056-L1060 WeakPolarHBondContact O-CG 3.43Å; I1056-L1060 PolarHBondContact O-N 3.3Å; F1057-L1060 HydrophobicContact CD1-CD1 4.17Å; L1060-E1063 PolarHBondContact O-N 2.82Å; L1060-L1064 VanDerWaalsContact O-CB 3.24Å; L1060-L1064 WeakPolarHBondContact O-CB 3.2Å; L1060-L1064 WeakPolarHBondContact O-CD1 3.44Å; L1060-L1064 VanDerWaalsContact O-CG 3.25Å; L1060-L1064 WeakPolarHBondContact O-CG 3.23Å; L1060-L1064 PolarHBondContact O-N 2.74Å; L1060-A1080 HydrophobicContact CB-CB 4Å; L1060-L1083 WeakPolarHBondContact CD1-O 3.4Å; L1060-L1084 HydrophobicContact CD1-CD2 4.16Å; L1060-P1086 HydrophobicContact CD2-CB 4.06Å; L1060-P1086 HydrophobicContact CD2-CG 3.84Å; L1060-F1087 HydrophobicContact CD1-CE2 3.97Å; L1060-F1087 HydrophobicContact CD2-CD2 4.38Å; L1060-F1087 HydrophobicContact CD2-CE2 3.81Å; L1060-F1087 HydrophobicContact CD2-CZ 4.44Å; L1060-F1087 HydrophobicContact CG-CE2 3.95Å; L1060-F1087 HydrophobicContact CG-CZ 4.39Å
1061	A	83.5	Confident	82.7	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.008	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-38.3	178.2	0	0	0	0	0	112.2	F1057 A1058 F1059 N1065 V1072 Q1076 A1080	F1057-A1061 WeakPolarHBondContact O-CB 3.38Å; F1057-A1061 PolarHBondContact O-N 3.32Å; A1058-A1061 PolarHBondContact O-N 2.72Å; F1059-A1061 VanDerWaalsContact C-N 3.29Å; F1059-A1061 PolarHBondContact O-N 3.42Å; A1061-N1065 VanDerWaalsContact O-CB 3.29Å; A1061-N1065 WeakPolarHBondContact O-CB 3.42Å; A1061-N1065 PolarHBondContact O-N 3.27Å; A1061-N1065 PolarHBondContact O-ND2 2.74Å; A1061-V1072 HydrophobicContact CB-CG1 3.53Å; A1061-V1072 HydrophobicContact CB-CG2 4.43Å; A1061-Q1076 HydrophobicContact CB-CB 4.18Å; A1061-A1080 HydrophobicContact CB-CB 3.98Å
1062	S	84.9	Confident	82.6	Confident	19 Å²	19	60.1 Å²	60.1	13%	0.133	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-48.3	173.9	167.8	0	0	0	0	111.1	A1058 F1059 S1066 V1067	A1058-S1062 VanDerWaalsContact O-CB 3.3Å; A1058-S1062 WeakPolarHBondContact O-CB 3.44Å; A1058-S1062 PolarHBondContact O-N 3.4Å; F1059-S1062 WeakPolarHBondContact O-CB 3.49Å; F1059-S1062 PolarHBondContact O-N 2.84Å; S1062-S1066 CarbonylContact O-C 3Å; S1062-S1066 VanDerWaalsContact O-CA 3.25Å; S1062-S1066 WeakPolarHBondContact O-CA 3.42Å; S1062-S1066 PolarHBondContact O-N 3.22Å; S1062-V1067 WeakPolarHBondContact CA-O 3.29Å; S1062-V1067 VanDerWaalsContact CB-O 3.25Å; S1062-V1067 WeakPolarHBondContact CB-O 3.35Å; S1062-V1067 PolarHBondContact O-N 3.15Å; S1062-V1067 PolarHBondContact OG-O 3.37Å
1063	E	80.7	Confident	82.5	Confident	108 Å²	108	57.3 Å²	57.3	51%	0.505	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-49.1	176.8	-74.9	-95.8	-161.8	0	0	112.1	K1045 F1059 L1060 N1065 S1066	K1045-E1063 IonicContact NZ-OE1 3.76Å; K1045-E1063 PolarHBondContact NZ-OE1 3.47Å; F1059-E1063 HydrophobicContact CD1-CG 4.38Å; F1059-E1063 HydrophobicContact CE1-CG 3.76Å; F1059-E1063 HydrophobicContact CE2-CG 4.39Å; F1059-E1063 HydrophobicContact CZ-CG 3.74Å; F1059-E1063 VanDerWaalsContact CZ-OE1 3.26Å; F1059-E1063 WeakPolarHBondContact CZ-OE1 3.2Å; F1059-E1063 PolarHBondContact O-N 3.34Å; L1060-E1063 PolarHBondContact O-N 2.82Å; E1063-N1065 VanDerWaalsContact C-N 3.35Å; E1063-N1065 PolarHBondContact O-N 3.09Å; E1063-S1066 PolarHBondContact O-N 2.87Å
1064	L	80.3	Confident	82.4	Confident	87 Å²	87	62.3 Å²	62.3	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-65.9	-34.3	-177.6	-77	165.4	0	0	0	113.3	L1060 L1083 P1086	L1060-L1064 VanDerWaalsContact O-CB 3.24Å; L1060-L1064 WeakPolarHBondContact O-CB 3.2Å; L1060-L1064 WeakPolarHBondContact O-CD1 3.44Å; L1060-L1064 VanDerWaalsContact O-CG 3.25Å; L1060-L1064 WeakPolarHBondContact O-CG 3.23Å; L1060-L1064 PolarHBondContact O-N 2.74Å; L1064-L1083 HydrophobicContact CD1-CB 4.47Å; L1064-L1083 HydrophobicContact CD1-CD1 3.72Å; L1064-P1086 HydrophobicContact CD2-CG 4.47Å
1065	N	82.5	Confident	82.4	Confident	71 Å²	71	62.6 Å²	62.6	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-97.9	-4	-179.9	-63.1	-85.3	0	0	0	112.9	A1061 E1063 V1067	A1061-N1065 VanDerWaalsContact O-CB 3.29Å; A1061-N1065 WeakPolarHBondContact O-CB 3.42Å; A1061-N1065 PolarHBondContact O-N 3.27Å; A1061-N1065 PolarHBondContact O-ND2 2.74Å; E1063-N1065 VanDerWaalsContact C-N 3.35Å; E1063-N1065 PolarHBondContact O-N 3.09Å; N1065-V1067 VanDerWaalsContact C-N 3.31Å; N1065-V1067 HydrophobicContact CB-CG2 3.92Å; N1065-V1067 WeakPolarHBondContact O-CG2 3.35Å; N1065-V1067 PolarHBondContact O-N 2.71Å
1066	S	83	Confident	82.3	Confident	115 Å²	115	62 Å²	62	80%	0.804	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	43.7	-173.5	-57	0	0	0	0	113.3	S1062 E1063	S1062-S1066 CarbonylContact O-C 3Å; S1062-S1066 VanDerWaalsContact O-CA 3.25Å; S1062-S1066 WeakPolarHBondContact O-CA 3.42Å; S1062-S1066 PolarHBondContact O-N 3.22Å; E1063-S1066 PolarHBondContact O-N 2.87Å
1067	V	86.6	Confident	82.2	Confident	44 Å²	44	65.8 Å²	65.8	27%	0.267	36%	0.364	S	S	.	.			trans	-117.4	150.3	-177.7	176.5	0	0	0	0	109.4	S1062 N1065 D1071	S1062-V1067 WeakPolarHBondContact CA-O 3.29Å; S1062-V1067 VanDerWaalsContact CB-O 3.25Å; S1062-V1067 WeakPolarHBondContact CB-O 3.35Å; S1062-V1067 PolarHBondContact O-N 3.15Å; S1062-V1067 PolarHBondContact OG-O 3.37Å; N1065-V1067 VanDerWaalsContact C-N 3.31Å; N1065-V1067 HydrophobicContact CB-CG2 3.92Å; N1065-V1067 WeakPolarHBondContact O-CG2 3.35Å; N1065-V1067 PolarHBondContact O-N 2.71Å; V1067-D1071 HydrophobicContact CG1-CB 3.4Å
1068	C	83.1	Confident	81.8	Confident	75 Å²	75	67.6 Å²	67.6	51%	0.507	38%	0.379	S	S	.	.			trans	-60.5	146.9	175.2	-167.2	0	0	0	0	111.1	T1070 D1071 V1072	C1068-T1070 PolarHBondContact O-N 3.26Å; C1068-D1071 PolarHBondContact O-N 2.87Å; C1068-V1072 PolarHBondContact O-N 3.16Å
1069	L	80.6	Confident	81.5	Confident	85 Å²	85	72.6 Å²	72.6	45%	0.445	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-51.2	-32	177.8	-82.8	167.9	0	0	0	113.5	F1059	F1059-L1069 VanDerWaalsContact CA-CD2 3.48Å; F1059-L1069 HydrophobicContact CB-CD2 4.07Å; F1059-L1069 HydrophobicContact CD2-CD2 4.23Å
1070	T	80.8	Confident	81.2	Confident	117 Å²	117	71.3 Å²	71.3	72%	0.718	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-76.3	-24	178.9	52.4	0	0	0	0	113.9	C1068	C1068-T1070 PolarHBondContact O-N 3.26Å
1071	D	84.5	Confident	80.8	Confident	111 Å²	111	76.1 Å²	76.1	59%	0.594	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-98.7	4.9	-173.3	-58.6	-25.5	0	0	0	112	V1067 C1068 S1073	V1067-D1071 HydrophobicContact CG1-CB 3.4Å; C1068-D1071 PolarHBondContact O-N 2.87Å; D1071-S1073 PolarHBondContact O-N 2.92Å
1072	V	83	Confident	80.1	Confident	25 Å²	25	84.5 Å²	84.5	15%	0.152	46%	0.455	C	S	.	.			trans	-70.4	116.3	177.4	177.2	0	0	0	0	110.3	A1061 C1068 Q1076 R1077	A1061-V1072 HydrophobicContact CB-CG1 3.53Å; A1061-V1072 HydrophobicContact CB-CG2 4.43Å; C1068-V1072 PolarHBondContact O-N 3.16Å; V1072-Q1076 HydrophobicContact CG1-CB 4.16Å; V1072-R1077 HydrophobicContact CG1-CB 4.12Å
1073	S	81.9	Confident	79.5	Confident	51 Å²	51	87.1 Å²	87.1	36%	0.357	47%	0.467	S	S	.	.			trans	-68.7	154.1	174.2	66.4	0	0	0	0	112.6	D1071 V1075 Q1076 R1077	D1071-S1073 PolarHBondContact O-N 2.92Å; S1073-V1075 PolarHBondContact O-N 3.45Å; S1073-Q1076 PolarHBondContact O-N 2.92Å; S1073-Q1076 VanDerWaalsContact O-N 3.16Å; S1073-Q1076 WeakPolarHBondContact OG-CB 3.46Å; S1073-Q1076 VanDerWaalsContact OG-CD 3.27Å; S1073-Q1076 VanDerWaalsContact OG-CG 3.23Å; S1073-Q1076 WeakPolarHBondContact OG-CG 3.49Å; S1073-Q1076 PolarHBondContact OG-N 3.23Å; S1073-Q1076 PolarHBondContact OG-OE1 3.48Å; S1073-R1077 PolarHBondContact O-N 3.41Å
1074	E	76.8	Confident	79.2	Confident	172 Å²	172	83.8 Å²	83.8	80%	0.804	45%	0.452	S	S	*	.	H	α-helix	trans	-57.2	-32.7	174.7	-73.2	-162.6	150.3	0	0	112.9	S1078	E1074-S1078 WeakPolarHBondContact O-CB 3.47Å; E1074-S1078 PolarHBondContact O-N 2.97Å
1075	V	79.2	Confident	78.8	Confident	97 Å²	97	84.7 Å²	84.7	59%	0.588	46%	0.457	S	S	*	.	H	α-helix	trans	-67.7	-48.5	177.9	-179	0	0	0	0	110.4	S1073 R1077 S1078 Q1079	S1073-V1075 PolarHBondContact O-N 3.45Å; V1075-R1077 VanDerWaalsContact C-N 3.35Å; V1075-R1077 PolarHBondContact O-N 3.35Å; V1075-S1078 PolarHBondContact O-N 2.74Å; V1075-S1078 VanDerWaalsContact O-N 3.17Å; V1075-Q1079 WeakPolarHBondContact O-CG 3.42Å; V1075-Q1079 PolarHBondContact O-N 3.44Å
1076	Q	79.8	Confident	78.4	Confident	45 Å²	45	84.7 Å²	84.7	21%	0.21	46%	0.461	C	S	.	.	H	α-helix	trans	-59.9	-45.5	176.2	-75.1	164.6	-37.6	0	0	111.1	A1061 V1072 S1073 S1078 Q1079 A1080	A1061-Q1076 HydrophobicContact CB-CB 4.18Å; V1072-Q1076 HydrophobicContact CG1-CB 4.16Å; S1073-Q1076 PolarHBondContact O-N 2.92Å; S1073-Q1076 VanDerWaalsContact O-N 3.16Å; S1073-Q1076 WeakPolarHBondContact OG-CB 3.46Å; S1073-Q1076 VanDerWaalsContact OG-CD 3.27Å; S1073-Q1076 VanDerWaalsContact OG-CG 3.23Å; S1073-Q1076 WeakPolarHBondContact OG-CG 3.49Å; S1073-Q1076 PolarHBondContact OG-N 3.23Å; S1073-Q1076 PolarHBondContact OG-OE1 3.48Å; Q1076-S1078 VanDerWaalsContact C-N 3.31Å; Q1076-S1078 PolarHBondContact O-N 3.08Å; Q1076-Q1079 PolarHBondContact O-N 3.21Å; Q1076-A1080 PolarHBondContact O-N 2.98Å
1077	R	80.7	Confident	78.2	Confident	80 Å²	80	79.6 Å²	79.6	30%	0.302	43%	0.425	S	S	.	.	H	α-helix	trans	-58.8	-41.2	174.5	-178.9	180	173.4	-102.7	7.8	112.5	D1055 F1057 V1072 S1073 V1075 A1080 K1081	D1055-R1077 IonicContact OD1-NE 3.82Å; D1055-R1077 PolarHBondContact OD1-NE 3.15Å; D1055-R1077 IonicContact OD1-NH2 3.12Å; D1055-R1077 IonicContact OD2-CZ 2.74Å; D1055-R1077 IonicContact OD2-NE 2.74Å; D1055-R1077 PolarHBondContact OD2-NE 3.03Å; D1055-R1077 IonicContact OD2-NH2 3.84Å; D1055-R1077 PolarHBondContact OD2-NH2 3.43Å; F1057-R1077 HydrophobicContact CB-CG 3.88Å; V1072-R1077 HydrophobicContact CG1-CB 4.12Å; S1073-R1077 PolarHBondContact O-N 3.41Å; V1075-R1077 VanDerWaalsContact C-N 3.35Å; V1075-R1077 PolarHBondContact O-N 3.35Å; R1077-A1080 PolarHBondContact O-N 3.1Å; R1077-K1081 PolarHBondContact O-N 2.74Å
1078	S	76.7	Confident	77.9	Confident	66 Å²	66	84.5 Å²	84.5	46%	0.462	45%	0.449	S	S	.	.	H	α-helix	trans	-69.3	-33.7	179.2	-170.1	0	0	0	0	112.8	E1074 V1075 Q1076 K1081	E1074-S1078 WeakPolarHBondContact O-CB 3.47Å; E1074-S1078 PolarHBondContact O-N 2.97Å; V1075-S1078 PolarHBondContact O-N 2.74Å; V1075-S1078 VanDerWaalsContact O-N 3.17Å; Q1076-S1078 VanDerWaalsContact C-N 3.31Å; Q1076-S1078 PolarHBondContact O-N 3.08Å; S1078-K1081 WeakPolarHBondContact O-CB 3.14Å; S1078-K1081 PolarHBondContact O-N 3.36Å
1079	Q	76	Confident	77.9	Confident	121 Å²	121	81.6 Å²	81.6	57%	0.565	43%	0.431	S	S	*	.	H	α-helix	trans	-68.2	-39.3	174.7	-72.1	173.8	-9.8	0	0	111.2	V1075 Q1076 K1081 Q1082	V1075-Q1079 WeakPolarHBondContact O-CG 3.42Å; V1075-Q1079 PolarHBondContact O-N 3.44Å; Q1076-Q1079 PolarHBondContact O-N 3.21Å; Q1079-K1081 PolarHBondContact O-N 3.03Å; Q1079-K1081 VanDerWaalsContact O-N 3.16Å; Q1079-Q1082 PolarHBondContact O-N 3.08Å
1080	A	78.7	Confident	78.2	Confident	3 Å²	3	77.7 Å²	77.7	3%	0.025	41%	0.411	C	S	.	.	H	α-helix	trans	-61.1	-22.9	176.8	0	0	0	0	0	113.7	F1057 L1060 A1061 Q1076 R1077 Q1082 L1083	F1057-A1080 HydrophobicContact CB-CB 4.42Å; F1057-A1080 WeakPolarHBondContact O-CB 3.47Å; L1060-A1080 HydrophobicContact CB-CB 4Å; A1061-A1080 HydrophobicContact CB-CB 3.98Å; Q1076-A1080 PolarHBondContact O-N 2.98Å; R1077-A1080 PolarHBondContact O-N 3.1Å; A1080-Q1082 PolarHBondContact O-N 2.74Å; A1080-L1083 PolarHBondContact O-N 3.46Å
1081	K	73.7	Confident	78.3	Confident	106 Å²	106	73.4 Å²	73.4	46%	0.461	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.4	175.6	-69.9	-178.7	178.1	177.5	0	114.8	F1057 R1077 S1078 Q1079	F1057-K1081 HydrophobicContact CB-CG 4.31Å; F1057-K1081 HydrophobicContact CD1-CB 4.23Å; F1057-K1081 HydrophobicContact CD1-CG 3.8Å; F1057-K1081 HydrophobicContact CD2-CG 3.87Å; F1057-K1081 HydrophobicContact CE1-CB 4.2Å; F1057-K1081 HydrophobicContact CE1-CG 4.02Å; F1057-K1081 HydrophobicContact CE2-CG 4.07Å; F1057-K1081 HydrophobicContact CG-CG 3.71Å; F1057-K1081 HydrophobicContact CZ-CG 4.14Å; R1077-K1081 PolarHBondContact O-N 2.74Å; S1078-K1081 WeakPolarHBondContact O-CB 3.14Å; S1078-K1081 PolarHBondContact O-N 3.36Å; Q1079-K1081 PolarHBondContact O-N 3.03Å; Q1079-K1081 VanDerWaalsContact O-N 3.16Å
1082	Q	69	Low	78.4	Confident	177 Å²	177	71.2 Å²	71.2	83%	0.827	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-1.3	178.9	-60	-174.8	2.3	0	0	113.1	Q1079 A1080	Q1079-Q1082 PolarHBondContact O-N 3.08Å; A1080-Q1082 PolarHBondContact O-N 2.74Å
1083	L	73	Confident	78.8	Confident	74 Å²	74	71.5 Å²	71.5	39%	0.387	38%	0.379	S	S	.	.			trans	-127.3	109.3	-169.8	-64.2	172.3	0	0	0	111.2	L1060 L1064 A1080	L1060-L1083 WeakPolarHBondContact CD1-O 3.4Å; L1064-L1083 HydrophobicContact CD1-CB 4.47Å; L1064-L1083 HydrophobicContact CD1-CD1 3.72Å; A1080-L1083 PolarHBondContact O-N 3.46Å
1084	L	73.8	Confident	79.1	Confident	37 Å²	37	71.7 Å²	71.7	19%	0.194	38%	0.375	C	S	.	.			trans	-117	-7.4	170	-66.3	175.1	0	0	0	113.2	L1034 I1037 L1060 P1086 F1087 V1090	L1034-L1084 HydrophobicContact CD1-CD1 3.69Å; L1034-L1084 HydrophobicContact CD1-CD2 3.55Å; L1034-L1084 HydrophobicContact CD1-CG 4.29Å; I1037-L1084 HydrophobicContact CD1-CD1 3.67Å; L1060-L1084 HydrophobicContact CD1-CD2 4.16Å; L1084-P1086 VanDerWaalsContact C-N 3.3Å; L1084-F1087 PolarHBondContact O-N 3.25Å; L1084-V1090 HydrophobicContact CB-CG1 4.3Å
1085	L	71.4	Confident	79.5	Confident	106 Å²	106	69.9 Å²	69.9	56%	0.555	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24	-179.6	-65.6	174	0	0	0	115.8	F1087 M1094	L1085-F1087 PolarHBondContact O-N 3.43Å; L1085-M1094 HydrophobicContact CD2-CE 4.4Å; L1085-M1094 HydrophobicContact CD2-SD 3.86Å
1086	P	73.7	Confident	79.9	Confident	71 Å²	71	67.3 Å²	67.3	46%	0.461	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.8	174.1	-27.3	37.1	0	0	0	114.6	L1060 L1064 L1084 L1088	L1060-P1086 HydrophobicContact CD2-CB 4.06Å; L1060-P1086 HydrophobicContact CD2-CG 3.84Å; L1064-P1086 HydrophobicContact CD2-CG 4.47Å; L1084-P1086 VanDerWaalsContact C-N 3.3Å; P1086-L1088 PolarHBondContact O-N 3.28Å
1087	F	79.1	Confident	80.3	Confident	9 Å²	9	65.9 Å²	65.9	4%	0.039	35%	0.35	C	S	.	.	S	Bend	trans	-79.5	108.6	172.5	-64.8	-76.5	0	0	0	109.7	K1045 L1046 L1049 I1056 L1060 L1084 L1085 G1089 V1090 A1091	K1045-F1087 HydrophobicContact CB-CD1 4.4Å; K1045-F1087 HydrophobicContact CB-CE1 4.3Å; K1045-F1087 HydrophobicContact CD-CE1 4.26Å; K1045-F1087 HydrophobicContact CG-CE1 4.13Å; L1046-F1087 HydrophobicContact CB-CD1 3.98Å; L1046-F1087 HydrophobicContact CB-CE1 4.1Å; L1046-F1087 HydrophobicContact CB-CG 4.31Å; L1046-F1087 HydrophobicContact CD1-CD2 4.43Å; L1046-F1087 HydrophobicContact CD1-CE1 4.47Å; L1046-F1087 HydrophobicContact CD1-CE2 4.01Å; L1046-F1087 HydrophobicContact CD1-CZ 4.05Å; L1049-F1087 HydrophobicContact CD1-CE1 4.08Å; L1049-F1087 HydrophobicContact CD1-CZ 3.99Å; I1056-F1087 HydrophobicContact CG2-CE2 4.22Å; I1056-F1087 HydrophobicContact CG2-CZ 4.25Å; L1060-F1087 HydrophobicContact CD1-CE2 3.97Å; L1060-F1087 HydrophobicContact CD2-CD2 4.38Å; L1060-F1087 HydrophobicContact CD2-CE2 3.81Å; L1060-F1087 HydrophobicContact CD2-CZ 4.44Å; L1060-F1087 HydrophobicContact CG-CE2 3.95Å; L1060-F1087 HydrophobicContact CG-CZ 4.39Å; L1084-F1087 PolarHBondContact O-N 3.25Å; L1085-F1087 PolarHBondContact O-N 3.43Å; F1087-G1089 PolarHBondContact O-N 3.11Å; F1087-V1090 HydrophobicContact CB-CB 4.05Å; F1087-V1090 HydrophobicContact CB-CG2 3.65Å; F1087-V1090 HydrophobicContact CG-CG2 4.5Å; F1087-V1090 WeakPolarHBondContact O-CA 3.45Å; F1087-V1090 WeakPolarHBondContact O-CB 3.37Å; F1087-V1090 PolarHBondContact O-N 2.98Å; F1087-A1091 PolarHBondContact O-N 3.43Å; F1087-A1091 VanDerWaalsContact O-N 3.1Å
1088	L	80.5	Confident	80.5	Confident	147 Å²	147	62.8 Å²	62.8	77%	0.77	34%	0.34	S	S	*	.	H	α-helix	trans	-57.7	-36.2	-175.1	-68.6	173.1	0	0	0	112.7	P1086 V1090 A1091 S1092	P1086-L1088 PolarHBondContact O-N 3.28Å; L1088-V1090 VanDerWaalsContact C-N 3.3Å; L1088-V1090 PolarHBondContact O-N 3.44Å; L1088-A1091 PolarHBondContact O-N 3.04Å; L1088-S1092 PolarHBondContact O-N 3.22Å; L1088-S1092 VanDerWaalsContact O-N 3.08Å; L1088-S1092 PolarHBondContact O-OG 3.32Å
1089	G	84	Confident	80.9	Confident	14 Å²	14	65.2 Å²	65.2	14%	0.144	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-32.5	175.7	0	0	0	0	0	112.8	S1041 D1043 F1087 S1092 W1093	S1041-G1089 WeakPolarHBondContact CB-O 3.35Å; D1043-G1089 WeakPolarHBondContact OD2-CA 3.33Å; D1043-G1089 PolarHBondContact OD2-N 3.1Å; F1087-G1089 PolarHBondContact O-N 3.11Å; G1089-S1092 PolarHBondContact O-OG 3Å; G1089-W1093 VanDerWaalsContact O-CB 3.24Å; G1089-W1093 WeakPolarHBondContact O-CB 3.23Å; G1089-W1093 PolarHBondContact O-N 2.85Å; G1089-W1093 VanDerWaalsContact O-N 3.07Å
1090	V	86.9	Confident	81.2	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-72.1	-44.8	176.8	180	0	0	0	0	110.6	I1037 L1046 L1084 F1087 L1088 S1092 W1093 M1094	I1037-V1090 HydrophobicContact CG2-CB 4.45Å; I1037-V1090 HydrophobicContact CG2-CG1 3.79Å; I1037-V1090 HydrophobicContact CG2-CG2 3.82Å; L1046-V1090 HydrophobicContact CD2-CG2 3.79Å; L1084-V1090 HydrophobicContact CB-CG1 4.3Å; F1087-V1090 HydrophobicContact CB-CB 4.05Å; F1087-V1090 HydrophobicContact CB-CG2 3.65Å; F1087-V1090 HydrophobicContact CG-CG2 4.5Å; F1087-V1090 WeakPolarHBondContact O-CA 3.45Å; F1087-V1090 WeakPolarHBondContact O-CB 3.37Å; F1087-V1090 PolarHBondContact O-N 2.98Å; L1088-V1090 VanDerWaalsContact C-N 3.3Å; L1088-V1090 PolarHBondContact O-N 3.44Å; V1090-S1092 PolarHBondContact O-N 2.91Å; V1090-W1093 PolarHBondContact O-N 3.13Å; V1090-M1094 HydrophobicContact CG1-CG 4.41Å; V1090-M1094 HydrophobicContact CG1-SD 4.09Å; V1090-M1094 VanDerWaalsContact O-CG 3.3Å; V1090-M1094 WeakPolarHBondContact O-CG 3.39Å; V1090-M1094 PolarHBondContact O-N 3Å
1091	A	82.8	Confident	81.4	Confident	27 Å²	27	67 Å²	67	22%	0.223	35%	0.346	C	S	.	.	H	α-helix	trans	-60.9	-44.5	178.5	0	0	0	0	0	112	F1087 L1088 M1094 Q1095	F1087-A1091 PolarHBondContact O-N 3.43Å; F1087-A1091 VanDerWaalsContact O-N 3.1Å; L1088-A1091 PolarHBondContact O-N 3.04Å; A1091-M1094 PolarHBondContact O-N 3.04Å; A1091-Q1095 PolarHBondContact O-N 3.32Å
1092	S	86.9	Confident	81.6	Confident	66 Å²	66	67.3 Å²	67.3	46%	0.462	35%	0.345	S	S	.	.	H	α-helix	trans	-66	-42.4	177.3	62.9	0	0	0	0	112.1	L1088 G1089 V1090 M1094 Q1095 A1096	L1088-S1092 PolarHBondContact O-N 3.22Å; L1088-S1092 VanDerWaalsContact O-N 3.08Å; L1088-S1092 PolarHBondContact O-OG 3.32Å; G1089-S1092 PolarHBondContact O-OG 3Å; V1090-S1092 PolarHBondContact O-N 2.91Å; S1092-M1094 PolarHBondContact O-N 3.17Å; S1092-Q1095 PolarHBondContact O-N 3.19Å; S1092-A1096 WeakPolarHBondContact O-CB 3.46Å; S1092-A1096 PolarHBondContact O-N 2.99Å
1093	W	91.2	Very high	82	Confident	30 Å²	30	66.7 Å²	66.7	11%	0.114	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.8	167.6	76.4	0	0	0	113.1	I1037 L1040 G1089 V1090 Q1095 A1096 T1097 I1132 T1135 V1136	I1037-W1093 HydrophobicContact CG1-CZ3 4.47Å; L1040-W1093 HydrophobicContact CB-CD2 4.33Å; L1040-W1093 HydrophobicContact CB-CZ2 4.05Å; L1040-W1093 HydrophobicContact CD1-CH2 4.35Å; L1040-W1093 HydrophobicContact CD1-CZ2 3.63Å; L1040-W1093 HydrophobicContact CG-CZ2 4.49Å; G1089-W1093 VanDerWaalsContact O-CB 3.24Å; G1089-W1093 WeakPolarHBondContact O-CB 3.23Å; G1089-W1093 PolarHBondContact O-N 2.85Å; G1089-W1093 VanDerWaalsContact O-N 3.07Å; V1090-W1093 PolarHBondContact O-N 3.13Å; W1093-Q1095 VanDerWaalsContact C-N 3.35Å; W1093-Q1095 PolarHBondContact O-N 2.86Å; W1093-A1096 PolarHBondContact O-N 3.26Å; W1093-T1097 VanDerWaalsContact CE2-OG1 3.32Å; W1093-T1097 PolarHBondContact NE1-OG1 3.48Å; W1093-T1097 VanDerWaalsContact NE1-OG1 3.1Å; W1093-T1097 VanDerWaalsContact O-CB 3.31Å; W1093-T1097 WeakPolarHBondContact O-CB 3.31Å; W1093-T1097 PolarHBondContact O-N 2.84Å; W1093-T1097 PolarHBondContact O-OG1 3.1Å; W1093-I1132 HydrophobicContact CH2-CG2 4.13Å; W1093-I1132 HydrophobicContact CZ3-CG2 4.28Å; W1093-T1135 HydrophobicContact CZ2-CG2 3.99Å; W1093-V1136 HydrophobicContact CH2-CG2 3.56Å; W1093-V1136 HydrophobicContact CZ2-CG2 4.41Å; W1093-V1136 HydrophobicContact CZ3-CG2 4.32Å
1094	M	87	Confident	82.2	Confident	55 Å²	55	66.6 Å²	66.6	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-44.3	176.8	-74.2	175.7	74.7	0	0	111.3	L1085 V1090 A1091 S1092 T1097 V1098 I1132	L1085-M1094 HydrophobicContact CD2-CE 4.4Å; L1085-M1094 HydrophobicContact CD2-SD 3.86Å; V1090-M1094 HydrophobicContact CG1-CG 4.41Å; V1090-M1094 HydrophobicContact CG1-SD 4.09Å; V1090-M1094 VanDerWaalsContact O-CG 3.3Å; V1090-M1094 WeakPolarHBondContact O-CG 3.39Å; V1090-M1094 PolarHBondContact O-N 3Å; A1091-M1094 PolarHBondContact O-N 3.04Å; S1092-M1094 PolarHBondContact O-N 3.17Å; M1094-T1097 PolarHBondContact O-N 2.6Å; M1094-V1098 WeakPolarHBondContact O-CG2 3.43Å; M1094-V1098 PolarHBondContact O-N 2.85Å; M1094-V1098 VanDerWaalsContact O-N 3.11Å; M1094-I1132 HydrophobicContact CB-CD1 4Å; M1094-I1132 HydrophobicContact CE-CD1 3.55Å; M1094-I1132 HydrophobicContact CE-CG2 4.48Å; M1094-I1132 HydrophobicContact CG-CD1 4.08Å
1095	Q	85.8	Confident	82.3	Confident	134 Å²	134	66.4 Å²	66.4	63%	0.626	35%	0.348	S	S	*	.	H	α-helix	trans	-63.4	-49.1	176.2	-71.4	-179.5	-8.8	0	0	111.5	A1091 S1092 W1093 T1097 V1098 E1099	A1091-Q1095 PolarHBondContact O-N 3.32Å; S1092-Q1095 PolarHBondContact O-N 3.19Å; W1093-Q1095 VanDerWaalsContact C-N 3.35Å; W1093-Q1095 PolarHBondContact O-N 2.86Å; Q1095-T1097 VanDerWaalsContact C-N 3.3Å; Q1095-T1097 PolarHBondContact O-N 2.94Å; Q1095-V1098 PolarHBondContact O-N 3.21Å; Q1095-E1099 PolarHBondContact O-N 3Å
1096	A	88.3	Confident	82.7	Confident	44 Å²	44	65.4 Å²	65.4	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-36.6	179	0	0	0	0	0	112.7	S1092 W1093 E1099 R1100	S1092-A1096 WeakPolarHBondContact O-CB 3.46Å; S1092-A1096 PolarHBondContact O-N 2.99Å; W1093-A1096 PolarHBondContact O-N 3.26Å; A1096-E1099 PolarHBondContact O-N 2.93Å; A1096-R1100 VanDerWaalsContact O-CB 3.28Å; A1096-R1100 WeakPolarHBondContact O-CB 3.39Å; A1096-R1100 PolarHBondContact O-N 3.27Å
1097	T	87.4	Confident	83.1	Confident	14 Å²	14	62.4 Å²	62.4	9%	0.086	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-43.4	176.9	-61.1	0	0	0	0	111.2	W1093 M1094 Q1095 R1100 C1101	W1093-T1097 VanDerWaalsContact CE2-OG1 3.32Å; W1093-T1097 PolarHBondContact NE1-OG1 3.48Å; W1093-T1097 VanDerWaalsContact NE1-OG1 3.1Å; W1093-T1097 VanDerWaalsContact O-CB 3.31Å; W1093-T1097 WeakPolarHBondContact O-CB 3.31Å; W1093-T1097 PolarHBondContact O-N 2.84Å; W1093-T1097 PolarHBondContact O-OG1 3.1Å; M1094-T1097 PolarHBondContact O-N 2.6Å; Q1095-T1097 VanDerWaalsContact C-N 3.3Å; Q1095-T1097 PolarHBondContact O-N 2.94Å; T1097-R1100 PolarHBondContact O-N 2.81Å; T1097-C1101 WeakPolarHBondContact O-CB 3.42Å; T1097-C1101 PolarHBondContact O-N 3.32Å
1098	V	84.9	Confident	83.5	Confident	16 Å²	16	64.5 Å²	64.5	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-43.7	175	165	0	0	0	0	111.1	M1094 Q1095 C1101 R1102 E1128 I1132	M1094-V1098 WeakPolarHBondContact O-CG2 3.43Å; M1094-V1098 PolarHBondContact O-N 2.85Å; M1094-V1098 VanDerWaalsContact O-N 3.11Å; Q1095-V1098 PolarHBondContact O-N 3.21Å; V1098-C1101 PolarHBondContact O-N 2.75Å; V1098-R1102 WeakPolarHBondContact O-CG 3.45Å; V1098-R1102 PolarHBondContact O-N 3.4Å; V1098-E1128 HydrophobicContact CG1-CB 4.41Å; V1098-E1128 HydrophobicContact CG1-CG 3.68Å; V1098-E1128 HydrophobicContact CG2-CB 4.05Å; V1098-E1128 HydrophobicContact CG2-CG 4.23Å; V1098-I1132 HydrophobicContact CG2-CD1 4.08Å; V1098-I1132 HydrophobicContact CG2-CG1 4.19Å
1099	E	84.5	Confident	83.9	Confident	117 Å²	117	57.7 Å²	57.7	55%	0.547	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-45.2	177.4	-77	172.5	-177	0	0	112.5	Q1095 A1096 C1101 R1102 H1103	Q1095-E1099 PolarHBondContact O-N 3Å; A1096-E1099 PolarHBondContact O-N 2.93Å; E1099-C1101 VanDerWaalsContact C-N 3.31Å; E1099-C1101 PolarHBondContact O-N 3.42Å; E1099-R1102 WeakPolarHBondContact O-CB 3.46Å; E1099-R1102 PolarHBondContact O-N 2.96Å; E1099-R1102 VanDerWaalsContact O-N 3.13Å; E1099-H1103 PolarHBondContact O-N 3.4Å
1100	R	83.2	Confident	84	Confident	154 Å²	154	60 Å²	60	58%	0.581	30%	0.302	S	S	*	.	H	α-helix	trans	-58.3	-44.3	174.5	-171.9	-172	-57.7	-164.5	1.1	111.5	A1096 T1097 R1102 H1103 L1104	A1096-R1100 VanDerWaalsContact O-CB 3.28Å; A1096-R1100 WeakPolarHBondContact O-CB 3.39Å; A1096-R1100 PolarHBondContact O-N 3.27Å; T1097-R1100 PolarHBondContact O-N 2.81Å; R1100-R1102 VanDerWaalsContact C-N 3.33Å; R1100-R1102 PolarHBondContact O-N 2.92Å; R1100-H1103 PolarHBondContact O-N 2.99Å; R1100-L1104 HydrophobicContact CG-CD1 3.71Å; R1100-L1104 HydrophobicContact CG-CG 4.29Å; R1100-L1104 WeakPolarHBondContact O-CB 3.33Å; R1100-L1104 WeakPolarHBondContact O-CG 3.47Å; R1100-L1104 PolarHBondContact O-N 3.45Å
1101	C	82.9	Confident	84	Confident	8 Å²	8	61.3 Å²	61.3	5%	0.054	31%	0.314	C	S	.	.	H	α-helix	trans	-64.9	-36.3	177.3	-176.1	0	0	0	0	112.1	T1097 V1098 E1099 H1103 G1105 Y1106 A1131	T1097-C1101 WeakPolarHBondContact O-CB 3.42Å; T1097-C1101 PolarHBondContact O-N 3.32Å; V1098-C1101 PolarHBondContact O-N 2.75Å; E1099-C1101 VanDerWaalsContact C-N 3.31Å; E1099-C1101 PolarHBondContact O-N 3.42Å; C1101-H1103 VanDerWaalsContact C-N 3.33Å; C1101-G1105 WeakPolarHBondContact O-CA 3.41Å; C1101-G1105 PolarHBondContact O-N 2.94Å; C1101-Y1106 WeakPolarHBondContact CA-O 3.36Å; C1101-A1131 HydrophobicContact CB-CB 4.04Å
1102	R	77.3	Confident	83.9	Confident	112 Å²	112	64.4 Å²	64.4	42%	0.423	33%	0.327	S	S	.	.	H	α-helix	trans	-64.4	-36.9	172.7	-72.9	175.9	-171	161.8	4.6	112.3	V1098 E1099 R1100 E1128	V1098-R1102 WeakPolarHBondContact O-CG 3.45Å; V1098-R1102 PolarHBondContact O-N 3.4Å; E1099-R1102 WeakPolarHBondContact O-CB 3.46Å; E1099-R1102 PolarHBondContact O-N 2.96Å; E1099-R1102 VanDerWaalsContact O-N 3.13Å; R1100-R1102 VanDerWaalsContact C-N 3.33Å; R1100-R1102 PolarHBondContact O-N 2.92Å; R1102-E1128 IonicContact CZ-OE1 2.75Å; R1102-E1128 IonicContact NE-OE1 3.49Å; R1102-E1128 IonicContact NH2-OE1 3.69Å; R1102-E1128 PolarHBondContact NH2-OE1 3.19Å
1103	H	78.5	Confident	83.8	Confident	164 Å²	164	61.4 Å²	61.4	76%	0.759	31%	0.305	S	S	*	.	H	α-helix	trans	-75.4	-45.9	179.3	-177.9	-80.8	0	0	0	112.7	E1099 R1100 C1101	E1099-H1103 PolarHBondContact O-N 3.4Å; R1100-H1103 PolarHBondContact O-N 2.99Å; C1101-H1103 VanDerWaalsContact C-N 3.33Å
1104	L	77.4	Confident	83.1	Confident	71 Å²	71	60.8 Å²	60.8	37%	0.372	30%	0.304	S	S	.	.	H	α-helix	trans	-84	-20.7	-175.8	-63.9	178.2	0	0	0	113.5	R1100 Y1106	R1100-L1104 HydrophobicContact CG-CD1 3.71Å; R1100-L1104 HydrophobicContact CG-CG 4.29Å; R1100-L1104 WeakPolarHBondContact O-CB 3.33Å; R1100-L1104 WeakPolarHBondContact O-CG 3.47Å; R1100-L1104 PolarHBondContact O-N 3.45Å; L1104-Y1106 VanDerWaalsContact C-N 3.26Å; L1104-Y1106 HydrophobicContact CB-CD1 4.11Å; L1104-Y1106 HydrophobicContact CB-CE1 3.87Å; L1104-Y1106 HydrophobicContact CB-CE2 4.39Å; L1104-Y1106 HydrophobicContact CB-CG 4.47Å; L1104-Y1106 HydrophobicContact CD1-CE2 4.26Å; L1104-Y1106 WeakPolarHBondContact O-CD1 3.43Å; L1104-Y1106 WeakPolarHBondContact O-CE1 3.34Å; L1104-Y1106 PolarHBondContact O-N 2.83Å
1105	G	75.6	Confident	82.4	Confident	33 Å²	33	59 Å²	59	34%	0.34	30%	0.295	S	S	.	.	S	Bend	trans	81.4	-1.7	-174.6	0	0	0	0	0	114.5	C1101 K1117	C1101-G1105 WeakPolarHBondContact O-CA 3.41Å; C1101-G1105 PolarHBondContact O-N 2.94Å; G1105-K1117 WeakPolarHBondContact O-CB 3.47Å; G1105-K1117 PolarHBondContact O-N 3.48Å
1106	Y	79.6	Confident	81.2	Confident	85 Å²	85	56.5 Å²	56.5	33%	0.333	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.1	-179.2	60.4	-96.4	0	0	0	112.2	C1101 L1104 I1108 V1114 Q1115	C1101-Y1106 WeakPolarHBondContact CA-O 3.36Å; L1104-Y1106 VanDerWaalsContact C-N 3.26Å; L1104-Y1106 HydrophobicContact CB-CD1 4.11Å; L1104-Y1106 HydrophobicContact CB-CE1 3.87Å; L1104-Y1106 HydrophobicContact CB-CE2 4.39Å; L1104-Y1106 HydrophobicContact CB-CG 4.47Å; L1104-Y1106 HydrophobicContact CD1-CE2 4.26Å; L1104-Y1106 WeakPolarHBondContact O-CD1 3.43Å; L1104-Y1106 WeakPolarHBondContact O-CE1 3.34Å; L1104-Y1106 PolarHBondContact O-N 2.83Å; Y1106-I1108 HydrophobicContact CD2-CG2 3.63Å; Y1106-I1108 HydrophobicContact CE2-CG2 3.52Å; Y1106-V1114 HydrophobicContact CD1-CG1 4.39Å; Y1106-V1114 HydrophobicContact CD2-CG1 3.52Å; Y1106-V1114 HydrophobicContact CD2-CG2 4.4Å; Y1106-V1114 HydrophobicContact CE2-CG1 4.24Å; Y1106-V1114 HydrophobicContact CE2-CG2 4.42Å; Y1106-V1114 HydrophobicContact CG-CG1 3.61Å; Y1106-Q1115 CarbonylContact C-O 3.59Å; Y1106-Q1115 VanDerWaalsContact CA-O 3.25Å; Y1106-Q1115 WeakPolarHBondContact CA-O 3.4Å; Y1106-Q1115 VanDerWaalsContact CB-O 3.3Å; Y1106-Q1115 WeakPolarHBondContact CB-O 3.46Å
1107	A	82.3	Confident	79.7	Confident	8 Å²	8	57.5 Å²	57.5	7%	0.066	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	153.1	169.6	0	0	0	0	0	110	V1114 Q1115 A1131 T1134	A1107-V1114 CarbonylContact O-C 3.52Å; A1107-V1114 WeakPolarHBondContact O-CA 3.44Å; A1107-Q1115 PolarHBondContact N-O 2.95Å; A1107-Q1115 PolarHBondContact O-N 2.97Å; A1107-A1131 HydrophobicContact CB-CB 4.28Å; A1107-T1134 HydrophobicContact CB-CG2 4.07Å
1108	I	86.4	Confident	78	Confident	53 Å²	53	59 Å²	59	27%	0.272	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.8	178.6	61	176.6	0	0	0	111.6	Y1106 R1113 V1114 T1135	Y1106-I1108 HydrophobicContact CD2-CG2 3.63Å; Y1106-I1108 HydrophobicContact CE2-CG2 3.52Å; I1108-R1113 CarbonylContact C-O 3.58Å; I1108-R1113 VanDerWaalsContact CA-O 3.28Å; I1108-R1113 WeakPolarHBondContact CA-O 3.49Å; I1108-V1114 HydrophobicContact CG2-CG2 3.97Å; I1108-T1135 WeakPolarHBondContact O-CG2 3.45Å; I1108-T1135 PolarHBondContact O-OG1 3.23Å
1109	T	89.5	Confident	76.3	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.031	33%	0.33	C	S	.	.			trans	-86.2	172.1	167.8	72.1	0	0	0	0	111.3	A1111 N1112 R1113 S1139 D1142	T1109-A1111 PolarHBondContact O-N 2.92Å; T1109-A1111 PolarHBondContact OG1-N 2.97Å; T1109-N1112 PolarHBondContact O-N 3.43Å; T1109-N1112 VanDerWaalsContact O-N 3.09Å; T1109-R1113 HydrophobicContact CG2-CB 4.03Å; T1109-R1113 PolarHBondContact N-O 2.96Å; T1109-R1113 WeakPolarHBondContact OG1-CB 3.48Å; T1109-R1113 PolarHBondContact OG1-N 3.25Å; T1109-R1113 VanDerWaalsContact OG1-N 3.1Å; T1109-S1139 WeakPolarHBondContact CA-OG 3.47Å; T1109-S1139 WeakPolarHBondContact CB-OG 3.5Å; T1109-D1142 WeakPolarHBondContact CB-OD2 3.38Å; T1109-D1142 WeakPolarHBondContact CG2-OD2 3.4Å; T1109-D1142 PolarHBondContact OG1-OD2 3.4Å
1110	I	86.5	Confident	74.5	Confident	61 Å²	61	63.6 Å²	63.6	31%	0.313	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-32.7	173.3	-67.3	171.2	0	0	0	111.5	I1036 L1040 N1112 S1139 L1197	I1036-I1110 HydrophobicContact CG1-CD1 4.49Å; I1036-I1110 HydrophobicContact CG2-CD1 4.07Å; L1040-I1110 HydrophobicContact CD2-CD1 4.27Å; L1040-I1110 HydrophobicContact CD2-CG1 3.98Å; L1040-I1110 HydrophobicContact CG-CD1 4.46Å; I1110-N1112 PolarHBondContact O-N 2.85Å; I1110-S1139 WeakPolarHBondContact CG1-OG 3.47Å; I1110-S1139 PolarHBondContact N-OG 2.99Å; I1110-L1197 HydrophobicContact CD1-CD2 3.93Å
1111	A	85.3	Confident	73	Confident	31 Å²	31	61.7 Å²	61.7	26%	0.256	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	20.7	178.1	0	0	0	0	0	113.4	I851 T1109 R1113 D1142	I851-A1111 HydrophobicContact CD1-CB 3.59Å; T1109-A1111 PolarHBondContact O-N 2.92Å; T1109-A1111 PolarHBondContact OG1-N 2.97Å; A1111-R1113 VanDerWaalsContact C-N 3.25Å; A1111-R1113 PolarHBondContact O-N 2.79Å; A1111-D1142 HydrophobicContact CB-CB 3.99Å
1112	N	82.1	Confident	71.4	Confident	92 Å²	92	66.2 Å²	66.2	49%	0.492	37%	0.372	S	S	.	.			trans	61	22.6	179.9	-63.8	-31.2	0	0	0	115.5	T1109 I1110 V1114	T1109-N1112 PolarHBondContact O-N 3.43Å; T1109-N1112 VanDerWaalsContact O-N 3.09Å; I1110-N1112 PolarHBondContact O-N 2.85Å; N1112-V1114 PolarHBondContact O-N 3.31Å
1113	R	84.2	Confident	70.5	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.011	37%	0.365	C	S	.	.			trans	-76.6	126.7	172.5	-175.8	164.7	57.9	90.5	-2.9	110	L783 T993 I1108 T1109 A1111 G1138 D1142	L783-R1113 HydrophobicContact CD1-CG 3.62Å; T993-R1113 PolarHBondContact O-NH1 3.5Å; T993-R1113 PolarHBondContact O-NH2 2.99Å; I1108-R1113 CarbonylContact C-O 3.58Å; I1108-R1113 VanDerWaalsContact CA-O 3.28Å; I1108-R1113 WeakPolarHBondContact CA-O 3.49Å; T1109-R1113 HydrophobicContact CG2-CB 4.03Å; T1109-R1113 PolarHBondContact N-O 2.96Å; T1109-R1113 WeakPolarHBondContact OG1-CB 3.48Å; T1109-R1113 PolarHBondContact OG1-N 3.25Å; T1109-R1113 VanDerWaalsContact OG1-N 3.1Å; A1111-R1113 VanDerWaalsContact C-N 3.25Å; A1111-R1113 PolarHBondContact O-N 2.79Å; R1113-G1138 PolarHBondContact NH2-O 3.22Å; R1113-G1138 VanDerWaalsContact NH2-O 3.15Å; R1113-D1142 IonicContact CZ-OD1 3.69Å; R1113-D1142 IonicContact NE-OD1 2.65Å; R1113-D1142 PolarHBondContact NE-OD1 2.95Å; R1113-D1142 IonicContact NE-OD2 3.93Å; R1113-D1142 IonicContact NH2-OD1 3.94Å; R1113-D1142 PolarHBondContact NH2-OD1 3Å; R1113-D1142 IonicContact NH2-OD2 2.85Å
1114	V	77.3	Confident	69.8	Low	16 Å²	16	63.1 Å²	63.1	10%	0.097	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140	-174	180	0	0	0	0	111.1	M844 Y1106 A1107 I1108 N1112 I1116	M844-V1114 HydrophobicContact CG-CG2 4.38Å; M844-V1114 HydrophobicContact SD-CB 3.85Å; M844-V1114 HydrophobicContact SD-CG2 3.89Å; Y1106-V1114 HydrophobicContact CD1-CG1 4.39Å; Y1106-V1114 HydrophobicContact CD2-CG1 3.52Å; Y1106-V1114 HydrophobicContact CD2-CG2 4.4Å; Y1106-V1114 HydrophobicContact CE2-CG1 4.24Å; Y1106-V1114 HydrophobicContact CE2-CG2 4.42Å; Y1106-V1114 HydrophobicContact CG-CG1 3.61Å; A1107-V1114 CarbonylContact O-C 3.52Å; A1107-V1114 WeakPolarHBondContact O-CA 3.44Å; I1108-V1114 HydrophobicContact CG2-CG2 3.97Å; N1112-V1114 PolarHBondContact O-N 3.31Å; V1114-I1116 HydrophobicContact CG1-CG1 4.42Å
1115	Q	71	Confident	69.2	Low	17 Å²	17	63.4 Å²	63.4	8%	0.079	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.7	165.8	-165.8	172.1	6.6	0	0	110.5	P786 D787 A992 Y1106 A1107 T1134	P786-Q1115 HydrophobicContact CG-CG 4.39Å; D787-Q1115 PolarHBondContact OD1-NE2 2.76Å; A992-Q1115 PolarHBondContact O-NE2 3.11Å; A992-Q1115 PolarHBondContact O-OE1 3.24Å; Y1106-Q1115 CarbonylContact C-O 3.59Å; Y1106-Q1115 VanDerWaalsContact CA-O 3.25Å; Y1106-Q1115 WeakPolarHBondContact CA-O 3.4Å; Y1106-Q1115 VanDerWaalsContact CB-O 3.3Å; Y1106-Q1115 WeakPolarHBondContact CB-O 3.46Å; A1107-Q1115 PolarHBondContact N-O 2.95Å; A1107-Q1115 PolarHBondContact O-N 2.97Å; Q1115-T1134 HydrophobicContact CB-CG2 3.59Å; Q1115-T1134 HydrophobicContact CG-CG2 4.43Å; Q1115-T1134 PolarHBondContact OE1-OG1 3.31Å
1116	I	61.4	Low	69	Low	83 Å²	83	66.3 Å²	66.3	43%	0.426	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	143.1	-175.3	-57.2	172.1	0	0	0	110.2	V1114	V1114-I1116 HydrophobicContact CG1-CG1 4.42Å
1117	K	56	Low	68.5	Low	64 Å²	64	62.7 Å²	62.7	28%	0.278	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-81.2	136.6	177.9	-174.4	169.7	164	168.3	0	111.1	G1105 S1119 A1127	G1105-K1117 WeakPolarHBondContact O-CB 3.47Å; G1105-K1117 PolarHBondContact O-N 3.48Å; K1117-S1119 PolarHBondContact O-N 3.27Å; K1117-A1127 HydrophobicContact CD-CB 4.13Å; K1117-A1127 VanDerWaalsContact CE-CB 3.47Å; K1117-A1127 HydrophobicContact CG-CB 4.14Å
1118	S	51.6	Low	68.2	Low	45 Å²	45	64.4 Å²	64.4	32%	0.315	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-53.2	131.9	165	161	0	0	0	0	110.9	I1120	S1118-I1120 PolarHBondContact O-N 2.88Å; S1118-I1120 PolarHBondContact OG-N 3.27Å
1119	S	49.1	Very low	67.7	Low	128 Å²	128	70.1 Å²	70.1	90%	0.895	38%	0.38	S	S	*	.			trans	-74.8	3.7	-178.7	35.5	0	0	0	0	114.3	K1117	K1117-S1119 PolarHBondContact O-N 3.27Å
1120	I	47.8	Very low	67.2	Low	102 Å²	102	74.6 Å²	74.6	52%	0.523	40%	0.396	S	S	.	.			trans	-89.9	118.9	-175.4	-53.1	175	0	0	0	111.3	S1118 S1122	S1118-I1120 PolarHBondContact O-N 2.88Å; S1118-I1120 PolarHBondContact OG-N 3.27Å; I1120-S1122 VanDerWaalsContact C-N 3.33Å; I1120-S1122 WeakPolarHBondContact CG2-OG 3.34Å; I1120-S1122 PolarHBondContact O-N 2.89Å
1121	S	50.5	Low	67	Low	115 Å²	115	72 Å²	72	80%	0.804	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-59.3	-33.8	179.9	158.6	0	0	0	0	114.5	E1123 R1124	S1121-E1123 PolarHBondContact O-N 3.38Å; S1121-R1124 PolarHBondContact O-N 3.43Å
1122	S	50.7	Low	67	Low	103 Å²	103	71.7 Å²	71.7	72%	0.72	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-67.3	-7.1	-173.5	65.2	0	0	0	0	114.8	I1120	I1120-S1122 VanDerWaalsContact C-N 3.33Å; I1120-S1122 WeakPolarHBondContact CG2-OG 3.34Å; I1120-S1122 PolarHBondContact O-N 2.89Å
1123	E	56.8	Low	67.1	Low	62 Å²	62	70.8 Å²	70.8	29%	0.29	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-113	23.5	-176	-67.1	-170.3	-179.5	0	0	113.8	S1121 C1125 Q1126 A1127 R1130	S1121-E1123 PolarHBondContact O-N 3.38Å; E1123-C1125 PolarHBondContact O-N 3.28Å; E1123-Q1126 HydrophobicContact CB-CB 4.35Å; E1123-Q1126 WeakPolarHBondContact O-CB 3.33Å; E1123-Q1126 PolarHBondContact O-N 2.96Å; E1123-A1127 PolarHBondContact O-N 2.9Å; E1123-R1130 IonicContact OE2-CZ 3Å; E1123-R1130 IonicContact OE2-NH1 3.39Å; E1123-R1130 PolarHBondContact OE2-NH1 3.45Å; E1123-R1130 IonicContact OE2-NH2 2.76Å
1124	R	64.2	Low	67	Low	149 Å²	149	71 Å²	71	56%	0.562	37%	0.374	S	S	*	.	H	α-helix	trans	-48.5	-50.7	-172.4	-172.7	174.2	178.4	168.9	2	114.3	S1121 Q1126 A1127 E1128	S1121-R1124 PolarHBondContact O-N 3.43Å; R1124-Q1126 VanDerWaalsContact C-N 3.34Å; R1124-Q1126 PolarHBondContact O-N 3.21Å; R1124-A1127 PolarHBondContact O-N 3.09Å; R1124-E1128 WeakPolarHBondContact CG-OE1 3.3Å; R1124-E1128 IonicContact NE-OE1 2.63Å; R1124-E1128 PolarHBondContact NE-OE1 2.81Å; R1124-E1128 VanDerWaalsContact O-CG 3.23Å; R1124-E1128 WeakPolarHBondContact O-CG 3.42Å; R1124-E1128 PolarHBondContact O-N 3.46Å
1125	C	65.7	Low	67.5	Low	76 Å²	76	70.8 Å²	70.8	51%	0.514	37%	0.373	S	S	.	.	H	α-helix	trans	-65.4	-36.1	-179.9	-172	0	0	0	0	112.7	E1123 R1129	E1123-C1125 PolarHBondContact O-N 3.28Å; C1125-R1129 WeakPolarHBondContact O-CG 3.45Å; C1125-R1129 PolarHBondContact O-N 2.92Å; C1125-R1129 VanDerWaalsContact O-N 3.12Å
1126	Q	70.2	Confident	68.4	Low	94 Å²	94	70.3 Å²	70.3	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-70.9	-39.7	177	-172.2	172.2	5.8	0	0	111.1	E1123 R1124 R1129 R1130	E1123-Q1126 HydrophobicContact CB-CB 4.35Å; E1123-Q1126 WeakPolarHBondContact O-CB 3.33Å; E1123-Q1126 PolarHBondContact O-N 2.96Å; R1124-Q1126 VanDerWaalsContact C-N 3.34Å; R1124-Q1126 PolarHBondContact O-N 3.21Å; Q1126-R1129 PolarHBondContact O-N 2.85Å; Q1126-R1130 VanDerWaalsContact NE2-NH2 3.17Å; Q1126-R1130 WeakPolarHBondContact O-CB 3.09Å; Q1126-R1130 VanDerWaalsContact O-CG 3.25Å; Q1126-R1130 WeakPolarHBondContact O-CG 3.33Å; Q1126-R1130 PolarHBondContact O-N 2.98Å
1127	A	69.8	Low	69.7	Low	9 Å²	9	68.1 Å²	68.1	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-35.8	176.5	0	0	0	0	0	112.7	K1117 E1123 R1124 R1130 A1131	K1117-A1127 HydrophobicContact CD-CB 4.13Å; K1117-A1127 VanDerWaalsContact CE-CB 3.47Å; K1117-A1127 HydrophobicContact CG-CB 4.14Å; E1123-A1127 PolarHBondContact O-N 2.9Å; R1124-A1127 PolarHBondContact O-N 3.09Å; A1127-R1130 PolarHBondContact O-N 3.04Å; A1127-A1131 PolarHBondContact O-N 2.9Å
1128	E	75.9	Confident	71.2	Confident	45 Å²	45	65.1 Å²	65.1	21%	0.21	35%	0.346	C	S	.	.	H	α-helix	trans	-66.3	-45.1	174.3	-71.2	171.7	-177	0	0	111.8	V1098 R1102 R1124 R1130 A1131 I1132	V1098-E1128 HydrophobicContact CG1-CB 4.41Å; V1098-E1128 HydrophobicContact CG1-CG 3.68Å; V1098-E1128 HydrophobicContact CG2-CB 4.05Å; V1098-E1128 HydrophobicContact CG2-CG 4.23Å; R1102-E1128 IonicContact CZ-OE1 2.75Å; R1102-E1128 IonicContact NE-OE1 3.49Å; R1102-E1128 IonicContact NH2-OE1 3.69Å; R1102-E1128 PolarHBondContact NH2-OE1 3.19Å; R1124-E1128 WeakPolarHBondContact CG-OE1 3.3Å; R1124-E1128 IonicContact NE-OE1 2.63Å; R1124-E1128 PolarHBondContact NE-OE1 2.81Å; R1124-E1128 VanDerWaalsContact O-CG 3.23Å; R1124-E1128 WeakPolarHBondContact O-CG 3.42Å; R1124-E1128 PolarHBondContact O-N 3.46Å; E1128-R1130 VanDerWaalsContact C-N 3.32Å; E1128-R1130 PolarHBondContact O-N 2.89Å; E1128-A1131 PolarHBondContact O-N 2.91Å; E1128-I1132 PolarHBondContact O-N 3.15Å
1129	R	76.9	Confident	73.1	Confident	172 Å²	172	63 Å²	63	65%	0.649	33%	0.331	S	S	*	.	H	α-helix	trans	-62	-40	172.3	-75	178.5	174.7	165.8	0.1	112.2	C1125 Q1126 I1132 N1133	C1125-R1129 WeakPolarHBondContact O-CG 3.45Å; C1125-R1129 PolarHBondContact O-N 2.92Å; C1125-R1129 VanDerWaalsContact O-N 3.12Å; Q1126-R1129 PolarHBondContact O-N 2.85Å; R1129-I1132 PolarHBondContact O-N 3.26Å; R1129-N1133 WeakPolarHBondContact O-CB 3.45Å; R1129-N1133 VanDerWaalsContact O-CG 3.25Å; R1129-N1133 PolarHBondContact O-N 3.02Å; R1129-N1133 PolarHBondContact O-ND2 3.23Å
1130	R	79.2	Confident	75	Confident	100 Å²	100	57.2 Å²	57.2	38%	0.377	29%	0.292	S	S	.	.	H	α-helix	trans	-58.6	-50.7	175.2	-80.2	174.5	176.7	150.2	-1.1	110.4	E1123 Q1126 A1127 E1128 I1132 N1133 T1134	E1123-R1130 IonicContact OE2-CZ 3Å; E1123-R1130 IonicContact OE2-NH1 3.39Å; E1123-R1130 PolarHBondContact OE2-NH1 3.45Å; E1123-R1130 IonicContact OE2-NH2 2.76Å; Q1126-R1130 VanDerWaalsContact NE2-NH2 3.17Å; Q1126-R1130 WeakPolarHBondContact O-CB 3.09Å; Q1126-R1130 VanDerWaalsContact O-CG 3.25Å; Q1126-R1130 WeakPolarHBondContact O-CG 3.33Å; Q1126-R1130 PolarHBondContact O-N 2.98Å; A1127-R1130 PolarHBondContact O-N 3.04Å; E1128-R1130 VanDerWaalsContact C-N 3.32Å; E1128-R1130 PolarHBondContact O-N 2.89Å; R1130-I1132 VanDerWaalsContact C-N 3.32Å; R1130-I1132 PolarHBondContact O-N 2.76Å; R1130-N1133 PolarHBondContact O-N 3.48Å; R1130-N1133 VanDerWaalsContact O-N 3.13Å; R1130-T1134 WeakPolarHBondContact O-CB 3.24Å; R1130-T1134 PolarHBondContact O-N 3.17Å; R1130-T1134 PolarHBondContact O-OG1 2.64Å
1131	A	80.8	Confident	77	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-54.8	-45.7	179.8	0	0	0	0	0	112.9	C1101 A1107 A1127 E1128 T1135	C1101-A1131 HydrophobicContact CB-CB 4.04Å; A1107-A1131 HydrophobicContact CB-CB 4.28Å; A1127-A1131 PolarHBondContact O-N 2.9Å; E1128-A1131 PolarHBondContact O-N 2.91Å; A1131-T1135 PolarHBondContact O-N 3.21Å; A1131-T1135 VanDerWaalsContact O-N 3.16Å; A1131-T1135 PolarHBondContact O-OG1 3.23Å
1132	I	85.4	Confident	78.9	Confident	26 Å²	26	47.5 Å²	47.5	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-46.3	178	-61.4	174	0	0	0	110.9	W1093 M1094 V1098 E1128 R1129 R1130 T1134 T1135 V1136	W1093-I1132 HydrophobicContact CH2-CG2 4.13Å; W1093-I1132 HydrophobicContact CZ3-CG2 4.28Å; M1094-I1132 HydrophobicContact CB-CD1 4Å; M1094-I1132 HydrophobicContact CE-CD1 3.55Å; M1094-I1132 HydrophobicContact CE-CG2 4.48Å; M1094-I1132 HydrophobicContact CG-CD1 4.08Å; V1098-I1132 HydrophobicContact CG2-CD1 4.08Å; V1098-I1132 HydrophobicContact CG2-CG1 4.19Å; E1128-I1132 PolarHBondContact O-N 3.15Å; R1129-I1132 PolarHBondContact O-N 3.26Å; R1130-I1132 VanDerWaalsContact C-N 3.32Å; R1130-I1132 PolarHBondContact O-N 2.76Å; I1132-T1134 VanDerWaalsContact C-N 3.34Å; I1132-T1134 PolarHBondContact O-N 2.93Å; I1132-T1135 PolarHBondContact O-N 2.66Å; I1132-V1136 WeakPolarHBondContact O-CG2 3.43Å; I1132-V1136 PolarHBondContact O-N 3.17Å
1133	N	83.7	Confident	80.7	Confident	72 Å²	72	42.9 Å²	42.9	39%	0.385	20%	0.199	S	C	.	.	H	α-helix	trans	-63.6	-38.1	179.1	-73.6	-12.5	0	0	0	112.1	R1129 R1130 V1136 Q1137	R1129-N1133 WeakPolarHBondContact O-CB 3.45Å; R1129-N1133 VanDerWaalsContact O-CG 3.25Å; R1129-N1133 PolarHBondContact O-N 3.02Å; R1129-N1133 PolarHBondContact O-ND2 3.23Å; R1130-N1133 PolarHBondContact O-N 3.48Å; R1130-N1133 VanDerWaalsContact O-N 3.13Å; N1133-V1136 PolarHBondContact O-N 3.01Å; N1133-Q1137 HydrophobicContact CB-CG 4.5Å; N1133-Q1137 WeakPolarHBondContact O-CA 3.28Å; N1133-Q1137 WeakPolarHBondContact O-CB 3.46Å; N1133-Q1137 WeakPolarHBondContact O-CG 2.81Å; N1133-Q1137 PolarHBondContact O-N 3.05Å
1134	T	83	Confident	82.2	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.043	19%	0.189	C	C	.	.	I	π-helix	trans	-58.3	-52.2	173.7	-58.7	0	0	0	0	110.5	A1107 Q1115 R1130 I1132 V1136 G1138	A1107-T1134 HydrophobicContact CB-CG2 4.07Å; Q1115-T1134 HydrophobicContact CB-CG2 3.59Å; Q1115-T1134 HydrophobicContact CG-CG2 4.43Å; Q1115-T1134 PolarHBondContact OE1-OG1 3.31Å; R1130-T1134 WeakPolarHBondContact O-CB 3.24Å; R1130-T1134 PolarHBondContact O-N 3.17Å; R1130-T1134 PolarHBondContact O-OG1 2.64Å; I1132-T1134 VanDerWaalsContact C-N 3.34Å; I1132-T1134 PolarHBondContact O-N 2.93Å; T1134-V1136 VanDerWaalsContact C-N 3.32Å; T1134-V1136 PolarHBondContact O-N 2.82Å; T1134-G1138 WeakPolarHBondContact O-CA 3.4Å; T1134-G1138 PolarHBondContact O-N 2.89Å
1135	T	88.1	Confident	83.3	Confident	12 Å²	12	33.6 Å²	33.6	7%	0.074	16%	0.162	C	C	.	.	I	π-helix	trans	-65	-36.9	-176.9	-61.3	0	0	0	0	111.7	L1040 W1093 I1108 A1131 I1132 S1139	L1040-T1135 HydrophobicContact CD1-CG2 3.64Å; W1093-T1135 HydrophobicContact CZ2-CG2 3.99Å; I1108-T1135 WeakPolarHBondContact O-CG2 3.45Å; I1108-T1135 PolarHBondContact O-OG1 3.23Å; A1131-T1135 PolarHBondContact O-N 3.21Å; A1131-T1135 VanDerWaalsContact O-N 3.16Å; A1131-T1135 PolarHBondContact O-OG1 3.23Å; I1132-T1135 PolarHBondContact O-N 2.66Å; T1135-S1139 WeakPolarHBondContact O-CB 3.47Å; T1135-S1139 PolarHBondContact O-OG 2.92Å
1136	V	90.1	Very high	84.4	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.042	15%	0.149	C	C	.	.	I	π-helix	trans	-83.6	-60.7	179.7	-179.8	0	0	0	0	112.3	E1033 I1036 I1037 W1093 I1132 N1133 T1134 S1139 A1140	E1033-V1136 HydrophobicContact CB-CG1 3.75Å; E1033-V1136 HydrophobicContact CG-CG1 4.04Å; I1036-V1136 HydrophobicContact CG2-CG1 4.39Å; I1037-V1136 HydrophobicContact CD1-CG1 4.17Å; I1037-V1136 HydrophobicContact CD1-CG2 4.32Å; I1037-V1136 HydrophobicContact CG1-CG1 3.97Å; I1037-V1136 HydrophobicContact CG1-CG2 3.72Å; W1093-V1136 HydrophobicContact CH2-CG2 3.56Å; W1093-V1136 HydrophobicContact CZ2-CG2 4.41Å; W1093-V1136 HydrophobicContact CZ3-CG2 4.32Å; I1132-V1136 WeakPolarHBondContact O-CG2 3.43Å; I1132-V1136 PolarHBondContact O-N 3.17Å; N1133-V1136 PolarHBondContact O-N 3.01Å; T1134-V1136 VanDerWaalsContact C-N 3.32Å; T1134-V1136 PolarHBondContact O-N 2.82Å; V1136-S1139 PolarHBondContact O-N 2.68Å; V1136-A1140 WeakPolarHBondContact O-CB 3.5Å; V1136-A1140 PolarHBondContact O-N 2.93Å
1137	Q	87.2	Confident	85	Confident	38 Å²	38	27.7 Å²	27.7	18%	0.178	13%	0.128	C	C	.	.	I	π-helix	trans	-71.6	-32.9	-174.1	-54.9	-176.8	-16	0	0	111.7	N1133 A1140 S1141	N1133-Q1137 HydrophobicContact CB-CG 4.5Å; N1133-Q1137 WeakPolarHBondContact O-CA 3.28Å; N1133-Q1137 WeakPolarHBondContact O-CB 3.46Å; N1133-Q1137 WeakPolarHBondContact O-CG 2.81Å; N1133-Q1137 PolarHBondContact O-N 3.05Å; Q1137-A1140 PolarHBondContact O-N 3.39Å; Q1137-S1141 PolarHBondContact O-N 2.96Å
1138	G	88.2	Confident	85.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.126	C	C	.	.	I	π-helix	trans	-65.5	-47.1	173.1	0	0	0	0	0	111.5	T993 R1113 T1134 A1140 S1141 D1142	T993-G1138 WeakPolarHBondContact O-CA 3.27Å; R1113-G1138 PolarHBondContact NH2-O 3.22Å; R1113-G1138 VanDerWaalsContact NH2-O 3.15Å; T1134-G1138 WeakPolarHBondContact O-CA 3.4Å; T1134-G1138 PolarHBondContact O-N 2.89Å; G1138-A1140 VanDerWaalsContact C-N 3.3Å; G1138-A1140 PolarHBondContact O-N 3.31Å; G1138-S1141 WeakPolarHBondContact O-CA 3.28Å; G1138-S1141 WeakPolarHBondContact O-CB 3.41Å; G1138-S1141 PolarHBondContact O-N 3.36Å; G1138-S1141 VanDerWaalsContact O-N 3.08Å; G1138-D1142 PolarHBondContact O-N 3.12Å; G1138-D1142 VanDerWaalsContact O-OD1 3.13Å
1139	S	91.8	Very high	85.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-37.9	174	-58.4	0	0	0	0	112.3	T1109 I1110 T1135 V1136 S1141 D1142 I1143	T1109-S1139 WeakPolarHBondContact CA-OG 3.47Å; T1109-S1139 WeakPolarHBondContact CB-OG 3.5Å; I1110-S1139 WeakPolarHBondContact CG1-OG 3.47Å; I1110-S1139 PolarHBondContact N-OG 2.99Å; T1135-S1139 WeakPolarHBondContact O-CB 3.47Å; T1135-S1139 PolarHBondContact O-OG 2.92Å; V1136-S1139 PolarHBondContact O-N 2.68Å; S1139-S1141 VanDerWaalsContact C-N 3.28Å; S1139-S1141 PolarHBondContact O-N 3.18Å; S1139-D1142 PolarHBondContact O-N 3.25Å; S1139-I1143 VanDerWaalsContact O-CG1 3.31Å; S1139-I1143 WeakPolarHBondContact O-CG1 3.45Å; S1139-I1143 PolarHBondContact O-N 2.9Å
1140	A	89.7	Confident	86.1	Confident	8 Å²	8	21.6 Å²	21.6	7%	0.066	11%	0.11	C	C	.	.	H	α-helix	trans	-61.3	-40.6	174.6	0	0	0	0	0	111.3	L1032 E1033 I1036 V1136 Q1137 G1138 F1144	L1032-A1140 HydrophobicContact CD2-CB 3.89Å; L1032-A1140 HydrophobicContact CG-CB 4.13Å; E1033-A1140 HydrophobicContact CG-CB 3.99Å; I1036-A1140 VanDerWaalsContact CD1-CA 3.41Å; I1036-A1140 HydrophobicContact CD1-CB 3.62Å; I1036-A1140 VanDerWaalsContact CD1-N 3.34Å; V1136-A1140 WeakPolarHBondContact O-CB 3.5Å; V1136-A1140 PolarHBondContact O-N 2.93Å; Q1137-A1140 PolarHBondContact O-N 3.39Å; G1138-A1140 VanDerWaalsContact C-N 3.3Å; G1138-A1140 PolarHBondContact O-N 3.31Å; A1140-F1144 VanDerWaalsContact O-CB 3.24Å; A1140-F1144 WeakPolarHBondContact O-CB 3.3Å; A1140-F1144 PolarHBondContact O-N 3.19Å
1141	S	89.3	Confident	86	Confident	8 Å²	8	16.9 Å²	16.9	6%	0.056	9%	0.092	C	C	.	.	H	α-helix	trans	-66.1	-40.5	175.6	-169.2	0	0	0	0	112.4	G994 R995 Q1137 G1138 S1139 F1144 K1145	G994-S1141 PolarHBondContact O-OG 3.3Å; R995-S1141 PolarHBondContact N-OG 2.88Å; Q1137-S1141 PolarHBondContact O-N 2.96Å; G1138-S1141 WeakPolarHBondContact O-CA 3.28Å; G1138-S1141 WeakPolarHBondContact O-CB 3.41Å; G1138-S1141 PolarHBondContact O-N 3.36Å; G1138-S1141 VanDerWaalsContact O-N 3.08Å; S1139-S1141 VanDerWaalsContact C-N 3.28Å; S1139-S1141 PolarHBondContact O-N 3.18Å; S1141-F1144 PolarHBondContact O-N 3.39Å; S1141-K1145 VanDerWaalsContact O-CG 3.31Å; S1141-K1145 WeakPolarHBondContact O-CG 3.38Å; S1141-K1145 PolarHBondContact O-N 3.31Å
1142	D	89.4	Confident	85.7	Confident	4 Å²	4	17.5 Å²	17.5	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-65.8	-46.4	-179.7	-57.1	-17.5	0	0	0	110.6	T1109 A1111 R1113 G1138 S1139 F1144 K1145 L1146	T1109-D1142 WeakPolarHBondContact CB-OD2 3.38Å; T1109-D1142 WeakPolarHBondContact CG2-OD2 3.4Å; T1109-D1142 PolarHBondContact OG1-OD2 3.4Å; A1111-D1142 HydrophobicContact CB-CB 3.99Å; R1113-D1142 IonicContact CZ-OD1 3.69Å; R1113-D1142 IonicContact NE-OD1 2.65Å; R1113-D1142 PolarHBondContact NE-OD1 2.95Å; R1113-D1142 IonicContact NE-OD2 3.93Å; R1113-D1142 IonicContact NH2-OD1 3.94Å; R1113-D1142 PolarHBondContact NH2-OD1 3Å; R1113-D1142 IonicContact NH2-OD2 2.85Å; G1138-D1142 PolarHBondContact O-N 3.12Å; G1138-D1142 VanDerWaalsContact O-OD1 3.13Å; S1139-D1142 PolarHBondContact O-N 3.25Å; D1142-F1144 VanDerWaalsContact C-N 3.31Å; D1142-F1144 PolarHBondContact O-N 2.84Å; D1142-K1145 PolarHBondContact O-N 3.06Å; D1142-L1146 WeakPolarHBondContact O-CG 3.27Å; D1142-L1146 PolarHBondContact O-N 3.26Å
1143	I	90.2	Very high	85.1	Confident	6 Å²	6	21 Å²	21	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-41.9	175	-65.4	173.6	0	0	0	110.7	F1029 L1032 I1036 S1139 L1146 A1147 A1194 A1195 L1197 L1201	F1029-I1143 HydrophobicContact CE2-CG2 4.24Å; F1029-I1143 HydrophobicContact CZ-CG2 4.05Å; L1032-I1143 HydrophobicContact CD1-CD1 4.34Å; L1032-I1143 HydrophobicContact CD1-CG2 4.18Å; I1036-I1143 HydrophobicContact CD1-CD1 4.04Å; I1036-I1143 HydrophobicContact CG1-CD1 4.09Å; S1139-I1143 VanDerWaalsContact O-CG1 3.31Å; S1139-I1143 WeakPolarHBondContact O-CG1 3.45Å; S1139-I1143 PolarHBondContact O-N 2.9Å; I1143-L1146 PolarHBondContact O-N 3.49Å; I1143-A1147 WeakPolarHBondContact O-CB 3.32Å; I1143-A1147 PolarHBondContact O-N 2.79Å; I1143-A1194 HydrophobicContact CG2-CB 4.38Å; I1143-A1195 HydrophobicContact CD1-CB 4.04Å; I1143-A1195 HydrophobicContact CG1-CB 3.8Å; I1143-A1195 HydrophobicContact CG2-CB 4.2Å; I1143-L1197 HydrophobicContact CD1-CD1 4.11Å; I1143-L1197 HydrophobicContact CD1-CD2 4.42Å; I1143-L1201 HydrophobicContact CG2-CD1 4.13Å
1144	F	87.2	Confident	84.5	Confident	15 Å²	15	23.5 Å²	23.5	7%	0.066	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-42	177.5	-175.1	-111.6	0	0	0	112.2	F1029 A1140 S1141 D1142 A1147 V1148 L1163 S1166 I1168	F1029-F1144 HydrophobicContact CD2-CD2 4.37Å; F1029-F1144 HydrophobicContact CE2-CD2 4.3Å; A1140-F1144 VanDerWaalsContact O-CB 3.24Å; A1140-F1144 WeakPolarHBondContact O-CB 3.3Å; A1140-F1144 PolarHBondContact O-N 3.19Å; S1141-F1144 PolarHBondContact O-N 3.39Å; D1142-F1144 VanDerWaalsContact C-N 3.31Å; D1142-F1144 PolarHBondContact O-N 2.84Å; F1144-A1147 WeakPolarHBondContact O-CB 3.42Å; F1144-A1147 PolarHBondContact O-N 3.26Å; F1144-V1148 HydrophobicContact CD1-CG2 4.41Å; F1144-V1148 HydrophobicContact CE1-CG2 4.1Å; F1144-V1148 HydrophobicContact CZ-CG2 4.14Å; F1144-V1148 WeakPolarHBondContact O-CG2 3.4Å; F1144-V1148 PolarHBondContact O-N 3Å; F1144-L1163 HydrophobicContact CE1-CD2 3.54Å; F1144-L1163 HydrophobicContact CE2-CD2 4.4Å; F1144-L1163 HydrophobicContact CZ-CD2 3.3Å; F1144-S1166 WeakPolarHBondContact CE2-O 2.98Å; F1144-S1166 VanDerWaalsContact CZ-C 3.48Å; F1144-I1168 HydrophobicContact CE2-CG1 4.44Å
1145	K	88.3	Confident	83.8	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.009	13%	0.125	C	C	.	.	H	α-helix	trans	-63.9	-39.9	175.7	-74.1	173.7	-174.9	-179.6	0	112.3	I851 E852 A855 W989 G994 S1141 D1142 A1147 V1148 K1149	I851-K1145 HydrophobicContact CG2-CB 3.71Å; I851-K1145 HydrophobicContact CG2-CD 4.17Å; E852-K1145 IonicContact OE1-NZ 3.55Å; E852-K1145 PolarHBondContact OE1-NZ 3.25Å; E852-K1145 IonicContact OE2-NZ 3.27Å; E852-K1145 PolarHBondContact OE2-NZ 2.97Å; A855-K1145 HydrophobicContact CB-CB 3.85Å; A855-K1145 HydrophobicContact CB-CD 4.41Å; A855-K1145 HydrophobicContact CB-CG 4.01Å; W989-K1145 HydrophobicContact CZ2-CD 4.19Å; G994-K1145 WeakPolarHBondContact O-CE 3.5Å; G994-K1145 PolarHBondContact O-NZ 3.02Å; S1141-K1145 VanDerWaalsContact O-CG 3.31Å; S1141-K1145 WeakPolarHBondContact O-CG 3.38Å; S1141-K1145 PolarHBondContact O-N 3.31Å; D1142-K1145 PolarHBondContact O-N 3.06Å; K1145-A1147 VanDerWaalsContact C-N 3.33Å; K1145-V1148 PolarHBondContact O-N 3.27Å; K1145-K1149 PolarHBondContact O-N 2.82Å
1146	L	87.7	Confident	82.6	Confident	46 Å²	46	29.9 Å²	29.9	24%	0.241	15%	0.152	C	C	.	.	H	α-helix	trans	-61.3	-42.2	172.2	-76.6	171.2	0	0	0	111.8	I851 D1142 I1143 K1149 A1150 A1194	I851-L1146 HydrophobicContact CD1-CD1 4.29Å; I851-L1146 HydrophobicContact CD1-CG 4.36Å; I851-L1146 HydrophobicContact CG1-CD2 3.9Å; I851-L1146 HydrophobicContact CG1-CG 4.15Å; I851-L1146 HydrophobicContact CG2-CG 4.43Å; D1142-L1146 WeakPolarHBondContact O-CG 3.27Å; D1142-L1146 PolarHBondContact O-N 3.26Å; I1143-L1146 PolarHBondContact O-N 3.49Å; L1146-K1149 WeakPolarHBondContact O-CB 3.4Å; L1146-K1149 PolarHBondContact O-N 3.08Å; L1146-A1150 WeakPolarHBondContact O-CB 3.35Å; L1146-A1150 PolarHBondContact O-N 3.26Å; L1146-A1194 HydrophobicContact CB-CB 4.39Å
1147	A	84.2	Confident	80.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-43	175.5	0	0	0	0	0	111.9	F1029 I1143 F1144 K1145 A1150 V1151 M1191 A1194	F1029-A1147 HydrophobicContact CE2-CB 3.86Å; F1029-A1147 HydrophobicContact CZ-CB 3.86Å; I1143-A1147 WeakPolarHBondContact O-CB 3.32Å; I1143-A1147 PolarHBondContact O-N 2.79Å; F1144-A1147 WeakPolarHBondContact O-CB 3.42Å; F1144-A1147 PolarHBondContact O-N 3.26Å; K1145-A1147 VanDerWaalsContact C-N 3.33Å; A1147-A1150 PolarHBondContact O-N 3.44Å; A1147-V1151 WeakPolarHBondContact O-CG2 3.48Å; A1147-V1151 PolarHBondContact O-N 3.05Å; A1147-M1191 HydrophobicContact CB-CB 4.48Å; A1147-M1191 HydrophobicContact CB-CE 4.43Å; A1147-M1191 HydrophobicContact CB-CG 4.12Å; A1147-A1194 HydrophobicContact CB-CB 3.83Å
1148	V	81.7	Confident	79.2	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-48.4	174.2	171.9	0	0	0	0	111.2	A858 M862 F1144 K1145 A1150 V1151 C1152 L1163 I1168	A858-V1148 HydrophobicContact CB-CG1 3.82Å; M862-V1148 HydrophobicContact CE-CG1 3.67Å; F1144-V1148 HydrophobicContact CD1-CG2 4.41Å; F1144-V1148 HydrophobicContact CE1-CG2 4.1Å; F1144-V1148 HydrophobicContact CZ-CG2 4.14Å; F1144-V1148 WeakPolarHBondContact O-CG2 3.4Å; F1144-V1148 PolarHBondContact O-N 3Å; K1145-V1148 PolarHBondContact O-N 3.27Å; V1148-A1150 VanDerWaalsContact C-N 3.33Å; V1148-A1150 PolarHBondContact O-N 3.07Å; V1148-V1151 PolarHBondContact O-N 3.05Å; V1148-C1152 WeakPolarHBondContact O-CB 3.3Å; V1148-C1152 PolarHBondContact O-N 2.85Å; V1148-C1152 PolarHBondContact O-SG 3.23Å; V1148-C1152 VanDerWaalsContact O-SG 3.33Å; V1148-L1163 HydrophobicContact CG1-CD1 4.38Å; V1148-L1163 HydrophobicContact CG2-CD1 4.17Å; V1148-L1163 HydrophobicContact CG2-CD2 3.39Å; V1148-L1163 HydrophobicContact CG2-CG 4.35Å; V1148-I1168 HydrophobicContact CG2-CD1 4.14Å; V1148-I1168 HydrophobicContact CG2-CG1 4.34Å
1149	K	82	Confident	77.8	Confident	65 Å²	65	39.3 Å²	39.3	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-56.2	-47.2	174.9	176.2	-170.4	178.7	-177.6	0	111.3	E850 P854 K1145 L1146 C1152 T1153	E850-K1149 WeakPolarHBondContact O-CD 3.24Å; E850-K1149 PolarHBondContact O-NZ 2.78Å; P854-K1149 HydrophobicContact CB-CD 3.91Å; P854-K1149 HydrophobicContact CB-CG 4.01Å; P854-K1149 HydrophobicContact CG-CD 4.34Å; K1145-K1149 PolarHBondContact O-N 2.82Å; L1146-K1149 WeakPolarHBondContact O-CB 3.4Å; L1146-K1149 PolarHBondContact O-N 3.08Å; K1149-C1152 PolarHBondContact O-N 2.75Å; K1149-T1153 WeakPolarHBondContact O-CB 3.35Å; K1149-T1153 PolarHBondContact O-N 3.14Å; K1149-T1153 PolarHBondContact O-OG1 3.16Å
1150	A	81.4	Confident	76	Confident	29 Å²	29	43.3 Å²	43.3	24%	0.24	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-44.8	-179.1	0	0	0	0	0	111.8	L1146 A1147 V1148 R1154 A1190	L1146-A1150 WeakPolarHBondContact O-CB 3.35Å; L1146-A1150 PolarHBondContact O-N 3.26Å; A1147-A1150 PolarHBondContact O-N 3.44Å; V1148-A1150 VanDerWaalsContact C-N 3.33Å; V1148-A1150 PolarHBondContact O-N 3.07Å; A1150-R1154 PolarHBondContact O-N 2.7Å; A1150-A1190 HydrophobicContact CB-CB 4.01Å
1151	V	76.3	Confident	74.4	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-45.1	178.6	175.1	0	0	0	0	111.6	A1147 V1148 T1153 R1154 L1155 I1161 I1168 A1190 M1191	A1147-V1151 WeakPolarHBondContact O-CG2 3.48Å; A1147-V1151 PolarHBondContact O-N 3.05Å; V1148-V1151 PolarHBondContact O-N 3.05Å; V1151-T1153 VanDerWaalsContact C-N 3.35Å; V1151-T1153 PolarHBondContact O-N 3.48Å; V1151-R1154 PolarHBondContact O-N 3.38Å; V1151-L1155 HydrophobicContact CG1-CD1 3.53Å; V1151-L1155 HydrophobicContact CG1-CG 4.15Å; V1151-L1155 WeakPolarHBondContact O-CB 3.47Å; V1151-L1155 WeakPolarHBondContact O-CG 3.2Å; V1151-L1155 PolarHBondContact O-N 2.86Å; V1151-I1161 HydrophobicContact CG1-CD1 4.23Å; V1151-I1168 HydrophobicContact CB-CD1 4Å; V1151-I1168 HydrophobicContact CG1-CD1 4.36Å; V1151-I1168 HydrophobicContact CG1-CG2 4.04Å; V1151-I1168 HydrophobicContact CG2-CD1 3.75Å; V1151-A1190 HydrophobicContact CG2-CB 3.89Å; V1151-M1191 HydrophobicContact CG2-CG 3.96Å
1152	C	75.3	Confident	72.9	Confident	17 Å²	17	43.5 Å²	43.5	12%	0.115	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-43.8	177.2	-75.2	0	0	0	0	112.4	A858 V1148 K1149 Q1156 I1161	A858-C1152 HydrophobicContact CB-CB 4.16Å; A858-C1152 WeakPolarHBondContact CB-SG 3.33Å; V1148-C1152 WeakPolarHBondContact O-CB 3.3Å; V1148-C1152 PolarHBondContact O-N 2.85Å; V1148-C1152 PolarHBondContact O-SG 3.23Å; V1148-C1152 VanDerWaalsContact O-SG 3.33Å; K1149-C1152 PolarHBondContact O-N 2.75Å; C1152-Q1156 PolarHBondContact O-N 2.88Å; C1152-I1161 HydrophobicContact CB-CD1 4.47Å; C1152-I1161 VanDerWaalsContact SG-CD1 3.52Å
1153	T	72.9	Confident	71.2	Confident	101 Å²	101	43.5 Å²	43.5	62%	0.62	22%	0.224	S	C	*	.	H	α-helix	trans	-63.3	-44.2	177.8	-59.6	0	0	0	0	111.1	K1149 V1151 Q1156	K1149-T1153 WeakPolarHBondContact O-CB 3.35Å; K1149-T1153 PolarHBondContact O-N 3.14Å; K1149-T1153 PolarHBondContact O-OG1 3.16Å; V1151-T1153 VanDerWaalsContact C-N 3.35Å; V1151-T1153 PolarHBondContact O-N 3.48Å; T1153-Q1156 PolarHBondContact O-N 2.89Å
1154	R	71.1	Confident	69.5	Low	124 Å²	124	43.3 Å²	43.3	47%	0.468	22%	0.223	S	C	.	.	H	α-helix	trans	-68.6	-40.7	179.2	-76.7	-164.4	178.5	142.8	5.9	113.4	A1150 V1151 Q1156 E1186 A1190	A1150-R1154 PolarHBondContact O-N 2.7Å; V1151-R1154 PolarHBondContact O-N 3.38Å; R1154-Q1156 PolarHBondContact O-N 3.47Å; R1154-Q1156 VanDerWaalsContact O-N 3.16Å; R1154-E1186 PolarHBondContact NH1-O 3.01Å; R1154-A1190 VanDerWaalsContact NH1-CB 3.26Å
1155	L	67.9	Low	67.7	Low	15 Å²	15	47.2 Å²	47.2	8%	0.079	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-0.9	179.6	-65.4	176.4	0	0	0	113.7	V1151 G1157 K1158 H1159 I1161 C1170	V1151-L1155 HydrophobicContact CG1-CD1 3.53Å; V1151-L1155 HydrophobicContact CG1-CG 4.15Å; V1151-L1155 WeakPolarHBondContact O-CB 3.47Å; V1151-L1155 WeakPolarHBondContact O-CG 3.2Å; V1151-L1155 PolarHBondContact O-N 2.86Å; L1155-G1157 PolarHBondContact O-N 3.28Å; L1155-K1158 PolarHBondContact O-N 3.08Å; L1155-H1159 HydrophobicContact CB-CB 4.47Å; L1155-H1159 HydrophobicContact CD1-CB 4.2Å; L1155-I1161 HydrophobicContact CD1-CD1 3.85Å; L1155-I1161 HydrophobicContact CD1-CG1 4.27Å; L1155-C1170 VanDerWaalsContact CD1-SG 3.56Å
1156	Q	62.3	Low	65.9	Low	137 Å²	137	49.4 Å²	49.4	64%	0.64	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	29.8	177.7	-62.4	-175	-17.4	0	0	114	C1152 T1153 R1154 K1158	C1152-Q1156 PolarHBondContact O-N 2.88Å; T1153-Q1156 PolarHBondContact O-N 2.89Å; R1154-Q1156 PolarHBondContact O-N 3.47Å; R1154-Q1156 VanDerWaalsContact O-N 3.16Å; Q1156-K1158 PolarHBondContact O-N 2.86Å
1157	G	53.2	Low	64.2	Low	62 Å²	62	48 Å²	48	64%	0.639	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	4.7	-175	0	0	0	0	0	115.8	L1155 H1159	L1155-G1157 PolarHBondContact O-N 3.28Å; G1157-H1159 VanDerWaalsContact C-N 3.29Å; G1157-H1159 PolarHBondContact O-N 2.74Å
1158	K	53.7	Low	62.8	Low	147 Å²	147	48.1 Å²	48.1	64%	0.639	25%	0.251	S	S	*	.			trans	-75	-20.1	-178.1	-71.4	173.9	178.1	156.8	0	113	L1155 Q1156	L1155-K1158 PolarHBondContact O-N 3.08Å; Q1156-K1158 PolarHBondContact O-N 2.86Å
1159	H	57.8	Low	61.5	Low	34 Å²	34	48 Å²	48	16%	0.157	25%	0.251	C	S	.	.	S	Bend	trans	-114.6	131.7	179.4	-65.5	-78.2	0	0	0	110.4	L1155 G1157 I1161 N1171 H1172	L1155-H1159 HydrophobicContact CB-CB 4.47Å; L1155-H1159 HydrophobicContact CD1-CB 4.2Å; G1157-H1159 VanDerWaalsContact C-N 3.29Å; G1157-H1159 PolarHBondContact O-N 2.74Å; H1159-I1161 WeakPolarHBondContact O-CG1 3.26Å; H1159-I1161 PolarHBondContact O-N 3.46Å; H1159-N1171 PolarHBondContact ND1-O 2.98Å; H1159-H1172 AromaticContact CE1-CD2 3.79Å; H1159-H1172 AromaticContact CE1-NE2 3.92Å
1160	Y	53.7	Low	60.2	Low	84 Å²	84	45.2 Å²	45.2	33%	0.329	24%	0.239	S	C	.	.			trans	-72	119.9	178	-61.4	-58	0	0	0	109.7	T865 R1019 C1170 N1171	T865-Y1160 HydrophobicContact CG2-CD1 3.12Å; T865-Y1160 HydrophobicContact CG2-CE1 4.1Å; T865-Y1160 HydrophobicContact CG2-CG 3.5Å; T865-Y1160 VanDerWaalsContact CG2-CG 3.5Å; R1019-Y1160 PolarHBondContact NH1-OH 2.89Å; Y1160-C1170 VanDerWaalsContact O-CA 3.31Å; Y1160-C1170 WeakPolarHBondContact O-CA 3.35Å; Y1160-N1171 HydrophobicContact CD2-CB 4.24Å; Y1160-N1171 PolarHBondContact O-N 3.09Å
1161	I	57.4	Low	58.8	Low	14 Å²	14	44.1 Å²	44.1	7%	0.072	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.7	-176	-52	176.4	0	0	0	109	M862 V1151 C1152 L1155 H1159 I1168 I1169	M862-I1161 WeakPolarHBondContact CB-O 3.29Å; M862-I1161 HydrophobicContact CE-CB 3.86Å; M862-I1161 HydrophobicContact CE-CG2 3.42Å; M862-I1161 VanDerWaalsContact CE-CG2 3.42Å; M862-I1161 HydrophobicContact CG-CB 4.18Å; M862-I1161 WeakPolarHBondContact CG-O 3.47Å; M862-I1161 HydrophobicContact SD-CB 4.16Å; M862-I1161 HydrophobicContact SD-CG2 3.86Å; V1151-I1161 HydrophobicContact CG1-CD1 4.23Å; C1152-I1161 HydrophobicContact CB-CD1 4.47Å; C1152-I1161 VanDerWaalsContact SG-CD1 3.52Å; L1155-I1161 HydrophobicContact CD1-CD1 3.85Å; L1155-I1161 HydrophobicContact CD1-CG1 4.27Å; H1159-I1161 WeakPolarHBondContact O-CG1 3.26Å; H1159-I1161 PolarHBondContact O-N 3.46Å; I1161-I1168 HydrophobicContact CG2-CG2 3.45Å; I1161-I1168 VanDerWaalsContact CG2-CG2 3.45Å; I1161-I1169 CarbonylContact C-O 3.59Å; I1161-I1169 VanDerWaalsContact CA-O 3.25Å; I1161-I1169 WeakPolarHBondContact CA-O 3.41Å
1162	L	57.1	Low	57.7	Low	6 Å²	6	44.9 Å²	44.9	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.2	167.3	-173.3	87.3	0	0	0	109.1	I867 Y987 M998 L1003 I1164 I1169	I867-L1162 HydrophobicContact CB-CD1 4.35Å; I867-L1162 HydrophobicContact CB-CD2 4.16Å; I867-L1162 HydrophobicContact CD1-CB 4.09Å; I867-L1162 HydrophobicContact CD1-CD2 3.52Å; I867-L1162 HydrophobicContact CD1-CG 4.35Å; I867-L1162 HydrophobicContact CG1-CD2 4.44Å; I867-L1162 HydrophobicContact CG2-CD1 4.48Å; I867-L1162 HydrophobicContact CG2-CD2 4.1Å; Y987-L1162 WeakPolarHBondContact OH-CD1 3.24Å; M998-L1162 HydrophobicContact CE-CD1 4.45Å; L1003-L1162 HydrophobicContact CD1-CD2 4.08Å; L1162-I1164 HydrophobicContact CD2-CD1 3.53Å; L1162-I1164 HydrophobicContact CD2-CG1 3.42Å; L1162-I1164 VanDerWaalsContact CD2-CG1 3.42Å; L1162-I1164 HydrophobicContact CG-CG1 4.14Å; L1162-I1169 HydrophobicContact CB-CB 4.32Å; L1162-I1169 PolarHBondContact N-O 3.37Å; L1162-I1169 PolarHBondContact O-N 2.91Å
1163	L	54.5	Low	56.6	Low	4 Å²	4	48.9 Å²	48.9	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.5	169.4	-71.1	163	0	0	0	111.1	V859 M862 Y987 F1144 V1148 V1167 I1168	V859-L1163 HydrophobicContact CB-CD1 4.48Å; V859-L1163 HydrophobicContact CG2-CD1 3.21Å; M862-L1163 HydrophobicContact CE-CD1 3.9Å; M862-L1163 HydrophobicContact CE-CD2 4.45Å; M862-L1163 HydrophobicContact CE-CG 3.88Å; M862-L1163 HydrophobicContact SD-CB 4.22Å; M862-L1163 HydrophobicContact SD-CD1 3.67Å; M862-L1163 HydrophobicContact SD-CG 3.47Å; M862-L1163 WeakPolarHBondContact SD-CG 3.29Å; Y987-L1163 HydrophobicContact CE1-CB 4.06Å; Y987-L1163 WeakPolarHBondContact CE1-O 3.39Å; Y987-L1163 PolarHBondContact OH-N 3.33Å; Y987-L1163 VanDerWaalsContact OH-N 3.13Å; Y987-L1163 PolarHBondContact OH-O 3.07Å; F1144-L1163 HydrophobicContact CE1-CD2 3.54Å; F1144-L1163 HydrophobicContact CE2-CD2 4.4Å; F1144-L1163 HydrophobicContact CZ-CD2 3.3Å; V1148-L1163 HydrophobicContact CG1-CD1 4.38Å; V1148-L1163 HydrophobicContact CG2-CD1 4.17Å; V1148-L1163 HydrophobicContact CG2-CD2 3.39Å; V1148-L1163 HydrophobicContact CG2-CG 4.35Å; L1163-V1167 WeakPolarHBondContact CA-O 3.41Å; L1163-I1168 HydrophobicContact CD2-CG1 4.08Å
1164	I	54.1	Low	55.4	Low	2 Å²	2	48.8 Å²	48.8	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	108.4	170.2	-53.6	-166.8	0	0	0	109	L1003 L1162 S1166 V1167 I1169 W1211	L1003-I1164 HydrophobicContact CB-CD1 4.35Å; L1162-I1164 HydrophobicContact CD2-CD1 3.53Å; L1162-I1164 HydrophobicContact CD2-CG1 3.42Å; L1162-I1164 VanDerWaalsContact CD2-CG1 3.42Å; L1162-I1164 HydrophobicContact CG-CG1 4.14Å; I1164-S1166 VanDerWaalsContact C-N 3.33Å; I1164-S1166 PolarHBondContact O-N 2.77Å; I1164-V1167 PolarHBondContact N-O 2.91Å; I1164-V1167 VanDerWaalsContact O-CB 3.29Å; I1164-V1167 WeakPolarHBondContact O-CB 3.4Å; I1164-V1167 PolarHBondContact O-N 2.8Å; I1164-I1169 HydrophobicContact CD1-CD1 3.47Å; I1164-I1169 VanDerWaalsContact CD1-CD1 3.47Å; I1164-I1169 HydrophobicContact CG1-CD1 3.96Å; I1164-W1211 HydrophobicContact CB-CH2 4.34Å; I1164-W1211 HydrophobicContact CB-CZ2 4.34Å; I1164-W1211 HydrophobicContact CD1-CD2 4.12Å; I1164-W1211 HydrophobicContact CD1-CE3 3.78Å; I1164-W1211 HydrophobicContact CD1-CH2 3.32Å; I1164-W1211 HydrophobicContact CD1-CZ2 3.66Å; I1164-W1211 HydrophobicContact CD1-CZ3 3.33Å; I1164-W1211 HydrophobicContact CG1-CH2 4.38Å; I1164-W1211 HydrophobicContact CG2-CH2 3.39Å; I1164-W1211 HydrophobicContact CG2-CZ2 3.61Å; I1164-W1211 HydrophobicContact CG2-CZ3 4.34Å
1165	H	50.2	Low	54	Low	98 Å²	98	45.5 Å²	45.5	45%	0.454	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	-86.3	-172.4	-79.4	-73.4	0	0	0	113.5	Q1004 N1005	Q1004-H1165 VanDerWaalsContact C-CD2 3.44Å; Q1004-H1165 PolarHBondContact O-CD2 3.29Å; Q1004-H1165 PolarHBondContact O-NE2 2.97Å; N1005-H1165 PolarHBondContact OD1-NE2 2.8Å
1166	S	49.1	Very low	52.6	Low	47 Å²	47	53.1 Å²	53.1	33%	0.329	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	18.7	-178.4	-57.5	0	0	0	0	110.9	D1028 F1144 I1164	D1028-S1166 WeakPolarHBondContact OD1-CB 3.34Å; F1144-S1166 WeakPolarHBondContact CE2-O 2.98Å; F1144-S1166 VanDerWaalsContact CZ-C 3.48Å; I1164-S1166 VanDerWaalsContact C-N 3.33Å; I1164-S1166 PolarHBondContact O-N 2.77Å
1167	V	52.9	Low	51.7	Low	17 Å²	17	57.8 Å²	57.8	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.5	-178.3	-174.4	0	0	0	0	109.8	S1026 A1027 D1028 L1163 I1164 I1169	S1026-V1167 WeakPolarHBondContact OG-CG1 3.06Å; A1027-V1167 WeakPolarHBondContact O-CA 3.49Å; D1028-V1167 HydrophobicContact CB-CG2 4.09Å; L1163-V1167 WeakPolarHBondContact CA-O 3.41Å; I1164-V1167 PolarHBondContact N-O 2.91Å; I1164-V1167 VanDerWaalsContact O-CB 3.29Å; I1164-V1167 WeakPolarHBondContact O-CB 3.4Å; I1164-V1167 PolarHBondContact O-N 2.8Å; V1167-I1169 HydrophobicContact CG1-CD1 4.45Å; V1167-I1169 HydrophobicContact CG1-CG1 3.76Å
1168	I	53.7	Low	51.3	Low	2 Å²	2	63.6 Å²	63.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	117.8	166.6	-62.6	179.5	0	0	0	107.1	S1026 A1027 F1144 V1148 V1151 I1161 L1163 M1191	S1026-I1168 WeakPolarHBondContact CA-O 3.38Å; A1027-I1168 PolarHBondContact N-O 3.19Å; A1027-I1168 PolarHBondContact O-N 3.48Å; F1144-I1168 HydrophobicContact CE2-CG1 4.44Å; V1148-I1168 HydrophobicContact CG2-CD1 4.14Å; V1148-I1168 HydrophobicContact CG2-CG1 4.34Å; V1151-I1168 HydrophobicContact CB-CD1 4Å; V1151-I1168 HydrophobicContact CG1-CD1 4.36Å; V1151-I1168 HydrophobicContact CG1-CG2 4.04Å; V1151-I1168 HydrophobicContact CG2-CD1 3.75Å; I1161-I1168 HydrophobicContact CG2-CG2 3.45Å; I1161-I1168 VanDerWaalsContact CG2-CG2 3.45Å; L1163-I1168 HydrophobicContact CD2-CG1 4.08Å; I1168-M1191 HydrophobicContact CD1-CG 4.48Å; I1168-M1191 HydrophobicContact CD1-SD 4.02Å
1169	I	54.9	Low	50.7	Low	2 Å²	2	62.7 Å²	62.7	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	111.1	176.1	-59.6	-175	0	0	0	110.4	I867 L1024 L1025 I1161 L1162 I1164 V1167 W1211	I867-I1169 HydrophobicContact CD1-CG2 4.07Å; L1024-I1169 HydrophobicContact CB-CG2 4.02Å; L1024-I1169 HydrophobicContact CD1-CG2 4.38Å; L1024-I1169 HydrophobicContact CD2-CG2 3.65Å; L1024-I1169 HydrophobicContact CG-CG2 4.22Å; L1025-I1169 CarbonylContact O-C 3.49Å; L1025-I1169 WeakPolarHBondContact O-CA 3.24Å; I1161-I1169 CarbonylContact C-O 3.59Å; I1161-I1169 VanDerWaalsContact CA-O 3.25Å; I1161-I1169 WeakPolarHBondContact CA-O 3.41Å; L1162-I1169 HydrophobicContact CB-CB 4.32Å; L1162-I1169 PolarHBondContact N-O 3.37Å; L1162-I1169 PolarHBondContact O-N 2.91Å; I1164-I1169 HydrophobicContact CD1-CD1 3.47Å; I1164-I1169 VanDerWaalsContact CD1-CD1 3.47Å; I1164-I1169 HydrophobicContact CG1-CD1 3.96Å; V1167-I1169 HydrophobicContact CG1-CD1 4.45Å; V1167-I1169 HydrophobicContact CG1-CG1 3.76Å; I1169-W1211 HydrophobicContact CD1-CD2 4.34Å; I1169-W1211 HydrophobicContact CD1-CG 4.36Å
1170	C	54.1	Low	50	Low	5 Å²	5	61.8 Å²	61.8	3%	0.034	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	136.7	178.7	-61.2	0	0	0	0	111.8	I1023 L1024 L1025 L1155 Y1160	I1023-C1170 VanDerWaalsContact O-O 3.04Å; L1024-C1170 WeakPolarHBondContact CA-O 3.18Å; L1025-C1170 HydrophobicContact CB-CB 4.5Å; L1025-C1170 PolarHBondContact N-O 2.87Å; L1025-C1170 VanDerWaalsContact N-O 3.08Å; L1025-C1170 PolarHBondContact O-N 2.68Å; L1155-C1170 VanDerWaalsContact CD1-SG 3.56Å; Y1160-C1170 VanDerWaalsContact O-CA 3.31Å; Y1160-C1170 WeakPolarHBondContact O-CA 3.35Å
1171	N	52.3	Low	49.8	Very low	7 Å²	7	60.4 Å²	60.4	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	114.7	162.4	-82.3	-47.2	0	0	0	109.5	A1018 R1019 C1022 I1023 H1159 Y1160	A1018-N1171 WeakPolarHBondContact CA-OD1 3.3Å; R1019-N1171 HydrophobicContact CB-CB 4.43Å; R1019-N1171 PolarHBondContact N-OD1 3.07Å; C1022-N1171 HydrophobicContact CB-CB 4.06Å; I1023-N1171 WeakPolarHBondContact O-CA 3.44Å; H1159-N1171 PolarHBondContact ND1-O 2.98Å; Y1160-N1171 HydrophobicContact CD2-CB 4.24Å; Y1160-N1171 PolarHBondContact O-N 3.09Å
1172	H	54.7	Low	49.3	Very low	18 Å²	18	67.3 Å²	67.3	8%	0.083	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.8	177.6	-158.6	-77.2	0	0	0	111.9	C1022 I1023 H1159 D1174 S1183	C1022-H1172 CarbonylContact C-O 3.46Å; C1022-H1172 WeakPolarHBondContact CA-O 3.49Å; C1022-H1172 WeakPolarHBondContact CB-O 3.41Å; I1023-H1172 HydrophobicContact CG1-CB 4.08Å; I1023-H1172 PolarHBondContact N-O 3.33Å; I1023-H1172 PolarHBondContact O-N 3.21Å; H1159-H1172 AromaticContact CE1-CD2 3.79Å; H1159-H1172 AromaticContact CE1-NE2 3.92Å; H1172-D1174 PolarHBondContact O-N 3.18Å; H1172-S1183 PolarHBondContact CD2-OG 3.16Å; H1172-S1183 VanDerWaalsContact NE2-CB 3.32Å; H1172-S1183 WeakPolarHBondContact NE2-CB 3.33Å; H1172-S1183 PolarHBondContact NE2-OG 3.01Å; H1172-S1183 VanDerWaalsContact NE2-OG 3.09Å
1173	I	51.2	Low	48.9	Very low	101 Å²	101	67.4 Å²	67.4	52%	0.518	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	129.4	-179.2	-59.5	173.2	0	0	0	109.6	G1021 A1175	G1021-I1173 CarbonylContact O-C 3.43Å; G1021-I1173 WeakPolarHBondContact O-CA 3.34Å; I1173-A1175 HydrophobicContact CG2-CB 3.66Å; I1173-A1175 PolarHBondContact O-N 3.04Å
1174	D	47.8	Very low	49	Very low	98 Å²	98	68.1 Å²	68.1	52%	0.524	33%	0.331	S	S	.	.			trans	-76.2	19.3	-179.6	-156.4	13	0	0	0	112.3	G1021 H1172 F1176	G1021-D1174 WeakPolarHBondContact O-CB 3.28Å; G1021-D1174 PolarHBondContact O-N 3.43Å; H1172-D1174 PolarHBondContact O-N 3.18Å; D1174-F1176 VanDerWaalsContact C-N 3.31Å; D1174-F1176 PolarHBondContact O-N 3.18Å
1175	A	42.7	Very low	49.1	Very low	55 Å²	55	69.5 Å²	69.5	46%	0.455	34%	0.341	S	S	.	.	S	Bend	trans	-74.3	89.2	175.8	0	0	0	0	0	108.2	I1173	I1173-A1175 HydrophobicContact CG2-CB 3.66Å; I1173-A1175 PolarHBondContact O-N 3.04Å
1176	F	38.3	Very low	49.8	Very low	175 Å²	175	67.5 Å²	67.5	77%	0.768	33%	0.331	S	S	*	.			trans	63	121.7	168.2	-98.9	-103.4	0	0	0	115.1	D1174 K1178 Q1179	D1174-F1176 VanDerWaalsContact C-N 3.31Å; D1174-F1176 PolarHBondContact O-N 3.18Å; F1176-K1178 PolarHBondContact O-N 2.78Å; F1176-Q1179 PolarHBondContact O-N 2.72Å; F1176-Q1179 VanDerWaalsContact O-N 3.09Å
1177	R	41.5	Very low	50.4	Low	236 Å²	236	65.5 Å²	65.5	89%	0.891	32%	0.318	S	S	*	.	H	α-helix	trans	-41.3	-9.1	170.7	-76.7	178.4	170.8	172.3	-3.9	117.2
1178	K	45.2	Very low	51.1	Low	184 Å²	184	66.1 Å²	66.1	80%	0.8	32%	0.319	S	S	*	.	H	α-helix	trans	-82.1	-27.1	176.4	-73.5	-172.7	175.5	-177.5	0	114.6	F1176	F1176-K1178 PolarHBondContact O-N 2.78Å
1179	Q	41.7	Very low	51.9	Low	127 Å²	127	73.1 Å²	73.1	59%	0.593	35%	0.347	S	S	*	.	H	α-helix	trans	-87	-21.2	177.2	-108.1	179.5	-1.8	0	0	113.6	F1176 A1181 Y1182 S1183	F1176-Q1179 PolarHBondContact O-N 2.72Å; F1176-Q1179 VanDerWaalsContact O-N 3.09Å; Q1179-A1181 VanDerWaalsContact C-N 3.32Å; Q1179-A1181 PolarHBondContact O-N 3.5Å; Q1179-Y1182 PolarHBondContact O-N 3.24Å; Q1179-Y1182 VanDerWaalsContact O-N 3.15Å; Q1179-S1183 PolarHBondContact O-N 3.23Å
1180	C	44.1	Very low	52.7	Low	15 Å²	15	73.2 Å²	73.2	10%	0.101	35%	0.347	C	S	.	.	H	α-helix	trans	-58.4	-43.2	177.9	-68.6	0	0	0	0	111.7	Y1182 S1183 E1184	C1180-Y1182 PolarHBondContact O-N 3.24Å; C1180-S1183 PolarHBondContact O-N 2.97Å; C1180-S1183 PolarHBondContact O-OG 3Å; C1180-S1183 VanDerWaalsContact O-OG 3.11Å; C1180-E1184 WeakPolarHBondContact CB-OE1 3.39Å; C1180-E1184 WeakPolarHBondContact O-CB 3.47Å; C1180-E1184 WeakPolarHBondContact O-CG 3.39Å; C1180-E1184 PolarHBondContact O-N 2.93Å
1181	A	48.4	Very low	53.8	Low	55 Å²	55	73 Å²	73	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-57.7	-36.3	178.2	0	0	0	0	0	112.9	Q1179 S1185	Q1179-A1181 VanDerWaalsContact C-N 3.32Å; Q1179-A1181 PolarHBondContact O-N 3.5Å; A1181-S1185 VanDerWaalsContact O-CB 3.27Å; A1181-S1185 WeakPolarHBondContact O-CB 2.96Å; A1181-S1185 PolarHBondContact O-N 2.79Å; A1181-S1185 PolarHBondContact O-OG 2.88Å
1182	Y	48.1	Very low	55.1	Low	159 Å²	159	75.4 Å²	75.4	62%	0.624	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-52.1	-179.3	-166.1	-92.3	0	0	0	111.1	Q1179 C1180 S1185 E1186	Q1179-Y1182 PolarHBondContact O-N 3.24Å; Q1179-Y1182 VanDerWaalsContact O-N 3.15Å; C1180-Y1182 PolarHBondContact O-N 3.24Å; Y1182-S1185 PolarHBondContact O-N 2.97Å; Y1182-S1185 PolarHBondContact O-OG 3.27Å; Y1182-E1186 HydrophobicContact CD1-CG 4.42Å; Y1182-E1186 HydrophobicContact CE1-CG 4.22Å; Y1182-E1186 WeakPolarHBondContact CE1-OE1 3.46Å; Y1182-E1186 WeakPolarHBondContact O-CG 3.34Å; Y1182-E1186 PolarHBondContact O-N 2.94Å
1183	S	48.7	Very low	56.3	Low	9 Å²	9	77.5 Å²	77.5	6%	0.063	38%	0.383	C	S	.	.	H	α-helix	trans	-69.6	-33.9	178.4	58	0	0	0	0	114.2	H1172 Q1179 C1180 S1185 E1186 S1187	H1172-S1183 PolarHBondContact CD2-OG 3.16Å; H1172-S1183 VanDerWaalsContact NE2-CB 3.32Å; H1172-S1183 WeakPolarHBondContact NE2-CB 3.33Å; H1172-S1183 PolarHBondContact NE2-OG 3.01Å; H1172-S1183 VanDerWaalsContact NE2-OG 3.09Å; Q1179-S1183 PolarHBondContact O-N 3.23Å; C1180-S1183 PolarHBondContact O-N 2.97Å; C1180-S1183 PolarHBondContact O-OG 3Å; C1180-S1183 VanDerWaalsContact O-OG 3.11Å; S1183-S1185 VanDerWaalsContact C-N 3.34Å; S1183-E1186 PolarHBondContact O-N 3.34Å; S1183-S1187 PolarHBondContact O-N 2.8Å; S1183-S1187 PolarHBondContact O-OG 3.18Å
1184	E	55.2	Low	57.6	Low	18 Å²	18	73.4 Å²	73.4	8%	0.084	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-47.5	174.5	-76.6	166.5	-171.3	0	0	109.2	L1025 C1180 E1186 H1188 I1205 I1217 L1219	L1025-E1184 HydrophobicContact CD1-CB 4.42Å; L1025-E1184 HydrophobicContact CD1-CG 3.65Å; C1180-E1184 WeakPolarHBondContact CB-OE1 3.39Å; C1180-E1184 WeakPolarHBondContact O-CB 3.47Å; C1180-E1184 WeakPolarHBondContact O-CG 3.39Å; C1180-E1184 PolarHBondContact O-N 2.93Å; E1184-E1186 PolarHBondContact O-N 3.32Å; E1184-H1188 VanDerWaalsContact O-CB 3.25Å; E1184-H1188 WeakPolarHBondContact O-CB 3.42Å; E1184-H1188 PolarHBondContact O-N 3.25Å; E1184-I1205 WeakPolarHBondContact O-CD1 3.41Å; E1184-I1217 WeakPolarHBondContact OE1-CD1 3.45Å; E1184-L1219 HydrophobicContact CB-CD1 4.19Å; E1184-L1219 HydrophobicContact CB-CD2 4.08Å
1185	S	57.4	Low	59.1	Low	31 Å²	31	70 Å²	70	22%	0.217	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-40.4	174.6	77.5	0	0	0	0	112.4	A1181 Y1182 S1183 S1187 H1188 Y1189	A1181-S1185 VanDerWaalsContact O-CB 3.27Å; A1181-S1185 WeakPolarHBondContact O-CB 2.96Å; A1181-S1185 PolarHBondContact O-N 2.79Å; A1181-S1185 PolarHBondContact O-OG 2.88Å; Y1182-S1185 PolarHBondContact O-N 2.97Å; Y1182-S1185 PolarHBondContact O-OG 3.27Å; S1183-S1185 VanDerWaalsContact C-N 3.34Å; S1185-S1187 PolarHBondContact O-N 2.89Å; S1185-H1188 WeakPolarHBondContact O-CB 3.37Å; S1185-H1188 PolarHBondContact O-N 2.83Å; S1185-Y1189 WeakPolarHBondContact O-CB 3.4Å; S1185-Y1189 WeakPolarHBondContact O-CD2 3.47Å; S1185-Y1189 PolarHBondContact O-N 3.1Å
1186	E	64.9	Low	61	Low	56 Å²	56	73.3 Å²	73.3	26%	0.262	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-42.2	-179.6	-76.7	-167.1	160.1	0	0	113.5	R1154 Y1182 S1183 E1184 A1190	R1154-E1186 PolarHBondContact NH1-O 3.01Å; Y1182-E1186 HydrophobicContact CD1-CG 4.42Å; Y1182-E1186 HydrophobicContact CE1-CG 4.22Å; Y1182-E1186 WeakPolarHBondContact CE1-OE1 3.46Å; Y1182-E1186 WeakPolarHBondContact O-CG 3.34Å; Y1182-E1186 PolarHBondContact O-N 2.94Å; S1183-E1186 PolarHBondContact O-N 3.34Å; E1184-E1186 PolarHBondContact O-N 3.32Å; E1186-A1190 WeakPolarHBondContact O-CB 3.28Å; E1186-A1190 PolarHBondContact O-N 3.41Å
1187	S	61.3	Low	63.4	Low	6 Å²	6	66.1 Å²	66.1	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-67.3	-41.2	176.1	-58.3	0	0	0	0	110.4	S1183 S1185 A1190 M1191	S1183-S1187 PolarHBondContact O-N 2.8Å; S1183-S1187 PolarHBondContact O-OG 3.18Å; S1185-S1187 PolarHBondContact O-N 2.89Å; S1187-A1190 PolarHBondContact O-N 2.86Å; S1187-M1191 WeakPolarHBondContact O-CG 3.32Å; S1187-M1191 PolarHBondContact O-N 2.82Å; S1187-M1191 VanDerWaalsContact O-N 3.09Å
1188	H	68.2	Low	65.4	Low	29 Å²	29	61.5 Å²	61.5	13%	0.134	33%	0.326	C	S	.	.	H	α-helix	trans	-57.8	-57.9	175.2	-167.8	-92.9	0	0	0	111.7	E1184 S1185 A1190 M1191 E1192 I1205 L1219	E1184-H1188 VanDerWaalsContact O-CB 3.25Å; E1184-H1188 WeakPolarHBondContact O-CB 3.42Å; E1184-H1188 PolarHBondContact O-N 3.25Å; S1185-H1188 WeakPolarHBondContact O-CB 3.37Å; S1185-H1188 PolarHBondContact O-N 2.83Å; H1188-A1190 VanDerWaalsContact C-N 3.26Å; H1188-A1190 PolarHBondContact O-N 3.46Å; H1188-M1191 PolarHBondContact O-N 2.84Å; H1188-E1192 IonicContact CE1-OE1 2.81Å; H1188-E1192 PolarHBondContact CE1-OE1 3.43Å; H1188-E1192 IonicContact CE1-OE2 2.92Å; H1188-E1192 PolarHBondContact CE1-OE2 2.81Å; H1188-E1192 IonicContact ND1-OE1 2.72Å; H1188-E1192 IonicContact ND1-OE2 3.75Å; H1188-E1192 PolarHBondContact ND1-OE2 3.1Å; H1188-E1192 IonicContact NE2-OE1 2.85Å; H1188-E1192 PolarHBondContact O-N 3.16Å; H1188-I1205 HydrophobicContact CB-CD1 3.67Å; H1188-L1219 HydrophobicContact CB-CD1 3.69Å
1189	Y	70.2	Confident	67.4	Low	150 Å²	150	52.8 Å²	52.8	59%	0.588	29%	0.288	S	S	*	.	H	α-helix	trans	-64.3	-28.6	179.8	-68.7	-56.1	0	0	0	112.8	S1185 G1193	S1185-Y1189 WeakPolarHBondContact O-CB 3.4Å; S1185-Y1189 WeakPolarHBondContact O-CD2 3.47Å; S1185-Y1189 PolarHBondContact O-N 3.1Å; Y1189-G1193 PolarHBondContact O-N 2.95Å; Y1189-G1193 VanDerWaalsContact O-N 3.13Å
1190	A	71.2	Confident	69.4	Low	3 Å²	3	49.5 Å²	49.5	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-67.3	-43.3	175.8	0	0	0	0	0	111.5	A1150 V1151 R1154 E1186 S1187 H1188 A1194	A1150-A1190 HydrophobicContact CB-CB 4.01Å; V1151-A1190 HydrophobicContact CG2-CB 3.89Å; R1154-A1190 VanDerWaalsContact NH1-CB 3.26Å; E1186-A1190 WeakPolarHBondContact O-CB 3.28Å; E1186-A1190 PolarHBondContact O-N 3.41Å; S1187-A1190 PolarHBondContact O-N 2.86Å; H1188-A1190 VanDerWaalsContact C-N 3.26Å; H1188-A1190 PolarHBondContact O-N 3.46Å; A1190-A1194 PolarHBondContact O-N 3.27Å
1191	M	77.2	Confident	71.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-74.9	-43.5	-178.5	-69.6	-168.1	65.4	0	0	111.8	A1027 F1029 A1147 V1151 I1168 S1187 H1188 G1193 A1194 V1203	A1027-M1191 HydrophobicContact CB-CE 4.43Å; A1027-M1191 HydrophobicContact CB-SD 3.31Å; A1027-M1191 WeakPolarHBondContact CB-SD 3.37Å; F1029-M1191 HydrophobicContact CD2-CE 3.78Å; F1029-M1191 HydrophobicContact CE1-CB 4.19Å; F1029-M1191 HydrophobicContact CE1-CE 4.38Å; F1029-M1191 VanDerWaalsContact CE1-O 3.28Å; F1029-M1191 WeakPolarHBondContact CE1-O 3.48Å; F1029-M1191 HydrophobicContact CE2-CE 3.56Å; F1029-M1191 HydrophobicContact CG-CE 4.3Å; F1029-M1191 HydrophobicContact CZ-CB 4.04Å; F1029-M1191 HydrophobicContact CZ-CE 3.9Å; F1029-M1191 VanDerWaalsContact CZ-O 3.3Å; F1029-M1191 WeakPolarHBondContact CZ-O 3.08Å; A1147-M1191 HydrophobicContact CB-CB 4.48Å; A1147-M1191 HydrophobicContact CB-CE 4.43Å; A1147-M1191 HydrophobicContact CB-CG 4.12Å; V1151-M1191 HydrophobicContact CG2-CG 3.96Å; I1168-M1191 HydrophobicContact CD1-CG 4.48Å; I1168-M1191 HydrophobicContact CD1-SD 4.02Å; S1187-M1191 WeakPolarHBondContact O-CG 3.32Å; S1187-M1191 PolarHBondContact O-N 2.82Å; S1187-M1191 VanDerWaalsContact O-N 3.09Å; H1188-M1191 PolarHBondContact O-N 2.84Å; M1191-G1193 VanDerWaalsContact C-N 3.28Å; M1191-G1193 PolarHBondContact O-N 3.42Å; M1191-A1194 WeakPolarHBondContact O-CB 3.49Å; M1191-A1194 PolarHBondContact O-N 2.68Å; M1191-A1194 VanDerWaalsContact O-N 3.13Å; M1191-V1203 HydrophobicContact CB-CG1 4.37Å; M1191-V1203 HydrophobicContact CB-CG2 3.57Å; M1191-V1203 HydrophobicContact CE-CG1 4.38Å; M1191-V1203 HydrophobicContact SD-CG1 4.03Å
1192	E	80.3	Confident	73.1	Confident	58 Å²	58	49.3 Å²	49.3	27%	0.271	28%	0.275	S	S	.	.	H	α-helix	trans	-64.7	-33.9	176.7	-68.5	-171	149.1	0	0	112.3	H1188 A1194 L1201 V1203	H1188-E1192 IonicContact CE1-OE1 2.81Å; H1188-E1192 PolarHBondContact CE1-OE1 3.43Å; H1188-E1192 IonicContact CE1-OE2 2.92Å; H1188-E1192 PolarHBondContact CE1-OE2 2.81Å; H1188-E1192 IonicContact ND1-OE1 2.72Å; H1188-E1192 IonicContact ND1-OE2 3.75Å; H1188-E1192 PolarHBondContact ND1-OE2 3.1Å; H1188-E1192 IonicContact NE2-OE1 2.85Å; H1188-E1192 PolarHBondContact O-N 3.16Å; E1192-A1194 VanDerWaalsContact C-N 3.27Å; E1192-A1194 PolarHBondContact O-N 3.13Å; E1192-L1201 WeakPolarHBondContact CG-O 3.43Å; E1192-V1203 HydrophobicContact CG-CB 4.27Å; E1192-V1203 HydrophobicContact CG-CG2 3.69Å
1193	G	78.7	Confident	74.9	Confident	62 Å²	62	42.1 Å²	42.1	64%	0.639	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	3.9	174.7	0	0	0	0	0	115.2	Y1189 M1191 A1195	Y1189-G1193 PolarHBondContact O-N 2.95Å; Y1189-G1193 VanDerWaalsContact O-N 3.13Å; M1191-G1193 VanDerWaalsContact C-N 3.28Å; M1191-G1193 PolarHBondContact O-N 3.42Å; G1193-A1195 VanDerWaalsContact C-N 3.31Å; G1193-A1195 PolarHBondContact O-N 3.26Å
1194	A	77.8	Confident	76.6	Confident	16 Å²	16	45.6 Å²	45.6	13%	0.132	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.9	-174.1	0	0	0	0	0	113.6	F1029 I1143 L1146 A1147 A1190 M1191 E1192	F1029-A1194 HydrophobicContact CZ-CB 4.42Å; I1143-A1194 HydrophobicContact CG2-CB 4.38Å; L1146-A1194 HydrophobicContact CB-CB 4.39Å; A1147-A1194 HydrophobicContact CB-CB 3.83Å; A1190-A1194 PolarHBondContact O-N 3.27Å; M1191-A1194 WeakPolarHBondContact O-CB 3.49Å; M1191-A1194 PolarHBondContact O-N 2.68Å; M1191-A1194 VanDerWaalsContact O-N 3.13Å; E1192-A1194 VanDerWaalsContact C-N 3.27Å; E1192-A1194 PolarHBondContact O-N 3.13Å
1195	A	81.1	Confident	77.8	Confident	26 Å²	26	44.9 Å²	44.9	22%	0.215	26%	0.258	C	S	.	.			trans	-153.1	146.1	175.5	0	0	0	0	0	111.8	I1143 G1193 L1201	I1143-A1195 HydrophobicContact CD1-CB 4.04Å; I1143-A1195 HydrophobicContact CG1-CB 3.8Å; I1143-A1195 HydrophobicContact CG2-CB 4.2Å; G1193-A1195 VanDerWaalsContact C-N 3.31Å; G1193-A1195 PolarHBondContact O-N 3.26Å; A1195-L1201 HydrophobicContact CB-CD1 4.26Å
1196	S	82.5	Confident	79.1	Confident	124 Å²	124	46.6 Å²	46.6	87%	0.867	26%	0.262	S	S	*	.			trans	-92	105.4	174.8	-172.1	0	0	0	0	110
1197	L	87.4	Confident	80	Confident	24 Å²	24	45.2 Å²	45.2	13%	0.126	26%	0.257	C	S	.	.			trans	-112.2	162.3	176	-58.9	-176.7	0	0	0	110.3	I1036 H1039 I1110 I1143 V1199 L1201	I1036-L1197 HydrophobicContact CG1-CD1 4.34Å; H1039-L1197 HydrophobicContact CB-CB 4.3Å; H1039-L1197 HydrophobicContact CB-CD2 4.38Å; I1110-L1197 HydrophobicContact CD1-CD2 3.93Å; I1143-L1197 HydrophobicContact CD1-CD1 4.11Å; I1143-L1197 HydrophobicContact CD1-CD2 4.42Å; L1197-V1199 WeakPolarHBondContact CB-O 3.4Å; L1197-V1199 PolarHBondContact O-N 3.47Å; L1197-L1201 HydrophobicContact CD1-CD2 3.75Å; L1197-L1201 HydrophobicContact CD1-CG 4.31Å
1198	K	84.6	Confident	81	Confident	140 Å²	140	45.6 Å²	45.6	61%	0.609	26%	0.262	S	S	*	.	S	Bend	trans	-67.1	-15.4	173.8	-69.1	176	-177.2	173.9	0	113	H1039 M1047	H1039-K1198 PolarHBondContact ND1-N 3.48Å; H1039-K1198 VanDerWaalsContact ND1-N 3.11Å; M1047-K1198 HydrophobicContact SD-CB 4.14Å
1199	V	85.6	Confident	81.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	-120.3	133.8	177.3	179.4	0	0	0	0	106.9	R1035 A1038 M1047 L1050 N1051 L1197 L1201	R1035-V1199 HydrophobicContact CB-CG1 4.43Å; R1035-V1199 HydrophobicContact CG-CG1 4.17Å; A1038-V1199 HydrophobicContact CB-CG2 3.82Å; M1047-V1199 HydrophobicContact CB-CG2 3.93Å; M1047-V1199 HydrophobicContact CG-CG2 3.5Å; M1047-V1199 HydrophobicContact SD-CG2 4.16Å; L1050-V1199 HydrophobicContact CB-CG1 3.66Å; L1050-V1199 HydrophobicContact CD1-CG1 4.04Å; L1050-V1199 HydrophobicContact CG-CG1 4.45Å; N1051-V1199 WeakPolarHBondContact OD1-CG1 3.45Å; L1197-V1199 WeakPolarHBondContact CB-O 3.4Å; L1197-V1199 PolarHBondContact O-N 3.47Å; V1199-L1201 PolarHBondContact O-N 3.46Å
1200	A	83.6	Confident	82.3	Confident	58 Å²	58	45 Å²	45	48%	0.479	27%	0.267	S	S	.	.			trans	-59.3	137	-178	0	0	0	0	0	110.7	R1035 N1051	R1035-A1200 WeakPolarHBondContact CD-O 3.47Å; R1035-A1200 PolarHBondContact NH1-O 3.17Å; N1051-A1200 PolarHBondContact OD1-N 3.24Å
1201	L	87.6	Confident	83	Confident	11 Å²	11	45.3 Å²	45.3	6%	0.058	27%	0.268	C	S	.	.			trans	-75.4	132.3	166.8	-69.3	176.9	0	0	0	108	F1029 L1032 I1143 E1192 A1195 L1197 V1199	F1029-L1201 HydrophobicContact CD1-CB 4.45Å; F1029-L1201 HydrophobicContact CD1-CD2 4.46Å; F1029-L1201 HydrophobicContact CE1-CB 4.18Å; F1029-L1201 HydrophobicContact CE1-CD1 4.05Å; F1029-L1201 HydrophobicContact CE1-CD2 4.46Å; F1029-L1201 HydrophobicContact CE1-CG 4.48Å; L1032-L1201 HydrophobicContact CD1-CD2 3.58Å; I1143-L1201 HydrophobicContact CG2-CD1 4.13Å; E1192-L1201 WeakPolarHBondContact CG-O 3.43Å; A1195-L1201 HydrophobicContact CB-CD1 4.26Å; L1197-L1201 HydrophobicContact CD1-CD2 3.75Å; L1197-L1201 HydrophobicContact CD1-CG 4.31Å; V1199-L1201 PolarHBondContact O-N 3.46Å
1202	V	84.4	Confident	83.3	Confident	55 Å²	55	47.2 Å²	47.2	33%	0.333	29%	0.288	S	S	.	.			trans	-120.9	131	179.2	175.8	0	0	0	0	108.4	S1030	S1030-V1202 WeakPolarHBondContact CB-O 3.1Å; S1030-V1202 PolarHBondContact N-O 3.47Å
1203	V	84.1	Confident	83.5	Confident	9 Å²	9	49 Å²	49	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135	-177.1	178.5	0	0	0	0	109.8	A1027 D1028 F1029 M1191 E1192 I1205	A1027-V1203 HydrophobicContact CB-CG1 4.05Å; D1028-V1203 WeakPolarHBondContact O-CA 3.41Å; F1029-V1203 HydrophobicContact CD1-CG2 3.75Å; F1029-V1203 HydrophobicContact CE1-CG2 3.78Å; M1191-V1203 HydrophobicContact CB-CG1 4.37Å; M1191-V1203 HydrophobicContact CB-CG2 3.57Å; M1191-V1203 HydrophobicContact CE-CG1 4.38Å; M1191-V1203 HydrophobicContact SD-CG1 4.03Å; E1192-V1203 HydrophobicContact CG-CB 4.27Å; E1192-V1203 HydrophobicContact CG-CG2 3.69Å; V1203-I1205 HydrophobicContact CG1-CG1 4.24Å
1204	K	84.3	Confident	83.8	Confident	81 Å²	81	47.4 Å²	47.4	35%	0.352	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.2	173.2	-73.5	170.1	169	-82.3	0	108.8	D1028 S1030 E1216	D1028-K1204 PolarHBondContact N-O 3.39Å; D1028-K1204 PolarHBondContact O-N 3.27Å; S1030-K1204 WeakPolarHBondContact OG-CE 3.45Å; K1204-E1216 WeakPolarHBondContact CG-OE1 3.28Å; K1204-E1216 IonicContact NZ-OE1 3.43Å; K1204-E1216 PolarHBondContact NZ-OE1 3.25Å; K1204-E1216 IonicContact NZ-OE2 3.42Å
1205	I	82.1	Confident	84	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132	176.1	-68	-174.6	0	0	0	109.9	L1025 S1026 A1027 E1184 H1188 V1203 V1207 E1216 I1217 L1219	L1025-I1205 HydrophobicContact CD1-CG2 4.45Å; L1025-I1205 HydrophobicContact CG-CG2 4.2Å; S1026-I1205 CarbonylContact O-C 3.6Å; S1026-I1205 WeakPolarHBondContact O-CA 3.25Å; A1027-I1205 HydrophobicContact CB-CG1 4.19Å; E1184-I1205 WeakPolarHBondContact O-CD1 3.41Å; H1188-I1205 HydrophobicContact CB-CD1 3.67Å; V1203-I1205 HydrophobicContact CG1-CG1 4.24Å; I1205-V1207 HydrophobicContact CG2-CG1 4.44Å; I1205-E1216 CarbonylContact O-C 3.08Å; I1205-E1216 WeakPolarHBondContact O-CA 3.27Å; I1205-I1217 PolarHBondContact O-N 3.12Å; I1205-L1219 HydrophobicContact CD1-CD1 3.66Å
1206	K	84.5	Confident	84.1	Confident	67 Å²	67	54.3 Å²	54.3	29%	0.291	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.7	172.5	-46.9	-161.4	175.9	-141.5	0	110.4	L1025 S1026 M1214 V1215 E1216	L1025-K1206 CarbonylContact C-O 3.52Å; S1026-K1206 PolarHBondContact N-O 2.85Å; S1026-K1206 PolarHBondContact O-N 3.19Å; K1206-M1214 HydrophobicContact CB-CB 3.83Å; K1206-M1214 HydrophobicContact CB-CE 4.22Å; K1206-V1215 CarbonylContact C-O 3.59Å; K1206-V1215 WeakPolarHBondContact CA-O 3.27Å; K1206-E1216 HydrophobicContact CD-CB 4.31Å; K1206-E1216 VanDerWaalsContact CE-OE2 3.23Å; K1206-E1216 WeakPolarHBondContact CE-OE2 3.38Å; K1206-E1216 HydrophobicContact CG-CB 4.13Å; K1206-E1216 HydrophobicContact CG-CG 4.41Å; K1206-E1216 IonicContact NZ-OE2 3.49Å; K1206-E1216 PolarHBondContact NZ-OE2 3.34Å
1207	V	82.4	Confident	83.8	Confident	28 Å²	28	50.9 Å²	50.9	17%	0.17	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.2	175.8	-56.7	0	0	0	0	111.9	I1023 L1024 L1025 I1205 M1214 V1215 I1217	I1023-V1207 HydrophobicContact CD1-CB 4.33Å; I1023-V1207 HydrophobicContact CD1-CG1 4.49Å; L1024-V1207 VanDerWaalsContact O-CA 3.26Å; L1024-V1207 WeakPolarHBondContact O-CA 3.5Å; L1025-V1207 HydrophobicContact CB-CG1 4.47Å; L1025-V1207 HydrophobicContact CG-CG1 4.38Å; I1205-V1207 HydrophobicContact CG2-CG1 4.44Å; V1207-M1214 CarbonylContact O-C 3.59Å; V1207-M1214 WeakPolarHBondContact O-CA 3.49Å; V1207-V1215 PolarHBondContact N-O 3.44Å; V1207-V1215 PolarHBondContact O-N 3.1Å; V1207-I1217 HydrophobicContact CB-CD1 4.13Å; V1207-I1217 HydrophobicContact CG1-CD1 3.53Å; V1207-I1217 HydrophobicContact CG1-CG1 4.39Å; V1207-I1217 HydrophobicContact CG2-CD1 3.54Å; V1207-I1217 HydrophobicContact CG2-CG1 4Å
1208	G	82.4	Confident	82.7	Confident	13 Å²	13	55.2 Å²	55.2	13%	0.134	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	164.8	173	0	0	0	0	0	112.9	L1024	L1024-G1208 WeakPolarHBondContact CA-O 3.03Å; L1024-G1208 VanDerWaalsContact CB-O 3.3Å; L1024-G1208 WeakPolarHBondContact CB-O 3.45Å; L1024-G1208 PolarHBondContact N-O 3.07Å; L1024-G1208 PolarHBondContact O-N 3.34Å
1209	V	81.9	Confident	81.5	Confident	93 Å²	93	54.5 Å²	54.5	56%	0.564	31%	0.313	S	S	*	.	S	Bend	trans	-74.2	-34.2	176.9	-178.5	0	0	0	0	111.2	A1018	A1018-V1209 PolarHBondContact N-O 3.17Å
1210	R	85.4	Confident	81.3	Confident	73 Å²	73	57.3 Å²	57.3	28%	0.275	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-118.4	147	177.1	-58.8	-167.7	172.8	-104.5	0.6	109.7	D870 N1014 V1017 G1212 D1213 M1214	D870-R1210 IonicContact OD2-CZ 2.71Å; D870-R1210 IonicContact OD2-NH1 3.94Å; D870-R1210 PolarHBondContact OD2-NH1 3.43Å; D870-R1210 IonicContact OD2-NH2 3.29Å; D870-R1210 PolarHBondContact OD2-NH2 3.42Å; N1014-R1210 PolarHBondContact O-NH1 3.03Å; V1017-R1210 HydrophobicContact CG1-CG 4.13Å; R1210-G1212 VanDerWaalsContact C-N 3.34Å; R1210-G1212 PolarHBondContact O-N 2.93Å; R1210-D1213 PolarHBondContact O-N 3.33Å; R1210-M1214 WeakPolarHBondContact O-CG 3.32Å
1211	W	85.6	Confident	81.2	Confident	11 Å²	11	57.2 Å²	57.2	4%	0.042	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-66.1	-33.1	-174.3	179.4	29.1	0	0	0	113.5	L1003 L1006 R1013 V1016 L1024 I1164 I1169 D1213 M1214	L1003-W1211 WeakPolarHBondContact O-CH2 3.45Å; L1006-W1211 HydrophobicContact CB-CH2 4.44Å; L1006-W1211 HydrophobicContact CB-CZ3 4.31Å; L1006-W1211 HydrophobicContact CD1-CE3 4.18Å; L1006-W1211 HydrophobicContact CD1-CH2 4.47Å; L1006-W1211 HydrophobicContact CD1-CZ3 3.59Å; L1006-W1211 HydrophobicContact CG-CZ3 4.21Å; R1013-W1211 HydrophobicContact CB-CB 4.41Å; R1013-W1211 HydrophobicContact CB-CD2 4.05Å; R1013-W1211 HydrophobicContact CB-CE3 4.06Å; R1013-W1211 HydrophobicContact CB-CG 4.25Å; R1013-W1211 HydrophobicContact CG-CD2 4.1Å; R1013-W1211 HydrophobicContact CG-CE3 4Å; R1013-W1211 HydrophobicContact CG-CH2 4.32Å; R1013-W1211 HydrophobicContact CG-CZ2 4.45Å; R1013-W1211 HydrophobicContact CG-CZ3 4.16Å; R1013-W1211 WeakPolarHBondContact O-CB 3.31Å; V1016-W1211 HydrophobicContact CB-CB 4Å; V1016-W1211 HydrophobicContact CB-CE3 3.98Å; V1016-W1211 HydrophobicContact CG1-CB 4.25Å; V1016-W1211 HydrophobicContact CG1-CE3 4.33Å; V1016-W1211 HydrophobicContact CG2-CE3 3.85Å; V1016-W1211 HydrophobicContact CG2-CZ3 4.4Å; V1016-W1211 PolarHBondContact O-N 3.31Å; V1016-W1211 VanDerWaalsContact O-N 3.07Å; L1024-W1211 HydrophobicContact CD1-CB 3.97Å; I1164-W1211 HydrophobicContact CB-CH2 4.34Å; I1164-W1211 HydrophobicContact CB-CZ2 4.34Å; I1164-W1211 HydrophobicContact CD1-CD2 4.12Å; I1164-W1211 HydrophobicContact CD1-CE3 3.78Å; I1164-W1211 HydrophobicContact CD1-CH2 3.32Å; I1164-W1211 HydrophobicContact CD1-CZ2 3.66Å; I1164-W1211 HydrophobicContact CD1-CZ3 3.33Å; I1164-W1211 HydrophobicContact CG1-CH2 4.38Å; I1164-W1211 HydrophobicContact CG2-CH2 3.39Å; I1164-W1211 HydrophobicContact CG2-CZ2 3.61Å; I1164-W1211 HydrophobicContact CG2-CZ3 4.34Å; I1169-W1211 HydrophobicContact CD1-CD2 4.34Å; I1169-W1211 HydrophobicContact CD1-CG 4.36Å; W1211-D1213 VanDerWaalsContact C-N 3.35Å; W1211-M1214 HydrophobicContact CG-CE 4.5Å
1212	G	83.7	Confident	80.8	Confident	40 Å²	40	59.8 Å²	59.8	41%	0.412	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-79.7	-13.3	178.1	0	0	0	0	0	115	N1014 R1210	N1014-G1212 WeakPolarHBondContact OD1-CA 3.24Å; N1014-G1212 PolarHBondContact OD1-N 3.25Å; R1210-G1212 VanDerWaalsContact C-N 3.34Å; R1210-G1212 PolarHBondContact O-N 2.93Å
1213	D	83.7	Confident	80.6	Confident	94 Å²	94	60.1 Å²	60.1	50%	0.503	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-107	15.6	-176.8	-53	-37.2	0	0	0	112.4	N1014 R1210 W1211	N1014-D1213 PolarHBondContact ND2-OD1 2.69Å; R1210-D1213 PolarHBondContact O-N 3.33Å; W1211-D1213 VanDerWaalsContact C-N 3.35Å
1214	M	85	Confident	80.4	Confident	30 Å²	30	63.3 Å²	63.3	15%	0.148	35%	0.353	C	S	.	.			trans	-72.1	136.5	-178.1	-59.5	-175.2	-49.3	0	0	112.2	L1024 K1206 V1207 R1210 W1211	L1024-M1214 HydrophobicContact CB-SD 4.24Å; K1206-M1214 HydrophobicContact CB-CB 3.83Å; K1206-M1214 HydrophobicContact CB-CE 4.22Å; V1207-M1214 CarbonylContact O-C 3.59Å; V1207-M1214 WeakPolarHBondContact O-CA 3.49Å; R1210-M1214 WeakPolarHBondContact O-CG 3.32Å; W1211-M1214 HydrophobicContact CG-CE 4.5Å
1215	V	82.4	Confident	80.2	Confident	103 Å²	103	62.1 Å²	62.1	62%	0.624	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.3	179.8	-173.9	0	0	0	0	109.6	K1206 V1207	K1206-V1215 CarbonylContact C-O 3.59Å; K1206-V1215 WeakPolarHBondContact CA-O 3.27Å; V1207-V1215 PolarHBondContact N-O 3.44Å; V1207-V1215 PolarHBondContact O-N 3.1Å
1216	E	82.4	Confident	80	Confident	84 Å²	84	66.3 Å²	66.3	39%	0.393	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130.7	176.1	-167.6	164	160.1	0	0	110.2	K1204 I1205 K1206	K1204-E1216 WeakPolarHBondContact CG-OE1 3.28Å; K1204-E1216 IonicContact NZ-OE1 3.43Å; K1204-E1216 PolarHBondContact NZ-OE1 3.25Å; K1204-E1216 IonicContact NZ-OE2 3.42Å; I1205-E1216 CarbonylContact O-C 3.08Å; I1205-E1216 WeakPolarHBondContact O-CA 3.27Å; K1206-E1216 HydrophobicContact CD-CB 4.31Å; K1206-E1216 VanDerWaalsContact CE-OE2 3.23Å; K1206-E1216 WeakPolarHBondContact CE-OE2 3.38Å; K1206-E1216 HydrophobicContact CG-CB 4.13Å; K1206-E1216 HydrophobicContact CG-CG 4.41Å; K1206-E1216 IonicContact NZ-OE2 3.49Å; K1206-E1216 PolarHBondContact NZ-OE2 3.34Å
1217	I	76.1	Confident	79.7	Confident	52 Å²	52	66.2 Å²	66.2	27%	0.267	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.9	175.7	-49	178.8	0	0	0	107.7	E1184 I1205 V1207	E1184-I1217 WeakPolarHBondContact OE1-CD1 3.45Å; I1205-I1217 PolarHBondContact O-N 3.12Å; V1207-I1217 HydrophobicContact CB-CD1 4.13Å; V1207-I1217 HydrophobicContact CG1-CD1 3.53Å; V1207-I1217 HydrophobicContact CG1-CG1 4.39Å; V1207-I1217 HydrophobicContact CG2-CD1 3.54Å; V1207-I1217 HydrophobicContact CG2-CG1 4Å
1218	S	65.9	Low	79.5	Confident	115 Å²	115	69.4 Å²	69.4	80%	0.804	40%	0.402	S	S	*	.			trans	-83.5	115.5	163.6	53.7	0	0	0	0	109
1219	L	59.2	Low	79.2	Confident	125 Å²	125	74.5 Å²	74.5	65%	0.654	43%	0.426	S	S	*	.			trans	-87.6	0	169.4	-76.8	173.4	0	0	0	111.5	E1184 H1188 I1205	E1184-L1219 HydrophobicContact CB-CD1 4.19Å; E1184-L1219 HydrophobicContact CB-CD2 4.08Å; H1188-L1219 HydrophobicContact CB-CD1 3.69Å; I1205-L1219 HydrophobicContact CD1-CD1 3.66Å

Retrieved 1,219 of 1,219 residues in 3056.5 ms (Link to these results)

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