A0A087YG16_POEFO Loading...

Transforming growth factor, beta receptor III

AlphaFold DB , UniProt , Accession A0A087YG16, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 817 aa.

						>A0A087YG16_POEFO|A0A087YG16
MGQRSRIPLMLLALCCLTSAGPLLRSPCELLPVGTGHPVQAILKSFTAMSGCASKGTMSLSQEVHVINLRGHAAEGPDSTPARVELHLKPIQSVRQHQKRLVFVLNSPQPVIWNVKAENLAPFIHHTFHVSLGSEVLLKQANFSLNTQIQEENLPQGNEHLLNWAQKKYRAVTSFSELRMTQAIYIKVGEDSVFSDTCKIDTRFLSLNYLGSYEEPQTSKGCILSVPNREVHIIELQAPNSSSAFQVDVIVDLRPLKDDDLVVRDVTLVLRCAKSVHWVVKAHNMRGNLEVVASDTVTINSQMVETTSPRQLLPSGSQALIKWAVENGYNPVTSYTSTPMANHFNIRLREQDVSDHLESRLPPELFNLRHVSPLPEKGPAAPPAAPHSSLPFPFPYLPISLPNLNYDNEEPVEDRNVLDVELIVQCEEKRMVVSIDRKSLEAKGFANASLMLKNPECKAKVNATHYTLETPLTECGTIVFPVHNTQDVLHINSVTVISEEAQGDDDPISTWFPRLGEAAESTQTEPNPPAPLINFNCTYRKSKEVPNTKPDFGAIPGQPVNSISFEMELYKTQFFNNPPQQRIFKVSDQMEVVVQITSTASNPDIGLTITSCFISPSSSPSESSDYSLIETFCTKDNSLKWTQNSQGHFLFSSGKKGKSFSFTFNSKMLNKTLVFLHCEMSLCSENSQRYQELPQCPDLRNCSSLTGETMFVLMSNKRSLTKPIAVVDNSESQDYPPKKHEEAEMFLLDTTTVVLIAFAAFVIGVLLTGALWFIYTHTGGNARAQPVQKPQPVSENSSAAHSIGSTQSTPCSSSSTA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	45.8	Very low	256 Å²	256	151.6 Å²	151.6	100%	1.261	76%	0.763	S	S	*	*				0	120.3	0	-77.6	169.9	152.6	0	0	107.3
2	G	39.8	Very low	45.8	Very low	75 Å²	75	149.9 Å²	149.9	77%	0.773	76%	0.757	S	S	*	*			cis	-168.4	140.9	0.5	0	0	0	0	0	106.5
3	Q	49.5	Very low	45.8	Very low	195 Å²	195	142.7 Å²	142.7	91%	0.911	73%	0.734	S	S	*	*			trans	-54.3	137.5	175.3	-75.9	157.4	-56.6	0	0	111.7
4	R	45.1	Very low	45.6	Very low	245 Å²	245	140.9 Å²	140.9	93%	0.925	73%	0.726	S	S	*	*			trans	-128	79	152.1	-89	-174.4	173.7	174.9	-2	110.2
5	S	41.6	Very low	45.1	Very low	72 Å²	72	137.8 Å²	137.8	50%	0.503	72%	0.72	S	S	.	*				44.4	93.4	121.8	-161.9	0	0	0	0	117.7	I7	S5-I7 PolarHBondContact O-N 2.97Å; S5-I7 WeakPolarHBondContact OG-CB 3.42Å; S5-I7 WeakPolarHBondContact OG-CD1 3.36Å; S5-I7 WeakPolarHBondContact OG-CG1 3.5Å
6	R	49	Very low	44.6	Very low	241 Å²	241	136 Å²	136	91%	0.909	72%	0.721	S	S	*	*	S	Bend	trans	-76.5	51.3	161.5	-70.3	-166.4	173.7	-168	-0.2	111.7
7	I	53.3	Low	44.2	Very low	103 Å²	103	136.3 Å²	136.3	53%	0.528	72%	0.722	S	S	.	*			trans	-95.5	-25.7	-179.2	-64.8	179	0	0	0	114.3	S5 L9 L11	S5-I7 PolarHBondContact O-N 2.97Å; S5-I7 WeakPolarHBondContact OG-CB 3.42Å; S5-I7 WeakPolarHBondContact OG-CD1 3.36Å; S5-I7 WeakPolarHBondContact OG-CG1 3.5Å; I7-L9 PolarHBondContact O-N 3.19Å; I7-L11 HydrophobicContact CG2-CD1 3.8Å
8	P	48.3	Very low	43.7	Very low	86 Å²	86	135.2 Å²	135.2	56%	0.558	72%	0.722	S	S	*	*	H	α-helix	trans	-80.9	-20	-172	32.3	-32.5	0	0	0	113.7
9	L	46.9	Very low	43.4	Very low	154 Å²	154	133.2 Å²	133.2	81%	0.806	72%	0.72	S	S	*	*	H	α-helix	trans	-82.8	-26.1	179.4	-108.9	103.2	0	0	0	113.8	I7	I7-L9 PolarHBondContact O-N 3.19Å
10	M	47.3	Very low	42.9	Very low	132 Å²	132	131.3 Å²	131.3	65%	0.65	72%	0.722	S	S	*	*	H	α-helix	trans	-77.1	-30.4	175.4	-99.5	-75	-140.4	0	0	112.1	A13 L14	M10-A13 PolarHBondContact O-N 3.15Å; M10-L14 WeakPolarHBondContact O-CD1 3.19Å; M10-L14 PolarHBondContact O-N 2.95Å; M10-L14 HydrophobicContact SD-CD1 4.42Å
11	L	46.9	Very low	42.4	Very low	109 Å²	109	127.2 Å²	127.2	57%	0.571	71%	0.711	S	S	*	*	H	α-helix	trans	-73.5	-30.6	177.9	-84.5	156	0	0	0	113.1	I7 A13 C15	I7-L11 HydrophobicContact CG2-CD1 3.8Å; L11-A13 VanDerWaalsContact C-N 3.35Å; L11-C15 PolarHBondContact O-N 3.21Å
12	L	45.8	Very low	42.2	Very low	131 Å²	131	120.5 Å²	120.5	69%	0.686	69%	0.686	S	S	*	*	H	α-helix	trans	-74.1	-25.2	173.2	-103.2	127.9	0	0	0	113.1
13	A	45.8	Very low	41.8	Very low	56 Å²	56	125 Å²	125	46%	0.463	69%	0.692	S	S	.	*	H	α-helix	trans	-78.6	-28.9	173.8	0	0	0	0	0	112.8	M10 L11	M10-A13 PolarHBondContact O-N 3.15Å; L11-A13 VanDerWaalsContact C-N 3.35Å
14	L	43	Very low	41.1	Very low	117 Å²	117	123.3 Å²	123.3	61%	0.613	69%	0.688	S	S	*	*	H	α-helix	trans	-79.7	-26.9	174.9	-94.3	88.7	0	0	0	113.9	M10 C16 L17	M10-L14 WeakPolarHBondContact O-CD1 3.19Å; M10-L14 PolarHBondContact O-N 2.95Å; M10-L14 HydrophobicContact SD-CD1 4.42Å; L14-C16 VanDerWaalsContact C-N 3.27Å; L14-C16 PolarHBondContact O-N 3.49Å; L14-L17 PolarHBondContact O-N 2.8Å
15	C	38.2	Very low	40.7	Very low	95 Å²	95	122.9 Å²	122.9	64%	0.642	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-73.2	-15.2	174.9	-81.3	0	0	0	0	114.1	L11 T18	L11-C15 PolarHBondContact O-N 3.21Å; C15-T18 PolarHBondContact O-OG1 3.49Å
16	C	36.2	Very low	41.2	Very low	109 Å²	109	121.8 Å²	121.8	74%	0.736	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-90.8	3.5	175.3	-66.6	0	0	0	0	113.6	L14	L14-C16 VanDerWaalsContact C-N 3.27Å; L14-C16 PolarHBondContact O-N 3.49Å
17	L	38.1	Very low	41.8	Very low	141 Å²	141	115.3 Å²	115.3	74%	0.738	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-100.5	8.6	174.7	-84.1	158	0	0	0	113.4	L14 S19	L14-L17 PolarHBondContact O-N 2.8Å; L17-S19 PolarHBondContact O-N 2.84Å
18	T	36.3	Very low	42.8	Very low	117 Å²	117	110.7 Å²	110.7	72%	0.718	64%	0.644	S	S	*	*			trans	-74.5	78.7	155.1	52.7	0	0	0	0	107.6	C15 A20	C15-T18 PolarHBondContact O-OG1 3.49Å; T18-A20 VanDerWaalsContact C-N 3.29Å; T18-A20 PolarHBondContact O-N 3.41Å
19	S	36.2	Very low	44.2	Very low	97 Å²	97	113.7 Å²	113.7	68%	0.678	65%	0.651	S	S	*	*			trans	-47.8	104.1	154.3	165	0	0	0	0	106.3	L17 G21	L17-S19 PolarHBondContact O-N 2.84Å; S19-G21 PolarHBondContact O-N 3.2Å
20	A	35.1	Very low	46	Very low	94 Å²	94	109.6 Å²	109.6	78%	0.777	63%	0.63	S	S	*	*			trans	-51.8	105.6	147.8	0	0	0	0	0	103.6	T18	T18-A20 VanDerWaalsContact C-N 3.29Å; T18-A20 PolarHBondContact O-N 3.41Å
21	G	30.9	Very low	47.8	Very low	46 Å²	46	108 Å²	108	47%	0.474	62%	0.623	S	S	.	*			trans	-47.3	148.3	174.3	0	0	0	0	0	108	S19 L23	S19-G21 PolarHBondContact O-N 3.2Å; G21-L23 PolarHBondContact O-N 2.86Å
22	P	32.2	Very low	49.7	Very low	115 Å²	115	107.9 Å²	107.9	75%	0.747	63%	0.629	S	S	*	*			trans	-46.9	126.7	-179.2	21	-31.7	0	0	0	107.8	L24	P22-L24 VanDerWaalsContact C-N 3.26Å; P22-L24 PolarHBondContact O-N 2.81Å
23	L	31.7	Very low	51.6	Low	171 Å²	171	103.3 Å²	103.3	90%	0.895	61%	0.606	S	S	*	*			trans	-50.8	105.3	166.4	-75.7	172.2	0	0	0	104.6	G21 R25	G21-L23 PolarHBondContact O-N 2.86Å; L23-R25 VanDerWaalsContact C-N 3.25Å; L23-R25 PolarHBondContact O-N 2.78Å
24	L	34.1	Very low	53.2	Low	158 Å²	158	102.9 Å²	102.9	83%	0.827	61%	0.607	S	S	*	*			trans	-56.7	102.7	173.6	-101.1	128.1	0	0	0	104.2	P22 S26	P22-L24 VanDerWaalsContact C-N 3.26Å; P22-L24 PolarHBondContact O-N 2.81Å; L24-S26 PolarHBondContact O-N 2.87Å
25	R	38.1	Very low	54.8	Low	237 Å²	237	104.1 Å²	104.1	89%	0.894	62%	0.62	S	S	*	*			trans	-52.9	108.9	173.7	-158.4	176.5	-168.5	171.3	2.1	104.2	L23 P27	L23-R25 VanDerWaalsContact C-N 3.25Å; L23-R25 PolarHBondContact O-N 2.78Å; R25-P27 WeakPolarHBondContact O-CD 3.39Å
26	S	50.7	Low	56.7	Low	48 Å²	48	101.8 Å²	101.8	34%	0.336	61%	0.612	S	S	.	*			trans	-60.7	126.8	-169.3	50.4	0	0	0	0	108.3	L24 C28 Q318	L24-S26 PolarHBondContact O-N 2.87Å; S26-C28 PolarHBondContact O-N 2.91Å; S26-C28 PolarHBondContact OG-O 3.24Å; S26-Q318 VanDerWaalsContact CB-NE2 3.25Å
27	P	62.4	Low	59.1	Low	105 Å²	105	97.3 Å²	97.3	68%	0.682	58%	0.581	S	S	*	*	S	Bend	trans	-63.2	-11.8	-176.7	22.5	-31.5	0	0	0	112.9	R25 L224	R25-P27 WeakPolarHBondContact O-CD 3.39Å; P27-L224 HydrophobicContact CB-CD2 4.12Å; P27-L224 WeakPolarHBondContact O-CD2 3.3Å
28	C	73.8	Confident	61.5	Low	6 Å²	6	91.5 Å²	91.5	4%	0.041	55%	0.551	C	S	.	*			trans	-121.6	111.2	179.1	178.4	0	0	0	0	110.7	S26 C222 L224 I321	S26-C28 PolarHBondContact O-N 2.91Å; S26-C28 PolarHBondContact OG-O 3.24Å; C28-C222 HydrophobicContact CB-CB 4.03Å; C28-C222 WeakPolarHBondContact CB-SG 3.41Å; C28-C222 WeakPolarHBondContact SG-CB 3.37Å; C28-C222 CovalentContact SG-SG 2.01Å; C28-C222 PolarHBondContact SG-SG 2.88Å; C28-L224 HydrophobicContact CB-CD2 4.11Å; C28-I321 HydrophobicContact CB-CD1 3.66Å
29	E	79	Confident	64.1	Low	149 Å²	149	85.9 Å²	85.9	70%	0.696	52%	0.517	S	S	*	.			trans	-91.1	122.8	164.7	-171.1	171.9	-179.7	0	0	108.6	L31	E29-L31 PolarHBondContact O-N 2.99Å; E29-L31 VanDerWaalsContact O-N 3.11Å
30	L	83.2	Confident	66.8	Low	68 Å²	68	84.2 Å²	84.2	36%	0.356	50%	0.498	S	S	.	.			trans	-77.6	100.1	-175.2	-65.8	179	0	0	0	110.5	K220 Y335	L30-K220 HydrophobicContact CB-CB 4.43Å; L30-Y335 HydrophobicContact CD2-CD1 3.48Å; L30-Y335 VanDerWaalsContact CD2-CD1 3.48Å; L30-Y335 HydrophobicContact CD2-CE1 3.5Å
31	L	86.1	Confident	69.5	Low	99 Å²	99	79.9 Å²	79.9	52%	0.518	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	154.7	176.2	-64	175.3	0	0	0	110.8	E29 V33 K220 G221	E29-L31 PolarHBondContact O-N 2.99Å; E29-L31 VanDerWaalsContact O-N 3.11Å; L31-V33 PolarHBondContact O-N 3.44Å; L31-K220 CarbonylContact O-C 3.59Å; L31-K220 VanDerWaalsContact O-CA 3.3Å; L31-K220 WeakPolarHBondContact O-CA 3.03Å; L31-G221 PolarHBondContact N-O 2.81Å; L31-G221 VanDerWaalsContact N-O 3.14Å; L31-G221 PolarHBondContact O-N 3.49Å
32	P	85.8	Confident	72.3	Confident	107 Å²	107	78.8 Å²	78.8	70%	0.695	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.4	128.9	168	-23	33.7	0	0	0	110.4	G34	P32-G34 PolarHBondContact O-N 3.16Å
33	V	87	Confident	75	Confident	34 Å²	34	74.2 Å²	74.2	21%	0.206	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-72.4	124.4	-177.2	170.7	0	0	0	0	109.9	L31 H37 S219	L31-V33 PolarHBondContact O-N 3.44Å; V33-H37 HydrophobicContact CB-CB 4.49Å; V33-H37 HydrophobicContact CG1-CB 3.32Å; V33-S219 WeakPolarHBondContact CB-O 3.47Å; V33-S219 WeakPolarHBondContact CG2-O 3.42Å; V33-S219 PolarHBondContact N-O 3.46Å
34	G	79.6	Confident	77.5	Confident	47 Å²	47	68.3 Å²	68.3	49%	0.485	38%	0.382	S	S	.	.			trans	-91.7	-178.8	171.8	0	0	0	0	0	113	P32 G36 H37 Q40	P32-G34 PolarHBondContact O-N 3.16Å; G34-G36 PolarHBondContact O-N 3.1Å; G34-H37 PolarHBondContact O-N 3.38Å; G34-Q40 PolarHBondContact O-NE2 3.16Å
35	T	76.9	Confident	79.6	Confident	143 Å²	143	62.6 Å²	62.6	88%	0.877	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22	179.6	51.1	0	0	0	0	114.1
36	G	76.7	Confident	81.5	Confident	47 Å²	47	55.9 Å²	55.9	49%	0.485	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.4	-179.6	0	0	0	0	0	115.7	G34 R349	G34-G36 PolarHBondContact O-N 3.1Å; G36-R349 PolarHBondContact O-NH2 2.81Å; G36-R349 VanDerWaalsContact O-NH2 3.13Å
37	H	86.7	Confident	82.8	Confident	15 Å²	15	57.1 Å²	57.1	7%	0.069	34%	0.338	C	S	.	.	S	Bend	trans	-79.8	139.2	176.1	-170.8	76.5	0	0	0	110.5	V33 G34 V39 Q40 I223 T336	V33-H37 HydrophobicContact CB-CB 4.49Å; V33-H37 HydrophobicContact CG1-CB 3.32Å; G34-H37 PolarHBondContact O-N 3.38Å; H37-V39 PolarHBondContact CD2-N 3Å; H37-V39 PolarHBondContact CD2-O 3.04Å; H37-V39 VanDerWaalsContact CD2-O 3.29Å; H37-V39 PolarHBondContact O-N 2.82Å; H37-Q40 PolarHBondContact O-NE2 2.9Å; H37-Q40 VanDerWaalsContact O-NE2 3.1Å; H37-I223 WeakPolarHBondContact ND1-CG1 3.34Å; H37-T336 PolarHBondContact NE2-OG1 2.82Å
38	P	88.1	Confident	83.7	Confident	18 Å²	18	52.8 Å²	52.8	12%	0.117	31%	0.311	C	S	.	.	S	Bend	trans	-63.1	-25.8	-172.8	23.3	-34.5	0	0	0	113.6	I346 R347	P38-I346 CarbonylContact O-C 3.53Å; P38-I346 VanDerWaalsContact O-CA 3.28Å; P38-I346 WeakPolarHBondContact O-CA 3.32Å; P38-R347 PolarHBondContact O-N 2.79Å
39	V	91.8	Very high	84.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.1	-176.8	-173.3	0	0	0	0	111.1	H37 I234 T336 F344 N345 I346	H37-V39 PolarHBondContact CD2-N 3Å; H37-V39 PolarHBondContact CD2-O 3.04Å; H37-V39 VanDerWaalsContact CD2-O 3.29Å; H37-V39 PolarHBondContact O-N 2.82Å; V39-I234 HydrophobicContact CG1-CD1 3.91Å; V39-I234 HydrophobicContact CG1-CG1 4.27Å; V39-T336 HydrophobicContact CB-CG2 4.2Å; V39-T336 WeakPolarHBondContact CB-OG1 3.47Å; V39-T336 HydrophobicContact CG1-CG2 4.06Å; V39-F344 HydrophobicContact CG1-CB 4.47Å; V39-F344 HydrophobicContact CG1-CD1 3.85Å; V39-N345 CarbonylContact C-O 3.52Å; V39-N345 WeakPolarHBondContact CA-O 3.37Å; V39-I346 HydrophobicContact CG1-CG1 4.42Å; V39-I346 HydrophobicContact CG2-CG1 4.19Å
40	Q	92.3	Very high	84.8	Confident	61 Å²	61	49.6 Å²	49.6	29%	0.285	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.8	175.1	-62.5	-62.2	-33.8	0	0	110	G34 H37 F344 N345	G34-Q40 PolarHBondContact O-NE2 3.16Å; H37-Q40 PolarHBondContact O-NE2 2.9Å; H37-Q40 VanDerWaalsContact O-NE2 3.1Å; Q40-F344 CarbonylContact O-C 3.52Å; Q40-F344 WeakPolarHBondContact O-CA 3Å; Q40-N345 HydrophobicContact CB-CB 4.46Å; Q40-N345 PolarHBondContact N-O 3.36Å; Q40-N345 PolarHBondContact O-N 2.64Å
41	A	93.1	Very high	85.3	Confident	3 Å²	3	46.4 Å²	46.4	3%	0.025	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.3	-178.5	0	0	0	0	0	111.6	Q217 S219 T338 A341 F344	A41-Q217 HydrophobicContact CB-CB 4.12Å; A41-Q217 PolarHBondContact O-N 3.36Å; A41-S219 WeakPolarHBondContact CB-OG 3.25Å; A41-T338 HydrophobicContact CB-CG2 3.66Å; A41-A341 HydrophobicContact CB-CB 3.96Å; A41-F344 HydrophobicContact CB-CD1 3.8Å; A41-F344 HydrophobicContact CB-CE1 3.57Å; A41-F344 HydrophobicContact CB-CZ 4.42Å
42	I	90.2	Very high	85.7	Confident	23 Å²	23	41.9 Å²	41.9	12%	0.118	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.5	-177.2	-57.7	175.9	0	0	0	108.9	E214 N342 H343 N345	I42-E214 HydrophobicContact CG2-CB 3.97Å; I42-E214 HydrophobicContact CG2-CG 4.42Å; I42-N342 PolarHBondContact O-N 2.83Å; I42-N342 PolarHBondContact O-OD1 3.08Å; I42-H343 HydrophobicContact CB-CB 4.25Å; I42-H343 PolarHBondContact N-O 2.01Å; I42-H343 PolarHBondContact O-N 2.86Å; I42-H343 VanDerWaalsContact O-O 3.08Å; I42-N345 VanDerWaalsContact CD1-ND2 3.26Å; I42-N345 WeakPolarHBondContact CD1-ND2 3.11Å
43	L	88.4	Confident	86.1	Confident	20 Å²	20	37.1 Å²	37.1	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	107	166.4	-174.2	67.6	0	0	0	108.9	E215 Q217 P239 M340 N342	L43-E215 PolarHBondContact N-O 3.34Å; L43-E215 PolarHBondContact O-N 3.44Å; L43-Q217 HydrophobicContact CB-CG 3.75Å; L43-P239 WeakPolarHBondContact CD1-O 3.5Å; L43-M340 HydrophobicContact CD1-CG 4.24Å; L43-M340 HydrophobicContact CD2-CE 3.87Å; L43-M340 HydrophobicContact CD2-CG 4.46Å; L43-M340 HydrophobicContact CD2-SD 4.28Å; L43-N342 WeakPolarHBondContact CA-OD1 3.4Å
44	K	83.6	Confident	86.4	Confident	46 Å²	46	35.7 Å²	35.7	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.8	175	-170.3	164.7	-172.4	144.5	0	110.1	F46 Y213 E214 N342	K44-F46 HydrophobicContact CD-CE2 4.44Å; K44-F46 HydrophobicContact CD-CZ 4.17Å; K44-F46 HydrophobicContact CG-CE2 4.15Å; K44-F46 HydrophobicContact CG-CZ 4.25Å; K44-Y213 CarbonylContact C-O 3.59Å; K44-Y213 VanDerWaalsContact CA-O 3.3Å; K44-Y213 WeakPolarHBondContact CA-O 3.2Å; K44-E214 HydrophobicContact CD-CG 4.32Å; K44-E214 WeakPolarHBondContact CE-OE1 3.45Å; K44-E214 HydrophobicContact CG-CG 4.12Å; K44-E214 IonicContact NZ-OE1 2.74Å; K44-E214 PolarHBondContact NZ-OE1 3.15Å; K44-N342 PolarHBondContact N-OD1 2.8Å; K44-N342 PolarHBondContact O-ND2 3.18Å
45	S	78.3	Confident	87	Confident	38 Å²	38	36.3 Å²	36.3	27%	0.266	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.9	174.9	55	0	0	0	0	110.6	S212 Y213	S45-S212 CarbonylContact O-C 3.58Å; S45-Y213 PolarHBondContact N-O 3.32Å; S45-Y213 PolarHBondContact O-N 3.48Å
46	F	78.9	Confident	87.6	Confident	96 Å²	96	30.2 Å²	30.2	42%	0.421	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	99	179.2	-63.5	-90.5	0	0	0	108.5	K44 Y185 L210 G211	K44-F46 HydrophobicContact CD-CE2 4.44Å; K44-F46 HydrophobicContact CD-CZ 4.17Å; K44-F46 HydrophobicContact CG-CE2 4.15Å; K44-F46 HydrophobicContact CG-CZ 4.25Å; F46-Y185 HydrophobicContact CE1-CE2 4.11Å; F46-L210 HydrophobicContact CB-CD1 4.37Å; F46-L210 HydrophobicContact CB-CD2 4.47Å; F46-G211 WeakPolarHBondContact CA-O 3.47Å
47	T	76.7	Confident	88.4	Confident	74 Å²	74	28 Å²	28	45%	0.454	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	160.8	-176.4	60.5	0	0	0	0	111.1	G211	T47-G211 PolarHBondContact N-O 2.85Å
48	A	81.9	Confident	88.5	Confident	14 Å²	14	32.7 Å²	32.7	12%	0.116	17%	0.173	C	C	.	.			trans	-108.5	148	162.8	0	0	0	0	0	109.1	L178	A48-L178 HydrophobicContact CB-CD2 3.65Å
49	M	84.8	Confident	88.4	Confident	87 Å²	87	37.2 Å²	37.2	43%	0.429	21%	0.205	S	C	.	.	S	Bend	trans	-74.3	-41.5	177.2	-67.8	-176.8	55.7	0	0	111.2	E177 R179	M49-E177 HydrophobicContact CB-CG 4.24Å; M49-E177 PolarHBondContact N-O 2.98Å; M49-R179 HydrophobicContact SD-CB 4Å
50	S	91.2	Very high	88.4	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	161.9	171.6	73.6	0	0	0	0	108.9	E177 D201	S50-E177 PolarHBondContact O-N 3.1Å; S50-E177 VanDerWaalsContact OG-CB 3.28Å; S50-E177 WeakPolarHBondContact OG-CB 3.41Å; S50-E177 PolarHBondContact OG-OE2 2.97Å; S50-D201 VanDerWaalsContact CA-O 3.32Å; S50-D201 WeakPolarHBondContact CA-O 3.43Å; S50-D201 WeakPolarHBondContact CB-O 3.41Å
51	G	93.7	Very high	88.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.6	-178.5	176.7	0	0	0	0	0	114.1	F175 D201 F204	G51-F175 CarbonylContact C-O 3.58Å; G51-F175 WeakPolarHBondContact CA-O 3.37Å; G51-D201 PolarHBondContact N-O 3.46Å; G51-D201 PolarHBondContact O-N 2.87Å; G51-F204 VanDerWaalsContact C-CD1 3.44Å; G51-F204 VanDerWaalsContact C-CG 3.41Å; G51-F204 VanDerWaalsContact CA-CD1 3.48Å; G51-F204 WeakPolarHBondContact O-CB 3.43Å; G51-F204 VanDerWaalsContact O-CG 3.31Å; G51-F204 WeakPolarHBondContact O-CG 3.29Å
52	C	93.8	Very high	88.3	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.027	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159.4	170.1	57.6	0	0	0	0	110.3	S174 F175 C198 K199	C52-S174 CarbonylContact O-C 2.79Å; C52-S174 WeakPolarHBondContact O-CA 3.4Å; C52-F175 PolarHBondContact N-O 2.72Å; C52-F175 PolarHBondContact O-N 3.03Å; C52-F175 VanDerWaalsContact SG-CB 3.56Å; C52-C198 HydrophobicContact CB-CB 4.14Å; C52-C198 WeakPolarHBondContact CB-SG 3.33Å; C52-C198 PolarHBondContact O-SG 3.19Å; C52-C198 VanDerWaalsContact SG-CA 3.51Å; C52-C198 WeakPolarHBondContact SG-CB 3.22Å; C52-C198 CovalentContact SG-SG 2.03Å; C52-C198 PolarHBondContact SG-SG 3.48Å; C52-K199 WeakPolarHBondContact CB-O 3.32Å
53	A	94.6	Very high	88.5	Confident	7 Å²	7	41.1 Å²	41.1	6%	0.058	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.7	170.2	0	0	0	0	0	109.2	T173 F194 F204 Y209	A53-T173 CarbonylContact C-O 3.53Å; A53-T173 WeakPolarHBondContact CA-O 3.41Å; A53-F194 HydrophobicContact CB-CB 4.5Å; A53-F194 HydrophobicContact CB-CD1 3.74Å; A53-F194 HydrophobicContact CB-CD2 3.69Å; A53-F194 HydrophobicContact CB-CE1 3.79Å; A53-F194 HydrophobicContact CB-CE2 3.76Å; A53-F194 HydrophobicContact CB-CG 3.7Å; A53-F194 HydrophobicContact CB-CZ 3.81Å; A53-F204 HydrophobicContact CB-CE2 4.05Å; A53-F204 HydrophobicContact CB-CZ 3.87Å; A53-Y209 HydrophobicContact CB-CD2 4.36Å; A53-Y209 HydrophobicContact CB-CE2 3.52Å
54	S	93.8	Very high	88.9	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	23%	0.228	C	C	.	.			trans	-152.2	148.5	-173.6	179.2	0	0	0	0	111.8	G56 V172 T173 S195 D196 T197	S54-G56 PolarHBondContact OG-N 2.03Å; S54-V172 WeakPolarHBondContact CB-O 3.3Å; S54-T173 PolarHBondContact N-O 2.83Å; S54-S195 CarbonylContact C-O 2.67Å; S54-S195 WeakPolarHBondContact CA-O 3.3Å; S54-S195 WeakPolarHBondContact CB-O 3.47Å; S54-S195 PolarHBondContact OG-O 2.83Å; S54-D196 PolarHBondContact OG-O 2.79Å; S54-D196 VanDerWaalsContact OG-O 3.08Å; S54-T197 PolarHBondContact OG-N 3.04Å
55	K	92.4	Very high	89.5	Confident	61 Å²	61	38 Å²	38	27%	0.265	22%	0.218	S	C	.	.	S	Bend	trans	-93.9	7.9	169.8	72.3	-176.6	174.6	-164.9	0	113.6	T57 M58 S192 F194 S195 D196	K55-T57 PolarHBondContact O-N 2.98Å; K55-M58 HydrophobicContact CB-CG 4.06Å; K55-M58 HydrophobicContact CB-SD 3.81Å; K55-M58 HydrophobicContact CD-SD 4.17Å; K55-M58 HydrophobicContact CG-SD 4.29Å; K55-M58 WeakPolarHBondContact O-CB 3.44Å; K55-M58 VanDerWaalsContact O-CG 3.25Å; K55-M58 WeakPolarHBondContact O-CG 3.27Å; K55-M58 PolarHBondContact O-N 2.79Å; K55-S192 PolarHBondContact NZ-O 3.16Å; K55-F194 VanDerWaalsContact CD-O 3.25Å; K55-F194 WeakPolarHBondContact CD-O 3.29Å; K55-F194 VanDerWaalsContact CE-O 3.29Å; K55-F194 WeakPolarHBondContact CE-O 3.29Å; K55-S195 PolarHBondContact N-O 3.23Å; K55-D196 WeakPolarHBondContact CE-OD1 3.34Å; K55-D196 VanDerWaalsContact CG-OD1 3.22Å; K55-D196 WeakPolarHBondContact CG-OD1 3.4Å
56	G	89.1	Confident	90.4	Very high	15 Å²	15	36.1 Å²	36.1	16%	0.155	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-15.3	-178.4	0	0	0	0	0	114.6	S54 D196	S54-G56 PolarHBondContact OG-N 2.03Å; G56-D196 VanDerWaalsContact CA-O 3.3Å; G56-D196 WeakPolarHBondContact CA-O 3.03Å
57	T	92.3	Very high	91.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-6.5	174.9	58	0	0	0	0	114.3	K55 S59 L60 K99 A171 T173 E190	K55-T57 PolarHBondContact O-N 2.98Å; T57-S59 PolarHBondContact O-N 3.02Å; T57-L60 HydrophobicContact CG2-CD1 4.39Å; T57-L60 WeakPolarHBondContact O-CB 3.01Å; T57-L60 PolarHBondContact O-N 3.07Å; T57-K99 PolarHBondContact O-NZ 3.04Å; T57-A171 HydrophobicContact CG2-CB 3.98Å; T57-T173 WeakPolarHBondContact CB-OG1 3.21Å; T57-T173 WeakPolarHBondContact CG2-OG1 3.12Å; T57-T173 PolarHBondContact OG1-OG1 2.7Å; T57-E190 VanDerWaalsContact OG1-CG 3.32Å; T57-E190 WeakPolarHBondContact OG1-CG 3.38Å; T57-E190 PolarHBondContact OG1-OE1 2.81Å
58	M	88.8	Confident	92.1	Very high	114 Å²	114	28.1 Å²	28.1	56%	0.562	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-38.6	-178.4	-75.8	-176.1	80	0	0	112.8	K55 L60 E190	K55-M58 HydrophobicContact CB-CG 4.06Å; K55-M58 HydrophobicContact CB-SD 3.81Å; K55-M58 HydrophobicContact CD-SD 4.17Å; K55-M58 HydrophobicContact CG-SD 4.29Å; K55-M58 WeakPolarHBondContact O-CB 3.44Å; K55-M58 VanDerWaalsContact O-CG 3.25Å; K55-M58 WeakPolarHBondContact O-CG 3.27Å; K55-M58 PolarHBondContact O-N 2.79Å; M58-L60 VanDerWaalsContact C-N 3.33Å; M58-E190 HydrophobicContact CG-CB 3.54Å; M58-E190 HydrophobicContact CG-CG 3.79Å; M58-E190 HydrophobicContact SD-CB 4.44Å
59	S	87.8	Confident	92.6	Very high	112 Å²	112	27.4 Å²	27.4	78%	0.783	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-4	178.8	59.4	0	0	0	0	114.3	T57	T57-S59 PolarHBondContact O-N 3.02Å
60	L	91.5	Very high	92.9	Very high	40 Å²	40	26.5 Å²	26.5	21%	0.209	15%	0.15	C	C	.	.	S	Bend	trans	-100.4	162.4	-178.8	-57.4	-178.6	0	0	0	111.5	T57 M58 Q62 K99 Y169 R170 A171	T57-L60 HydrophobicContact CG2-CD1 4.39Å; T57-L60 WeakPolarHBondContact O-CB 3.01Å; T57-L60 PolarHBondContact O-N 3.07Å; M58-L60 VanDerWaalsContact C-N 3.33Å; L60-Q62 VanDerWaalsContact C-N 3.32Å; L60-Q62 PolarHBondContact O-N 2.95Å; L60-K99 WeakPolarHBondContact O-CE 3.32Å; L60-K99 PolarHBondContact O-NZ 2.78Å; L60-Y169 WeakPolarHBondContact CD1-O 3.17Å; L60-R170 HydrophobicContact CD1-CB 4.33Å; L60-A171 HydrophobicContact CD1-CB 3.68Å
61	S	89.7	Confident	92.5	Very high	82 Å²	82	28.1 Å²	28.1	57%	0.573	17%	0.167	S	C	*	.	S	Bend	trans	-78.1	-11.8	179.7	47	0	0	0	0	114.8
62	Q	92.5	Very high	91.7	Very high	45 Å²	45	35.2 Å²	35.2	21%	0.21	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152	-179.2	59.1	-92.5	-4.6	0	0	112.1	L60 R100 V102 Y169	L60-Q62 VanDerWaalsContact C-N 3.32Å; L60-Q62 PolarHBondContact O-N 2.95Å; Q62-R100 CarbonylContact C-O 3.59Å; Q62-R100 VanDerWaalsContact CA-O 3.24Å; Q62-R100 WeakPolarHBondContact CA-O 3.1Å; Q62-R100 HydrophobicContact CB-CB 3.95Å; Q62-R100 WeakPolarHBondContact CB-O 3.44Å; Q62-V102 HydrophobicContact CB-CG2 4.19Å; Q62-V102 HydrophobicContact CG-CG2 4.09Å; Q62-Y169 HydrophobicContact CG-CD1 4.32Å
63	E	94.8	Very high	90.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	147.6	166.4	-73.8	166.5	-129.5	0	0	110	H65 H97 K99 R100 L101 V102 T173 G189 E190	E63-H65 IonicContact OE2-NE2 3.76Å; E63-H65 PolarHBondContact OE2-NE2 3.4Å; E63-H97 VanDerWaalsContact CD-NE2 3.26Å; E63-H97 IonicContact OE1-CD2 3.19Å; E63-H97 IonicContact OE1-CE1 3.28Å; E63-H97 PolarHBondContact OE1-CE1 3.37Å; E63-H97 IonicContact OE1-NE2 2.74Å; E63-H97 PolarHBondContact OE1-NE2 3.44Å; E63-H97 IonicContact OE2-NE2 3.05Å; E63-H97 PolarHBondContact OE2-NE2 3.33Å; E63-K99 HydrophobicContact CG-CD 4.05Å; E63-R100 PolarHBondContact N-O 3.17Å; E63-L101 HydrophobicContact CB-CD2 3.93Å; E63-V102 WeakPolarHBondContact O-CB 3.49Å; E63-V102 PolarHBondContact O-N 3.44Å; E63-T173 WeakPolarHBondContact CA-OG1 3.2Å; E63-T173 HydrophobicContact CG-CG2 4.36Å; E63-G189 VanDerWaalsContact OE2-CA 3.27Å; E63-G189 WeakPolarHBondContact OE2-CA 3.4Å; E63-G189 PolarHBondContact OE2-N 3.38Å; E63-E190 HydrophobicContact CG-CG 4.39Å; E63-E190 WeakPolarHBondContact CG-OE1 3.36Å
64	V	96.3	Very high	89	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	114.5	-176.4	-177.2	0	0	0	0	108.8	V66 V102 A165 Y169 V172 T173 S174	V64-V66 HydrophobicContact CG1-CG2 4.3Å; V64-V102 CarbonylContact C-O 3.48Å; V64-V102 WeakPolarHBondContact CA-O 3.21Å; V64-V102 HydrophobicContact CG2-CB 4.19Å; V64-A165 HydrophobicContact CG1-CB 4.47Å; V64-Y169 HydrophobicContact CG1-CD2 4.3Å; V64-Y169 HydrophobicContact CG2-CD1 4.36Å; V64-Y169 HydrophobicContact CG2-CD2 4.22Å; V64-Y169 HydrophobicContact CG2-CG 3.8Å; V64-V172 HydrophobicContact CG1-CG2 4.23Å; V64-T173 PolarHBondContact N-OG1 2.99Å; V64-T173 WeakPolarHBondContact O-CA 3.29Å; V64-T173 VanDerWaalsContact O-CB 3.32Å; V64-T173 WeakPolarHBondContact O-CB 3.37Å; V64-T173 PolarHBondContact O-N 3.36Å; V64-S174 PolarHBondContact O-N 3.3Å
65	H	96.8	Very high	87.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.7	178.8	-61.7	-76.8	0	0	0	109.4	E63 V102 F103 V104 S174	E63-H65 IonicContact OE2-NE2 3.76Å; E63-H65 PolarHBondContact OE2-NE2 3.4Å; H65-V102 PolarHBondContact N-O 2.81Å; H65-F103 HydrophobicContact CB-CD1 3.69Å; H65-F103 HydrophobicContact CB-CE1 3.63Å; H65-F103 AromaticContact CD2-CE1 3.95Å; H65-F103 AromaticContact CG-CE1 3.99Å; H65-F103 CarbonylContact O-C 3.59Å; H65-F103 WeakPolarHBondContact O-CA 3.34Å; H65-V104 PolarHBondContact O-N 3.24Å; H65-S174 PolarHBondContact ND1-OG 3.46Å
66	V	97	Very high	85.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.1	-178.2	-175.4	0	0	0	0	109.3	V64 V104 L161 A165 V172 S174 F175 S176	V64-V66 HydrophobicContact CG1-CG2 4.3Å; V66-V104 HydrophobicContact CB-CB 4.41Å; V66-V104 HydrophobicContact CG1-CB 4.19Å; V66-V104 HydrophobicContact CG1-CG1 4.37Å; V66-V104 HydrophobicContact CG2-CB 4.12Å; V66-V104 HydrophobicContact CG2-CG2 4.22Å; V66-L161 HydrophobicContact CG1-CD2 3.65Å; V66-L161 HydrophobicContact CG1-CG 3.84Å; V66-A165 HydrophobicContact CG2-CB 3.84Å; V66-V172 HydrophobicContact CG2-CG1 3.89Å; V66-S174 PolarHBondContact N-O 3.35Å; V66-F175 HydrophobicContact CB-CD2 3.69Å; V66-F175 HydrophobicContact CB-CE2 4.25Å; V66-F175 HydrophobicContact CB-CG 4.4Å; V66-F175 HydrophobicContact CG1-CD2 3.53Å; V66-F175 HydrophobicContact CG1-CE2 3.56Å; V66-F175 HydrophobicContact CG2-CD2 4.42Å; V66-F175 CarbonylContact O-C 3.56Å; V66-F175 WeakPolarHBondContact O-CA 3.46Å; V66-S176 PolarHBondContact O-N 2.91Å
67	I	96.4	Very high	83.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.4	176.3	-59.6	177.1	0	0	0	107.6	L69 L86 V104 L105 N106 W113 L178 I184 I186	I67-L69 HydrophobicContact CG2-CD2 4.28Å; I67-L69 HydrophobicContact CG2-CG 4.41Å; I67-L86 HydrophobicContact CD1-CD1 3.74Å; I67-V104 PolarHBondContact N-O 2.85Å; I67-L105 HydrophobicContact CB-CD2 4.11Å; I67-L105 HydrophobicContact CD1-CD2 3.72Å; I67-L105 HydrophobicContact CG1-CD2 4.19Å; I67-N106 PolarHBondContact O-N 3.02Å; I67-W113 HydrophobicContact CG2-CH2 4.2Å; I67-L178 HydrophobicContact CG2-CD1 4.22Å; I67-I184 HydrophobicContact CD1-CD1 4.47Å; I67-I184 HydrophobicContact CD1-CG2 4.18Å; I67-I184 HydrophobicContact CG2-CD1 3.88Å; I67-I186 HydrophobicContact CD1-CD1 4.22Å; I67-I186 HydrophobicContact CD1-CG1 4.1Å
68	N	95.2	Very high	82.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	103.2	176.5	-164.2	14.8	0	0	0	110.2	R70 N106 Q156 N158 L161 F175 S176 E177 L178	N68-R70 PolarHBondContact ND2-NH2 2.84Å; N68-N106 PolarHBondContact OD1-ND2 2.86Å; N68-Q156 PolarHBondContact ND2-O 2.8Å; N68-N158 PolarHBondContact ND2-OD1 2.94Å; N68-L161 HydrophobicContact CB-CD2 3.91Å; N68-F175 HydrophobicContact CB-CE1 4.49Å; N68-F175 HydrophobicContact CB-CZ 4.01Å; N68-S176 PolarHBondContact N-O 2.96Å; N68-E177 WeakPolarHBondContact O-CA 3.42Å; N68-L178 PolarHBondContact O-N 2.92Å
69	L	93	Very high	80.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.9	177.4	-67	-176	0	0	0	111.6	I67 V84 N106 P108 W113 L178 M180 T181 I184	I67-L69 HydrophobicContact CG2-CD2 4.28Å; I67-L69 HydrophobicContact CG2-CG 4.41Å; L69-V84 HydrophobicContact CD1-CG2 4.24Å; L69-N106 PolarHBondContact N-O 3Å; L69-P108 WeakPolarHBondContact O-CD 3.44Å; L69-W113 HydrophobicContact CD1-CH2 3.4Å; L69-W113 HydrophobicContact CD1-CZ2 3.74Å; L69-W113 HydrophobicContact CD1-CZ3 4.29Å; L69-W113 HydrophobicContact CG-CH2 3.88Å; L69-W113 HydrophobicContact CG-CZ2 4.37Å; L69-L178 CarbonylContact C-O 3.53Å; L69-L178 VanDerWaalsContact CA-O 3.3Å; L69-L178 WeakPolarHBondContact CA-O 3.49Å; L69-L178 HydrophobicContact CD2-CB 3.95Å; L69-M180 HydrophobicContact CD1-SD 3.91Å; L69-T181 HydrophobicContact CD2-CG2 4.29Å; L69-I184 HydrophobicContact CD2-CD1 3.92Å
70	R	90.1	Very high	79.7	Confident	67 Å²	67	56.3 Å²	56.3	25%	0.253	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139	178.8	-67.6	-62.8	-166.2	-158.7	-7.3	112.2	N68 Q156 N158 E177 L178 R179 M180	N68-R70 PolarHBondContact ND2-NH2 2.84Å; R70-Q156 PolarHBondContact NH1-O 2.69Å; R70-Q156 PolarHBondContact NH2-O 2.84Å; R70-N158 PolarHBondContact NH2-OD1 2.91Å; R70-E177 HydrophobicContact CG-CG 3.89Å; R70-E177 WeakPolarHBondContact CG-OE1 3.32Å; R70-E177 IonicContact CZ-OE1 3.7Å; R70-E177 IonicContact NE-OE1 2.7Å; R70-E177 PolarHBondContact NE-OE1 3.03Å; R70-E177 IonicContact NH2-OE1 3.38Å; R70-L178 PolarHBondContact N-O 2.87Å; R70-R179 CarbonylContact O-C 3.47Å; R70-R179 WeakPolarHBondContact O-CA 3.4Å; R70-M180 PolarHBondContact O-N 3.3Å
71	G	83.8	Confident	78.9	Confident	36 Å²	36	57 Å²	57	37%	0.371	35%	0.346	S	S	.	.	S	Bend	trans	90.5	-178.3	179.2	0	0	0	0	0	112.8	P108	G71-P108 WeakPolarHBondContact O-CG 2.97Å
72	H	76.7	Confident	78.6	Confident	149 Å²	149	54 Å²	54	69%	0.69	33%	0.327	S	S	*	.			trans	-115.9	137.2	-175.9	-60.6	81.1	0	0	0	108.8	Q109	H72-Q109 VanDerWaalsContact CB-OE1 3.28Å; H72-Q109 PolarHBondContact CD2-OE1 2.96Å; H72-Q109 VanDerWaalsContact CD2-OE1 3.24Å
73	A	69.4	Low	78.4	Confident	23 Å²	23	60 Å²	60	19%	0.19	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-85	145.6	165.4	0	0	0	0	0	109.1	E75 A82 Q109 M180	A73-E75 PolarHBondContact O-N 2.94Å; A73-A82 HydrophobicContact CB-CB 3.4Å; A73-Q109 PolarHBondContact O-NE2 2.83Å; A73-M180 HydrophobicContact CB-CE 3.53Å; A73-M180 HydrophobicContact CB-CG 3.72Å; A73-M180 HydrophobicContact CB-SD 4.38Å
74	A	60.8	Low	78.2	Confident	99 Å²	99	60 Å²	60	82%	0.818	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-56.9	126.1	174.3	0	0	0	0	0	109.6	G76	A74-G76 PolarHBondContact O-N 2.81Å
75	E	57	Low	78	Confident	173 Å²	173	62.7 Å²	62.7	81%	0.808	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-60.5	129.7	176	-73.9	174.2	167	0	0	109.2	A73	A73-E75 PolarHBondContact O-N 2.94Å
76	G	56	Low	77.8	Confident	23 Å²	23	62.7 Å²	62.7	24%	0.237	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-63.8	159.7	176.5	0	0	0	0	0	111.4	A74 D78 S79	A74-G76 PolarHBondContact O-N 2.81Å; G76-D78 PolarHBondContact O-N 3.4Å; G76-S79 PolarHBondContact O-N 3.08Å
77	P	53.8	Low	77.6	Confident	137 Å²	137	63.9 Å²	63.9	89%	0.89	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-22	-177.1	18.4	-29.7	0	0	0	114.5
78	D	56	Low	77.3	Confident	129 Å²	129	63.9 Å²	63.9	69%	0.69	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	22.8	-178.9	-69.1	-29	0	0	0	114.3	G76 T80	G76-D78 PolarHBondContact O-N 3.4Å; D78-T80 HydrophobicContact CB-CG2 4.12Å; D78-T80 PolarHBondContact O-N 2.81Å
79	S	60.7	Low	77.2	Confident	106 Å²	106	67.8 Å²	67.8	74%	0.741	38%	0.383	S	S	*	.			trans	58.3	14.9	-175.5	68.5	0	0	0	0	115	G76	G76-S79 PolarHBondContact O-N 3.08Å
80	T	66.3	Low	77.1	Confident	71 Å²	71	68.6 Å²	68.6	44%	0.436	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-66.5	133.4	176.4	54.1	0	0	0	0	110.4	D78	D78-T80 HydrophobicContact CB-CG2 4.12Å; D78-T80 PolarHBondContact O-N 2.81Å
81	P	74.6	Confident	77.1	Confident	54 Å²	54	65.7 Å²	65.7	35%	0.351	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-59.8	147.8	178.1	-13.7	23	0	0	0	111.6	P110 I112	P81-P110 HydrophobicContact CB-CB 4.36Å; P81-P110 WeakPolarHBondContact CB-O 3.49Å; P81-I112 HydrophobicContact CB-CD1 4.42Å; P81-I112 HydrophobicContact CB-CG1 4.15Å; P81-I112 HydrophobicContact CG-CD1 4.38Å; P81-I112 HydrophobicContact CG-CG1 4.36Å
82	A	83.8	Confident	77	Confident	20 Å²	20	72.9 Å²	72.9	17%	0.165	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	140.4	-178.5	0	0	0	0	0	111.5	A73 V111 I112 M180	A73-A82 HydrophobicContact CB-CB 3.4Å; A82-V111 HydrophobicContact CB-CG1 4.41Å; A82-V111 CarbonylContact O-C 3.56Å; A82-V111 VanDerWaalsContact O-CA 3.26Å; A82-V111 WeakPolarHBondContact O-CA 3.3Å; A82-V111 WeakPolarHBondContact O-CB 3.35Å; A82-I112 PolarHBondContact O-N 3.28Å; A82-M180 HydrophobicContact CB-CE 3.65Å
83	R	88.2	Confident	77.2	Confident	171 Å²	171	70.6 Å²	70.6	65%	0.645	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	132.9	-179.1	-67.4	176.8	179.1	174	1.1	110.7	I112	R83-I112 WeakPolarHBondContact CA-O 3.06Å; R83-I112 HydrophobicContact CG-CB 4.12Å; R83-I112 HydrophobicContact CG-CD1 4.35Å; R83-I112 HydrophobicContact CG-CG2 4.5Å
84	V	90.3	Very high	78	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.8	177.2	-177.4	0	0	0	0	108.9	L69 V111 I112 W113 N114 M180 I184	L69-V84 HydrophobicContact CD1-CG2 4.24Å; V84-V111 HydrophobicContact CG2-CB 4.36Å; V84-I112 PolarHBondContact N-O 2.74Å; V84-W113 HydrophobicContact CB-CE3 4Å; V84-W113 HydrophobicContact CB-CZ3 4.12Å; V84-W113 HydrophobicContact CG1-CE3 3.9Å; V84-W113 HydrophobicContact CG1-CH2 4.4Å; V84-W113 HydrophobicContact CG1-CZ3 3.62Å; V84-W113 CarbonylContact O-C 3.43Å; V84-W113 WeakPolarHBondContact O-CA 3.44Å; V84-N114 PolarHBondContact O-N 3.32Å; V84-M180 HydrophobicContact CG2-CE 3.73Å; V84-I184 HydrophobicContact CG1-CD1 3.86Å; V84-I184 HydrophobicContact CG1-CG1 4.04Å
85	E	91.6	Very high	79	Confident	58 Å²	58	78.5 Å²	78.5	27%	0.271	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.5	173.9	-60.2	-157.1	150.3	0	0	111.1	H87 N114 K116 Q182 A183 I184	E85-H87 IonicContact OE2-CE1 3.51Å; E85-H87 IonicContact OE2-NE2 2.79Å; E85-H87 PolarHBondContact OE2-NE2 3.12Å; E85-N114 CarbonylContact C-O 3.58Å; E85-N114 WeakPolarHBondContact CA-O 2.99Å; E85-N114 HydrophobicContact CG-CB 4.39Å; E85-K116 IonicContact OE1-NZ 2.72Å; E85-K116 PolarHBondContact OE1-NZ 2.74Å; E85-K116 IonicContact OE2-NZ 3.59Å; E85-K116 PolarHBondContact OE2-NZ 3.45Å; E85-Q182 PolarHBondContact N-O 2.68Å; E85-A183 HydrophobicContact CB-CB 4.26Å; E85-A183 CarbonylContact O-C 3.51Å; E85-A183 VanDerWaalsContact O-CA 3.3Å; E85-A183 WeakPolarHBondContact O-CA 3.29Å; E85-I184 PolarHBondContact O-N 2.76Å
86	L	93	Very high	80.4	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	107.5	174.5	179.6	61.8	0	0	0	109.8	I67 L88 F103 L105 W113 N114 V115 K116 F128 I184 I186	I67-L86 HydrophobicContact CD1-CD1 3.74Å; L86-L88 HydrophobicContact CD1-CD2 4.01Å; L86-L88 HydrophobicContact CD2-CD2 4.14Å; L86-L88 HydrophobicContact CG-CD2 3.79Å; L86-L88 HydrophobicContact CG-CG 4.27Å; L86-F103 HydrophobicContact CD2-CD1 4.48Å; L86-L105 HydrophobicContact CD2-CD1 4.36Å; L86-L105 HydrophobicContact CD2-CD2 4.15Å; L86-W113 HydrophobicContact CB-CE3 4.44Å; L86-N114 PolarHBondContact N-O 3Å; L86-V115 HydrophobicContact CB-CG2 4.3Å; L86-V115 HydrophobicContact CD2-CG2 4.2Å; L86-V115 CarbonylContact O-C 3.5Å; L86-V115 WeakPolarHBondContact O-CA 3.34Å; L86-K116 PolarHBondContact O-N 3.44Å; L86-F128 HydrophobicContact CD2-CE1 4.42Å; L86-I184 HydrophobicContact CD1-CB 4.01Å; L86-I184 HydrophobicContact CD1-CG2 4.05Å; L86-I186 HydrophobicContact CD1-CG1 3.88Å
87	H	92.1	Very high	82	Confident	24 Å²	24	73.8 Å²	73.8	11%	0.111	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.5	179.4	-67.1	-103.8	0	0	0	110.2	E85 K116 I184 Y185 I186	E85-H87 IonicContact OE2-CE1 3.51Å; E85-H87 IonicContact OE2-NE2 2.79Å; E85-H87 PolarHBondContact OE2-NE2 3.12Å; H87-K116 CarbonylContact C-O 3.5Å; H87-K116 WeakPolarHBondContact CA-O 3.44Å; H87-I184 PolarHBondContact N-O 3.27Å; H87-Y185 HydrophobicContact CB-CD1 3.53Å; H87-Y185 HydrophobicContact CB-CE1 3.88Å; H87-Y185 HydrophobicContact CB-CG 4.32Å; H87-Y185 AromaticContact CD2-CE1 3.78Å; H87-Y185 AromaticContact CG-CD1 3.84Å; H87-Y185 AromaticContact CG-CE1 3.62Å; H87-Y185 AromaticContact ND1-CE1 3.99Å; H87-I186 PolarHBondContact O-N 3.3Å
88	L	92.1	Very high	83.7	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.3	-178.9	-54.4	-178.2	0	0	0	109.9	L86 F103 V115 K116 A117 E118 L120 F143 I186	L86-L88 HydrophobicContact CD1-CD2 4.01Å; L86-L88 HydrophobicContact CD2-CD2 4.14Å; L86-L88 HydrophobicContact CG-CD2 3.79Å; L86-L88 HydrophobicContact CG-CG 4.27Å; L88-F103 HydrophobicContact CD1-CE2 3.62Å; L88-F103 HydrophobicContact CD1-CZ 3.65Å; L88-F103 HydrophobicContact CD2-CE1 3.7Å; L88-F103 HydrophobicContact CD2-CE2 4.25Å; L88-F103 HydrophobicContact CD2-CZ 3.43Å; L88-F103 VanDerWaalsContact CD2-CZ 3.43Å; L88-F103 HydrophobicContact CG-CZ 4.17Å; L88-V115 HydrophobicContact CD1-CG1 3.7Å; L88-V115 HydrophobicContact CG-CG1 4.18Å; L88-K116 PolarHBondContact N-O 2.84Å; L88-A117 HydrophobicContact CB-CB 4.29Å; L88-A117 CarbonylContact O-C 3.39Å; L88-A117 WeakPolarHBondContact O-CA 3.18Å; L88-E118 PolarHBondContact O-N 3.11Å; L88-L120 HydrophobicContact CB-CD1 4.5Å; L88-F143 HydrophobicContact CD1-CZ 4.49Å; L88-I186 WeakPolarHBondContact CA-O 3.18Å; L88-I186 HydrophobicContact CD2-CB 3.88Å; L88-I186 HydrophobicContact CD2-CG1 4.43Å; L88-I186 HydrophobicContact CD2-CG2 4.44Å
89	K	91.2	Very high	85.3	Confident	83 Å²	83	69.5 Å²	69.5	36%	0.361	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.2	173	-55.1	-162.2	-174.5	-154.8	0	110.2	E118 I186 K187 V188	K89-E118 WeakPolarHBondContact CE-OE1 3.48Å; K89-E118 WeakPolarHBondContact CE-OE2 3.41Å; K89-E118 HydrophobicContact CG-CB 4.26Å; K89-E118 IonicContact NZ-OE1 2.7Å; K89-E118 PolarHBondContact NZ-OE1 2.88Å; K89-E118 IonicContact NZ-OE2 3.18Å; K89-E118 PolarHBondContact NZ-OE2 3.4Å; K89-I186 PolarHBondContact N-O 2.85Å; K89-I186 VanDerWaalsContact N-O 3.08Å; K89-K187 CarbonylContact O-C 3.59Å; K89-K187 WeakPolarHBondContact O-CA 3.27Å; K89-V188 WeakPolarHBondContact O-CG2 3.41Å; K89-V188 PolarHBondContact O-N 2.99Å
90	P	92.6	Very high	86.8	Confident	16 Å²	16	70.9 Å²	70.9	10%	0.104	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	156	170.7	-20.6	31.6	0	0	0	112.3	V94 H97 E118 N119 V188	P90-V94 HydrophobicContact CB-CB 3.98Å; P90-V94 HydrophobicContact CB-CG1 3.99Å; P90-V94 VanDerWaalsContact CB-O 3.25Å; P90-V94 WeakPolarHBondContact CB-O 3.46Å; P90-H97 HydrophobicContact CB-CB 4.21Å; P90-H97 HydrophobicContact CG-CB 3.91Å; P90-E118 VanDerWaalsContact CD-O 3.22Å; P90-E118 WeakPolarHBondContact CD-O 3.43Å; P90-N119 HydrophobicContact CG-CB 3.89Å; P90-N119 WeakPolarHBondContact CG-O 3.39Å; P90-V188 CarbonylContact C-O 3.55Å; P90-V188 WeakPolarHBondContact CA-O 3.22Å
91	I	89.3	Confident	88.1	Confident	7 Å²	7	67.5 Å²	67.5	4%	0.036	31%	0.314	C	S	.	.			trans	-61.1	155.2	164	58	173.7	0	0	0	110.5	S93 V94 K187 V188	I91-S93 WeakPolarHBondContact CD1-OG 3.26Å; I91-S93 WeakPolarHBondContact CG1-OG 3.23Å; I91-S93 PolarHBondContact O-N 3.06Å; I91-V94 HydrophobicContact CD1-CG2 4.18Å; I91-V94 HydrophobicContact CG1-CB 4.19Å; I91-V94 HydrophobicContact CG1-CG2 3.76Å; I91-V94 PolarHBondContact O-N 2.97Å; I91-V94 VanDerWaalsContact O-O 3.12Å; I91-K187 HydrophobicContact CG2-CB 3.81Å; I91-V188 PolarHBondContact N-O 2.83Å
92	Q	82.5	Confident	89.1	Confident	186 Å²	186	65.2 Å²	65.2	87%	0.869	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.4	-172.7	-71.8	178	-21.1	0	0	114.4	V94	Q92-V94 VanDerWaalsContact C-N 3.25Å; Q92-V94 PolarHBondContact O-N 3.3Å
93	S	81	Confident	89.7	Confident	102 Å²	102	64.2 Å²	64.2	71%	0.713	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.4	176.3	52.3	0	0	0	0	113.7	I91	I91-S93 WeakPolarHBondContact CD1-OG 3.26Å; I91-S93 WeakPolarHBondContact CG1-OG 3.23Å; I91-S93 PolarHBondContact O-N 3.06Å
94	V	85.1	Confident	90.1	Very high	48 Å²	48	56.1 Å²	56.1	29%	0.291	26%	0.261	S	S	.	.			trans	-117.2	117	-175.1	178.7	0	0	0	0	109.2	P90 I91 Q92 Q96 H97	P90-V94 HydrophobicContact CB-CB 3.98Å; P90-V94 HydrophobicContact CB-CG1 3.99Å; P90-V94 VanDerWaalsContact CB-O 3.25Å; P90-V94 WeakPolarHBondContact CB-O 3.46Å; I91-V94 HydrophobicContact CD1-CG2 4.18Å; I91-V94 HydrophobicContact CG1-CB 4.19Å; I91-V94 HydrophobicContact CG1-CG2 3.76Å; I91-V94 PolarHBondContact O-N 2.97Å; I91-V94 VanDerWaalsContact O-O 3.12Å; Q92-V94 VanDerWaalsContact C-N 3.25Å; Q92-V94 PolarHBondContact O-N 3.3Å; V94-Q96 WeakPolarHBondContact CG1-O 3.46Å; V94-H97 HydrophobicContact CG1-CB 4.3Å
95	R	81.5	Confident	90.4	Very high	239 Å²	239	56.1 Å²	56.1	90%	0.902	26%	0.261	S	S	*	.	S	Bend	trans	-74.5	-41.9	178.2	-70.7	-168	179.4	-164.8	-0.1	113.1
96	Q	87.1	Confident	90.5	Very high	91 Å²	91	53.3 Å²	53.3	43%	0.425	25%	0.248	S	C	.	.	S	Bend	trans	-138	125.6	174.7	-170.5	179.9	25.8	0	0	108.5	V94 N119 A121	V94-Q96 WeakPolarHBondContact CG1-O 3.46Å; Q96-N119 CarbonylContact C-O 3.57Å; Q96-N119 VanDerWaalsContact CA-O 3.28Å; Q96-N119 WeakPolarHBondContact CA-O 3.4Å; Q96-N119 WeakPolarHBondContact CG-O 3.34Å; Q96-A121 HydrophobicContact CG-CB 4.22Å
97	H	90.4	Very high	90.5	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.028	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-83.3	128.9	-178.3	-175.1	-70.4	0	0	0	110.6	E63 P90 V94 K99 L101 N119 L120 A121 V188	E63-H97 VanDerWaalsContact CD-NE2 3.26Å; E63-H97 IonicContact OE1-CD2 3.19Å; E63-H97 IonicContact OE1-CE1 3.28Å; E63-H97 PolarHBondContact OE1-CE1 3.37Å; E63-H97 IonicContact OE1-NE2 2.74Å; E63-H97 PolarHBondContact OE1-NE2 3.44Å; E63-H97 IonicContact OE2-NE2 3.05Å; E63-H97 PolarHBondContact OE2-NE2 3.33Å; P90-H97 HydrophobicContact CB-CB 4.21Å; P90-H97 HydrophobicContact CG-CB 3.91Å; V94-H97 HydrophobicContact CG1-CB 4.3Å; H97-K99 PolarHBondContact CE1-N 3.35Å; H97-K99 PolarHBondContact CE1-O 2.99Å; H97-K99 PolarHBondContact ND1-N 2.74Å; H97-K99 PolarHBondContact ND1-O 3.01Å; H97-L101 WeakPolarHBondContact CE1-CD2 3.39Å; H97-N119 PolarHBondContact N-O 2.03Å; H97-L120 HydrophobicContact CB-CG 4.4Å; H97-A121 WeakPolarHBondContact O-CB 3.49Å; H97-A121 PolarHBondContact O-N 3.44Å; H97-V188 HydrophobicContact CB-CG2 4.04Å; H97-V188 VanDerWaalsContact CD2-CG2 3.45Å; H97-V188 WeakPolarHBondContact CD2-CG2 3.22Å
98	Q	88.8	Confident	90.5	Very high	138 Å²	138	54.9 Å²	54.9	65%	0.645	26%	0.26	S	S	*	.			trans	-124.4	10.8	-171.2	-64.2	-177	-0.8	0	0	113.8	A121 I124	Q98-A121 HydrophobicContact CB-CB 4.49Å; Q98-A121 HydrophobicContact CG-CB 3.83Å; Q98-I124 VanDerWaalsContact CA-CD1 3.45Å; Q98-I124 HydrophobicContact CB-CD1 4.23Å; Q98-I124 VanDerWaalsContact O-CD1 3.23Å; Q98-I124 WeakPolarHBondContact O-CD1 3.39Å
99	K	90.3	Very high	90.4	Very high	39 Å²	39	56.4 Å²	56.4	17%	0.17	27%	0.267	C	S	.	.	S	Bend	trans	-100.4	151.2	-178.5	-167.3	165.2	176.6	177.7	0	110.4	T57 L60 E63 H97 L101 E190	T57-K99 PolarHBondContact O-NZ 3.04Å; L60-K99 WeakPolarHBondContact O-CE 3.32Å; L60-K99 PolarHBondContact O-NZ 2.78Å; E63-K99 HydrophobicContact CG-CD 4.05Å; H97-K99 PolarHBondContact CE1-N 3.35Å; H97-K99 PolarHBondContact CE1-O 2.99Å; H97-K99 PolarHBondContact ND1-N 2.74Å; H97-K99 PolarHBondContact ND1-O 3.01Å; K99-L101 PolarHBondContact O-N 2.91Å; K99-E190 WeakPolarHBondContact CE-OE1 3.39Å; K99-E190 IonicContact NZ-OE1 3.67Å; K99-E190 PolarHBondContact NZ-OE1 3.12Å; K99-E190 IonicContact NZ-OE2 3.66Å
100	R	91.5	Very high	90.3	Very high	134 Å²	134	55.4 Å²	55.4	51%	0.506	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	136	176.8	-66.3	-176.8	-175.7	-171.9	-0.5	109.3	Q62 E63 I124 H125	Q62-R100 CarbonylContact C-O 3.59Å; Q62-R100 VanDerWaalsContact CA-O 3.24Å; Q62-R100 WeakPolarHBondContact CA-O 3.1Å; Q62-R100 HydrophobicContact CB-CB 3.95Å; Q62-R100 WeakPolarHBondContact CB-O 3.44Å; E63-R100 PolarHBondContact N-O 3.17Å; R100-I124 HydrophobicContact CB-CG2 4.45Å; R100-I124 HydrophobicContact CG-CG2 3.87Å; R100-H125 WeakPolarHBondContact CG-O 3.48Å
101	L	93.5	Very high	90.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.3	-179.1	-59.9	172.5	0	0	0	109.8	E63 H97 K99 F103 L120 H126 T127 V188	E63-L101 HydrophobicContact CB-CD2 3.93Å; H97-L101 WeakPolarHBondContact CE1-CD2 3.39Å; K99-L101 PolarHBondContact O-N 2.91Å; L101-F103 HydrophobicContact CB-CD2 4.29Å; L101-F103 HydrophobicContact CB-CE2 3.73Å; L101-F103 HydrophobicContact CB-CZ 4.48Å; L101-F103 HydrophobicContact CD1-CE2 3.94Å; L101-F103 HydrophobicContact CD1-CZ 4.27Å; L101-F103 HydrophobicContact CG-CE2 4.4Å; L101-L120 HydrophobicContact CD1-CD2 3.42Å; L101-L120 VanDerWaalsContact CD1-CD2 3.42Å; L101-L120 HydrophobicContact CD1-CG 4.41Å; L101-H126 WeakPolarHBondContact CB-ND1 3.22Å; L101-H126 PolarHBondContact N-ND1 2.88Å; L101-H126 CarbonylContact O-C 3.58Å; L101-H126 VanDerWaalsContact O-CA 3.3Å; L101-H126 WeakPolarHBondContact O-CA 3.22Å; L101-T127 PolarHBondContact O-N 3.45Å; L101-V188 HydrophobicContact CD1-CB 4.39Å; L101-V188 HydrophobicContact CD1-CG1 4.01Å; L101-V188 HydrophobicContact CD1-CG2 4.34Å; L101-V188 HydrophobicContact CD2-CB 4Å; L101-V188 HydrophobicContact CD2-CG1 4.02Å
102	V	95.6	Very high	90.4	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.03	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.7	170.4	-179	0	0	0	0	108.1	Q62 E63 V64 H65 T127 Y169	Q62-V102 HydrophobicContact CB-CG2 4.19Å; Q62-V102 HydrophobicContact CG-CG2 4.09Å; E63-V102 WeakPolarHBondContact O-CB 3.49Å; E63-V102 PolarHBondContact O-N 3.44Å; V64-V102 CarbonylContact C-O 3.48Å; V64-V102 WeakPolarHBondContact CA-O 3.21Å; V64-V102 HydrophobicContact CG2-CB 4.19Å; H65-V102 PolarHBondContact N-O 2.81Å; V102-T127 CarbonylContact C-O 3.54Å; V102-T127 VanDerWaalsContact CA-O 3.32Å; V102-T127 WeakPolarHBondContact CA-O 3.44Å; V102-Y169 HydrophobicContact CG1-CD2 4.29Å; V102-Y169 HydrophobicContact CG1-CE1 4.21Å; V102-Y169 HydrophobicContact CG1-CE2 3.67Å; V102-Y169 HydrophobicContact CG2-CD1 4.4Å; V102-Y169 HydrophobicContact CG2-CE1 3.94Å
103	F	96.1	Very high	90.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.8	172.6	-71.5	-82	0	0	0	109.9	H65 L86 L88 L101 L105 T127 F128 H129 I186 V188	H65-F103 HydrophobicContact CB-CD1 3.69Å; H65-F103 HydrophobicContact CB-CE1 3.63Å; H65-F103 AromaticContact CD2-CE1 3.95Å; H65-F103 AromaticContact CG-CE1 3.99Å; H65-F103 CarbonylContact O-C 3.59Å; H65-F103 WeakPolarHBondContact O-CA 3.34Å; L86-F103 HydrophobicContact CD2-CD1 4.48Å; L88-F103 HydrophobicContact CD1-CE2 3.62Å; L88-F103 HydrophobicContact CD1-CZ 3.65Å; L88-F103 HydrophobicContact CD2-CE1 3.7Å; L88-F103 HydrophobicContact CD2-CE2 4.25Å; L88-F103 HydrophobicContact CD2-CZ 3.43Å; L88-F103 VanDerWaalsContact CD2-CZ 3.43Å; L88-F103 HydrophobicContact CG-CZ 4.17Å; L101-F103 HydrophobicContact CB-CD2 4.29Å; L101-F103 HydrophobicContact CB-CE2 3.73Å; L101-F103 HydrophobicContact CB-CZ 4.48Å; L101-F103 HydrophobicContact CD1-CE2 3.94Å; L101-F103 HydrophobicContact CD1-CZ 4.27Å; L101-F103 HydrophobicContact CG-CE2 4.4Å; F103-L105 HydrophobicContact CB-CD2 4.02Å; F103-L105 HydrophobicContact CB-CG 4.15Å; F103-T127 PolarHBondContact N-O 3.09Å; F103-F128 HydrophobicContact CB-CD1 3.56Å; F103-F128 HydrophobicContact CB-CE1 3.8Å; F103-F128 HydrophobicContact CB-CG 4.44Å; F103-F128 AromaticContact CD2-CD1 3.98Å; F103-F128 HydrophobicContact CD2-CD1 3.98Å; F103-F128 AromaticContact CD2-CE1 3.37Å; F103-F128 HydrophobicContact CD2-CE1 3.37Å; F103-F128 AromaticContact CD2-CZ 3.77Å; F103-F128 HydrophobicContact CD2-CZ 3.77Å; F103-F128 HydrophobicContact CE2-CE1 4.17Å; F103-F128 HydrophobicContact CE2-CZ 4.28Å; F103-F128 HydrophobicContact CG-CD1 4.06Å; F103-F128 AromaticContact CG-CE1 3.74Å; F103-F128 HydrophobicContact CG-CE1 3.74Å; F103-F128 WeakPolarHBondContact O-CA 3.03Å; F103-H129 PolarHBondContact O-N 3.49Å; F103-I186 HydrophobicContact CE1-CG2 4.29Å; F103-V188 HydrophobicContact CZ-CG1 4.03Å
104	V	96.7	Very high	91.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	103.8	171	-175	0	0	0	0	106.8	H65 V66 I67 H129 L154 L161 W164	H65-V104 PolarHBondContact O-N 3.24Å; V66-V104 HydrophobicContact CB-CB 4.41Å; V66-V104 HydrophobicContact CG1-CB 4.19Å; V66-V104 HydrophobicContact CG1-CG1 4.37Å; V66-V104 HydrophobicContact CG2-CB 4.12Å; V66-V104 HydrophobicContact CG2-CG2 4.22Å; I67-V104 PolarHBondContact N-O 2.85Å; V104-H129 HydrophobicContact CG1-CB 4.46Å; V104-L154 HydrophobicContact CG1-CD1 3.91Å; V104-L154 HydrophobicContact CG1-CD2 3.9Å; V104-L161 HydrophobicContact CG1-CD1 4.07Å; V104-W164 HydrophobicContact CB-CZ3 4.46Å; V104-W164 HydrophobicContact CG1-CE3 4.24Å; V104-W164 HydrophobicContact CG1-CZ3 3.79Å; V104-W164 HydrophobicContact CG2-CZ3 3.76Å
105	L	95.9	Very high	91.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	91.7	-171.7	-55.2	-176.3	0	0	0	109.2	I67 L86 F103 W113 F128 H129 V130 S131	I67-L105 HydrophobicContact CB-CD2 4.11Å; I67-L105 HydrophobicContact CD1-CD2 3.72Å; I67-L105 HydrophobicContact CG1-CD2 4.19Å; L86-L105 HydrophobicContact CD2-CD1 4.36Å; L86-L105 HydrophobicContact CD2-CD2 4.15Å; F103-L105 HydrophobicContact CB-CD2 4.02Å; F103-L105 HydrophobicContact CB-CG 4.15Å; L105-W113 HydrophobicContact CB-CD2 4.32Å; L105-W113 HydrophobicContact CB-CH2 4.31Å; L105-W113 HydrophobicContact CB-CZ2 3.72Å; L105-W113 HydrophobicContact CD1-CB 4.31Å; L105-W113 HydrophobicContact CD1-CD2 3.7Å; L105-W113 HydrophobicContact CD1-CE3 4.1Å; L105-W113 HydrophobicContact CD1-CG 3.79Å; L105-W113 HydrophobicContact CD2-CH2 4.39Å; L105-W113 HydrophobicContact CD2-CZ3 4.39Å; L105-W113 HydrophobicContact CG-CD2 4.48Å; L105-F128 HydrophobicContact CD1-CD1 3.87Å; L105-H129 PolarHBondContact N-O 2.75Å; L105-V130 HydrophobicContact CB-CG1 4.18Å; L105-V130 HydrophobicContact CD1-CG1 4.11Å; L105-S131 PolarHBondContact O-N 3.07Å; L105-S131 PolarHBondContact O-OG 3.34Å
106	N	95.4	Very high	91.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	132	179.4	-169.4	48.1	0	0	0	111.5	I67 N68 L69 S131 L154 P155 Q156 L161	I67-N106 PolarHBondContact O-N 3.02Å; N68-N106 PolarHBondContact OD1-ND2 2.86Å; L69-N106 PolarHBondContact N-O 3Å; N106-S131 WeakPolarHBondContact CA-OG 3.42Å; N106-S131 PolarHBondContact OD1-OG 2.99Å; N106-S131 VanDerWaalsContact OD1-OG 3.14Å; N106-L154 HydrophobicContact CB-CB 4.32Å; N106-L154 HydrophobicContact CB-CD1 4.01Å; N106-L154 WeakPolarHBondContact OD1-CB 3.39Å; N106-P155 PolarHBondContact ND2-O 3.46Å; N106-Q156 PolarHBondContact ND2-NE2 2.92Å; N106-Q156 PolarHBondContact ND2-OE1 2.9Å; N106-Q156 PolarHBondContact OD1-NE2 2.87Å; N106-L161 HydrophobicContact CB-CD1 4.39Å; N106-L161 HydrophobicContact CB-CD2 3.66Å
107	S	93.1	Very high	91.9	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.021	13%	0.133	C	C	.	.			trans	-140.4	149.5	174.4	58.7	0	0	0	0	110.6	Q109 S131 Q156	S107-Q109 VanDerWaalsContact C-N 3.32Å; S107-Q109 VanDerWaalsContact CB-O 3.32Å; S107-Q109 WeakPolarHBondContact CB-O 3.18Å; S107-Q109 PolarHBondContact OG-O 2.86Å; S107-S131 PolarHBondContact N-OG 2.95Å; S107-S131 PolarHBondContact O-OG 3.43Å; S107-Q156 PolarHBondContact O-NE2 2.76Å
108	P	90.8	Very high	91.7	Very high	54 Å²	54	30.8 Å²	30.8	35%	0.351	15%	0.149	S	C	.	.	S	Bend	trans	-77.2	-21.8	178.9	30	-34.3	0	0	0	112.5	L69 G71	L69-P108 WeakPolarHBondContact O-CD 3.44Å; G71-P108 WeakPolarHBondContact O-CG 2.97Å
109	Q	89.6	Confident	91.5	Very high	33 Å²	33	29.2 Å²	29.2	15%	0.154	15%	0.145	C	C	.	.	S	Bend	trans	-127.4	158.1	175.3	67.3	-174	40.5	0	0	110.1	H72 A73 S107 V111	H72-Q109 VanDerWaalsContact CB-OE1 3.28Å; H72-Q109 PolarHBondContact CD2-OE1 2.96Å; H72-Q109 VanDerWaalsContact CD2-OE1 3.24Å; A73-Q109 PolarHBondContact O-NE2 2.83Å; S107-Q109 VanDerWaalsContact C-N 3.32Å; S107-Q109 VanDerWaalsContact CB-O 3.32Å; S107-Q109 WeakPolarHBondContact CB-O 3.18Å; S107-Q109 PolarHBondContact OG-O 2.86Å; Q109-V111 HydrophobicContact CG-CG1 4.34Å; Q109-V111 PolarHBondContact O-N 3Å
110	P	90.3	Very high	91.2	Very high	62 Å²	62	28.3 Å²	28.3	40%	0.403	14%	0.142	S	C	.	.			trans	-56.1	133.4	172.7	-27.4	37.2	0	0	0	111.9	P81 G133	P81-P110 HydrophobicContact CB-CB 4.36Å; P81-P110 WeakPolarHBondContact CB-O 3.49Å; P110-G133 WeakPolarHBondContact CB-O 3.41Å
111	V	91.3	Very high	90.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.8	177.1	-60.1	0	0	0	0	110.9	A82 V84 Q109 W113 S134 E135 M180	A82-V111 HydrophobicContact CB-CG1 4.41Å; A82-V111 CarbonylContact O-C 3.56Å; A82-V111 VanDerWaalsContact O-CA 3.26Å; A82-V111 WeakPolarHBondContact O-CA 3.3Å; A82-V111 WeakPolarHBondContact O-CB 3.35Å; V84-V111 HydrophobicContact CG2-CB 4.36Å; Q109-V111 HydrophobicContact CG-CG1 4.34Å; Q109-V111 PolarHBondContact O-N 3Å; V111-W113 HydrophobicContact CG2-CD2 4.16Å; V111-W113 VanDerWaalsContact CG2-CE2 3.43Å; V111-W113 HydrophobicContact CG2-CG 4.36Å; V111-W113 HydrophobicContact CG2-CZ2 3.81Å; V111-S134 PolarHBondContact N-OG 3.29Å; V111-S134 VanDerWaalsContact O-CA 3.23Å; V111-S134 WeakPolarHBondContact O-CA 3.42Å; V111-S134 VanDerWaalsContact O-CB 3.25Å; V111-S134 WeakPolarHBondContact O-CB 3.27Å; V111-E135 PolarHBondContact O-N 2.81Å; V111-M180 HydrophobicContact CG1-CE 3.66Å; V111-M180 HydrophobicContact CG1-SD 4.49Å
112	I	91.6	Very high	89.7	Confident	16 Å²	16	25.3 Å²	25.3	8%	0.082	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	113.2	173.6	-60.6	167.6	0	0	0	108.1	P81 A82 R83 V84 L137	P81-I112 HydrophobicContact CB-CD1 4.42Å; P81-I112 HydrophobicContact CB-CG1 4.15Å; P81-I112 HydrophobicContact CG-CD1 4.38Å; P81-I112 HydrophobicContact CG-CG1 4.36Å; A82-I112 PolarHBondContact O-N 3.28Å; R83-I112 WeakPolarHBondContact CA-O 3.06Å; R83-I112 HydrophobicContact CG-CB 4.12Å; R83-I112 HydrophobicContact CG-CD1 4.35Å; R83-I112 HydrophobicContact CG-CG2 4.5Å; V84-I112 PolarHBondContact N-O 2.74Å; I112-L137 HydrophobicContact CG2-CD1 3.5Å; I112-L137 VanDerWaalsContact CG2-CD1 3.5Å; I112-L137 HydrophobicContact CG2-CG 3.81Å
113	W	91.8	Very high	88.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	105.4	179.4	-65.4	98.1	0	0	0	111	I67 L69 V84 L86 L105 V111 V115 E135 V136 L137 I184	I67-W113 HydrophobicContact CG2-CH2 4.2Å; L69-W113 HydrophobicContact CD1-CH2 3.4Å; L69-W113 HydrophobicContact CD1-CZ2 3.74Å; L69-W113 HydrophobicContact CD1-CZ3 4.29Å; L69-W113 HydrophobicContact CG-CH2 3.88Å; L69-W113 HydrophobicContact CG-CZ2 4.37Å; V84-W113 HydrophobicContact CB-CE3 4Å; V84-W113 HydrophobicContact CB-CZ3 4.12Å; V84-W113 HydrophobicContact CG1-CE3 3.9Å; V84-W113 HydrophobicContact CG1-CH2 4.4Å; V84-W113 HydrophobicContact CG1-CZ3 3.62Å; V84-W113 CarbonylContact O-C 3.43Å; V84-W113 WeakPolarHBondContact O-CA 3.44Å; L86-W113 HydrophobicContact CB-CE3 4.44Å; L105-W113 HydrophobicContact CB-CD2 4.32Å; L105-W113 HydrophobicContact CB-CH2 4.31Å; L105-W113 HydrophobicContact CB-CZ2 3.72Å; L105-W113 HydrophobicContact CD1-CB 4.31Å; L105-W113 HydrophobicContact CD1-CD2 3.7Å; L105-W113 HydrophobicContact CD1-CE3 4.1Å; L105-W113 HydrophobicContact CD1-CG 3.79Å; L105-W113 HydrophobicContact CD2-CH2 4.39Å; L105-W113 HydrophobicContact CD2-CZ3 4.39Å; L105-W113 HydrophobicContact CG-CD2 4.48Å; V111-W113 HydrophobicContact CG2-CD2 4.16Å; V111-W113 VanDerWaalsContact CG2-CE2 3.43Å; V111-W113 HydrophobicContact CG2-CG 4.36Å; V111-W113 HydrophobicContact CG2-CZ2 3.81Å; W113-V115 PolarHBondContact O-N 3.05Å; W113-E135 WeakPolarHBondContact CB-O 3.44Å; W113-E135 PolarHBondContact N-O 2.03Å; W113-V136 HydrophobicContact CB-CB 4.48Å; W113-V136 HydrophobicContact CB-CG1 4.34Å; W113-V136 HydrophobicContact CB-CG2 4.22Å; W113-V136 CarbonylContact O-C 3.56Å; W113-V136 WeakPolarHBondContact O-CA 3.44Å; W113-L137 PolarHBondContact O-N 3Å; W113-I184 HydrophobicContact CH2-CD1 4.11Å; W113-I184 HydrophobicContact CZ3-CD1 3.69Å
114	N	91.4	Very high	87.8	Confident	19 Å²	19	33 Å²	33	10%	0.102	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	97.9	174.9	-75.4	-12.8	0	0	0	110.1	V84 E85 L86 L137	V84-N114 PolarHBondContact O-N 3.32Å; E85-N114 CarbonylContact C-O 3.58Å; E85-N114 WeakPolarHBondContact CA-O 2.99Å; E85-N114 HydrophobicContact CG-CB 4.39Å; L86-N114 PolarHBondContact N-O 3Å; N114-L137 WeakPolarHBondContact OD1-CB 3.02Å; N114-L137 WeakPolarHBondContact OD1-CD1 3.26Å
115	V	90.1	Very high	87.1	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	123.4	-176.7	-174	0	0	0	0	110.5	L86 L88 W113 F128 V136 L137 L138 F143	L86-V115 HydrophobicContact CB-CG2 4.3Å; L86-V115 HydrophobicContact CD2-CG2 4.2Å; L86-V115 CarbonylContact O-C 3.5Å; L86-V115 WeakPolarHBondContact O-CA 3.34Å; L88-V115 HydrophobicContact CD1-CG1 3.7Å; L88-V115 HydrophobicContact CG-CG1 4.18Å; W113-V115 PolarHBondContact O-N 3.05Å; V115-F128 HydrophobicContact CG1-CZ 4.24Å; V115-F128 HydrophobicContact CG2-CE1 4.12Å; V115-F128 HydrophobicContact CG2-CZ 4.35Å; V115-V136 HydrophobicContact CG2-CG1 3.52Å; V115-L137 PolarHBondContact N-O 2.95Å; V115-L138 HydrophobicContact CB-CD2 3.65Å; V115-L138 HydrophobicContact CG1-CD2 4.02Å; V115-L138 HydrophobicContact CG2-CD2 4.09Å; V115-F143 HydrophobicContact CG1-CE1 4.36Å
116	K	88.9	Confident	86.8	Confident	57 Å²	57	37.8 Å²	37.8	25%	0.248	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	112.8	173	-66.1	175.6	-175.6	168	0	108.1	E85 L86 H87 L88	E85-K116 IonicContact OE1-NZ 2.72Å; E85-K116 PolarHBondContact OE1-NZ 2.74Å; E85-K116 IonicContact OE2-NZ 3.59Å; E85-K116 PolarHBondContact OE2-NZ 3.45Å; L86-K116 PolarHBondContact O-N 3.44Å; H87-K116 CarbonylContact C-O 3.5Å; H87-K116 WeakPolarHBondContact CA-O 3.44Å; L88-K116 PolarHBondContact N-O 2.84Å
117	A	87.5	Confident	86.7	Confident	3 Å²	3	39 Å²	39	3%	0.025	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.1	178.9	0	0	0	0	0	110.7	L88 L120 Q140 F143	L88-A117 HydrophobicContact CB-CB 4.29Å; L88-A117 CarbonylContact O-C 3.39Å; L88-A117 WeakPolarHBondContact O-CA 3.18Å; A117-L120 HydrophobicContact CB-CD1 4.21Å; A117-L120 HydrophobicContact CB-CD2 4.12Å; A117-Q140 PolarHBondContact O-NE2 2.03Å; A117-Q140 PolarHBondContact O-OE1 2.92Å; A117-F143 HydrophobicContact CB-CD2 4.19Å; A117-F143 HydrophobicContact CB-CE2 4.09Å; A117-F143 HydrophobicContact CB-CZ 4.36Å
118	E	85.8	Confident	86.7	Confident	80 Å²	80	38.8 Å²	38.8	37%	0.374	20%	0.204	S	C	.	.			trans	-130.7	139.1	173.7	-65.8	176.5	-151.7	0	0	109.4	L88 K89 P90 L120	L88-E118 PolarHBondContact O-N 3.11Å; K89-E118 WeakPolarHBondContact CE-OE1 3.48Å; K89-E118 WeakPolarHBondContact CE-OE2 3.41Å; K89-E118 HydrophobicContact CG-CB 4.26Å; K89-E118 IonicContact NZ-OE1 2.7Å; K89-E118 PolarHBondContact NZ-OE1 2.88Å; K89-E118 IonicContact NZ-OE2 3.18Å; K89-E118 PolarHBondContact NZ-OE2 3.4Å; P90-E118 VanDerWaalsContact CD-O 3.22Å; P90-E118 WeakPolarHBondContact CD-O 3.43Å; E118-L120 WeakPolarHBondContact O-CD1 3.29Å; E118-L120 PolarHBondContact O-N 2.99Å
119	N	84.2	Confident	86.9	Confident	105 Å²	105	36.2 Å²	36.2	56%	0.561	19%	0.187	S	C	*	.	S	Bend	trans	56.1	30.1	177.6	-57.7	-39.5	0	0	0	114.6	P90 Q96 H97	P90-N119 HydrophobicContact CG-CB 3.89Å; P90-N119 WeakPolarHBondContact CG-O 3.39Å; Q96-N119 CarbonylContact C-O 3.57Å; Q96-N119 VanDerWaalsContact CA-O 3.28Å; Q96-N119 WeakPolarHBondContact CA-O 3.4Å; Q96-N119 WeakPolarHBondContact CG-O 3.34Å; H97-N119 PolarHBondContact N-O 2.03Å
120	L	84.8	Confident	87.2	Confident	19 Å²	19	34.7 Å²	34.7	10%	0.099	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-92.6	140.3	164.7	-79.1	68.4	0	0	0	108.4	L88 H97 L101 A117 E118 F143 V188	L88-L120 HydrophobicContact CB-CD1 4.5Å; H97-L120 HydrophobicContact CB-CG 4.4Å; L101-L120 HydrophobicContact CD1-CD2 3.42Å; L101-L120 VanDerWaalsContact CD1-CD2 3.42Å; L101-L120 HydrophobicContact CD1-CG 4.41Å; A117-L120 HydrophobicContact CB-CD1 4.21Å; A117-L120 HydrophobicContact CB-CD2 4.12Å; E118-L120 WeakPolarHBondContact O-CD1 3.29Å; E118-L120 PolarHBondContact O-N 2.99Å; L120-F143 HydrophobicContact CB-CE2 4.37Å; L120-F143 HydrophobicContact CD2-CE2 3.58Å; L120-F143 HydrophobicContact CD2-CZ 4.11Å; L120-V188 HydrophobicContact CD1-CG2 4.38Å
121	A	80.2	Confident	87.3	Confident	11 Å²	11	32.1 Å²	32.1	9%	0.091	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-68.2	131.3	180	0	0	0	0	0	111.3	Q96 H97 Q98 I124	Q96-A121 HydrophobicContact CG-CB 4.22Å; H97-A121 WeakPolarHBondContact O-CB 3.49Å; H97-A121 PolarHBondContact O-N 3.44Å; Q98-A121 HydrophobicContact CB-CB 4.49Å; Q98-A121 HydrophobicContact CG-CB 3.83Å; A121-I124 HydrophobicContact CB-CD1 3.64Å; A121-I124 HydrophobicContact CB-CG1 4.35Å
122	P	72.4	Confident	87.2	Confident	62 Å²	62	37 Å²	37	40%	0.403	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	157.1	179.4	29.3	-34.6	0	0	0	110.6	I124 N142	P122-I124 VanDerWaalsContact C-N 3.28Å; P122-I124 PolarHBondContact O-N 2.86Å; P122-N142 HydrophobicContact CB-CB 4.27Å
123	F	73	Confident	87	Confident	134 Å²	134	38.2 Å²	38.2	59%	0.588	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	9.1	177.9	-45.7	-75	0	0	0	116.7	N146	F123-N146 PolarHBondContact O-ND2 3.44Å
124	I	79.8	Confident	86.9	Confident	32 Å²	32	38.3 Å²	38.3	16%	0.164	21%	0.206	C	C	.	.			trans	-83.5	136	171.7	-62.1	179.9	0	0	0	109.9	Q98 R100 A121 P122 H126	Q98-I124 VanDerWaalsContact CA-CD1 3.45Å; Q98-I124 HydrophobicContact CB-CD1 4.23Å; Q98-I124 VanDerWaalsContact O-CD1 3.23Å; Q98-I124 WeakPolarHBondContact O-CD1 3.39Å; R100-I124 HydrophobicContact CB-CG2 4.45Å; R100-I124 HydrophobicContact CG-CG2 3.87Å; A121-I124 HydrophobicContact CB-CD1 3.64Å; A121-I124 HydrophobicContact CB-CG1 4.35Å; P122-I124 VanDerWaalsContact C-N 3.28Å; P122-I124 PolarHBondContact O-N 2.86Å; I124-H126 PolarHBondContact O-CD2 2.79Å; I124-H126 PolarHBondContact O-N 2.85Å
125	H	81.9	Confident	86.8	Confident	98 Å²	98	43 Å²	43	45%	0.454	23%	0.227	S	C	.	.			trans	-73.9	115.5	174.9	-70.2	-70.5	0	0	0	111.1	R100 N146	R100-H125 WeakPolarHBondContact CG-O 3.48Å; H125-N146 WeakPolarHBondContact CA-O 3.49Å; H125-N146 PolarHBondContact CE1-ND2 3.27Å; H125-N146 PolarHBondContact ND1-O 2.97Å
126	H	89.4	Confident	86.8	Confident	3 Å²	3	43.6 Å²	43.6	1%	0.014	23%	0.231	C	C	.	.			trans	-110.1	149.3	173.3	-54.1	-71.3	0	0	0	110.2	L101 I124 F128 F143 T147 Q148	L101-H126 WeakPolarHBondContact CB-ND1 3.22Å; L101-H126 PolarHBondContact N-ND1 2.88Å; L101-H126 CarbonylContact O-C 3.58Å; L101-H126 VanDerWaalsContact O-CA 3.3Å; L101-H126 WeakPolarHBondContact O-CA 3.22Å; I124-H126 PolarHBondContact O-CD2 2.79Å; I124-H126 PolarHBondContact O-N 2.85Å; H126-F128 HydrophobicContact CB-CE2 4.35Å; H126-F143 HydrophobicContact CB-CZ 4.33Å; H126-F143 AromaticContact CD2-CD2 3.91Å; H126-F143 AromaticContact CD2-CE2 3.22Å; H126-F143 WeakPolarHBondContact CD2-CE2 3.33Å; H126-F143 AromaticContact CD2-CZ 3.52Å; H126-F143 AromaticContact CG-CZ 3.94Å; H126-F143 AromaticContact NE2-CE2 3.38Å; H126-F143 WeakPolarHBondContact NE2-CE2 2.95Å; H126-T147 HydrophobicContact CB-CG2 4.03Å; H126-T147 CarbonylContact O-C 3.55Å; H126-T147 WeakPolarHBondContact O-CA 3.49Å; H126-Q148 PolarHBondContact O-N 3.22Å
127	T	92.3	Very high	86.7	Confident	24 Å²	24	44.9 Å²	44.9	15%	0.147	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.7	-178.7	-51.6	0	0	0	0	110.6	L101 V102 F103 H129 Q148	L101-T127 PolarHBondContact O-N 3.45Å; V102-T127 CarbonylContact C-O 3.54Å; V102-T127 VanDerWaalsContact CA-O 3.32Å; V102-T127 WeakPolarHBondContact CA-O 3.44Å; F103-T127 PolarHBondContact N-O 3.09Å; T127-H129 WeakPolarHBondContact CG2-NE2 3.44Å; T127-Q148 CarbonylContact C-O 3.52Å; T127-Q148 VanDerWaalsContact CA-O 3.3Å; T127-Q148 WeakPolarHBondContact CA-O 3.35Å
128	F	93.7	Very high	86.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	116	174.4	-67.1	-90	0	0	0	109.2	L86 F103 L105 V115 H126 V136 L138 F143 T147 Q148 I149 Q150	L86-F128 HydrophobicContact CD2-CE1 4.42Å; F103-F128 HydrophobicContact CB-CD1 3.56Å; F103-F128 HydrophobicContact CB-CE1 3.8Å; F103-F128 HydrophobicContact CB-CG 4.44Å; F103-F128 AromaticContact CD2-CD1 3.98Å; F103-F128 HydrophobicContact CD2-CD1 3.98Å; F103-F128 AromaticContact CD2-CE1 3.37Å; F103-F128 HydrophobicContact CD2-CE1 3.37Å; F103-F128 AromaticContact CD2-CZ 3.77Å; F103-F128 HydrophobicContact CD2-CZ 3.77Å; F103-F128 HydrophobicContact CE2-CE1 4.17Å; F103-F128 HydrophobicContact CE2-CZ 4.28Å; F103-F128 HydrophobicContact CG-CD1 4.06Å; F103-F128 AromaticContact CG-CE1 3.74Å; F103-F128 HydrophobicContact CG-CE1 3.74Å; F103-F128 WeakPolarHBondContact O-CA 3.03Å; L105-F128 HydrophobicContact CD1-CD1 3.87Å; V115-F128 HydrophobicContact CG1-CZ 4.24Å; V115-F128 HydrophobicContact CG2-CE1 4.12Å; V115-F128 HydrophobicContact CG2-CZ 4.35Å; H126-F128 HydrophobicContact CB-CE2 4.35Å; F128-V136 HydrophobicContact CB-CG2 4.29Å; F128-L138 HydrophobicContact CE2-CD2 4.34Å; F128-F143 AromaticContact CE2-CE1 3.99Å; F128-F143 HydrophobicContact CE2-CE1 3.99Å; F128-F143 AromaticContact CZ-CE1 3.98Å; F128-F143 HydrophobicContact CZ-CE1 3.98Å; F128-F143 HydrophobicContact CZ-CZ 4.35Å; F128-T147 HydrophobicContact CE2-CG2 4Å; F128-Q148 PolarHBondContact N-O 2.81Å; F128-I149 HydrophobicContact CB-CG1 4.46Å; F128-I149 CarbonylContact O-C 3.56Å; F128-I149 WeakPolarHBondContact O-CA 3.44Å; F128-Q150 PolarHBondContact O-N 2.96Å
129	H	95.3	Very high	85.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.1	166.2	-58	-82.6	0	0	0	107.7	F103 V104 L105 T127 Q150 E152 W164 K168 Y169	F103-H129 PolarHBondContact O-N 3.49Å; V104-H129 HydrophobicContact CG1-CB 4.46Å; L105-H129 PolarHBondContact N-O 2.75Å; T127-H129 WeakPolarHBondContact CG2-NE2 3.44Å; H129-Q150 CarbonylContact C-O 3.58Å; H129-Q150 VanDerWaalsContact CA-O 3.28Å; H129-Q150 WeakPolarHBondContact CA-O 3.46Å; H129-Q150 PolarHBondContact CE1-OE1 2.9Å; H129-E152 HydrophobicContact CB-CG 4.35Å; H129-E152 IonicContact ND1-OE1 2.87Å; H129-W164 HydrophobicContact CB-CH2 4.19Å; H129-W164 AromaticContact CG-CH2 3.83Å; H129-W164 AromaticContact ND1-CH2 3.94Å; H129-K168 PolarHBondContact CE1-NZ 3.47Å; H129-K168 PolarHBondContact ND1-NZ 2.82Å; H129-Y169 PolarHBondContact CE1-OH 2.8Å; H129-Y169 AromaticContact NE2-CE2 3.9Å; H129-Y169 AromaticContact NE2-CZ 3.68Å; H129-Y169 PolarHBondContact NE2-OH 2.86Å
130	V	94.8	Very high	84.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	155.4	-178.3	-62.2	0	0	0	0	110.9	L105 S134 V136 I149 Q150 E151 E152	L105-V130 HydrophobicContact CB-CG1 4.18Å; L105-V130 HydrophobicContact CD1-CG1 4.11Å; V130-S134 WeakPolarHBondContact CG2-O 3.39Å; V130-V136 HydrophobicContact CG1-CG2 3.45Å; V130-V136 VanDerWaalsContact CG1-CG2 3.45Å; V130-I149 HydrophobicContact CG2-CG2 4.17Å; V130-Q150 PolarHBondContact N-O 3.03Å; V130-E151 HydrophobicContact CG2-CG 3.88Å; V130-E151 WeakPolarHBondContact O-CA 3.32Å; V130-E152 PolarHBondContact O-N 3.37Å
131	S	93.1	Very high	82.6	Confident	9 Å²	9	51.1 Å²	51.1	6%	0.063	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	152.8	173.4	-56.6	0	0	0	0	110.9	L105 N106 S107 G133 S134	L105-S131 PolarHBondContact O-N 3.07Å; L105-S131 PolarHBondContact O-OG 3.34Å; N106-S131 WeakPolarHBondContact CA-OG 3.42Å; N106-S131 PolarHBondContact OD1-OG 2.99Å; N106-S131 VanDerWaalsContact OD1-OG 3.14Å; S107-S131 PolarHBondContact N-OG 2.95Å; S107-S131 PolarHBondContact O-OG 3.43Å; S131-G133 PolarHBondContact O-N 3.46Å; S131-S134 WeakPolarHBondContact O-CB 3.04Å; S131-S134 PolarHBondContact O-N 3.45Å; S131-S134 PolarHBondContact O-OG 3.13Å
132	L	90.3	Very high	81.2	Confident	103 Å²	103	55.3 Å²	55.3	54%	0.539	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	130.3	-178.3	-65	171.3	0	0	0	112.2	S134 E151 N153	L132-S134 PolarHBondContact O-N 3.09Å; L132-E151 HydrophobicContact CD2-CB 4.45Å; L132-N153 HydrophobicContact CD1-CB 4.49Å
133	G	86.1	Confident	80.6	Confident	41 Å²	41	53.1 Å²	53.1	42%	0.423	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	2.4	-179.1	0	0	0	0	0	115.5	P110 S131 E151	P110-G133 WeakPolarHBondContact CB-O 3.41Å; S131-G133 PolarHBondContact O-N 3.46Å; G133-E151 PolarHBondContact N-OE2 3Å; G133-E151 VanDerWaalsContact N-OE2 3.13Å
134	S	91	Very high	79.7	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.014	27%	0.268	C	S	.	.			trans	-84.7	144.6	171.5	-57.6	0	0	0	0	111.3	V111 V130 S131 L132	V111-S134 PolarHBondContact N-OG 3.29Å; V111-S134 VanDerWaalsContact O-CA 3.23Å; V111-S134 WeakPolarHBondContact O-CA 3.42Å; V111-S134 VanDerWaalsContact O-CB 3.25Å; V111-S134 WeakPolarHBondContact O-CB 3.27Å; V130-S134 WeakPolarHBondContact CG2-O 3.39Å; S131-S134 WeakPolarHBondContact O-CB 3.04Å; S131-S134 PolarHBondContact O-N 3.45Å; S131-S134 PolarHBondContact O-OG 3.13Å; L132-S134 PolarHBondContact O-N 3.09Å
135	E	88.8	Confident	78.4	Confident	117 Å²	117	53.6 Å²	53.6	55%	0.547	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	154.1	-179.4	-65.5	-178.4	-179.9	0	0	110.9	V111 W113	V111-E135 PolarHBondContact O-N 2.81Å; W113-E135 WeakPolarHBondContact CB-O 3.44Å; W113-E135 PolarHBondContact N-O 2.03Å
136	V	89	Confident	77.5	Confident	16 Å²	16	51 Å²	51	10%	0.097	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.8	175	-171.8	0	0	0	0	109.3	W113 V115 F128 V130 L138 I149	W113-V136 HydrophobicContact CB-CB 4.48Å; W113-V136 HydrophobicContact CB-CG1 4.34Å; W113-V136 HydrophobicContact CB-CG2 4.22Å; W113-V136 CarbonylContact O-C 3.56Å; W113-V136 WeakPolarHBondContact O-CA 3.44Å; V115-V136 HydrophobicContact CG2-CG1 3.52Å; F128-V136 HydrophobicContact CB-CG2 4.29Å; V130-V136 HydrophobicContact CG1-CG2 3.45Å; V130-V136 VanDerWaalsContact CG1-CG2 3.45Å; V136-L138 HydrophobicContact CG1-CD2 4.22Å; V136-L138 HydrophobicContact CG1-CG 4.31Å; V136-I149 HydrophobicContact CB-CD1 3.89Å; V136-I149 HydrophobicContact CB-CG1 4.27Å; V136-I149 HydrophobicContact CG2-CD1 4.5Å; V136-I149 HydrophobicContact CG2-CG1 4.43Å; V136-I149 HydrophobicContact CG2-CG2 4.12Å
137	L	86.6	Confident	76.9	Confident	83 Å²	83	52 Å²	52	44%	0.435	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.2	175.4	-61.6	-179.6	0	0	0	109.7	I112 W113 N114 V115	I112-L137 HydrophobicContact CG2-CD1 3.5Å; I112-L137 VanDerWaalsContact CG2-CD1 3.5Å; I112-L137 HydrophobicContact CG2-CG 3.81Å; W113-L137 PolarHBondContact O-N 3Å; N114-L137 WeakPolarHBondContact OD1-CB 3.02Å; N114-L137 WeakPolarHBondContact OD1-CD1 3.26Å; V115-L137 PolarHBondContact N-O 2.95Å
138	L	80.8	Confident	76.5	Confident	34 Å²	34	55.8 Å²	55.8	18%	0.178	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.5	-178.8	-61.6	158.2	0	0	0	107.9	V115 F128 V136 Q140 F143 S144 T147	V115-L138 HydrophobicContact CB-CD2 3.65Å; V115-L138 HydrophobicContact CG1-CD2 4.02Å; V115-L138 HydrophobicContact CG2-CD2 4.09Å; F128-L138 HydrophobicContact CE2-CD2 4.34Å; V136-L138 HydrophobicContact CG1-CD2 4.22Å; V136-L138 HydrophobicContact CG1-CG 4.31Å; L138-Q140 VanDerWaalsContact C-N 3.31Å; L138-Q140 PolarHBondContact O-N 3.34Å; L138-F143 HydrophobicContact CD1-CD1 4.5Å; L138-F143 HydrophobicContact CD2-CD1 3.44Å; L138-F143 VanDerWaalsContact CD2-CD1 3.44Å; L138-F143 HydrophobicContact CD2-CE1 3.58Å; L138-F143 HydrophobicContact CG-CD1 4.4Å; L138-S144 VanDerWaalsContact CB-OG 3.29Å; L138-S144 WeakPolarHBondContact CB-OG 3.37Å; L138-T147 HydrophobicContact CD1-CG2 4.02Å; L138-T147 WeakPolarHBondContact CD1-OG1 3.21Å
139	K	64.1	Low	76.3	Confident	146 Å²	146	59.4 Å²	59.4	64%	0.635	32%	0.324	S	S	*	.	S	Bend	trans	-78.9	-11.2	-177.6	-70.2	-166.1	175.8	-165	0	114.3
140	Q	62.4	Low	76.1	Confident	83 Å²	83	61.9 Å²	61.9	39%	0.388	34%	0.335	S	S	.	.			trans	-109.3	116.9	-176.7	-74.9	162.5	-20.4	0	0	110.9	A117 L138 N142 F143 S144	A117-Q140 PolarHBondContact O-NE2 2.03Å; A117-Q140 PolarHBondContact O-OE1 2.92Å; L138-Q140 VanDerWaalsContact C-N 3.31Å; L138-Q140 PolarHBondContact O-N 3.34Å; Q140-N142 VanDerWaalsContact C-N 3.26Å; Q140-N142 PolarHBondContact O-N 2.73Å; Q140-F143 HydrophobicContact CB-CB 4.04Å; Q140-F143 PolarHBondContact O-N 3.12Å; Q140-F143 VanDerWaalsContact O-N 3.09Å; Q140-S144 PolarHBondContact O-N 3.22Å; Q140-S144 PolarHBondContact O-OG 3.42Å
141	A	50.7	Low	75.9	Confident	75 Å²	75	67.4 Å²	67.4	62%	0.62	36%	0.361	S	S	*	.	H	α-helix	trans	-55.1	-39.2	-179.4	0	0	0	0	0	113	F143 S144	A141-F143 VanDerWaalsContact C-N 3.32Å; A141-F143 PolarHBondContact O-N 3.43Å; A141-S144 PolarHBondContact O-N 3.11Å
142	N	50.9	Low	75.8	Confident	99 Å²	99	69.6 Å²	69.6	53%	0.529	37%	0.37	S	S	.	.	H	α-helix	trans	-71.1	-23.9	-179.3	-64.9	-21.2	0	0	0	114.1	P122 Q140	P122-N142 HydrophobicContact CB-CB 4.27Å; Q140-N142 VanDerWaalsContact C-N 3.26Å; Q140-N142 PolarHBondContact O-N 2.73Å
143	F	58.4	Low	75.8	Confident	16 Å²	16	71 Å²	71	7%	0.07	38%	0.378	C	S	.	.	H	α-helix	trans	-83.3	-29.3	175.1	-163.5	-101.4	0	0	0	110.8	L88 V115 A117 L120 H126 F128 L138 Q140 A141 T147	L88-F143 HydrophobicContact CD1-CZ 4.49Å; V115-F143 HydrophobicContact CG1-CE1 4.36Å; A117-F143 HydrophobicContact CB-CD2 4.19Å; A117-F143 HydrophobicContact CB-CE2 4.09Å; A117-F143 HydrophobicContact CB-CZ 4.36Å; L120-F143 HydrophobicContact CB-CE2 4.37Å; L120-F143 HydrophobicContact CD2-CE2 3.58Å; L120-F143 HydrophobicContact CD2-CZ 4.11Å; H126-F143 HydrophobicContact CB-CZ 4.33Å; H126-F143 AromaticContact CD2-CD2 3.91Å; H126-F143 AromaticContact CD2-CE2 3.22Å; H126-F143 WeakPolarHBondContact CD2-CE2 3.33Å; H126-F143 AromaticContact CD2-CZ 3.52Å; H126-F143 AromaticContact CG-CZ 3.94Å; H126-F143 AromaticContact NE2-CE2 3.38Å; H126-F143 WeakPolarHBondContact NE2-CE2 2.95Å; F128-F143 AromaticContact CE2-CE1 3.99Å; F128-F143 HydrophobicContact CE2-CE1 3.99Å; F128-F143 AromaticContact CZ-CE1 3.98Å; F128-F143 HydrophobicContact CZ-CE1 3.98Å; F128-F143 HydrophobicContact CZ-CZ 4.35Å; L138-F143 HydrophobicContact CD1-CD1 4.5Å; L138-F143 HydrophobicContact CD2-CD1 3.44Å; L138-F143 VanDerWaalsContact CD2-CD1 3.44Å; L138-F143 HydrophobicContact CD2-CE1 3.58Å; L138-F143 HydrophobicContact CG-CD1 4.4Å; Q140-F143 HydrophobicContact CB-CB 4.04Å; Q140-F143 PolarHBondContact O-N 3.12Å; Q140-F143 VanDerWaalsContact O-N 3.09Å; A141-F143 VanDerWaalsContact C-N 3.32Å; A141-F143 PolarHBondContact O-N 3.43Å; F143-T147 HydrophobicContact CD1-CG2 3.91Å; F143-T147 HydrophobicContact CE1-CG2 3.87Å; F143-T147 WeakPolarHBondContact O-CG2 3.38Å
144	S	54.8	Low	76.2	Confident	44 Å²	44	69.4 Å²	69.4	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-77	-30	-171.9	-52.9	0	0	0	0	114.6	L138 Q140 A141 N146 T147	L138-S144 VanDerWaalsContact CB-OG 3.29Å; L138-S144 WeakPolarHBondContact CB-OG 3.37Å; Q140-S144 PolarHBondContact O-N 3.22Å; Q140-S144 PolarHBondContact O-OG 3.42Å; A141-S144 PolarHBondContact O-N 3.11Å; S144-N146 VanDerWaalsContact C-N 3.29Å; S144-N146 PolarHBondContact O-N 2.84Å; S144-T147 PolarHBondContact O-OG1 3.32Å
145	L	52.7	Low	76.3	Confident	132 Å²	132	71.2 Å²	71.2	69%	0.691	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-24.1	-173.7	-73.2	163.1	0	0	0	114
146	N	61.9	Low	76.3	Confident	43 Å²	43	69.1 Å²	69.1	23%	0.23	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	7.8	-175.4	-79.6	25.9	0	0	0	113.7	F123 H125 S144	F123-N146 PolarHBondContact O-ND2 3.44Å; H125-N146 WeakPolarHBondContact CA-O 3.49Å; H125-N146 PolarHBondContact CE1-ND2 3.27Å; H125-N146 PolarHBondContact ND1-O 2.97Å; S144-N146 VanDerWaalsContact C-N 3.29Å; S144-N146 PolarHBondContact O-N 2.84Å
147	T	76.4	Confident	76.4	Confident	25 Å²	25	69.8 Å²	69.8	15%	0.153	37%	0.372	C	S	.	.			trans	-87.2	134.7	178.8	43.5	0	0	0	0	113	H126 F128 L138 F143 S144	H126-T147 HydrophobicContact CB-CG2 4.03Å; H126-T147 CarbonylContact O-C 3.55Å; H126-T147 WeakPolarHBondContact O-CA 3.49Å; F128-T147 HydrophobicContact CE2-CG2 4Å; L138-T147 HydrophobicContact CD1-CG2 4.02Å; L138-T147 WeakPolarHBondContact CD1-OG1 3.21Å; F143-T147 HydrophobicContact CD1-CG2 3.91Å; F143-T147 HydrophobicContact CE1-CG2 3.87Å; F143-T147 WeakPolarHBondContact O-CG2 3.38Å; S144-T147 PolarHBondContact O-OG1 3.32Å
148	Q	85.1	Confident	76.8	Confident	103 Å²	103	67.2 Å²	67.2	48%	0.481	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.6	172.5	-171.5	178.2	12.8	0	0	110.2	H126 T127 F128 Q150	H126-Q148 PolarHBondContact O-N 3.22Å; T127-Q148 CarbonylContact C-O 3.52Å; T127-Q148 VanDerWaalsContact CA-O 3.3Å; T127-Q148 WeakPolarHBondContact CA-O 3.35Å; F128-Q148 PolarHBondContact N-O 2.81Å; Q148-Q150 HydrophobicContact CG-CG 4.2Å
149	I	89.3	Confident	77.4	Confident	77 Å²	77	70.3 Å²	70.3	40%	0.395	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129	174.7	-57.3	161	0	0	0	107.7	F128 V130 V136	F128-I149 HydrophobicContact CB-CG1 4.46Å; F128-I149 CarbonylContact O-C 3.56Å; F128-I149 WeakPolarHBondContact O-CA 3.44Å; V130-I149 HydrophobicContact CG2-CG2 4.17Å; V136-I149 HydrophobicContact CB-CD1 3.89Å; V136-I149 HydrophobicContact CB-CG1 4.27Å; V136-I149 HydrophobicContact CG2-CD1 4.5Å; V136-I149 HydrophobicContact CG2-CG1 4.43Å; V136-I149 HydrophobicContact CG2-CG2 4.12Å
150	Q	90.1	Very high	78.9	Confident	52 Å²	52	69.8 Å²	69.8	24%	0.243	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.1	178.5	-65.2	-177.7	15.9	0	0	109	F128 H129 V130 Q148 E152	F128-Q150 PolarHBondContact O-N 2.96Å; H129-Q150 CarbonylContact C-O 3.58Å; H129-Q150 VanDerWaalsContact CA-O 3.28Å; H129-Q150 WeakPolarHBondContact CA-O 3.46Å; H129-Q150 PolarHBondContact CE1-OE1 2.9Å; V130-Q150 PolarHBondContact N-O 3.03Å; Q148-Q150 HydrophobicContact CG-CG 4.2Å; Q150-E152 HydrophobicContact CB-CG 4.48Å
151	E	91.3	Very high	80.5	Confident	116 Å²	116	65.8 Å²	65.8	54%	0.542	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	127.6	167.7	-70.6	-175.2	-135	0	0	109.4	V130 L132 G133	V130-E151 HydrophobicContact CG2-CG 3.88Å; V130-E151 WeakPolarHBondContact O-CA 3.32Å; L132-E151 HydrophobicContact CD2-CB 4.45Å; G133-E151 PolarHBondContact N-OE2 3Å; G133-E151 VanDerWaalsContact N-OE2 3.13Å
152	E	90.6	Very high	82.6	Confident	54 Å²	54	62.4 Å²	62.4	25%	0.252	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.1	-176.2	-72.4	-83.9	-155.3	0	0	109.9	H129 V130 Q150 L154 W164 K168	H129-E152 HydrophobicContact CB-CG 4.35Å; H129-E152 IonicContact ND1-OE1 2.87Å; V130-E152 PolarHBondContact O-N 3.37Å; Q150-E152 HydrophobicContact CB-CG 4.48Å; E152-L154 HydrophobicContact CB-CD2 3.93Å; E152-L154 HydrophobicContact CB-CG 4.07Å; E152-L154 PolarHBondContact O-N 2.98Å; E152-L154 VanDerWaalsContact O-N 3.07Å; E152-W164 HydrophobicContact CB-CZ2 4.44Å; E152-W164 HydrophobicContact CG-CZ2 4.21Å; E152-K168 IonicContact OE1-NZ 3.56Å; E152-K168 PolarHBondContact OE1-NZ 3.32Å
153	N	91.5	Very high	84.7	Confident	134 Å²	134	61.7 Å²	61.7	72%	0.717	32%	0.32	S	S	*	.			trans	-81.5	87.5	171.1	-171.9	10.1	0	0	0	109.4	L132	L132-N153 HydrophobicContact CD1-CB 4.49Å
154	L	93.2	Very high	86.5	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.037	33%	0.327	C	S	.	.			trans	-83.8	135.2	-173.7	-64.8	175.4	0	0	0	111.9	V104 N106 E152 L161 W164	V104-L154 HydrophobicContact CG1-CD1 3.91Å; V104-L154 HydrophobicContact CG1-CD2 3.9Å; N106-L154 HydrophobicContact CB-CB 4.32Å; N106-L154 HydrophobicContact CB-CD1 4.01Å; N106-L154 WeakPolarHBondContact OD1-CB 3.39Å; E152-L154 HydrophobicContact CB-CD2 3.93Å; E152-L154 HydrophobicContact CB-CG 4.07Å; E152-L154 PolarHBondContact O-N 2.98Å; E152-L154 VanDerWaalsContact O-N 3.07Å; L154-L161 HydrophobicContact CB-CD1 4.07Å; L154-L161 HydrophobicContact CD2-CD1 4.11Å; L154-W164 HydrophobicContact CD2-CD2 4.19Å; L154-W164 HydrophobicContact CD2-CE3 4.12Å; L154-W164 HydrophobicContact CD2-CH2 3.85Å; L154-W164 HydrophobicContact CD2-CZ2 3.88Å; L154-W164 HydrophobicContact CD2-CZ3 3.98Å
155	P	93.4	Very high	88.5	Confident	40 Å²	40	61.6 Å²	61.6	26%	0.26	31%	0.313	S	S	.	.			trans	-71.4	137.1	177.9	30	-35.6	0	0	0	111.1	N106 G157 H160 L161 W164	N106-P155 PolarHBondContact ND2-O 3.46Å; P155-G157 PolarHBondContact O-N 2.86Å; P155-H160 HydrophobicContact CB-CB 3.83Å; P155-H160 HydrophobicContact CG-CB 4.11Å; P155-L161 HydrophobicContact CG-CB 4.11Å; P155-L161 HydrophobicContact CG-CD1 4.03Å; P155-W164 HydrophobicContact CG-CB 4.31Å
156	Q	88.9	Confident	90.4	Very high	73 Å²	73	58.2 Å²	58.2	34%	0.341	29%	0.294	S	S	.	.	S	Bend	trans	-75.5	-24.7	-177.2	-64.6	-62.7	-38.3	0	0	113.5	N68 R70 N106 S107	N68-Q156 PolarHBondContact ND2-O 2.8Å; R70-Q156 PolarHBondContact NH1-O 2.69Å; R70-Q156 PolarHBondContact NH2-O 2.84Å; N106-Q156 PolarHBondContact ND2-NE2 2.92Å; N106-Q156 PolarHBondContact ND2-OE1 2.9Å; N106-Q156 PolarHBondContact OD1-NE2 2.87Å; S107-Q156 PolarHBondContact O-NE2 2.76Å
157	G	91.9	Very high	92	Very high	29 Å²	29	65.5 Å²	65.5	30%	0.299	32%	0.323	S	S	.	.	S	Bend	trans	-75.4	136.6	-179.5	0	0	0	0	0	112.6	P155 E159 H160 L161	P155-G157 PolarHBondContact O-N 2.86Å; G157-E159 PolarHBondContact O-N 3.19Å; G157-H160 PolarHBondContact O-N 2.9Å; G157-L161 WeakPolarHBondContact O-CB 3.48Å; G157-L161 PolarHBondContact O-N 3.1Å
158	N	94	Very high	92.9	Very high	29 Å²	29	68.4 Å²	68.4	16%	0.155	33%	0.334	C	S	.	.	H	α-helix	trans	-56.8	-51.8	-173.9	-65.8	-7.7	0	0	0	112.8	N68 R70 H160 L161 L162 F175 E177 I200	N68-N158 PolarHBondContact ND2-OD1 2.94Å; R70-N158 PolarHBondContact NH2-OD1 2.91Å; N158-H160 VanDerWaalsContact C-N 3.34Å; N158-H160 PolarHBondContact O-N 3.35Å; N158-L161 PolarHBondContact O-N 3.47Å; N158-L162 WeakPolarHBondContact O-CB 3.29Å; N158-L162 PolarHBondContact O-N 2.87Å; N158-F175 HydrophobicContact CB-CE1 4.06Å; N158-F175 HydrophobicContact CB-CZ 3.8Å; N158-E177 PolarHBondContact ND2-OE1 3.37Å; N158-E177 PolarHBondContact ND2-OE2 2.98Å; N158-E177 PolarHBondContact OD1-OE1 3.28Å; N158-I200 HydrophobicContact CB-CD1 3.74Å
159	E	93.8	Very high	93.3	Very high	100 Å²	100	64.9 Å²	64.9	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-36.6	179	-68.5	-59.8	153.1	0	0	112.4	G157 N163	G157-E159 PolarHBondContact O-N 3.19Å; E159-N163 VanDerWaalsContact O-CB 3.25Å; E159-N163 WeakPolarHBondContact O-CB 3.37Å; E159-N163 PolarHBondContact O-N 2.79Å; E159-N163 PolarHBondContact O-ND2 2.97Å
160	H	95.3	Very high	93.5	Very high	134 Å²	134	71.4 Å²	71.4	62%	0.62	34%	0.336	S	S	*	.	H	α-helix	trans	-67.9	-39.2	177.4	-65.7	-65.2	0	0	0	111.7	P155 G157 N158 W164	P155-H160 HydrophobicContact CB-CB 3.83Å; P155-H160 HydrophobicContact CG-CB 4.11Å; G157-H160 PolarHBondContact O-N 2.9Å; N158-H160 VanDerWaalsContact C-N 3.34Å; N158-H160 PolarHBondContact O-N 3.35Å; H160-W164 WeakPolarHBondContact O-CB 3.13Å; H160-W164 PolarHBondContact O-N 3.43Å
161	L	96	Very high	93.6	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.9	-41.3	176.8	-171.6	63.7	0	0	0	111.9	V66 N68 V104 N106 L154 P155 G157 N158 W164 A165 F175	V66-L161 HydrophobicContact CG1-CD2 3.65Å; V66-L161 HydrophobicContact CG1-CG 3.84Å; N68-L161 HydrophobicContact CB-CD2 3.91Å; V104-L161 HydrophobicContact CG1-CD1 4.07Å; N106-L161 HydrophobicContact CB-CD1 4.39Å; N106-L161 HydrophobicContact CB-CD2 3.66Å; L154-L161 HydrophobicContact CB-CD1 4.07Å; L154-L161 HydrophobicContact CD2-CD1 4.11Å; P155-L161 HydrophobicContact CG-CB 4.11Å; P155-L161 HydrophobicContact CG-CD1 4.03Å; G157-L161 WeakPolarHBondContact O-CB 3.48Å; G157-L161 PolarHBondContact O-N 3.1Å; N158-L161 PolarHBondContact O-N 3.47Å; L161-W164 WeakPolarHBondContact O-CB 3.41Å; L161-W164 PolarHBondContact O-N 3.41Å; L161-A165 PolarHBondContact O-N 3.21Å; L161-F175 HydrophobicContact CB-CE2 4.29Å; L161-F175 HydrophobicContact CD2-CE2 4.15Å; L161-F175 HydrophobicContact CD2-CZ 4.48Å; L161-F175 HydrophobicContact CG-CE2 4.36Å
162	L	95.5	Very high	93.9	Very high	4 Å²	4	64.3 Å²	64.3	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-46.3	174	-178.9	63.5	0	0	0	111.1	N158 W164 A165 Q166 V172 F175 C198 I200	N158-L162 WeakPolarHBondContact O-CB 3.29Å; N158-L162 PolarHBondContact O-N 2.87Å; L162-W164 VanDerWaalsContact C-N 3.32Å; L162-W164 PolarHBondContact O-N 3.04Å; L162-A165 PolarHBondContact O-N 2.86Å; L162-Q166 HydrophobicContact CD1-CG 4.35Å; L162-Q166 HydrophobicContact CG-CG 4.47Å; L162-Q166 WeakPolarHBondContact O-CB 3.49Å; L162-Q166 WeakPolarHBondContact O-CG 3.2Å; L162-Q166 PolarHBondContact O-N 2.97Å; L162-V172 HydrophobicContact CD1-CB 4.05Å; L162-V172 HydrophobicContact CD1-CG1 4.07Å; L162-V172 HydrophobicContact CD1-CG2 3.97Å; L162-F175 HydrophobicContact CB-CD2 4.18Å; L162-F175 HydrophobicContact CB-CE2 4.26Å; L162-F175 HydrophobicContact CD1-CD2 4.16Å; L162-C198 HydrophobicContact CD1-CB 4.44Å; L162-I200 HydrophobicContact CB-CD1 4.22Å; L162-I200 HydrophobicContact CD2-CD1 3.92Å; L162-I200 HydrophobicContact CD2-CG1 3.81Å
163	N	95.5	Very high	94.1	Very high	83 Å²	83	61.7 Å²	61.7	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-38.4	176.1	-78	-46	0	0	0	112.3	E159 K167	E159-N163 VanDerWaalsContact O-CB 3.25Å; E159-N163 WeakPolarHBondContact O-CB 3.37Å; E159-N163 PolarHBondContact O-N 2.79Å; E159-N163 PolarHBondContact O-ND2 2.97Å; N163-K167 WeakPolarHBondContact O-CB 3.43Å; N163-K167 PolarHBondContact O-N 3.36Å
164	W	96	Very high	94.3	Very high	58 Å²	58	55.4 Å²	55.4	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-48.5	173.8	179.1	98.1	0	0	0	111.2	V104 H129 E152 L154 P155 H160 L161 L162 K167 K168	V104-W164 HydrophobicContact CB-CZ3 4.46Å; V104-W164 HydrophobicContact CG1-CE3 4.24Å; V104-W164 HydrophobicContact CG1-CZ3 3.79Å; V104-W164 HydrophobicContact CG2-CZ3 3.76Å; H129-W164 HydrophobicContact CB-CH2 4.19Å; H129-W164 AromaticContact CG-CH2 3.83Å; H129-W164 AromaticContact ND1-CH2 3.94Å; E152-W164 HydrophobicContact CB-CZ2 4.44Å; E152-W164 HydrophobicContact CG-CZ2 4.21Å; L154-W164 HydrophobicContact CD2-CD2 4.19Å; L154-W164 HydrophobicContact CD2-CE3 4.12Å; L154-W164 HydrophobicContact CD2-CH2 3.85Å; L154-W164 HydrophobicContact CD2-CZ2 3.88Å; L154-W164 HydrophobicContact CD2-CZ3 3.98Å; P155-W164 HydrophobicContact CG-CB 4.31Å; H160-W164 WeakPolarHBondContact O-CB 3.13Å; H160-W164 PolarHBondContact O-N 3.43Å; L161-W164 WeakPolarHBondContact O-CB 3.41Å; L161-W164 PolarHBondContact O-N 3.41Å; L162-W164 VanDerWaalsContact C-N 3.32Å; L162-W164 PolarHBondContact O-N 3.04Å; W164-K167 PolarHBondContact O-N 3Å; W164-K168 HydrophobicContact CH2-CD 3.82Å; W164-K168 HydrophobicContact CZ2-CD 3.9Å; W164-K168 HydrophobicContact CZ3-CD 4.43Å; W164-K168 PolarHBondContact O-N 3.42Å; W164-K168 VanDerWaalsContact O-N 3.13Å
165	A	95.3	Very high	94.4	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-44.2	-180	0	0	0	0	0	111.8	V64 V66 L161 L162 K167 K168 Y169 V172	V64-A165 HydrophobicContact CG1-CB 4.47Å; V66-A165 HydrophobicContact CG2-CB 3.84Å; L161-A165 PolarHBondContact O-N 3.21Å; L162-A165 PolarHBondContact O-N 2.86Å; A165-K167 PolarHBondContact O-N 3.05Å; A165-K168 PolarHBondContact O-N 3.3Å; A165-Y169 PolarHBondContact O-N 2.81Å; A165-V172 HydrophobicContact CB-CG2 3.74Å
166	Q	94.1	Very high	94.5	Very high	62 Å²	62	53.1 Å²	53.1	29%	0.29	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-38.6	176.2	-72.6	177.7	-6.5	0	0	112.1	L162 K168 R170 V172	L162-Q166 HydrophobicContact CD1-CG 4.35Å; L162-Q166 HydrophobicContact CG-CG 4.47Å; L162-Q166 WeakPolarHBondContact O-CB 3.49Å; L162-Q166 WeakPolarHBondContact O-CG 3.2Å; L162-Q166 PolarHBondContact O-N 2.97Å; Q166-K168 VanDerWaalsContact C-N 3.34Å; Q166-K168 PolarHBondContact O-N 3.48Å; Q166-R170 WeakPolarHBondContact O-CA 3.26Å; Q166-R170 PolarHBondContact O-N 2.73Å; Q166-V172 HydrophobicContact CG-CG2 3.78Å
167	K	95.1	Very high	94.8	Very high	195 Å²	195	50.8 Å²	50.8	85%	0.848	24%	0.235	S	C	*	.	H	α-helix	trans	-64.6	-37	176.6	-173.8	178	179.2	-177.9	0	112.2	N163 W164 A165	N163-K167 WeakPolarHBondContact O-CB 3.43Å; N163-K167 PolarHBondContact O-N 3.36Å; W164-K167 PolarHBondContact O-N 3Å; A165-K167 PolarHBondContact O-N 3.05Å
168	K	94.6	Very high	94.7	Very high	86 Å²	86	49.6 Å²	49.6	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-81	-38.6	-179.5	-163.7	167.6	-176.8	176.8	0	112.5	H129 E152 W164 A165 Q166	H129-K168 PolarHBondContact CE1-NZ 3.47Å; H129-K168 PolarHBondContact ND1-NZ 2.82Å; E152-K168 IonicContact OE1-NZ 3.56Å; E152-K168 PolarHBondContact OE1-NZ 3.32Å; W164-K168 HydrophobicContact CH2-CD 3.82Å; W164-K168 HydrophobicContact CZ2-CD 3.9Å; W164-K168 HydrophobicContact CZ3-CD 4.43Å; W164-K168 PolarHBondContact O-N 3.42Å; W164-K168 VanDerWaalsContact O-N 3.13Å; A165-K168 PolarHBondContact O-N 3.3Å; Q166-K168 VanDerWaalsContact C-N 3.34Å; Q166-K168 PolarHBondContact O-N 3.48Å
169	Y	93.8	Very high	94.4	Very high	30 Å²	30	54.1 Å²	54.1	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-119.7	3.7	-169.4	-64.1	-71.7	0	0	0	116	L60 Q62 V64 V102 H129 A165 A171	L60-Y169 WeakPolarHBondContact CD1-O 3.17Å; Q62-Y169 HydrophobicContact CG-CD1 4.32Å; V64-Y169 HydrophobicContact CG1-CD2 4.3Å; V64-Y169 HydrophobicContact CG2-CD1 4.36Å; V64-Y169 HydrophobicContact CG2-CD2 4.22Å; V64-Y169 HydrophobicContact CG2-CG 3.8Å; V102-Y169 HydrophobicContact CG1-CD2 4.29Å; V102-Y169 HydrophobicContact CG1-CE1 4.21Å; V102-Y169 HydrophobicContact CG1-CE2 3.67Å; V102-Y169 HydrophobicContact CG2-CD1 4.4Å; V102-Y169 HydrophobicContact CG2-CE1 3.94Å; H129-Y169 PolarHBondContact CE1-OH 2.8Å; H129-Y169 AromaticContact NE2-CE2 3.9Å; H129-Y169 AromaticContact NE2-CZ 3.68Å; H129-Y169 PolarHBondContact NE2-OH 2.86Å; A165-Y169 PolarHBondContact O-N 2.81Å; Y169-A171 PolarHBondContact O-N 3.2Å
170	R	92.8	Very high	94	Very high	213 Å²	213	50.8 Å²	50.8	80%	0.804	22%	0.221	S	C	*	.	S	Bend	trans	69.5	-41.3	-178.1	-52.7	179	178.8	-178.4	-1	115.5	L60 Q166	L60-R170 HydrophobicContact CD1-CB 4.33Å; Q166-R170 WeakPolarHBondContact O-CA 3.26Å; Q166-R170 PolarHBondContact O-N 2.73Å
171	A	93.4	Very high	93.5	Very high	16 Å²	16	45 Å²	45	13%	0.132	20%	0.195	C	C	.	.			trans	-139.9	161	176.9	0	0	0	0	0	111.8	T57 L60 Y169	T57-A171 HydrophobicContact CG2-CB 3.98Å; L60-A171 HydrophobicContact CD1-CB 3.68Å; Y169-A171 PolarHBondContact O-N 3.2Å
172	V	96.1	Very high	92.9	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.018	22%	0.221	C	C	.	.			trans	-127.1	128.7	-178.6	174.7	0	0	0	0	109.1	S54 V64 V66 L162 A165 Q166 S174 C198	S54-V172 WeakPolarHBondContact CB-O 3.3Å; V64-V172 HydrophobicContact CG1-CG2 4.23Å; V66-V172 HydrophobicContact CG2-CG1 3.89Å; L162-V172 HydrophobicContact CD1-CB 4.05Å; L162-V172 HydrophobicContact CD1-CG1 4.07Å; L162-V172 HydrophobicContact CD1-CG2 3.97Å; A165-V172 HydrophobicContact CB-CG2 3.74Å; Q166-V172 HydrophobicContact CG-CG2 3.78Å; V172-S174 VanDerWaalsContact CG1-O 3.27Å; V172-S174 WeakPolarHBondContact CG1-O 3.11Å; V172-C198 HydrophobicContact CB-CB 4.42Å
173	T	95.4	Very high	92.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-78.8	-44.3	-178.6	-45.9	0	0	0	0	111	A53 S54 T57 E63 V64 E190	A53-T173 CarbonylContact C-O 3.53Å; A53-T173 WeakPolarHBondContact CA-O 3.41Å; S54-T173 PolarHBondContact N-O 2.83Å; T57-T173 WeakPolarHBondContact CB-OG1 3.21Å; T57-T173 WeakPolarHBondContact CG2-OG1 3.12Å; T57-T173 PolarHBondContact OG1-OG1 2.7Å; E63-T173 WeakPolarHBondContact CA-OG1 3.2Å; E63-T173 HydrophobicContact CG-CG2 4.36Å; V64-T173 PolarHBondContact N-OG1 2.99Å; V64-T173 WeakPolarHBondContact O-CA 3.29Å; V64-T173 VanDerWaalsContact O-CB 3.32Å; V64-T173 WeakPolarHBondContact O-CB 3.37Å; V64-T173 PolarHBondContact O-N 3.36Å; T173-E190 HydrophobicContact CG2-CG 4.26Å
174	S	95.8	Very high	92.5	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	150.1	173.5	75.3	0	0	0	0	112.8	C52 V64 H65 V66 V172 Y209	C52-S174 CarbonylContact O-C 2.79Å; C52-S174 WeakPolarHBondContact O-CA 3.4Å; V64-S174 PolarHBondContact O-N 3.3Å; H65-S174 PolarHBondContact ND1-OG 3.46Å; V66-S174 PolarHBondContact N-O 3.35Å; V172-S174 VanDerWaalsContact CG1-O 3.27Å; V172-S174 WeakPolarHBondContact CG1-O 3.11Å; S174-Y209 VanDerWaalsContact CB-CZ 3.44Å; S174-Y209 WeakPolarHBondContact OG-CE1 3.39Å
175	F	96.3	Very high	92.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.1	168.7	-173.4	-79.6	0	0	0	108.1	G51 C52 V66 N68 N158 L161 L162 E177 I200	G51-F175 CarbonylContact C-O 3.58Å; G51-F175 WeakPolarHBondContact CA-O 3.37Å; C52-F175 PolarHBondContact N-O 2.72Å; C52-F175 PolarHBondContact O-N 3.03Å; C52-F175 VanDerWaalsContact SG-CB 3.56Å; V66-F175 HydrophobicContact CB-CD2 3.69Å; V66-F175 HydrophobicContact CB-CE2 4.25Å; V66-F175 HydrophobicContact CB-CG 4.4Å; V66-F175 HydrophobicContact CG1-CD2 3.53Å; V66-F175 HydrophobicContact CG1-CE2 3.56Å; V66-F175 HydrophobicContact CG2-CD2 4.42Å; V66-F175 CarbonylContact O-C 3.56Å; V66-F175 WeakPolarHBondContact O-CA 3.46Å; N68-F175 HydrophobicContact CB-CE1 4.49Å; N68-F175 HydrophobicContact CB-CZ 4.01Å; N158-F175 HydrophobicContact CB-CE1 4.06Å; N158-F175 HydrophobicContact CB-CZ 3.8Å; L161-F175 HydrophobicContact CB-CE2 4.29Å; L161-F175 HydrophobicContact CD2-CE2 4.15Å; L161-F175 HydrophobicContact CD2-CZ 4.48Å; L161-F175 HydrophobicContact CG-CE2 4.36Å; L162-F175 HydrophobicContact CB-CD2 4.18Å; L162-F175 HydrophobicContact CB-CE2 4.26Å; L162-F175 HydrophobicContact CD1-CD2 4.16Å; F175-E177 HydrophobicContact CE1-CB 4.27Å; F175-I200 HydrophobicContact CD1-CD1 3.82Å; F175-I200 HydrophobicContact CD1-CG1 4.13Å; F175-I200 HydrophobicContact CD1-CG2 4.5Å; F175-I200 HydrophobicContact CD2-CD1 4.29Å; F175-I200 HydrophobicContact CE1-CD1 3.76Å; F175-I200 HydrophobicContact CE2-CD1 4.22Å; F175-I200 HydrophobicContact CG-CD1 4.11Å; F175-I200 HydrophobicContact CG-CG1 4.36Å; F175-I200 HydrophobicContact CZ-CD1 3.98Å
176	S	95.2	Very high	92.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	114	179.1	-56.8	0	0	0	0	110.2	V66 N68 Y209	V66-S176 PolarHBondContact O-N 2.91Å; N68-S176 PolarHBondContact N-O 2.96Å; S176-Y209 WeakPolarHBondContact OG-CB 3.44Å
177	E	94.2	Very high	92.1	Very high	24 Å²	24	48.3 Å²	48.3	11%	0.112	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.2	166.8	-176.8	177.5	-145.2	0	0	108.9	M49 S50 N68 R70 N158 F175	M49-E177 HydrophobicContact CB-CG 4.24Å; M49-E177 PolarHBondContact N-O 2.98Å; S50-E177 PolarHBondContact O-N 3.1Å; S50-E177 VanDerWaalsContact OG-CB 3.28Å; S50-E177 WeakPolarHBondContact OG-CB 3.41Å; S50-E177 PolarHBondContact OG-OE2 2.97Å; N68-E177 WeakPolarHBondContact O-CA 3.42Å; R70-E177 HydrophobicContact CG-CG 3.89Å; R70-E177 WeakPolarHBondContact CG-OE1 3.32Å; R70-E177 IonicContact CZ-OE1 3.7Å; R70-E177 IonicContact NE-OE1 2.7Å; R70-E177 PolarHBondContact NE-OE1 3.03Å; R70-E177 IonicContact NH2-OE1 3.38Å; N158-E177 PolarHBondContact ND2-OE1 3.37Å; N158-E177 PolarHBondContact ND2-OE2 2.98Å; N158-E177 PolarHBondContact OD1-OE1 3.28Å; F175-E177 HydrophobicContact CE1-CB 4.27Å
178	L	91.5	Very high	92	Very high	3 Å²	3	39 Å²	39	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.8	-176.6	-57.6	174.7	0	0	0	109	A48 I67 N68 L69 R70 I184	A48-L178 HydrophobicContact CB-CD2 3.65Å; I67-L178 HydrophobicContact CG2-CD1 4.22Å; N68-L178 PolarHBondContact O-N 2.92Å; L69-L178 CarbonylContact C-O 3.53Å; L69-L178 VanDerWaalsContact CA-O 3.3Å; L69-L178 WeakPolarHBondContact CA-O 3.49Å; L69-L178 HydrophobicContact CD2-CB 3.95Å; R70-L178 PolarHBondContact N-O 2.87Å; L178-I184 HydrophobicContact CD1-CB 4.43Å; L178-I184 HydrophobicContact CD1-CD1 3.86Å; L178-I184 HydrophobicContact CD1-CG1 3.98Å; L178-I184 HydrophobicContact CD1-CG2 3.64Å
179	R	87.2	Confident	91.8	Very high	125 Å²	125	35 Å²	35	47%	0.472	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	153.7	163.9	-167.8	-180	-69.7	-174.6	-0.9	108.6	M49 R70 T181 Y213	M49-R179 HydrophobicContact SD-CB 4Å; R70-R179 CarbonylContact O-C 3.47Å; R70-R179 WeakPolarHBondContact O-CA 3.4Å; R179-T181 WeakPolarHBondContact O-CG2 3.47Å; R179-T181 PolarHBondContact O-N 3.25Å; R179-T181 VanDerWaalsContact O-N 3.14Å; R179-Y213 PolarHBondContact NH1-OH 2.95Å
180	M	85.8	Confident	91.6	Very high	29 Å²	29	35.5 Å²	35.5	14%	0.143	15%	0.154	C	C	.	.	S	Bend	trans	-48	122.2	173.9	-169	60.9	-171.6	0	0	110	L69 R70 A73 A82 V84 V111	L69-M180 HydrophobicContact CD1-SD 3.91Å; R70-M180 PolarHBondContact O-N 3.3Å; A73-M180 HydrophobicContact CB-CE 3.53Å; A73-M180 HydrophobicContact CB-CG 3.72Å; A73-M180 HydrophobicContact CB-SD 4.38Å; A82-M180 HydrophobicContact CB-CE 3.65Å; V84-M180 HydrophobicContact CG2-CE 3.73Å; V111-M180 HydrophobicContact CG1-CE 3.66Å; V111-M180 HydrophobicContact CG1-SD 4.49Å
181	T	83.9	Confident	91.1	Very high	12 Å²	12	27.4 Å²	27.4	7%	0.074	13%	0.126	C	C	.	.			trans	-142.6	151.7	-167.8	171.6	0	0	0	0	110.1	L69 R179 A183 I184 S212	L69-T181 HydrophobicContact CD2-CG2 4.29Å; R179-T181 WeakPolarHBondContact O-CG2 3.47Å; R179-T181 PolarHBondContact O-N 3.25Å; R179-T181 VanDerWaalsContact O-N 3.14Å; T181-A183 PolarHBondContact OG1-N 3.16Å; T181-A183 PolarHBondContact OG1-O 3.3Å; T181-I184 HydrophobicContact CG2-CD1 4.11Å; T181-I184 HydrophobicContact CG2-CG1 3.58Å; T181-S212 WeakPolarHBondContact CB-O 3.34Å; T181-S212 VanDerWaalsContact OG1-C 3.3Å; T181-S212 PolarHBondContact OG1-N 3.28Å; T181-S212 PolarHBondContact OG1-O 3.12Å; T181-S212 PolarHBondContact OG1-OG 3.47Å
182	Q	83.2	Confident	90.6	Very high	118 Å²	118	30.9 Å²	30.9	55%	0.551	15%	0.15	S	C	*	.	S	Bend	trans	-76.2	-28.9	177	-63.6	172	26.7	0	0	112.9	E85 E214	E85-Q182 PolarHBondContact N-O 2.68Å; Q182-E214 PolarHBondContact NE2-OE2 2.68Å
183	A	88.9	Confident	90.2	Very high	9 Å²	9	36.3 Å²	36.3	7%	0.074	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	137.5	-176.9	0	0	0	0	0	112.9	E85 T181 Y185 S212	E85-A183 HydrophobicContact CB-CB 4.26Å; E85-A183 CarbonylContact O-C 3.51Å; E85-A183 VanDerWaalsContact O-CA 3.3Å; E85-A183 WeakPolarHBondContact O-CA 3.29Å; T181-A183 PolarHBondContact OG1-N 3.16Å; T181-A183 PolarHBondContact OG1-O 3.3Å; A183-Y185 HydrophobicContact CB-CE2 3.97Å; A183-S212 WeakPolarHBondContact CB-OG 3.07Å; A183-S212 PolarHBondContact N-OG 3.21Å; A183-S212 PolarHBondContact O-N 2.57Å; A183-S212 PolarHBondContact O-OG 3.03Å
184	I	93	Very high	89.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.3	179	-52.4	176.8	0	0	0	108.4	I67 L69 V84 E85 L86 H87 W113 L178 T181 I186 L210	I67-I184 HydrophobicContact CD1-CD1 4.47Å; I67-I184 HydrophobicContact CD1-CG2 4.18Å; I67-I184 HydrophobicContact CG2-CD1 3.88Å; L69-I184 HydrophobicContact CD2-CD1 3.92Å; V84-I184 HydrophobicContact CG1-CD1 3.86Å; V84-I184 HydrophobicContact CG1-CG1 4.04Å; E85-I184 PolarHBondContact O-N 2.76Å; L86-I184 HydrophobicContact CD1-CB 4.01Å; L86-I184 HydrophobicContact CD1-CG2 4.05Å; H87-I184 PolarHBondContact N-O 3.27Å; W113-I184 HydrophobicContact CH2-CD1 4.11Å; W113-I184 HydrophobicContact CZ3-CD1 3.69Å; L178-I184 HydrophobicContact CD1-CB 4.43Å; L178-I184 HydrophobicContact CD1-CD1 3.86Å; L178-I184 HydrophobicContact CD1-CG1 3.98Å; L178-I184 HydrophobicContact CD1-CG2 3.64Å; T181-I184 HydrophobicContact CG2-CD1 4.11Å; T181-I184 HydrophobicContact CG2-CG1 3.58Å; I184-I186 HydrophobicContact CG2-CD1 3.98Å; I184-I186 HydrophobicContact CG2-CG1 4.12Å; I184-L210 WeakPolarHBondContact CA-O 3.39Å
185	Y	92.1	Very high	89.5	Confident	85 Å²	85	41.4 Å²	41.4	33%	0.333	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.3	-179.3	-59.6	-90.5	0	0	0	109.2	F46 H87 A183 L210	F46-Y185 HydrophobicContact CE1-CE2 4.11Å; H87-Y185 HydrophobicContact CB-CD1 3.53Å; H87-Y185 HydrophobicContact CB-CE1 3.88Å; H87-Y185 HydrophobicContact CB-CG 4.32Å; H87-Y185 AromaticContact CD2-CE1 3.78Å; H87-Y185 AromaticContact CG-CD1 3.84Å; H87-Y185 AromaticContact CG-CE1 3.62Å; H87-Y185 AromaticContact ND1-CE1 3.99Å; A183-Y185 HydrophobicContact CB-CE2 3.97Å; Y185-L210 PolarHBondContact N-O 3.32Å; Y185-L210 PolarHBondContact O-N 3.07Å
186	I	93.7	Very high	89.1	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.4	178.1	-56.5	-62.3	0	0	0	109.1	I67 L86 H87 L88 K89 F103 I184 V188 N208 Y209	I67-I186 HydrophobicContact CD1-CD1 4.22Å; I67-I186 HydrophobicContact CD1-CG1 4.1Å; L86-I186 HydrophobicContact CD1-CG1 3.88Å; H87-I186 PolarHBondContact O-N 3.3Å; L88-I186 WeakPolarHBondContact CA-O 3.18Å; L88-I186 HydrophobicContact CD2-CB 3.88Å; L88-I186 HydrophobicContact CD2-CG1 4.43Å; L88-I186 HydrophobicContact CD2-CG2 4.44Å; K89-I186 PolarHBondContact N-O 2.85Å; K89-I186 VanDerWaalsContact N-O 3.08Å; F103-I186 HydrophobicContact CE1-CG2 4.29Å; I184-I186 HydrophobicContact CG2-CD1 3.98Å; I184-I186 HydrophobicContact CG2-CG1 4.12Å; I186-V188 HydrophobicContact CG2-CG1 4.1Å; I186-N208 CarbonylContact C-O 3.59Å; I186-N208 WeakPolarHBondContact CA-O 3.33Å; I186-Y209 HydrophobicContact CD1-CD1 4.02Å; I186-Y209 HydrophobicContact CG2-CD1 4.07Å; I186-Y209 HydrophobicContact CG2-CE1 4.26Å
187	K	93.2	Very high	88.9	Confident	62 Å²	62	50.1 Å²	50.1	27%	0.27	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.2	168.3	-61.6	-175.4	-172.2	164.7	0	109.8	K89 I91 N208	K89-K187 CarbonylContact O-C 3.59Å; K89-K187 WeakPolarHBondContact O-CA 3.27Å; I91-K187 HydrophobicContact CG2-CB 3.81Å; K187-N208 HydrophobicContact CB-CB 3.95Å; K187-N208 PolarHBondContact N-O 3.33Å
188	V	92.6	Very high	88.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	147.8	-177.3	-62.3	0	0	0	0	111.7	K89 P90 I91 H97 L101 F103 L120 I186	K89-V188 WeakPolarHBondContact O-CG2 3.41Å; K89-V188 PolarHBondContact O-N 2.99Å; P90-V188 CarbonylContact C-O 3.55Å; P90-V188 WeakPolarHBondContact CA-O 3.22Å; I91-V188 PolarHBondContact N-O 2.83Å; H97-V188 HydrophobicContact CB-CG2 4.04Å; H97-V188 VanDerWaalsContact CD2-CG2 3.45Å; H97-V188 WeakPolarHBondContact CD2-CG2 3.22Å; L101-V188 HydrophobicContact CD1-CB 4.39Å; L101-V188 HydrophobicContact CD1-CG1 4.01Å; L101-V188 HydrophobicContact CD1-CG2 4.34Å; L101-V188 HydrophobicContact CD2-CB 4Å; L101-V188 HydrophobicContact CD2-CG1 4.02Å; F103-V188 HydrophobicContact CZ-CG1 4.03Å; L120-V188 HydrophobicContact CD1-CG2 4.38Å; I186-V188 HydrophobicContact CG2-CG1 4.1Å
189	G	89.3	Confident	89	Confident	2 Å²	2	56.9 Å²	56.9	2%	0.021	29%	0.292	C	S	.	.	S	Bend	trans	120.1	147.8	-174.1	0	0	0	0	0	112.8	E63	E63-G189 VanDerWaalsContact OE2-CA 3.27Å; E63-G189 WeakPolarHBondContact OE2-CA 3.4Å; E63-G189 PolarHBondContact OE2-N 3.38Å
190	E	89.9	Confident	89.3	Confident	40 Å²	40	52.6 Å²	52.6	19%	0.187	28%	0.278	C	S	.	.			trans	-82.8	118.4	178.2	-61.6	98.1	160.6	0	0	112.9	T57 M58 E63 K99 T173	T57-E190 VanDerWaalsContact OG1-CG 3.32Å; T57-E190 WeakPolarHBondContact OG1-CG 3.38Å; T57-E190 PolarHBondContact OG1-OE1 2.81Å; M58-E190 HydrophobicContact CG-CB 3.54Å; M58-E190 HydrophobicContact CG-CG 3.79Å; M58-E190 HydrophobicContact SD-CB 4.44Å; E63-E190 HydrophobicContact CG-CG 4.39Å; E63-E190 WeakPolarHBondContact CG-OE1 3.36Å; K99-E190 WeakPolarHBondContact CE-OE1 3.39Å; K99-E190 IonicContact NZ-OE1 3.67Å; K99-E190 PolarHBondContact NZ-OE1 3.12Å; K99-E190 IonicContact NZ-OE2 3.66Å; T173-E190 HydrophobicContact CG2-CG 4.26Å
191	D	83.4	Confident	89.6	Confident	43 Å²	43	54.7 Å²	54.7	23%	0.23	29%	0.29	C	S	.	.			trans	-91.6	124.2	175.7	-175.8	-11.4	0	0	0	111	V193 F194	D191-V193 PolarHBondContact O-N 2.79Å; D191-V193 VanDerWaalsContact O-N 3.14Å; D191-V193 WeakPolarHBondContact OD1-CB 3.25Å; D191-V193 VanDerWaalsContact OD1-CG2 3.32Å; D191-V193 WeakPolarHBondContact OD1-CG2 3.3Å; D191-V193 PolarHBondContact OD1-N 3.47Å; D191-F194 HydrophobicContact CB-CD2 3.75Å; D191-F194 HydrophobicContact CB-CE2 3.79Å; D191-F194 PolarHBondContact O-N 2.74Å
192	S	82.1	Confident	89.8	Confident	89 Å²	89	59.5 Å²	59.5	62%	0.622	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.7	-177.9	65	0	0	0	0	114.7	K55 F194	K55-S192 PolarHBondContact NZ-O 3.16Å; S192-F194 VanDerWaalsContact C-N 3.26Å; S192-F194 PolarHBondContact O-N 3.1Å
193	V	86.7	Confident	89.8	Confident	118 Å²	118	64 Å²	64	72%	0.715	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.6	179.8	176.2	0	0	0	0	111.9	D191	D191-V193 PolarHBondContact O-N 2.79Å; D191-V193 VanDerWaalsContact O-N 3.14Å; D191-V193 WeakPolarHBondContact OD1-CB 3.25Å; D191-V193 VanDerWaalsContact OD1-CG2 3.32Å; D191-V193 WeakPolarHBondContact OD1-CG2 3.3Å; D191-V193 PolarHBondContact OD1-N 3.47Å
194	F	87.8	Confident	89.6	Confident	42 Å²	42	65 Å²	65	18%	0.184	33%	0.334	C	S	.	.	S	Bend	trans	-86.3	161.4	-176.2	-61.7	-66.3	0	0	0	113.8	A53 K55 D191 S192 F204	A53-F194 HydrophobicContact CB-CB 4.5Å; A53-F194 HydrophobicContact CB-CD1 3.74Å; A53-F194 HydrophobicContact CB-CD2 3.69Å; A53-F194 HydrophobicContact CB-CE1 3.79Å; A53-F194 HydrophobicContact CB-CE2 3.76Å; A53-F194 HydrophobicContact CB-CG 3.7Å; A53-F194 HydrophobicContact CB-CZ 3.81Å; K55-F194 VanDerWaalsContact CD-O 3.25Å; K55-F194 WeakPolarHBondContact CD-O 3.29Å; K55-F194 VanDerWaalsContact CE-O 3.29Å; K55-F194 WeakPolarHBondContact CE-O 3.29Å; D191-F194 HydrophobicContact CB-CD2 3.75Å; D191-F194 HydrophobicContact CB-CE2 3.79Å; D191-F194 PolarHBondContact O-N 2.74Å; S192-F194 VanDerWaalsContact C-N 3.26Å; S192-F194 PolarHBondContact O-N 3.1Å; F194-F204 HydrophobicContact CE1-CE2 4.26Å
195	S	89.3	Confident	89.1	Confident	65 Å²	65	70.7 Å²	70.7	46%	0.455	36%	0.364	S	S	.	.			trans	-75.5	164.8	177.4	87.9	0	0	0	0	112.5	S54 K55 T197	S54-S195 CarbonylContact C-O 2.67Å; S54-S195 WeakPolarHBondContact CA-O 3.3Å; S54-S195 WeakPolarHBondContact CB-O 3.47Å; S54-S195 PolarHBondContact OG-O 2.83Å; K55-S195 PolarHBondContact N-O 3.23Å; S195-T197 PolarHBondContact O-N 2.87Å; S195-T197 PolarHBondContact OG-N 2.93Å; S195-T197 PolarHBondContact OG-O 2.92Å
196	D	89.1	Confident	88.7	Confident	109 Å²	109	67.3 Å²	67.3	58%	0.583	35%	0.353	S	S	*	.	S	Bend	trans	-71.5	-8.5	178.7	-56.4	-39.7	0	0	0	113.5	S54 K55 G56	S54-D196 PolarHBondContact OG-O 2.79Å; S54-D196 VanDerWaalsContact OG-O 3.08Å; K55-D196 WeakPolarHBondContact CE-OD1 3.34Å; K55-D196 VanDerWaalsContact CG-OD1 3.22Å; K55-D196 WeakPolarHBondContact CG-OD1 3.4Å; G56-D196 VanDerWaalsContact CA-O 3.3Å; G56-D196 WeakPolarHBondContact CA-O 3.03Å
197	T	90.3	Very high	88.3	Confident	74 Å²	74	73.3 Å²	73.3	45%	0.454	38%	0.384	S	S	.	.	S	Bend	trans	-123.3	139.5	179.1	60.4	0	0	0	0	112	S54 S195 K199	S54-T197 PolarHBondContact OG-N 3.04Å; S195-T197 PolarHBondContact O-N 2.87Å; S195-T197 PolarHBondContact OG-N 2.93Å; S195-T197 PolarHBondContact OG-O 2.92Å; T197-K199 PolarHBondContact O-N 3.28Å
198	C	93.8	Very high	88	Confident	7 Å²	7	71.4 Å²	71.4	5%	0.047	38%	0.377	C	S	.	.			trans	-87.4	109.1	171.1	-153.2	0	0	0	0	108.9	C52 L162 V172	C52-C198 HydrophobicContact CB-CB 4.14Å; C52-C198 WeakPolarHBondContact CB-SG 3.33Å; C52-C198 PolarHBondContact O-SG 3.19Å; C52-C198 VanDerWaalsContact SG-CA 3.51Å; C52-C198 WeakPolarHBondContact SG-CB 3.22Å; C52-C198 CovalentContact SG-SG 2.03Å; C52-C198 PolarHBondContact SG-SG 3.48Å; L162-C198 HydrophobicContact CD1-CB 4.44Å; V172-C198 HydrophobicContact CB-CB 4.42Å
199	K	93.7	Very high	87.9	Confident	163 Å²	163	71.6 Å²	71.6	71%	0.709	38%	0.378	S	S	*	.			trans	-115.6	119	173.5	-66.9	-176.3	-179.1	-179.4	0	109.1	C52 T197 D201	C52-K199 WeakPolarHBondContact CB-O 3.32Å; T197-K199 PolarHBondContact O-N 3.28Å; K199-D201 PolarHBondContact O-N 3.02Å
200	I	93.6	Very high	87.7	Confident	35 Å²	35	72.7 Å²	72.7	18%	0.179	38%	0.383	C	S	.	.			trans	-66.4	124.9	-172.7	-52.6	-178.3	0	0	0	109.8	N158 L162 F175	N158-I200 HydrophobicContact CB-CD1 3.74Å; L162-I200 HydrophobicContact CB-CD1 4.22Å; L162-I200 HydrophobicContact CD2-CD1 3.92Å; L162-I200 HydrophobicContact CD2-CG1 3.81Å; F175-I200 HydrophobicContact CD1-CD1 3.82Å; F175-I200 HydrophobicContact CD1-CG1 4.13Å; F175-I200 HydrophobicContact CD1-CG2 4.5Å; F175-I200 HydrophobicContact CD2-CD1 4.29Å; F175-I200 HydrophobicContact CE1-CD1 3.76Å; F175-I200 HydrophobicContact CE2-CD1 4.22Å; F175-I200 HydrophobicContact CG-CD1 4.11Å; F175-I200 HydrophobicContact CG-CG1 4.36Å; F175-I200 HydrophobicContact CZ-CD1 3.98Å
201	D	91.1	Very high	87.6	Confident	73 Å²	73	71 Å²	71	39%	0.39	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-122.4	136.8	175.4	-174.9	2.3	0	0	0	109.6	S50 G51 K199 R203 F204	S50-D201 VanDerWaalsContact CA-O 3.32Å; S50-D201 WeakPolarHBondContact CA-O 3.43Å; S50-D201 WeakPolarHBondContact CB-O 3.41Å; G51-D201 PolarHBondContact N-O 3.46Å; G51-D201 PolarHBondContact O-N 2.87Å; K199-D201 PolarHBondContact O-N 3.02Å; D201-R203 VanDerWaalsContact C-N 3.27Å; D201-R203 PolarHBondContact OD1-N 2.93Å; D201-F204 HydrophobicContact CB-CB 4.23Å; D201-F204 VanDerWaalsContact O-CB 3.26Å; D201-F204 WeakPolarHBondContact O-CB 3.29Å; D201-F204 PolarHBondContact O-N 3.3Å
202	T	89	Confident	87.6	Confident	112 Å²	112	69 Å²	69	69%	0.687	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-16.3	176.4	56.2	0	0	0	0	112.6
203	R	83.9	Confident	87.4	Confident	214 Å²	214	67.6 Å²	67.6	81%	0.808	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	9.1	173.4	-64.4	-175.2	-66.8	176.7	-1.6	113	D201 L205	D201-R203 VanDerWaalsContact C-N 3.27Å; D201-R203 PolarHBondContact OD1-N 2.93Å; R203-L205 PolarHBondContact O-N 2.81Å
204	F	85.1	Confident	87.2	Confident	29 Å²	29	64.3 Å²	64.3	13%	0.127	32%	0.324	C	S	.	.			trans	-65.5	124.4	178	178	-101.5	0	0	0	111.2	G51 A53 F194 D201 Y209	G51-F204 VanDerWaalsContact C-CD1 3.44Å; G51-F204 VanDerWaalsContact C-CG 3.41Å; G51-F204 VanDerWaalsContact CA-CD1 3.48Å; G51-F204 WeakPolarHBondContact O-CB 3.43Å; G51-F204 VanDerWaalsContact O-CG 3.31Å; G51-F204 WeakPolarHBondContact O-CG 3.29Å; A53-F204 HydrophobicContact CB-CE2 4.05Å; A53-F204 HydrophobicContact CB-CZ 3.87Å; F194-F204 HydrophobicContact CE1-CE2 4.26Å; D201-F204 HydrophobicContact CB-CB 4.23Å; D201-F204 VanDerWaalsContact O-CB 3.26Å; D201-F204 WeakPolarHBondContact O-CB 3.29Å; D201-F204 PolarHBondContact O-N 3.3Å; F204-Y209 HydrophobicContact CE1-CD2 4.17Å; F204-Y209 AromaticContact CZ-CD2 3.91Å; F204-Y209 HydrophobicContact CZ-CD2 3.91Å; F204-Y209 HydrophobicContact CZ-CE2 4.37Å
205	L	82.1	Confident	86.9	Confident	119 Å²	119	66.2 Å²	66.2	62%	0.623	33%	0.333	S	S	*	.			trans	-136.4	125.8	171.7	-175.3	67.8	0	0	0	109	R203	R203-L205 PolarHBondContact O-N 2.81Å
206	S	82.6	Confident	86.7	Confident	14 Å²	14	68.4 Å²	68.4	10%	0.098	35%	0.346	C	S	.	.			trans	-142	133.3	176.8	178.8	0	0	0	0	110.3	N208 Y209 L210	S206-N208 PolarHBondContact O-N 2.84Å; S206-N208 VanDerWaalsContact O-N 3.09Å; S206-N208 PolarHBondContact OG-N 2.98Å; S206-Y209 PolarHBondContact O-N 3.19Å; S206-Y209 VanDerWaalsContact O-N 3.16Å; S206-L210 VanDerWaalsContact O-CD2 3.31Å; S206-L210 WeakPolarHBondContact O-CD2 3.38Å
207	L	84.8	Confident	86.8	Confident	130 Å²	130	65 Å²	65	68%	0.681	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-4.8	174.5	-60.5	177.9	0	0	0	113.4	L210	L207-L210 HydrophobicContact CD2-CD1 4.48Å
208	N	88.4	Confident	86.8	Confident	22 Å²	22	67.3 Å²	67.3	12%	0.118	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-21.5	176.2	-61.8	-19.8	0	0	0	111.9	I186 K187 S206	I186-N208 CarbonylContact C-O 3.59Å; I186-N208 WeakPolarHBondContact CA-O 3.33Å; K187-N208 HydrophobicContact CB-CB 3.95Å; K187-N208 PolarHBondContact N-O 3.33Å; S206-N208 PolarHBondContact O-N 2.84Å; S206-N208 VanDerWaalsContact O-N 3.09Å; S206-N208 PolarHBondContact OG-N 2.98Å
209	Y	90.4	Very high	86.7	Confident	3 Å²	3	67.3 Å²	67.3	1%	0.012	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	94.8	-173.7	-41.5	-72.1	0	0	0	109.7	A53 S174 S176 I186 F204 S206	A53-Y209 HydrophobicContact CB-CD2 4.36Å; A53-Y209 HydrophobicContact CB-CE2 3.52Å; S174-Y209 VanDerWaalsContact CB-CZ 3.44Å; S174-Y209 WeakPolarHBondContact OG-CE1 3.39Å; S176-Y209 WeakPolarHBondContact OG-CB 3.44Å; I186-Y209 HydrophobicContact CD1-CD1 4.02Å; I186-Y209 HydrophobicContact CG2-CD1 4.07Å; I186-Y209 HydrophobicContact CG2-CE1 4.26Å; F204-Y209 HydrophobicContact CE1-CD2 4.17Å; F204-Y209 AromaticContact CZ-CD2 3.91Å; F204-Y209 HydrophobicContact CZ-CD2 3.91Å; F204-Y209 HydrophobicContact CZ-CE2 4.37Å; S206-Y209 PolarHBondContact O-N 3.19Å; S206-Y209 VanDerWaalsContact O-N 3.16Å
210	L	85.7	Confident	86.6	Confident	26 Å²	26	65.6 Å²	65.6	14%	0.136	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.5	-172.2	-62.2	173.4	0	0	0	111.2	F46 I184 Y185 S206 L207	F46-L210 HydrophobicContact CB-CD1 4.37Å; F46-L210 HydrophobicContact CB-CD2 4.47Å; I184-L210 WeakPolarHBondContact CA-O 3.39Å; Y185-L210 PolarHBondContact N-O 3.32Å; Y185-L210 PolarHBondContact O-N 3.07Å; S206-L210 VanDerWaalsContact O-CD2 3.31Å; S206-L210 WeakPolarHBondContact O-CD2 3.38Å; L207-L210 HydrophobicContact CD2-CD1 4.48Å
211	G	86.1	Confident	86.4	Confident	3 Å²	3	64.2 Å²	64.2	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.2	164.2	0	0	0	0	0	110.4	F46 T47 Y213	F46-G211 WeakPolarHBondContact CA-O 3.47Å; T47-G211 PolarHBondContact N-O 2.85Å; G211-Y213 PolarHBondContact O-N 3.46Å
212	S	84.1	Confident	86.3	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.014	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	105	177.4	67.8	0	0	0	0	111	S45 T181 A183	S45-S212 CarbonylContact O-C 3.58Å; T181-S212 WeakPolarHBondContact CB-O 3.34Å; T181-S212 VanDerWaalsContact OG1-C 3.3Å; T181-S212 PolarHBondContact OG1-N 3.28Å; T181-S212 PolarHBondContact OG1-O 3.12Å; T181-S212 PolarHBondContact OG1-OG 3.47Å; A183-S212 WeakPolarHBondContact CB-OG 3.07Å; A183-S212 PolarHBondContact N-OG 3.21Å; A183-S212 PolarHBondContact O-N 2.57Å; A183-S212 PolarHBondContact O-OG 3.03Å
213	Y	78.1	Confident	86.2	Confident	59 Å²	59	60.2 Å²	60.2	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.2	175.6	-178	-116	0	0	0	110.4	K44 S45 R179 G211 E215	K44-Y213 CarbonylContact C-O 3.59Å; K44-Y213 VanDerWaalsContact CA-O 3.3Å; K44-Y213 WeakPolarHBondContact CA-O 3.2Å; S45-Y213 PolarHBondContact N-O 3.32Å; S45-Y213 PolarHBondContact O-N 3.48Å; R179-Y213 PolarHBondContact NH1-OH 2.95Å; G211-Y213 PolarHBondContact O-N 3.46Å; Y213-E215 HydrophobicContact CD1-CB 4.49Å; Y213-E215 HydrophobicContact CE1-CB 3.75Å; Y213-E215 HydrophobicContact CE1-CG 4.41Å
214	E	81.4	Confident	85.9	Confident	50 Å²	50	52.2 Å²	52.2	23%	0.234	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.1	178.4	-65.9	-174.2	172.9	0	0	109.1	I42 K44 Q182	I42-E214 HydrophobicContact CG2-CB 3.97Å; I42-E214 HydrophobicContact CG2-CG 4.42Å; K44-E214 HydrophobicContact CD-CG 4.32Å; K44-E214 WeakPolarHBondContact CE-OE1 3.45Å; K44-E214 HydrophobicContact CG-CG 4.12Å; K44-E214 IonicContact NZ-OE1 2.74Å; K44-E214 PolarHBondContact NZ-OE1 3.15Å; Q182-E214 PolarHBondContact NE2-OE2 2.68Å
215	E	81.5	Confident	85.1	Confident	82 Å²	82	53.5 Å²	53.5	38%	0.383	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.8	180	-173.7	168.1	-154.2	0	0	110.2	L43 Y213 Q217	L43-E215 PolarHBondContact N-O 3.34Å; L43-E215 PolarHBondContact O-N 3.44Å; Y213-E215 HydrophobicContact CD1-CB 4.49Å; Y213-E215 HydrophobicContact CE1-CB 3.75Å; Y213-E215 HydrophobicContact CE1-CG 4.41Å; E215-Q217 PolarHBondContact O-N 3.49Å; E215-Q217 PolarHBondContact O-NE2 3.14Å
216	P	86.5	Confident	84	Confident	111 Å²	111	52.6 Å²	52.6	72%	0.721	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	135.4	173.9	-23.2	33.7	0	0	0	111.4
217	Q	90.1	Very high	82.9	Confident	36 Å²	36	54 Å²	54	17%	0.168	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.9	-176.2	-64.8	-66	-45.8	0	0	111	A41 L43 E215 S219 T338 M340 A341	A41-Q217 HydrophobicContact CB-CB 4.12Å; A41-Q217 PolarHBondContact O-N 3.36Å; L43-Q217 HydrophobicContact CB-CG 3.75Å; E215-Q217 PolarHBondContact O-N 3.49Å; E215-Q217 PolarHBondContact O-NE2 3.14Å; Q217-S219 PolarHBondContact O-N 2.81Å; Q217-S219 PolarHBondContact O-OG 3.46Å; Q217-T338 HydrophobicContact CB-CG2 4.24Å; Q217-M340 WeakPolarHBondContact CB-O 3.42Å; Q217-M340 WeakPolarHBondContact CG-O 3.24Å; Q217-M340 PolarHBondContact OE1-O 3.14Å; Q217-A341 HydrophobicContact CG-CB 4.37Å
218	T	90.4	Very high	81.7	Confident	123 Å²	123	52.5 Å²	52.5	76%	0.755	29%	0.289	S	S	*	.			trans	-67.6	121.6	177.6	56.6	0	0	0	0	110	P339	T218-P339 WeakPolarHBondContact O-CD 3.43Å
219	S	92.5	Very high	81.1	Confident	8 Å²	8	55.7 Å²	55.7	6%	0.056	30%	0.299	C	S	.	.			trans	-115.5	157.2	178.7	-58.4	0	0	0	0	110.7	V33 A41 Q217 S337 T338	V33-S219 WeakPolarHBondContact CB-O 3.47Å; V33-S219 WeakPolarHBondContact CG2-O 3.42Å; V33-S219 PolarHBondContact N-O 3.46Å; A41-S219 WeakPolarHBondContact CB-OG 3.25Å; Q217-S219 PolarHBondContact O-N 2.81Å; Q217-S219 PolarHBondContact O-OG 3.46Å; S219-S337 WeakPolarHBondContact CA-O 3.24Å; S219-T338 WeakPolarHBondContact CB-OG1 3.46Å; S219-T338 PolarHBondContact OG-OG1 2.98Å
220	K	92	Very high	80.8	Confident	127 Å²	127	56 Å²	56	55%	0.552	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.6	172.2	-64.7	-177.2	-178.3	-179.4	0	109.3	L30 L31 S337	L30-K220 HydrophobicContact CB-CB 4.43Å; L31-K220 CarbonylContact O-C 3.59Å; L31-K220 VanDerWaalsContact O-CA 3.3Å; L31-K220 WeakPolarHBondContact O-CA 3.03Å; K220-S337 PolarHBondContact N-O 3.1Å; K220-S337 PolarHBondContact O-N 3.48Å
221	G	89.5	Confident	81	Confident	6 Å²	6	54.8 Å²	54.8	6%	0.062	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	179.5	-172.3	0	0	0	0	0	113.7	L31 Y335	L31-G221 PolarHBondContact N-O 2.81Å; L31-G221 VanDerWaalsContact N-O 3.14Å; L31-G221 PolarHBondContact O-N 3.49Å; G221-Y335 CarbonylContact C-O 3.57Å; G221-Y335 WeakPolarHBondContact CA-O 3.4Å
222	C	88	Confident	81.3	Confident	15 Å²	15	54.6 Å²	54.6	10%	0.101	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	157.6	174.9	67	0	0	0	0	110	C28 S334 Y335	C28-C222 HydrophobicContact CB-CB 4.03Å; C28-C222 WeakPolarHBondContact CB-SG 3.41Å; C28-C222 WeakPolarHBondContact SG-CB 3.37Å; C28-C222 CovalentContact SG-SG 2.01Å; C28-C222 PolarHBondContact SG-SG 2.88Å; C222-S334 WeakPolarHBondContact O-CA 3.36Å; C222-Y335 PolarHBondContact N-O 3.26Å; C222-Y335 PolarHBondContact O-N 3.3Å
223	I	86	Confident	81.8	Confident	85 Å²	85	54.5 Å²	54.5	44%	0.436	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.9	173.8	-55.8	172.6	0	0	0	106.5	H37	H37-I223 WeakPolarHBondContact ND1-CG1 3.34Å
224	L	78.6	Confident	82.6	Confident	47 Å²	47	51.7 Å²	51.7	25%	0.246	28%	0.281	C	S	.	.			trans	-111.6	-45.7	-169.1	-72.5	168	0	0	0	112.6	P27 C28 I321 V332 T333	P27-L224 HydrophobicContact CB-CD2 4.12Å; P27-L224 WeakPolarHBondContact O-CD2 3.3Å; C28-L224 HydrophobicContact CB-CD2 4.11Å; L224-I321 HydrophobicContact CD1-CD1 4.1Å; L224-I321 HydrophobicContact CD1-CG1 4.4Å; L224-I321 HydrophobicContact CD1-CG2 4.22Å; L224-V332 WeakPolarHBondContact CB-O 3.3Å; L224-V332 HydrophobicContact CD1-CB 3.98Å; L224-V332 HydrophobicContact CD1-CG1 3.93Å; L224-T333 PolarHBondContact N-O 3.23Å
225	S	67.8	Low	83.2	Confident	55 Å²	55	50 Å²	50	39%	0.385	27%	0.273	S	S	.	.			trans	-158.9	155.4	-179.5	-71.4	0	0	0	0	112	V332 T333	S225-V332 PolarHBondContact N-O 3.32Å; S225-T333 VanDerWaalsContact O-CA 3.29Å; S225-T333 WeakPolarHBondContact O-CA 3.31Å; S225-T333 WeakPolarHBondContact O-CG2 3.37Å
226	V	58.9	Low	83.8	Confident	101 Å²	101	46 Å²	46	61%	0.612	25%	0.254	S	S	*	.			trans	-127.9	88.2	175.7	-170.1	0	0	0	0	110.1
227	P	60.2	Low	84.1	Confident	43 Å²	43	44.8 Å²	44.8	28%	0.279	24%	0.239	S	C	.	.			trans	-107.8	-177.6	170.8	21.1	-0.3	0	0	0	111.7	R229 P331	P227-R229 PolarHBondContact O-N 3.02Å; P227-P331 HydrophobicContact CB-CG 4.34Å; P227-P331 HydrophobicContact CG-CG 3.17Å
228	N	59.9	Low	84	Confident	99 Å²	99	43.8 Å²	43.8	53%	0.529	24%	0.237	S	C	.	.	S	Bend	trans	-57.3	-18.8	-178.2	-75.8	-5.7	0	0	0	115.9	R264 Q351	N228-R264 WeakPolarHBondContact O-CD 3.33Å; N228-R264 PolarHBondContact O-NH1 2.84Å; N228-R264 PolarHBondContact OD1-NH1 3.23Å; N228-Q351 PolarHBondContact OD1-NE2 3.22Å; N228-Q351 PolarHBondContact OD1-OE1 3.37Å; N228-Q351 VanDerWaalsContact OD1-OE1 3.11Å
229	R	74.5	Confident	83.8	Confident	89 Å²	89	38 Å²	38	34%	0.336	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.8	175.5	179.4	177.5	173.6	172.9	1.6	108.8	P227 D265 T267 E290	P227-R229 PolarHBondContact O-N 3.02Å; R229-D265 HydrophobicContact CG-CB 4.09Å; R229-T267 PolarHBondContact NE-OG1 3.07Å; R229-T267 PolarHBondContact NH2-OG1 2.84Å; R229-E290 IonicContact NH2-OE2 3.51Å; R229-E290 PolarHBondContact NH2-OE2 2.79Å
230	E	85.8	Confident	83.4	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.037	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.3	-177.4	-67.4	-164.8	-135.7	0	0	111.5	H232 D265 V266 T267 T333 L348	E230-H232 IonicContact OE2-CE1 3.55Å; E230-H232 PolarHBondContact OE2-CE1 2.74Å; E230-H232 VanDerWaalsContact OE2-CE1 3.28Å; E230-H232 IonicContact OE2-NE2 2.9Å; E230-H232 PolarHBondContact OE2-NE2 2.84Å; E230-D265 PolarHBondContact N-O 3.05Å; E230-V266 CarbonylContact O-C 3.42Å; E230-V266 WeakPolarHBondContact O-CA 3.41Å; E230-T267 PolarHBondContact O-N 3.05Å; E230-T333 WeakPolarHBondContact CA-OG1 3.32Å; E230-T333 HydrophobicContact CG-CG2 4.38Å; E230-L348 HydrophobicContact CB-CD2 4.4Å; E230-L348 HydrophobicContact CG-CD2 4.5Å; E230-L348 WeakPolarHBondContact OE2-CD2 3.43Å
231	V	89.9	Confident	82.4	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	110.5	179	-177.6	0	0	0	0	109.2	T267 T333 S334	V231-T267 CarbonylContact C-O 3.56Å; V231-T267 WeakPolarHBondContact CA-O 3.39Å; V231-T333 PolarHBondContact N-OG1 3.4Å; V231-T333 WeakPolarHBondContact O-CA 3.42Å; V231-T333 VanDerWaalsContact O-CB 3.29Å; V231-T333 WeakPolarHBondContact O-CB 3.33Å; V231-T333 PolarHBondContact O-N 3.38Å; V231-S334 PolarHBondContact O-N 2.84Å
232	H	92.4	Very high	81.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127	179.9	-55.2	-79.7	0	0	0	111.2	E230 T267 L268 V269 S334 L348	E230-H232 IonicContact OE2-CE1 3.55Å; E230-H232 PolarHBondContact OE2-CE1 2.74Å; E230-H232 VanDerWaalsContact OE2-CE1 3.28Å; E230-H232 IonicContact OE2-NE2 2.9Å; E230-H232 PolarHBondContact OE2-NE2 2.84Å; H232-T267 PolarHBondContact N-O 2.93Å; H232-L268 HydrophobicContact CB-CD2 3.92Å; H232-V269 PolarHBondContact O-N 2.99Å; H232-S334 PolarHBondContact ND1-OG 3.18Å; H232-L348 VanDerWaalsContact NE2-CD2 3.34Å; H232-L348 WeakPolarHBondContact NE2-CD2 3.46Å
233	I	93.4	Very high	79.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.6	176.4	-51.8	-179.3	0	0	0	108.9	V269 L320 I321 A324 V332 S334 Y335 T336	I233-V269 WeakPolarHBondContact CA-O 3.04Å; I233-V269 HydrophobicContact CB-CB 4.43Å; I233-V269 HydrophobicContact CG1-CB 4.1Å; I233-V269 HydrophobicContact CG1-CG2 4.38Å; I233-V269 HydrophobicContact CG2-CB 4.28Å; I233-V269 HydrophobicContact CG2-CG1 4.36Å; I233-L320 HydrophobicContact CG2-CB 4.13Å; I233-L320 HydrophobicContact CG2-CD1 4.24Å; I233-I321 HydrophobicContact CD1-CG1 4.09Å; I233-A324 HydrophobicContact CD1-CB 3.87Å; I233-V332 HydrophobicContact CD1-CG1 3.64Å; I233-V332 HydrophobicContact CD1-CG2 4.09Å; I233-V332 HydrophobicContact CG1-CG1 3.93Å; I233-S334 PolarHBondContact N-O 2.81Å; I233-Y335 HydrophobicContact CB-CD2 3.91Å; I233-Y335 HydrophobicContact CG2-CD2 3.72Å; I233-Y335 HydrophobicContact CG2-CE2 3.96Å; I233-T336 PolarHBondContact O-N 3.29Å
234	I	95.1	Very high	77.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.5	177.9	-58.4	178.3	0	0	0	109.3	V39 V269 L270 R271 W278 T336 F344 I346	V39-I234 HydrophobicContact CG1-CD1 3.91Å; V39-I234 HydrophobicContact CG1-CG1 4.27Å; I234-V269 PolarHBondContact N-O 2.73Å; I234-L270 HydrophobicContact CB-CD2 3.98Å; I234-L270 HydrophobicContact CD1-CD2 4.04Å; I234-L270 HydrophobicContact CG1-CD2 4.27Å; I234-R271 PolarHBondContact O-N 2.87Å; I234-W278 HydrophobicContact CG2-CH2 4.37Å; I234-T336 CarbonylContact C-O 3.58Å; I234-T336 WeakPolarHBondContact CA-O 3.43Å; I234-F344 HydrophobicContact CD1-CB 4.28Å; I234-F344 HydrophobicContact CD1-CD1 4.34Å; I234-F344 HydrophobicContact CD1-CG 4.24Å; I234-F344 HydrophobicContact CG2-CD1 4.1Å; I234-F344 HydrophobicContact CG2-CD2 4.35Å; I234-F344 HydrophobicContact CG2-CE1 3.71Å; I234-F344 HydrophobicContact CG2-CE2 4Å; I234-F344 HydrophobicContact CG2-CG 4.39Å; I234-F344 HydrophobicContact CG2-CZ 3.64Å; I234-I346 HydrophobicContact CD1-CD1 3.99Å
235	E	94.6	Very high	76.3	Confident	13 Å²	13	52.6 Å²	52.6	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.2	173	-177.5	179.3	-130.3	0	0	110.4	R271 G316 L320 Y335 T336 S337 T338	E235-R271 WeakPolarHBondContact CA-O 2.8Å; E235-R271 IonicContact OE1-NE 2.7Å; E235-G316 PolarHBondContact OE1-N 3Å; E235-L320 HydrophobicContact CB-CD1 4.11Å; E235-L320 HydrophobicContact CG-CD1 4.36Å; E235-Y335 HydrophobicContact CB-CE2 4.48Å; E235-Y335 PolarHBondContact OE2-OH 3.09Å; E235-T336 PolarHBondContact N-O 3.17Å; E235-S337 CarbonylContact O-C 3.55Å; E235-S337 VanDerWaalsContact O-CA 3.28Å; E235-S337 WeakPolarHBondContact O-CA 3.26Å; E235-S337 PolarHBondContact OE2-OG 2.88Å; E235-T338 PolarHBondContact O-N 2.97Å
236	L	94.2	Very high	76	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.9	-179.8	177.9	64.1	0	0	0	111.3	A238 V249 R271 C272 A273 W278 A341 F344	L236-A238 WeakPolarHBondContact CD1-O 3.31Å; L236-V249 HydrophobicContact CD2-CG1 4.09Å; L236-V249 HydrophobicContact CD2-CG2 3.82Å; L236-R271 PolarHBondContact N-O 2.91Å; L236-C272 HydrophobicContact CB-CB 4.3Å; L236-C272 CarbonylContact O-C 3.5Å; L236-C272 WeakPolarHBondContact O-CA 2.99Å; L236-C272 PolarHBondContact O-SG 3.09Å; L236-A273 PolarHBondContact O-N 3.36Å; L236-W278 HydrophobicContact CB-CH2 4.19Å; L236-W278 HydrophobicContact CD2-CH2 4.33Å; L236-A341 HydrophobicContact CD1-CB 4.21Å; L236-A341 WeakPolarHBondContact CD1-O 3.4Å; L236-A341 WeakPolarHBondContact CD2-O 3.03Å; L236-F344 HydrophobicContact CB-CZ 4.47Å; L236-F344 HydrophobicContact CD1-CE2 4.36Å; L236-F344 HydrophobicContact CD1-CZ 4.04Å; L236-F344 HydrophobicContact CD2-CE2 4.33Å
237	Q	91.9	Very high	77.1	Confident	84 Å²	84	51.1 Å²	51.1	39%	0.393	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-40.5	176.1	-53.9	-64.1	-36.7	0	0	112.6	T338 P339	Q237-T338 PolarHBondContact N-O 3.03Å; Q237-P339 WeakPolarHBondContact CB-O 3.28Å
238	A	88.8	Confident	78.4	Confident	15 Å²	15	53.4 Å²	53.4	12%	0.124	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	143.6	175.9	0	0	0	0	0	112.6	L236 K274 P339 M340 A341	L236-A238 WeakPolarHBondContact CD1-O 3.31Å; A238-K274 HydrophobicContact CB-CD 3.93Å; A238-P339 PolarHBondContact N-O 2.72Å; A238-P339 VanDerWaalsContact N-O 3.08Å; A238-M340 VanDerWaalsContact O-CA 3.25Å; A238-M340 WeakPolarHBondContact O-CA 3.47Å; A238-A341 PolarHBondContact O-N 2.83Å
239	P	86.6	Confident	79.8	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.019	27%	0.274	C	S	.	.	S	Bend	trans	-74.7	-28.3	177	31.3	-36.2	0	0	0	113.3	L43 V247 V249 V276 A341	L43-P239 WeakPolarHBondContact CD1-O 3.5Å; P239-V247 HydrophobicContact CB-CB 4.15Å; P239-V247 HydrophobicContact CB-CG1 4.45Å; P239-V247 HydrophobicContact CG-CB 4.14Å; P239-V247 HydrophobicContact CG-CG2 4.36Å; P239-V249 HydrophobicContact CB-CG2 3.9Å; P239-V276 HydrophobicContact CB-CG1 3.99Å; P239-V276 HydrophobicContact CG-CG1 3.81Å; P239-A341 WeakPolarHBondContact CA-O 3.39Å; P239-A341 CarbonylContact O-C 3.58Å
240	N	82.7	Confident	80.7	Confident	39 Å²	39	46.6 Å²	46.6	21%	0.209	27%	0.268	C	S	.	.	S	Bend	trans	-155.6	172.9	-179.3	61.2	17.4	0	0	0	111.5	S242	N240-S242 PolarHBondContact O-N 2.77Å; N240-S242 PolarHBondContact OD1-N 2.79Å; N240-S242 PolarHBondContact OD1-O 2.9Å
241	S	71.1	Confident	81.1	Confident	104 Å²	104	46.2 Å²	46.2	73%	0.727	27%	0.267	S	S	*	.	S	Bend	trans	-72	-9.8	175.7	-47.6	0	0	0	0	113.5	M340	S241-M340 PolarHBondContact N-SD 2.77Å; S241-M340 VanDerWaalsContact N-SD 3.36Å; S241-M340 PolarHBondContact OG-SD 3.35Å
242	S	64.3	Low	81.2	Confident	74 Å²	74	46.8 Å²	46.8	52%	0.517	27%	0.27	S	S	.	.	S	Bend	trans	-94.4	160.8	-178.1	-58.4	0	0	0	0	111.4	N240	N240-S242 PolarHBondContact O-N 2.77Å; N240-S242 PolarHBondContact OD1-N 2.79Å; N240-S242 PolarHBondContact OD1-O 2.9Å
243	S	51	Low	81.2	Confident	125 Å²	125	46.9 Å²	46.9	87%	0.874	27%	0.27	S	S	*	.			trans	-97	6.7	-177.1	53.6	0	0	0	0	114
244	A	43	Very low	81	Confident	56 Å²	56	50.5 Å²	50.5	46%	0.463	28%	0.284	S	S	.	.			trans	-98.7	123.2	-164.3	0	0	0	0	0	113.4
245	F	55.5	Low	80.5	Confident	196 Å²	196	50.6 Å²	50.6	86%	0.86	28%	0.284	S	S	*	.	S	Bend	trans	49.1	170.6	161.2	-66	-77.5	0	0	0	117.9	V247	F245-V247 WeakPolarHBondContact O-CG2 3.45Å; F245-V247 PolarHBondContact O-N 2.85Å; F245-V247 VanDerWaalsContact O-N 3.17Å
246	Q	62.8	Low	79.8	Confident	89 Å²	89	54.9 Å²	54.9	42%	0.416	31%	0.307	S	S	.	.			trans	-65.5	113.1	178.6	-165.1	175.7	21.2	0	0	108.9	V276 H277 T296	Q246-V276 PolarHBondContact NE2-O 2.88Å; Q246-H277 HydrophobicContact CG-CB 4.15Å; Q246-T296 PolarHBondContact NE2-OG1 2.82Å
247	V	81	Confident	79	Confident	36 Å²	36	59.9 Å²	59.9	22%	0.218	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.3	-180	-176.1	0	0	0	0	109.5	P239 F245 H277	P239-V247 HydrophobicContact CB-CB 4.15Å; P239-V247 HydrophobicContact CB-CG1 4.45Å; P239-V247 HydrophobicContact CG-CB 4.14Å; P239-V247 HydrophobicContact CG-CG2 4.36Å; F245-V247 WeakPolarHBondContact O-CG2 3.45Å; F245-V247 PolarHBondContact O-N 2.85Å; F245-V247 VanDerWaalsContact O-N 3.17Å; V247-H277 PolarHBondContact O-N 2.93Å
248	D	86.9	Confident	77.6	Confident	91 Å²	91	59.8 Å²	59.8	49%	0.487	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	128.7	174.5	-65.1	-8.1	0	0	0	111	H277 V279	D248-H277 CarbonylContact C-O 3.52Å; D248-H277 VanDerWaalsContact CA-O 3.27Å; D248-H277 WeakPolarHBondContact CA-O 3.45Å; D248-H277 WeakPolarHBondContact OD1-CB 3.36Å; D248-H277 IonicContact OD1-CD2 2.68Å; D248-H277 PolarHBondContact OD1-CD2 2.78Å; D248-H277 IonicContact OD1-CG 2.67Å; D248-V279 HydrophobicContact CB-CG2 4.21Å
249	V	91.1	Very high	76.5	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.3	171.9	179.7	0	0	0	0	107.7	L236 P239 V276 H277 W278 V279 N342 F344	L236-V249 HydrophobicContact CD2-CG1 4.09Å; L236-V249 HydrophobicContact CD2-CG2 3.82Å; P239-V249 HydrophobicContact CB-CG2 3.9Å; V249-V276 HydrophobicContact CG2-CB 3.87Å; V249-V276 HydrophobicContact CG2-CG1 3.9Å; V249-V276 HydrophobicContact CG2-CG2 4.31Å; V249-H277 PolarHBondContact N-O 3.17Å; V249-W278 HydrophobicContact CB-CD2 4.44Å; V249-W278 HydrophobicContact CB-CE3 3.91Å; V249-W278 HydrophobicContact CB-CZ3 4.06Å; V249-W278 HydrophobicContact CG1-CE3 3.66Å; V249-W278 HydrophobicContact CG1-CH2 4.07Å; V249-W278 HydrophobicContact CG1-CZ3 3.37Å; V249-W278 WeakPolarHBondContact O-CA 3.48Å; V249-V279 PolarHBondContact O-N 2.91Å; V249-N342 WeakPolarHBondContact CA-O 3.37Å; V249-F344 HydrophobicContact CG1-CD2 3.88Å; V249-F344 HydrophobicContact CG1-CE2 3.83Å
250	I	92.4	Very high	75.7	Confident	44 Å²	44	69.5 Å²	69.5	23%	0.226	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.1	-174.8	-60	168.4	0	0	0	109.5	V279 K281 N342 H343 F344	I250-V279 CarbonylContact C-O 3.46Å; I250-V279 WeakPolarHBondContact CA-O 2.99Å; I250-V279 HydrophobicContact CG1-CB 4.31Å; I250-K281 HydrophobicContact CG2-CD 4.2Å; I250-N342 PolarHBondContact N-O 2.91Å; I250-H343 CarbonylContact O-C 3.59Å; I250-H343 WeakPolarHBondContact O-CA 3.27Å; I250-F344 PolarHBondContact O-N 2.88Å
251	V	94.5	Very high	75.1	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	108.2	170.1	-175.8	0	0	0	0	107.9	L268 L270 W278 V279 V280 K281 F344 I346	V251-L268 HydrophobicContact CG1-CD1 3.99Å; V251-L270 HydrophobicContact CG2-CD1 4.36Å; V251-L270 HydrophobicContact CG2-CD2 4.33Å; V251-W278 HydrophobicContact CG2-CE3 3.81Å; V251-W278 HydrophobicContact CG2-CZ3 4Å; V251-V279 PolarHBondContact N-O 2.77Å; V251-V280 HydrophobicContact CB-CG2 4.35Å; V251-V280 CarbonylContact O-C 3.55Å; V251-V280 WeakPolarHBondContact O-CA 3.13Å; V251-K281 PolarHBondContact O-N 2.82Å; V251-F344 CarbonylContact C-O 3.52Å; V251-F344 WeakPolarHBondContact CA-O 2.98Å; V251-F344 HydrophobicContact CG2-CB 4.43Å; V251-I346 HydrophobicContact CG1-CD1 3.48Å; V251-I346 VanDerWaalsContact CG1-CD1 3.48Å; V251-I346 HydrophobicContact CG1-CG1 4.01Å
252	D	92.6	Very high	75.4	Confident	13 Å²	13	67.7 Å²	67.7	7%	0.07	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	110.9	-179.4	-168.3	-17.2	0	0	0	109.5	R254 H283 F344 I346	D252-R254 VanDerWaalsContact CG-NE 3.35Å; D252-R254 VanDerWaalsContact OD1-CG 3.27Å; D252-R254 WeakPolarHBondContact OD1-CG 3.34Å; D252-R254 IonicContact OD1-CZ 3.32Å; D252-R254 IonicContact OD1-NE 2.69Å; D252-R254 PolarHBondContact OD1-NE 3.02Å; D252-R254 IonicContact OD1-NH2 3.84Å; D252-R254 IonicContact OD2-CZ 2.79Å; D252-R254 IonicContact OD2-NE 3.03Å; D252-R254 PolarHBondContact OD2-NE 3.48Å; D252-R254 VanDerWaalsContact OD2-NE 3.09Å; D252-R254 IonicContact OD2-NH2 2.9Å; D252-R254 PolarHBondContact OD2-NH2 2.05Å; D252-H283 IonicContact OD1-CD2 3.04Å; D252-H283 PolarHBondContact OD1-CD2 2.87Å; D252-H283 IonicContact OD1-NE2 3.69Å; D252-F344 PolarHBondContact N-O 3.04Å; D252-I346 PolarHBondContact O-N 3.4Å
253	L	90.9	Very high	76	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.5	178.6	-77.4	152.5	0	0	0	109.7	V266 L268 V280 K281 A282 H283 L289 I346 L348	L253-V266 HydrophobicContact CD2-CG1 4.02Å; L253-L268 HydrophobicContact CD1-CD1 3.93Å; L253-L268 HydrophobicContact CD2-CD2 4.47Å; L253-V280 HydrophobicContact CD1-CG1 3.62Å; L253-K281 PolarHBondContact N-O 2.81Å; L253-A282 HydrophobicContact CB-CB 3.95Å; L253-A282 HydrophobicContact CD1-CB 4.15Å; L253-A282 WeakPolarHBondContact O-CA 3.44Å; L253-H283 PolarHBondContact O-N 2.84Å; L253-L289 HydrophobicContact CD1-CD1 3.94Å; L253-L289 HydrophobicContact CD1-CD2 4.29Å; L253-I346 HydrophobicContact CD2-CB 3.94Å; L253-I346 HydrophobicContact CD2-CD1 4.05Å; L253-I346 HydrophobicContact CD2-CG2 3.97Å; L253-I346 HydrophobicContact CG-CB 4.5Å; L253-I346 HydrophobicContact CG-CD1 4.5Å; L253-L348 HydrophobicContact CD2-CD1 4.41Å
254	R	89.2	Confident	77.4	Confident	76 Å²	76	64.4 Å²	64.4	29%	0.287	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.1	177.3	-58.2	-170.7	-174.3	-150.4	2	112.3	D252 H283 I346 R347 L348	D252-R254 VanDerWaalsContact CG-NE 3.35Å; D252-R254 VanDerWaalsContact OD1-CG 3.27Å; D252-R254 WeakPolarHBondContact OD1-CG 3.34Å; D252-R254 IonicContact OD1-CZ 3.32Å; D252-R254 IonicContact OD1-NE 2.69Å; D252-R254 PolarHBondContact OD1-NE 3.02Å; D252-R254 IonicContact OD1-NH2 3.84Å; D252-R254 IonicContact OD2-CZ 2.79Å; D252-R254 IonicContact OD2-NE 3.03Å; D252-R254 PolarHBondContact OD2-NE 3.48Å; D252-R254 VanDerWaalsContact OD2-NE 3.09Å; D252-R254 IonicContact OD2-NH2 2.9Å; D252-R254 PolarHBondContact OD2-NH2 2.05Å; R254-H283 HydrophobicContact CG-CB 4.31Å; R254-I346 PolarHBondContact N-O 2.8Å; R254-R347 VanDerWaalsContact CB-NH1 3.26Å; R254-R347 WeakPolarHBondContact O-CA 3.15Å; R254-L348 PolarHBondContact O-N 3.34Å
255	P	85.8	Confident	79.4	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.013	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	157.7	162.2	-23.9	33.6	0	0	0	112.1	K257 D260 V262 H283 N284 M285 R347	P255-K257 VanDerWaalsContact C-N 3.29Å; P255-K257 VanDerWaalsContact CB-O 3.3Å; P255-K257 WeakPolarHBondContact CB-O 3.4Å; P255-D260 VanDerWaalsContact CG-O 3.25Å; P255-D260 WeakPolarHBondContact CG-O 3.38Å; P255-V262 HydrophobicContact CB-CG2 3.75Å; P255-V262 HydrophobicContact CG-CB 4.28Å; P255-V262 HydrophobicContact CG-CG2 3.92Å; P255-H283 VanDerWaalsContact CD-O 3.29Å; P255-H283 WeakPolarHBondContact CD-O 3.47Å; P255-N284 HydrophobicContact CG-CB 4.17Å; P255-M285 HydrophobicContact CG-SD 3.9Å; P255-R347 WeakPolarHBondContact O-CD 3.04Å; P255-R347 PolarHBondContact O-NH1 2.79Å
256	L	79.6	Confident	81	Confident	104 Å²	104	56 Å²	56	55%	0.545	29%	0.287	S	S	.	.	S	Bend	trans	-65	-34.2	171.5	-171.9	67.3	0	0	0	111.8	R347 L348	L256-R347 HydrophobicContact CD1-CB 4.12Å; L256-L348 VanDerWaalsContact CB-O 3.29Å; L256-L348 WeakPolarHBondContact CB-O 3.32Å; L256-L348 PolarHBondContact N-O 2.93Å
257	K	76.7	Confident	82.4	Confident	105 Å²	105	51.9 Å²	51.9	46%	0.457	27%	0.268	S	S	.	.	S	Bend	trans	-109.4	117.8	171.6	-59.1	-161.4	-148.1	103.4	0	109.8	P255 D259 D260 E350	P255-K257 VanDerWaalsContact C-N 3.29Å; P255-K257 VanDerWaalsContact CB-O 3.3Å; P255-K257 WeakPolarHBondContact CB-O 3.4Å; K257-D259 PolarHBondContact O-N 2.89Å; K257-D259 VanDerWaalsContact O-N 3.1Å; K257-D260 HydrophobicContact CB-CB 4.45Å; K257-D260 WeakPolarHBondContact CB-OD2 3.26Å; K257-D260 IonicContact NZ-OD2 3.77Å; K257-D260 PolarHBondContact O-N 2.89Å; K257-D260 VanDerWaalsContact O-N 3.16Å; K257-E350 IonicContact NZ-OE1 2.73Å; K257-E350 PolarHBondContact NZ-OE1 2.91Å; K257-E350 IonicContact NZ-OE2 2.89Å; K257-E350 PolarHBondContact NZ-OE2 2.69Å
258	D	64.2	Low	83	Confident	81 Å²	81	50.1 Å²	50.1	43%	0.433	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22	-168.7	-78.3	-33.6	0	0	0	114.5	N284 R347	D258-N284 PolarHBondContact O-ND2 2.85Å; D258-R347 IonicContact OD1-CZ 3.35Å; D258-R347 IonicContact OD1-NH1 3.46Å; D258-R347 PolarHBondContact OD1-NH1 3.19Å; D258-R347 IonicContact OD1-NH2 3.81Å
259	D	64.1	Low	83.4	Confident	162 Å²	162	45.8 Å²	45.8	87%	0.866	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-11.5	-179	-66.2	-28	0	0	0	114.2	K257	K257-D259 PolarHBondContact O-N 2.89Å; K257-D259 VanDerWaalsContact O-N 3.1Å
260	D	69.9	Low	83.5	Confident	61 Å²	61	45.8 Å²	45.8	33%	0.326	23%	0.234	S	C	.	.			trans	-91.8	133.9	-173.9	-71.2	-35.5	0	0	0	111.6	P255 K257 V262 E350	P255-D260 VanDerWaalsContact CG-O 3.25Å; P255-D260 WeakPolarHBondContact CG-O 3.38Å; K257-D260 HydrophobicContact CB-CB 4.45Å; K257-D260 WeakPolarHBondContact CB-OD2 3.26Å; K257-D260 IonicContact NZ-OD2 3.77Å; K257-D260 PolarHBondContact O-N 2.89Å; K257-D260 VanDerWaalsContact O-N 3.16Å; D260-V262 PolarHBondContact O-N 3.39Å; D260-E350 VanDerWaalsContact OD2-OE1 3.09Å
261	L	71.3	Confident	83.6	Confident	91 Å²	91	45.8 Å²	45.8	48%	0.476	23%	0.231	S	C	.	.			trans	-85.6	110.9	173.3	-174.5	72.8	0	0	0	110.2	R286	L261-R286 HydrophobicContact CD1-CG 4.43Å
262	V	75.9	Confident	83.4	Confident	14 Å²	14	46.2 Å²	46.2	9%	0.085	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.7	-177	175.3	0	0	0	0	110.5	P255 D260 R264 N284 M285 R286	P255-V262 HydrophobicContact CB-CG2 3.75Å; P255-V262 HydrophobicContact CG-CB 4.28Å; P255-V262 HydrophobicContact CG-CG2 3.92Å; D260-V262 PolarHBondContact O-N 3.39Å; V262-R264 HydrophobicContact CG1-CB 4.26Å; V262-R264 HydrophobicContact CG1-CG 3.5Å; V262-R264 VanDerWaalsContact CG1-CG 3.5Å; V262-N284 PolarHBondContact N-O 2.91Å; V262-M285 HydrophobicContact CB-CE 4.08Å; V262-M285 HydrophobicContact CB-SD 3.69Å; V262-M285 HydrophobicContact CG1-CE 3.84Å; V262-M285 HydrophobicContact CG1-SD 4.05Å; V262-M285 WeakPolarHBondContact O-CA 3.23Å; V262-R286 PolarHBondContact O-N 2.99Å
263	V	77.9	Confident	83.3	Confident	96 Å²	96	48.7 Å²	48.7	58%	0.582	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	103.7	175	-172	0	0	0	0	109.5	R286	V263-R286 CarbonylContact C-O 3.54Å; V263-R286 WeakPolarHBondContact CA-O 3.4Å; V263-R286 HydrophobicContact CG1-CB 4.44Å; V263-R286 HydrophobicContact CG2-CB 4.2Å
264	R	79.3	Confident	83.1	Confident	33 Å²	33	52.9 Å²	52.9	13%	0.125	28%	0.275	C	S	.	.			trans	-147.6	143	-177	-73.2	-64.9	-168.4	-158.9	-0.9	112.3	N228 V262 V266 M285 R286 M303	N228-R264 WeakPolarHBondContact O-CD 3.33Å; N228-R264 PolarHBondContact O-NH1 2.84Å; N228-R264 PolarHBondContact OD1-NH1 3.23Å; V262-R264 HydrophobicContact CG1-CB 4.26Å; V262-R264 HydrophobicContact CG1-CG 3.5Å; V262-R264 VanDerWaalsContact CG1-CG 3.5Å; R264-V266 HydrophobicContact CB-CG2 4.37Å; R264-M285 HydrophobicContact CB-CE 3.98Å; R264-R286 PolarHBondContact N-O 3.33Å; R264-M303 WeakPolarHBondContact O-CE 3.4Å
265	D	86.2	Confident	83	Confident	75 Å²	75	52.5 Å²	52.5	40%	0.401	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.6	167.6	-64.2	-23.3	0	0	0	109.2	R229 E230 N288	R229-D265 HydrophobicContact CG-CB 4.09Å; E230-D265 PolarHBondContact N-O 3.05Å; D265-N288 WeakPolarHBondContact CA-O 3.32Å; D265-N288 PolarHBondContact OD1-N 2.89Å
266	V	89.8	Confident	83.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.9	-175.4	-177.4	0	0	0	0	109.5	E230 L253 R264 L268 M285 N288 L289 E290 L348	E230-V266 CarbonylContact O-C 3.42Å; E230-V266 WeakPolarHBondContact O-CA 3.41Å; L253-V266 HydrophobicContact CD2-CG1 4.02Å; R264-V266 HydrophobicContact CB-CG2 4.37Å; V266-L268 HydrophobicContact CG1-CD2 4.09Å; V266-L268 HydrophobicContact CG1-CG 4.34Å; V266-M285 HydrophobicContact CG2-CE 4.48Å; V266-N288 PolarHBondContact N-O 2.81Å; V266-L289 HydrophobicContact CB-CD1 4.12Å; V266-L289 HydrophobicContact CG1-CD1 4.24Å; V266-L289 WeakPolarHBondContact O-CA 3.27Å; V266-E290 PolarHBondContact O-N 2.87Å; V266-L348 HydrophobicContact CG2-CD1 3.89Å
267	T	91.6	Very high	83.7	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.2	171.5	-54.5	0	0	0	0	110.1	R229 E230 V231 H232 E290 Y329	R229-T267 PolarHBondContact NE-OG1 3.07Å; R229-T267 PolarHBondContact NH2-OG1 2.84Å; E230-T267 PolarHBondContact O-N 3.05Å; V231-T267 CarbonylContact C-O 3.56Å; V231-T267 WeakPolarHBondContact CA-O 3.39Å; H232-T267 PolarHBondContact N-O 2.93Å; T267-E290 CarbonylContact C-O 3.55Å; T267-E290 VanDerWaalsContact CA-O 3.24Å; T267-E290 WeakPolarHBondContact CA-O 3.15Å; T267-E290 HydrophobicContact CG2-CB 4.19Å; T267-E290 HydrophobicContact CG2-CG 4.3Å; T267-Y329 HydrophobicContact CG2-CD1 3.6Å; T267-Y329 HydrophobicContact CG2-CE1 3.86Å; T267-Y329 HydrophobicContact CG2-CG 4.22Å
268	L	93.8	Very high	84.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.9	176.7	-63.4	-175.2	0	0	0	110.6	H232 V251 L253 V266 L270 V280 L289 E290 V291 V292 I346	H232-L268 HydrophobicContact CB-CD2 3.92Å; V251-L268 HydrophobicContact CG1-CD1 3.99Å; L253-L268 HydrophobicContact CD1-CD1 3.93Å; L253-L268 HydrophobicContact CD2-CD2 4.47Å; V266-L268 HydrophobicContact CG1-CD2 4.09Å; V266-L268 HydrophobicContact CG1-CG 4.34Å; L268-L270 HydrophobicContact CB-CD2 4.18Å; L268-L270 HydrophobicContact CB-CG 4.17Å; L268-V280 HydrophobicContact CD1-CG1 3.83Å; L268-V280 HydrophobicContact CD1-CG2 4.2Å; L268-L289 HydrophobicContact CG-CD1 4.47Å; L268-E290 PolarHBondContact N-O 2.82Å; L268-V291 HydrophobicContact CB-CG1 4.35Å; L268-V291 HydrophobicContact CB-CG2 4.41Å; L268-V291 HydrophobicContact CD1-CG2 4.46Å; L268-V292 PolarHBondContact O-N 3.38Å; L268-I346 HydrophobicContact CD2-CD1 3.66Å
269	V	93.9	Very high	85.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	107.3	171.1	-175.9	0	0	0	0	108.5	H232 I233 I234 V292 L313 W323	H232-V269 PolarHBondContact O-N 2.99Å; I233-V269 WeakPolarHBondContact CA-O 3.04Å; I233-V269 HydrophobicContact CB-CB 4.43Å; I233-V269 HydrophobicContact CG1-CB 4.1Å; I233-V269 HydrophobicContact CG1-CG2 4.38Å; I233-V269 HydrophobicContact CG2-CB 4.28Å; I233-V269 HydrophobicContact CG2-CG1 4.36Å; I234-V269 PolarHBondContact N-O 2.73Å; V269-V292 CarbonylContact C-O 3.53Å; V269-V292 WeakPolarHBondContact CA-O 3.13Å; V269-L313 HydrophobicContact CG1-CD1 3.96Å; V269-L313 HydrophobicContact CG1-CD2 4.1Å; V269-W323 HydrophobicContact CG1-CE3 4.39Å; V269-W323 HydrophobicContact CG1-CZ3 4.01Å; V269-W323 HydrophobicContact CG2-CZ3 4.33Å
270	L	94.5	Very high	87.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.6	-169.4	-54.3	178.8	0	0	0	111	I234 V251 L268 W278 V280 V291 V292 A293 S294 L313	I234-L270 HydrophobicContact CB-CD2 3.98Å; I234-L270 HydrophobicContact CD1-CD2 4.04Å; I234-L270 HydrophobicContact CG1-CD2 4.27Å; V251-L270 HydrophobicContact CG2-CD1 4.36Å; V251-L270 HydrophobicContact CG2-CD2 4.33Å; L268-L270 HydrophobicContact CB-CD2 4.18Å; L268-L270 HydrophobicContact CB-CG 4.17Å; L270-W278 HydrophobicContact CB-CD2 3.81Å; L270-W278 HydrophobicContact CB-CE3 4.17Å; L270-W278 HydrophobicContact CB-CG 4.25Å; L270-W278 HydrophobicContact CB-CH2 4.24Å; L270-W278 HydrophobicContact CB-CZ2 3.91Å; L270-W278 HydrophobicContact CB-CZ3 4.36Å; L270-W278 HydrophobicContact CD1-CB 3.97Å; L270-W278 HydrophobicContact CD1-CD2 3.76Å; L270-W278 HydrophobicContact CD1-CE3 3.77Å; L270-W278 HydrophobicContact CD1-CG 3.86Å; L270-W278 HydrophobicContact CD1-CZ3 4.46Å; L270-W278 HydrophobicContact CD2-CE3 4.31Å; L270-W278 HydrophobicContact CD2-CZ3 4.19Å; L270-W278 HydrophobicContact CG-CD2 4.31Å; L270-W278 HydrophobicContact CG-CE3 4.31Å; L270-V280 HydrophobicContact CD1-CG2 4.1Å; L270-V291 HydrophobicContact CD1-CG1 3.75Å; L270-V291 HydrophobicContact CG-CG1 4.37Å; L270-V292 PolarHBondContact N-O 3.41Å; L270-A293 HydrophobicContact CB-CB 4.03Å; L270-A293 VanDerWaalsContact O-CA 3.23Å; L270-A293 WeakPolarHBondContact O-CA 3.1Å; L270-S294 PolarHBondContact O-N 2.7Å; L270-L313 VanDerWaalsContact O-CD1 3.31Å; L270-L313 WeakPolarHBondContact O-CD1 3.13Å
271	R	93.1	Very high	88.1	Confident	43 Å²	43	33.7 Å²	33.7	16%	0.162	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.3	178.3	178.8	-166.9	173.7	80.6	10.4	110.2	I234 E235 L236 L313 P314 S315	I234-R271 PolarHBondContact O-N 2.87Å; E235-R271 WeakPolarHBondContact CA-O 2.8Å; E235-R271 IonicContact OE1-NE 2.7Å; L236-R271 PolarHBondContact N-O 2.91Å; R271-L313 HydrophobicContact CB-CD1 4.02Å; R271-L313 PolarHBondContact NH1-O 2.61Å; R271-P314 WeakPolarHBondContact CD-O 3.14Å; R271-P314 VanDerWaalsContact CZ-C 3.43Å; R271-P314 VanDerWaalsContact CZ-O 3.29Å; R271-P314 PolarHBondContact NE-O 2.86Å; R271-P314 PolarHBondContact NH1-O 2.95Å; R271-S315 VanDerWaalsContact NH2-CB 3.33Å
272	C	91.3	Very high	89	Confident	10 Å²	10	29.8 Å²	29.8	7%	0.068	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.8	164.3	-165.3	0	0	0	0	112	L236 K274 V276 W278 S294	L236-C272 HydrophobicContact CB-CB 4.3Å; L236-C272 CarbonylContact O-C 3.5Å; L236-C272 WeakPolarHBondContact O-CA 2.99Å; L236-C272 PolarHBondContact O-SG 3.09Å; C272-K274 VanDerWaalsContact C-N 3.3Å; C272-K274 VanDerWaalsContact CB-O 3.22Å; C272-K274 WeakPolarHBondContact CB-O 3.18Å; C272-K274 PolarHBondContact SG-N 2.93Å; C272-K274 PolarHBondContact SG-O 2.97Å; C272-V276 HydrophobicContact CB-CB 4.44Å; C272-V276 HydrophobicContact CB-CG1 4.05Å; C272-V276 HydrophobicContact CB-CG2 3.54Å; C272-W278 HydrophobicContact CB-CZ2 4.04Å; C272-S294 PolarHBondContact N-OG 3.13Å
273	A	89.7	Confident	89.5	Confident	65 Å²	65	32.6 Å²	32.6	54%	0.537	18%	0.178	S	C	.	.	S	Bend	trans	-75.1	-21.6	172.5	0	0	0	0	0	112.7	L236	L236-A273 PolarHBondContact O-N 3.36Å
274	K	87.4	Confident	89.8	Confident	90 Å²	90	31.9 Å²	31.9	39%	0.391	17%	0.171	S	C	.	.	S	Bend	trans	-107.8	160.6	171.5	-67.5	-177.5	178.1	179.1	0	109.8	A238 C272 V276	A238-K274 HydrophobicContact CB-CD 3.93Å; C272-K274 VanDerWaalsContact C-N 3.3Å; C272-K274 VanDerWaalsContact CB-O 3.22Å; C272-K274 WeakPolarHBondContact CB-O 3.18Å; C272-K274 PolarHBondContact SG-N 2.93Å; C272-K274 PolarHBondContact SG-O 2.97Å; K274-V276 PolarHBondContact O-N 3.06Å
275	S	86.6	Confident	89.6	Confident	67 Å²	67	30.5 Å²	30.5	47%	0.469	17%	0.166	S	C	.	.			trans	-72.1	124.4	174.8	-169	0	0	0	0	110.8	D295	S275-D295 WeakPolarHBondContact CA-OD1 3.49Å; S275-D295 PolarHBondContact OG-OD1 3.22Å
276	V	89.9	Confident	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	164.2	-177.9	-62.6	0	0	0	0	110.7	P239 Q246 V249 C272 K274 W278 D295	P239-V276 HydrophobicContact CB-CG1 3.99Å; P239-V276 HydrophobicContact CG-CG1 3.81Å; Q246-V276 PolarHBondContact NE2-O 2.88Å; V249-V276 HydrophobicContact CG2-CB 3.87Å; V249-V276 HydrophobicContact CG2-CG1 3.9Å; V249-V276 HydrophobicContact CG2-CG2 4.31Å; C272-V276 HydrophobicContact CB-CB 4.44Å; C272-V276 HydrophobicContact CB-CG1 4.05Å; C272-V276 HydrophobicContact CB-CG2 3.54Å; K274-V276 PolarHBondContact O-N 3.06Å; V276-W278 HydrophobicContact CG2-CD2 4.28Å; V276-W278 HydrophobicContact CG2-CG 4.47Å; V276-W278 HydrophobicContact CG2-CZ2 3.99Å; V276-D295 HydrophobicContact CG2-CB 4.34Å; V276-D295 WeakPolarHBondContact O-CB 3.49Å
277	H	90.4	Very high	88.8	Confident	37 Å²	37	34.6 Å²	34.6	17%	0.171	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.5	168.3	-178	41.9	0	0	0	109	Q246 V247 D248 V249 T296 T298	Q246-H277 HydrophobicContact CG-CB 4.15Å; V247-H277 PolarHBondContact O-N 2.93Å; D248-H277 CarbonylContact C-O 3.52Å; D248-H277 VanDerWaalsContact CA-O 3.27Å; D248-H277 WeakPolarHBondContact CA-O 3.45Å; D248-H277 WeakPolarHBondContact OD1-CB 3.36Å; D248-H277 IonicContact OD1-CD2 2.68Å; D248-H277 PolarHBondContact OD1-CD2 2.78Å; D248-H277 IonicContact OD1-CG 2.67Å; V249-H277 PolarHBondContact N-O 3.17Å; H277-T296 WeakPolarHBondContact ND1-CB 3.45Å; H277-T296 PolarHBondContact ND1-O 2.82Å; H277-T296 PolarHBondContact ND1-OG1 2.78Å; H277-T298 PolarHBondContact CE1-OG1 2.97Å; H277-T298 PolarHBondContact NE2-OG1 3.18Å
278	W	91.9	Very high	88.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	127.5	179.9	-64	96.6	0	0	0	110.3	I234 L236 V249 V251 L270 C272 V276 T296 V297 T298 F344	I234-W278 HydrophobicContact CG2-CH2 4.37Å; L236-W278 HydrophobicContact CB-CH2 4.19Å; L236-W278 HydrophobicContact CD2-CH2 4.33Å; V249-W278 HydrophobicContact CB-CD2 4.44Å; V249-W278 HydrophobicContact CB-CE3 3.91Å; V249-W278 HydrophobicContact CB-CZ3 4.06Å; V249-W278 HydrophobicContact CG1-CE3 3.66Å; V249-W278 HydrophobicContact CG1-CH2 4.07Å; V249-W278 HydrophobicContact CG1-CZ3 3.37Å; V249-W278 WeakPolarHBondContact O-CA 3.48Å; V251-W278 HydrophobicContact CG2-CE3 3.81Å; V251-W278 HydrophobicContact CG2-CZ3 4Å; L270-W278 HydrophobicContact CB-CD2 3.81Å; L270-W278 HydrophobicContact CB-CE3 4.17Å; L270-W278 HydrophobicContact CB-CG 4.25Å; L270-W278 HydrophobicContact CB-CH2 4.24Å; L270-W278 HydrophobicContact CB-CZ2 3.91Å; L270-W278 HydrophobicContact CB-CZ3 4.36Å; L270-W278 HydrophobicContact CD1-CB 3.97Å; L270-W278 HydrophobicContact CD1-CD2 3.76Å; L270-W278 HydrophobicContact CD1-CE3 3.77Å; L270-W278 HydrophobicContact CD1-CG 3.86Å; L270-W278 HydrophobicContact CD1-CZ3 4.46Å; L270-W278 HydrophobicContact CD2-CE3 4.31Å; L270-W278 HydrophobicContact CD2-CZ3 4.19Å; L270-W278 HydrophobicContact CG-CD2 4.31Å; L270-W278 HydrophobicContact CG-CE3 4.31Å; C272-W278 HydrophobicContact CB-CZ2 4.04Å; V276-W278 HydrophobicContact CG2-CD2 4.28Å; V276-W278 HydrophobicContact CG2-CG 4.47Å; V276-W278 HydrophobicContact CG2-CZ2 3.99Å; W278-T296 PolarHBondContact N-O 2.98Å; W278-V297 HydrophobicContact CB-CG1 4.48Å; W278-V297 HydrophobicContact CB-CG2 4.22Å; W278-V297 CarbonylContact O-C 3.48Å; W278-V297 VanDerWaalsContact O-CA 3.32Å; W278-V297 WeakPolarHBondContact O-CA 3.42Å; W278-T298 PolarHBondContact O-N 2.82Å; W278-F344 HydrophobicContact CH2-CE2 4.49Å; W278-F344 HydrophobicContact CZ3-CD2 4.32Å; W278-F344 HydrophobicContact CZ3-CE2 4.25Å
279	V	92.3	Very high	88.4	Confident	17 Å²	17	37.1 Å²	37.1	10%	0.103	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	102.8	175.3	-177.9	0	0	0	0	108.4	D248 V249 I250 V251 K281 T298	D248-V279 HydrophobicContact CB-CG2 4.21Å; V249-V279 PolarHBondContact O-N 2.91Å; I250-V279 CarbonylContact C-O 3.46Å; I250-V279 WeakPolarHBondContact CA-O 2.99Å; I250-V279 HydrophobicContact CG1-CB 4.31Å; V251-V279 PolarHBondContact N-O 2.77Å; V279-K281 HydrophobicContact CG1-CG 4.37Å; V279-T298 CarbonylContact C-O 3.4Å; V279-T298 WeakPolarHBondContact CA-O 3.45Å
280	V	92.4	Very high	88.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.5	-178.5	-176.4	0	0	0	0	109.2	V251 L253 L268 L270 L289 V291 V297 T298 I299 N300	V251-V280 HydrophobicContact CB-CG2 4.35Å; V251-V280 CarbonylContact O-C 3.55Å; V251-V280 WeakPolarHBondContact O-CA 3.13Å; L253-V280 HydrophobicContact CD1-CG1 3.62Å; L268-V280 HydrophobicContact CD1-CG1 3.83Å; L268-V280 HydrophobicContact CD1-CG2 4.2Å; L270-V280 HydrophobicContact CD1-CG2 4.1Å; V280-L289 HydrophobicContact CG1-CD2 4.05Å; V280-V291 HydrophobicContact CG2-CG1 4.26Å; V280-V291 HydrophobicContact CG2-CG2 4.21Å; V280-V297 HydrophobicContact CG2-CG1 4.24Å; V280-T298 PolarHBondContact N-O 3.06Å; V280-I299 HydrophobicContact CB-CG1 4.43Å; V280-I299 HydrophobicContact CB-CG2 4.42Å; V280-I299 WeakPolarHBondContact O-CA 3.39Å; V280-N300 PolarHBondContact O-N 2.75Å
281	K	91.6	Very high	88.1	Confident	67 Å²	67	38.9 Å²	38.9	29%	0.291	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.8	177.8	-60.4	-179.1	-178.5	178.3	0	108.4	I250 V251 L253 V279 N300	I250-K281 HydrophobicContact CG2-CD 4.2Å; V251-K281 PolarHBondContact O-N 2.82Å; L253-K281 PolarHBondContact N-O 2.81Å; V279-K281 HydrophobicContact CG1-CG 4.37Å; K281-N300 WeakPolarHBondContact CA-O 3.33Å; K281-N300 HydrophobicContact CG-CB 4.41Å
282	A	89.3	Confident	88	Confident	9 Å²	9	36.8 Å²	36.8	7%	0.074	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.1	174	0	0	0	0	0	110.6	L253 N300 S301 M303	L253-A282 HydrophobicContact CB-CB 3.95Å; L253-A282 HydrophobicContact CD1-CB 4.15Å; L253-A282 WeakPolarHBondContact O-CA 3.44Å; A282-N300 PolarHBondContact N-O 2.73Å; A282-S301 WeakPolarHBondContact CB-OG 3.15Å; A282-M303 HydrophobicContact CB-SD 4.13Å
283	H	87.2	Confident	88	Confident	73 Å²	73	36.4 Å²	36.4	34%	0.338	19%	0.193	S	C	.	.			trans	-123.5	135.2	-177.1	-57.4	-80.8	0	0	0	110.1	D252 L253 R254 P255 M285	D252-H283 IonicContact OD1-CD2 3.04Å; D252-H283 PolarHBondContact OD1-CD2 2.87Å; D252-H283 IonicContact OD1-NE2 3.69Å; L253-H283 PolarHBondContact O-N 2.84Å; R254-H283 HydrophobicContact CG-CB 4.31Å; P255-H283 VanDerWaalsContact CD-O 3.29Å; P255-H283 WeakPolarHBondContact CD-O 3.47Å; H283-M285 WeakPolarHBondContact O-CG 3.27Å; H283-M285 PolarHBondContact O-N 3.02Å
284	N	82.6	Confident	87.6	Confident	81 Å²	81	34.8 Å²	34.8	43%	0.433	18%	0.177	S	C	.	.	S	Bend	trans	55.1	36.8	177.8	-60.5	-9.1	0	0	0	113.9	P255 D258 V262	P255-N284 HydrophobicContact CG-CB 4.17Å; D258-N284 PolarHBondContact O-ND2 2.85Å; V262-N284 PolarHBondContact N-O 2.91Å
285	M	76.3	Confident	87.6	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.02	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.5	-179.4	-65.5	-66.3	-54.1	0	0	110.9	P255 V262 R264 V266 H283 M303 L348	P255-M285 HydrophobicContact CG-SD 3.9Å; V262-M285 HydrophobicContact CB-CE 4.08Å; V262-M285 HydrophobicContact CB-SD 3.69Å; V262-M285 HydrophobicContact CG1-CE 3.84Å; V262-M285 HydrophobicContact CG1-SD 4.05Å; V262-M285 WeakPolarHBondContact O-CA 3.23Å; R264-M285 HydrophobicContact CB-CE 3.98Å; V266-M285 HydrophobicContact CG2-CE 4.48Å; H283-M285 WeakPolarHBondContact O-CG 3.27Å; H283-M285 PolarHBondContact O-N 3.02Å; M285-M303 HydrophobicContact CB-CE 4.32Å; M285-M303 HydrophobicContact CB-CG 4.17Å; M285-M303 HydrophobicContact CB-SD 3.67Å; M285-M303 WeakPolarHBondContact O-CG 3.47Å; M285-L348 HydrophobicContact CE-CD1 3.17Å; M285-L348 HydrophobicContact SD-CD1 3.67Å
286	R	76.9	Confident	87.6	Confident	142 Å²	142	29.9 Å²	29.9	54%	0.536	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.3	168.3	-75.9	-165.4	-75.1	-166	-4.9	110.3	L261 V262 V263 R264	L261-R286 HydrophobicContact CD1-CG 4.43Å; V262-R286 PolarHBondContact O-N 2.99Å; V263-R286 CarbonylContact C-O 3.54Å; V263-R286 WeakPolarHBondContact CA-O 3.4Å; V263-R286 HydrophobicContact CG1-CB 4.44Å; V263-R286 HydrophobicContact CG2-CB 4.2Å; R264-R286 PolarHBondContact N-O 3.33Å
287	G	82.8	Confident	87.5	Confident	20 Å²	20	31.7 Å²	31.7	21%	0.206	16%	0.163	C	C	.	.	S	Bend	trans	138.2	-167.5	-178.4	0	0	0	0	0	111.9	M303 V304	G287-M303 WeakPolarHBondContact O-CB 3.46Å; G287-V304 PolarHBondContact O-N 2.92Å
288	N	86.3	Confident	87.5	Confident	54 Å²	54	32.7 Å²	32.7	29%	0.289	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.8	173.2	-171.2	32	0	0	0	110.6	D265 V266 V304 T306	D265-N288 WeakPolarHBondContact CA-O 3.32Å; D265-N288 PolarHBondContact OD1-N 2.89Å; V266-N288 PolarHBondContact N-O 2.81Å; N288-V304 PolarHBondContact OD1-O 3.35Å; N288-V304 VanDerWaalsContact OD1-O 3.09Å; N288-T306 PolarHBondContact OD1-OG1 2.86Å
289	L	89.6	Confident	87.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	108.7	174	177.6	60.5	0	0	0	109.2	L253 V266 L268 V280 V291 I299 M303 V304 T306	L253-L289 HydrophobicContact CD1-CD1 3.94Å; L253-L289 HydrophobicContact CD1-CD2 4.29Å; V266-L289 HydrophobicContact CB-CD1 4.12Å; V266-L289 HydrophobicContact CG1-CD1 4.24Å; V266-L289 WeakPolarHBondContact O-CA 3.27Å; L268-L289 HydrophobicContact CG-CD1 4.47Å; V280-L289 HydrophobicContact CG1-CD2 4.05Å; L289-V291 HydrophobicContact CD1-CG2 4.2Å; L289-V291 HydrophobicContact CG-CG2 4.09Å; L289-I299 HydrophobicContact CD2-CG2 3.69Å; L289-M303 HydrophobicContact CB-CB 4Å; L289-M303 HydrophobicContact CB-CE 4.42Å; L289-M303 HydrophobicContact CB-SD 4.03Å; L289-V304 PolarHBondContact N-O 3.45Å; L289-T306 PolarHBondContact O-N 2.9Å
290	E	90.8	Very high	86.9	Confident	36 Å²	36	37.1 Å²	37.1	17%	0.168	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.3	177.6	-174.5	171.6	-159.7	0	0	110.1	R229 V266 T267 L268 T306 Y329	R229-E290 IonicContact NH2-OE2 3.51Å; R229-E290 PolarHBondContact NH2-OE2 2.79Å; V266-E290 PolarHBondContact O-N 2.87Å; T267-E290 CarbonylContact C-O 3.55Å; T267-E290 VanDerWaalsContact CA-O 3.24Å; T267-E290 WeakPolarHBondContact CA-O 3.15Å; T267-E290 HydrophobicContact CG2-CB 4.19Å; T267-E290 HydrophobicContact CG2-CG 4.3Å; L268-E290 PolarHBondContact N-O 2.82Å; E290-T306 WeakPolarHBondContact CA-O 3.35Å; E290-Y329 PolarHBondContact OE1-OH 3.21Å; E290-Y329 WeakPolarHBondContact OE2-CE1 3.22Å
291	V	91.2	Very high	86.3	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.6	-179.7	-172.8	0	0	0	0	110.4	L268 L270 V280 L289 V297 I299 T306 S308	L268-V291 HydrophobicContact CB-CG1 4.35Å; L268-V291 HydrophobicContact CB-CG2 4.41Å; L268-V291 HydrophobicContact CD1-CG2 4.46Å; L270-V291 HydrophobicContact CD1-CG1 3.75Å; L270-V291 HydrophobicContact CG-CG1 4.37Å; V280-V291 HydrophobicContact CG2-CG1 4.26Å; V280-V291 HydrophobicContact CG2-CG2 4.21Å; L289-V291 HydrophobicContact CD1-CG2 4.2Å; L289-V291 HydrophobicContact CG-CG2 4.09Å; V291-V297 HydrophobicContact CB-CG1 4.29Å; V291-V297 HydrophobicContact CG1-CG1 3.78Å; V291-V297 HydrophobicContact CG1-CG2 4.12Å; V291-I299 HydrophobicContact CB-CD1 4.06Å; V291-I299 HydrophobicContact CG2-CD1 3.56Å; V291-I299 HydrophobicContact CG2-CG1 4.27Å; V291-T306 PolarHBondContact N-O 2.65Å; V291-S308 PolarHBondContact O-N 3.2Å; V291-S308 VanDerWaalsContact O-N 3.14Å; V291-S308 PolarHBondContact O-OG 2.98Å
292	V	91.5	Very high	85.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.8	176.2	-177.9	0	0	0	0	109.3	L268 V269 L270 S308 Q311 L313 W323 Y329	L268-V292 PolarHBondContact O-N 3.38Å; V269-V292 CarbonylContact C-O 3.53Å; V269-V292 WeakPolarHBondContact CA-O 3.13Å; L270-V292 PolarHBondContact N-O 3.41Å; V292-S308 WeakPolarHBondContact CA-OG 3.32Å; V292-Q311 HydrophobicContact CG1-CB 4.22Å; V292-L313 HydrophobicContact CG1-CD2 4.14Å; V292-W323 HydrophobicContact CG1-CH2 3.79Å; V292-W323 HydrophobicContact CG1-CZ3 4.32Å; V292-Y329 HydrophobicContact CG2-CE1 4.48Å; V292-Y329 HydrophobicContact CG2-CE2 4.15Å; V292-Y329 WeakPolarHBondContact CG2-OH 3.34Å
293	A	90.4	Very high	84.9	Confident	2 Å²	2	43.4 Å²	43.4	2%	0.017	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.8	-179.7	0	0	0	0	0	113.9	L270 D295 V297 Q311	L270-A293 HydrophobicContact CB-CB 4.03Å; L270-A293 VanDerWaalsContact O-CA 3.23Å; L270-A293 WeakPolarHBondContact O-CA 3.1Å; A293-D295 VanDerWaalsContact C-N 3.28Å; A293-V297 HydrophobicContact CB-CG2 3.39Å; A293-Q311 PolarHBondContact O-N 2.94Å
294	S	83.3	Confident	84.4	Confident	30 Å²	30	44.8 Å²	44.8	21%	0.21	24%	0.24	C	C	.	.	S	Bend	trans	-69	-27.9	167.6	50.3	0	0	0	0	113.2	L270 C272 Q311	L270-S294 PolarHBondContact O-N 2.7Å; C272-S294 PolarHBondContact N-OG 3.13Å; S294-Q311 WeakPolarHBondContact CA-O 3.23Å
295	D	85.7	Confident	84.4	Confident	21 Å²	21	45 Å²	45	11%	0.112	24%	0.238	C	C	.	.	S	Bend	trans	-119.4	-172.9	-171.7	-57.8	-91	0	0	0	112	S275 V276 A293	S275-D295 WeakPolarHBondContact CA-OD1 3.49Å; S275-D295 PolarHBondContact OG-OD1 3.22Å; V276-D295 HydrophobicContact CG2-CB 4.34Å; V276-D295 WeakPolarHBondContact O-CB 3.49Å; A293-D295 VanDerWaalsContact C-N 3.28Å
296	T	86.9	Confident	84.5	Confident	34 Å²	34	47.6 Å²	47.6	21%	0.209	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.4	179	47.8	0	0	0	0	111.7	Q246 H277 W278	Q246-T296 PolarHBondContact NE2-OG1 2.82Å; H277-T296 WeakPolarHBondContact ND1-CB 3.45Å; H277-T296 PolarHBondContact ND1-O 2.82Å; H277-T296 PolarHBondContact ND1-OG1 2.78Å; W278-T296 PolarHBondContact N-O 2.98Å
297	V	89.3	Confident	84.4	Confident	38 Å²	38	44.9 Å²	44.9	23%	0.23	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.7	-179.9	-174.5	0	0	0	0	109.7	W278 V280 V291 A293 I299	W278-V297 HydrophobicContact CB-CG1 4.48Å; W278-V297 HydrophobicContact CB-CG2 4.22Å; W278-V297 CarbonylContact O-C 3.48Å; W278-V297 VanDerWaalsContact O-CA 3.32Å; W278-V297 WeakPolarHBondContact O-CA 3.42Å; V280-V297 HydrophobicContact CG2-CG1 4.24Å; V291-V297 HydrophobicContact CB-CG1 4.29Å; V291-V297 HydrophobicContact CG1-CG1 3.78Å; V291-V297 HydrophobicContact CG1-CG2 4.12Å; A293-V297 HydrophobicContact CB-CG2 3.39Å; V297-I299 HydrophobicContact CG1-CD1 4.49Å; V297-I299 HydrophobicContact CG1-CG1 3.84Å
298	T	88.8	Confident	83.9	Confident	58 Å²	58	45.4 Å²	45.4	36%	0.356	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.6	163.6	-62.7	0	0	0	0	107.7	H277 W278 V279 V280	H277-T298 PolarHBondContact CE1-OG1 2.97Å; H277-T298 PolarHBondContact NE2-OG1 3.18Å; W278-T298 PolarHBondContact O-N 2.82Å; V279-T298 CarbonylContact C-O 3.4Å; V279-T298 WeakPolarHBondContact CA-O 3.45Å; V280-T298 PolarHBondContact N-O 3.06Å
299	I	88.1	Confident	83	Confident	18 Å²	18	48.3 Å²	48.3	9%	0.092	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.1	178.4	-50.9	-177.4	0	0	0	108.6	V280 L289 V291 V297 E305 T307	V280-I299 HydrophobicContact CB-CG1 4.43Å; V280-I299 HydrophobicContact CB-CG2 4.42Å; V280-I299 WeakPolarHBondContact O-CA 3.39Å; L289-I299 HydrophobicContact CD2-CG2 3.69Å; V291-I299 HydrophobicContact CB-CD1 4.06Å; V291-I299 HydrophobicContact CG2-CD1 3.56Å; V291-I299 HydrophobicContact CG2-CG1 4.27Å; V297-I299 HydrophobicContact CG1-CD1 4.49Å; V297-I299 HydrophobicContact CG1-CG1 3.84Å; I299-E305 HydrophobicContact CB-CG 4.45Å; I299-E305 WeakPolarHBondContact CB-OE2 3.31Å; I299-E305 HydrophobicContact CD1-CB 4.34Å; I299-E305 HydrophobicContact CG2-CG 3.89Å; I299-E305 WeakPolarHBondContact CG2-OE1 3.32Å; I299-T307 HydrophobicContact CD1-CG2 3.37Å; I299-T307 HydrophobicContact CG1-CG2 3.97Å
300	N	84.5	Confident	82.3	Confident	92 Å²	92	56.8 Å²	56.8	49%	0.492	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	89.1	171.4	-67.4	6	0	0	0	107.6	V280 K281 A282	V280-N300 PolarHBondContact O-N 2.75Å; K281-N300 WeakPolarHBondContact CA-O 3.33Å; K281-N300 HydrophobicContact CG-CB 4.41Å; A282-N300 PolarHBondContact N-O 2.73Å
301	S	80.3	Confident	81.8	Confident	28 Å²	28	57.8 Å²	57.8	20%	0.196	31%	0.313	C	S	.	.			trans	-138.6	159.5	-177.2	-171.8	0	0	0	0	112.4	A282 M303 E305	A282-S301 WeakPolarHBondContact CB-OG 3.15Å; S301-M303 VanDerWaalsContact C-N 3.35Å; S301-M303 WeakPolarHBondContact OG-CB 3.15Å; S301-M303 VanDerWaalsContact OG-CG 3.26Å; S301-M303 WeakPolarHBondContact OG-CG 3.17Å; S301-M303 PolarHBondContact OG-N 3.03Å; S301-E305 WeakPolarHBondContact CA-OE1 3.43Å; S301-E305 WeakPolarHBondContact CB-OE1 3.37Å; S301-E305 PolarHBondContact N-OE1 2.96Å
302	Q	72.9	Confident	81.3	Confident	166 Å²	166	65.8 Å²	65.8	78%	0.776	35%	0.354	S	S	*	.	S	Bend	trans	-93.4	2	164.9	-65.4	-179.5	-11.3	0	0	112
303	M	77.9	Confident	81.2	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.069	36%	0.357	C	S	.	.	S	Bend	trans	-80.9	166.5	177.5	-62.2	178.8	85.2	0	0	111.3	R264 A282 M285 G287 L289 S301 E305	R264-M303 WeakPolarHBondContact O-CE 3.4Å; A282-M303 HydrophobicContact CB-SD 4.13Å; M285-M303 HydrophobicContact CB-CE 4.32Å; M285-M303 HydrophobicContact CB-CG 4.17Å; M285-M303 HydrophobicContact CB-SD 3.67Å; M285-M303 WeakPolarHBondContact O-CG 3.47Å; G287-M303 WeakPolarHBondContact O-CB 3.46Å; L289-M303 HydrophobicContact CB-CB 4Å; L289-M303 HydrophobicContact CB-CE 4.42Å; L289-M303 HydrophobicContact CB-SD 4.03Å; S301-M303 VanDerWaalsContact C-N 3.35Å; S301-M303 WeakPolarHBondContact OG-CB 3.15Å; S301-M303 VanDerWaalsContact OG-CG 3.26Å; S301-M303 WeakPolarHBondContact OG-CG 3.17Å; S301-M303 PolarHBondContact OG-N 3.03Å; M303-E305 WeakPolarHBondContact O-CG 3.34Å; M303-E305 PolarHBondContact O-N 3.25Å
304	V	75.9	Confident	81.1	Confident	102 Å²	102	68.1 Å²	68.1	62%	0.618	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	116.2	169.3	179.8	0	0	0	0	107.6	G287 N288 L289	G287-V304 PolarHBondContact O-N 2.92Å; N288-V304 PolarHBondContact OD1-O 3.35Å; N288-V304 VanDerWaalsContact OD1-O 3.09Å; L289-V304 PolarHBondContact N-O 3.45Å
305	E	82.6	Confident	81.3	Confident	84 Å²	84	70.6 Å²	70.6	39%	0.393	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.1	-170.4	-57.8	-178.6	172.3	0	0	111.6	I299 S301 M303	I299-E305 HydrophobicContact CB-CG 4.45Å; I299-E305 WeakPolarHBondContact CB-OE2 3.31Å; I299-E305 HydrophobicContact CD1-CB 4.34Å; I299-E305 HydrophobicContact CG2-CG 3.89Å; I299-E305 WeakPolarHBondContact CG2-OE1 3.32Å; S301-E305 WeakPolarHBondContact CA-OE1 3.43Å; S301-E305 WeakPolarHBondContact CB-OE1 3.37Å; S301-E305 PolarHBondContact N-OE1 2.96Å; M303-E305 WeakPolarHBondContact O-CG 3.34Å; M303-E305 PolarHBondContact O-N 3.25Å
306	T	78.7	Confident	81.2	Confident	59 Å²	59	70.9 Å²	70.9	36%	0.362	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.7	169.9	-53.6	0	0	0	0	108.9	N288 L289 E290 V291	N288-T306 PolarHBondContact OD1-OG1 2.86Å; L289-T306 PolarHBondContact O-N 2.9Å; E290-T306 WeakPolarHBondContact CA-O 3.35Å; V291-T306 PolarHBondContact N-O 2.65Å
307	T	76.2	Confident	81.2	Confident	86 Å²	86	70.1 Å²	70.1	53%	0.528	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.7	171.8	49.5	0	0	0	0	109.7	I299	I299-T307 HydrophobicContact CD1-CG2 3.37Å; I299-T307 HydrophobicContact CG1-CG2 3.97Å
308	S	71.8	Confident	81.1	Confident	30 Å²	30	74.3 Å²	74.3	21%	0.21	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-80	146.7	170.4	71.9	0	0	0	0	110.1	V291 V292	V291-S308 PolarHBondContact O-N 3.2Å; V291-S308 VanDerWaalsContact O-N 3.14Å; V291-S308 PolarHBondContact O-OG 2.98Å; V292-S308 WeakPolarHBondContact CA-OG 3.32Å
309	P	67.3	Low	81	Confident	116 Å²	116	73.5 Å²	73.5	75%	0.753	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-56.3	153.2	168.8	24.4	-32.6	0	0	0	110.6	Q311	P309-Q311 PolarHBondContact O-N 2.83Å
310	R	74.2	Confident	81.1	Confident	178 Å²	178	72.7 Å²	72.7	67%	0.672	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-47.5	116	-176.6	-70.1	-170.3	-167.9	179.6	7.2	110.6
311	Q	79.6	Confident	81.2	Confident	57 Å²	57	69 Å²	69	27%	0.266	38%	0.382	S	S	.	.			trans	-109.1	134.7	-171.6	-155.1	165.9	28.4	0	0	110.7	V292 A293 S294 P309 L313 W323	V292-Q311 HydrophobicContact CG1-CB 4.22Å; A293-Q311 PolarHBondContact O-N 2.94Å; S294-Q311 WeakPolarHBondContact CA-O 3.23Å; P309-Q311 PolarHBondContact O-N 2.83Å; Q311-L313 PolarHBondContact O-N 2.91Å; Q311-W323 HydrophobicContact CG-CZ2 4.11Å
312	L	81.3	Confident	81.6	Confident	169 Å²	169	73.8 Å²	73.8	89%	0.885	40%	0.4	S	S	*	.			trans	-76.4	93	177	-168	76.3	0	0	0	109.5
313	L	88.9	Confident	82.4	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.052	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-75.9	150.5	177.4	-61.4	175.6	0	0	0	110.6	V269 L270 R271 V292 Q311 L320 W323	V269-L313 HydrophobicContact CG1-CD1 3.96Å; V269-L313 HydrophobicContact CG1-CD2 4.1Å; L270-L313 VanDerWaalsContact O-CD1 3.31Å; L270-L313 WeakPolarHBondContact O-CD1 3.13Å; R271-L313 HydrophobicContact CB-CD1 4.02Å; R271-L313 PolarHBondContact NH1-O 2.61Å; V292-L313 HydrophobicContact CG1-CD2 4.14Å; Q311-L313 PolarHBondContact O-N 2.91Å; L313-L320 HydrophobicContact CB-CD2 4.07Å; L313-W323 HydrophobicContact CD2-CD2 4.03Å; L313-W323 HydrophobicContact CD2-CE3 3.83Å; L313-W323 HydrophobicContact CD2-CH2 3.67Å; L313-W323 HydrophobicContact CD2-CZ2 3.81Å; L313-W323 HydrophobicContact CD2-CZ3 3.64Å
314	P	89.9	Confident	83	Confident	40 Å²	40	66.8 Å²	66.8	26%	0.26	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-82.2	157.8	170.8	32.8	-35.7	0	0	0	112.5	R271 A319 L320 W323	R271-P314 WeakPolarHBondContact CD-O 3.14Å; R271-P314 VanDerWaalsContact CZ-C 3.43Å; R271-P314 VanDerWaalsContact CZ-O 3.29Å; R271-P314 PolarHBondContact NE-O 2.86Å; R271-P314 PolarHBondContact NH1-O 2.95Å; P314-A319 HydrophobicContact CB-CB 3.86Å; P314-A319 HydrophobicContact CG-CB 4.11Å; P314-L320 HydrophobicContact CG-CD2 4.15Å; P314-L320 HydrophobicContact CG-CG 4.41Å; P314-L320 WeakPolarHBondContact O-CD2 3.33Å; P314-L320 WeakPolarHBondContact O-CG 3.35Å; P314-W323 HydrophobicContact CG-CB 3.77Å; P314-W323 HydrophobicContact CG-CG 4.02Å
315	S	86.2	Confident	83.5	Confident	82 Å²	82	64.9 Å²	64.9	57%	0.573	35%	0.354	S	S	*	.	S	Bend	trans	-89.6	145.3	176	42.9	0	0	0	0	112.6	R271	R271-S315 VanDerWaalsContact NH2-CB 3.33Å
316	G	85	Confident	83.8	Confident	27 Å²	27	67 Å²	67	28%	0.278	36%	0.364	S	S	.	.	S	Bend	trans	91.1	149.2	173	0	0	0	0	0	113.5	E235 Q318 A319 L320	E235-G316 PolarHBondContact OE1-N 3Å; G316-Q318 PolarHBondContact O-N 3.17Å; G316-A319 PolarHBondContact O-N 3.2Å; G316-L320 PolarHBondContact O-N 3.37Å
317	S	86.6	Confident	84.2	Confident	18 Å²	18	67.6 Å²	67.6	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-56.5	-50.1	-169.7	58.7	0	0	0	0	113.8	A319 L320 I321 Y335	S317-A319 VanDerWaalsContact C-N 3.34Å; S317-A319 PolarHBondContact O-N 3.26Å; S317-L320 PolarHBondContact O-N 2.87Å; S317-I321 WeakPolarHBondContact O-CB 3.07Å; S317-I321 WeakPolarHBondContact O-CD1 3.49Å; S317-I321 WeakPolarHBondContact O-CG1 3.08Å; S317-I321 PolarHBondContact O-N 3.44Å; S317-Y335 VanDerWaalsContact CA-OH 3.29Å; S317-Y335 WeakPolarHBondContact CA-OH 3.22Å; S317-Y335 VanDerWaalsContact CB-CE1 3.42Å; S317-Y335 PolarHBondContact N-OH 2.82Å
318	Q	86.1	Confident	84.6	Confident	127 Å²	127	66 Å²	66	59%	0.593	37%	0.366	S	S	*	.	H	α-helix	trans	-63.9	-40.3	-177.5	-65.3	179.5	-8.1	0	0	112.1	S26 G316 K322	S26-Q318 VanDerWaalsContact CB-NE2 3.25Å; G316-Q318 PolarHBondContact O-N 3.17Å; Q318-K322 WeakPolarHBondContact O-CB 3.24Å; Q318-K322 PolarHBondContact O-N 2.83Å
319	A	87.1	Confident	85.2	Confident	41 Å²	41	65.8 Å²	65.8	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-71.8	-40.9	-178.9	0	0	0	0	0	111.4	P314 G316 S317 W323	P314-A319 HydrophobicContact CB-CB 3.86Å; P314-A319 HydrophobicContact CG-CB 4.11Å; G316-A319 PolarHBondContact O-N 3.2Å; S317-A319 VanDerWaalsContact C-N 3.34Å; S317-A319 PolarHBondContact O-N 3.26Å; A319-W323 WeakPolarHBondContact O-CB 3.44Å; A319-W323 PolarHBondContact O-N 2.89Å
320	L	89.8	Confident	85.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-44.5	176.5	-79.5	167.2	0	0	0	112.7	I233 E235 L313 P314 G316 S317 W323 A324 Y335	I233-L320 HydrophobicContact CG2-CB 4.13Å; I233-L320 HydrophobicContact CG2-CD1 4.24Å; E235-L320 HydrophobicContact CB-CD1 4.11Å; E235-L320 HydrophobicContact CG-CD1 4.36Å; L313-L320 HydrophobicContact CB-CD2 4.07Å; P314-L320 HydrophobicContact CG-CD2 4.15Å; P314-L320 HydrophobicContact CG-CG 4.41Å; P314-L320 WeakPolarHBondContact O-CD2 3.33Å; P314-L320 WeakPolarHBondContact O-CG 3.35Å; G316-L320 PolarHBondContact O-N 3.37Å; S317-L320 PolarHBondContact O-N 2.87Å; L320-W323 PolarHBondContact O-N 3.09Å; L320-A324 WeakPolarHBondContact O-CB 3.4Å; L320-A324 PolarHBondContact O-N 3.2Å; L320-Y335 HydrophobicContact CB-CE2 4.36Å; L320-Y335 HydrophobicContact CD1-CE2 3.99Å
321	I	87.7	Confident	86.2	Confident	15 Å²	15	58.9 Å²	58.9	8%	0.077	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-45.7	177.4	-67.6	162.9	0	0	0	109.8	C28 L224 I233 S317 W323 A324 V325 V332 Y335	C28-I321 HydrophobicContact CB-CD1 3.66Å; L224-I321 HydrophobicContact CD1-CD1 4.1Å; L224-I321 HydrophobicContact CD1-CG1 4.4Å; L224-I321 HydrophobicContact CD1-CG2 4.22Å; I233-I321 HydrophobicContact CD1-CG1 4.09Å; S317-I321 WeakPolarHBondContact O-CB 3.07Å; S317-I321 WeakPolarHBondContact O-CD1 3.49Å; S317-I321 WeakPolarHBondContact O-CG1 3.08Å; S317-I321 PolarHBondContact O-N 3.44Å; I321-W323 PolarHBondContact O-N 2.9Å; I321-A324 PolarHBondContact O-N 2.82Å; I321-V325 WeakPolarHBondContact O-CG2 3.29Å; I321-V325 PolarHBondContact O-N 2.85Å; I321-V325 VanDerWaalsContact O-N 3.12Å; I321-V332 HydrophobicContact CG2-CG2 4.37Å; I321-Y335 HydrophobicContact CD1-CD2 4.36Å; I321-Y335 HydrophobicContact CD1-CG 4.29Å; I321-Y335 HydrophobicContact CG1-CD2 4.22Å
322	K	87.9	Confident	86.6	Confident	129 Å²	129	56.5 Å²	56.5	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-60.4	-46.2	176.3	-179.8	176.2	171.1	-179.7	0	111.5	Q318 A324 V325 E326	Q318-K322 WeakPolarHBondContact O-CB 3.24Å; Q318-K322 PolarHBondContact O-N 2.83Å; K322-A324 VanDerWaalsContact C-N 3.34Å; K322-A324 PolarHBondContact O-N 2.87Å; K322-V325 PolarHBondContact O-N 2.96Å; K322-E326 WeakPolarHBondContact CE-OE1 3.25Å; K322-E326 HydrophobicContact CG-CG 4.43Å; K322-E326 IonicContact NZ-OE1 2.75Å; K322-E326 WeakPolarHBondContact O-CG 3.38Å; K322-E326 PolarHBondContact O-N 3.17Å
323	W	90.6	Very high	86.9	Confident	32 Å²	32	48.6 Å²	48.6	12%	0.121	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-42.5	178	177.8	90.4	0	0	0	112.1	V269 V292 Q311 L313 P314 A319 L320 I321 V325 E326 N327 Y329	V269-W323 HydrophobicContact CG1-CE3 4.39Å; V269-W323 HydrophobicContact CG1-CZ3 4.01Å; V269-W323 HydrophobicContact CG2-CZ3 4.33Å; V292-W323 HydrophobicContact CG1-CH2 3.79Å; V292-W323 HydrophobicContact CG1-CZ3 4.32Å; Q311-W323 HydrophobicContact CG-CZ2 4.11Å; L313-W323 HydrophobicContact CD2-CD2 4.03Å; L313-W323 HydrophobicContact CD2-CE3 3.83Å; L313-W323 HydrophobicContact CD2-CH2 3.67Å; L313-W323 HydrophobicContact CD2-CZ2 3.81Å; L313-W323 HydrophobicContact CD2-CZ3 3.64Å; P314-W323 HydrophobicContact CG-CB 3.77Å; P314-W323 HydrophobicContact CG-CG 4.02Å; A319-W323 WeakPolarHBondContact O-CB 3.44Å; A319-W323 PolarHBondContact O-N 2.89Å; L320-W323 PolarHBondContact O-N 3.09Å; I321-W323 PolarHBondContact O-N 2.9Å; W323-V325 PolarHBondContact O-N 3.23Å; W323-E326 PolarHBondContact O-N 2.78Å; W323-N327 HydrophobicContact CH2-CB 4.29Å; W323-N327 HydrophobicContact CZ2-CB 4.25Å; W323-N327 PolarHBondContact NE1-ND2 2.88Å; W323-N327 PolarHBondContact O-N 2.63Å; W323-N327 PolarHBondContact O-ND2 3.21Å; W323-Y329 HydrophobicContact CH2-CD2 4.32Å; W323-Y329 AromaticContact CH2-CE2 3.79Å; W323-Y329 HydrophobicContact CH2-CE2 3.79Å; W323-Y329 HydrophobicContact CZ3-CD2 4.07Å; W323-Y329 AromaticContact CZ3-CE2 3.99Å; W323-Y329 HydrophobicContact CZ3-CE2 3.99Å
324	A	89	Confident	87	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-45.7	177.4	0	0	0	0	0	111.3	I233 L320 I321 K322 E326 N327 G328 Y329 V332	I233-A324 HydrophobicContact CD1-CB 3.87Å; L320-A324 WeakPolarHBondContact O-CB 3.4Å; L320-A324 PolarHBondContact O-N 3.2Å; I321-A324 PolarHBondContact O-N 2.82Å; K322-A324 VanDerWaalsContact C-N 3.34Å; K322-A324 PolarHBondContact O-N 2.87Å; A324-E326 PolarHBondContact O-N 2.91Å; A324-N327 PolarHBondContact O-N 3.45Å; A324-G328 PolarHBondContact O-N 2.87Å; A324-Y329 WeakPolarHBondContact O-CA 3.11Å; A324-Y329 WeakPolarHBondContact O-CB 3.46Å; A324-Y329 PolarHBondContact O-N 3.3Å; A324-V332 HydrophobicContact CB-CG2 3.92Å
325	V	87.2	Confident	87.1	Confident	62 Å²	62	46.3 Å²	46.3	38%	0.376	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-41.9	177.2	174.5	0	0	0	0	111.7	I321 K322 W323 N327 G328 N330 V332	I321-V325 WeakPolarHBondContact O-CG2 3.29Å; I321-V325 PolarHBondContact O-N 2.85Å; I321-V325 VanDerWaalsContact O-N 3.12Å; K322-V325 PolarHBondContact O-N 2.96Å; W323-V325 PolarHBondContact O-N 3.23Å; V325-N327 VanDerWaalsContact C-N 3.31Å; V325-N327 PolarHBondContact O-N 3.19Å; V325-G328 PolarHBondContact O-N 3.45Å; V325-N330 HydrophobicContact CG1-CB 4.37Å; V325-V332 HydrophobicContact CG2-CG2 4.28Å
326	E	88.2	Confident	87.4	Confident	130 Å²	130	42.4 Å²	42.4	61%	0.607	24%	0.239	S	C	*	.	H	α-helix	trans	-67.5	-27.9	179.3	-74.2	175.1	167.8	0	0	113.4	K322 W323 A324 G328	K322-E326 WeakPolarHBondContact CE-OE1 3.25Å; K322-E326 HydrophobicContact CG-CG 4.43Å; K322-E326 IonicContact NZ-OE1 2.75Å; K322-E326 WeakPolarHBondContact O-CG 3.38Å; K322-E326 PolarHBondContact O-N 3.17Å; W323-E326 PolarHBondContact O-N 2.78Å; A324-E326 PolarHBondContact O-N 2.91Å; E326-G328 VanDerWaalsContact C-N 3.35Å
327	N	87.4	Confident	87.9	Confident	71 Å²	71	42.1 Å²	42.1	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	12.2	179.3	-73.1	-94.5	0	0	0	113.4	W323 A324 V325 Y329	W323-N327 HydrophobicContact CH2-CB 4.29Å; W323-N327 HydrophobicContact CZ2-CB 4.25Å; W323-N327 PolarHBondContact NE1-ND2 2.88Å; W323-N327 PolarHBondContact O-N 2.63Å; W323-N327 PolarHBondContact O-ND2 3.21Å; A324-N327 PolarHBondContact O-N 3.45Å; V325-N327 VanDerWaalsContact C-N 3.31Å; V325-N327 PolarHBondContact O-N 3.19Å; N327-Y329 HydrophobicContact CB-CD2 3.85Å; N327-Y329 HydrophobicContact CB-CE2 3.69Å
328	G	84.1	Confident	88.2	Confident	53 Å²	53	41.3 Å²	41.3	55%	0.546	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	87	6.4	175.9	0	0	0	0	0	115.1	A324 V325 E326 N330	A324-G328 PolarHBondContact O-N 2.87Å; V325-G328 PolarHBondContact O-N 3.45Å; E326-G328 VanDerWaalsContact C-N 3.35Å; G328-N330 VanDerWaalsContact C-N 3.26Å; G328-N330 PolarHBondContact O-N 3.24Å
329	Y	85.4	Confident	88.5	Confident	24 Å²	24	38.9 Å²	38.9	9%	0.094	22%	0.222	C	C	.	.			trans	-90.2	55.9	175.1	-48.1	-63.3	0	0	0	111.2	T267 E290 V292 W323 A324 N327	T267-Y329 HydrophobicContact CG2-CD1 3.6Å; T267-Y329 HydrophobicContact CG2-CE1 3.86Å; T267-Y329 HydrophobicContact CG2-CG 4.22Å; E290-Y329 PolarHBondContact OE1-OH 3.21Å; E290-Y329 WeakPolarHBondContact OE2-CE1 3.22Å; V292-Y329 HydrophobicContact CG2-CE1 4.48Å; V292-Y329 HydrophobicContact CG2-CE2 4.15Å; V292-Y329 WeakPolarHBondContact CG2-OH 3.34Å; W323-Y329 HydrophobicContact CH2-CD2 4.32Å; W323-Y329 AromaticContact CH2-CE2 3.79Å; W323-Y329 HydrophobicContact CH2-CE2 3.79Å; W323-Y329 HydrophobicContact CZ3-CD2 4.07Å; W323-Y329 AromaticContact CZ3-CE2 3.99Å; W323-Y329 HydrophobicContact CZ3-CE2 3.99Å; A324-Y329 WeakPolarHBondContact O-CA 3.11Å; A324-Y329 WeakPolarHBondContact O-CB 3.46Å; A324-Y329 PolarHBondContact O-N 3.3Å; N327-Y329 HydrophobicContact CB-CD2 3.85Å; N327-Y329 HydrophobicContact CB-CE2 3.69Å
330	N	79.3	Confident	88.7	Confident	108 Å²	108	39.1 Å²	39.1	58%	0.578	22%	0.217	S	C	*	.			trans	-113	133.9	-179.2	-175.3	20	0	0	0	110.3	V325 G328	V325-N330 HydrophobicContact CG1-CB 4.37Å; G328-N330 VanDerWaalsContact C-N 3.26Å; G328-N330 PolarHBondContact O-N 3.24Å
331	P	84.1	Confident	88.7	Confident	42 Å²	42	39.1 Å²	39.1	27%	0.273	22%	0.217	S	C	.	.	S	Bend	cis	-90.1	148.4	-1.1	36.4	-34.7	0	0	0	114.5	P227	P227-P331 HydrophobicContact CB-CG 4.34Å; P227-P331 HydrophobicContact CG-CG 3.17Å
332	V	86.6	Confident	88.9	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.036	22%	0.22	C	C	.	.			trans	-70.9	129	175.5	-178.9	0	0	0	0	109	L224 S225 I233 I321 A324 V325	L224-V332 WeakPolarHBondContact CB-O 3.3Å; L224-V332 HydrophobicContact CD1-CB 3.98Å; L224-V332 HydrophobicContact CD1-CG1 3.93Å; S225-V332 PolarHBondContact N-O 3.32Å; I233-V332 HydrophobicContact CD1-CG1 3.64Å; I233-V332 HydrophobicContact CD1-CG2 4.09Å; I233-V332 HydrophobicContact CG1-CG1 3.93Å; I321-V332 HydrophobicContact CG2-CG2 4.37Å; A324-V332 HydrophobicContact CB-CG2 3.92Å; V325-V332 HydrophobicContact CG2-CG2 4.28Å
333	T	87.9	Confident	89.1	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.025	20%	0.198	C	C	.	.			trans	-83.7	-52.7	-178.9	-56.1	0	0	0	0	111.4	L224 S225 E230 V231	L224-T333 PolarHBondContact N-O 3.23Å; S225-T333 VanDerWaalsContact O-CA 3.29Å; S225-T333 WeakPolarHBondContact O-CA 3.31Å; S225-T333 WeakPolarHBondContact O-CG2 3.37Å; E230-T333 WeakPolarHBondContact CA-OG1 3.32Å; E230-T333 HydrophobicContact CG-CG2 4.38Å; V231-T333 PolarHBondContact N-OG1 3.4Å; V231-T333 WeakPolarHBondContact O-CA 3.42Å; V231-T333 VanDerWaalsContact O-CB 3.29Å; V231-T333 WeakPolarHBondContact O-CB 3.33Å; V231-T333 PolarHBondContact O-N 3.38Å
334	S	90.3	Very high	89.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	147	-179.1	72	0	0	0	0	112.4	C222 V231 H232 I233	C222-S334 WeakPolarHBondContact O-CA 3.36Å; V231-S334 PolarHBondContact O-N 2.84Å; H232-S334 PolarHBondContact ND1-OG 3.18Å; I233-S334 PolarHBondContact N-O 2.81Å
335	Y	92.1	Very high	89.4	Confident	1 Å²	1	34.9 Å²	34.9	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.3	167.9	176.5	-90.9	0	0	0	110.1	L30 G221 C222 I233 E235 S317 L320 I321	L30-Y335 HydrophobicContact CD2-CD1 3.48Å; L30-Y335 VanDerWaalsContact CD2-CD1 3.48Å; L30-Y335 HydrophobicContact CD2-CE1 3.5Å; G221-Y335 CarbonylContact C-O 3.57Å; G221-Y335 WeakPolarHBondContact CA-O 3.4Å; C222-Y335 PolarHBondContact N-O 3.26Å; C222-Y335 PolarHBondContact O-N 3.3Å; I233-Y335 HydrophobicContact CB-CD2 3.91Å; I233-Y335 HydrophobicContact CG2-CD2 3.72Å; I233-Y335 HydrophobicContact CG2-CE2 3.96Å; E235-Y335 HydrophobicContact CB-CE2 4.48Å; E235-Y335 PolarHBondContact OE2-OH 3.09Å; S317-Y335 VanDerWaalsContact CA-OH 3.29Å; S317-Y335 WeakPolarHBondContact CA-OH 3.22Å; S317-Y335 VanDerWaalsContact CB-CE1 3.42Å; S317-Y335 PolarHBondContact N-OH 2.82Å; L320-Y335 HydrophobicContact CB-CE2 4.36Å; L320-Y335 HydrophobicContact CD1-CE2 3.99Å; I321-Y335 HydrophobicContact CD1-CD2 4.36Å; I321-Y335 HydrophobicContact CD1-CG 4.29Å; I321-Y335 HydrophobicContact CG1-CD2 4.22Å
336	T	93.9	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.6	178.8	-45.1	0	0	0	0	110.2	H37 V39 I233 I234 E235	H37-T336 PolarHBondContact NE2-OG1 2.82Å; V39-T336 HydrophobicContact CB-CG2 4.2Å; V39-T336 WeakPolarHBondContact CB-OG1 3.47Å; V39-T336 HydrophobicContact CG1-CG2 4.06Å; I233-T336 PolarHBondContact O-N 3.29Å; I234-T336 CarbonylContact C-O 3.58Å; I234-T336 WeakPolarHBondContact CA-O 3.43Å; E235-T336 PolarHBondContact N-O 3.17Å
337	S	94.1	Very high	89.7	Confident	22 Å²	22	29.3 Å²	29.3	15%	0.154	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.5	174.8	-173.3	0	0	0	0	109.7	S219 K220 E235	S219-S337 WeakPolarHBondContact CA-O 3.24Å; K220-S337 PolarHBondContact N-O 3.1Å; K220-S337 PolarHBondContact O-N 3.48Å; E235-S337 CarbonylContact O-C 3.55Å; E235-S337 VanDerWaalsContact O-CA 3.28Å; E235-S337 WeakPolarHBondContact O-CA 3.26Å; E235-S337 PolarHBondContact OE2-OG 2.88Å
338	T	93.8	Very high	89.5	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.6	-174.4	-53.6	0	0	0	0	110.2	A41 Q217 S219 E235 Q237 A341 F344	A41-T338 HydrophobicContact CB-CG2 3.66Å; Q217-T338 HydrophobicContact CB-CG2 4.24Å; S219-T338 WeakPolarHBondContact CB-OG1 3.46Å; S219-T338 PolarHBondContact OG-OG1 2.98Å; E235-T338 PolarHBondContact O-N 2.97Å; Q237-T338 PolarHBondContact N-O 3.03Å; T338-A341 HydrophobicContact CG2-CB 3.75Å; T338-F344 HydrophobicContact CG2-CE1 4.41Å; T338-F344 HydrophobicContact CG2-CZ 4.43Å; T338-F344 WeakPolarHBondContact OG1-CE1 3.43Å
339	P	91.8	Very high	88.8	Confident	77 Å²	77	29.8 Å²	29.8	50%	0.5	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	-45.1	177.6	-22.7	33.3	0	0	0	112.6	T218 Q237 A238	T218-P339 WeakPolarHBondContact O-CD 3.43Å; Q237-P339 WeakPolarHBondContact CB-O 3.28Å; A238-P339 PolarHBondContact N-O 2.72Å; A238-P339 VanDerWaalsContact N-O 3.08Å
340	M	90.8	Very high	87.5	Confident	45 Å²	45	32.9 Å²	32.9	22%	0.222	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	127.8	-178.9	-175.6	171.1	56.8	0	0	110.8	L43 Q217 A238 S241	L43-M340 HydrophobicContact CD1-CG 4.24Å; L43-M340 HydrophobicContact CD2-CE 3.87Å; L43-M340 HydrophobicContact CD2-CG 4.46Å; L43-M340 HydrophobicContact CD2-SD 4.28Å; Q217-M340 WeakPolarHBondContact CB-O 3.42Å; Q217-M340 WeakPolarHBondContact CG-O 3.24Å; Q217-M340 PolarHBondContact OE1-O 3.14Å; A238-M340 VanDerWaalsContact O-CA 3.25Å; A238-M340 WeakPolarHBondContact O-CA 3.47Å; S241-M340 PolarHBondContact N-SD 2.77Å; S241-M340 VanDerWaalsContact N-SD 3.36Å; S241-M340 PolarHBondContact OG-SD 3.35Å
341	A	91.6	Very high	86.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.			trans	-172.5	151.8	174.5	0	0	0	0	0	109.7	A41 Q217 L236 A238 P239 T338 F344	A41-A341 HydrophobicContact CB-CB 3.96Å; Q217-A341 HydrophobicContact CG-CB 4.37Å; L236-A341 HydrophobicContact CD1-CB 4.21Å; L236-A341 WeakPolarHBondContact CD1-O 3.4Å; L236-A341 WeakPolarHBondContact CD2-O 3.03Å; A238-A341 PolarHBondContact O-N 2.83Å; P239-A341 WeakPolarHBondContact CA-O 3.39Å; P239-A341 CarbonylContact O-C 3.58Å; T338-A341 HydrophobicContact CG2-CB 3.75Å; A341-F344 HydrophobicContact CB-CE1 4.4Å; A341-F344 HydrophobicContact CB-CE2 4.17Å; A341-F344 HydrophobicContact CB-CZ 3.92Å
342	N	90.7	Very high	84	Confident	28 Å²	28	35.8 Å²	35.8	15%	0.15	18%	0.175	C	C	.	.	S	Bend	trans	-125	5.5	171.9	62.9	-3.3	0	0	0	112.8	I42 L43 K44 V249 I250	I42-N342 PolarHBondContact O-N 2.83Å; I42-N342 PolarHBondContact O-OD1 3.08Å; L43-N342 WeakPolarHBondContact CA-OD1 3.4Å; K44-N342 PolarHBondContact N-OD1 2.8Å; K44-N342 PolarHBondContact O-ND2 3.18Å; V249-N342 WeakPolarHBondContact CA-O 3.37Å; I250-N342 PolarHBondContact N-O 2.91Å
343	H	92.3	Very high	81.6	Confident	22 Å²	22	41.7 Å²	41.7	10%	0.102	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	129.5	175.9	-166.6	178	0	0	0	109.7	I42 I250 N345	I42-H343 HydrophobicContact CB-CB 4.25Å; I42-H343 PolarHBondContact N-O 2.01Å; I42-H343 PolarHBondContact O-N 2.86Å; I42-H343 VanDerWaalsContact O-O 3.08Å; I250-H343 CarbonylContact O-C 3.59Å; I250-H343 WeakPolarHBondContact O-CA 3.27Å; H343-N345 PolarHBondContact NE2-OD1 3.47Å
344	F	94.4	Very high	79	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.6	174.9	-69.2	-86.8	0	0	0	110	V39 Q40 A41 I234 L236 V249 I250 V251 D252 W278 T338 A341	V39-F344 HydrophobicContact CG1-CB 4.47Å; V39-F344 HydrophobicContact CG1-CD1 3.85Å; Q40-F344 CarbonylContact O-C 3.52Å; Q40-F344 WeakPolarHBondContact O-CA 3Å; A41-F344 HydrophobicContact CB-CD1 3.8Å; A41-F344 HydrophobicContact CB-CE1 3.57Å; A41-F344 HydrophobicContact CB-CZ 4.42Å; I234-F344 HydrophobicContact CD1-CB 4.28Å; I234-F344 HydrophobicContact CD1-CD1 4.34Å; I234-F344 HydrophobicContact CD1-CG 4.24Å; I234-F344 HydrophobicContact CG2-CD1 4.1Å; I234-F344 HydrophobicContact CG2-CD2 4.35Å; I234-F344 HydrophobicContact CG2-CE1 3.71Å; I234-F344 HydrophobicContact CG2-CE2 4Å; I234-F344 HydrophobicContact CG2-CG 4.39Å; I234-F344 HydrophobicContact CG2-CZ 3.64Å; L236-F344 HydrophobicContact CB-CZ 4.47Å; L236-F344 HydrophobicContact CD1-CE2 4.36Å; L236-F344 HydrophobicContact CD1-CZ 4.04Å; L236-F344 HydrophobicContact CD2-CE2 4.33Å; V249-F344 HydrophobicContact CG1-CD2 3.88Å; V249-F344 HydrophobicContact CG1-CE2 3.83Å; I250-F344 PolarHBondContact O-N 2.88Å; V251-F344 CarbonylContact C-O 3.52Å; V251-F344 WeakPolarHBondContact CA-O 2.98Å; V251-F344 HydrophobicContact CG2-CB 4.43Å; D252-F344 PolarHBondContact N-O 3.04Å; W278-F344 HydrophobicContact CH2-CE2 4.49Å; W278-F344 HydrophobicContact CZ3-CD2 4.32Å; W278-F344 HydrophobicContact CZ3-CE2 4.25Å; T338-F344 HydrophobicContact CG2-CE1 4.41Å; T338-F344 HydrophobicContact CG2-CZ 4.43Å; T338-F344 WeakPolarHBondContact OG1-CE1 3.43Å; A341-F344 HydrophobicContact CB-CE1 4.4Å; A341-F344 HydrophobicContact CB-CE2 4.17Å; A341-F344 HydrophobicContact CB-CZ 3.92Å
345	N	92.4	Very high	76.5	Confident	38 Å²	38	50.8 Å²	50.8	20%	0.203	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.3	172.3	-67.2	-25.1	0	0	0	108.9	V39 Q40 I42 H343	V39-N345 CarbonylContact C-O 3.52Å; V39-N345 WeakPolarHBondContact CA-O 3.37Å; Q40-N345 HydrophobicContact CB-CB 4.46Å; Q40-N345 PolarHBondContact N-O 3.36Å; Q40-N345 PolarHBondContact O-N 2.64Å; I42-N345 VanDerWaalsContact CD1-ND2 3.26Å; I42-N345 WeakPolarHBondContact CD1-ND2 3.11Å; H343-N345 PolarHBondContact NE2-OD1 3.47Å
346	I	91.9	Very high	73.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.5	176.4	-52.9	-177.4	0	0	0	108.5	P38 V39 I234 V251 D252 L253 R254 L268 L348	P38-I346 CarbonylContact O-C 3.53Å; P38-I346 VanDerWaalsContact O-CA 3.28Å; P38-I346 WeakPolarHBondContact O-CA 3.32Å; V39-I346 HydrophobicContact CG1-CG1 4.42Å; V39-I346 HydrophobicContact CG2-CG1 4.19Å; I234-I346 HydrophobicContact CD1-CD1 3.99Å; V251-I346 HydrophobicContact CG1-CD1 3.48Å; V251-I346 VanDerWaalsContact CG1-CD1 3.48Å; V251-I346 HydrophobicContact CG1-CG1 4.01Å; D252-I346 PolarHBondContact O-N 3.4Å; L253-I346 HydrophobicContact CD2-CB 3.94Å; L253-I346 HydrophobicContact CD2-CD1 4.05Å; L253-I346 HydrophobicContact CD2-CG2 3.97Å; L253-I346 HydrophobicContact CG-CB 4.5Å; L253-I346 HydrophobicContact CG-CD1 4.5Å; R254-I346 PolarHBondContact N-O 2.8Å; L268-I346 HydrophobicContact CD2-CD1 3.66Å; I346-L348 HydrophobicContact CG2-CD2 4.15Å
347	R	88.5	Confident	70.9	Confident	75 Å²	75	63.8 Å²	63.8	28%	0.283	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.7	178.1	-63.3	-61.9	-172.4	159.6	-0.2	110.6	P38 R254 P255 L256 D258	P38-R347 PolarHBondContact O-N 2.79Å; R254-R347 VanDerWaalsContact CB-NH1 3.26Å; R254-R347 WeakPolarHBondContact O-CA 3.15Å; P255-R347 WeakPolarHBondContact O-CD 3.04Å; P255-R347 PolarHBondContact O-NH1 2.79Å; L256-R347 HydrophobicContact CD1-CB 4.12Å; D258-R347 IonicContact OD1-CZ 3.35Å; D258-R347 IonicContact OD1-NH1 3.46Å; D258-R347 PolarHBondContact OD1-NH1 3.19Å; D258-R347 IonicContact OD1-NH2 3.81Å
348	L	82.6	Confident	68.1	Low	1 Å²	1	70 Å²	70	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	137.6	-176.6	-57.6	170.2	0	0	0	110.8	E230 H232 L253 R254 L256 V266 M285 I346	E230-L348 HydrophobicContact CB-CD2 4.4Å; E230-L348 HydrophobicContact CG-CD2 4.5Å; E230-L348 WeakPolarHBondContact OE2-CD2 3.43Å; H232-L348 VanDerWaalsContact NE2-CD2 3.34Å; H232-L348 WeakPolarHBondContact NE2-CD2 3.46Å; L253-L348 HydrophobicContact CD2-CD1 4.41Å; R254-L348 PolarHBondContact O-N 3.34Å; L256-L348 VanDerWaalsContact CB-O 3.29Å; L256-L348 WeakPolarHBondContact CB-O 3.32Å; L256-L348 PolarHBondContact N-O 2.93Å; V266-L348 HydrophobicContact CG2-CD1 3.89Å; M285-L348 HydrophobicContact CE-CD1 3.17Å; M285-L348 HydrophobicContact SD-CD1 3.67Å; I346-L348 HydrophobicContact CG2-CD2 4.15Å
349	R	69.9	Low	65.5	Low	133 Å²	133	74.5 Å²	74.5	50%	0.502	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-88.7	147.5	-176.7	-65.2	-173.9	-178.7	178.7	2.4	111.7	G36	G36-R349 PolarHBondContact O-NH2 2.81Å; G36-R349 VanDerWaalsContact O-NH2 3.13Å
350	E	59.6	Low	62.7	Low	88 Å²	88	81 Å²	81	41%	0.411	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-71.3	154.3	171.6	-79.5	159.4	-126.3	0	0	112.2	K257 D260	K257-E350 IonicContact NZ-OE1 2.73Å; K257-E350 PolarHBondContact NZ-OE1 2.91Å; K257-E350 IonicContact NZ-OE2 2.89Å; K257-E350 PolarHBondContact NZ-OE2 2.69Å; D260-E350 VanDerWaalsContact OD2-OE1 3.09Å
351	Q	50.3	Low	59.9	Low	73 Å²	73	84.5 Å²	84.5	34%	0.341	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-77.3	118.5	171.4	-159.5	132.2	6.8	0	0	109.5	N228 V353	N228-Q351 PolarHBondContact OD1-NE2 3.22Å; N228-Q351 PolarHBondContact OD1-OE1 3.37Å; N228-Q351 VanDerWaalsContact OD1-OE1 3.11Å; Q351-V353 PolarHBondContact O-N 3.42Å
352	D	37.6	Very low	57.2	Low	139 Å²	139	88.8 Å²	88.8	74%	0.743	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-63.7	125.5	162.4	-98.4	-29.9	0	0	0	108.3	S354	D352-S354 PolarHBondContact O-N 3.43Å
353	V	36.4	Very low	54.7	Low	130 Å²	130	93.1 Å²	93.1	79%	0.788	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	7.3	-177.5	178.2	0	0	0	0	112.9	Q351	Q351-V353 PolarHBondContact O-N 3.42Å
354	S	34.9	Very low	52.1	Low	92 Å²	92	100.5 Å²	100.5	64%	0.643	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-19.5	-179.9	-160.9	0	0	0	0	114.5	D352 H356	D352-S354 PolarHBondContact O-N 3.43Å; S354-H356 PolarHBondContact O-N 2.84Å
355	D	36.8	Very low	49.6	Very low	102 Å²	102	106.5 Å²	106.5	55%	0.545	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.4	-174.1	-83.1	-11.5	0	0	0	114.8	L357	D355-L357 VanDerWaalsContact C-N 3.3Å; D355-L357 PolarHBondContact O-N 2.87Å
356	H	34.6	Very low	46.8	Very low	127 Å²	127	113.4 Å²	113.4	59%	0.588	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-8.1	177.1	-87	-63.4	0	0	0	114.5	S354	S354-H356 PolarHBondContact O-N 2.84Å
357	L	33.8	Very low	43.9	Very low	148 Å²	148	120.6 Å²	120.6	78%	0.775	61%	0.613	S	S	*	*	S	Bend	trans	-96.4	-14.5	179.8	-148.9	70	0	0	0	114.1	D355	D355-L357 VanDerWaalsContact C-N 3.3Å; D355-L357 PolarHBondContact O-N 2.87Å
358	E	35.5	Very low	41.3	Very low	151 Å²	151	124.3 Å²	124.3	71%	0.706	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-93.5	-8.7	-178.5	-102	156.7	167.1	0	0	114.7	R360	E358-R360 VanDerWaalsContact C-N 3.35Å
359	S	39	Very low	38.9	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-87.6	5.7	175.6	59.4	0	0	0	0	114.7
360	R	34.1	Very low	37.1	Very low	214 Å²	214	138 Å²	138	81%	0.808	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-109.8	16.2	-179.3	-72.7	-164.3	-174	-167.7	3.8	115.6	E358	E358-R360 VanDerWaalsContact C-N 3.35Å
361	L	31.7	Very low	35.7	Very low	118 Å²	118	140.5 Å²	140.5	62%	0.618	72%	0.718	S	S	*	*	S	Bend	trans	-105.9	128.4	176.2	-69.9	171.4	0	0	0	111.8
362	P	34.9	Very low	34.5	Very low	91 Å²	91	142.2 Å²	142.2	59%	0.591	74%	0.738	S	S	*	*			trans	-64.8	160.2	174.8	-17.6	30	0	0	0	113	E364	P362-E364 PolarHBondContact O-N 2.77Å
363	P	38.5	Very low	34.4	Very low	118 Å²	118	140.7 Å²	140.7	77%	0.766	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-69	-0.8	-165.8	-10.4	22.7	0	0	0	116.7
364	E	36.9	Very low	33.8	Very low	177 Å²	177	142 Å²	142	83%	0.827	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-89.6	-5.5	-169.8	-61.6	-141.9	162.8	0	0	115.3	P362	P362-E364 PolarHBondContact O-N 2.77Å
365	L	41	Very low	33.9	Very low	127 Å²	127	142.8 Å²	142.8	67%	0.665	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-98.1	0.2	-179.5	-83.3	164	0	0	0	115.2	N367	L365-N367 VanDerWaalsContact C-N 3.26Å; L365-N367 PolarHBondContact O-N 3.5Å
366	F	35.3	Very low	33.4	Very low	183 Å²	183	146.2 Å²	146.2	80%	0.803	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-75.7	-7.3	178.6	-91.3	-83	0	0	0	114.8	L368	F366-L368 PolarHBondContact O-N 2.84Å
367	N	30.7	Very low	33.1	Very low	151 Å²	151	149.7 Å²	149.7	81%	0.807	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-89.9	12.7	-175.1	-81.4	-21.8	0	0	0	115.9	L365	L365-N367 VanDerWaalsContact C-N 3.26Å; L365-N367 PolarHBondContact O-N 3.5Å
368	L	34	Very low	32.6	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-124.2	17.8	-177.7	-83.2	171	0	0	0	116.8	F366	F366-L368 PolarHBondContact O-N 2.84Å
369	R	32.4	Very low	32.9	Very low	238 Å²	238	145.2 Å²	145.2	90%	0.898	77%	0.772	S	S	*	*			trans	-132.9	72.8	172.4	-81.5	-171.4	176.7	175	0.2	113.6
370	H	31.3	Very low	32.2	Very low	184 Å²	184	145.7 Å²	145.7	85%	0.852	78%	0.782	S	S	*	*			trans	-130.9	155.9	148.2	-91.8	3.4	0	0	0	109.2
371	V	29	Very low	31.7	Very low	141 Å²	141	140 Å²	140	86%	0.855	78%	0.78	S	S	*	*			trans	100.4	113.9	-170.2	-176.2	0	0	0	0	110
372	S	26.1	Very low	32.1	Very low	108 Å²	108	140 Å²	140	76%	0.755	79%	0.788	S	S	*	*			cis	-166.4	173.2	12.7	-95.8	0	0	0	0	111.2
373	P	35.8	Very low	32.1	Very low	107 Å²	107	141.5 Å²	141.5	70%	0.695	80%	0.797	S	S	*	*			trans	-108.7	164.6	-165.4	39.3	-31.5	0	0	0	118.1
374	L	24.4	Very low	31.4	Very low	157 Å²	157	140.2 Å²	140.2	82%	0.822	80%	0.797	S	S	*	*			trans	75.6	161.6	158.1	-81.1	135.7	0	0	0	120.3
375	P	36	Very low	30.7	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	79%	0.794	S	S	*	*			cis	-141.9	169.7	-11.1	32.2	-9	0	0	0	118.9
376	E	27.4	Very low	30.5	Very low	175 Å²	175	134.8 Å²	134.8	82%	0.818	79%	0.792	S	S	*	*			trans	24.3	135.9	149.1	-73.4	-169.4	147.4	0	0	127.1
377	K	27.2	Very low	30	Very low	200 Å²	200	134.1 Å²	134.1	87%	0.87	79%	0.792	S	S	*	*				137.5	130.8	127.4	-94.5	177.2	179.2	172.5	0	115.7
378	G	23.2	Very low	29.7	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	79%	0.785	S	S	*	*			trans	-91.7	-156.9	165.8	0	0	0	0	0	112.8
379	P	41.8	Very low	29.4	Very low	132 Å²	132	129.8 Å²	129.8	86%	0.857	79%	0.786	S	S	*	*			cis	-135.1	-171.3	-16.7	40.4	-21.5	0	0	0	114.7
380	A	25.5	Very low	29.1	Very low	106 Å²	106	125.7 Å²	125.7	88%	0.876	78%	0.781	S	S	*	*			trans	94.2	144.7	157.5	0	0	0	0	0	121
381	A	23.7	Very low	29.2	Very low	93 Å²	93	121.1 Å²	121.1	77%	0.769	77%	0.767	S	S	*	*			trans	-97.9	-156.8	-158.7	0	0	0	0	0	115.5
382	P	38.4	Very low	29.1	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	77%	0.765	S	S	*	*				-97.8	-161.9	-113.3	39.3	-18.7	0	0	0	112.2
383	P	35.9	Very low	29.2	Very low	121 Å²	121	123.3 Å²	123.3	79%	0.786	76%	0.764	S	S	*	*			cis	-148.5	-179.9	19.2	41.6	-17.8	0	0	0	119.9
384	A	22.8	Very low	28.6	Very low	91 Å²	91	127.3 Å²	127.3	75%	0.752	77%	0.77	S	S	*	*			trans	78.1	104.3	147.6	0	0	0	0	0	122.3
385	A	22.3	Very low	28.7	Very low	94 Å²	94	126 Å²	126	78%	0.777	77%	0.771	S	S	*	*				46.9	173.2	127	0	0	0	0	0	121.5
386	P	37.1	Very low	28.1	Very low	96 Å²	96	130.6 Å²	130.6	62%	0.623	78%	0.776	S	S	*	*			cis	-140.5	-177.6	-6.9	22.5	5.4	0	0	0	115.8
387	H	25.5	Very low	27.7	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.787	78%	0.775	S	S	*	*			trans	81.1	143.2	154.9	-56.5	-58.3	0	0	0	119.8
388	S	24.1	Very low	27.7	Very low	95 Å²	95	125.6 Å²	125.6	66%	0.664	77%	0.77	S	S	*	*			cis	167.5	132	-31.9	46.5	0	0	0	0	106.5
389	S	26.7	Very low	27.8	Very low	117 Å²	117	129.8 Å²	129.8	82%	0.818	77%	0.774	S	S	*	*			trans	-156.6	82.1	155.4	58.5	0	0	0	0	110.6
390	L	27.8	Very low	26.8	Very low	151 Å²	151	128.3 Å²	128.3	79%	0.791	77%	0.766	S	S	*	*				31.5	158.6	123.1	-72	-178.9	0	0	0	120.8
391	P	33.6	Very low	26.7	Very low	88 Å²	88	131 Å²	131	57%	0.571	77%	0.765	S	S	*	*			cis	-152.7	168	-15.7	38.2	-16.6	0	0	0	120
392	F	26	Very low	26.9	Very low	185 Å²	185	132.1 Å²	132.1	81%	0.811	76%	0.764	S	S	*	*			trans	86.2	154.5	147.2	-62.5	-47.3	0	0	0	120.9
393	P	27.4	Very low	26.3	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	77%	0.766	S	S	*	*				-140.6	148.2	-80.1	31.1	-7.4	0	0	0	114.8
394	F	23.7	Very low	25.8	Very low	191 Å²	191	136 Å²	136	84%	0.838	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-83.7	138.1	165.7	-72.9	-88.1	0	0	0	110.8
395	P	26.2	Very low	25.8	Very low	128 Å²	128	138.1 Å²	138.1	83%	0.831	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-85.9	151.1	170.2	30	-24.8	0	0	0	112.4
396	Y	23	Very low	25.9	Very low	206 Å²	206	143.2 Å²	143.2	81%	0.808	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-101.8	156.1	-166.7	-85.1	-89.4	0	0	0	114.1
397	L	20.8	Very low	25.3	Very low	155 Å²	155	144.5 Å²	144.5	81%	0.812	77%	0.772	S	S	*	*			trans	75.4	163.1	145.4	-70.5	158.3	0	0	0	119.3
398	P	26	Very low	25.3	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	77%	0.773	S	S	*	*			cis	-135	-178.5	-21.2	30.5	-8	0	0	0	114.5
399	I	25.8	Very low	25.4	Very low	160 Å²	160	148.2 Å²	148.2	82%	0.821	78%	0.784	S	S	*	*			trans	-65.9	138	171.5	-65.6	157.7	0	0	0	113
400	S	21	Very low	25.4	Very low	101 Å²	101	151.1 Å²	151.1	71%	0.706	79%	0.785	S	S	*	*			trans	-178.5	115.4	132.7	20.3	0	0	0	0	115.6
401	L	22.3	Very low	25.5	Very low	163 Å²	163	149.6 Å²	149.6	85%	0.853	78%	0.784	S	S	*	*			trans	51	163.7	143.5	-74	116.3	0	0	0	122.1
402	P	29.3	Very low	25.2	Very low	115 Å²	115	151.8 Å²	151.8	75%	0.747	80%	0.795	S	S	*	*			cis	-129.5	177.7	-16.4	32.2	-11	0	0	0	114.9
403	N	25.4	Very low	25.3	Very low	153 Å²	153	151.8 Å²	151.8	82%	0.818	80%	0.798	S	S	*	*			trans	-43	143	167.8	-85.2	-23.9	0	0	0	116.4
404	L	24.1	Very low	25.4	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	80%	0.795	S	S	*	*			trans	-162.7	118.1	135.2	-113.8	132.3	0	0	0	111.5
405	N	23.7	Very low	26.1	Very low	134 Å²	134	153.9 Å²	153.9	72%	0.717	80%	0.795	S	S	*	*			trans	-12.5	144.4	160.6	-67.2	-2.5	0	0	0	118.3
406	Y	24	Very low	26.7	Very low	202 Å²	202	152.8 Å²	152.8	79%	0.792	78%	0.782	S	S	*	*				-178.7	158.7	89.9	-124.3	-92.9	0	0	0	111
407	D	24.6	Very low	27.7	Very low	122 Å²	122	147.6 Å²	147.6	65%	0.652	77%	0.772	S	S	*	*			trans	-34.8	147.1	-179.6	-60	-51	0	0	0	118.2
408	N	25.8	Very low	29.4	Very low	154 Å²	154	141.3 Å²	141.3	82%	0.824	74%	0.739	S	S	*	*			trans	-138.6	96.5	150.7	-90.4	-17.7	0	0	0	109
409	E	26.1	Very low	30.7	Very low	189 Å²	189	142 Å²	142	88%	0.883	74%	0.736	S	S	*	*			trans	-68.8	135.1	143.6	-68.6	-175.6	139.5	0	0	107.2
410	E	26.2	Very low	32.6	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	70%	0.702	S	S	*	*			trans	-121.5	146.6	161.8	-88.5	-167.4	175.1	0	0	111.5
411	P	29.9	Very low	34.6	Very low	119 Å²	119	137.8 Å²	137.8	77%	0.773	70%	0.703	S	S	*	*			trans	-108.4	174.8	-154.7	16.4	8.1	0	0	0	112.4	E413	P411-E413 PolarHBondContact O-N 3.42Å
412	V	27.5	Very low	37	Very low	135 Å²	135	132.2 Å²	132.2	82%	0.818	67%	0.674	S	S	*	*			trans	-54.3	122.6	173.9	179.3	0	0	0	0	111.4	D414	V412-D414 PolarHBondContact O-N 2.78Å
413	E	28.2	Very low	39.5	Very low	184 Å²	184	130.3 Å²	130.3	86%	0.86	66%	0.656	S	S	*	*			trans	-70.2	91	167.1	-82.7	-169.9	157	0	0	109.9	P411	P411-E413 PolarHBondContact O-N 3.42Å
414	D	29.8	Very low	42.3	Very low	123 Å²	123	125.4 Å²	125.4	66%	0.658	63%	0.632	S	S	*	*			trans	-92	110.6	161.4	-155.3	4.8	0	0	0	108	V412 N416	V412-D414 PolarHBondContact O-N 2.78Å; D414-N416 PolarHBondContact O-N 3.24Å
415	R	37.9	Very low	45.1	Very low	224 Å²	224	122.1 Å²	122.1	85%	0.845	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	82.9	177.8	-80.2	-180	169.8	176	-3.3	109.4
416	N	39.3	Very low	48.1	Very low	104 Å²	104	119 Å²	119	56%	0.556	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	176.5	20.7	151.4	-90.1	-12.1	0	0	0	113.5	D414	D414-N416 PolarHBondContact O-N 3.24Å
417	V	43.2	Very low	50.8	Low	97 Å²	97	112.6 Å²	112.6	59%	0.588	58%	0.577	S	S	*	*			trans	-94.3	116.4	177.7	-174	0	0	0	0	109.7	D419	V417-D419 PolarHBondContact O-N 3.36Å
418	L	58	Low	53.3	Low	24 Å²	24	115.1 Å²	115.1	13%	0.126	59%	0.585	C	S	.	*			trans	-68.4	108.6	164.1	-82.6	170.6	0	0	0	108.2	V420 F445 V496 P531 I533	L418-V420 HydrophobicContact CB-CG2 4.23Å; L418-V420 PolarHBondContact O-N 2.9Å; L418-F445 HydrophobicContact CD1-CE2 4.2Å; L418-F445 HydrophobicContact CD1-CZ 4.25Å; L418-F445 HydrophobicContact CD2-CD2 4.24Å; L418-F445 HydrophobicContact CD2-CE2 3.45Å; L418-F445 VanDerWaalsContact CD2-CE2 3.45Å; L418-F445 HydrophobicContact CD2-CZ 4Å; L418-F445 HydrophobicContact CG-CE2 4.44Å; L418-V496 HydrophobicContact CD1-CB 4.02Å; L418-V496 HydrophobicContact CD1-CG2 3.44Å; L418-V496 VanDerWaalsContact CD1-CG2 3.44Å; L418-P531 HydrophobicContact CD1-CB 3.49Å; L418-P531 VanDerWaalsContact CD1-CB 3.49Å; L418-P531 HydrophobicContact CD1-CG 3.29Å; L418-P531 HydrophobicContact CD2-CB 4.49Å; L418-P531 HydrophobicContact CD2-CG 4.44Å; L418-P531 HydrophobicContact CG-CB 3.57Å; L418-P531 HydrophobicContact CG-CG 3.81Å; L418-I533 HydrophobicContact CB-CD1 3.97Å; L418-I533 HydrophobicContact CB-CG1 4.2Å; L418-I533 HydrophobicContact CD1-CD1 4.43Å
419	D	53.1	Low	55.8	Low	131 Å²	131	115.8 Å²	115.8	70%	0.701	58%	0.581	S	S	*	*			trans	-73.4	77.3	174.1	-169.7	33	0	0	0	109.8	V417 K443	V417-D419 PolarHBondContact O-N 3.36Å; D419-K443 WeakPolarHBondContact O-CE 3.26Å
420	V	65.6	Low	58.6	Low	16 Å²	16	111.4 Å²	111.4	10%	0.097	56%	0.556	C	S	.	*			trans	-125.2	130.8	176.7	-177.4	0	0	0	0	107.5	L418 L422 I435 L440 K443	L418-V420 HydrophobicContact CB-CG2 4.23Å; L418-V420 PolarHBondContact O-N 2.9Å; V420-L422 PolarHBondContact O-N 3.23Å; V420-L422 VanDerWaalsContact O-N 3.12Å; V420-I435 HydrophobicContact CG1-CG2 3.53Å; V420-L440 HydrophobicContact CG1-CG 4.41Å; V420-K443 HydrophobicContact CG2-CG 4.29Å
421	E	62.1	Low	61.5	Low	156 Å²	156	102.9 Å²	102.9	73%	0.729	52%	0.516	S	S	*	.			trans	-60.7	114.2	179.6	-166.7	176.7	179.4	0	0	110.7
422	L	74.3	Confident	64.2	Low	45 Å²	45	97.7 Å²	97.7	24%	0.236	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.5	-177.7	-171.5	73.5	0	0	0	110.1	V420 V424 V433 I435 I533 F535	V420-L422 PolarHBondContact O-N 3.23Å; V420-L422 VanDerWaalsContact O-N 3.12Å; L422-V424 HydrophobicContact CD2-CG2 3.68Å; L422-V424 HydrophobicContact CG-CG2 3.93Å; L422-V433 HydrophobicContact CD1-CG1 3.17Å; L422-V433 HydrophobicContact CD2-CG1 4.06Å; L422-V433 HydrophobicContact CG-CG1 3.75Å; L422-I435 HydrophobicContact CD1-CD1 3.68Å; L422-I435 HydrophobicContact CD1-CG1 3.35Å; L422-I533 HydrophobicContact CD2-CG2 4.08Å; L422-F535 HydrophobicContact CD2-CB 3.92Å
423	I	80.3	Confident	67	Low	75 Å²	75	91.3 Å²	91.3	39%	0.385	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.7	175.3	-57.7	173.3	0	0	0	108.9	Q425 V433 S434	I423-Q425 HydrophobicContact CG2-CG 4.49Å; I423-V433 CarbonylContact O-C 3.49Å; I423-V433 WeakPolarHBondContact O-CA 3.29Å; I423-S434 PolarHBondContact N-O 2.88Å; I423-S434 PolarHBondContact O-N 2.63Å
424	V	84.8	Confident	69.7	Low	50 Å²	50	83.4 Å²	83.4	30%	0.303	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.3	178.5	-174.2	0	0	0	0	110.1	L422 V433 F535	L422-V424 HydrophobicContact CD2-CG2 3.68Å; L422-V424 HydrophobicContact CG-CG2 3.93Å; V424-V433 HydrophobicContact CG1-CG2 4.42Å; V424-V433 HydrophobicContact CG2-CG2 4.42Å; V424-F535 HydrophobicContact CG1-CD2 4.2Å; V424-F535 HydrophobicContact CG2-CB 3.9Å
425	Q	82.1	Confident	72.3	Confident	102 Å²	102	77.6 Å²	77.6	48%	0.477	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	111.6	175.3	-64.8	178.5	-2.7	0	0	109.4	I423 E427 V432	I423-Q425 HydrophobicContact CG2-CG 4.49Å; Q425-E427 PolarHBondContact O-N 2.85Å; Q425-V432 HydrophobicContact CB-CB 4.28Å; Q425-V432 PolarHBondContact N-O 3.41Å; Q425-V432 PolarHBondContact O-N 3.44Å
426	C	86.6	Confident	74.5	Confident	68 Å²	68	69 Å²	69	46%	0.459	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	97.6	176.6	-53.2	0	0	0	0	109.4	C537 Y539	C426-C537 VanDerWaalsContact CA-SG 3.59Å; C426-C537 HydrophobicContact CB-CB 3.71Å; C426-C537 WeakPolarHBondContact CB-SG 3.27Å; C426-C537 VanDerWaalsContact SG-CA 3.58Å; C426-C537 WeakPolarHBondContact SG-CB 3.34Å; C426-C537 CovalentContact SG-SG 2.03Å; C426-C537 PolarHBondContact SG-SG 3.33Å; C426-Y539 WeakPolarHBondContact CA-OH 3.44Å; C426-Y539 WeakPolarHBondContact CB-OH 3.16Å
427	E	82.6	Confident	76.6	Confident	69 Å²	69	67.6 Å²	67.6	32%	0.322	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	157.6	174.7	-57.5	-176.2	-171.2	0	0	110.9	Q425 K429 R430 Y539	Q425-E427 PolarHBondContact O-N 2.85Å; E427-K429 PolarHBondContact O-N 2.81Å; E427-R430 CarbonylContact C-O 3.56Å; E427-R430 WeakPolarHBondContact CA-O 3.46Å; E427-R430 HydrophobicContact CB-CG 4.09Å; E427-R430 VanDerWaalsContact CB-O 3.32Å; E427-R430 WeakPolarHBondContact CB-O 3.39Å; E427-R430 HydrophobicContact CG-CG 4.48Å; E427-R430 PolarHBondContact N-O 3.44Å; E427-R430 PolarHBondContact O-N 2.61Å; E427-R430 IonicContact OE1-CZ 2.83Å; E427-R430 IonicContact OE1-NE 2.8Å; E427-R430 IonicContact OE1-NH2 2.64Å; E427-R430 PolarHBondContact OE1-NH2 3.46Å; E427-R430 WeakPolarHBondContact OE2-CG 3.39Å; E427-R430 IonicContact OE2-CZ 3.59Å; E427-R430 VanDerWaalsContact OE2-CZ 3.32Å; E427-R430 IonicContact OE2-NE 3.49Å; E427-R430 PolarHBondContact OE2-NE 2.85Å; E427-R430 IonicContact OE2-NH2 2.8Å; E427-R430 PolarHBondContact OE2-NH2 2.84Å; E427-Y539 WeakPolarHBondContact O-CE1 3.43Å; E427-Y539 PolarHBondContact O-OH 2.94Å
428	E	76.3	Confident	78.3	Confident	175 Å²	175	70.6 Å²	70.6	82%	0.818	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-27.4	-174.7	-63.5	-177.7	173.1	0	0	115.6
429	K	78.9	Confident	79.4	Confident	168 Å²	168	71.5 Å²	71.5	73%	0.73	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	-4.5	-175.9	-62.3	-176.3	-178.7	178.8	0	114.7	E427	E427-K429 PolarHBondContact O-N 2.81Å
430	R	84.4	Confident	80.5	Confident	96 Å²	96	65.3 Å²	65.3	36%	0.362	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	156.6	-175.2	62.3	178.9	178.2	164.6	6.9	111.6	E427 V432 E469 T470	E427-R430 CarbonylContact C-O 3.56Å; E427-R430 WeakPolarHBondContact CA-O 3.46Å; E427-R430 HydrophobicContact CB-CG 4.09Å; E427-R430 VanDerWaalsContact CB-O 3.32Å; E427-R430 WeakPolarHBondContact CB-O 3.39Å; E427-R430 HydrophobicContact CG-CG 4.48Å; E427-R430 PolarHBondContact N-O 3.44Å; E427-R430 PolarHBondContact O-N 2.61Å; E427-R430 IonicContact OE1-CZ 2.83Å; E427-R430 IonicContact OE1-NE 2.8Å; E427-R430 IonicContact OE1-NH2 2.64Å; E427-R430 PolarHBondContact OE1-NH2 3.46Å; E427-R430 WeakPolarHBondContact OE2-CG 3.39Å; E427-R430 IonicContact OE2-CZ 3.59Å; E427-R430 VanDerWaalsContact OE2-CZ 3.32Å; E427-R430 IonicContact OE2-NE 3.49Å; E427-R430 PolarHBondContact OE2-NE 2.85Å; E427-R430 IonicContact OE2-NH2 2.8Å; E427-R430 PolarHBondContact OE2-NH2 2.84Å; R430-V432 HydrophobicContact CG-CG2 4.41Å; R430-E469 IonicContact CZ-OE2 3.17Å; R430-E469 IonicContact NH1-OE2 3.8Å; R430-E469 PolarHBondContact NH1-OE2 2.78Å; R430-T470 CarbonylContact C-O 3.38Å; R430-T470 VanDerWaalsContact CA-O 3.3Å; R430-T470 WeakPolarHBondContact CA-O 3.41Å; R430-T470 WeakPolarHBondContact CB-O 3.08Å
431	M	86.3	Confident	81.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.4	173.2	-57.4	179.5	-65.8	0	0	108.6	E469 T470 L472 T477 H490 F535 C537	M431-E469 WeakPolarHBondContact O-CA 3.46Å; M431-T470 HydrophobicContact CB-CG2 4.09Å; M431-T470 HydrophobicContact CE-CG2 3.72Å; M431-T470 PolarHBondContact N-O 2.84Å; M431-T470 PolarHBondContact O-N 3.06Å; M431-L472 HydrophobicContact CG-CD2 3.96Å; M431-T477 HydrophobicContact CE-CG2 3.42Å; M431-T477 VanDerWaalsContact CE-CG2 3.42Å; M431-H490 HydrophobicContact CE-CB 4.22Å; M431-H490 HydrophobicContact SD-CB 3.92Å; M431-F535 HydrophobicContact CB-CE2 4.14Å; M431-F535 HydrophobicContact CE-CE2 4.07Å; M431-F535 HydrophobicContact SD-CE2 4.2Å; M431-C537 HydrophobicContact CG-CB 4.03Å; M431-C537 HydrophobicContact SD-CB 3.6Å; M431-C537 VanDerWaalsContact SD-SG 3.66Å
432	V	86.2	Confident	81.6	Confident	10 Å²	10	64.9 Å²	64.9	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.2	178.2	-174.9	0	0	0	0	108.6	Q425 R430 T467 L468 E469	Q425-V432 HydrophobicContact CB-CB 4.28Å; Q425-V432 PolarHBondContact N-O 3.41Å; Q425-V432 PolarHBondContact O-N 3.44Å; R430-V432 HydrophobicContact CG-CG2 4.41Å; V432-T467 HydrophobicContact CG1-CG2 3.68Å; V432-L468 CarbonylContact C-O 3.55Å; V432-L468 WeakPolarHBondContact CA-O 2.81Å; V432-E469 HydrophobicContact CG1-CG 4.05Å; V432-E469 HydrophobicContact CG2-CG 4.1Å
433	V	87.9	Confident	81.5	Confident	1 Å²	1	68 Å²	68	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.2	-176.5	179.4	0	0	0	0	108.5	L422 I423 V424 T467 L468 V494 F535	L422-V433 HydrophobicContact CD1-CG1 3.17Å; L422-V433 HydrophobicContact CD2-CG1 4.06Å; L422-V433 HydrophobicContact CG-CG1 3.75Å; I423-V433 CarbonylContact O-C 3.49Å; I423-V433 WeakPolarHBondContact O-CA 3.29Å; V424-V433 HydrophobicContact CG1-CG2 4.42Å; V424-V433 HydrophobicContact CG2-CG2 4.42Å; V433-T467 CarbonylContact O-C 3.5Å; V433-T467 VanDerWaalsContact O-CA 3.32Å; V433-T467 WeakPolarHBondContact O-CA 3.44Å; V433-L468 HydrophobicContact CB-CB 4.42Å; V433-L468 PolarHBondContact N-O 2.78Å; V433-L468 PolarHBondContact O-N 3.37Å; V433-V494 HydrophobicContact CG1-CG2 4.3Å; V433-F535 HydrophobicContact CG2-CD1 4Å; V433-F535 HydrophobicContact CG2-CD2 3.69Å; V433-F535 HydrophobicContact CG2-CE1 3.82Å; V433-F535 HydrophobicContact CG2-CE2 3.49Å; V433-F535 VanDerWaalsContact CG2-CE2 3.49Å; V433-F535 HydrophobicContact CG2-CG 3.93Å; V433-F535 HydrophobicContact CG2-CZ 3.53Å
434	S	84	Confident	80.8	Confident	18 Å²	18	67 Å²	67	13%	0.126	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.6	179.8	-59.8	0	0	0	0	111.4	I423 Y466	I423-S434 PolarHBondContact N-O 2.88Å; I423-S434 PolarHBondContact O-N 2.63Å; S434-Y466 CarbonylContact C-O 3.52Å; S434-Y466 VanDerWaalsContact CA-O 3.3Å; S434-Y466 WeakPolarHBondContact CA-O 3.26Å
435	I	85.4	Confident	80.3	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.7	179.6	-53.6	177	0	0	0	109	V420 L422 L440 L450 H465 Y466 V494	V420-I435 HydrophobicContact CG1-CG2 3.53Å; L422-I435 HydrophobicContact CD1-CD1 3.68Å; L422-I435 HydrophobicContact CD1-CG1 3.35Å; I435-L440 HydrophobicContact CB-CD1 4.16Å; I435-L440 HydrophobicContact CG2-CD1 3.42Å; I435-L440 VanDerWaalsContact CG2-CD1 3.42Å; I435-L440 HydrophobicContact CG2-CG 3.91Å; I435-L450 HydrophobicContact CD1-CD1 4.06Å; I435-L450 HydrophobicContact CD1-CD2 4.09Å; I435-H465 CarbonylContact O-C 3.56Å; I435-H465 VanDerWaalsContact O-CA 3.25Å; I435-H465 WeakPolarHBondContact O-CA 3.29Å; I435-Y466 PolarHBondContact N-O 2.9Å; I435-Y466 PolarHBondContact O-N 2.84Å; I435-V494 HydrophobicContact CD1-CG1 4.17Å
436	D	83.3	Confident	79.5	Confident	44 Å²	44	63.2 Å²	63.2	24%	0.235	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	132.9	177.1	-178.6	84	0	0	0	111.3	K438 S439 L440	D436-K438 WeakPolarHBondContact OD2-CA 3.38Å; D436-K438 VanDerWaalsContact OD2-CB 3.32Å; D436-K438 WeakPolarHBondContact OD2-CB 3.28Å; D436-K438 PolarHBondContact OD2-N 2.88Å; D436-S439 PolarHBondContact OD2-N 3.23Å; D436-S439 PolarHBondContact OD2-OG 3.01Å; D436-L440 PolarHBondContact O-N 3.37Å
437	R	82.6	Confident	78.7	Confident	73 Å²	73	64.4 Å²	64.4	28%	0.275	33%	0.334	S	S	.	.	H	α-helix	trans	-69.1	-39.6	-176.4	176.7	176.7	171.6	163.7	7	112.5	S439 L440 E441 T464 Y466	R437-S439 VanDerWaalsContact C-N 3.32Å; R437-L440 PolarHBondContact O-N 2.78Å; R437-E441 WeakPolarHBondContact CG-OE1 3.48Å; R437-E441 IonicContact CZ-OE1 3.82Å; R437-E441 IonicContact NE-OE1 3.09Å; R437-E441 PolarHBondContact NE-OE1 2.87Å; R437-E441 IonicContact NH2-OE1 2.93Å; R437-E441 PolarHBondContact NH2-OE1 2.91Å; R437-E441 WeakPolarHBondContact O-CG 3.16Å; R437-E441 PolarHBondContact O-N 2.97Å; R437-T464 WeakPolarHBondContact CB-O 3.06Å; R437-T464 PolarHBondContact N-O 2.8Å; R437-Y466 HydrophobicContact CB-CD2 4.27Å; R437-Y466 HydrophobicContact CB-CE2 3.93Å; R437-Y466 HydrophobicContact CG-CE2 3.86Å
438	K	79.9	Confident	78.4	Confident	160 Å²	160	61.3 Å²	61.3	70%	0.696	32%	0.321	S	S	*	.	H	α-helix	trans	-69.5	-34.1	-178.9	-63.9	-178	177.8	179.3	0	111.1	D436 E441 A442	D436-K438 WeakPolarHBondContact OD2-CA 3.38Å; D436-K438 VanDerWaalsContact OD2-CB 3.32Å; D436-K438 WeakPolarHBondContact OD2-CB 3.28Å; D436-K438 PolarHBondContact OD2-N 2.88Å; K438-E441 PolarHBondContact O-N 2.89Å; K438-A442 WeakPolarHBondContact O-CB 3.31Å; K438-A442 PolarHBondContact O-N 3.09Å
439	S	80.3	Confident	78.6	Confident	44 Å²	44	54.3 Å²	54.3	31%	0.308	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-37.7	175.6	-61.9	0	0	0	0	112.6	D436 R437 K443	D436-S439 PolarHBondContact OD2-N 3.23Å; D436-S439 PolarHBondContact OD2-OG 3.01Å; R437-S439 VanDerWaalsContact C-N 3.32Å; S439-K443 WeakPolarHBondContact O-CG 3.25Å
440	L	76.9	Confident	78.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-43.3	172.2	-88.1	158.9	0	0	0	112.4	V420 I435 D436 R437 A442 K443 F445 L450 Y466 V496	V420-L440 HydrophobicContact CG1-CG 4.41Å; I435-L440 HydrophobicContact CB-CD1 4.16Å; I435-L440 HydrophobicContact CG2-CD1 3.42Å; I435-L440 VanDerWaalsContact CG2-CD1 3.42Å; I435-L440 HydrophobicContact CG2-CG 3.91Å; D436-L440 PolarHBondContact O-N 3.37Å; R437-L440 PolarHBondContact O-N 2.78Å; L440-A442 VanDerWaalsContact C-N 3.34Å; L440-A442 PolarHBondContact O-N 2.74Å; L440-K443 PolarHBondContact O-N 2.89Å; L440-K443 VanDerWaalsContact O-N 3.15Å; L440-F445 HydrophobicContact CD2-CB 4.34Å; L440-F445 PolarHBondContact O-N 2.58Å; L440-L450 HydrophobicContact CD1-CD1 3.91Å; L440-Y466 HydrophobicContact CD1-CD2 3.64Å; L440-Y466 HydrophobicContact CD1-CE2 3.81Å; L440-V496 HydrophobicContact CD2-CG1 3.93Å
441	E	77.9	Confident	78.9	Confident	74 Å²	74	43.2 Å²	43.2	35%	0.346	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-40.8	177	-73.4	170.8	-178.7	0	0	111.6	R437 K438 K443 G444	R437-E441 WeakPolarHBondContact CG-OE1 3.48Å; R437-E441 IonicContact CZ-OE1 3.82Å; R437-E441 IonicContact NE-OE1 3.09Å; R437-E441 PolarHBondContact NE-OE1 2.87Å; R437-E441 IonicContact NH2-OE1 2.93Å; R437-E441 PolarHBondContact NH2-OE1 2.91Å; R437-E441 WeakPolarHBondContact O-CG 3.16Å; R437-E441 PolarHBondContact O-N 2.97Å; K438-E441 PolarHBondContact O-N 2.89Å; E441-K443 PolarHBondContact O-N 2.89Å; E441-G444 PolarHBondContact O-N 3.27Å; E441-G444 VanDerWaalsContact O-N 3.08Å
442	A	73.4	Confident	78.8	Confident	88 Å²	88	43.3 Å²	43.3	73%	0.727	25%	0.247	S	C	*	.	H	α-helix	trans	-63.2	-20.7	177	0	0	0	0	0	113.9	K438 L440	K438-A442 WeakPolarHBondContact O-CB 3.31Å; K438-A442 PolarHBondContact O-N 3.09Å; L440-A442 VanDerWaalsContact C-N 3.34Å; L440-A442 PolarHBondContact O-N 2.74Å
443	K	70.6	Confident	78.5	Confident	111 Å²	111	48.5 Å²	48.5	48%	0.483	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	9	177.8	-64.3	-73.4	-173.3	168.8	0	113.1	D419 V420 S439 L440 E441 F445	D419-K443 WeakPolarHBondContact O-CE 3.26Å; V420-K443 HydrophobicContact CG2-CG 4.29Å; S439-K443 WeakPolarHBondContact O-CG 3.25Å; L440-K443 PolarHBondContact O-N 2.89Å; L440-K443 VanDerWaalsContact O-N 3.15Å; E441-K443 PolarHBondContact O-N 2.89Å; K443-F445 HydrophobicContact CB-CD2 4.25Å
444	G	67.4	Low	78.1	Confident	55 Å²	55	51.4 Å²	51.4	57%	0.567	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	11.5	175.4	0	0	0	0	0	115.1	E441	E441-G444 PolarHBondContact O-N 3.27Å; E441-G444 VanDerWaalsContact O-N 3.08Å
445	F	74.1	Confident	77.7	Confident	35 Å²	35	54 Å²	54	15%	0.154	30%	0.3	C	S	.	.			trans	-104.7	71.4	177.3	-61.3	-96	0	0	0	110.5	L418 L440 K443 A448 V496 S498 P531	L418-F445 HydrophobicContact CD1-CE2 4.2Å; L418-F445 HydrophobicContact CD1-CZ 4.25Å; L418-F445 HydrophobicContact CD2-CD2 4.24Å; L418-F445 HydrophobicContact CD2-CE2 3.45Å; L418-F445 VanDerWaalsContact CD2-CE2 3.45Å; L418-F445 HydrophobicContact CD2-CZ 4Å; L418-F445 HydrophobicContact CG-CE2 4.44Å; L440-F445 HydrophobicContact CD2-CB 4.34Å; L440-F445 PolarHBondContact O-N 2.58Å; K443-F445 HydrophobicContact CB-CD2 4.25Å; F445-A448 HydrophobicContact CB-CB 3.94Å; F445-V496 HydrophobicContact CD1-CG1 3.74Å; F445-V496 HydrophobicContact CE1-CG1 4.27Å; F445-V496 HydrophobicContact CG-CG1 4.19Å; F445-S498 WeakPolarHBondContact CD1-OG 3.21Å; F445-P531 HydrophobicContact CE1-CG 3.96Å; F445-P531 HydrophobicContact CZ-CG 3.76Å
446	A	65.4	Low	77.3	Confident	36 Å²	36	61.8 Å²	61.8	30%	0.298	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	127.9	171.3	0	0	0	0	0	109.5
447	N	68.4	Low	77.3	Confident	93 Å²	93	61 Å²	61	50%	0.497	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	50.1	-175.9	-54.3	-40.9	0	0	0	114.2
448	A	77.1	Confident	77.4	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.033	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	133.1	177.5	0	0	0	0	0	113.1	F445 Y466 V496 I497	F445-A448 HydrophobicContact CB-CB 3.94Å; A448-Y466 WeakPolarHBondContact O-CE1 3.47Å; A448-Y466 PolarHBondContact O-OH 2.75Å; A448-V496 HydrophobicContact CB-CG1 3.76Å; A448-I497 CarbonylContact C-O 3.55Å; A448-I497 WeakPolarHBondContact CA-O 3.38Å
449	S	79.7	Confident	77.6	Confident	29 Å²	29	57.1 Å²	57.1	20%	0.203	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.6	164.4	171.6	0	0	0	0	109.8	I497	S449-I497 PolarHBondContact N-O 3.16Å; S449-I497 PolarHBondContact O-N 3.02Å
450	L	84.7	Confident	77.8	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	136.2	178.6	-66.4	157.3	0	0	0	110.9	I435 L440 K458 A459 Y466 L468 V494 T495 V496	I435-L450 HydrophobicContact CD1-CD1 4.06Å; I435-L450 HydrophobicContact CD1-CD2 4.09Å; L440-L450 HydrophobicContact CD1-CD1 3.91Å; L450-K458 WeakPolarHBondContact O-CA 3.47Å; L450-A459 HydrophobicContact CB-CB 3.71Å; L450-A459 HydrophobicContact CD1-CB 4.37Å; L450-A459 PolarHBondContact O-N 3.29Å; L450-Y466 HydrophobicContact CD1-CD1 3.71Å; L450-Y466 HydrophobicContact CD1-CD2 3.74Å; L450-Y466 HydrophobicContact CD1-CE1 4.48Å; L450-Y466 HydrophobicContact CD1-CE2 4.49Å; L450-Y466 HydrophobicContact CD1-CG 3.3Å; L450-L468 HydrophobicContact CB-CD1 4.3Å; L450-L468 HydrophobicContact CB-CD2 4.42Å; L450-V494 HydrophobicContact CB-CG1 4.22Å; L450-V494 HydrophobicContact CD2-CG1 3.69Å; L450-T495 WeakPolarHBondContact CA-O 3.28Å; L450-V496 HydrophobicContact CD2-CB 3.9Å; L450-V496 HydrophobicContact CD2-CG1 3.79Å; L450-V496 HydrophobicContact CD2-CG2 3.45Å; L450-V496 VanDerWaalsContact CD2-CG2 3.45Å
451	M	85	Confident	78	Confident	29 Å²	29	65.5 Å²	65.5	14%	0.143	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	153.9	174.3	63.2	-177.1	61.5	0	0	111.7	P455 C457 V494 T495 I497	M451-P455 HydrophobicContact SD-CB 3.96Å; M451-C457 WeakPolarHBondContact CA-O 2.97Å; M451-V494 CarbonylContact O-C 3.52Å; M451-V494 WeakPolarHBondContact O-CA 2.77Å; M451-T495 PolarHBondContact N-O 3.46Å; M451-T495 PolarHBondContact O-N 2.99Å; M451-I497 HydrophobicContact CE-CD1 3.33Å; M451-I497 HydrophobicContact CE-CG1 4.41Å; M451-I497 HydrophobicContact SD-CD1 4.03Å
452	L	84.8	Confident	77.9	Confident	2 Å²	2	67 Å²	67	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-179.3	168.1	-65.8	175.9	0	0	0	111	N454 C457 L468 T470 C475 S493 V494 F535	L452-N454 CarbonylContact O-C 3.58Å; L452-N454 PolarHBondContact O-N 3.32Å; L452-C457 HydrophobicContact CB-CB 4.1Å; L452-C457 HydrophobicContact CD1-CB 4.14Å; L452-C457 HydrophobicContact CG-CB 4.42Å; L452-C457 PolarHBondContact N-O 2.73Å; L452-L468 HydrophobicContact CD1-CB 4.47Å; L452-L468 HydrophobicContact CD2-CB 4.19Å; L452-L468 HydrophobicContact CD2-CD2 3.87Å; L452-L468 HydrophobicContact CG-CB 4.24Å; L452-L468 HydrophobicContact CG-CD2 3.71Å; L452-T470 HydrophobicContact CD1-CG2 3.77Å; L452-C475 HydrophobicContact CB-CB 4.29Å; L452-C475 HydrophobicContact CD1-CB 3.76Å; L452-S493 CarbonylContact C-O 3.59Å; L452-S493 VanDerWaalsContact CA-O 3.27Å; L452-S493 WeakPolarHBondContact CA-O 3.3Å; L452-V494 HydrophobicContact CD2-CG2 4.04Å; L452-F535 HydrophobicContact CD2-CE1 3.53Å; L452-F535 HydrophobicContact CD2-CZ 3.7Å
453	K	80.4	Confident	77.7	Confident	119 Å²	119	66.7 Å²	66.7	52%	0.517	37%	0.369	S	S	.	.	S	Bend	trans	-52.4	-28.3	176.4	-169.8	172.9	180	-177.2	0	113.7	N492 S493	K453-N492 WeakPolarHBondContact CB-OD1 3.28Å; K453-N492 PolarHBondContact N-OD1 3.46Å; K453-S493 PolarHBondContact N-O 3.48Å; K453-S493 VanDerWaalsContact N-O 3.12Å
454	N	78	Confident	77.8	Confident	61 Å²	61	65.2 Å²	65.2	33%	0.326	37%	0.37	S	S	.	.	S	Bend	trans	-92.1	121.6	165.9	-173.4	-18.9	0	0	0	110.5	L452 E456 C457 C475	L452-N454 CarbonylContact O-C 3.58Å; L452-N454 PolarHBondContact O-N 3.32Å; N454-E456 PolarHBondContact O-N 2.99Å; N454-E456 VanDerWaalsContact O-N 3.16Å; N454-E456 PolarHBondContact OD1-N 3.45Å; N454-E456 VanDerWaalsContact OD1-N 3.16Å; N454-C457 PolarHBondContact O-N 2.86Å; N454-C475 HydrophobicContact CB-CB 4.33Å; N454-C475 PolarHBondContact N-O 2.91Å
455	P	77.1	Confident	78.5	Confident	72 Å²	72	65.2 Å²	65.2	47%	0.468	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.4	-176.4	25.5	-35.8	0	0	0	115.1	M451 C457	M451-P455 HydrophobicContact SD-CB 3.96Å; P455-C457 VanDerWaalsContact C-N 3.26Å; P455-C457 PolarHBondContact O-N 2.82Å
456	E	77.2	Confident	79.1	Confident	166 Å²	166	63.9 Å²	63.9	78%	0.776	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.7	173.8	-64.4	-60.8	138.6	0	0	112.4	N454 K458	N454-E456 PolarHBondContact O-N 2.99Å; N454-E456 VanDerWaalsContact O-N 3.16Å; N454-E456 PolarHBondContact OD1-N 3.45Å; N454-E456 VanDerWaalsContact OD1-N 3.16Å; E456-K458 PolarHBondContact O-N 3.14Å
457	C	82.3	Confident	80	Confident	27 Å²	27	63.6 Å²	63.6	18%	0.182	34%	0.343	C	S	.	.			trans	-93.6	79.7	-177.2	-58.7	0	0	0	0	110.8	M451 L452 N454 P455 C475	M451-C457 WeakPolarHBondContact CA-O 2.97Å; L452-C457 HydrophobicContact CB-CB 4.1Å; L452-C457 HydrophobicContact CD1-CB 4.14Å; L452-C457 HydrophobicContact CG-CB 4.42Å; L452-C457 PolarHBondContact N-O 2.73Å; N454-C457 PolarHBondContact O-N 2.86Å; P455-C457 VanDerWaalsContact C-N 3.26Å; P455-C457 PolarHBondContact O-N 2.82Å; C457-C475 HydrophobicContact CB-CB 3.64Å; C457-C475 WeakPolarHBondContact CB-SG 3.41Å; C457-C475 WeakPolarHBondContact SG-CB 3.5Å; C457-C475 CovalentContact SG-SG 2.03Å; C457-C475 PolarHBondContact SG-SG 3.2Å
458	K	84.2	Confident	80.9	Confident	133 Å²	133	59.2 Å²	59.2	58%	0.578	32%	0.32	S	S	*	.	B	Isolated β-bridge	trans	-87.7	152.8	-179.9	-62.4	-174.6	-179.7	-175.7	0	112.7	L450 E456	L450-K458 WeakPolarHBondContact O-CA 3.47Å; E456-K458 PolarHBondContact O-N 3.14Å
459	A	85.8	Confident	81.3	Confident	18 Å²	18	62.1 Å²	62.1	15%	0.149	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-67.1	140.5	174.9	0	0	0	0	0	112.2	L450 Y466 T467 L468	L450-A459 HydrophobicContact CB-CB 3.71Å; L450-A459 HydrophobicContact CD1-CB 4.37Å; L450-A459 PolarHBondContact O-N 3.29Å; A459-Y466 HydrophobicContact CB-CD1 4.38Å; A459-T467 CarbonylContact C-O 3.53Å; A459-T467 WeakPolarHBondContact CA-O 3.3Å; A459-L468 HydrophobicContact CB-CD1 3.95Å; A459-L468 HydrophobicContact CB-CD2 4.12Å; A459-L468 HydrophobicContact CB-CG 3.65Å
460	K	83.8	Confident	81.5	Confident	131 Å²	131	60.9 Å²	60.9	57%	0.57	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.6	164.4	-62.4	175	-169.6	161.8	0	108.1	T467 E469	K460-T467 PolarHBondContact N-O 2.87Å; K460-T467 PolarHBondContact O-N 2.88Å; K460-E469 IonicContact NZ-OE1 2.77Å; K460-E469 PolarHBondContact NZ-OE1 2.87Å; K460-E469 IonicContact NZ-OE2 3.7Å
461	V	80.9	Confident	81.5	Confident	90 Å²	90	63 Å²	63	55%	0.545	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.9	-179.7	-167.9	0	0	0	0	109.4	Y466	V461-Y466 HydrophobicContact CB-CD1 4.29Å; V461-Y466 HydrophobicContact CB-CE1 4.28Å; V461-Y466 HydrophobicContact CG1-CD1 4.09Å; V461-Y466 HydrophobicContact CG1-CE1 3.8Å; V461-Y466 HydrophobicContact CG2-CD1 3.69Å; V461-Y466 HydrophobicContact CG2-CE1 3.6Å
462	N	76.8	Confident	81.3	Confident	106 Å²	106	63.1 Å²	63.1	57%	0.567	34%	0.339	S	S	*	.			trans	-104.8	172.1	167.8	-158.8	-3.4	0	0	0	110	T464 H465	N462-T464 PolarHBondContact O-N 2.91Å; N462-T464 VanDerWaalsContact O-N 3.1Å; N462-H465 WeakPolarHBondContact CA-O 3.46Å; N462-H465 WeakPolarHBondContact CB-O 3.42Å; N462-H465 PolarHBondContact N-O 3.11Å
463	A	67.4	Low	80.9	Confident	82 Å²	82	68.1 Å²	68.1	68%	0.678	37%	0.37	S	S	*	.	S	Bend	trans	-59.3	-25.2	-176.7	0	0	0	0	0	114
464	T	74.1	Confident	80.7	Confident	80 Å²	80	68 Å²	68	49%	0.491	37%	0.371	S	S	.	.	S	Bend	trans	-121.1	-24.2	-176.8	54	0	0	0	0	114	R437 N462	R437-T464 WeakPolarHBondContact CB-O 3.06Å; R437-T464 PolarHBondContact N-O 2.8Å; N462-T464 PolarHBondContact O-N 2.91Å; N462-T464 VanDerWaalsContact O-N 3.1Å
465	H	81.8	Confident	80.7	Confident	55 Å²	55	65.7 Å²	65.7	26%	0.255	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.4	-173	-64.2	75.9	0	0	0	112.6	I435 N462	I435-H465 CarbonylContact O-C 3.56Å; I435-H465 VanDerWaalsContact O-CA 3.25Å; I435-H465 WeakPolarHBondContact O-CA 3.29Å; N462-H465 WeakPolarHBondContact CA-O 3.46Å; N462-H465 WeakPolarHBondContact CB-O 3.42Å; N462-H465 PolarHBondContact N-O 3.11Å
466	Y	85.6	Confident	80.5	Confident	6 Å²	6	64 Å²	64	2%	0.024	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.4	161	-65.2	-88.5	0	0	0	109.6	S434 I435 R437 L440 A448 L450 A459 V461	S434-Y466 CarbonylContact C-O 3.52Å; S434-Y466 VanDerWaalsContact CA-O 3.3Å; S434-Y466 WeakPolarHBondContact CA-O 3.26Å; I435-Y466 PolarHBondContact N-O 2.9Å; I435-Y466 PolarHBondContact O-N 2.84Å; R437-Y466 HydrophobicContact CB-CD2 4.27Å; R437-Y466 HydrophobicContact CB-CE2 3.93Å; R437-Y466 HydrophobicContact CG-CE2 3.86Å; L440-Y466 HydrophobicContact CD1-CD2 3.64Å; L440-Y466 HydrophobicContact CD1-CE2 3.81Å; A448-Y466 WeakPolarHBondContact O-CE1 3.47Å; A448-Y466 PolarHBondContact O-OH 2.75Å; L450-Y466 HydrophobicContact CD1-CD1 3.71Å; L450-Y466 HydrophobicContact CD1-CD2 3.74Å; L450-Y466 HydrophobicContact CD1-CE1 4.48Å; L450-Y466 HydrophobicContact CD1-CE2 4.49Å; L450-Y466 HydrophobicContact CD1-CG 3.3Å; A459-Y466 HydrophobicContact CB-CD1 4.38Å; V461-Y466 HydrophobicContact CB-CD1 4.29Å; V461-Y466 HydrophobicContact CB-CE1 4.28Å; V461-Y466 HydrophobicContact CG1-CD1 4.09Å; V461-Y466 HydrophobicContact CG1-CE1 3.8Å; V461-Y466 HydrophobicContact CG2-CD1 3.69Å; V461-Y466 HydrophobicContact CG2-CE1 3.6Å
467	T	84.6	Confident	80.7	Confident	30 Å²	30	56.8 Å²	56.8	18%	0.184	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.8	-178	-54.8	0	0	0	0	111	V432 V433 A459 K460 E469	V432-T467 HydrophobicContact CG1-CG2 3.68Å; V433-T467 CarbonylContact O-C 3.5Å; V433-T467 VanDerWaalsContact O-CA 3.32Å; V433-T467 WeakPolarHBondContact O-CA 3.44Å; A459-T467 CarbonylContact C-O 3.53Å; A459-T467 WeakPolarHBondContact CA-O 3.3Å; K460-T467 PolarHBondContact N-O 2.87Å; K460-T467 PolarHBondContact O-N 2.88Å; T467-E469 HydrophobicContact CG2-CG 4.34Å
468	L	87.8	Confident	80.3	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.3	172	-58.5	100.3	0	0	0	109.5	V432 V433 L450 L452 A459 V494	V432-L468 CarbonylContact C-O 3.55Å; V432-L468 WeakPolarHBondContact CA-O 2.81Å; V433-L468 HydrophobicContact CB-CB 4.42Å; V433-L468 PolarHBondContact N-O 2.78Å; V433-L468 PolarHBondContact O-N 3.37Å; L450-L468 HydrophobicContact CB-CD1 4.3Å; L450-L468 HydrophobicContact CB-CD2 4.42Å; L452-L468 HydrophobicContact CD1-CB 4.47Å; L452-L468 HydrophobicContact CD2-CB 4.19Å; L452-L468 HydrophobicContact CD2-CD2 3.87Å; L452-L468 HydrophobicContact CG-CB 4.24Å; L452-L468 HydrophobicContact CG-CD2 3.71Å; A459-L468 HydrophobicContact CB-CD1 3.95Å; A459-L468 HydrophobicContact CB-CD2 4.12Å; A459-L468 HydrophobicContact CB-CG 3.65Å; L468-V494 HydrophobicContact CD1-CG1 4.08Å; L468-V494 HydrophobicContact CD1-CG2 4.3Å; L468-V494 HydrophobicContact CD2-CG1 4.27Å
469	E	85.8	Confident	79.9	Confident	65 Å²	65	55.2 Å²	55.2	30%	0.304	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.3	177.8	-62.8	175.9	-127	0	0	109	R430 M431 V432 K460 T467	R430-E469 IonicContact CZ-OE2 3.17Å; R430-E469 IonicContact NH1-OE2 3.8Å; R430-E469 PolarHBondContact NH1-OE2 2.78Å; M431-E469 WeakPolarHBondContact O-CA 3.46Å; V432-E469 HydrophobicContact CG1-CG 4.05Å; V432-E469 HydrophobicContact CG2-CG 4.1Å; K460-E469 IonicContact NZ-OE1 2.77Å; K460-E469 PolarHBondContact NZ-OE1 2.87Å; K460-E469 IonicContact NZ-OE2 3.7Å; T467-E469 HydrophobicContact CG2-CG 4.34Å
470	T	83.4	Confident	78.7	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	135.2	174.4	177.3	0	0	0	0	112	R430 M431 L452 E474 C475 T477 F535	R430-T470 CarbonylContact C-O 3.38Å; R430-T470 VanDerWaalsContact CA-O 3.3Å; R430-T470 WeakPolarHBondContact CA-O 3.41Å; R430-T470 WeakPolarHBondContact CB-O 3.08Å; M431-T470 HydrophobicContact CB-CG2 4.09Å; M431-T470 HydrophobicContact CE-CG2 3.72Å; M431-T470 PolarHBondContact N-O 2.84Å; M431-T470 PolarHBondContact O-N 3.06Å; L452-T470 HydrophobicContact CD1-CG2 3.77Å; T470-E474 PolarHBondContact OG1-O 3.45Å; T470-E474 VanDerWaalsContact OG1-O 3.08Å; T470-C475 WeakPolarHBondContact OG1-CB 3.43Å; T470-T477 PolarHBondContact OG1-OG1 2.73Å; T470-F535 HydrophobicContact CG2-CZ 4.39Å
471	P	84.9	Confident	77.8	Confident	48 Å²	48	56.7 Å²	56.7	31%	0.312	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	158.1	162.5	-22.4	34.1	0	0	0	111.8	T473 E474	P471-T473 PolarHBondContact O-N 2.84Å; P471-E474 HydrophobicContact CB-CB 3.98Å; P471-E474 HydrophobicContact CB-CG 4.08Å; P471-E474 HydrophobicContact CG-CB 4.03Å; P471-E474 HydrophobicContact CG-CG 4.26Å; P471-E474 WeakPolarHBondContact CG-OE2 3.34Å; P471-E474 PolarHBondContact O-N 3.18Å
472	L	79.9	Confident	76.7	Confident	31 Å²	31	55.2 Å²	55.2	16%	0.162	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.3	-173.4	-59.4	-172.7	0	0	0	114.9	M431 T477 H490 Y539	M431-L472 HydrophobicContact CG-CD2 3.96Å; L472-T477 WeakPolarHBondContact O-CG2 3.49Å; L472-H490 PolarHBondContact O-CE1 2.83Å; L472-H490 PolarHBondContact O-ND1 2.8Å; L472-Y539 HydrophobicContact CD1-CD1 4.3Å; L472-Y539 HydrophobicContact CD1-CD2 4.11Å; L472-Y539 HydrophobicContact CD1-CE1 4.33Å; L472-Y539 HydrophobicContact CD1-CE2 4.12Å; L472-Y539 HydrophobicContact CD1-CG 4.19Å; L472-Y539 HydrophobicContact CD2-CD2 4.1Å; L472-Y539 HydrophobicContact CD2-CE1 4.21Å; L472-Y539 HydrophobicContact CD2-CE2 3.32Å; L472-Y539 WeakPolarHBondContact CD2-OH 3.48Å; L472-Y539 HydrophobicContact CG-CE2 4.35Å
473	T	77.2	Confident	74.9	Confident	106 Å²	106	56.8 Å²	56.8	65%	0.65	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	3.5	-176.9	53.4	0	0	0	0	113.5	P471 V479	P471-T473 PolarHBondContact O-N 2.84Å; T473-V479 HydrophobicContact CG2-CG2 4.27Å
474	E	76.4	Confident	73.7	Confident	117 Å²	117	61.6 Å²	61.6	55%	0.547	34%	0.341	S	S	.	.	S	Bend	trans	-111.9	179.8	-175.1	-64.9	-178	-164	0	0	111	T470 P471 G476 T477	T470-E474 PolarHBondContact OG1-O 3.45Å; T470-E474 VanDerWaalsContact OG1-O 3.08Å; P471-E474 HydrophobicContact CB-CB 3.98Å; P471-E474 HydrophobicContact CB-CG 4.08Å; P471-E474 HydrophobicContact CG-CB 4.03Å; P471-E474 HydrophobicContact CG-CG 4.26Å; P471-E474 WeakPolarHBondContact CG-OE2 3.34Å; P471-E474 PolarHBondContact O-N 3.18Å; E474-G476 PolarHBondContact O-N 3.44Å; E474-G476 VanDerWaalsContact O-N 3.07Å; E474-T477 VanDerWaalsContact O-CB 3.26Å; E474-T477 WeakPolarHBondContact O-CB 3.42Å; E474-T477 PolarHBondContact O-N 2.89Å; E474-T477 PolarHBondContact O-OG1 3.45Å
475	C	78.7	Confident	72.5	Confident	13 Å²	13	61.3 Å²	61.3	9%	0.088	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	51	31.6	-178.3	-58.2	0	0	0	0	115.9	L452 N454 C457 T470 T477 N492	L452-C475 HydrophobicContact CB-CB 4.29Å; L452-C475 HydrophobicContact CD1-CB 3.76Å; N454-C475 HydrophobicContact CB-CB 4.33Å; N454-C475 PolarHBondContact N-O 2.91Å; C457-C475 HydrophobicContact CB-CB 3.64Å; C457-C475 WeakPolarHBondContact CB-SG 3.41Å; C457-C475 WeakPolarHBondContact SG-CB 3.5Å; C457-C475 CovalentContact SG-SG 2.03Å; C457-C475 PolarHBondContact SG-SG 3.2Å; T470-C475 WeakPolarHBondContact OG1-CB 3.43Å; C475-T477 VanDerWaalsContact C-N 3.34Å; C475-N492 PolarHBondContact O-ND2 3.02Å
476	G	71.4	Confident	71.4	Confident	36 Å²	36	63.8 Å²	63.8	37%	0.371	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	14.3	179.4	0	0	0	0	0	114.6	E474 I478	E474-G476 PolarHBondContact O-N 3.44Å; E474-G476 VanDerWaalsContact O-N 3.07Å; G476-I478 PolarHBondContact O-N 2.99Å
477	T	81.3	Confident	70.6	Confident	14 Å²	14	66.3 Å²	66.3	9%	0.086	37%	0.365	C	S	.	.			trans	-63.6	123.7	176.4	-56.2	0	0	0	0	110.9	M431 T470 L472 E474 C475 H490 I491 N492	M431-T477 HydrophobicContact CE-CG2 3.42Å; M431-T477 VanDerWaalsContact CE-CG2 3.42Å; T470-T477 PolarHBondContact OG1-OG1 2.73Å; L472-T477 WeakPolarHBondContact O-CG2 3.49Å; E474-T477 VanDerWaalsContact O-CB 3.26Å; E474-T477 WeakPolarHBondContact O-CB 3.42Å; E474-T477 PolarHBondContact O-N 2.89Å; E474-T477 PolarHBondContact O-OG1 3.45Å; C475-T477 VanDerWaalsContact C-N 3.34Å; T477-H490 HydrophobicContact CG2-CB 3.91Å; T477-I491 WeakPolarHBondContact CA-O 3.45Å; T477-N492 PolarHBondContact OG1-ND2 3.05Å
478	I	75	Confident	70.2	Confident	66 Å²	66	66 Å²	66	34%	0.338	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.1	178	-48.8	162	0	0	0	108.9	G476 F480 H490 I491	G476-I478 PolarHBondContact O-N 2.99Å; I478-F480 HydrophobicContact CB-CD2 4.38Å; I478-F480 HydrophobicContact CB-CE2 3.75Å; I478-F480 HydrophobicContact CB-CZ 4.35Å; I478-F480 HydrophobicContact CD1-CE2 4.48Å; I478-F480 HydrophobicContact CG2-CD2 3.9Å; I478-F480 HydrophobicContact CG2-CE1 4.24Å; I478-F480 HydrophobicContact CG2-CE2 3.24Å; I478-F480 HydrophobicContact CG2-CZ 3.45Å; I478-F480 VanDerWaalsContact CG2-CZ 3.45Å; I478-H490 CarbonylContact O-C 3.6Å; I478-H490 WeakPolarHBondContact O-CA 3.08Å; I478-I491 PolarHBondContact N-O 2.94Å; I478-I491 PolarHBondContact O-N 2.85Å
479	V	75.2	Confident	69.8	Low	62 Å²	62	67.9 Å²	67.9	38%	0.376	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.5	-177.2	-173.1	0	0	0	0	110	T473 V488 L489	T473-V479 HydrophobicContact CG2-CG2 4.27Å; V479-V488 HydrophobicContact CG1-CG1 3.16Å; V479-L489 CarbonylContact C-O 3.42Å; V479-L489 WeakPolarHBondContact CA-O 3.37Å
480	F	60.3	Low	69.5	Low	88 Å²	88	65.4 Å²	65.4	39%	0.386	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.6	-177.4	-70.3	-79.7	0	0	0	110.8	I478 V482 L489 I491	I478-F480 HydrophobicContact CB-CD2 4.38Å; I478-F480 HydrophobicContact CB-CE2 3.75Å; I478-F480 HydrophobicContact CB-CZ 4.35Å; I478-F480 HydrophobicContact CD1-CE2 4.48Å; I478-F480 HydrophobicContact CG2-CD2 3.9Å; I478-F480 HydrophobicContact CG2-CE1 4.24Å; I478-F480 HydrophobicContact CG2-CE2 3.24Å; I478-F480 HydrophobicContact CG2-CZ 3.45Å; I478-F480 VanDerWaalsContact CG2-CZ 3.45Å; F480-V482 PolarHBondContact O-N 3.3Å; F480-L489 HydrophobicContact CB-CB 4.17Å; F480-L489 PolarHBondContact N-O 2.85Å; F480-L489 PolarHBondContact O-N 3.39Å; F480-I491 HydrophobicContact CD2-CD1 3.64Å; F480-I491 HydrophobicContact CD2-CG1 3.99Å; F480-I491 HydrophobicContact CE2-CB 4.47Å; F480-I491 HydrophobicContact CE2-CD1 3.63Å; F480-I491 HydrophobicContact CE2-CG1 4.16Å
481	P	65.1	Low	69.5	Low	91 Å²	91	67.5 Å²	67.5	59%	0.591	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	122	172.6	29.2	-31.2	0	0	0	110.5	H483	P481-H483 PolarHBondContact O-N 3.49Å
482	V	57.5	Low	69.3	Low	60 Å²	60	65.4 Å²	65.4	36%	0.364	36%	0.359	S	S	.	.			trans	-78.2	114	-178.6	-178.2	0	0	0	0	109.5	F480 T485 D487 L489	F480-V482 PolarHBondContact O-N 3.3Å; V482-T485 VanDerWaalsContact CB-OG1 3.3Å; V482-T485 WeakPolarHBondContact CB-OG1 3.22Å; V482-T485 VanDerWaalsContact CG1-OG1 3.3Å; V482-T485 WeakPolarHBondContact CG1-OG1 3.42Å; V482-T485 PolarHBondContact O-N 3.3Å; V482-T485 PolarHBondContact O-OG1 3.45Å; V482-T485 VanDerWaalsContact O-OG1 3.14Å; V482-D487 PolarHBondContact N-O 3.17Å; V482-L489 HydrophobicContact CG2-CB 4.29Å
483	H	39.8	Very low	69.4	Low	138 Å²	138	64.5 Å²	64.5	64%	0.639	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	141.8	-179.8	-75.2	15.1	0	0	0	111.4	P481 T485	P481-H483 PolarHBondContact O-N 3.49Å; H483-T485 VanDerWaalsContact C-N 3.26Å; H483-T485 PolarHBondContact O-N 2.91Å
484	N	41.5	Very low	69.8	Low	183 Å²	183	59.5 Å²	59.5	98%	0.979	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	9.3	-175.6	-96.2	0.5	0	0	0	117
485	T	49.1	Very low	70.1	Confident	75 Å²	75	55.4 Å²	55.4	46%	0.46	31%	0.307	S	S	.	.	S	Bend	trans	-135.8	167.3	174.3	64.9	0	0	0	0	111.7	V482 H483	V482-T485 VanDerWaalsContact CB-OG1 3.3Å; V482-T485 WeakPolarHBondContact CB-OG1 3.22Å; V482-T485 VanDerWaalsContact CG1-OG1 3.3Å; V482-T485 WeakPolarHBondContact CG1-OG1 3.42Å; V482-T485 PolarHBondContact O-N 3.3Å; V482-T485 PolarHBondContact O-OG1 3.45Å; V482-T485 VanDerWaalsContact O-OG1 3.14Å; H483-T485 VanDerWaalsContact C-N 3.26Å; H483-T485 PolarHBondContact O-N 2.91Å
486	Q	58.6	Low	70.2	Confident	106 Å²	106	54.8 Å²	54.8	50%	0.495	30%	0.303	S	S	.	.	S	Bend	trans	-89	15.1	174.5	-78.4	178.4	-17.3	0	0	112.5	K541	Q486-K541 VanDerWaalsContact O-CB 3.29Å; Q486-K541 WeakPolarHBondContact O-CB 3.44Å; Q486-K541 PolarHBondContact O-N 3.27Å
487	D	68.2	Low	70.5	Confident	59 Å²	59	56.4 Å²	56.4	32%	0.316	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.8	-171	-57.4	-28.1	0	0	0	110.9	V482 Y539 R540	V482-D487 PolarHBondContact N-O 3.17Å; D487-Y539 WeakPolarHBondContact CA-O 3.31Å; D487-R540 WeakPolarHBondContact OD1-CG 3.49Å
488	V	77.4	Confident	70.1	Confident	23 Å²	23	57.9 Å²	57.9	14%	0.139	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.9	-178.9	-172.7	0	0	0	0	107.9	V479 H490 T538 Y539 K541	V479-V488 HydrophobicContact CG1-CG1 3.16Å; V488-H490 WeakPolarHBondContact CG1-NE2 3.33Å; V488-H490 PolarHBondContact O-CD2 2.82Å; V488-T538 WeakPolarHBondContact O-CA 3.34Å; V488-Y539 PolarHBondContact N-O 3.34Å; V488-Y539 PolarHBondContact O-N 3.18Å; V488-K541 HydrophobicContact CG2-CB 4.49Å
489	L	80.1	Confident	69.3	Low	42 Å²	42	61.2 Å²	61.2	22%	0.22	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	128	-179.9	177	70.4	0	0	0	109.5	V479 F480 V482 I491 N536 T538	V479-L489 CarbonylContact C-O 3.42Å; V479-L489 WeakPolarHBondContact CA-O 3.37Å; F480-L489 HydrophobicContact CB-CB 4.17Å; F480-L489 PolarHBondContact N-O 2.85Å; F480-L489 PolarHBondContact O-N 3.39Å; V482-L489 HydrophobicContact CG2-CB 4.29Å; L489-I491 HydrophobicContact CD2-CD1 3.8Å; L489-I491 HydrophobicContact CD2-CG1 4.15Å; L489-I491 HydrophobicContact CG-CD1 4.16Å; L489-I491 HydrophobicContact CG-CG1 3.93Å; L489-N536 HydrophobicContact CD1-CB 4Å; L489-T538 HydrophobicContact CB-CG2 4.31Å; L489-T538 HydrophobicContact CD1-CG2 3.44Å; L489-T538 VanDerWaalsContact CD1-CG2 3.44Å; L489-T538 HydrophobicContact CG-CG2 4.49Å
490	H	79.4	Confident	68.1	Low	13 Å²	13	65.6 Å²	65.6	6%	0.06	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.1	179	-66.4	-106.7	0	0	0	108.8	M431 L472 T477 I478 V488 N536 C537 Y539	M431-H490 HydrophobicContact CE-CB 4.22Å; M431-H490 HydrophobicContact SD-CB 3.92Å; L472-H490 PolarHBondContact O-CE1 2.83Å; L472-H490 PolarHBondContact O-ND1 2.8Å; T477-H490 HydrophobicContact CG2-CB 3.91Å; I478-H490 CarbonylContact O-C 3.6Å; I478-H490 WeakPolarHBondContact O-CA 3.08Å; V488-H490 WeakPolarHBondContact CG1-NE2 3.33Å; V488-H490 PolarHBondContact O-CD2 2.82Å; H490-N536 CarbonylContact O-C 3.57Å; H490-N536 WeakPolarHBondContact O-CA 3.37Å; H490-C537 PolarHBondContact N-O 2.82Å; H490-C537 PolarHBondContact O-N 2.8Å; H490-Y539 HydrophobicContact CB-CE2 4.44Å; H490-Y539 AromaticContact CD2-CD2 3.44Å; H490-Y539 VanDerWaalsContact CD2-CD2 3.44Å; H490-Y539 WeakPolarHBondContact CD2-CD2 3.43Å; H490-Y539 AromaticContact NE2-CD2 3.94Å
491	I	81.5	Confident	67.2	Low	47 Å²	47	65.5 Å²	65.5	24%	0.241	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134	-174	-50.7	-175.8	0	0	0	110	T477 I478 F480 L489 F535 N536	T477-I491 WeakPolarHBondContact CA-O 3.45Å; I478-I491 PolarHBondContact N-O 2.94Å; I478-I491 PolarHBondContact O-N 2.85Å; F480-I491 HydrophobicContact CD2-CD1 3.64Å; F480-I491 HydrophobicContact CD2-CG1 3.99Å; F480-I491 HydrophobicContact CE2-CB 4.47Å; F480-I491 HydrophobicContact CE2-CD1 3.63Å; F480-I491 HydrophobicContact CE2-CG1 4.16Å; L489-I491 HydrophobicContact CD2-CD1 3.8Å; L489-I491 HydrophobicContact CD2-CG1 4.15Å; L489-I491 HydrophobicContact CG-CD1 4.16Å; L489-I491 HydrophobicContact CG-CG1 3.93Å; I491-F535 WeakPolarHBondContact CA-O 3.22Å; I491-N536 HydrophobicContact CG1-CB 4Å
492	N	81.8	Confident	66.2	Low	4 Å²	4	70.1 Å²	70.1	2%	0.021	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	172.3	173	-158.4	-22.1	0	0	0	110	K453 C475 T477 F535	K453-N492 WeakPolarHBondContact CB-OD1 3.28Å; K453-N492 PolarHBondContact N-OD1 3.46Å; C475-N492 PolarHBondContact O-ND2 3.02Å; T477-N492 PolarHBondContact OG1-ND2 3.05Å; N492-F535 HydrophobicContact CB-CE1 3.87Å; N492-F535 HydrophobicContact CB-CE2 4.01Å; N492-F535 HydrophobicContact CB-CZ 3.55Å; N492-F535 PolarHBondContact N-O 2.92Å; N492-F535 WeakPolarHBondContact O-CD1 3.43Å; N492-F535 PolarHBondContact O-N 2.91Å
493	S	83	Confident	64.9	Low	12 Å²	12	70.8 Å²	70.8	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.2	-174.2	63	0	0	0	0	111.7	L452 K453 I533 N534	L452-S493 CarbonylContact C-O 3.59Å; L452-S493 VanDerWaalsContact CA-O 3.27Å; L452-S493 WeakPolarHBondContact CA-O 3.3Å; K453-S493 PolarHBondContact N-O 3.48Å; K453-S493 VanDerWaalsContact N-O 3.12Å; S493-I533 CarbonylContact C-O 3.58Å; S493-I533 WeakPolarHBondContact CA-O 3.45Å; S493-N534 VanDerWaalsContact CB-OD1 3.23Å; S493-N534 WeakPolarHBondContact CB-OD1 3.35Å
494	V	85	Confident	64.4	Low	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.2	176.3	-173.5	0	0	0	0	109.5	V433 I435 L450 M451 L452 L468 L532 I533 F535	V433-V494 HydrophobicContact CG1-CG2 4.3Å; I435-V494 HydrophobicContact CD1-CG1 4.17Å; L450-V494 HydrophobicContact CB-CG1 4.22Å; L450-V494 HydrophobicContact CD2-CG1 3.69Å; M451-V494 CarbonylContact O-C 3.52Å; M451-V494 WeakPolarHBondContact O-CA 2.77Å; L452-V494 HydrophobicContact CD2-CG2 4.04Å; L468-V494 HydrophobicContact CD1-CG1 4.08Å; L468-V494 HydrophobicContact CD1-CG2 4.3Å; L468-V494 HydrophobicContact CD2-CG1 4.27Å; V494-L532 WeakPolarHBondContact O-CA 3.28Å; V494-I533 HydrophobicContact CB-CB 4.44Å; V494-I533 PolarHBondContact N-O 3.05Å; V494-I533 PolarHBondContact O-N 3.45Å; V494-F535 HydrophobicContact CG2-CD1 4.03Å; V494-F535 HydrophobicContact CG2-CE1 3.84Å
495	T	82.4	Confident	64.2	Low	31 Å²	31	71.1 Å²	71.1	19%	0.19	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132	173.4	-55.8	0	0	0	0	109.6	L450 M451 I497 A530 L532	L450-T495 WeakPolarHBondContact CA-O 3.28Å; M451-T495 PolarHBondContact N-O 3.46Å; M451-T495 PolarHBondContact O-N 2.99Å; T495-I497 HydrophobicContact CG2-CG1 4.41Å; T495-A530 HydrophobicContact CG2-CB 3.87Å; T495-L532 VanDerWaalsContact OG1-CD1 3.29Å; T495-L532 WeakPolarHBondContact OG1-CD1 3.34Å
496	V	81.1	Confident	63.3	Low	1 Å²	1	75 Å²	75	1%	0.006	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.4	179.7	-164.4	0	0	0	0	110.1	L418 L440 F445 A448 L450 P531 I533	L418-V496 HydrophobicContact CD1-CB 4.02Å; L418-V496 HydrophobicContact CD1-CG2 3.44Å; L418-V496 VanDerWaalsContact CD1-CG2 3.44Å; L440-V496 HydrophobicContact CD2-CG1 3.93Å; F445-V496 HydrophobicContact CD1-CG1 3.74Å; F445-V496 HydrophobicContact CE1-CG1 4.27Å; F445-V496 HydrophobicContact CG-CG1 4.19Å; A448-V496 HydrophobicContact CB-CG1 3.76Å; L450-V496 HydrophobicContact CD2-CB 3.9Å; L450-V496 HydrophobicContact CD2-CG1 3.79Å; L450-V496 HydrophobicContact CD2-CG2 3.45Å; L450-V496 VanDerWaalsContact CD2-CG2 3.45Å; V496-P531 HydrophobicContact CB-CG 4.18Å; V496-P531 HydrophobicContact CG2-CG 4.49Å; V496-P531 PolarHBondContact N-O 2.94Å; V496-I533 HydrophobicContact CG2-CD1 4.39Å
497	I	78.3	Confident	62.7	Low	70 Å²	70	74.5 Å²	74.5	36%	0.359	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	177.8	-51.6	-177.9	0	0	0	108.7	A448 S449 M451 T495	A448-I497 CarbonylContact C-O 3.55Å; A448-I497 WeakPolarHBondContact CA-O 3.38Å; S449-I497 PolarHBondContact N-O 3.16Å; S449-I497 PolarHBondContact O-N 3.02Å; M451-I497 HydrophobicContact CE-CD1 3.33Å; M451-I497 HydrophobicContact CE-CG1 4.41Å; M451-I497 HydrophobicContact SD-CD1 4.03Å; T495-I497 HydrophobicContact CG2-CG1 4.41Å
498	S	71.3	Confident	60.9	Low	44 Å²	44	79.1 Å²	79.1	31%	0.308	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	135.8	170.8	-65.1	0	0	0	0	110.7	F445 E500	F445-S498 WeakPolarHBondContact CD1-OG 3.21Å; S498-E500 VanDerWaalsContact C-N 3.32Å; S498-E500 PolarHBondContact O-N 2.95Å
499	E	59.9	Low	58.5	Low	137 Å²	137	83 Å²	83	64%	0.64	47%	0.473	S	S	*	.	S	Bend	trans	-82.1	-0.1	177.4	-72.3	-169.7	159.3	0	0	114.3	A501	E499-A501 PolarHBondContact O-N 3.05Å
500	E	48.8	Very low	56.1	Low	154 Å²	154	86.1 Å²	86.1	72%	0.72	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	22.6	-178.8	-70	-178.8	167.2	0	0	115.3	S498	S498-E500 VanDerWaalsContact C-N 3.32Å; S498-E500 PolarHBondContact O-N 2.95Å
501	A	41.8	Very low	53.6	Low	85 Å²	85	95.2 Å²	95.2	70%	0.702	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	39.6	169.1	0	0	0	0	0	111.8	E499	E499-A501 PolarHBondContact O-N 3.05Å
502	Q	43.9	Very low	51	Low	188 Å²	188	101.4 Å²	101.4	88%	0.879	55%	0.554	S	S	*	*	S	Bend	trans	-159.5	104.6	165.5	-153.8	98.5	21.8	0	0	111.1
503	G	29.6	Very low	48.9	Very low	75 Å²	75	106.4 Å²	106.4	77%	0.773	59%	0.586	S	S	*	*			trans	141.9	93.4	160.1	0	0	0	0	0	115.2
504	D	29.7	Very low	46.1	Very low	166 Å²	166	117.3 Å²	117.3	89%	0.888	63%	0.626	S	S	*	*				-157	96.1	119.7	-138.4	16.4	0	0	0	109.2
505	D	37.9	Very low	43.4	Very low	162 Å²	162	126 Å²	126	87%	0.866	67%	0.671	S	S	*	*			trans	-85.7	115.1	157.3	-99.6	-35.3	0	0	0	105.9
506	D	30	Very low	40.7	Very low	157 Å²	157	127.7 Å²	127.7	84%	0.84	70%	0.695	S	S	*	*			trans	-155.7	147.5	139.7	-126.3	7.8	0	0	0	112.5
507	P	46.5	Very low	38.2	Very low	95 Å²	95	137.4 Å²	137.4	62%	0.617	74%	0.74	S	S	*	*			trans	-102	173.9	-156.4	41.3	-38.5	0	0	0	113.9
508	I	29.3	Very low	36	Very low	156 Å²	156	139 Å²	139	80%	0.8	76%	0.764	S	S	*	*			trans	90.5	101.7	162.9	-58	166.4	0	0	0	116.2
509	S	27.9	Very low	33.8	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	79%	0.785	S	S	*	*				-179	114.7	103.9	43.7	0	0	0	0	113
510	T	28.5	Very low	32.3	Very low	108 Å²	108	143.3 Å²	143.3	66%	0.663	80%	0.795	S	S	*	*			trans	11.7	133.1	132.7	46.8	0	0	0	0	117.1
511	W	28.1	Very low	31.2	Very low	204 Å²	204	141.5 Å²	141.5	77%	0.773	80%	0.799	S	S	*	*			cis	-178.9	142	49.6	-129.6	-45.8	0	0	0	111.8
512	F	27.1	Very low	30.4	Very low	177 Å²	177	143.7 Å²	143.7	78%	0.776	80%	0.804	S	S	*	*			trans	96.6	133.7	153.6	-62.4	-67	0	0	0	123.2
513	P	36.7	Very low	29.8	Very low	109 Å²	109	143.1 Å²	143.1	71%	0.708	80%	0.801	S	S	*	*			trans	-108	164.9	-169	42.4	-33.1	0	0	0	114.5
514	R	24.9	Very low	29.6	Very low	242 Å²	242	146 Å²	146	91%	0.913	80%	0.804	S	S	*	*			trans	-178.9	103.7	145.7	-98	158.7	-164.2	-144.7	6.2	108.2
515	L	27.7	Very low	29.5	Very low	181 Å²	181	146.4 Å²	146.4	95%	0.948	80%	0.8	S	S	*	*				67.8	106.6	88.6	-162.3	81.6	0	0	0	113.1
516	G	26.4	Very low	29.3	Very low	67 Å²	67	144.4 Å²	144.4	69%	0.691	80%	0.796	S	S	*	*			trans	151.7	97.7	158.6	0	0	0	0	0	115.7
517	E	27.4	Very low	29.5	Very low	205 Å²	205	144 Å²	144	96%	0.958	79%	0.794	S	S	*	*			trans	85.5	139.8	145	-65.1	178.4	156.1	0	0	120.8
518	A	31.8	Very low	29.2	Very low	105 Å²	105	144.9 Å²	144.9	87%	0.868	80%	0.8	S	S	*	*			trans	-80.8	140.1	-163.4	0	0	0	0	0	112.6
519	A	26.4	Very low	30.1	Very low	90 Å²	90	142.1 Å²	142.1	74%	0.744	79%	0.792	S	S	*	*			trans	-150.4	118.6	156.2	0	0	0	0	0	109.5
520	E	27.1	Very low	31.5	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	78%	0.778	S	S	*	*			trans	36.5	120.4	139.3	-98.5	159.1	161.1	0	0	119.5	T522	E520-T522 PolarHBondContact O-N 3.39Å
521	S	26.7	Very low	33.3	Very low	115 Å²	115	135.6 Å²	135.6	80%	0.804	75%	0.753	S	S	*	*			trans	-53.3	106.2	168	63.5	0	0	0	0	110.6	Q523	S521-Q523 PolarHBondContact O-N 2.79Å; S521-Q523 VanDerWaalsContact O-N 3.15Å
522	T	25	Very low	35.2	Very low	132 Å²	132	129.5 Å²	129.5	81%	0.81	74%	0.736	S	S	*	*			trans	-67.2	110	162.7	-34.3	0	0	0	0	106.8	E520 T524	E520-T522 PolarHBondContact O-N 3.39Å; T522-T524 PolarHBondContact O-N 2.78Å
523	Q	30.6	Very low	37.6	Very low	176 Å²	176	121.8 Å²	121.8	82%	0.822	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.1	162.6	-75	178.4	-12.3	0	0	107	S521 E525	S521-Q523 PolarHBondContact O-N 2.79Å; S521-Q523 VanDerWaalsContact O-N 3.15Å; Q523-E525 PolarHBondContact O-N 3.38Å
524	T	26.8	Very low	39.5	Very low	135 Å²	135	122.1 Å²	122.1	83%	0.828	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56.8	117.5	167.7	-30.8	0	0	0	0	107.7	T522	T522-T524 PolarHBondContact O-N 2.78Å
525	E	27.8	Very low	42.2	Very low	174 Å²	174	111 Å²	111	81%	0.813	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-54.6	137.5	171	-76.9	-171.3	141.6	0	0	109.7	Q523 N527	Q523-E525 PolarHBondContact O-N 3.38Å; E525-N527 PolarHBondContact O-N 2.87Å
526	P	33.5	Very low	45	Very low	121 Å²	121	107 Å²	107	79%	0.786	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-68.8	130.9	173.2	27.4	-29.7	0	0	0	109.4
527	N	33.7	Very low	47.7	Very low	147 Å²	147	103.9 Å²	103.9	79%	0.786	60%	0.604	S	S	*	*			trans	-44.8	145.8	174.2	-71.4	-30.7	0	0	0	112.1	E525	E525-N527 PolarHBondContact O-N 2.87Å
528	P	39.8	Very low	50.4	Low	115 Å²	115	98.7 Å²	98.7	75%	0.747	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-56.4	140.9	176.2	22.4	-31.8	0	0	0	111.2	A530	P528-A530 PolarHBondContact O-N 2.85Å
529	P	48.5	Very low	52.6	Low	98 Å²	98	95.4 Å²	95.4	64%	0.636	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-62.5	133.9	-178.4	23.6	-31.4	0	0	0	110.9
530	A	57.5	Low	54.8	Low	51 Å²	51	100.1 Å²	100.1	42%	0.421	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-57.3	137.1	176.5	0	0	0	0	0	110.8	T495 P528	T495-A530 HydrophobicContact CG2-CB 3.87Å; P528-A530 PolarHBondContact O-N 2.85Å
531	P	66.4	Low	56.5	Low	22 Å²	22	98.9 Å²	98.9	14%	0.143	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-65.5	141.4	-177.4	24.7	-32.6	0	0	0	112.2	L418 F445 V496	L418-P531 HydrophobicContact CD1-CB 3.49Å; L418-P531 VanDerWaalsContact CD1-CB 3.49Å; L418-P531 HydrophobicContact CD1-CG 3.29Å; L418-P531 HydrophobicContact CD2-CB 4.49Å; L418-P531 HydrophobicContact CD2-CG 4.44Å; L418-P531 HydrophobicContact CG-CB 3.57Å; L418-P531 HydrophobicContact CG-CG 3.81Å; F445-P531 HydrophobicContact CE1-CG 3.96Å; F445-P531 HydrophobicContact CZ-CG 3.76Å; V496-P531 HydrophobicContact CB-CG 4.18Å; V496-P531 HydrophobicContact CG2-CG 4.49Å; V496-P531 PolarHBondContact N-O 2.94Å
532	L	66.6	Low	57.6	Low	76 Å²	76	97.8 Å²	97.8	40%	0.398	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.7	-173.1	-170.9	75.5	0	0	0	110.4	V494 T495	V494-L532 WeakPolarHBondContact O-CA 3.28Å; T495-L532 VanDerWaalsContact OG1-CD1 3.29Å; T495-L532 WeakPolarHBondContact OG1-CD1 3.34Å
533	I	77.9	Confident	58.4	Low	16 Å²	16	100.1 Å²	100.1	8%	0.082	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.4	179.9	-53.3	172	0	0	0	109.2	L418 L422 S493 V494 V496	L418-I533 HydrophobicContact CB-CD1 3.97Å; L418-I533 HydrophobicContact CB-CG1 4.2Å; L418-I533 HydrophobicContact CD1-CD1 4.43Å; L422-I533 HydrophobicContact CD2-CG2 4.08Å; S493-I533 CarbonylContact C-O 3.58Å; S493-I533 WeakPolarHBondContact CA-O 3.45Å; V494-I533 HydrophobicContact CB-CB 4.44Å; V494-I533 PolarHBondContact N-O 3.05Å; V494-I533 PolarHBondContact O-N 3.45Å; V496-I533 HydrophobicContact CG2-CD1 4.39Å
534	N	77	Confident	58.9	Low	115 Å²	115	100 Å²	100	62%	0.615	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.1	-178.5	-65.9	-39.1	0	0	0	112.3	S493	S493-N534 VanDerWaalsContact CB-OD1 3.23Å; S493-N534 WeakPolarHBondContact CB-OD1 3.35Å
535	F	81.8	Confident	59.3	Low	8 Å²	8	99 Å²	99	4%	0.035	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	156.3	172.9	69.2	-88.1	0	0	0	112.5	L422 V424 M431 V433 L452 T470 I491 N492 V494	L422-F535 HydrophobicContact CD2-CB 3.92Å; V424-F535 HydrophobicContact CG1-CD2 4.2Å; V424-F535 HydrophobicContact CG2-CB 3.9Å; M431-F535 HydrophobicContact CB-CE2 4.14Å; M431-F535 HydrophobicContact CE-CE2 4.07Å; M431-F535 HydrophobicContact SD-CE2 4.2Å; V433-F535 HydrophobicContact CG2-CD1 4Å; V433-F535 HydrophobicContact CG2-CD2 3.69Å; V433-F535 HydrophobicContact CG2-CE1 3.82Å; V433-F535 HydrophobicContact CG2-CE2 3.49Å; V433-F535 VanDerWaalsContact CG2-CE2 3.49Å; V433-F535 HydrophobicContact CG2-CG 3.93Å; V433-F535 HydrophobicContact CG2-CZ 3.53Å; L452-F535 HydrophobicContact CD2-CE1 3.53Å; L452-F535 HydrophobicContact CD2-CZ 3.7Å; T470-F535 HydrophobicContact CG2-CZ 4.39Å; I491-F535 WeakPolarHBondContact CA-O 3.22Å; N492-F535 HydrophobicContact CB-CE1 3.87Å; N492-F535 HydrophobicContact CB-CE2 4.01Å; N492-F535 HydrophobicContact CB-CZ 3.55Å; N492-F535 PolarHBondContact N-O 2.92Å; N492-F535 WeakPolarHBondContact O-CD1 3.43Å; N492-F535 PolarHBondContact O-N 2.91Å; V494-F535 HydrophobicContact CG2-CD1 4.03Å; V494-F535 HydrophobicContact CG2-CE1 3.84Å
536	N	85.9	Confident	59.7	Low	97 Å²	97	95.8 Å²	95.8	52%	0.519	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	158.5	-179.2	69.3	62.2	0	0	0	113.6	L489 H490 I491	L489-N536 HydrophobicContact CD1-CB 4Å; H490-N536 CarbonylContact O-C 3.57Å; H490-N536 WeakPolarHBondContact O-CA 3.37Å; I491-N536 HydrophobicContact CG1-CB 4Å
537	C	84.4	Confident	59.9	Low	3 Å²	3	97.7 Å²	97.7	2%	0.02	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.5	174.1	-72.7	0	0	0	0	110.7	C426 M431 H490 Y539	C426-C537 VanDerWaalsContact CA-SG 3.59Å; C426-C537 HydrophobicContact CB-CB 3.71Å; C426-C537 WeakPolarHBondContact CB-SG 3.27Å; C426-C537 VanDerWaalsContact SG-CA 3.58Å; C426-C537 WeakPolarHBondContact SG-CB 3.34Å; C426-C537 CovalentContact SG-SG 2.03Å; C426-C537 PolarHBondContact SG-SG 3.33Å; M431-C537 HydrophobicContact CG-CB 4.03Å; M431-C537 HydrophobicContact SD-CB 3.6Å; M431-C537 VanDerWaalsContact SD-SG 3.66Å; H490-C537 PolarHBondContact N-O 2.82Å; H490-C537 PolarHBondContact O-N 2.8Å; C537-Y539 HydrophobicContact CB-CD2 4.4Å; C537-Y539 HydrophobicContact CB-CE2 3.5Å
538	T	82.6	Confident	59.9	Low	95 Å²	95	96.9 Å²	96.9	58%	0.583	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.8	176.8	44.3	0	0	0	0	111.5	V488 L489	V488-T538 WeakPolarHBondContact O-CA 3.34Å; L489-T538 HydrophobicContact CB-CG2 4.31Å; L489-T538 HydrophobicContact CD1-CG2 3.44Å; L489-T538 VanDerWaalsContact CD1-CG2 3.44Å; L489-T538 HydrophobicContact CG-CG2 4.49Å
539	Y	77.9	Confident	59.5	Low	36 Å²	36	100.7 Å²	100.7	14%	0.141	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.7	178.5	-62.3	-86.6	0	0	0	110.9	C426 E427 L472 D487 V488 H490 C537	C426-Y539 WeakPolarHBondContact CA-OH 3.44Å; C426-Y539 WeakPolarHBondContact CB-OH 3.16Å; E427-Y539 WeakPolarHBondContact O-CE1 3.43Å; E427-Y539 PolarHBondContact O-OH 2.94Å; L472-Y539 HydrophobicContact CD1-CD1 4.3Å; L472-Y539 HydrophobicContact CD1-CD2 4.11Å; L472-Y539 HydrophobicContact CD1-CE1 4.33Å; L472-Y539 HydrophobicContact CD1-CE2 4.12Å; L472-Y539 HydrophobicContact CD1-CG 4.19Å; L472-Y539 HydrophobicContact CD2-CD2 4.1Å; L472-Y539 HydrophobicContact CD2-CE1 4.21Å; L472-Y539 HydrophobicContact CD2-CE2 3.32Å; L472-Y539 WeakPolarHBondContact CD2-OH 3.48Å; L472-Y539 HydrophobicContact CG-CE2 4.35Å; D487-Y539 WeakPolarHBondContact CA-O 3.31Å; V488-Y539 PolarHBondContact N-O 3.34Å; V488-Y539 PolarHBondContact O-N 3.18Å; H490-Y539 HydrophobicContact CB-CE2 4.44Å; H490-Y539 AromaticContact CD2-CD2 3.44Å; H490-Y539 VanDerWaalsContact CD2-CD2 3.44Å; H490-Y539 WeakPolarHBondContact CD2-CD2 3.43Å; H490-Y539 AromaticContact NE2-CD2 3.94Å; C537-Y539 HydrophobicContact CB-CD2 4.4Å; C537-Y539 HydrophobicContact CB-CE2 3.5Å
540	R	74	Confident	58.9	Low	189 Å²	189	101.5 Å²	101.5	71%	0.713	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.3	176.7	-169.1	166.8	-174.9	166.1	4.3	110	D487 S542	D487-R540 WeakPolarHBondContact OD1-CG 3.49Å; R540-S542 PolarHBondContact O-N 3.31Å; R540-S542 VanDerWaalsContact O-N 3.1Å
541	K	61.4	Low	57.4	Low	156 Å²	156	106.8 Å²	106.8	68%	0.678	56%	0.556	S	S	*	*			trans	-69	108	-178.7	-153.6	173.2	-171.6	176.3	0	109.9	Q486 V488 K543	Q486-K541 VanDerWaalsContact O-CB 3.29Å; Q486-K541 WeakPolarHBondContact O-CB 3.44Å; Q486-K541 PolarHBondContact O-N 3.27Å; V488-K541 HydrophobicContact CG2-CB 4.49Å; K541-K543 PolarHBondContact O-N 3.18Å
542	S	50.3	Low	56.2	Low	92 Å²	92	115.2 Å²	115.2	64%	0.643	59%	0.59	S	S	*	*			trans	-65.8	130.2	170	51	0	0	0	0	109.4	R540 E544	R540-S542 PolarHBondContact O-N 3.31Å; R540-S542 VanDerWaalsContact O-N 3.1Å; S542-E544 VanDerWaalsContact C-N 3.27Å; S542-E544 PolarHBondContact O-N 2.79Å
543	K	42	Very low	54.7	Low	181 Å²	181	115.4 Å²	115.4	79%	0.787	61%	0.611	S	S	*	*			trans	-65.1	90.2	166.6	-87	-178.2	173.4	178.8	0	108.4	K541 V545	K541-K543 PolarHBondContact O-N 3.18Å; K543-V545 PolarHBondContact O-N 2.79Å
544	E	40.6	Very low	52.4	Low	172 Å²	172	119.1 Å²	119.1	80%	0.804	64%	0.644	S	S	*	*			trans	-66.9	112.9	156.2	-73	-172.2	167.4	0	0	106.7	S542 P546	S542-E544 VanDerWaalsContact C-N 3.27Å; S542-E544 PolarHBondContact O-N 2.79Å; E544-P546 WeakPolarHBondContact O-CD 3.41Å
545	V	35.8	Very low	50.6	Low	115 Å²	115	121.3 Å²	121.3	70%	0.697	65%	0.654	S	S	*	*			trans	-68.1	112	174.2	176.5	0	0	0	0	107	K543 N547	K543-V545 PolarHBondContact O-N 2.79Å; V545-N547 PolarHBondContact O-N 3.14Å
546	P	37.1	Very low	48.5	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	69%	0.69	S	S	*	*			trans	-75.4	104.2	172.1	-5.7	25.1	0	0	0	106.8	E544 T548	E544-P546 WeakPolarHBondContact O-CD 3.41Å; P546-T548 PolarHBondContact O-N 3.14Å
547	N	36.6	Very low	46.5	Very low	161 Å²	161	124.4 Å²	124.4	86%	0.861	69%	0.689	S	S	*	*			trans	-70.1	86.4	164.4	-96.9	-17.8	0	0	0	108.5	V545	V545-N547 PolarHBondContact O-N 3.14Å
548	T	34.6	Very low	44.7	Very low	130 Å²	130	128.2 Å²	128.2	80%	0.798	71%	0.706	S	S	*	*			trans	-144	126.7	164.8	-19.4	0	0	0	0	110.3	P546	P546-T548 PolarHBondContact O-N 3.14Å
549	K	31.5	Very low	43.3	Very low	195 Å²	195	128.2 Å²	128.2	85%	0.848	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-54.7	154.5	-177.8	-75.1	173.7	175	176.9	0	112.7	D551	K549-D551 PolarHBondContact O-N 2.88Å
550	P	34.3	Very low	42.1	Very low	115 Å²	115	128.4 Å²	128.4	75%	0.747	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-76.2	125.7	-179.1	31.2	-30.9	0	0	0	110.2
551	D	27.4	Very low	41.2	Very low	161 Å²	161	126.3 Å²	126.3	86%	0.861	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-100.9	129.4	161	-162.4	13.4	0	0	0	109.2	K549 G553	K549-D551 PolarHBondContact O-N 2.88Å; D551-G553 PolarHBondContact O-N 3.3Å
552	F	40.1	Very low	40.9	Very low	199 Å²	199	121.7 Å²	121.7	87%	0.873	70%	0.703	S	S	*	*			trans	-81.2	108.8	-176	-92.6	-104.2	0	0	0	109
553	G	36.1	Very low	41.8	Very low	80 Å²	80	117.4 Å²	117.4	83%	0.825	67%	0.673	S	S	*	*			trans	170.5	38.1	174.2	0	0	0	0	0	118.8	D551	D551-G553 PolarHBondContact O-N 3.3Å
554	A	30.1	Very low	43.4	Very low	95 Å²	95	111.7 Å²	111.7	79%	0.785	66%	0.655	S	S	*	*			trans	-145.3	124.5	165.1	0	0	0	0	0	110.7
555	I	38	Very low	45.4	Very low	160 Å²	160	104.7 Å²	104.7	82%	0.821	62%	0.622	S	S	*	*			trans	-58.6	136	171.9	-59.7	168.8	0	0	0	107.8	G557	I555-G557 PolarHBondContact O-N 3.44Å
556	P	38.6	Very low	47.6	Very low	123 Å²	123	103 Å²	103	80%	0.799	61%	0.607	S	S	*	*			trans	-63.8	112.4	-179.9	-13.3	26.4	0	0	0	109.6	Q558	P556-Q558 PolarHBondContact O-N 3.41Å
557	G	43	Very low	50	Low	47 Å²	47	98.1 Å²	98.1	49%	0.485	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-61.9	132.6	169.2	0	0	0	0	0	110	I555	I555-G557 PolarHBondContact O-N 3.44Å
558	Q	46.7	Very low	52.2	Low	84 Å²	84	93.1 Å²	93.1	39%	0.393	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-60.5	135.8	179.9	-173.2	175.6	-19.9	0	0	110.6	P556 V560 S562	P556-Q558 PolarHBondContact O-N 3.41Å; Q558-V560 PolarHBondContact O-N 2.85Å; Q558-S562 VanDerWaalsContact CG-OG 3.25Å; Q558-S562 WeakPolarHBondContact CG-OG 3.33Å; Q558-S562 PolarHBondContact NE2-OG 2.95Å
559	P	53.2	Low	54.6	Low	94 Å²	94	87.5 Å²	87.5	61%	0.61	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-64.1	130.1	179.7	23.1	-31.5	0	0	0	111.1	N561 S562	P559-N561 PolarHBondContact O-N 2.52Å; P559-S562 PolarHBondContact O-N 3.35Å; P559-S562 PolarHBondContact O-OG 2.81Å
560	V	53.8	Low	56.9	Low	41 Å²	41	79.9 Å²	79.9	25%	0.248	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-52.5	-30	-175	-178.5	0	0	0	0	112.9	Q558 S562 I563 L682 L693	Q558-V560 PolarHBondContact O-N 2.85Å; V560-S562 VanDerWaalsContact C-N 3.25Å; V560-S562 PolarHBondContact O-N 3.47Å; V560-I563 PolarHBondContact O-N 3.42Å; V560-L682 HydrophobicContact CG1-CD1 3.61Å; V560-L693 HydrophobicContact CG1-CD2 4.43Å; V560-L693 HydrophobicContact CG2-CD1 4.41Å
561	N	54.1	Low	58.7	Low	145 Å²	145	79 Å²	79	78%	0.775	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-67.3	-16.7	177.7	-81.7	-5.4	0	0	0	115.3	P559	P559-N561 PolarHBondContact O-N 2.52Å
562	S	54.5	Low	60.4	Low	58 Å²	58	75.3 Å²	75.3	41%	0.406	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-87.4	-6.3	-178.8	65.6	0	0	0	0	114.7	Q558 P559 V560	Q558-S562 VanDerWaalsContact CG-OG 3.25Å; Q558-S562 WeakPolarHBondContact CG-OG 3.33Å; Q558-S562 PolarHBondContact NE2-OG 2.95Å; P559-S562 PolarHBondContact O-N 3.35Å; P559-S562 PolarHBondContact O-OG 2.81Å; V560-S562 VanDerWaalsContact C-N 3.25Å; V560-S562 PolarHBondContact O-N 3.47Å
563	I	69.6	Low	61.2	Low	3 Å²	3	70.7 Å²	70.7	2%	0.015	43%	0.427	C	S	.	.			trans	-82.6	129.3	-177.7	-60.7	170.4	0	0	0	109.2	V560 F565 S598 A600 I605 L682 R718	V560-I563 PolarHBondContact O-N 3.42Å; I563-F565 HydrophobicContact CG2-CE1 4.08Å; I563-F565 HydrophobicContact CG2-CZ 3.99Å; I563-S598 WeakPolarHBondContact CG2-OG 3.26Å; I563-A600 HydrophobicContact CD1-CB 4.07Å; I563-A600 HydrophobicContact CG1-CB 4.41Å; I563-A600 HydrophobicContact CG2-CB 3.94Å; I563-I605 HydrophobicContact CD1-CD1 3.9Å; I563-I605 HydrophobicContact CD1-CG2 4.19Å; I563-L682 HydrophobicContact CB-CD1 4.26Å; I563-L682 HydrophobicContact CD1-CD1 4.04Å; I563-L682 HydrophobicContact CG2-CD1 4.38Å; I563-L682 HydrophobicContact CG2-CD2 4.16Å; I563-R718 PolarHBondContact O-NH1 2.9Å
564	S	76.2	Confident	61.7	Low	60 Å²	60	75.1 Å²	75.1	42%	0.42	42%	0.423	S	S	.	.			trans	-116.7	162	179.7	64.4	0	0	0	0	111.5	S598 T599	S564-S598 WeakPolarHBondContact O-CA 3.21Å; S564-T599 PolarHBondContact N-OG1 3.25Å; S564-T599 PolarHBondContact O-N 3.35Å; S564-T599 PolarHBondContact O-OG1 3.18Å; S564-T599 VanDerWaalsContact OG-CG2 3.26Å; S564-T599 WeakPolarHBondContact OG-CG2 3.35Å; S564-T599 PolarHBondContact OG-OG1 3.38Å
565	F	83	Confident	62.8	Low	25 Å²	25	74.3 Å²	74.3	11%	0.11	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.5	-178	-53.2	-69.7	0	0	0	110.8	I563 T597 S598 L607 M680 L682 R718 L720	I563-F565 HydrophobicContact CG2-CE1 4.08Å; I563-F565 HydrophobicContact CG2-CZ 3.99Å; F565-T597 WeakPolarHBondContact CA-O 3.33Å; F565-S598 WeakPolarHBondContact CE1-OG 3.38Å; F565-L607 HydrophobicContact CD1-CD1 3.34Å; F565-L607 HydrophobicContact CE1-CD1 3.63Å; F565-L607 HydrophobicContact CG-CD1 4.38Å; F565-M680 HydrophobicContact CB-CG 4.36Å; F565-M680 HydrophobicContact CB-SD 4.32Å; F565-M680 HydrophobicContact CD1-CE 3.29Å; F565-M680 HydrophobicContact CD1-CG 4.45Å; F565-M680 HydrophobicContact CD1-SD 3.84Å; F565-M680 HydrophobicContact CD2-CE 3.61Å; F565-M680 HydrophobicContact CD2-CG 4.1Å; F565-M680 HydrophobicContact CD2-SD 3.04Å; F565-M680 WeakPolarHBondContact CD2-SD 3.44Å; F565-M680 HydrophobicContact CE1-CE 3.01Å; F565-M680 HydrophobicContact CE1-SD 3.93Å; F565-M680 HydrophobicContact CE2-CE 3.34Å; F565-M680 HydrophobicContact CE2-SD 3.13Å; F565-M680 WeakPolarHBondContact CE2-SD 3.36Å; F565-M680 HydrophobicContact CG-CE 3.57Å; F565-M680 HydrophobicContact CG-CG 3.99Å; F565-M680 HydrophobicContact CG-SD 3.41Å; F565-M680 WeakPolarHBondContact CG-SD 3.12Å; F565-M680 HydrophobicContact CZ-CE 3.04Å; F565-M680 HydrophobicContact CZ-SD 3.59Å; F565-M680 VanDerWaalsContact CZ-SD 3.59Å; F565-L682 HydrophobicContact CE1-CD2 3.69Å; F565-L682 HydrophobicContact CE1-CG 4.42Å; F565-L682 HydrophobicContact CZ-CD1 4.21Å; F565-L682 HydrophobicContact CZ-CD2 3.46Å; F565-L682 VanDerWaalsContact CZ-CD2 3.46Å; F565-L682 HydrophobicContact CZ-CG 3.7Å; F565-R718 HydrophobicContact CD2-CB 4.4Å; F565-R718 HydrophobicContact CE2-CG 4.37Å; F565-L720 HydrophobicContact CB-CD1 3.72Å; F565-L720 HydrophobicContact CB-CG 4.41Å
566	E	81.8	Confident	63.1	Low	79 Å²	79	73.5 Å²	73.5	37%	0.369	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128	-178	179.2	167.2	-145.2	0	0	108.6	I596 T597 K655	E566-I596 CarbonylContact O-C 3.58Å; E566-I596 WeakPolarHBondContact O-CA 3.45Å; E566-T597 PolarHBondContact N-O 3.34Å; E566-T597 PolarHBondContact O-N 3.05Å; E566-K655 IonicContact OE2-NZ 3.94Å; E566-K655 PolarHBondContact OE2-NZ 3.4Å
567	M	86.6	Confident	63.4	Low	5 Å²	5	74.3 Å²	74.3	3%	0.025	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.8	178.4	178.6	-169.7	-71.4	0	0	109.6	V594 Q595 I596 L676 C678 L720 K722	M567-V594 HydrophobicContact CG-CG1 4.13Å; M567-V594 HydrophobicContact SD-CG1 4.46Å; M567-Q595 CarbonylContact C-O 3.57Å; M567-Q595 VanDerWaalsContact CA-O 3.32Å; M567-Q595 WeakPolarHBondContact CA-O 3.3Å; M567-I596 HydrophobicContact CB-CG1 4.44Å; M567-I596 HydrophobicContact CE-CD1 4.02Å; M567-I596 HydrophobicContact CE-CG1 4.35Å; M567-I596 HydrophobicContact CG-CG1 4.26Å; M567-L676 HydrophobicContact SD-CD2 4.17Å; M567-C678 HydrophobicContact CE-CB 3.39Å; M567-L720 HydrophobicContact CB-CB 4.39Å; M567-L720 HydrophobicContact CB-CD1 3.81Å; M567-L720 HydrophobicContact CE-CB 3.86Å; M567-K722 HydrophobicContact CB-CG 4.35Å; M567-K722 HydrophobicContact CG-CG 4.02Å; M567-K722 WeakPolarHBondContact O-CE 3.4Å; M567-K722 PolarHBondContact O-NZ 3.25Å; M567-K722 HydrophobicContact SD-CB 4.01Å; M567-K722 HydrophobicContact SD-CG 3.57Å; M567-K722 VanDerWaalsContact SD-CG 3.57Å
568	E	83.2	Confident	63.6	Low	56 Å²	56	77 Å²	77	26%	0.262	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.7	176.7	-65.4	-174.6	146.5	0	0	111.1	Y570 Q595	E568-Y570 HydrophobicContact CB-CD2 4.47Å; E568-Y570 HydrophobicContact CB-CE2 3.59Å; E568-Y570 PolarHBondContact OE2-OH 3.08Å; E568-Q595 PolarHBondContact N-O 3.48Å; E568-Q595 PolarHBondContact O-N 3.23Å
569	L	84.3	Confident	63.9	Low	13 Å²	13	76.8 Å²	76.8	7%	0.068	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.1	-176.2	-64.2	173.2	0	0	0	110.1	F584 V592 V593 V594 L676 K722 I724	L569-F584 HydrophobicContact CB-CB 4.35Å; L569-F584 HydrophobicContact CB-CD1 4.28Å; L569-F584 HydrophobicContact CB-CD2 3.57Å; L569-F584 HydrophobicContact CB-CE2 3.82Å; L569-F584 HydrophobicContact CB-CG 3.82Å; L569-F584 HydrophobicContact CB-CZ 4.29Å; L569-F584 HydrophobicContact CD1-CB 3.98Å; L569-F584 HydrophobicContact CD1-CD1 4.15Å; L569-F584 HydrophobicContact CD1-CG 4.01Å; L569-V592 HydrophobicContact CD2-CG1 4.04Å; L569-V593 WeakPolarHBondContact CA-O 3.49Å; L569-V594 HydrophobicContact CD2-CB 4.23Å; L569-V594 HydrophobicContact CD2-CG1 4.12Å; L569-V594 HydrophobicContact CD2-CG2 3.73Å; L569-L676 HydrophobicContact CD2-CD2 3.8Å; L569-K722 HydrophobicContact CD1-CB 3.91Å; L569-I724 HydrophobicContact CD1-CD1 4.06Å; L569-I724 HydrophobicContact CD1-CG1 3.81Å
570	Y	80.1	Confident	63.6	Low	34 Å²	34	81.6 Å²	81.6	13%	0.133	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.6	-176.6	-61.8	-88.9	0	0	0	111.8	E568 F575 V593 Q595	E568-Y570 HydrophobicContact CB-CD2 4.47Å; E568-Y570 HydrophobicContact CB-CE2 3.59Å; E568-Y570 PolarHBondContact OE2-OH 3.08Å; Y570-F575 HydrophobicContact CD2-CE1 4.37Å; Y570-F575 HydrophobicContact CE2-CD1 4.37Å; Y570-F575 HydrophobicContact CE2-CE1 4.36Å; Y570-V593 PolarHBondContact N-O 3.25Å; Y570-V593 PolarHBondContact O-N 3.03Å; Y570-Q595 HydrophobicContact CD2-CB 4.39Å; Y570-Q595 HydrophobicContact CE2-CB 4.04Å
571	K	71.6	Confident	63.5	Low	96 Å²	96	85 Å²	85	42%	0.417	44%	0.44	S	S	.	.	S	Bend	trans	-88.1	-18.4	176.5	-67.2	-177.4	167.3	-166.9	0	113.2	F584 K585 M590	K571-F584 HydrophobicContact CG-CE2 3.67Å; K571-F584 HydrophobicContact CG-CZ 3.72Å; K571-K585 WeakPolarHBondContact CE-O 3.22Å; K571-K585 PolarHBondContact NZ-O 2.78Å; K571-K585 VanDerWaalsContact NZ-O 3.16Å; K571-M590 HydrophobicContact CB-CE 3.79Å; K571-M590 HydrophobicContact CD-CE 3.71Å; K571-M590 HydrophobicContact CG-CE 3.61Å
572	T	63.7	Low	63.6	Low	85 Å²	85	90.2 Å²	90.2	52%	0.521	45%	0.448	S	S	.	.	S	Bend	trans	-141.4	157	-178.3	58.6	0	0	0	0	109.6	F574	T572-F574 PolarHBondContact O-N 2.89Å
573	Q	56.3	Low	64.1	Low	102 Å²	102	91.3 Å²	91.3	48%	0.477	45%	0.449	S	S	.	.	S	Bend	trans	-77.1	5.7	-179.3	-60.7	178.3	-0.1	0	0	113.5	F575 V593	Q573-F575 WeakPolarHBondContact O-CD2 3.38Å; Q573-F575 WeakPolarHBondContact O-CE2 3.36Å; Q573-V593 HydrophobicContact CG-CG2 4.17Å
574	F	47.2	Very low	64.6	Low	172 Å²	172	92.5 Å²	92.5	75%	0.754	45%	0.454	S	S	*	.			trans	-102.4	99.7	-176.7	-62.9	-75.9	0	0	0	110.5	T572 N576	T572-F574 PolarHBondContact O-N 2.89Å; F574-N576 PolarHBondContact O-N 2.8Å
575	F	53.2	Low	64.9	Low	79 Å²	79	94.5 Å²	94.5	35%	0.346	46%	0.455	S	S	.	.			trans	-71.6	33.9	-173.3	-60.1	-83.6	0	0	0	115.8	Y570 Q573 Q595	Y570-F575 HydrophobicContact CD2-CE1 4.37Å; Y570-F575 HydrophobicContact CE2-CD1 4.37Å; Y570-F575 HydrophobicContact CE2-CE1 4.36Å; Q573-F575 WeakPolarHBondContact O-CD2 3.38Å; Q573-F575 WeakPolarHBondContact O-CE2 3.36Å; F575-Q595 VanDerWaalsContact CE1-OE1 3.25Å
576	N	45.1	Very low	64.9	Low	143 Å²	143	93.4 Å²	93.4	77%	0.765	45%	0.451	S	S	*	.			trans	-105.3	6.1	-167.6	-81.6	-0.5	0	0	0	116	F574	F574-N576 PolarHBondContact O-N 2.8Å
577	N	45.1	Very low	65	Low	140 Å²	140	90.5 Å²	90.5	75%	0.749	44%	0.439	S	S	*	.	S	Bend	trans	-143.8	135	171.3	-84.9	-32.5	0	0	0	111.9
578	P	46.3	Very low	64.8	Low	104 Å²	104	92.8 Å²	92.8	68%	0.675	45%	0.451	S	S	*	.			trans	-63.8	141.6	174.3	26.5	-32.4	0	0	0	110.3	Q580	P578-Q580 PolarHBondContact O-N 2.76Å
579	P	52.3	Low	64.7	Low	78 Å²	78	97.1 Å²	97.1	51%	0.506	47%	0.472	S	S	.	.			trans	-66.4	103.2	178.9	24.7	-30.9	0	0	0	110.1	Q581	P579-Q581 PolarHBondContact O-N 2.75Å
580	Q	48.4	Very low	64.6	Low	195 Å²	195	98.8 Å²	98.8	91%	0.911	48%	0.48	S	S	*	.			trans	-67.3	2.9	179	-92.1	-178.6	-34.8	0	0	114.7	P578	P578-Q580 PolarHBondContact O-N 2.76Å
581	Q	49.9	Very low	64.8	Low	114 Å²	114	100.9 Å²	100.9	53%	0.533	49%	0.491	S	S	.	.			trans	-119.7	129.8	-175.2	-68.2	-176.2	-28.1	0	0	111.9	P579 I583	P579-Q581 PolarHBondContact O-N 2.75Å; Q581-I583 PolarHBondContact O-N 3.29Å
582	R	56.3	Low	65.5	Low	253 Å²	253	96.3 Å²	96.3	96%	0.955	47%	0.471	S	S	*	.	S	Bend	trans	-63.4	-19.6	179.4	-80.5	-171.2	-172.8	176.9	4.1	114.5
583	I	65.1	Low	66.5	Low	82 Å²	82	92.4 Å²	92.4	42%	0.421	45%	0.447	S	S	.	.	S	Bend	trans	-134.3	129.1	180	-56.9	174.8	0	0	0	108.6	Q581 K585 L673 A725	Q581-I583 PolarHBondContact O-N 3.29Å; I583-K585 PolarHBondContact O-N 2.85Å; I583-L673 HydrophobicContact CG2-CD1 4.37Å; I583-A725 HydrophobicContact CG2-CB 3.8Å
584	F	80.2	Confident	68	Low	27 Å²	27	87.5 Å²	87.5	12%	0.118	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.5	-178.8	-175.2	-95.1	0	0	0	110.2	L569 K571 V586 V592 I724 A725	L569-F584 HydrophobicContact CB-CB 4.35Å; L569-F584 HydrophobicContact CB-CD1 4.28Å; L569-F584 HydrophobicContact CB-CD2 3.57Å; L569-F584 HydrophobicContact CB-CE2 3.82Å; L569-F584 HydrophobicContact CB-CG 3.82Å; L569-F584 HydrophobicContact CB-CZ 4.29Å; L569-F584 HydrophobicContact CD1-CB 3.98Å; L569-F584 HydrophobicContact CD1-CD1 4.15Å; L569-F584 HydrophobicContact CD1-CG 4.01Å; K571-F584 HydrophobicContact CG-CE2 3.67Å; K571-F584 HydrophobicContact CG-CZ 3.72Å; F584-V586 HydrophobicContact CE1-CB 4.32Å; F584-V592 HydrophobicContact CE1-CB 4.42Å; F584-V592 HydrophobicContact CE1-CG1 3.74Å; F584-V592 HydrophobicContact CE1-CG2 3.87Å; F584-V592 HydrophobicContact CZ-CG1 3.92Å; F584-V592 HydrophobicContact CZ-CG2 4.34Å; F584-I724 HydrophobicContact CD1-CG1 4.35Å; F584-I724 HydrophobicContact CD1-CG2 4.27Å; F584-I724 CarbonylContact O-C 3.54Å; F584-I724 VanDerWaalsContact O-CA 3.3Å; F584-I724 WeakPolarHBondContact O-CA 3.46Å; F584-A725 PolarHBondContact O-N 3.46Å
585	K	82.4	Confident	69.8	Low	102 Å²	102	79.7 Å²	79.7	44%	0.443	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.9	179.6	-64	-176.4	179.2	-171.5	0	111.4	K571 I583 A725 V727	K571-K585 WeakPolarHBondContact CE-O 3.22Å; K571-K585 PolarHBondContact NZ-O 2.78Å; K571-K585 VanDerWaalsContact NZ-O 3.16Å; I583-K585 PolarHBondContact O-N 2.85Å; K585-A725 CarbonylContact C-O 3.58Å; K585-A725 VanDerWaalsContact CA-O 3.31Å; K585-A725 WeakPolarHBondContact CA-O 3.43Å; K585-A725 HydrophobicContact CG-CB 4.29Å; K585-V727 HydrophobicContact CB-CG2 4.12Å; K585-V727 HydrophobicContact CD-CG2 4.26Å; K585-V727 HydrophobicContact CG-CG2 4.39Å
586	V	84.4	Confident	71.3	Confident	2 Å²	2	76 Å²	76	1%	0.012	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.1	178.4	77.3	0	0	0	0	110.1	F584 M590 V592 F664 I724 A725 V726 V727	F584-V586 HydrophobicContact CE1-CB 4.32Å; V586-M590 HydrophobicContact CG2-CB 3.87Å; V586-M590 HydrophobicContact CG2-CG 4.37Å; V586-M590 HydrophobicContact CG2-SD 4.28Å; V586-V592 HydrophobicContact CG2-CG2 3.55Å; V586-F664 HydrophobicContact CB-CD1 4.35Å; V586-F664 HydrophobicContact CB-CG 4.43Å; V586-F664 HydrophobicContact CG1-CD1 3.53Å; V586-F664 HydrophobicContact CG1-CD2 4.18Å; V586-F664 HydrophobicContact CG1-CE1 3.63Å; V586-F664 HydrophobicContact CG1-CE2 4.26Å; V586-F664 HydrophobicContact CG1-CG 3.82Å; V586-F664 HydrophobicContact CG1-CZ 4Å; V586-F664 HydrophobicContact CG2-CB 3.54Å; V586-F664 HydrophobicContact CG2-CD1 3.86Å; V586-F664 HydrophobicContact CG2-CG 3.71Å; V586-I724 HydrophobicContact CB-CG2 3.82Å; V586-I724 HydrophobicContact CG1-CG2 3.27Å; V586-A725 PolarHBondContact N-O 3.13Å; V586-V726 HydrophobicContact CG1-CG2 4.27Å; V586-V726 CarbonylContact O-C 3.54Å; V586-V726 WeakPolarHBondContact O-CA 3.21Å; V586-V727 PolarHBondContact O-N 3.35Å
587	S	83.5	Confident	73.1	Confident	19 Å²	19	69.6 Å²	69.6	13%	0.133	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	166.3	169.2	62.5	0	0	0	0	110.2	Q589 M590 V727	S587-Q589 PolarHBondContact O-N 2.75Å; S587-M590 VanDerWaalsContact O-CB 3.24Å; S587-M590 WeakPolarHBondContact O-CB 3.49Å; S587-M590 PolarHBondContact O-N 3.08Å; S587-V727 WeakPolarHBondContact CA-O 3.11Å
588	D	81.3	Confident	74.7	Confident	52 Å²	52	63.1 Å²	63.1	28%	0.278	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	139.8	172.7	-166.9	34.7	0	0	0	110.8	M590 S666	D588-M590 PolarHBondContact O-N 2.87Å; D588-S666 WeakPolarHBondContact CB-OG 3.32Å; D588-S666 PolarHBondContact OD1-N 3.17Å; D588-S666 PolarHBondContact OD1-OG 2.94Å
589	Q	82.1	Confident	76.1	Confident	148 Å²	148	60.5 Å²	60.5	69%	0.692	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	16.4	-178.4	-53.4	-174	-15.7	0	0	116.2	S587 T663 F664	S587-Q589 PolarHBondContact O-N 2.75Å; Q589-T663 HydrophobicContact CB-CG2 4.49Å; Q589-F664 WeakPolarHBondContact CA-O 3.38Å; Q589-F664 PolarHBondContact N-O 2.96Å
590	M	82.6	Confident	76.8	Confident	47 Å²	47	57.3 Å²	57.3	23%	0.232	27%	0.268	C	S	.	.			trans	-79.6	137.1	176.5	-170.5	173.7	-172	0	0	111.6	K571 V586 S587 D588 F664	K571-M590 HydrophobicContact CB-CE 3.79Å; K571-M590 HydrophobicContact CD-CE 3.71Å; K571-M590 HydrophobicContact CG-CE 3.61Å; V586-M590 HydrophobicContact CG2-CB 3.87Å; V586-M590 HydrophobicContact CG2-CG 4.37Å; V586-M590 HydrophobicContact CG2-SD 4.28Å; S587-M590 VanDerWaalsContact O-CB 3.24Å; S587-M590 WeakPolarHBondContact O-CB 3.49Å; S587-M590 PolarHBondContact O-N 3.08Å; D588-M590 PolarHBondContact O-N 2.87Å; M590-F664 PolarHBondContact O-N 2.9Å
591	E	83.8	Confident	77.4	Confident	78 Å²	78	52.6 Å²	52.6	36%	0.364	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127.7	171.4	-169.8	177.6	-167.4	0	0	110.5	S661 F662	E591-S661 VanDerWaalsContact OE1-CB 3.27Å; E591-S661 WeakPolarHBondContact OE1-CB 3.19Å; E591-S661 PolarHBondContact OE1-OG 2.86Å; E591-F662 WeakPolarHBondContact CA-O 3.28Å
592	V	86	Confident	78.1	Confident	1 Å²	1	49 Å²	49	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127	178.2	-178.7	0	0	0	0	108.6	L569 F584 V586 S661 F662 F664	L569-V592 HydrophobicContact CD2-CG1 4.04Å; F584-V592 HydrophobicContact CE1-CB 4.42Å; F584-V592 HydrophobicContact CE1-CG1 3.74Å; F584-V592 HydrophobicContact CE1-CG2 3.87Å; F584-V592 HydrophobicContact CZ-CG1 3.92Å; F584-V592 HydrophobicContact CZ-CG2 4.34Å; V586-V592 HydrophobicContact CG2-CG2 3.55Å; V592-S661 CarbonylContact O-C 3.5Å; V592-S661 VanDerWaalsContact O-CA 3.23Å; V592-S661 WeakPolarHBondContact O-CA 3.49Å; V592-F662 HydrophobicContact CB-CD1 4.36Å; V592-F662 HydrophobicContact CB-CE1 3.86Å; V592-F662 HydrophobicContact CB-CE2 4.45Å; V592-F662 HydrophobicContact CB-CZ 3.91Å; V592-F662 HydrophobicContact CG1-CE1 3.93Å; V592-F662 HydrophobicContact CG1-CZ 4.12Å; V592-F662 HydrophobicContact CG2-CZ 4.38Å; V592-F662 PolarHBondContact N-O 2.75Å; V592-F662 PolarHBondContact O-N 2.91Å; V592-F664 HydrophobicContact CG2-CB 4.32Å
593	V	85.4	Confident	78.4	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.3	175	-176.5	0	0	0	0	108.8	L569 Y570 Q573	L569-V593 WeakPolarHBondContact CA-O 3.49Å; Y570-V593 PolarHBondContact N-O 3.25Å; Y570-V593 PolarHBondContact O-N 3.03Å; Q573-V593 HydrophobicContact CG-CG2 4.17Å
594	V	87	Confident	78.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.7	178	-170.5	0	0	0	0	108.8	M567 L569 I596 S659 F660 F662 L676	M567-V594 HydrophobicContact CG-CG1 4.13Å; M567-V594 HydrophobicContact SD-CG1 4.46Å; L569-V594 HydrophobicContact CD2-CB 4.23Å; L569-V594 HydrophobicContact CD2-CG1 4.12Å; L569-V594 HydrophobicContact CD2-CG2 3.73Å; V594-I596 HydrophobicContact CG1-CG1 4.26Å; V594-S659 WeakPolarHBondContact O-CA 3.31Å; V594-S659 WeakPolarHBondContact O-CB 3.32Å; V594-F660 HydrophobicContact CB-CD1 4.22Å; V594-F660 HydrophobicContact CB-CD2 4.35Å; V594-F660 HydrophobicContact CB-CE1 3.77Å; V594-F660 HydrophobicContact CB-CE2 3.93Å; V594-F660 HydrophobicContact CB-CG 4.49Å; V594-F660 HydrophobicContact CB-CZ 3.62Å; V594-F660 HydrophobicContact CG1-CE1 3.88Å; V594-F660 HydrophobicContact CG1-CZ 3.84Å; V594-F660 HydrophobicContact CG2-CD2 4.29Å; V594-F660 HydrophobicContact CG2-CE1 4.35Å; V594-F660 HydrophobicContact CG2-CE2 3.64Å; V594-F660 HydrophobicContact CG2-CZ 3.69Å; V594-F660 PolarHBondContact N-O 2.8Å; V594-F660 PolarHBondContact O-N 2.86Å; V594-F662 HydrophobicContact CG2-CD1 4.02Å; V594-F662 HydrophobicContact CG2-CE1 3.59Å; V594-L676 HydrophobicContact CG1-CD2 4.11Å; V594-L676 HydrophobicContact CG2-CD2 3.82Å
595	Q	85.1	Confident	78	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.2	175.5	-174.7	-177.3	-11.2	0	0	109.4	M567 E568 Y570 F575 T597 F651	M567-Q595 CarbonylContact C-O 3.57Å; M567-Q595 VanDerWaalsContact CA-O 3.32Å; M567-Q595 WeakPolarHBondContact CA-O 3.3Å; E568-Q595 PolarHBondContact N-O 3.48Å; E568-Q595 PolarHBondContact O-N 3.23Å; Y570-Q595 HydrophobicContact CD2-CB 4.39Å; Y570-Q595 HydrophobicContact CE2-CB 4.04Å; F575-Q595 VanDerWaalsContact CE1-OE1 3.25Å; Q595-T597 HydrophobicContact CG-CG2 4Å; Q595-F651 HydrophobicContact CG-CE1 4.27Å; Q595-F651 HydrophobicContact CG-CZ 4.04Å
596	I	85.4	Confident	77.6	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.6	176.8	-58	179.2	0	0	0	108.2	E566 M567 V594 L607 I609 G657 K658 C678	E566-I596 CarbonylContact O-C 3.58Å; E566-I596 WeakPolarHBondContact O-CA 3.45Å; M567-I596 HydrophobicContact CB-CG1 4.44Å; M567-I596 HydrophobicContact CE-CD1 4.02Å; M567-I596 HydrophobicContact CE-CG1 4.35Å; M567-I596 HydrophobicContact CG-CG1 4.26Å; V594-I596 HydrophobicContact CG1-CG1 4.26Å; I596-L607 HydrophobicContact CG2-CD1 3.94Å; I596-L607 HydrophobicContact CG2-CD2 4.15Å; I596-I609 HydrophobicContact CD1-CD1 3.81Å; I596-I609 HydrophobicContact CD1-CG1 4.11Å; I596-G657 CarbonylContact O-C 3.58Å; I596-G657 WeakPolarHBondContact O-CA 3.3Å; I596-K658 PolarHBondContact N-O 3.49Å; I596-K658 PolarHBondContact O-N 2.95Å; I596-C678 HydrophobicContact CD1-CB 4.05Å
597	T	81.8	Confident	77.4	Confident	8 Å²	8	33.4 Å²	33.4	5%	0.049	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152.9	-179.5	71.2	0	0	0	0	111.5	F565 E566 Q595 F651 K656	F565-T597 WeakPolarHBondContact CA-O 3.33Å; E566-T597 PolarHBondContact N-O 3.34Å; E566-T597 PolarHBondContact O-N 3.05Å; Q595-T597 HydrophobicContact CG-CG2 4Å; T597-F651 HydrophobicContact CG2-CD2 3.59Å; T597-F651 HydrophobicContact CG2-CE2 3.41Å; T597-F651 VanDerWaalsContact CG2-CE2 3.41Å; T597-F651 HydrophobicContact CG2-CG 4.49Å; T597-F651 HydrophobicContact CG2-CZ 4.15Å; T597-K656 WeakPolarHBondContact CA-O 3.37Å
598	S	80	Confident	77.3	Confident	4 Å²	4	32.5 Å²	32.5	3%	0.028	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	147	175.7	-176.9	0	0	0	0	110.7	I563 S564 F565 A600 K656	I563-S598 WeakPolarHBondContact CG2-OG 3.26Å; S564-S598 WeakPolarHBondContact O-CA 3.21Å; F565-S598 WeakPolarHBondContact CE1-OG 3.38Å; S598-A600 PolarHBondContact O-N 3.18Å; S598-A600 WeakPolarHBondContact OG-CB 3.1Å; S598-A600 PolarHBondContact OG-N 2.97Å; S598-K656 PolarHBondContact N-O 2.84Å
599	T	74.4	Confident	77.4	Confident	49 Å²	49	30 Å²	30	30%	0.301	17%	0.169	S	C	.	.			trans	-83	9.2	170.5	57.4	0	0	0	0	113.4	S564 S601	S564-T599 PolarHBondContact N-OG1 3.25Å; S564-T599 PolarHBondContact O-N 3.35Å; S564-T599 PolarHBondContact O-OG1 3.18Å; S564-T599 VanDerWaalsContact OG-CG2 3.26Å; S564-T599 WeakPolarHBondContact OG-CG2 3.35Å; S564-T599 PolarHBondContact OG-OG1 3.38Å; T599-S601 PolarHBondContact O-N 3.28Å
600	A	68.7	Low	77.4	Confident	12 Å²	12	23.1 Å²	23.1	10%	0.099	14%	0.137	C	C	.	.			trans	-57.2	121	176	0	0	0	0	0	110.7	I563 S598 I605	I563-A600 HydrophobicContact CD1-CB 4.07Å; I563-A600 HydrophobicContact CG1-CB 4.41Å; I563-A600 HydrophobicContact CG2-CB 3.94Å; S598-A600 PolarHBondContact O-N 3.18Å; S598-A600 WeakPolarHBondContact OG-CB 3.1Å; S598-A600 PolarHBondContact OG-N 2.97Å; A600-I605 HydrophobicContact CB-CB 4.42Å; A600-I605 HydrophobicContact CB-CG2 4.3Å
601	S	59.5	Low	77.6	Confident	96 Å²	96	21.8 Å²	21.8	67%	0.671	13%	0.132	S	C	*	.			trans	-88.8	-18.3	178.4	-58.4	0	0	0	0	112.6	T599	T599-S601 PolarHBondContact O-N 3.28Å
602	N	65.1	Low	77.9	Confident	39 Å²	39	18 Å²	18	21%	0.209	12%	0.115	C	C	.	.			trans	-85.6	124.6	179.1	-173.7	-19.8	0	0	0	110.5	D604 I605 Y690	N602-D604 PolarHBondContact O-N 3.44Å; N602-D604 PolarHBondContact OD1-N 2.81Å; N602-I605 HydrophobicContact CB-CD1 4.01Å; N602-I605 HydrophobicContact CB-CG1 4.13Å; N602-I605 PolarHBondContact O-N 2.86Å; N602-Y690 WeakPolarHBondContact ND2-CE2 2.91Å; N602-Y690 PolarHBondContact ND2-OH 2.62Å
603	P	62.7	Low	78.1	Confident	79 Å²	79	19.2 Å²	19.2	51%	0.513	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.1	178.6	27.6	-36.6	0	0	0	114.3	I605 K656	P603-I605 VanDerWaalsContact C-N 3.31Å; P603-K656 PolarHBondContact O-NZ 3.27Å
604	D	66.3	Low	78.3	Confident	34 Å²	34	19.1 Å²	19.1	18%	0.182	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9.4	-179.2	-65.1	-36.7	0	0	0	113.4	N602 S684 E685 Y690	N602-D604 PolarHBondContact O-N 3.44Å; N602-D604 PolarHBondContact OD1-N 2.81Å; D604-S684 WeakPolarHBondContact O-CA 3.32Å; D604-S684 PolarHBondContact O-OG 3.34Å; D604-E685 PolarHBondContact O-N 2.88Å; D604-E685 VanDerWaalsContact O-N 3.11Å; D604-Y690 HydrophobicContact CB-CD2 4.45Å
605	I	71.6	Confident	78.4	Confident	8 Å²	8	19.2 Å²	19.2	4%	0.041	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.3	178.4	-57.3	178.8	0	0	0	108.9	I563 A600 N602 P603 L682 L693	I563-I605 HydrophobicContact CD1-CD1 3.9Å; I563-I605 HydrophobicContact CD1-CG2 4.19Å; A600-I605 HydrophobicContact CB-CB 4.42Å; A600-I605 HydrophobicContact CB-CG2 4.3Å; N602-I605 HydrophobicContact CB-CD1 4.01Å; N602-I605 HydrophobicContact CB-CG1 4.13Å; N602-I605 PolarHBondContact O-N 2.86Å; P603-I605 VanDerWaalsContact C-N 3.31Å; I605-L682 HydrophobicContact CG2-CD2 3.83Å; I605-L693 HydrophobicContact CG1-CD1 4.48Å; I605-L693 HydrophobicContact CG2-CD1 4.46Å
606	G	72.8	Confident	78.4	Confident	5 Å²	5	21.5 Å²	21.5	5%	0.052	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	173.6	175.1	0	0	0	0	0	113.7	C683	G606-C683 CarbonylContact C-O 3.58Å; G606-C683 WeakPolarHBondContact CA-O 3.44Å; G606-C683 PolarHBondContact N-O 3.18Å; G606-C683 PolarHBondContact O-N 2.87Å; G606-C683 VanDerWaalsContact O-N 3.1Å
607	L	81.3	Confident	78.1	Confident	12 Å²	12	22.7 Å²	22.7	6%	0.063	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.4	179	174.9	142.8	0	0	0	110	F565 I596 I609 K658 M680	F565-L607 HydrophobicContact CD1-CD1 3.34Å; F565-L607 HydrophobicContact CE1-CD1 3.63Å; F565-L607 HydrophobicContact CG-CD1 4.38Å; I596-L607 HydrophobicContact CG2-CD1 3.94Å; I596-L607 HydrophobicContact CG2-CD2 4.15Å; L607-I609 HydrophobicContact CD2-CG1 4.26Å; L607-K658 HydrophobicContact CD2-CB 4.21Å; L607-K658 HydrophobicContact CD2-CD 4.41Å; L607-K658 HydrophobicContact CD2-CG 4.25Å; L607-K658 WeakPolarHBondContact O-CD 3.27Å; L607-K658 WeakPolarHBondContact O-CE 3.16Å; L607-K658 PolarHBondContact O-NZ 2.96Å; L607-K658 VanDerWaalsContact O-NZ 3.16Å; L607-M680 HydrophobicContact CD1-CE 3.57Å; L607-M680 HydrophobicContact CG-CE 3.89Å
608	T	80.3	Confident	78.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.7	170.7	-161.8	0	0	0	0	111.8	F632 M680 S681 L713	T608-F632 HydrophobicContact CG2-CD1 4.26Å; T608-F632 HydrophobicContact CG2-CE1 3.82Å; T608-M680 CarbonylContact O-C 3.58Å; T608-M680 VanDerWaalsContact O-CA 3.27Å; T608-M680 WeakPolarHBondContact O-CA 3.4Å; T608-M680 WeakPolarHBondContact O-CB 3.35Å; T608-S681 WeakPolarHBondContact CG2-OG 3.27Å; T608-S681 PolarHBondContact N-O 2.81Å; T608-S681 PolarHBondContact O-N 2.76Å; T608-L713 HydrophobicContact CG2-CD2 4.09Å
609	I	84.4	Confident	78	Confident	0 Å²	0	28 Å²	28	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.6	-179.6	-59.7	170	0	0	0	106.7	I596 L607 C612 I629 F632 W641 K658 F660	I596-I609 HydrophobicContact CD1-CD1 3.81Å; I596-I609 HydrophobicContact CD1-CG1 4.11Å; L607-I609 HydrophobicContact CD2-CG1 4.26Å; I609-C612 VanDerWaalsContact CG2-SG 3.54Å; I609-I629 HydrophobicContact CG2-CD1 3.84Å; I609-F632 WeakPolarHBondContact O-CD1 3.45Å; I609-W641 HydrophobicContact CD1-CH2 3.91Å; I609-W641 HydrophobicContact CD1-CZ3 4.05Å; I609-K658 HydrophobicContact CD1-CB 4.24Å; I609-F660 HydrophobicContact CD1-CD1 3.99Å; I609-F660 HydrophobicContact CD1-CE1 3.91Å
610	T	81.4	Confident	77.8	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-45	-174.6	59.1	0	0	0	0	111.1	T631 F632 E679 S681	T610-T631 PolarHBondContact O-N 2.84Å; T610-F632 HydrophobicContact CG2-CD1 4.21Å; T610-F632 HydrophobicContact CG2-CE1 3.3Å; T610-F632 HydrophobicContact CG2-CZ 3.52Å; T610-F632 PolarHBondContact O-N 3.2Å; T610-E679 PolarHBondContact N-O 2.87Å; T610-E679 WeakPolarHBondContact OG1-CB 3.36Å; T610-E679 PolarHBondContact OG1-O 3.21Å; T610-S681 VanDerWaalsContact CG2-OG 3.3Å; T610-S681 WeakPolarHBondContact CG2-OG 3.32Å
611	S	87	Confident	77.9	Confident	18 Å²	18	32 Å²	32	13%	0.126	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	152.1	176.7	70.7	0	0	0	0	110.4	I629 C678 E679	S611-I629 CarbonylContact C-O 3.57Å; S611-I629 WeakPolarHBondContact CA-O 3.5Å; S611-C678 CarbonylContact O-C 3.56Å; S611-C678 VanDerWaalsContact O-CA 3.26Å; S611-C678 WeakPolarHBondContact O-CA 3.36Å; S611-E679 PolarHBondContact N-O 3.42Å; S611-E679 PolarHBondContact O-N 3.07Å; S611-E679 WeakPolarHBondContact OG-CB 3.4Å; S611-E679 VanDerWaalsContact OG-CD 3.3Å; S611-E679 WeakPolarHBondContact OG-CG 3.43Å; S611-E679 PolarHBondContact OG-OE2 3.28Å
612	C	89.7	Confident	78.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	131.1	170.6	-73.8	0	0	0	0	109.3	I609 L628 I629 F660 H677 C678	I609-C612 VanDerWaalsContact CG2-SG 3.54Å; C612-L628 HydrophobicContact CB-CB 4.18Å; C612-L628 WeakPolarHBondContact O-CA 3.15Å; C612-L628 WeakPolarHBondContact O-CB 3.48Å; C612-L628 PolarHBondContact O-N 3.36Å; C612-I629 HydrophobicContact CB-CB 4.1Å; C612-I629 HydrophobicContact CB-CD1 4.27Å; C612-I629 HydrophobicContact CB-CG1 4.26Å; C612-I629 PolarHBondContact N-O 3.04Å; C612-I629 PolarHBondContact O-N 3.33Å; C612-F660 HydrophobicContact CB-CZ 4.43Å; C612-H677 CarbonylContact C-O 3.57Å; C612-H677 WeakPolarHBondContact CA-O 3.23Å; C612-C678 HydrophobicContact CB-CB 4.16Å; C612-C678 WeakPolarHBondContact CB-SG 3.35Å; C612-C678 WeakPolarHBondContact SG-CB 3.45Å; C612-C678 CovalentContact SG-SG 2.05Å; C612-C678 PolarHBondContact SG-SG 2.72Å
613	F	90.9	Very high	78.4	Confident	26 Å²	26	35.6 Å²	35.6	11%	0.114	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	158	177.7	65	-88.5	0	0	0	111.1	P620 E622 Y626 H677	F613-P620 WeakPolarHBondContact CZ-O 3.48Å; F613-E622 VanDerWaalsContact CE2-O 3.24Å; F613-E622 WeakPolarHBondContact CE2-O 3.25Å; F613-Y626 CarbonylContact C-O 3.5Å; F613-Y626 WeakPolarHBondContact CA-O 3.37Å; F613-Y626 WeakPolarHBondContact CB-O 3.1Å; F613-H677 HydrophobicContact CD1-CB 4.3Å; F613-H677 HydrophobicContact CD2-CB 4.47Å; F613-H677 AromaticContact CD2-CD2 3.87Å; F613-H677 HydrophobicContact CE1-CB 3.9Å; F613-H677 HydrophobicContact CE2-CB 4.1Å; F613-H677 AromaticContact CE2-CD2 3.4Å; F613-H677 VanDerWaalsContact CE2-CD2 3.4Å; F613-H677 WeakPolarHBondContact CE2-CD2 3.47Å; F613-H677 AromaticContact CE2-CG 3.94Å; F613-H677 HydrophobicContact CZ-CB 3.81Å; F613-H677 AromaticContact CZ-CD2 3.9Å; F613-H677 AromaticContact CZ-CG 3.96Å; F613-H677 PolarHBondContact N-O 2.82Å; F613-H677 PolarHBondContact O-N 3.14Å
614	I	89.4	Confident	79	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.6	178.6	-55.1	177.2	0	0	0	108.4	S624 Y626 L628 F662 F664 L669 V674 F675 L676	I614-S624 VanDerWaalsContact O-CB 3.29Å; I614-S624 WeakPolarHBondContact O-CB 3.35Å; I614-S624 PolarHBondContact O-OG 2.8Å; I614-Y626 HydrophobicContact CB-CD1 4.12Å; I614-Y626 HydrophobicContact CB-CG 4.16Å; I614-Y626 HydrophobicContact CD1-CD1 4.3Å; I614-Y626 HydrophobicContact CD1-CE1 4.02Å; I614-Y626 HydrophobicContact CD1-CE2 4.25Å; I614-Y626 PolarHBondContact N-O 3.16Å; I614-L628 HydrophobicContact CD1-CD1 4.27Å; I614-L628 HydrophobicContact CG1-CD1 4.23Å; I614-F662 HydrophobicContact CD1-CE2 3.65Å; I614-F662 HydrophobicContact CD1-CZ 3.84Å; I614-F664 HydrophobicContact CD1-CD2 4.1Å; I614-F664 HydrophobicContact CD1-CE2 4.23Å; I614-L669 HydrophobicContact CB-CD1 4.05Å; I614-L669 HydrophobicContact CG2-CD1 3.43Å; I614-L669 VanDerWaalsContact CG2-CD1 3.43Å; I614-V674 HydrophobicContact CG2-CB 3.92Å; I614-V674 HydrophobicContact CG2-CG2 3.86Å; I614-F675 CarbonylContact C-O 3.54Å; I614-F675 VanDerWaalsContact CA-O 3.31Å; I614-F675 WeakPolarHBondContact CA-O 3.43Å; I614-L676 HydrophobicContact CD1-CD1 4.5Å; I614-L676 HydrophobicContact CG1-CD1 3.75Å
615	S	88.4	Confident	79.5	Confident	1 Å²	1	39 Å²	39	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	160.3	179.1	95.2	0	0	0	0	111.3	S617 V674 F675 H677	S615-S617 PolarHBondContact O-N 2.88Å; S615-S617 PolarHBondContact OG-N 3.26Å; S615-S617 VanDerWaalsContact OG-N 3.09Å; S615-S617 PolarHBondContact OG-O 3.45Å; S615-V674 CarbonylContact O-C 3.53Å; S615-V674 WeakPolarHBondContact O-CA 3.48Å; S615-F675 PolarHBondContact N-O 3.45Å; S615-F675 PolarHBondContact O-N 2.76Å; S615-H677 PolarHBondContact OG-NE2 3.37Å
616	P	84.9	Confident	80.2	Confident	56 Å²	56	38.9 Å²	38.9	36%	0.364	24%	0.243	S	C	.	.	S	Bend	trans	-76	-3.7	173	32.8	-34.3	0	0	0	112.9	K671	P616-K671 HydrophobicContact CB-CG 3.92Å
617	S	80.7	Confident	80.8	Confident	27 Å²	27	39.4 Å²	39.4	19%	0.189	25%	0.246	C	C	.	.	S	Bend	trans	-113.3	151.6	-171.8	-178.6	0	0	0	0	111.6	S615 S619 E622 F675 H677	S615-S617 PolarHBondContact O-N 2.88Å; S615-S617 PolarHBondContact OG-N 3.26Å; S615-S617 VanDerWaalsContact OG-N 3.09Å; S615-S617 PolarHBondContact OG-O 3.45Å; S617-S619 PolarHBondContact O-N 2.88Å; S617-S619 PolarHBondContact OG-N 3.46Å; S617-E622 WeakPolarHBondContact CB-OE2 3.25Å; S617-E622 PolarHBondContact OG-OE2 2.78Å; S617-F675 VanDerWaalsContact O-CB 3.25Å; S617-F675 WeakPolarHBondContact O-CB 3.48Å; S617-F675 WeakPolarHBondContact O-CD2 3.5Å; S617-F675 VanDerWaalsContact O-CG 3.31Å; S617-F675 WeakPolarHBondContact O-CG 3.3Å; S617-H677 PolarHBondContact O-CE1 3.21Å; S617-H677 VanDerWaalsContact O-CE1 3.23Å; S617-H677 PolarHBondContact O-NE2 2.89Å
618	S	81.2	Confident	81.1	Confident	81 Å²	81	38.9 Å²	38.9	57%	0.566	24%	0.243	S	C	*	.	S	Bend	trans	-79	-8	176.1	63.1	0	0	0	0	113.3
619	S	76.6	Confident	81.3	Confident	42 Å²	42	39 Å²	39	29%	0.294	24%	0.244	S	C	.	.			trans	-88.3	126.5	-178.1	-166.8	0	0	0	0	112.4	S617 S621	S617-S619 PolarHBondContact O-N 2.88Å; S617-S619 PolarHBondContact OG-N 3.46Å; S619-S621 PolarHBondContact O-N 2.98Å; S619-S621 PolarHBondContact OG-OG 3.25Å
620	P	71.1	Confident	81.1	Confident	42 Å²	42	43.6 Å²	43.6	27%	0.273	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.4	176.3	32.4	-35.9	0	0	0	113.9	F613 H677	F613-P620 WeakPolarHBondContact CZ-O 3.48Å; P620-H677 HydrophobicContact CB-CB 4.37Å
621	S	70.8	Confident	80.9	Confident	103 Å²	103	46.2 Å²	46.2	72%	0.72	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.6	178.6	64.2	0	0	0	0	113.9	S619	S619-S621 PolarHBondContact O-N 2.98Å; S619-S621 PolarHBondContact OG-OG 3.25Å
622	E	70.2	Confident	80.4	Confident	88 Å²	88	45.7 Å²	45.7	41%	0.411	28%	0.277	S	S	.	.	S	Bend	trans	-91.2	126.2	-176.6	-162.5	167.6	146.4	0	0	109.8	F613 S617	F613-E622 VanDerWaalsContact CE2-O 3.24Å; F613-E622 WeakPolarHBondContact CE2-O 3.25Å; S617-E622 WeakPolarHBondContact CB-OE2 3.25Å; S617-E622 PolarHBondContact OG-OE2 2.78Å
623	S	64.8	Low	79.8	Confident	122 Å²	122	47.4 Å²	47.4	85%	0.853	29%	0.289	S	S	*	.			trans	-70.7	131.2	178.6	53.7	0	0	0	0	110.5
624	S	75.9	Confident	79.2	Confident	27 Å²	27	49.6 Å²	49.6	19%	0.189	30%	0.304	C	S	.	.			trans	-131.9	139	175.7	-177.9	0	0	0	0	110.9	I614 Y626	I614-S624 VanDerWaalsContact O-CB 3.29Å; I614-S624 WeakPolarHBondContact O-CB 3.35Å; I614-S624 PolarHBondContact O-OG 2.8Å; S624-Y626 PolarHBondContact O-N 3.18Å; S624-Y626 PolarHBondContact OG-N 2.7Å
625	D	77.3	Confident	78.8	Confident	159 Å²	159	54.7 Å²	54.7	85%	0.85	33%	0.326	S	S	*	.	S	Bend	trans	-70	-22.7	176.4	-63.2	-34.3	0	0	0	112.2	S627	D625-S627 VanDerWaalsContact C-N 3.28Å; D625-S627 PolarHBondContact O-N 3.09Å; D625-S627 PolarHBondContact O-OG 3.28Å
626	Y	86.3	Confident	78.3	Confident	5 Å²	5	56.3 Å²	56.3	2%	0.02	34%	0.335	C	S	.	.			trans	-79.9	76.5	177.1	-161.2	164.8	0	0	0	110.9	F613 I614 S624 L628 T663 F664 N665 M668 L669	F613-Y626 CarbonylContact C-O 3.5Å; F613-Y626 WeakPolarHBondContact CA-O 3.37Å; F613-Y626 WeakPolarHBondContact CB-O 3.1Å; I614-Y626 HydrophobicContact CB-CD1 4.12Å; I614-Y626 HydrophobicContact CB-CG 4.16Å; I614-Y626 HydrophobicContact CD1-CD1 4.3Å; I614-Y626 HydrophobicContact CD1-CE1 4.02Å; I614-Y626 HydrophobicContact CD1-CE2 4.25Å; I614-Y626 PolarHBondContact N-O 3.16Å; S624-Y626 PolarHBondContact O-N 3.18Å; S624-Y626 PolarHBondContact OG-N 2.7Å; Y626-L628 HydrophobicContact CD2-CD2 4.24Å; Y626-L628 HydrophobicContact CE2-CD2 3.74Å; Y626-T663 PolarHBondContact OH-O 2.67Å; Y626-F664 HydrophobicContact CE1-CD2 4.39Å; Y626-F664 HydrophobicContact CE1-CE2 4.24Å; Y626-N665 HydrophobicContact CE1-CB 4.43Å; Y626-N665 WeakPolarHBondContact CE1-O 3.33Å; Y626-N665 PolarHBondContact OH-N 3.25Å; Y626-M668 HydrophobicContact CD1-CB 3.76Å; Y626-M668 HydrophobicContact CD1-CG 4.49Å; Y626-M668 HydrophobicContact CD2-SD 4.48Å; Y626-M668 HydrophobicContact CE1-CB 4.18Å; Y626-M668 HydrophobicContact CG-CB 4.3Å; Y626-M668 HydrophobicContact CG-SD 4.3Å; Y626-L669 HydrophobicContact CD1-CD1 3.67Å; Y626-L669 HydrophobicContact CD1-CG 4.06Å; Y626-L669 HydrophobicContact CE1-CD1 4.48Å
627	S	84.9	Confident	77.9	Confident	16 Å²	16	61.8 Å²	61.8	11%	0.112	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.3	-178.1	40.7	0	0	0	0	111.5	D625 K635	D625-S627 VanDerWaalsContact C-N 3.28Å; D625-S627 PolarHBondContact O-N 3.09Å; D625-S627 PolarHBondContact O-OG 3.28Å; S627-K635 WeakPolarHBondContact OG-CD 3.5Å; S627-K635 WeakPolarHBondContact OG-CE 3.37Å; S627-K635 PolarHBondContact OG-NZ 3.4Å
628	L	86.6	Confident	77.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-46	-179.9	-59.4	176.4	0	0	0	111.2	C612 I614 Y626 K635 D636 L639 F660 F662 L676	C612-L628 HydrophobicContact CB-CB 4.18Å; C612-L628 WeakPolarHBondContact O-CA 3.15Å; C612-L628 WeakPolarHBondContact O-CB 3.48Å; C612-L628 PolarHBondContact O-N 3.36Å; I614-L628 HydrophobicContact CD1-CD1 4.27Å; I614-L628 HydrophobicContact CG1-CD1 4.23Å; Y626-L628 HydrophobicContact CD2-CD2 4.24Å; Y626-L628 HydrophobicContact CE2-CD2 3.74Å; L628-K635 PolarHBondContact O-N 3.28Å; L628-D636 HydrophobicContact CD2-CB 3.87Å; L628-D636 PolarHBondContact O-N 3.14Å; L628-L639 HydrophobicContact CB-CD1 4.19Å; L628-F660 HydrophobicContact CD1-CE2 4.4Å; L628-F662 HydrophobicContact CD1-CD1 3.86Å; L628-F662 HydrophobicContact CD1-CD2 4.08Å; L628-F662 HydrophobicContact CD1-CE1 3.81Å; L628-F662 HydrophobicContact CD1-CE2 4.05Å; L628-F662 HydrophobicContact CD1-CG 3.99Å; L628-F662 HydrophobicContact CD1-CZ 3.91Å; L628-F662 HydrophobicContact CD2-CB 4.31Å; L628-F662 HydrophobicContact CD2-CD2 3.76Å; L628-F662 HydrophobicContact CD2-CE2 4.25Å; L628-F662 HydrophobicContact CD2-CG 4.01Å; L628-L676 HydrophobicContact CD1-CD1 3.71Å
629	I	84.6	Confident	78	Confident	3 Å²	3	59 Å²	59	2%	0.015	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129.5	178.9	-57.1	172.4	0	0	0	107.4	I609 S611 C612 C633 L639 W641 F660	I609-I629 HydrophobicContact CG2-CD1 3.84Å; S611-I629 CarbonylContact C-O 3.57Å; S611-I629 WeakPolarHBondContact CA-O 3.5Å; C612-I629 HydrophobicContact CB-CB 4.1Å; C612-I629 HydrophobicContact CB-CD1 4.27Å; C612-I629 HydrophobicContact CB-CG1 4.26Å; C612-I629 PolarHBondContact N-O 3.04Å; C612-I629 PolarHBondContact O-N 3.33Å; I629-C633 CarbonylContact C-O 3.58Å; I629-C633 VanDerWaalsContact CA-O 3.29Å; I629-C633 WeakPolarHBondContact CA-O 3.44Å; I629-C633 WeakPolarHBondContact CG2-O 3.25Å; I629-L639 HydrophobicContact CD1-CD1 3.96Å; I629-L639 HydrophobicContact CG1-CD1 3.52Å; I629-W641 HydrophobicContact CD1-CH2 4.13Å; I629-W641 HydrophobicContact CD1-CZ2 4.05Å; I629-F660 HydrophobicContact CD1-CD1 4.46Å; I629-F660 HydrophobicContact CD1-CE1 4.27Å; I629-F660 HydrophobicContact CD1-CZ 4.36Å
630	E	81.4	Confident	78.2	Confident	96 Å²	96	63.7 Å²	63.7	45%	0.449	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.7	175.8	-176.3	170.5	-160.6	0	0	108.5	F632 C633 K635	E630-F632 PolarHBondContact O-N 3.34Å; E630-C633 PolarHBondContact N-O 3.13Å; E630-C633 WeakPolarHBondContact O-CB 3.23Å; E630-C633 PolarHBondContact O-N 3.19Å; E630-K635 HydrophobicContact CB-CD 4.16Å; E630-K635 WeakPolarHBondContact OE2-CD 3.32Å; E630-K635 WeakPolarHBondContact OE2-CE 3.48Å; E630-K635 IonicContact OE2-NZ 3.95Å; E630-K635 PolarHBondContact OE2-NZ 2.96Å
631	T	75.5	Confident	78.5	Confident	59 Å²	59	64.6 Å²	64.6	36%	0.362	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	53.5	177.6	-47.5	0	0	0	0	112.3	T610 C633 M710	T610-T631 PolarHBondContact O-N 2.84Å; T631-C633 PolarHBondContact O-N 3.24Å; T631-M710 HydrophobicContact CG2-CE 4.41Å; T631-M710 HydrophobicContact CG2-CG 4.03Å; T631-M710 HydrophobicContact CG2-SD 3.22Å; T631-M710 WeakPolarHBondContact CG2-SD 3.3Å
632	F	76.3	Confident	78.3	Confident	7 Å²	7	61.7 Å²	61.7	3%	0.031	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	-5.9	-177.3	-47.6	-88.2	0	0	0	115.1	T608 I609 T610 E630 P697 L699 L705 M710 L713	T608-F632 HydrophobicContact CG2-CD1 4.26Å; T608-F632 HydrophobicContact CG2-CE1 3.82Å; I609-F632 WeakPolarHBondContact O-CD1 3.45Å; T610-F632 HydrophobicContact CG2-CD1 4.21Å; T610-F632 HydrophobicContact CG2-CE1 3.3Å; T610-F632 HydrophobicContact CG2-CZ 3.52Å; T610-F632 PolarHBondContact O-N 3.2Å; E630-F632 PolarHBondContact O-N 3.34Å; F632-P697 HydrophobicContact CD1-CG 4.21Å; F632-L699 VanDerWaalsContact O-CD2 3.27Å; F632-L699 WeakPolarHBondContact O-CD2 3.48Å; F632-L705 HydrophobicContact CD2-CD2 3.5Å; F632-L705 HydrophobicContact CE2-CD2 3.97Å; F632-L705 HydrophobicContact CG-CD2 4.19Å; F632-M710 HydrophobicContact CD2-CG 4.43Å; F632-M710 HydrophobicContact CE2-CG 3.89Å; F632-L713 HydrophobicContact CE1-CB 4.15Å; F632-L713 HydrophobicContact CE1-CD1 3.95Å; F632-L713 HydrophobicContact CZ-CB 3.57Å; F632-L713 HydrophobicContact CZ-CD1 3.85Å; F632-L713 HydrophobicContact CZ-CG 4.33Å
633	C	78	Confident	77.6	Confident	36 Å²	36	63.2 Å²	63.2	24%	0.243	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.2	-172.7	-69.8	0	0	0	0	112.2	I629 E630 T631 K635 C702	I629-C633 CarbonylContact C-O 3.58Å; I629-C633 VanDerWaalsContact CA-O 3.29Å; I629-C633 WeakPolarHBondContact CA-O 3.44Å; I629-C633 WeakPolarHBondContact CG2-O 3.25Å; E630-C633 PolarHBondContact N-O 3.13Å; E630-C633 WeakPolarHBondContact O-CB 3.23Å; E630-C633 PolarHBondContact O-N 3.19Å; T631-C633 PolarHBondContact O-N 3.24Å; C633-K635 PolarHBondContact O-N 2.89Å; C633-C702 WeakPolarHBondContact CA-SG 3.2Å; C633-C702 HydrophobicContact CB-CB 4.18Å; C633-C702 WeakPolarHBondContact CB-SG 3.5Å; C633-C702 WeakPolarHBondContact SG-CB 3.3Å; C633-C702 CovalentContact SG-SG 2.03Å; C633-C702 PolarHBondContact SG-SG 2.9Å
634	T	79.2	Confident	76.4	Confident	71 Å²	71	64 Å²	64	44%	0.436	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	122	177.5	56	0	0	0	0	109.6	L639	T634-L639 HydrophobicContact CG2-CD1 4.47Å; T634-L639 HydrophobicContact CG2-CD2 3.8Å
635	K	80.7	Confident	74.6	Confident	107 Å²	107	68.4 Å²	68.4	47%	0.465	36%	0.363	S	S	.	.			trans	-103	-30.3	176.4	-174.8	161.8	170.6	-168.9	0	112.1	S627 L628 E630 C633	S627-K635 WeakPolarHBondContact OG-CD 3.5Å; S627-K635 WeakPolarHBondContact OG-CE 3.37Å; S627-K635 PolarHBondContact OG-NZ 3.4Å; L628-K635 PolarHBondContact O-N 3.28Å; E630-K635 HydrophobicContact CB-CD 4.16Å; E630-K635 WeakPolarHBondContact OE2-CD 3.32Å; E630-K635 WeakPolarHBondContact OE2-CE 3.48Å; E630-K635 IonicContact OE2-NZ 3.95Å; E630-K635 PolarHBondContact OE2-NZ 2.96Å; C633-K635 PolarHBondContact O-N 2.89Å
636	D	77.8	Confident	72.5	Confident	35 Å²	35	69 Å²	69	19%	0.187	36%	0.361	C	S	.	.	S	Bend	trans	-86.6	125.2	174.6	-167.9	-58.6	0	0	0	111.4	L628 S638 L639	L628-D636 HydrophobicContact CD2-CB 3.87Å; L628-D636 PolarHBondContact O-N 3.14Å; D636-S638 PolarHBondContact O-N 3.39Å; D636-S638 WeakPolarHBondContact OD1-CA 3.3Å; D636-S638 VanDerWaalsContact OD1-CB 3.22Å; D636-S638 WeakPolarHBondContact OD1-CB 3.47Å; D636-S638 PolarHBondContact OD1-N 2.73Å; D636-S638 PolarHBondContact OD1-OG 3.31Å; D636-L639 WeakPolarHBondContact O-CB 3.46Å; D636-L639 PolarHBondContact O-N 3.37Å
637	N	75.9	Confident	70.3	Confident	171 Å²	171	72.2 Å²	72.2	91%	0.914	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-16.7	-177.8	-65.8	-32.7	0	0	0	113.9	L639	N637-L639 VanDerWaalsContact C-N 3.32Å
638	S	80.3	Confident	68	Low	30 Å²	30	76.8 Å²	76.8	21%	0.21	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.2	176	75.4	0	0	0	0	113	D636 K640 T663	D636-S638 PolarHBondContact O-N 3.39Å; D636-S638 WeakPolarHBondContact OD1-CA 3.3Å; D636-S638 VanDerWaalsContact OD1-CB 3.22Å; D636-S638 WeakPolarHBondContact OD1-CB 3.47Å; D636-S638 PolarHBondContact OD1-N 2.73Å; D636-S638 PolarHBondContact OD1-OG 3.31Å; S638-K640 PolarHBondContact O-N 3.15Å; S638-T663 PolarHBondContact OG-N 2.73Å
639	L	83.8	Confident	65.9	Low	19 Å²	19	80.4 Å²	80.4	10%	0.099	43%	0.431	C	S	.	.			trans	-72.2	121.8	-175.2	-164.5	156	0	0	0	111.5	L628 I629 T634 D636 N637 W641 F660 S661	L628-L639 HydrophobicContact CB-CD1 4.19Å; I629-L639 HydrophobicContact CD1-CD1 3.96Å; I629-L639 HydrophobicContact CG1-CD1 3.52Å; T634-L639 HydrophobicContact CG2-CD1 4.47Å; T634-L639 HydrophobicContact CG2-CD2 3.8Å; D636-L639 WeakPolarHBondContact O-CB 3.46Å; D636-L639 PolarHBondContact O-N 3.37Å; N637-L639 VanDerWaalsContact C-N 3.32Å; L639-W641 HydrophobicContact CD2-CD2 4.46Å; L639-W641 HydrophobicContact CD2-CG 4.43Å; L639-F660 HydrophobicContact CD1-CD2 3.9Å; L639-F660 HydrophobicContact CD1-CE2 4.23Å; L639-F660 HydrophobicContact CD2-CB 4.01Å; L639-F660 HydrophobicContact CD2-CD2 4.37Å; L639-F660 HydrophobicContact CD2-CG 4.45Å; L639-F660 HydrophobicContact CG-CB 4.47Å; L639-F660 HydrophobicContact CG-CD2 3.97Å; L639-S661 CarbonylContact C-O 3.6Å; L639-S661 VanDerWaalsContact CA-O 3.27Å; L639-S661 WeakPolarHBondContact CA-O 3.45Å
640	K	81	Confident	63.8	Low	141 Å²	141	86.2 Å²	86.2	61%	0.613	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.6	176.2	-65.2	176.6	-174.2	171.6	0	110.3	S638 T642 F660 S661	S638-K640 PolarHBondContact O-N 3.15Å; K640-T642 PolarHBondContact O-N 2.88Å; K640-F660 CarbonylContact O-C 3.53Å; K640-F660 WeakPolarHBondContact O-CA 3.24Å; K640-S661 PolarHBondContact N-O 3.44Å; K640-S661 PolarHBondContact O-N 2.79Å
641	W	76.8	Confident	62.3	Low	61 Å²	61	83 Å²	83	23%	0.231	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.7	169.3	-69.8	98.6	0	0	0	109.5	I609 I629 L639 Q643 K658 F660 L699	I609-W641 HydrophobicContact CD1-CH2 3.91Å; I609-W641 HydrophobicContact CD1-CZ3 4.05Å; I629-W641 HydrophobicContact CD1-CH2 4.13Å; I629-W641 HydrophobicContact CD1-CZ2 4.05Å; L639-W641 HydrophobicContact CD2-CD2 4.46Å; L639-W641 HydrophobicContact CD2-CG 4.43Å; W641-Q643 PolarHBondContact O-N 2.76Å; W641-K658 HydrophobicContact CZ3-CB 4.39Å; W641-K658 HydrophobicContact CZ3-CD 4.45Å; W641-F660 HydrophobicContact CD2-CB 4.31Å; W641-F660 HydrophobicContact CE3-CB 3.96Å; W641-F660 HydrophobicContact CH2-CD1 4.49Å; W641-F660 HydrophobicContact CZ3-CB 4.19Å; W641-F660 HydrophobicContact CZ3-CD1 4.27Å; W641-L699 HydrophobicContact CE3-CD1 4.37Å; W641-L699 HydrophobicContact CH2-CD1 3.56Å; W641-L699 HydrophobicContact CH2-CD2 4.22Å; W641-L699 HydrophobicContact CH2-CG 4.44Å; W641-L699 HydrophobicContact CZ2-CB 4.29Å; W641-L699 HydrophobicContact CZ2-CD1 3.72Å; W641-L699 HydrophobicContact CZ2-CD2 3.86Å; W641-L699 HydrophobicContact CZ2-CG 4.17Å; W641-L699 HydrophobicContact CZ3-CD1 3.91Å
642	T	67	Low	60.6	Low	42 Å²	42	86.7 Å²	86.7	26%	0.258	47%	0.474	S	S	.	.			trans	-77.8	90	175.7	8.7	0	0	0	0	107.9	K640 S659	K640-T642 PolarHBondContact O-N 2.88Å; T642-S659 PolarHBondContact N-O 2.81Å; T642-S659 VanDerWaalsContact OG1-C 3.23Å; T642-S659 WeakPolarHBondContact OG1-CB 3.45Å; T642-S659 PolarHBondContact OG1-O 2.83Å; T642-S659 VanDerWaalsContact OG1-O 3.07Å; T642-S659 PolarHBondContact OG1-OG 3.18Å
643	Q	55.6	Low	59.1	Low	120 Å²	120	91 Å²	91	56%	0.561	51%	0.505	S	S	*	.			trans	-101.2	127.3	178.8	-148.3	-174.3	44.7	0	0	109.6	W641 R700	W641-Q643 PolarHBondContact O-N 2.76Å; Q643-R700 VanDerWaalsContact OE1-CZ 3.22Å
644	N	40.1	Very low	57.6	Low	139 Å²	139	91.7 Å²	91.7	74%	0.743	52%	0.519	S	S	*	.			trans	-112.8	150.2	150.2	-105.6	-7.9	0	0	0	108.4	Q646	N644-Q646 PolarHBondContact O-N 2.87Å
645	S	36.6	Very low	56.6	Low	119 Å²	119	91.5 Å²	91.5	83%	0.832	51%	0.512	S	S	*	.	S	Bend	trans	-63.9	14.6	-153.3	43	0	0	0	0	119.1
646	Q	34.3	Very low	55.8	Low	173 Å²	173	87.8 Å²	87.8	81%	0.808	50%	0.496	S	S	*	.	S	Bend	trans	-144.5	123.6	168.6	-78.6	177.3	-26.7	0	0	107.9	N644 H648	N644-Q646 PolarHBondContact O-N 2.87Å; Q646-H648 PolarHBondContact O-N 2.79Å
647	G	39.1	Very low	55.5	Low	72 Å²	72	86.9 Å²	86.9	74%	0.742	50%	0.495	S	S	*	.	S	Bend	trans	-67.5	51.1	-165.6	0	0	0	0	0	117
648	H	38	Very low	55.6	Low	111 Å²	111	81.2 Å²	81.2	51%	0.514	46%	0.462	S	S	.	.			trans	-146.6	109.2	179.5	-99.3	-115	0	0	0	110	Q646 K656	Q646-H648 PolarHBondContact O-N 2.79Å; H648-K656 WeakPolarHBondContact CE1-CE 3.4Å; H648-K656 PolarHBondContact CE1-NZ 2.9Å; H648-K656 VanDerWaalsContact CE1-NZ 3.32Å; H648-K656 PolarHBondContact NE2-NZ 2.86Å
649	F	42.6	Very low	55.6	Low	76 Å²	76	80.1 Å²	80.1	33%	0.333	45%	0.454	S	S	.	.			trans	-86.5	114	149.2	-81.5	-77.9	0	0	0	107.6	F651 K655	F649-F651 HydrophobicContact CB-CD1 4.08Å; F649-F651 HydrophobicContact CB-CD2 4.24Å; F649-F651 HydrophobicContact CB-CE1 3.61Å; F649-F651 HydrophobicContact CB-CE2 3.78Å; F649-F651 HydrophobicContact CB-CG 4.37Å; F649-F651 HydrophobicContact CB-CZ 3.45Å; F649-F651 VanDerWaalsContact CB-CZ 3.45Å; F649-F651 HydrophobicContact CD1-CD1 4.18Å; F649-F651 AromaticContact CD1-CE1 3.76Å; F649-F651 HydrophobicContact CD1-CE1 3.76Å; F649-F651 HydrophobicContact CD1-CZ 4.39Å; F649-F651 HydrophobicContact CD2-CE1 4.22Å; F649-F651 HydrophobicContact CD2-CZ 4.15Å; F649-F651 HydrophobicContact CE1-CE1 4.49Å; F649-F651 HydrophobicContact CG-CD1 4.3Å; F649-F651 AromaticContact CG-CE1 3.6Å; F649-F651 HydrophobicContact CG-CE1 3.6Å; F649-F651 AromaticContact CG-CZ 3.76Å; F649-F651 HydrophobicContact CG-CZ 3.76Å; F649-K655 VanDerWaalsContact O-O 3.07Å
650	L	39.8	Very low	55.7	Low	126 Å²	126	79.2 Å²	79.2	66%	0.66	45%	0.45	S	S	*	.			trans	-83.9	100.7	142.1	-72.2	165	0	0	0	104.3
651	F	49.2	Very low	56	Low	28 Å²	28	72.6 Å²	72.6	12%	0.123	42%	0.421	C	S	.	.			trans	-58.4	160.2	165.5	-59.6	-67.1	0	0	0	108.1	Q595 T597 F649 S653 G654 K655	Q595-F651 HydrophobicContact CG-CE1 4.27Å; Q595-F651 HydrophobicContact CG-CZ 4.04Å; T597-F651 HydrophobicContact CG2-CD2 3.59Å; T597-F651 HydrophobicContact CG2-CE2 3.41Å; T597-F651 VanDerWaalsContact CG2-CE2 3.41Å; T597-F651 HydrophobicContact CG2-CG 4.49Å; T597-F651 HydrophobicContact CG2-CZ 4.15Å; F649-F651 HydrophobicContact CB-CD1 4.08Å; F649-F651 HydrophobicContact CB-CD2 4.24Å; F649-F651 HydrophobicContact CB-CE1 3.61Å; F649-F651 HydrophobicContact CB-CE2 3.78Å; F649-F651 HydrophobicContact CB-CG 4.37Å; F649-F651 HydrophobicContact CB-CZ 3.45Å; F649-F651 VanDerWaalsContact CB-CZ 3.45Å; F649-F651 HydrophobicContact CD1-CD1 4.18Å; F649-F651 AromaticContact CD1-CE1 3.76Å; F649-F651 HydrophobicContact CD1-CE1 3.76Å; F649-F651 HydrophobicContact CD1-CZ 4.39Å; F649-F651 HydrophobicContact CD2-CE1 4.22Å; F649-F651 HydrophobicContact CD2-CZ 4.15Å; F649-F651 HydrophobicContact CE1-CE1 4.49Å; F649-F651 HydrophobicContact CG-CD1 4.3Å; F649-F651 AromaticContact CG-CE1 3.6Å; F649-F651 HydrophobicContact CG-CE1 3.6Å; F649-F651 AromaticContact CG-CZ 3.76Å; F649-F651 HydrophobicContact CG-CZ 3.76Å; F651-S653 CarbonylContact O-C 3.6Å; F651-S653 PolarHBondContact O-N 2.75Å; F651-G654 PolarHBondContact O-N 2.85Å; F651-K655 HydrophobicContact CD2-CB 4.43Å; F651-K655 WeakPolarHBondContact CD2-O 3.41Å; F651-K655 PolarHBondContact N-O 2.89Å
652	S	40.8	Very low	56.6	Low	136 Å²	136	69.7 Å²	69.7	95%	0.951	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-3.1	-176.5	-49.4	0	0	0	0	115.3
653	S	44.2	Very low	57.6	Low	97 Å²	97	70.4 Å²	70.4	68%	0.678	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	8.4	175.4	-44.1	0	0	0	0	115.6	F651 K655	F651-S653 CarbonylContact O-C 3.6Å; F651-S653 PolarHBondContact O-N 2.75Å; S653-K655 PolarHBondContact O-N 2.82Å
654	G	47.9	Very low	59.1	Low	52 Å²	52	64.8 Å²	64.8	54%	0.536	39%	0.388	S	S	.	.	S	Bend	trans	77.5	10.2	178.1	0	0	0	0	0	116.5	F651	F651-G654 PolarHBondContact O-N 2.85Å
655	K	56.5	Low	61.1	Low	66 Å²	66	60.7 Å²	60.7	29%	0.287	37%	0.366	S	S	.	.			trans	-87.6	142.8	-179.2	-62.6	178.1	178	176.7	0	111.5	E566 F649 F651 S653	E566-K655 IonicContact OE2-NZ 3.94Å; E566-K655 PolarHBondContact OE2-NZ 3.4Å; F649-K655 VanDerWaalsContact O-O 3.07Å; F651-K655 HydrophobicContact CD2-CB 4.43Å; F651-K655 WeakPolarHBondContact CD2-O 3.41Å; F651-K655 PolarHBondContact N-O 2.89Å; S653-K655 PolarHBondContact O-N 2.82Å
656	K	63.7	Low	63.1	Low	29 Å²	29	56.3 Å²	56.3	13%	0.126	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	145.4	170.6	-76.6	-169.5	167.5	-161.3	0	111	T597 S598 P603 H648 E685	T597-K656 WeakPolarHBondContact CA-O 3.37Å; S598-K656 PolarHBondContact N-O 2.84Å; P603-K656 PolarHBondContact O-NZ 3.27Å; H648-K656 WeakPolarHBondContact CE1-CE 3.4Å; H648-K656 PolarHBondContact CE1-NZ 2.9Å; H648-K656 VanDerWaalsContact CE1-NZ 3.32Å; H648-K656 PolarHBondContact NE2-NZ 2.86Å; K656-E685 IonicContact NZ-OE2 3.33Å; K656-E685 PolarHBondContact NZ-OE2 3.47Å
657	G	71.7	Confident	64.9	Low	17 Å²	17	56.2 Å²	56.2	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	169.9	176.5	0	0	0	0	0	114.5	I596	I596-G657 CarbonylContact O-C 3.58Å; I596-G657 WeakPolarHBondContact O-CA 3.3Å
658	K	77.9	Confident	66.2	Low	52 Å²	52	58.3 Å²	58.3	23%	0.226	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.4	177.6	-72.8	-171.7	172.5	173.6	0	110.1	I596 L607 I609 W641 L699	I596-K658 PolarHBondContact N-O 3.49Å; I596-K658 PolarHBondContact O-N 2.95Å; L607-K658 HydrophobicContact CD2-CB 4.21Å; L607-K658 HydrophobicContact CD2-CD 4.41Å; L607-K658 HydrophobicContact CD2-CG 4.25Å; L607-K658 WeakPolarHBondContact O-CD 3.27Å; L607-K658 WeakPolarHBondContact O-CE 3.16Å; L607-K658 PolarHBondContact O-NZ 2.96Å; L607-K658 VanDerWaalsContact O-NZ 3.16Å; I609-K658 HydrophobicContact CD1-CB 4.24Å; W641-K658 HydrophobicContact CZ3-CB 4.39Å; W641-K658 HydrophobicContact CZ3-CD 4.45Å; K658-L699 HydrophobicContact CD-CD1 4.03Å; K658-L699 VanDerWaalsContact NZ-CD1 3.33Å
659	S	81.1	Confident	67.6	Low	6 Å²	6	53.9 Å²	53.9	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.9	175.4	60.5	0	0	0	0	112	V594 T642	V594-S659 WeakPolarHBondContact O-CA 3.31Å; V594-S659 WeakPolarHBondContact O-CB 3.32Å; T642-S659 PolarHBondContact N-O 2.81Å; T642-S659 VanDerWaalsContact OG1-C 3.23Å; T642-S659 WeakPolarHBondContact OG1-CB 3.45Å; T642-S659 PolarHBondContact OG1-O 2.83Å; T642-S659 VanDerWaalsContact OG1-O 3.07Å; T642-S659 PolarHBondContact OG1-OG 3.18Å
660	F	85.8	Confident	68.8	Low	0 Å²	0	58 Å²	58	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.5	173.8	64.1	-89	0	0	0	109.4	V594 I609 C612 L628 I629 L639 K640 W641 F662	V594-F660 HydrophobicContact CB-CD1 4.22Å; V594-F660 HydrophobicContact CB-CD2 4.35Å; V594-F660 HydrophobicContact CB-CE1 3.77Å; V594-F660 HydrophobicContact CB-CE2 3.93Å; V594-F660 HydrophobicContact CB-CG 4.49Å; V594-F660 HydrophobicContact CB-CZ 3.62Å; V594-F660 HydrophobicContact CG1-CE1 3.88Å; V594-F660 HydrophobicContact CG1-CZ 3.84Å; V594-F660 HydrophobicContact CG2-CD2 4.29Å; V594-F660 HydrophobicContact CG2-CE1 4.35Å; V594-F660 HydrophobicContact CG2-CE2 3.64Å; V594-F660 HydrophobicContact CG2-CZ 3.69Å; V594-F660 PolarHBondContact N-O 2.8Å; V594-F660 PolarHBondContact O-N 2.86Å; I609-F660 HydrophobicContact CD1-CD1 3.99Å; I609-F660 HydrophobicContact CD1-CE1 3.91Å; C612-F660 HydrophobicContact CB-CZ 4.43Å; L628-F660 HydrophobicContact CD1-CE2 4.4Å; I629-F660 HydrophobicContact CD1-CD1 4.46Å; I629-F660 HydrophobicContact CD1-CE1 4.27Å; I629-F660 HydrophobicContact CD1-CZ 4.36Å; L639-F660 HydrophobicContact CD1-CD2 3.9Å; L639-F660 HydrophobicContact CD1-CE2 4.23Å; L639-F660 HydrophobicContact CD2-CB 4.01Å; L639-F660 HydrophobicContact CD2-CD2 4.37Å; L639-F660 HydrophobicContact CD2-CG 4.45Å; L639-F660 HydrophobicContact CG-CB 4.47Å; L639-F660 HydrophobicContact CG-CD2 3.97Å; K640-F660 CarbonylContact O-C 3.53Å; K640-F660 WeakPolarHBondContact O-CA 3.24Å; W641-F660 HydrophobicContact CD2-CB 4.31Å; W641-F660 HydrophobicContact CE3-CB 3.96Å; W641-F660 HydrophobicContact CH2-CD1 4.49Å; W641-F660 HydrophobicContact CZ3-CB 4.19Å; W641-F660 HydrophobicContact CZ3-CD1 4.27Å; F660-F662 HydrophobicContact CD2-CD1 4.33Å; F660-F662 AromaticContact CE2-CD1 3.94Å; F660-F662 HydrophobicContact CE2-CD1 3.94Å; F660-F662 HydrophobicContact CE2-CE1 4.46Å
661	S	86.3	Confident	70.4	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.014	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	151.2	170.7	70.5	0	0	0	0	110.9	E591 V592 L639 K640	E591-S661 VanDerWaalsContact OE1-CB 3.27Å; E591-S661 WeakPolarHBondContact OE1-CB 3.19Å; E591-S661 PolarHBondContact OE1-OG 2.86Å; V592-S661 CarbonylContact O-C 3.5Å; V592-S661 VanDerWaalsContact O-CA 3.23Å; V592-S661 WeakPolarHBondContact O-CA 3.49Å; L639-S661 CarbonylContact C-O 3.6Å; L639-S661 VanDerWaalsContact CA-O 3.27Å; L639-S661 WeakPolarHBondContact CA-O 3.45Å; K640-S661 PolarHBondContact N-O 3.44Å; K640-S661 PolarHBondContact O-N 2.79Å
662	F	89.6	Confident	71.8	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	161.1	174	71.5	-84.4	0	0	0	109.9	E591 V592 V594 I614 L628 F660 F664	E591-F662 WeakPolarHBondContact CA-O 3.28Å; V592-F662 HydrophobicContact CB-CD1 4.36Å; V592-F662 HydrophobicContact CB-CE1 3.86Å; V592-F662 HydrophobicContact CB-CE2 4.45Å; V592-F662 HydrophobicContact CB-CZ 3.91Å; V592-F662 HydrophobicContact CG1-CE1 3.93Å; V592-F662 HydrophobicContact CG1-CZ 4.12Å; V592-F662 HydrophobicContact CG2-CZ 4.38Å; V592-F662 PolarHBondContact N-O 2.75Å; V592-F662 PolarHBondContact O-N 2.91Å; V594-F662 HydrophobicContact CG2-CD1 4.02Å; V594-F662 HydrophobicContact CG2-CE1 3.59Å; I614-F662 HydrophobicContact CD1-CE2 3.65Å; I614-F662 HydrophobicContact CD1-CZ 3.84Å; L628-F662 HydrophobicContact CD1-CD1 3.86Å; L628-F662 HydrophobicContact CD1-CD2 4.08Å; L628-F662 HydrophobicContact CD1-CE1 3.81Å; L628-F662 HydrophobicContact CD1-CE2 4.05Å; L628-F662 HydrophobicContact CD1-CG 3.99Å; L628-F662 HydrophobicContact CD1-CZ 3.91Å; L628-F662 HydrophobicContact CD2-CB 4.31Å; L628-F662 HydrophobicContact CD2-CD2 3.76Å; L628-F662 HydrophobicContact CD2-CE2 4.25Å; L628-F662 HydrophobicContact CD2-CG 4.01Å; F660-F662 HydrophobicContact CD2-CD1 4.33Å; F660-F662 AromaticContact CE2-CD1 3.94Å; F660-F662 HydrophobicContact CE2-CD1 3.94Å; F660-F662 HydrophobicContact CE2-CE1 4.46Å; F662-F664 HydrophobicContact CE2-CB 4.44Å; F662-F664 HydrophobicContact CE2-CD2 4.46Å
663	T	88.1	Confident	73.8	Confident	57 Å²	57	59.2 Å²	59.2	35%	0.35	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.3	177.9	-56.4	0	0	0	0	109.9	Q589 Y626 S638	Q589-T663 HydrophobicContact CB-CG2 4.49Å; Y626-T663 PolarHBondContact OH-O 2.67Å; S638-T663 PolarHBondContact OG-N 2.73Å
664	F	86.9	Confident	75.9	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	29%	0.293	C	S	.	.			trans	-70	142.4	178.8	-175.9	-102.1	0	0	0	111.4	V586 Q589 M590 V592 I614 Y626 F662 V674 V726	V586-F664 HydrophobicContact CB-CD1 4.35Å; V586-F664 HydrophobicContact CB-CG 4.43Å; V586-F664 HydrophobicContact CG1-CD1 3.53Å; V586-F664 HydrophobicContact CG1-CD2 4.18Å; V586-F664 HydrophobicContact CG1-CE1 3.63Å; V586-F664 HydrophobicContact CG1-CE2 4.26Å; V586-F664 HydrophobicContact CG1-CG 3.82Å; V586-F664 HydrophobicContact CG1-CZ 4Å; V586-F664 HydrophobicContact CG2-CB 3.54Å; V586-F664 HydrophobicContact CG2-CD1 3.86Å; V586-F664 HydrophobicContact CG2-CG 3.71Å; Q589-F664 WeakPolarHBondContact CA-O 3.38Å; Q589-F664 PolarHBondContact N-O 2.96Å; M590-F664 PolarHBondContact O-N 2.9Å; V592-F664 HydrophobicContact CG2-CB 4.32Å; I614-F664 HydrophobicContact CD1-CD2 4.1Å; I614-F664 HydrophobicContact CD1-CE2 4.23Å; Y626-F664 HydrophobicContact CE1-CD2 4.39Å; Y626-F664 HydrophobicContact CE1-CE2 4.24Å; F662-F664 HydrophobicContact CE2-CB 4.44Å; F662-F664 HydrophobicContact CE2-CD2 4.46Å; F664-V674 HydrophobicContact CE2-CG2 4.1Å; F664-V674 HydrophobicContact CZ-CG2 4.22Å; F664-V726 HydrophobicContact CE1-CG1 3.97Å; F664-V726 HydrophobicContact CE1-CG2 3.83Å; F664-V726 HydrophobicContact CZ-CG2 3.6Å
665	N	83.9	Confident	77.9	Confident	54 Å²	54	53.8 Å²	53.8	29%	0.289	28%	0.275	S	S	.	.			trans	-132.2	105	-176.5	-177.6	-10.3	0	0	0	108.2	Y626 K667	Y626-N665 HydrophobicContact CE1-CB 4.43Å; Y626-N665 WeakPolarHBondContact CE1-O 3.33Å; Y626-N665 PolarHBondContact OH-N 3.25Å; N665-K667 PolarHBondContact O-N 2.81Å; N665-K667 WeakPolarHBondContact OD1-CB 3.38Å; N665-K667 PolarHBondContact OD1-N 3.34Å; N665-K667 VanDerWaalsContact OD1-N 3.09Å
666	S	77	Confident	79.5	Confident	27 Å²	27	50.6 Å²	50.6	19%	0.189	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-70.9	-21.4	-176.2	66.4	0	0	0	0	112.5	D588 M668 L669	D588-S666 WeakPolarHBondContact CB-OG 3.32Å; D588-S666 PolarHBondContact OD1-N 3.17Å; D588-S666 PolarHBondContact OD1-OG 2.94Å; S666-M668 PolarHBondContact O-N 3.25Å; S666-L669 CarbonylContact O-C 3.54Å; S666-L669 PolarHBondContact O-N 3.14Å; S666-L669 VanDerWaalsContact O-N 3.17Å
667	K	72.4	Confident	80.8	Confident	170 Å²	170	49.2 Å²	49.2	74%	0.739	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-65.6	-22.8	-177.8	-60	-178.5	-179.6	178.2	0	113.6	N665	N665-K667 PolarHBondContact O-N 2.81Å; N665-K667 WeakPolarHBondContact OD1-CB 3.38Å; N665-K667 PolarHBondContact OD1-N 3.34Å; N665-K667 VanDerWaalsContact OD1-N 3.09Å
668	M	66.8	Low	81.6	Confident	116 Å²	116	48.5 Å²	48.5	57%	0.571	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-79.5	-21	178.8	-66.8	-141.8	178.3	0	0	113.2	Y626 S666	Y626-M668 HydrophobicContact CD1-CB 3.76Å; Y626-M668 HydrophobicContact CD1-CG 4.49Å; Y626-M668 HydrophobicContact CD2-SD 4.48Å; Y626-M668 HydrophobicContact CE1-CB 4.18Å; Y626-M668 HydrophobicContact CG-CB 4.3Å; Y626-M668 HydrophobicContact CG-SD 4.3Å; S666-M668 PolarHBondContact O-N 3.25Å
669	L	66.8	Low	82.1	Confident	19 Å²	19	47.4 Å²	47.4	10%	0.099	24%	0.243	C	C	.	.			trans	-137.5	104.7	-174.8	-67.5	171.1	0	0	0	110	I614 Y626 S666 K671 V674	I614-L669 HydrophobicContact CB-CD1 4.05Å; I614-L669 HydrophobicContact CG2-CD1 3.43Å; I614-L669 VanDerWaalsContact CG2-CD1 3.43Å; Y626-L669 HydrophobicContact CD1-CD1 3.67Å; Y626-L669 HydrophobicContact CD1-CG 4.06Å; Y626-L669 HydrophobicContact CE1-CD1 4.48Å; S666-L669 CarbonylContact O-C 3.54Å; S666-L669 PolarHBondContact O-N 3.14Å; S666-L669 VanDerWaalsContact O-N 3.17Å; L669-K671 PolarHBondContact O-N 3.41Å; L669-V674 HydrophobicContact CB-CG1 4.1Å; L669-V674 HydrophobicContact CD1-CB 4.3Å; L669-V674 HydrophobicContact CD1-CG1 3.94Å
670	N	67.3	Low	82.4	Confident	163 Å²	163	47.2 Å²	47.2	87%	0.872	24%	0.241	S	C	*	.			trans	-79.6	56.5	-179.6	-167	9	0	0	0	112.2
671	K	74.9	Confident	82.2	Confident	134 Å²	134	47.3 Å²	47.3	58%	0.583	24%	0.242	S	C	*	.			trans	-144.7	146.3	-177.4	-68	-65.7	-178.4	178.2	0	111.6	P616 L669 V674	P616-K671 HydrophobicContact CB-CG 3.92Å; L669-K671 PolarHBondContact O-N 3.41Å; K671-V674 HydrophobicContact CB-CG1 4.26Å
672	T	78.4	Confident	82	Confident	109 Å²	109	47.9 Å²	47.9	67%	0.669	25%	0.245	S	C	*	.	S	Bend	trans	-82.7	-16.2	179.5	53.5	0	0	0	0	113.7	A725 V726	T672-A725 CarbonylContact O-C 3.39Å; T672-A725 WeakPolarHBondContact O-CA 3.05Å; T672-V726 PolarHBondContact O-N 3.47Å
673	L	83.3	Confident	81.4	Confident	71 Å²	71	47.9 Å²	47.9	37%	0.372	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124	174.1	-174.7	71.9	0	0	0	108.6	I583 F675 P723 A725	I583-L673 HydrophobicContact CG2-CD1 4.37Å; L673-F675 HydrophobicContact CD2-CE2 4.28Å; L673-F675 HydrophobicContact CD2-CZ 3.93Å; L673-F675 HydrophobicContact CG-CE2 4.3Å; L673-F675 HydrophobicContact CG-CZ 4.27Å; L673-P723 HydrophobicContact CD1-CB 4.36Å; L673-A725 HydrophobicContact CD1-CB 4.46Å
674	V	87.9	Confident	80.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	162.7	179.2	-59.1	0	0	0	0	109.6	I614 S615 F664 L669 K671 I724 V726	I614-V674 HydrophobicContact CG2-CB 3.92Å; I614-V674 HydrophobicContact CG2-CG2 3.86Å; S615-V674 CarbonylContact O-C 3.53Å; S615-V674 WeakPolarHBondContact O-CA 3.48Å; F664-V674 HydrophobicContact CE2-CG2 4.1Å; F664-V674 HydrophobicContact CZ-CG2 4.22Å; L669-V674 HydrophobicContact CB-CG1 4.1Å; L669-V674 HydrophobicContact CD1-CB 4.3Å; L669-V674 HydrophobicContact CD1-CG1 3.94Å; K671-V674 HydrophobicContact CB-CG1 4.26Å; V674-I724 HydrophobicContact CG2-CB 3.86Å; V674-I724 HydrophobicContact CG2-CG2 4.08Å; V674-I724 PolarHBondContact N-O 2.91Å; V674-I724 PolarHBondContact O-N 3.27Å; V674-I724 VanDerWaalsContact O-O 3.07Å; V674-V726 HydrophobicContact CG1-CG2 4.27Å; V674-V726 HydrophobicContact CG2-CG2 4.07Å
675	F	89	Confident	79.9	Confident	35 Å²	35	49.7 Å²	49.7	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.1	-176.1	-60.9	-96.3	0	0	0	109.7	I614 S615 S617 L673 T721 K722 P723	I614-F675 CarbonylContact C-O 3.54Å; I614-F675 VanDerWaalsContact CA-O 3.31Å; I614-F675 WeakPolarHBondContact CA-O 3.43Å; S615-F675 PolarHBondContact N-O 3.45Å; S615-F675 PolarHBondContact O-N 2.76Å; S617-F675 VanDerWaalsContact O-CB 3.25Å; S617-F675 WeakPolarHBondContact O-CB 3.48Å; S617-F675 WeakPolarHBondContact O-CD2 3.5Å; S617-F675 VanDerWaalsContact O-CG 3.31Å; S617-F675 WeakPolarHBondContact O-CG 3.3Å; L673-F675 HydrophobicContact CD2-CE2 4.28Å; L673-F675 HydrophobicContact CD2-CZ 3.93Å; L673-F675 HydrophobicContact CG-CE2 4.3Å; L673-F675 HydrophobicContact CG-CZ 4.27Å; F675-T721 HydrophobicContact CB-CG2 3.94Å; F675-T721 HydrophobicContact CD1-CG2 4.08Å; F675-T721 HydrophobicContact CG-CG2 4.43Å; F675-K722 WeakPolarHBondContact CA-O 3.28Å; F675-P723 HydrophobicContact CD1-CB 4Å; F675-P723 HydrophobicContact CE1-CB 3.87Å
676	L	90.4	Very high	79	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.6	170.2	176.3	69.3	0	0	0	108.6	M567 L569 V594 I614 L628 T721 K722 I724	M567-L676 HydrophobicContact SD-CD2 4.17Å; L569-L676 HydrophobicContact CD2-CD2 3.8Å; V594-L676 HydrophobicContact CG1-CD2 4.11Å; V594-L676 HydrophobicContact CG2-CD2 3.82Å; I614-L676 HydrophobicContact CD1-CD1 4.5Å; I614-L676 HydrophobicContact CG1-CD1 3.75Å; L628-L676 HydrophobicContact CD1-CD1 3.71Å; L676-T721 CarbonylContact O-C 3.51Å; L676-T721 VanDerWaalsContact O-CA 3.28Å; L676-T721 WeakPolarHBondContact O-CA 3.29Å; L676-K722 PolarHBondContact N-O 2.73Å; L676-K722 PolarHBondContact O-N 3.5Å; L676-I724 HydrophobicContact CB-CD1 3.82Å
677	H	90.6	Very high	77.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.7	173.1	-50.1	-81.7	0	0	0	108.7	C612 F613 S615 S617 P620 L720 T721	C612-H677 CarbonylContact C-O 3.57Å; C612-H677 WeakPolarHBondContact CA-O 3.23Å; F613-H677 HydrophobicContact CD1-CB 4.3Å; F613-H677 HydrophobicContact CD2-CB 4.47Å; F613-H677 AromaticContact CD2-CD2 3.87Å; F613-H677 HydrophobicContact CE1-CB 3.9Å; F613-H677 HydrophobicContact CE2-CB 4.1Å; F613-H677 AromaticContact CE2-CD2 3.4Å; F613-H677 VanDerWaalsContact CE2-CD2 3.4Å; F613-H677 WeakPolarHBondContact CE2-CD2 3.47Å; F613-H677 AromaticContact CE2-CG 3.94Å; F613-H677 HydrophobicContact CZ-CB 3.81Å; F613-H677 AromaticContact CZ-CD2 3.9Å; F613-H677 AromaticContact CZ-CG 3.96Å; F613-H677 PolarHBondContact N-O 2.82Å; F613-H677 PolarHBondContact O-N 3.14Å; S615-H677 PolarHBondContact OG-NE2 3.37Å; S617-H677 PolarHBondContact O-CE1 3.21Å; S617-H677 VanDerWaalsContact O-CE1 3.23Å; S617-H677 PolarHBondContact O-NE2 2.89Å; P620-H677 HydrophobicContact CB-CB 4.37Å; H677-L720 WeakPolarHBondContact CA-O 2.86Å; H677-T721 WeakPolarHBondContact CE1-CG2 3.43Å; H677-T721 VanDerWaalsContact ND1-CG2 3.28Å; H677-T721 WeakPolarHBondContact ND1-CG2 3.25Å; H677-T721 PolarHBondContact ND1-OG1 3.42Å
678	C	89.6	Confident	76.8	Confident	1 Å²	1	54 Å²	54	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.2	166.7	-67.6	0	0	0	0	110.8	M567 I596 S611 C612 S719 L720	M567-C678 HydrophobicContact CE-CB 3.39Å; I596-C678 HydrophobicContact CD1-CB 4.05Å; S611-C678 CarbonylContact O-C 3.56Å; S611-C678 VanDerWaalsContact O-CA 3.26Å; S611-C678 WeakPolarHBondContact O-CA 3.36Å; C612-C678 HydrophobicContact CB-CB 4.16Å; C612-C678 WeakPolarHBondContact CB-SG 3.35Å; C612-C678 WeakPolarHBondContact SG-CB 3.45Å; C612-C678 CovalentContact SG-SG 2.05Å; C612-C678 PolarHBondContact SG-SG 2.72Å; C678-S719 CarbonylContact O-C 3.56Å; C678-S719 WeakPolarHBondContact O-CA 3.22Å; C678-L720 PolarHBondContact N-O 3.18Å; C678-L720 PolarHBondContact O-N 3.3Å
679	E	89.1	Confident	75.8	Confident	30 Å²	30	58.1 Å²	58.1	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133.8	173	-60.1	-175.6	141.7	0	0	109.3	T610 S611 K717 R718	T610-E679 PolarHBondContact N-O 2.87Å; T610-E679 WeakPolarHBondContact OG1-CB 3.36Å; T610-E679 PolarHBondContact OG1-O 3.21Å; S611-E679 PolarHBondContact N-O 3.42Å; S611-E679 PolarHBondContact O-N 3.07Å; S611-E679 WeakPolarHBondContact OG-CB 3.4Å; S611-E679 VanDerWaalsContact OG-CD 3.3Å; S611-E679 WeakPolarHBondContact OG-CG 3.43Å; S611-E679 PolarHBondContact OG-OE2 3.28Å; E679-K717 VanDerWaalsContact CD-NZ 3.27Å; E679-K717 WeakPolarHBondContact OE1-CE 3.18Å; E679-K717 IonicContact OE1-NZ 2.83Å; E679-K717 PolarHBondContact OE1-NZ 3.45Å; E679-K717 IonicContact OE2-NZ 3.83Å; E679-K717 PolarHBondContact OE2-NZ 3.2Å; E679-R718 CarbonylContact C-O 3.51Å; E679-R718 WeakPolarHBondContact CA-O 3.5Å
680	M	86.1	Confident	75.1	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.8	-177.6	63.5	61.8	55.4	0	0	110.6	F565 L607 T608 K717 R718	F565-M680 HydrophobicContact CB-CG 4.36Å; F565-M680 HydrophobicContact CB-SD 4.32Å; F565-M680 HydrophobicContact CD1-CE 3.29Å; F565-M680 HydrophobicContact CD1-CG 4.45Å; F565-M680 HydrophobicContact CD1-SD 3.84Å; F565-M680 HydrophobicContact CD2-CE 3.61Å; F565-M680 HydrophobicContact CD2-CG 4.1Å; F565-M680 HydrophobicContact CD2-SD 3.04Å; F565-M680 WeakPolarHBondContact CD2-SD 3.44Å; F565-M680 HydrophobicContact CE1-CE 3.01Å; F565-M680 HydrophobicContact CE1-SD 3.93Å; F565-M680 HydrophobicContact CE2-CE 3.34Å; F565-M680 HydrophobicContact CE2-SD 3.13Å; F565-M680 WeakPolarHBondContact CE2-SD 3.36Å; F565-M680 HydrophobicContact CG-CE 3.57Å; F565-M680 HydrophobicContact CG-CG 3.99Å; F565-M680 HydrophobicContact CG-SD 3.41Å; F565-M680 WeakPolarHBondContact CG-SD 3.12Å; F565-M680 HydrophobicContact CZ-CE 3.04Å; F565-M680 HydrophobicContact CZ-SD 3.59Å; F565-M680 VanDerWaalsContact CZ-SD 3.59Å; L607-M680 HydrophobicContact CD1-CE 3.57Å; L607-M680 HydrophobicContact CG-CE 3.89Å; T608-M680 CarbonylContact O-C 3.58Å; T608-M680 VanDerWaalsContact O-CA 3.27Å; T608-M680 WeakPolarHBondContact O-CA 3.4Å; T608-M680 WeakPolarHBondContact O-CB 3.35Å; M680-K717 CarbonylContact O-C 3.57Å; M680-K717 VanDerWaalsContact O-CA 3.31Å; M680-K717 WeakPolarHBondContact O-CA 3.31Å; M680-R718 PolarHBondContact N-O 3.5Å; M680-R718 PolarHBondContact O-N 2.92Å; M680-R718 HydrophobicContact SD-CB 3.85Å; M680-R718 HydrophobicContact SD-CG 4.42Å
681	S	82.5	Confident	74.3	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.007	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.2	173.9	55	0	0	0	0	111.6	T608 T610 L713	T608-S681 WeakPolarHBondContact CG2-OG 3.27Å; T608-S681 PolarHBondContact N-O 2.81Å; T608-S681 PolarHBondContact O-N 2.76Å; T610-S681 VanDerWaalsContact CG2-OG 3.3Å; T610-S681 WeakPolarHBondContact CG2-OG 3.32Å; S681-L713 VanDerWaalsContact CB-O 3.26Å; S681-L713 WeakPolarHBondContact CB-O 3.36Å; S681-L713 WeakPolarHBondContact OG-CD2 3.39Å
682	L	81.4	Confident	73.4	Confident	15 Å²	15	64.7 Å²	64.7	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	139.3	174	-69.7	174.7	0	0	0	109.6	V560 I563 F565 I605 L693	V560-L682 HydrophobicContact CG1-CD1 3.61Å; I563-L682 HydrophobicContact CB-CD1 4.26Å; I563-L682 HydrophobicContact CD1-CD1 4.04Å; I563-L682 HydrophobicContact CG2-CD1 4.38Å; I563-L682 HydrophobicContact CG2-CD2 4.16Å; F565-L682 HydrophobicContact CE1-CD2 3.69Å; F565-L682 HydrophobicContact CE1-CG 4.42Å; F565-L682 HydrophobicContact CZ-CD1 4.21Å; F565-L682 HydrophobicContact CZ-CD2 3.46Å; F565-L682 VanDerWaalsContact CZ-CD2 3.46Å; F565-L682 HydrophobicContact CZ-CG 3.7Å; I605-L682 HydrophobicContact CG2-CD2 3.83Å; L682-L693 HydrophobicContact CB-CD2 4.09Å
683	C	76.9	Confident	72.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	160.4	178	57.4	0	0	0	0	109.6	G606 P694 C696 L713	G606-C683 CarbonylContact C-O 3.58Å; G606-C683 WeakPolarHBondContact CA-O 3.44Å; G606-C683 PolarHBondContact N-O 3.18Å; G606-C683 PolarHBondContact O-N 2.87Å; G606-C683 VanDerWaalsContact O-N 3.1Å; C683-P694 CarbonylContact C-O 3.54Å; C683-P694 WeakPolarHBondContact CA-O 3.5Å; C683-P694 WeakPolarHBondContact CB-O 3.47Å; C683-C696 HydrophobicContact CB-CB 3.85Å; C683-C696 WeakPolarHBondContact CB-SG 3.07Å; C683-C696 WeakPolarHBondContact SG-CA 3.37Å; C683-C696 WeakPolarHBondContact SG-CB 3.25Å; C683-C696 CovalentContact SG-SG 2.03Å; C683-C696 PolarHBondContact SG-SG 2.9Å; C683-L713 HydrophobicContact CB-CD2 4.13Å
684	S	77	Confident	71.7	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.035	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.3	175.4	-169.9	0	0	0	0	111.1	D604 N686 P694 Q695 C696	D604-S684 WeakPolarHBondContact O-CA 3.32Å; D604-S684 PolarHBondContact O-OG 3.34Å; S684-N686 PolarHBondContact OG-N 2.81Å; S684-N686 PolarHBondContact OG-O 3.29Å; S684-N686 VanDerWaalsContact OG-O 3.12Å; S684-P694 PolarHBondContact N-O 3.28Å; S684-Q695 WeakPolarHBondContact O-CA 3.32Å; S684-C696 PolarHBondContact O-N 2.94Å
685	E	67.3	Low	70.9	Confident	91 Å²	91	64.7 Å²	64.7	43%	0.425	31%	0.307	S	S	.	.	S	Bend	trans	-81.2	-20.4	173	-82.7	180	160.4	0	0	112.3	D604 K656	D604-E685 PolarHBondContact O-N 2.88Å; D604-E685 VanDerWaalsContact O-N 3.11Å; K656-E685 IonicContact NZ-OE2 3.33Å; K656-E685 PolarHBondContact NZ-OE2 3.47Å
686	N	64.1	Low	70	Confident	79 Å²	79	64.5 Å²	64.5	42%	0.422	31%	0.31	S	S	.	.	S	Bend	trans	-128.3	118.6	-174.3	-166.1	-4.7	0	0	0	111.9	S684 Q688	S684-N686 PolarHBondContact OG-N 2.81Å; S684-N686 PolarHBondContact OG-O 3.29Å; S684-N686 VanDerWaalsContact OG-O 3.12Å; N686-Q688 PolarHBondContact O-N 2.85Å
687	S	52.3	Low	68.9	Low	90 Å²	90	65.5 Å²	65.5	63%	0.629	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.8	-167.4	52.9	0	0	0	0	115.9
688	Q	50.8	Low	67.5	Low	174 Å²	174	71 Å²	71	81%	0.813	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-2.6	-166.7	-66.2	-161.6	-11.6	0	0	117	N686	N686-Q688 PolarHBondContact O-N 2.85Å
689	R	46.4	Very low	65.9	Low	202 Å²	202	72.2 Å²	72.2	76%	0.762	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	-14.5	-174	-94.2	-173.6	-170.4	-174	2.6	118.2
690	Y	52	Low	64.2	Low	76 Å²	76	78.2 Å²	78.2	30%	0.298	37%	0.373	S	S	.	.			trans	-130.7	99.1	179.1	-82.5	-86	0	0	0	110.6	N602 D604 E692	N602-Y690 WeakPolarHBondContact ND2-CE2 2.91Å; N602-Y690 PolarHBondContact ND2-OH 2.62Å; D604-Y690 HydrophobicContact CB-CD2 4.45Å; Y690-E692 PolarHBondContact O-N 3.36Å
691	Q	49.9	Very low	62.7	Low	211 Å²	211	83.1 Å²	83.1	99%	0.986	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.9	177.4	-88.7	167.3	-37.3	0	0	114.1
692	E	55.8	Low	61.8	Low	166 Å²	166	86.3 Å²	86.3	78%	0.776	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-10	-176.5	-67.8	-175.5	167.8	0	0	114.7	Y690	Y690-E692 PolarHBondContact O-N 3.36Å
693	L	60.5	Low	60.3	Low	25 Å²	25	91 Å²	91	13%	0.131	46%	0.455	C	S	.	.	S	Bend	trans	-124.4	134.7	-178.1	-73.4	170.3	0	0	0	112	V560 I605 L682	V560-L693 HydrophobicContact CG1-CD2 4.43Å; V560-L693 HydrophobicContact CG2-CD1 4.41Å; I605-L693 HydrophobicContact CG1-CD1 4.48Å; I605-L693 HydrophobicContact CG2-CD1 4.46Å; L682-L693 HydrophobicContact CB-CD2 4.09Å
694	P	66.8	Low	59	Low	24 Å²	24	95.5 Å²	95.5	16%	0.156	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-68.7	154.2	178.2	29.8	-36.8	0	0	0	112	C683 S684 V712 L713	C683-P694 CarbonylContact C-O 3.54Å; C683-P694 WeakPolarHBondContact CA-O 3.5Å; C683-P694 WeakPolarHBondContact CB-O 3.47Å; S684-P694 PolarHBondContact N-O 3.28Å; P694-V712 HydrophobicContact CB-CG1 4.36Å; P694-V712 HydrophobicContact CG-CG1 3.94Å; P694-L713 HydrophobicContact CB-CD2 4.31Å; P694-L713 HydrophobicContact CB-CG 4.27Å; P694-L713 HydrophobicContact CG-CD2 3.39Å; P694-L713 HydrophobicContact CG-CG 3.67Å
695	Q	70.9	Confident	58	Low	132 Å²	132	98 Å²	98	62%	0.617	50%	0.499	S	S	*	.	B	Isolated β-bridge	trans	-66.9	140.2	179.5	-168.3	171.7	3.4	0	0	111.5	S684 P697	S684-Q695 WeakPolarHBondContact O-CA 3.32Å; Q695-P697 WeakPolarHBondContact O-CD 3.34Å
696	C	70.4	Confident	57.6	Low	31 Å²	31	97.9 Å²	97.9	21%	0.209	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-64.2	122.2	179	-66.7	0	0	0	0	111.1	C683 S684	C683-C696 HydrophobicContact CB-CB 3.85Å; C683-C696 WeakPolarHBondContact CB-SG 3.07Å; C683-C696 WeakPolarHBondContact SG-CA 3.37Å; C683-C696 WeakPolarHBondContact SG-CB 3.25Å; C683-C696 CovalentContact SG-SG 2.03Å; C683-C696 PolarHBondContact SG-SG 2.9Å; S684-C696 PolarHBondContact O-N 2.94Å
697	P	66	Low	57.3	Low	20 Å²	20	96.5 Å²	96.5	13%	0.13	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-72.8	145.1	179.4	29.4	-34	0	0	0	111.7	F632 Q695 L699 L705 L713	F632-P697 HydrophobicContact CD1-CG 4.21Å; Q695-P697 WeakPolarHBondContact O-CD 3.34Å; P697-L699 PolarHBondContact O-N 2.86Å; P697-L705 HydrophobicContact CB-CD1 3.46Å; P697-L705 VanDerWaalsContact CB-CD1 3.46Å; P697-L705 HydrophobicContact CG-CD1 4.32Å; P697-L713 HydrophobicContact CG-CD1 4.19Å
698	D	61.8	Low	57.5	Low	116 Å²	116	99.7 Å²	99.7	62%	0.62	51%	0.514	S	S	*	.			trans	-80.3	113.3	174.3	-165.5	-8.9	0	0	0	109.8	R700 N701	D698-R700 PolarHBondContact O-N 2.85Å; D698-N701 PolarHBondContact O-N 2.95Å
699	L	55.5	Low	58.1	Low	27 Å²	27	94.2 Å²	94.2	14%	0.141	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-1.4	-172.9	-70.4	155.9	0	0	0	113.9	F632 W641 K658 P697	F632-L699 VanDerWaalsContact O-CD2 3.27Å; F632-L699 WeakPolarHBondContact O-CD2 3.48Å; W641-L699 HydrophobicContact CE3-CD1 4.37Å; W641-L699 HydrophobicContact CH2-CD1 3.56Å; W641-L699 HydrophobicContact CH2-CD2 4.22Å; W641-L699 HydrophobicContact CH2-CG 4.44Å; W641-L699 HydrophobicContact CZ2-CB 4.29Å; W641-L699 HydrophobicContact CZ2-CD1 3.72Å; W641-L699 HydrophobicContact CZ2-CD2 3.86Å; W641-L699 HydrophobicContact CZ2-CG 4.17Å; W641-L699 HydrophobicContact CZ3-CD1 3.91Å; K658-L699 HydrophobicContact CD-CD1 4.03Å; K658-L699 VanDerWaalsContact NZ-CD1 3.33Å; P697-L699 PolarHBondContact O-N 2.86Å
700	R	53.3	Low	58.7	Low	156 Å²	156	87.2 Å²	87.2	59%	0.589	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-27.2	177.7	-73.2	-177.6	-178.4	-148.6	-11.9	114.4	Q643 D698	Q643-R700 VanDerWaalsContact OE1-CZ 3.22Å; D698-R700 PolarHBondContact O-N 2.85Å
701	N	55.6	Low	59	Low	105 Å²	105	90 Å²	90	56%	0.561	48%	0.483	S	S	*	.			trans	-115.7	84	-177.4	-79.7	3.1	0	0	0	110.2	D698 S703	D698-N701 PolarHBondContact O-N 2.95Å; N701-S703 PolarHBondContact O-N 3Å
702	C	62	Low	59.6	Low	68 Å²	68	83 Å²	83	46%	0.459	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	3.3	175.3	-83.3	0	0	0	0	115.1	C633	C633-C702 WeakPolarHBondContact CA-SG 3.2Å; C633-C702 HydrophobicContact CB-CB 4.18Å; C633-C702 WeakPolarHBondContact CB-SG 3.5Å; C633-C702 WeakPolarHBondContact SG-CB 3.3Å; C633-C702 CovalentContact SG-SG 2.03Å; C633-C702 PolarHBondContact SG-SG 2.9Å
703	S	51.6	Low	60	Low	113 Å²	113	75.2 Å²	75.2	79%	0.79	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-1.3	-174.8	49.6	0	0	0	0	114.9	N701	N701-S703 PolarHBondContact O-N 3Å
704	S	48.2	Very low	60.1	Low	94 Å²	94	77.5 Å²	77.5	66%	0.657	43%	0.429	S	S	*	.			trans	-118.9	12.7	-176.9	99.6	0	0	0	0	115.7	T706	S704-T706 PolarHBondContact O-N 3Å
705	L	57.1	Low	59.5	Low	57 Å²	57	79.5 Å²	79.5	30%	0.298	44%	0.444	S	S	.	.			trans	-80.2	111.9	-179.8	-129.8	78.3	0	0	0	110.6	F632 P697 M710	F632-L705 HydrophobicContact CD2-CD2 3.5Å; F632-L705 HydrophobicContact CE2-CD2 3.97Å; F632-L705 HydrophobicContact CG-CD2 4.19Å; P697-L705 HydrophobicContact CB-CD1 3.46Å; P697-L705 VanDerWaalsContact CB-CD1 3.46Å; P697-L705 HydrophobicContact CG-CD1 4.32Å; L705-M710 HydrophobicContact CD2-CB 4.11Å; L705-M710 HydrophobicContact CD2-CG 4.06Å
706	T	59.4	Low	59.2	Low	90 Å²	90	77.3 Å²	77.3	55%	0.552	44%	0.436	S	S	*	.			trans	-75.1	134.5	174.3	-33.5	0	0	0	0	109.3	S704 E708 T709 M710	S704-T706 PolarHBondContact O-N 3Å; T706-E708 PolarHBondContact O-N 3.24Å; T706-T709 PolarHBondContact O-N 2.81Å; T706-T709 PolarHBondContact O-OG1 2.03Å; T706-M710 PolarHBondContact O-N 3.45Å
707	G	57.4	Low	59.4	Low	49 Å²	49	80.3 Å²	80.3	51%	0.505	45%	0.446	S	S	.	.	H	α-helix	trans	-52.5	-30.5	-174.7	0	0	0	0	0	114.8	M710 F711	G707-M710 WeakPolarHBondContact O-CB 3.28Å; G707-M710 PolarHBondContact O-N 3.39Å; G707-F711 WeakPolarHBondContact O-CB 3.09Å; G707-F711 PolarHBondContact O-N 3.2Å
708	E	56.2	Low	60.2	Low	158 Å²	158	83.6 Å²	83.6	74%	0.738	46%	0.455	S	S	*	.	H	α-helix	trans	-65.1	-45.2	175.6	-65.3	-178.9	166.8	0	0	112.9	T706 M710 F711 V712	T706-E708 PolarHBondContact O-N 3.24Å; E708-M710 VanDerWaalsContact C-N 3.32Å; E708-M710 PolarHBondContact O-N 2.91Å; E708-F711 PolarHBondContact O-N 3.04Å; E708-V712 WeakPolarHBondContact O-CG2 3.12Å; E708-V712 PolarHBondContact O-N 2.94Å; E708-V712 VanDerWaalsContact O-N 3.13Å
709	T	62.3	Low	61.2	Low	59 Å²	59	80.9 Å²	80.9	36%	0.362	45%	0.446	S	S	.	.	H	α-helix	trans	-66.4	-35.9	177.1	58.2	0	0	0	0	112.2	T706 L713	T706-T709 PolarHBondContact O-N 2.81Å; T706-T709 PolarHBondContact O-OG1 2.03Å; T709-L713 WeakPolarHBondContact O-CB 3.49Å; T709-L713 WeakPolarHBondContact O-CG 3.03Å; T709-L713 PolarHBondContact O-N 3.08Å; T709-L713 VanDerWaalsContact O-N 3.09Å
710	M	60.1	Low	62.6	Low	55 Å²	55	81.7 Å²	81.7	27%	0.271	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-44.8	175.6	-165	177.7	76.5	0	0	111.1	T631 F632 L705 T706 G707 E708 L713 M714	T631-M710 HydrophobicContact CG2-CE 4.41Å; T631-M710 HydrophobicContact CG2-CG 4.03Å; T631-M710 HydrophobicContact CG2-SD 3.22Å; T631-M710 WeakPolarHBondContact CG2-SD 3.3Å; F632-M710 HydrophobicContact CD2-CG 4.43Å; F632-M710 HydrophobicContact CE2-CG 3.89Å; L705-M710 HydrophobicContact CD2-CB 4.11Å; L705-M710 HydrophobicContact CD2-CG 4.06Å; T706-M710 PolarHBondContact O-N 3.45Å; G707-M710 WeakPolarHBondContact O-CB 3.28Å; G707-M710 PolarHBondContact O-N 3.39Å; E708-M710 VanDerWaalsContact C-N 3.32Å; E708-M710 PolarHBondContact O-N 2.91Å; M710-L713 PolarHBondContact O-N 2.95Å; M710-M714 HydrophobicContact CE-CE 4.17Å; M710-M714 HydrophobicContact CG-CE 4.19Å; M710-M714 WeakPolarHBondContact O-CB 3.45Å; M710-M714 VanDerWaalsContact O-CG 3.29Å; M710-M714 WeakPolarHBondContact O-CG 3.32Å; M710-M714 PolarHBondContact O-N 3Å
711	F	57.7	Low	64.2	Low	133 Å²	133	76.5 Å²	76.5	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-64.6	-41.6	179.5	-171.2	-96.5	0	0	0	112.4	G707 E708 M714 S715	G707-F711 WeakPolarHBondContact O-CB 3.09Å; G707-F711 PolarHBondContact O-N 3.2Å; E708-F711 PolarHBondContact O-N 3.04Å; F711-M714 PolarHBondContact O-N 2.84Å; F711-S715 WeakPolarHBondContact O-CB 3.12Å; F711-S715 PolarHBondContact O-N 3.02Å; F711-S715 PolarHBondContact O-OG 3.08Å
712	V	62.1	Low	65.7	Low	65 Å²	65	75.4 Å²	75.4	39%	0.394	43%	0.426	S	S	.	.	H	α-helix	trans	-65.8	-43.3	177.2	176.2	0	0	0	0	111.6	P694 E708 S715	P694-V712 HydrophobicContact CB-CG1 4.36Å; P694-V712 HydrophobicContact CG-CG1 3.94Å; E708-V712 WeakPolarHBondContact O-CG2 3.12Å; E708-V712 PolarHBondContact O-N 2.94Å; E708-V712 VanDerWaalsContact O-N 3.13Å; V712-S715 PolarHBondContact O-N 3.49Å
713	L	65.9	Low	66.8	Low	3 Å²	3	74.1 Å²	74.1	2%	0.016	42%	0.417	C	S	.	.	H	α-helix	trans	-67.3	-35.4	177.6	-74.6	167.3	0	0	0	112.5	T608 F632 S681 C683 P694 P697 T709 M710	T608-L713 HydrophobicContact CG2-CD2 4.09Å; F632-L713 HydrophobicContact CE1-CB 4.15Å; F632-L713 HydrophobicContact CE1-CD1 3.95Å; F632-L713 HydrophobicContact CZ-CB 3.57Å; F632-L713 HydrophobicContact CZ-CD1 3.85Å; F632-L713 HydrophobicContact CZ-CG 4.33Å; S681-L713 VanDerWaalsContact CB-O 3.26Å; S681-L713 WeakPolarHBondContact CB-O 3.36Å; S681-L713 WeakPolarHBondContact OG-CD2 3.39Å; C683-L713 HydrophobicContact CB-CD2 4.13Å; P694-L713 HydrophobicContact CB-CD2 4.31Å; P694-L713 HydrophobicContact CB-CG 4.27Å; P694-L713 HydrophobicContact CG-CD2 3.39Å; P694-L713 HydrophobicContact CG-CG 3.67Å; P697-L713 HydrophobicContact CG-CD1 4.19Å; T709-L713 WeakPolarHBondContact O-CB 3.49Å; T709-L713 WeakPolarHBondContact O-CG 3.03Å; T709-L713 PolarHBondContact O-N 3.08Å; T709-L713 VanDerWaalsContact O-N 3.09Å; M710-L713 PolarHBondContact O-N 2.95Å
714	M	61.4	Low	68.5	Low	72 Å²	72	68.8 Å²	68.8	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-74.8	-25.3	176.4	-71.9	-159.3	-60.1	0	0	113.3	M710 F711 N716 K717	M710-M714 HydrophobicContact CE-CE 4.17Å; M710-M714 HydrophobicContact CG-CE 4.19Å; M710-M714 WeakPolarHBondContact O-CB 3.45Å; M710-M714 VanDerWaalsContact O-CG 3.29Å; M710-M714 WeakPolarHBondContact O-CG 3.32Å; M710-M714 PolarHBondContact O-N 3Å; F711-M714 PolarHBondContact O-N 2.84Å; M714-N716 VanDerWaalsContact C-N 3.35Å; M714-K717 WeakPolarHBondContact O-CD 3.17Å; M714-K717 VanDerWaalsContact O-CG 3.26Å; M714-K717 WeakPolarHBondContact O-CG 3.26Å
715	S	55.3	Low	70.2	Confident	67 Å²	67	65.3 Å²	65.3	47%	0.469	36%	0.357	S	S	.	.	H	α-helix	trans	-72.4	-27.4	178.8	-62.6	0	0	0	0	113.1	F711 V712	F711-S715 WeakPolarHBondContact O-CB 3.12Å; F711-S715 PolarHBondContact O-N 3.02Å; F711-S715 PolarHBondContact O-OG 3.08Å; V712-S715 PolarHBondContact O-N 3.49Å
716	N	63.8	Low	71.5	Confident	86 Å²	86	63.6 Å²	63.6	46%	0.46	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	32	177.8	-75.2	-45.1	0	0	0	112.9	M714	M714-N716 VanDerWaalsContact C-N 3.35Å
717	K	75.4	Confident	72.6	Confident	94 Å²	94	62.3 Å²	62.3	41%	0.409	34%	0.34	S	S	.	.			trans	-77.2	146	-178.5	72.4	-178	-177.7	161.8	0	112.7	E679 M680 M714	E679-K717 VanDerWaalsContact CD-NZ 3.27Å; E679-K717 WeakPolarHBondContact OE1-CE 3.18Å; E679-K717 IonicContact OE1-NZ 2.83Å; E679-K717 PolarHBondContact OE1-NZ 3.45Å; E679-K717 IonicContact OE2-NZ 3.83Å; E679-K717 PolarHBondContact OE2-NZ 3.2Å; M680-K717 CarbonylContact O-C 3.57Å; M680-K717 VanDerWaalsContact O-CA 3.31Å; M680-K717 WeakPolarHBondContact O-CA 3.31Å; M714-K717 WeakPolarHBondContact O-CD 3.17Å; M714-K717 VanDerWaalsContact O-CG 3.26Å; M714-K717 WeakPolarHBondContact O-CG 3.26Å
718	R	81.3	Confident	73.1	Confident	88 Å²	88	65.9 Å²	65.9	33%	0.332	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.9	170.3	-53.3	-164	-168.6	173.2	1.6	110.4	I563 F565 E679 M680	I563-R718 PolarHBondContact O-NH1 2.9Å; F565-R718 HydrophobicContact CD2-CB 4.4Å; F565-R718 HydrophobicContact CE2-CG 4.37Å; E679-R718 CarbonylContact C-O 3.51Å; E679-R718 WeakPolarHBondContact CA-O 3.5Å; M680-R718 PolarHBondContact N-O 3.5Å; M680-R718 PolarHBondContact O-N 2.92Å; M680-R718 HydrophobicContact SD-CB 3.85Å; M680-R718 HydrophobicContact SD-CG 4.42Å
719	S	83.1	Confident	73	Confident	60 Å²	60	64.8 Å²	64.8	42%	0.42	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.7	-178.6	58.7	0	0	0	0	111.8	C678	C678-S719 CarbonylContact O-C 3.56Å; C678-S719 WeakPolarHBondContact O-CA 3.22Å
720	L	85.2	Confident	72.2	Confident	43 Å²	43	66.4 Å²	66.4	23%	0.225	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	147	167.5	-68.2	-179.8	0	0	0	109.7	F565 M567 H677 C678	F565-L720 HydrophobicContact CB-CD1 3.72Å; F565-L720 HydrophobicContact CB-CG 4.41Å; M567-L720 HydrophobicContact CB-CB 4.39Å; M567-L720 HydrophobicContact CB-CD1 3.81Å; M567-L720 HydrophobicContact CE-CB 3.86Å; H677-L720 WeakPolarHBondContact CA-O 2.86Å; C678-L720 PolarHBondContact N-O 3.18Å; C678-L720 PolarHBondContact O-N 3.3Å
721	T	87.3	Confident	71.1	Confident	48 Å²	48	73.1 Å²	73.1	29%	0.294	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.3	-179.8	-59.2	0	0	0	0	110.9	F675 L676 H677	F675-T721 HydrophobicContact CB-CG2 3.94Å; F675-T721 HydrophobicContact CD1-CG2 4.08Å; F675-T721 HydrophobicContact CG-CG2 4.43Å; L676-T721 CarbonylContact O-C 3.51Å; L676-T721 VanDerWaalsContact O-CA 3.28Å; L676-T721 WeakPolarHBondContact O-CA 3.29Å; H677-T721 WeakPolarHBondContact CE1-CG2 3.43Å; H677-T721 VanDerWaalsContact ND1-CG2 3.28Å; H677-T721 WeakPolarHBondContact ND1-CG2 3.25Å; H677-T721 PolarHBondContact ND1-OG1 3.42Å
722	K	86.4	Confident	70.1	Confident	81 Å²	81	72.6 Å²	72.6	35%	0.352	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132	176.8	-79.1	-68.2	-167.2	175	0	112	M567 L569 F675 L676	M567-K722 HydrophobicContact CB-CG 4.35Å; M567-K722 HydrophobicContact CG-CG 4.02Å; M567-K722 WeakPolarHBondContact O-CE 3.4Å; M567-K722 PolarHBondContact O-NZ 3.25Å; M567-K722 HydrophobicContact SD-CB 4.01Å; M567-K722 HydrophobicContact SD-CG 3.57Å; M567-K722 VanDerWaalsContact SD-CG 3.57Å; L569-K722 HydrophobicContact CD1-CB 3.91Å; F675-K722 WeakPolarHBondContact CA-O 3.28Å; L676-K722 PolarHBondContact N-O 2.73Å; L676-K722 PolarHBondContact O-N 3.5Å
723	P	86.2	Confident	68.8	Low	42 Å²	42	78.4 Å²	78.4	27%	0.273	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	141.1	175.6	31.2	-33.8	0	0	0	111.9	L673 F675	L673-P723 HydrophobicContact CD1-CB 4.36Å; F675-P723 HydrophobicContact CD1-CB 4Å; F675-P723 HydrophobicContact CE1-CB 3.87Å
724	I	87.3	Confident	67.5	Low	1 Å²	1	85.7 Å²	85.7	1%	0.005	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.7	179.5	-61.3	173.9	0	0	0	108.3	L569 F584 V586 V674 L676	L569-I724 HydrophobicContact CD1-CD1 4.06Å; L569-I724 HydrophobicContact CD1-CG1 3.81Å; F584-I724 HydrophobicContact CD1-CG1 4.35Å; F584-I724 HydrophobicContact CD1-CG2 4.27Å; F584-I724 CarbonylContact O-C 3.54Å; F584-I724 VanDerWaalsContact O-CA 3.3Å; F584-I724 WeakPolarHBondContact O-CA 3.46Å; V586-I724 HydrophobicContact CB-CG2 3.82Å; V586-I724 HydrophobicContact CG1-CG2 3.27Å; V674-I724 HydrophobicContact CG2-CB 3.86Å; V674-I724 HydrophobicContact CG2-CG2 4.08Å; V674-I724 PolarHBondContact N-O 2.91Å; V674-I724 PolarHBondContact O-N 3.27Å; V674-I724 VanDerWaalsContact O-O 3.07Å; L676-I724 HydrophobicContact CB-CD1 3.82Å
725	A	83.9	Confident	65.9	Low	21 Å²	21	93 Å²	93	17%	0.174	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.8	175.4	0	0	0	0	0	110.4	I583 F584 K585 V586 T672 L673	I583-A725 HydrophobicContact CG2-CB 3.8Å; F584-A725 PolarHBondContact O-N 3.46Å; K585-A725 CarbonylContact C-O 3.58Å; K585-A725 VanDerWaalsContact CA-O 3.31Å; K585-A725 WeakPolarHBondContact CA-O 3.43Å; K585-A725 HydrophobicContact CG-CB 4.29Å; V586-A725 PolarHBondContact N-O 3.13Å; T672-A725 CarbonylContact O-C 3.39Å; T672-A725 WeakPolarHBondContact O-CA 3.05Å; L673-A725 HydrophobicContact CD1-CB 4.46Å
726	V	84.6	Confident	64.9	Low	20 Å²	20	94.9 Å²	94.9	12%	0.121	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.3	178.8	-173.3	0	0	0	0	109.2	V586 F664 T672 V674	V586-V726 HydrophobicContact CG1-CG2 4.27Å; V586-V726 CarbonylContact O-C 3.54Å; V586-V726 WeakPolarHBondContact O-CA 3.21Å; F664-V726 HydrophobicContact CE1-CG1 3.97Å; F664-V726 HydrophobicContact CE1-CG2 3.83Å; F664-V726 HydrophobicContact CZ-CG2 3.6Å; T672-V726 PolarHBondContact O-N 3.47Å; V674-V726 HydrophobicContact CG1-CG2 4.27Å; V674-V726 HydrophobicContact CG2-CG2 4.07Å
727	V	82.6	Confident	63.5	Low	63 Å²	63	97.1 Å²	97.1	38%	0.382	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.3	178.2	-174.2	0	0	0	0	109	K585 V586 S587 N729	K585-V727 HydrophobicContact CB-CG2 4.12Å; K585-V727 HydrophobicContact CD-CG2 4.26Å; K585-V727 HydrophobicContact CG-CG2 4.39Å; V586-V727 PolarHBondContact O-N 3.35Å; S587-V727 WeakPolarHBondContact CA-O 3.11Å; V727-N729 PolarHBondContact O-N 2.88Å
728	D	67.7	Low	61.3	Low	124 Å²	124	102.6 Å²	102.6	66%	0.663	55%	0.545	S	S	*	.			trans	-75	120.2	175.8	-71.3	-34	0	0	0	110.3	S730	D728-S730 PolarHBondContact O-N 2.8Å
729	N	54.5	Low	59.2	Low	135 Å²	135	107.4 Å²	107.4	72%	0.722	57%	0.568	S	S	*	*			trans	-81.9	48.3	174.3	-94.8	-2.3	0	0	0	111.4	V727	V727-N729 PolarHBondContact O-N 2.88Å
730	S	45.2	Very low	56.7	Low	94 Å²	94	111.6 Å²	111.6	66%	0.657	58%	0.581	S	S	*	*			trans	-110.1	77.2	168.2	63	0	0	0	0	109.6	D728	D728-S730 PolarHBondContact O-N 2.8Å
731	E	36	Very low	54.7	Low	196 Å²	196	117.5 Å²	117.5	92%	0.916	61%	0.607	S	S	*	*			trans	173.5	98.7	141	-98.1	173.1	-173.1	0	0	110.4
732	S	37.2	Very low	52	Low	122 Å²	122	124.6 Å²	124.6	85%	0.853	64%	0.637	S	S	*	*			trans	-130.1	80.9	155	61	0	0	0	0	108.1
733	Q	34	Very low	49.5	Very low	187 Å²	187	125.9 Å²	125.9	87%	0.874	66%	0.663	S	S	*	*			trans	-148.5	97.3	157.7	-106.3	178.8	7.2	0	0	109.6	Y735	Q733-Y735 PolarHBondContact O-N 2.88Å
734	D	38.8	Very low	47	Very low	156 Å²	156	130.7 Å²	130.7	83%	0.834	68%	0.682	S	S	*	*			trans	4.9	103.4	146.7	-154.6	15	0	0	0	117.4
735	Y	28.7	Very low	44.3	Very low	224 Å²	224	140 Å²	140	88%	0.878	73%	0.727	S	S	*	*			trans	-162.1	149	146.7	-87.6	-65.7	0	0	0	110.5	Q733	Q733-Y735 PolarHBondContact O-N 2.88Å
736	P	34.2	Very low	42.2	Very low	108 Å²	108	146 Å²	146	70%	0.701	75%	0.75	S	S	*	*			trans	-81.4	159.9	-161.4	34.4	-35.8	0	0	0	113.7
737	P	33.3	Very low	40	Very low	132 Å²	132	153.4 Å²	153.4	86%	0.857	79%	0.788	S	S	*	*			trans	-81	128.8	-163.1	32.2	-32.9	0	0	0	112.2
738	K	30.7	Very low	38.6	Very low	210 Å²	210	154.3 Å²	154.3	91%	0.913	79%	0.79	S	S	*	*			trans	-122.5	133.2	156.7	-84.4	-172.7	178.1	178.5	0	110.4
739	K	35.4	Very low	37.9	Very low	188 Å²	188	153.1 Å²	153.1	82%	0.817	78%	0.784	S	S	*	*			trans	-63.8	145	-176.5	-66	173	171	-178.5	0	113.8
740	H	32.5	Very low	38.5	Very low	149 Å²	149	151.9 Å²	151.9	69%	0.69	78%	0.781	S	S	*	*				150.1	104.2	123.4	-90.4	-81.3	0	0	0	107.8
741	E	41.4	Very low	39.7	Very low	166 Å²	166	151.3 Å²	151.3	78%	0.776	77%	0.774	S	S	*	*				92.6	103.4	90	-113.6	179.8	170.6	0	0	111
742	E	31.2	Very low	41.3	Very low	197 Å²	197	145 Å²	145	92%	0.921	75%	0.749	S	S	*	*			trans	-156.1	143.5	147.2	-108.8	172.2	-156.6	0	0	109.2	E744	E742-E744 PolarHBondContact O-N 3.24Å
743	A	34.6	Very low	43.3	Very low	108 Å²	108	142.9 Å²	142.9	89%	0.893	73%	0.731	S	S	*	*			trans	-75.2	112.6	-147.6	0	0	0	0	0	115.3
744	E	32.5	Very low	45.5	Very low	143 Å²	143	138.8 Å²	138.8	67%	0.668	72%	0.718	S	S	*	*			trans	-80	128.6	159.1	-74.9	-174.9	146.7	0	0	110.2	E742 F746	E742-E744 PolarHBondContact O-N 3.24Å; E744-F746 VanDerWaalsContact C-N 3.28Å; E744-F746 HydrophobicContact CB-CD2 3.95Å; E744-F746 HydrophobicContact CB-CE2 3.7Å; E744-F746 HydrophobicContact CB-CZ 4.29Å; E744-F746 WeakPolarHBondContact O-CD2 3.34Å; E744-F746 PolarHBondContact O-N 3Å; E744-F746 WeakPolarHBondContact OE2-CE2 3.45Å; E744-F746 WeakPolarHBondContact OE2-CZ 3.41Å
745	M	30.8	Very low	47.3	Very low	196 Å²	196	136.7 Å²	136.7	97%	0.966	71%	0.706	S	S	*	*			trans	-73.1	86.1	167.1	-163	-179.7	-70.7	0	0	108.2	L747	M745-L747 PolarHBondContact O-N 3.44Å
746	F	39.4	Very low	50.2	Low	148 Å²	148	130.6 Å²	130.6	65%	0.649	69%	0.688	S	S	*	*			trans	-66.3	112.3	175.7	-80.4	-85.8	0	0	0	110.5	E744 L748	E744-F746 VanDerWaalsContact C-N 3.28Å; E744-F746 HydrophobicContact CB-CD2 3.95Å; E744-F746 HydrophobicContact CB-CE2 3.7Å; E744-F746 HydrophobicContact CB-CZ 4.29Å; E744-F746 WeakPolarHBondContact O-CD2 3.34Å; E744-F746 PolarHBondContact O-N 3Å; E744-F746 WeakPolarHBondContact OE2-CE2 3.45Å; E744-F746 WeakPolarHBondContact OE2-CZ 3.41Å; F746-L748 VanDerWaalsContact C-N 3.3Å; F746-L748 HydrophobicContact CB-CD1 4.08Å; F746-L748 PolarHBondContact O-N 2.91Å
747	L	39.2	Very low	52.7	Low	176 Å²	176	128.3 Å²	128.3	92%	0.921	68%	0.678	S	S	*	*			trans	-70.6	92.6	156.7	-166.6	86.2	0	0	0	106.9	M745 D749	M745-L747 PolarHBondContact O-N 3.44Å; L747-D749 PolarHBondContact O-N 3.3Å
748	L	53.4	Low	55.4	Low	82 Å²	82	128.7 Å²	128.7	43%	0.429	67%	0.667	S	S	.	*			trans	-61.5	126	176.5	-88	93.2	0	0	0	109.6	F746 T752 V753 I756	F746-L748 VanDerWaalsContact C-N 3.3Å; F746-L748 HydrophobicContact CB-CD1 4.08Å; F746-L748 PolarHBondContact O-N 2.91Å; L748-T752 HydrophobicContact CD2-CG2 3.6Å; L748-V753 HydrophobicContact CB-CG2 3.73Å; L748-I756 HydrophobicContact CD2-CD1 3.53Å
749	D	52.9	Low	58.3	Low	98 Å²	98	121 Å²	121	52%	0.524	64%	0.642	S	S	.	*			trans	-54.4	142.8	172.2	-173.6	29.5	0	0	0	110.1	L747 T751 T752 V753	L747-D749 PolarHBondContact O-N 3.3Å; D749-T751 PolarHBondContact O-N 3.35Å; D749-T751 PolarHBondContact OD2-OG1 3.44Å; D749-T752 PolarHBondContact O-N 3.33Å; D749-V753 PolarHBondContact O-N 2.89Å
750	T	68	Low	60.9	Low	109 Å²	109	114.9 Å²	114.9	67%	0.669	63%	0.627	S	S	*	*	H	α-helix	trans	-51.2	-33.9	-177.4	47.5	0	0	0	0	112.3	T752 V753 V754	T750-T752 PolarHBondContact O-N 3.34Å; T750-V753 PolarHBondContact O-N 2.78Å; T750-V754 VanDerWaalsContact O-CG2 3.28Å; T750-V754 WeakPolarHBondContact O-CG2 3.4Å; T750-V754 PolarHBondContact O-N 3.49Å; T750-V754 VanDerWaalsContact O-N 3.08Å
751	T	68.6	Low	63.8	Low	83 Å²	83	114.5 Å²	114.5	51%	0.509	62%	0.623	S	S	.	*	H	α-helix	trans	-59.5	-44.1	174.6	-36.9	0	0	0	0	112.8	D749 V754 L755	D749-T751 PolarHBondContact O-N 3.35Å; D749-T751 PolarHBondContact OD2-OG1 3.44Å; T751-V754 PolarHBondContact O-N 3.49Å; T751-L755 PolarHBondContact O-N 3.3Å; T751-L755 VanDerWaalsContact O-N 3.09Å
752	T	71.1	Confident	66.2	Low	62 Å²	62	109.3 Å²	109.3	38%	0.38	60%	0.603	S	S	.	*	H	α-helix	trans	-73.9	-36.4	-177.9	-45.4	0	0	0	0	111.3	L748 D749 T750 L755 I756	L748-T752 HydrophobicContact CD2-CG2 3.6Å; D749-T752 PolarHBondContact O-N 3.33Å; T750-T752 PolarHBondContact O-N 3.34Å; T752-L755 PolarHBondContact O-N 2.96Å; T752-I756 HydrophobicContact CG2-CD1 4.24Å; T752-I756 VanDerWaalsContact O-CG1 3.31Å; T752-I756 WeakPolarHBondContact O-CG1 3.31Å; T752-I756 PolarHBondContact O-N 3.09Å
753	V	78.4	Confident	69.2	Low	78 Å²	78	104.7 Å²	104.7	47%	0.473	58%	0.584	S	S	.	*	H	α-helix	trans	-63.7	-42.4	174.9	-179.6	0	0	0	0	111	L748 D749 T750 L755 I756 A757	L748-V753 HydrophobicContact CB-CG2 3.73Å; D749-V753 PolarHBondContact O-N 2.89Å; T750-V753 PolarHBondContact O-N 2.78Å; V753-L755 VanDerWaalsContact C-N 3.34Å; V753-L755 PolarHBondContact O-N 3.49Å; V753-I756 PolarHBondContact O-N 2.84Å; V753-A757 WeakPolarHBondContact O-CB 3.25Å; V753-A757 PolarHBondContact O-N 2.93Å
754	V	81.4	Confident	71.9	Confident	102 Å²	102	101 Å²	101	62%	0.618	56%	0.556	S	S	*	*	H	α-helix	trans	-63.5	-40.6	175.9	172.1	0	0	0	0	111.2	T750 T751 A757 F758	T750-V754 VanDerWaalsContact O-CG2 3.28Å; T750-V754 WeakPolarHBondContact O-CG2 3.4Å; T750-V754 PolarHBondContact O-N 3.49Å; T750-V754 VanDerWaalsContact O-N 3.08Å; T751-V754 PolarHBondContact O-N 3.49Å; V754-A757 PolarHBondContact O-N 3.42Å; V754-F758 WeakPolarHBondContact O-CB 3.34Å; V754-F758 PolarHBondContact O-N 2.94Å
755	L	76.5	Confident	74.8	Confident	111 Å²	111	98.1 Å²	98.1	58%	0.581	55%	0.548	S	S	*	.	H	α-helix	trans	-62.7	-43.1	175.6	-94.3	153.5	0	0	0	112.7	T751 T752 V753 F758 A759	T751-L755 PolarHBondContact O-N 3.3Å; T751-L755 VanDerWaalsContact O-N 3.09Å; T752-L755 PolarHBondContact O-N 2.96Å; V753-L755 VanDerWaalsContact C-N 3.34Å; V753-L755 PolarHBondContact O-N 3.49Å; L755-F758 PolarHBondContact O-N 3.3Å; L755-A759 WeakPolarHBondContact O-CB 3.44Å; L755-A759 PolarHBondContact O-N 2.54Å
756	I	88.3	Confident	77.7	Confident	97 Å²	97	94.6 Å²	94.6	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-66.8	-43.8	177.5	-66.8	166	0	0	0	110.7	L748 T752 V753 F758 A759 A760	L748-I756 HydrophobicContact CD2-CD1 3.53Å; T752-I756 HydrophobicContact CG2-CD1 4.24Å; T752-I756 VanDerWaalsContact O-CG1 3.31Å; T752-I756 WeakPolarHBondContact O-CG1 3.31Å; T752-I756 PolarHBondContact O-N 3.09Å; V753-I756 PolarHBondContact O-N 2.84Å; I756-F758 VanDerWaalsContact C-N 3.31Å; I756-F758 PolarHBondContact O-N 2.95Å; I756-A759 PolarHBondContact O-N 2.92Å; I756-A760 WeakPolarHBondContact O-CB 3.45Å; I756-A760 PolarHBondContact O-N 3.43Å
757	A	86.8	Confident	80.2	Confident	59 Å²	59	92.5 Å²	92.5	49%	0.488	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-40.5	177	0	0	0	0	0	111.8	V753 V754 A760 F761	V753-A757 WeakPolarHBondContact O-CB 3.25Å; V753-A757 PolarHBondContact O-N 2.93Å; V754-A757 PolarHBondContact O-N 3.42Å; A757-A760 PolarHBondContact O-N 3.43Å; A757-F761 WeakPolarHBondContact O-CB 2.86Å; A757-F761 PolarHBondContact O-N 3.42Å
758	F	90.4	Very high	82.5	Confident	141 Å²	141	88.6 Å²	88.6	62%	0.618	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-44.1	176.2	-171	-99.1	0	0	0	112.1	V754 L755 I756 A760 F761 V762	V754-F758 WeakPolarHBondContact O-CB 3.34Å; V754-F758 PolarHBondContact O-N 2.94Å; L755-F758 PolarHBondContact O-N 3.3Å; I756-F758 VanDerWaalsContact C-N 3.31Å; I756-F758 PolarHBondContact O-N 2.95Å; F758-A760 PolarHBondContact O-N 2.83Å; F758-F761 PolarHBondContact O-N 2.93Å; F758-V762 HydrophobicContact CD1-CG2 4.21Å; F758-V762 HydrophobicContact CE1-CG2 3.89Å; F758-V762 HydrophobicContact CZ-CG2 4.2Å; F758-V762 WeakPolarHBondContact O-CG2 3.46Å; F758-V762 PolarHBondContact O-N 3.32Å
759	A	90.6	Very high	84.3	Confident	48 Å²	48	86.6 Å²	86.6	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-43.5	176.6	0	0	0	0	0	111.9	L755 I756 F761 V762 I763	L755-A759 WeakPolarHBondContact O-CB 3.44Å; L755-A759 PolarHBondContact O-N 2.54Å; I756-A759 PolarHBondContact O-N 2.92Å; A759-F761 VanDerWaalsContact C-N 3.34Å; A759-F761 PolarHBondContact O-N 3.5Å; A759-V762 PolarHBondContact O-N 3.47Å; A759-I763 VanDerWaalsContact O-CG1 3.29Å; A759-I763 WeakPolarHBondContact O-CG1 3.48Å; A759-I763 PolarHBondContact O-N 3.01Å
760	A	91.9	Very high	86	Confident	60 Å²	60	84.2 Å²	84.2	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-40.1	176.2	0	0	0	0	0	112.2	I756 A757 F758 I763 G764	I756-A760 WeakPolarHBondContact O-CB 3.45Å; I756-A760 PolarHBondContact O-N 3.43Å; A757-A760 PolarHBondContact O-N 3.43Å; F758-A760 PolarHBondContact O-N 2.83Å; A760-I763 PolarHBondContact O-N 3.26Å; A760-G764 PolarHBondContact O-N 3.46Å
761	F	92.1	Very high	86.8	Confident	140 Å²	140	84.7 Å²	84.7	61%	0.614	50%	0.502	S	S	*	.	H	α-helix	trans	-62.6	-45.4	175.4	-179.4	-100.3	0	0	0	112.1	A757 F758 A759 I763 G764 V765	A757-F761 WeakPolarHBondContact O-CB 2.86Å; A757-F761 PolarHBondContact O-N 3.42Å; F758-F761 PolarHBondContact O-N 2.93Å; A759-F761 VanDerWaalsContact C-N 3.34Å; A759-F761 PolarHBondContact O-N 3.5Å; F761-I763 VanDerWaalsContact C-N 3.35Å; F761-I763 PolarHBondContact O-N 2.65Å; F761-G764 PolarHBondContact O-N 3Å; F761-V765 HydrophobicContact CD1-CG2 4.35Å; F761-V765 HydrophobicContact CE1-CG2 3.95Å; F761-V765 HydrophobicContact CE2-CG2 4.48Å; F761-V765 HydrophobicContact CZ-CG2 4.02Å; F761-V765 WeakPolarHBondContact O-CG2 3.26Å; F761-V765 PolarHBondContact O-N 2.98Å
762	V	92.6	Very high	87.5	Confident	58 Å²	58	89.4 Å²	89.4	35%	0.352	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-42.2	177.8	173.7	0	0	0	0	111.2	F758 A759 G764 V765 L766	F758-V762 HydrophobicContact CD1-CG2 4.21Å; F758-V762 HydrophobicContact CE1-CG2 3.89Å; F758-V762 HydrophobicContact CZ-CG2 4.2Å; F758-V762 WeakPolarHBondContact O-CG2 3.46Å; F758-V762 PolarHBondContact O-N 3.32Å; A759-V762 PolarHBondContact O-N 3.47Å; V762-G764 VanDerWaalsContact C-N 3.33Å; V762-G764 PolarHBondContact O-N 3Å; V762-V765 PolarHBondContact O-N 3.48Å; V762-L766 HydrophobicContact CG1-CD1 4.09Å; V762-L766 HydrophobicContact CG1-CG 4.5Å; V762-L766 WeakPolarHBondContact O-CG 2.89Å; V762-L766 PolarHBondContact O-N 3.3Å
763	I	92.9	Very high	88.1	Confident	100 Å²	100	92.6 Å²	92.6	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-43	175.2	-67.2	165.2	0	0	0	110.6	A759 A760 F761 V765 L766 L767	A759-I763 VanDerWaalsContact O-CG1 3.29Å; A759-I763 WeakPolarHBondContact O-CG1 3.48Å; A759-I763 PolarHBondContact O-N 3.01Å; A760-I763 PolarHBondContact O-N 3.26Å; F761-I763 VanDerWaalsContact C-N 3.35Å; F761-I763 PolarHBondContact O-N 2.65Å; I763-V765 PolarHBondContact O-N 3.27Å; I763-L766 PolarHBondContact O-N 2.96Å; I763-L767 HydrophobicContact CG2-CD1 3.83Å; I763-L767 HydrophobicContact CG2-CG 4.25Å; I763-L767 WeakPolarHBondContact O-CB 3.38Å; I763-L767 WeakPolarHBondContact O-CG 3.29Å; I763-L767 PolarHBondContact O-N 2.85Å
764	G	91.8	Very high	88.3	Confident	31 Å²	31	93.5 Å²	93.5	32%	0.32	52%	0.521	S	S	.	.	H	α-helix	trans	-57.8	-46.5	175.3	0	0	0	0	0	112.4	A760 F761 V762 L766 L767 T768	A760-G764 PolarHBondContact O-N 3.46Å; F761-G764 PolarHBondContact O-N 3Å; V762-G764 VanDerWaalsContact C-N 3.33Å; V762-G764 PolarHBondContact O-N 3Å; G764-L766 PolarHBondContact O-N 3.47Å; G764-L767 PolarHBondContact O-N 3.41Å; G764-T768 WeakPolarHBondContact O-CB 3.37Å; G764-T768 PolarHBondContact O-N 2.88Å; G764-T768 PolarHBondContact O-OG1 3.39Å
765	V	93.1	Very high	88	Confident	82 Å²	82	96.6 Å²	96.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-62.3	-43.5	176.9	174.4	0	0	0	0	111.3	F761 V762 I763 T768 G769	F761-V765 HydrophobicContact CD1-CG2 4.35Å; F761-V765 HydrophobicContact CE1-CG2 3.95Å; F761-V765 HydrophobicContact CE2-CG2 4.48Å; F761-V765 HydrophobicContact CZ-CG2 4.02Å; F761-V765 WeakPolarHBondContact O-CG2 3.26Å; F761-V765 PolarHBondContact O-N 2.98Å; V762-V765 PolarHBondContact O-N 3.48Å; I763-V765 PolarHBondContact O-N 3.27Å; V765-T768 PolarHBondContact O-N 2.62Å; V765-G769 PolarHBondContact O-N 3.43Å
766	L	91.8	Very high	87.9	Confident	121 Å²	121	94.9 Å²	94.9	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-65.1	-42.9	178.8	-71.6	172.1	0	0	0	112.5	V762 I763 G764 G769 A770	V762-L766 HydrophobicContact CG1-CD1 4.09Å; V762-L766 HydrophobicContact CG1-CG 4.5Å; V762-L766 WeakPolarHBondContact O-CG 2.89Å; V762-L766 PolarHBondContact O-N 3.3Å; I763-L766 PolarHBondContact O-N 2.96Å; G764-L766 PolarHBondContact O-N 3.47Å; L766-G769 PolarHBondContact O-N 2.94Å; L766-A770 WeakPolarHBondContact O-CB 3.44Å; L766-A770 PolarHBondContact O-N 3.46Å
767	L	91.8	Very high	87	Confident	105 Å²	105	97 Å²	97	55%	0.55	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-41.5	177.1	-73.2	173.8	0	0	0	111.5	I763 G764 G769 A770 L771	I763-L767 HydrophobicContact CG2-CD1 3.83Å; I763-L767 HydrophobicContact CG2-CG 4.25Å; I763-L767 WeakPolarHBondContact O-CB 3.38Å; I763-L767 WeakPolarHBondContact O-CG 3.29Å; I763-L767 PolarHBondContact O-N 2.85Å; G764-L767 PolarHBondContact O-N 3.41Å; L767-G769 VanDerWaalsContact C-N 3.33Å; L767-A770 PolarHBondContact O-N 3.47Å; L767-L771 WeakPolarHBondContact O-CB 3.34Å; L767-L771 PolarHBondContact O-N 3.19Å
768	T	88.8	Confident	86	Confident	94 Å²	94	99 Å²	99	58%	0.577	53%	0.53	S	S	*	.	H	α-helix	trans	-65.7	-39.7	177.2	-42.1	0	0	0	0	110.7	G764 V765 L771 W772	G764-T768 WeakPolarHBondContact O-CB 3.37Å; G764-T768 PolarHBondContact O-N 2.88Å; G764-T768 PolarHBondContact O-OG1 3.39Å; V765-T768 PolarHBondContact O-N 2.62Å; T768-L771 PolarHBondContact O-N 2.88Å; T768-W772 WeakPolarHBondContact O-CB 3.37Å; T768-W772 PolarHBondContact O-N 2.85Å
769	G	90.7	Very high	84.5	Confident	40 Å²	40	94.6 Å²	94.6	41%	0.412	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-41.3	172.7	0	0	0	0	0	113	V765 L766 L767 W772 F773	V765-G769 PolarHBondContact O-N 3.43Å; L766-G769 PolarHBondContact O-N 2.94Å; L767-G769 VanDerWaalsContact C-N 3.33Å; G769-W772 PolarHBondContact O-N 2.88Å; G769-F773 WeakPolarHBondContact O-CB 3.47Å; G769-F773 PolarHBondContact O-N 3.27Å
770	A	87.9	Confident	83	Confident	47 Å²	47	95.1 Å²	95.1	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-42.6	176.2	0	0	0	0	0	112.1	L766 L767 W772 F773 I774	L766-A770 WeakPolarHBondContact O-CB 3.44Å; L766-A770 PolarHBondContact O-N 3.46Å; L767-A770 PolarHBondContact O-N 3.47Å; A770-W772 VanDerWaalsContact C-N 3.34Å; A770-F773 PolarHBondContact O-N 3.43Å; A770-I774 VanDerWaalsContact O-CG1 3.25Å; A770-I774 WeakPolarHBondContact O-CG1 3.42Å; A770-I774 PolarHBondContact O-N 2.84Å
771	L	85	Confident	81.2	Confident	119 Å²	119	100.1 Å²	100.1	62%	0.623	55%	0.553	S	S	*	*	H	α-helix	trans	-61.8	-41.9	173.3	-95.4	143.8	0	0	0	111.6	L767 T768 I774 Y775	L767-L771 WeakPolarHBondContact O-CB 3.34Å; L767-L771 PolarHBondContact O-N 3.19Å; T768-L771 PolarHBondContact O-N 2.88Å; L771-I774 PolarHBondContact O-N 3.28Å; L771-Y775 VanDerWaalsContact O-CB 3.25Å; L771-Y775 WeakPolarHBondContact O-CB 3.33Å; L771-Y775 PolarHBondContact O-N 3.11Å
772	W	84	Confident	79.1	Confident	182 Å²	182	98.3 Å²	98.3	69%	0.689	56%	0.564	S	S	*	*	H	α-helix	trans	-62.8	-44.8	173.8	-174.2	-84.1	0	0	0	111.4	T768 G769 A770 I774 Y775 T776	T768-W772 WeakPolarHBondContact O-CB 3.37Å; T768-W772 PolarHBondContact O-N 2.85Å; G769-W772 PolarHBondContact O-N 2.88Å; A770-W772 VanDerWaalsContact C-N 3.34Å; W772-I774 PolarHBondContact O-N 3.4Å; W772-Y775 PolarHBondContact O-N 3.49Å; W772-T776 WeakPolarHBondContact O-CG2 3.37Å; W772-T776 PolarHBondContact O-N 3.23Å; W772-T776 PolarHBondContact O-OG1 2.88Å; W772-T776 VanDerWaalsContact O-OG1 3.11Å
773	F	83.8	Confident	76.6	Confident	129 Å²	129	107.8 Å²	107.8	57%	0.566	59%	0.594	S	S	*	*	H	α-helix	trans	-60.3	-46.4	177.7	-178	-99.7	0	0	0	111.9	G769 A770 T776 H777	G769-F773 WeakPolarHBondContact O-CB 3.47Å; G769-F773 PolarHBondContact O-N 3.27Å; A770-F773 PolarHBondContact O-N 3.43Å; F773-T776 WeakPolarHBondContact CA-OG1 3.25Å; F773-T776 PolarHBondContact O-N 2.85Å; F773-T776 PolarHBondContact O-OG1 2.78Å; F773-H777 AromaticContact CE1-CD2 3.92Å; F773-H777 AromaticContact CE2-CD2 3.55Å; F773-H777 AromaticContact CE2-NE2 3.58Å; F773-H777 AromaticContact CZ-CD2 3.5Å; F773-H777 AromaticContact CZ-NE2 3.61Å; F773-H777 PolarHBondContact O-N 2.85Å; F773-H777 VanDerWaalsContact O-N 3.09Å
774	I	83.2	Confident	74.4	Confident	98 Å²	98	107.4 Å²	107.4	50%	0.503	61%	0.606	S	S	.	*	H	α-helix	trans	-59.2	-51.2	173.7	-67.1	164.5	0	0	0	109.4	A770 L771 W772 T776 H777 T778	A770-I774 VanDerWaalsContact O-CG1 3.25Å; A770-I774 WeakPolarHBondContact O-CG1 3.42Å; A770-I774 PolarHBondContact O-N 2.84Å; L771-I774 PolarHBondContact O-N 3.28Å; W772-I774 PolarHBondContact O-N 3.4Å; I774-T776 VanDerWaalsContact C-N 3.28Å; I774-T776 PolarHBondContact O-N 2.86Å; I774-H777 CarbonylContact O-C 3.53Å; I774-H777 PolarHBondContact O-N 2.83Å; I774-T778 HydrophobicContact CG2-CG2 4.1Å; I774-T778 PolarHBondContact O-N 3.34Å; I774-T778 PolarHBondContact O-OG1 3.26Å
775	Y	74.4	Confident	71.9	Confident	166 Å²	166	115.2 Å²	115.2	65%	0.651	63%	0.634	S	S	*	*	H	α-helix	trans	-56.9	-39.9	179.6	-175.6	-99	0	0	0	112.7	L771 W772 H777 G779	L771-Y775 VanDerWaalsContact O-CB 3.25Å; L771-Y775 WeakPolarHBondContact O-CB 3.33Å; L771-Y775 PolarHBondContact O-N 3.11Å; W772-Y775 PolarHBondContact O-N 3.49Å; Y775-H777 VanDerWaalsContact C-N 3.34Å; Y775-H777 PolarHBondContact O-N 3.49Å; Y775-G779 VanDerWaalsContact O-CA 3.32Å; Y775-G779 WeakPolarHBondContact O-CA 3.35Å; Y775-G779 PolarHBondContact O-N 3.49Å
776	T	74.8	Confident	69.6	Low	75 Å²	75	116.6 Å²	116.6	46%	0.46	65%	0.645	S	S	.	*	H	α-helix	trans	-70.3	-27.3	176.9	53.1	0	0	0	0	113.7	W772 F773 I774	W772-T776 WeakPolarHBondContact O-CG2 3.37Å; W772-T776 PolarHBondContact O-N 3.23Å; W772-T776 PolarHBondContact O-OG1 2.88Å; W772-T776 VanDerWaalsContact O-OG1 3.11Å; F773-T776 WeakPolarHBondContact CA-OG1 3.25Å; F773-T776 PolarHBondContact O-N 2.85Å; F773-T776 PolarHBondContact O-OG1 2.78Å; I774-T776 VanDerWaalsContact C-N 3.28Å; I774-T776 PolarHBondContact O-N 2.86Å
777	H	68.4	Low	67.1	Low	141 Å²	141	117 Å²	117	65%	0.653	65%	0.651	S	S	*	*	H	α-helix	trans	-93.4	-22.5	178.4	-88	-75.4	0	0	0	114	F773 I774 Y775	F773-H777 AromaticContact CE1-CD2 3.92Å; F773-H777 AromaticContact CE2-CD2 3.55Å; F773-H777 AromaticContact CE2-NE2 3.58Å; F773-H777 AromaticContact CZ-CD2 3.5Å; F773-H777 AromaticContact CZ-NE2 3.61Å; F773-H777 PolarHBondContact O-N 2.85Å; F773-H777 VanDerWaalsContact O-N 3.09Å; I774-H777 CarbonylContact O-C 3.53Å; I774-H777 PolarHBondContact O-N 2.83Å; Y775-H777 VanDerWaalsContact C-N 3.34Å; Y775-H777 PolarHBondContact O-N 3.49Å
778	T	66.8	Low	64.2	Low	101 Å²	101	121 Å²	121	62%	0.62	67%	0.667	S	S	*	*	H	α-helix	trans	-101.5	-9.1	176	59.6	0	0	0	0	113.3	I774 G780	I774-T778 HydrophobicContact CG2-CG2 4.1Å; I774-T778 PolarHBondContact O-N 3.34Å; I774-T778 PolarHBondContact O-OG1 3.26Å; T778-G780 VanDerWaalsContact C-N 3.27Å; T778-G780 PolarHBondContact O-N 3Å
779	G	57.6	Low	61.6	Low	49 Å²	49	125.8 Å²	125.8	51%	0.505	68%	0.68	S	S	.	*			trans	-77.7	-2.4	179.7	0	0	0	0	0	115.3	Y775 N781	Y775-G779 VanDerWaalsContact O-CA 3.32Å; Y775-G779 WeakPolarHBondContact O-CA 3.35Å; Y775-G779 PolarHBondContact O-N 3.49Å; G779-N781 PolarHBondContact O-N 2.79Å
780	G	58.6	Low	59.9	Low	59 Å²	59	128.9 Å²	128.9	61%	0.608	69%	0.693	S	S	*	*	S	Bend	trans	-82.5	86.6	170.3	0	0	0	0	0	111.3	T778	T778-G780 VanDerWaalsContact C-N 3.27Å; T778-G780 PolarHBondContact O-N 3Å
781	N	55.6	Low	57.2	Low	166 Å²	166	136 Å²	136	89%	0.888	72%	0.718	S	S	*	*	S	Bend	trans	127.3	64.8	159.7	-64.1	-12.4	0	0	0	114.7	G779	G779-N781 PolarHBondContact O-N 2.79Å
782	A	47.3	Very low	55.5	Low	102 Å²	102	135.2 Å²	135.2	84%	0.843	72%	0.721	S	S	*	*			trans	-141.1	115.4	146.7	0	0	0	0	0	109.4
783	R	41.3	Very low	53	Low	256 Å²	256	133 Å²	133	97%	0.966	73%	0.727	S	S	*	*			trans	-60.9	139.7	-166.5	-155.7	175.4	-168.7	168.4	1	113.1
784	A	46.6	Very low	50.4	Low	93 Å²	93	131.7 Å²	131.7	77%	0.769	73%	0.733	S	S	*	*			trans	-65.1	142.2	171.7	0	0	0	0	0	113.1
785	Q	37.6	Very low	47.9	Very low	195 Å²	195	135.4 Å²	135.4	91%	0.911	75%	0.749	S	S	*	*			trans	-148	148.2	143.1	-98.9	-167.5	-17.5	0	0	110.8
786	P	45.7	Very low	45.9	Very low	111 Å²	111	135 Å²	135	72%	0.721	76%	0.758	S	S	*	*			trans	-126.1	162.8	-147.8	43.6	-28	0	0	0	116.1
787	V	38.6	Very low	43.9	Very low	128 Å²	128	136.5 Å²	136.5	78%	0.776	77%	0.772	S	S	*	*			trans	70.1	118.1	153.4	-146.3	0	0	0	0	119.8
788	Q	32.4	Very low	42.2	Very low	189 Å²	189	135.5 Å²	135.5	88%	0.883	78%	0.78	S	S	*	*				178.4	141.1	104	-94.1	179.3	-5.5	0	0	113.3
789	K	32.4	Very low	40.5	Very low	196 Å²	196	135.1 Å²	135.1	85%	0.852	79%	0.787	S	S	*	*			trans	-113.6	172	170.6	-144.2	-162.1	-179.7	174.7	0	107
790	P	56.3	Low	39.2	Very low	105 Å²	105	136.6 Å²	136.6	68%	0.682	80%	0.795	S	S	*	*				-119.1	163.5	-92.1	39.3	-25.1	0	0	0	112.7
791	Q	29.8	Very low	38.1	Very low	195 Å²	195	141.9 Å²	141.9	91%	0.911	80%	0.803	S	S	*	*			trans	-157.4	164.1	155.1	-101.4	-159.4	-51	0	0	112.2
792	P	50	Low	37	Very low	104 Å²	104	138.7 Å²	138.7	68%	0.675	79%	0.794	S	S	*	*			trans	-122.4	178.6	-139.8	44.8	-32.4	0	0	0	115.9
793	V	31.7	Very low	36.5	Very low	136 Å²	136	141.5 Å²	141.5	82%	0.824	79%	0.793	S	S	*	*			trans	68.3	130	161	-174.5	0	0	0	0	118.9
794	S	30.2	Very low	36.2	Very low	100 Å²	100	132.5 Å²	132.5	70%	0.699	78%	0.78	S	S	*	*			trans	157.3	102	143.8	177.1	0	0	0	0	109
795	E	29.1	Very low	35.6	Very low	176 Å²	176	133.2 Å²	133.2	82%	0.822	78%	0.779	S	S	*	*				57.2	99.4	96	-74.6	-167.4	160.2	0	0	116.2
796	N	32.4	Very low	35.6	Very low	158 Å²	158	130.3 Å²	130.3	85%	0.845	78%	0.775	S	S	*	*				73.2	150.3	120.3	-133.6	16.6	0	0	0	122.5
797	S	32.9	Very low	35.1	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	78%	0.78	S	S	*	*			trans	97.3	134.7	174.9	-43.7	0	0	0	0	113.2
798	S	33.6	Very low	34.8	Very low	120 Å²	120	131.7 Å²	131.7	84%	0.839	77%	0.774	S	S	*	*			cis	-168.6	164.5	24.1	27.9	0	0	0	0	110.7
799	A	30.7	Very low	34.8	Very low	92 Å²	92	128.7 Å²	128.7	76%	0.76	77%	0.768	S	S	*	*			trans	-59.4	149.6	179.6	0	0	0	0	0	116.9
800	A	31.4	Very low	35.1	Very low	80 Å²	80	124.8 Å²	124.8	66%	0.661	76%	0.763	S	S	*	*			trans	57.8	153.5	145.9	0	0	0	0	0	117.7
801	H	34	Very low	33.8	Very low	171 Å²	171	125.5 Å²	125.5	79%	0.792	77%	0.769	S	S	*	*			cis	-156.4	138.6	29.7	-97.7	-74.5	0	0	0	106.4
802	S	32.8	Very low	33.8	Very low	99 Å²	99	120.2 Å²	120.2	69%	0.692	75%	0.754	S	S	*	*				84.9	146.4	88.9	-147.4	0	0	0	0	115.1
803	I	38.1	Very low	32.7	Very low	160 Å²	160	118.7 Å²	118.7	82%	0.821	75%	0.746	S	S	*	*			trans	109.1	123.7	149.2	-56	158.6	0	0	0	117.4
804	G	33.7	Very low	33.4	Very low	68 Å²	68	117.3 Å²	117.3	70%	0.701	74%	0.742	S	S	*	*			trans	131.4	59.7	154.4	0	0	0	0	0	113.1
805	S	33.8	Very low	34.5	Very low	107 Å²	107	117.8 Å²	117.8	75%	0.748	75%	0.746	S	S	*	*				65.4	99.9	66.6	-62.1	0	0	0	0	115
806	T	39	Very low	35.1	Very low	134 Å²	134	114.3 Å²	114.3	82%	0.822	74%	0.737	S	S	*	*				-158.3	94.4	127	39.4	0	0	0	0	106.7
807	Q	33.6	Very low	35.1	Very low	175 Å²	175	114.2 Å²	114.2	82%	0.818	76%	0.758	S	S	*	*				66.6	94.2	86.9	-153.5	175.9	38.8	0	0	110.7
808	S	32.7	Very low	35.3	Very low	93 Å²	93	114.6 Å²	114.6	65%	0.65	76%	0.758	S	S	*	*				54.6	126.6	77.2	77	0	0	0	0	112
809	T	32.8	Very low	35.3	Very low	126 Å²	126	114.3 Å²	114.3	77%	0.773	75%	0.754	S	S	*	*				-166	162.3	55	28	0	0	0	0	112.9
810	P	38.4	Very low	35.6	Very low	115 Å²	115	115.6 Å²	115.6	75%	0.747	75%	0.754	S	S	*	*			trans	-82.9	162.5	171.5	36.7	-34.4	0	0	0	112.4
811	C	29.8	Very low	35.8	Very low	119 Å²	119	117.6 Å²	117.6	80%	0.804	76%	0.759	S	S	*	*			trans	-136.5	109.9	159.1	-73.5	0	0	0	0	106.9
812	S	28.2	Very low	36	Very low	85 Å²	85	114.3 Å²	114.3	59%	0.594	76%	0.757	S	S	*	*				104.4	140.7	77.2	-69.3	0	0	0	0	108.6	T816	S812-T816 WeakPolarHBondContact CA-OG1 3.32Å; S812-T816 PolarHBondContact O-OG1 2.85Å
813	S	28.2	Very low	36.2	Very low	71 Å²	71	115.3 Å²	115.3	50%	0.497	76%	0.761	S	S	.	*			cis	-138.2	-167.1	21.7	-57.4	0	0	0	0	109.4	S815 T816	S813-S815 CarbonylContact O-C 3.56Å; S813-S815 WeakPolarHBondContact O-CA 3.25Å; S813-T816 CarbonylContact C-O 3.58Å; S813-T816 VanDerWaalsContact C-O 3.3Å; S813-T816 PolarHBondContact N-OG1 3.39Å; S813-T816 CarbonylContact O-C 3.3Å; S813-T816 WeakPolarHBondContact O-CA 3.41Å; S813-T816 VanDerWaalsContact O-CB 3.26Å; S813-T816 WeakPolarHBondContact O-CB 3.36Å; S813-T816 PolarHBondContact O-N 3.09Å; S813-T816 PolarHBondContact O-OG1 3.48Å
814	S	47.1	Very low	36	Very low	108 Å²	108	112.1 Å²	112.1	76%	0.755	76%	0.757	S	S	*	*	S	Bend	trans	-70.7	127.6	147.6	165.2	0	0	0	0	107.1
815	S	52.6	Low	36.2	Very low	110 Å²	110	115.5 Å²	115.5	77%	0.769	76%	0.761	S	S	*	*	S	Bend		107	-156.5	-87.3	60.2	0	0	0	0	104.6	S813 A817	S813-S815 CarbonylContact O-C 3.56Å; S813-S815 WeakPolarHBondContact O-CA 3.25Å; S815-A817 PolarHBondContact O-N 3.2Å
816	T	41.8	Very low	36.4	Very low	103 Å²	103	116.3 Å²	116.3	63%	0.632	76%	0.763	S	S	*	*			trans	-31.6	89.1	144	64.6	0	0	0	0	119.6	S812 S813	S812-T816 WeakPolarHBondContact CA-OG1 3.32Å; S812-T816 PolarHBondContact O-OG1 2.85Å; S813-T816 CarbonylContact C-O 3.58Å; S813-T816 VanDerWaalsContact C-O 3.3Å; S813-T816 PolarHBondContact N-OG1 3.39Å; S813-T816 CarbonylContact O-C 3.3Å; S813-T816 WeakPolarHBondContact O-CA 3.41Å; S813-T816 VanDerWaalsContact O-CB 3.26Å; S813-T816 WeakPolarHBondContact O-CB 3.36Å; S813-T816 PolarHBondContact O-N 3.09Å; S813-T816 PolarHBondContact O-OG1 3.48Å
817	A	32.9	Very low	36.2	Very low	156 Å²	156	114.6 Å²	114.6	100%	1.289	76%	0.757	S	S	*	*			trans	-154	0	146.9	0	0	0	0	0	110.6	S815	S815-A817 PolarHBondContact O-N 3.2Å

Retrieved 817 of 817 residues in 362.7 ms (Link to these results)

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