A0A087XZB6_POEFO Loading...

Integrin subunit alpha 7

AlphaFold DB , UniProt , Accession A0A087XZB6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,094 aa.

						>A0A087XZB6_POEFO|A0A087XZB6
MAALMGHGDPAASLSSVSSHPWVFFLLALSSLLSHVYCFNLDTTHTLHKLGDRGTFFGFSVALHQQLNPKPQSWILVGAPQAAGRGPLTGSRPGALFRCPITPEEYDCERVNIDGEVSLDRESKDNQWLGVSVKSQGIGGKVVTCAHLYELRQRVKQPSETRDPIGRCYVLSDDLTRRDDLDGGEWKFCEGRPQGHEQFGFCQQGLSVSFTPDRNFILFGAPGTYNWKGLLFMASAAEDVLLYKTLEPSTPFEDVAHNSYLGFSVDSAKGIMNLKELTFVAGAPRANHTGAVVLLRMDNVHRLVPQHIFWGEELASSFGYSVATTDLNKDGWTDVIVGAPNFFDRKAEIGGAVYVYLNPLGHWDDQARPIRLNGTYDSMFGMTVSSIGDLDQDGYGDIAVGAPFDGDGKVFIYRGSDAGIETKPAQVLDGHDFDVTRFGYSISGGLDIDDNHYPDVVVGSLNDSVVLFRSCPVIHVVREVSIDPQNIDLEQKNCKGRDGVCVEVKACFMFTAHPHHYSPHITLVVQFEADTERRKLGLPHRVSFLGRSSLEPEYTQTEEVELHRQRETHCATADFQLHENIRDKLRPISLAITHSIKPVPPRRNSAKRPQKLPPVLNISPSKTLNSEVNFLREGCGSDKICQSNLKLSYQFGTTHLNSDFFTPLPRDNDGVQVFSLSDQRLVVLEITVTNMPSDPLNPEEDGDDAHASQLFITLPDTLPYAGSRVPPQMICQANQNGSQVECDLGNPVKRNAKLKFTINLSTSNITTETTELTADLQLATISEQLNLDPVTAFAKVVIELPLSVNGLARPHQLFFSGTVKGESAMTSLEDIGNPVDLEFVLSNPGKALQKLGSAFLNIMWPVELPNGKWLLYPASLRFEGQPDTRCSPAEAVNPLNLQSSSAANQVVGRSRRSHPEEEDQVLTKGSDVGTTPAVAASERRKSLKLDCLLGSARCVLFQCPLHSFTGQAVLKIHARLWKSSFIEDFPTVSALELLIRANISVKSSIKHLVLRDASVQIPVMIYPELDLAEQYMIPWWIILIAILAGILLLTLLVCILWKCGFFKRSERRPHYETEYYRAHLGVQPSEAEKQALEL
					

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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	27.6	Very low	27.7	Very low	245 Å²	245	135 Å²	135	100%	1.207	84%	0.84	S	S	*	*				0	142.4	0	-75.1	176.6	167.6	0	0	107.9
2	A	24.4	Very low	27.6	Very low	104 Å²	104	131.8 Å²	131.8	86%	0.86	84%	0.836	S	S	*	*			trans	18.9	146.4	157.2	0	0	0	0	0	120.7
3	A	27	Very low	27.4	Very low	85 Å²	85	130.3 Å²	130.3	70%	0.702	83%	0.832	S	S	*	*			cis	178	171.8	6.3	0	0	0	0	0	108
4	L	31.3	Very low	27.7	Very low	140 Å²	140	133.6 Å²	133.6	73%	0.733	84%	0.839	S	S	*	*			cis	-168.9	153.6	-14.9	-106.8	166.8	0	0	0	109
5	M	27	Very low	27.6	Very low	177 Å²	177	131.9 Å²	131.9	87%	0.872	83%	0.833	S	S	*	*			trans	66.5	155.8	156.7	-65.9	161.1	171.4	0	0	118.7
6	G	25.6	Very low	28.1	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	84%	0.836	S	S	*	*			cis	158.3	161.1	-3.3	0	0	0	0	0	112.3
7	H	26.3	Very low	28.2	Very low	209 Å²	209	131.7 Å²	131.7	97%	0.968	84%	0.835	S	S	*	*			trans	82.4	140.7	-171.9	-54.6	-67.6	0	0	0	115.9
8	G	24.2	Very low	28.3	Very low	70 Å²	70	129.2 Å²	129.2	72%	0.722	82%	0.822	S	S	*	*			cis	161.4	119.9	-6.8	0	0	0	0	0	112.1
9	D	29.7	Very low	28.7	Very low	166 Å²	166	128.5 Å²	128.5	89%	0.888	82%	0.822	S	S	*	*			trans	-66.7	158	179.7	-67.2	-49.9	0	0	0	113.5
10	P	34.1	Very low	29	Very low	126 Å²	126	128.6 Å²	128.6	82%	0.818	81%	0.811	S	S	*	*				-132.3	147.7	120.2	36	-27.3	0	0	0	114.1
11	A	28	Very low	29.5	Very low	104 Å²	104	127 Å²	127	86%	0.86	80%	0.802	S	S	*	*			trans	-73.8	152.5	-176.3	0	0	0	0	0	114.6
12	A	25.9	Very low	29.9	Very low	96 Å²	96	125.1 Å²	125.1	79%	0.793	78%	0.781	S	S	*	*			trans	-137.7	110.1	161.6	0	0	0	0	0	111.4
13	S	25.3	Very low	30.6	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	77%	0.766	S	S	*	*			trans	-4.4	136.2	162.9	53.6	0	0	0	0	120.7
14	L	31.2	Very low	31.2	Very low	176 Å²	176	128.5 Å²	128.5	92%	0.921	77%	0.768	S	S	*	*			trans	-54.4	138.4	157.3	-75.8	75.7	0	0	0	111.7
15	S	25.8	Very low	31.6	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	76%	0.764	S	S	*	*			trans	-137.3	137.2	149.6	63.6	0	0	0	0	109.7
16	S	35.6	Very low	32.2	Very low	125 Å²	125	126.2 Å²	126.2	87%	0.874	75%	0.753	S	S	*	*			trans	-67.4	127.8	-172.7	52	0	0	0	0	112.7
17	V	31.2	Very low	32.7	Very low	136 Å²	136	128.8 Å²	128.8	82%	0.824	75%	0.752	S	S	*	*			trans	-118.3	141.2	163.3	-178.8	0	0	0	0	109
18	S	29.4	Very low	33.1	Very low	87 Å²	87	121 Å²	121	61%	0.608	73%	0.725	S	S	*	*			trans	-71.8	140.7	-164.9	44.9	0	0	0	0	114.1	H20	S18-H20 PolarHBondContact O-N 3.38Å
19	S	35.2	Very low	33.5	Very low	116 Å²	116	122.5 Å²	122.5	81%	0.811	72%	0.715	S	S	*	*			trans	-62.7	112.2	169.1	42.2	0	0	0	0	111.2	P21	S19-P21 WeakPolarHBondContact O-CD 3.31Å
20	H	35.6	Very low	33.5	Very low	130 Å²	130	118.9 Å²	118.9	60%	0.602	70%	0.703	S	S	*	*			trans	-98.4	107.8	165.3	-91.3	44.8	0	0	0	109.4	S18 W22 V23	S18-H20 PolarHBondContact O-N 3.38Å; H20-W22 PolarHBondContact O-N 3.14Å; H20-V23 PolarHBondContact O-N 3.09Å
21	P	38.9	Very low	33.2	Very low	96 Å²	96	117.2 Å²	117.2	62%	0.623	69%	0.694	S	S	*	*	H	α-helix	trans	-67.5	-9.9	-174.3	25.2	-32.6	0	0	0	114	S19 F25	S19-P21 WeakPolarHBondContact O-CD 3.31Å; P21-F25 PolarHBondContact O-N 3.19Å
22	W	36	Very low	33.3	Very low	205 Å²	205	118.2 Å²	118.2	78%	0.777	68%	0.684	S	S	*	*	H	α-helix	trans	-74.1	-30.5	-179.7	-77.1	57	0	0	0	113.8	H20 F25 L26	H20-W22 PolarHBondContact O-N 3.14Å; W22-F25 PolarHBondContact O-N 3.41Å; W22-L26 PolarHBondContact O-N 3.35Å
23	V	39.3	Very low	33.4	Very low	90 Å²	90	120.7 Å²	120.7	55%	0.545	68%	0.683	S	S	.	*	H	α-helix	trans	-72.6	-39.3	-179.8	-180	0	0	0	0	110.9	H20 F25 L26 L27	H20-V23 PolarHBondContact O-N 3.09Å; V23-F25 VanDerWaalsContact C-N 3.32Å; V23-L26 PolarHBondContact O-N 3.03Å; V23-L27 HydrophobicContact CG1-CD1 4.21Å; V23-L27 PolarHBondContact O-N 3.38Å
24	F	38.6	Very low	33.6	Very low	169 Å²	169	120 Å²	120	74%	0.741	68%	0.679	S	S	*	*	H	α-helix	trans	-65.4	-34.3	170.7	-92.1	-83	0	0	0	112.4	A28	F24-A28 WeakPolarHBondContact O-CB 3.4Å; F24-A28 PolarHBondContact O-N 2.9Å
25	F	40.2	Very low	33.5	Very low	148 Å²	148	118.7 Å²	118.7	65%	0.649	67%	0.668	S	S	*	*	H	α-helix	trans	-68.1	-38.2	177.1	-145.4	-91.4	0	0	0	112.2	P21 W22 V23 L29	P21-F25 PolarHBondContact O-N 3.19Å; W22-F25 PolarHBondContact O-N 3.41Å; V23-F25 VanDerWaalsContact C-N 3.32Å; F25-L29 HydrophobicContact CD1-CD1 4.38Å; F25-L29 HydrophobicContact CE1-CD1 4.12Å; F25-L29 WeakPolarHBondContact O-CB 3.39Å; F25-L29 PolarHBondContact O-N 3.46Å
26	L	39.3	Very low	33.7	Very low	122 Å²	122	117.6 Å²	117.6	64%	0.639	66%	0.657	S	S	*	*	H	α-helix	trans	-71	-39.7	175.6	-79	160.7	0	0	0	112.9	W22 V23 L29 S30	W22-L26 PolarHBondContact O-N 3.35Å; V23-L26 PolarHBondContact O-N 3.03Å; L26-L29 PolarHBondContact O-N 3.02Å; L26-S30 WeakPolarHBondContact O-CB 3.34Å; L26-S30 PolarHBondContact O-N 2.98Å
27	L	37.7	Very low	34	Very low	112 Å²	112	120.3 Å²	120.3	59%	0.586	65%	0.649	S	S	*	*	H	α-helix	trans	-66.4	-39	172.7	-85.2	157.3	0	0	0	112.2	V23 S30 S31	V23-L27 HydrophobicContact CG1-CD1 4.21Å; V23-L27 PolarHBondContact O-N 3.38Å; L27-S30 WeakPolarHBondContact O-CB 3.36Å; L27-S30 PolarHBondContact O-N 3.32Å; L27-S31 PolarHBondContact O-N 3.08Å; L27-S31 VanDerWaalsContact O-N 3.09Å; L27-S31 PolarHBondContact O-OG 3.48Å
28	A	34.3	Very low	35.1	Very low	47 Å²	47	115.4 Å²	115.4	39%	0.388	62%	0.62	S	S	.	*	H	α-helix	trans	-68.5	-33.9	175.5	0	0	0	0	0	113.2	F24 S31	F24-A28 WeakPolarHBondContact O-CB 3.4Å; F24-A28 PolarHBondContact O-N 2.9Å; A28-S31 WeakPolarHBondContact CA-OG 3.36Å; A28-S31 PolarHBondContact O-OG 3.5Å
29	L	32.3	Very low	37.6	Very low	101 Å²	101	111.6 Å²	111.6	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-69.7	-34.5	171.4	-122.5	72.2	0	0	0	111.8	F25 L26 S31 L32	F25-L29 HydrophobicContact CD1-CD1 4.38Å; F25-L29 HydrophobicContact CE1-CD1 4.12Å; F25-L29 WeakPolarHBondContact O-CB 3.39Å; F25-L29 PolarHBondContact O-N 3.46Å; L26-L29 PolarHBondContact O-N 3.02Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.32Å; L29-L32 PolarHBondContact O-N 3.37Å
30	S	29.2	Very low	40.3	Very low	89 Å²	89	106 Å²	106	62%	0.622	55%	0.554	S	S	*	*	H	α-helix	trans	-66.6	-31.2	175.2	-172.1	0	0	0	0	113.1	L26 L27 L32	L26-S30 WeakPolarHBondContact O-CB 3.34Å; L26-S30 PolarHBondContact O-N 2.98Å; L27-S30 WeakPolarHBondContact O-CB 3.36Å; L27-S30 PolarHBondContact O-N 3.32Å; S30-L32 VanDerWaalsContact C-N 3.31Å
31	S	29	Very low	43.1	Very low	91 Å²	91	99.9 Å²	99.9	64%	0.636	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.4	176.4	56	0	0	0	0	114.3	L27 A28 L29	L27-S31 PolarHBondContact O-N 3.08Å; L27-S31 VanDerWaalsContact O-N 3.09Å; L27-S31 PolarHBondContact O-OG 3.48Å; A28-S31 WeakPolarHBondContact CA-OG 3.36Å; A28-S31 PolarHBondContact O-OG 3.5Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-S31 PolarHBondContact O-N 3.32Å
32	L	28.3	Very low	45.7	Very low	125 Å²	125	95.8 Å²	95.8	65%	0.654	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	1.4	-176.6	-94.8	162.7	0	0	0	114.4	L29 S30	L29-L32 PolarHBondContact O-N 3.37Å; S30-L32 VanDerWaalsContact C-N 3.31Å
33	L	30	Very low	48.3	Very low	148 Å²	148	87.6 Å²	87.6	78%	0.775	47%	0.471	S	S	*	.			trans	-129.8	28.6	-175.2	-82.3	165.2	0	0	0	114.3
34	S	27.5	Very low	50.6	Low	100 Å²	100	88 Å²	88	70%	0.699	47%	0.474	S	S	*	.			trans	-101.1	64.7	163.4	-63.6	0	0	0	0	110.4	V36	S34-V36 PolarHBondContact O-N 3Å
35	H	30	Very low	52.8	Low	147 Å²	147	83.4 Å²	83.4	68%	0.681	46%	0.455	S	S	*	.			trans	-69.3	97.9	163.8	-82	-58.5	0	0	0	108.5	Y37	H35-Y37 WeakPolarHBondContact O-CD2 3.43Å; H35-Y37 PolarHBondContact O-N 3.49Å
36	V	31.1	Very low	55.3	Low	86 Å²	86	77.4 Å²	77.4	52%	0.521	43%	0.43	S	S	.	.			trans	-60.3	105.7	164.5	178.9	0	0	0	0	106.8	S34 C38	S34-V36 PolarHBondContact O-N 3Å; V36-C38 PolarHBondContact O-N 3.39Å; V36-C38 PolarHBondContact O-SG 3.03Å
37	Y	40	Very low	57.9	Low	181 Å²	181	72 Å²	72	71%	0.71	40%	0.402	S	S	*	.			trans	-68	98.3	177.7	-73.7	-78.7	0	0	0	108.8	H35	H35-Y37 WeakPolarHBondContact O-CD2 3.43Å; H35-Y37 PolarHBondContact O-N 3.49Å
38	C	55.3	Low	60.6	Low	33 Å²	33	69.3 Å²	69.3	22%	0.223	39%	0.386	C	S	.	.			trans	-67.5	139.2	170.9	-55.9	0	0	0	0	109	V36 L41 T43	V36-C38 PolarHBondContact O-N 3.39Å; V36-C38 PolarHBondContact O-SG 3.03Å; C38-L41 WeakPolarHBondContact CB-O 3.48Å; C38-T43 PolarHBondContact SG-OG1 3.13Å
39	F	82.8	Confident	63.6	Low	7 Å²	7	67.1 Å²	67.1	3%	0.031	37%	0.367	C	S	.	.	S	Bend	trans	-71	-53	173.9	77.4	-68.2	0	0	0	109.2	L41 L390 I412 A425 Q426 V615 I618	F39-L41 HydrophobicContact CE1-CB 4.2Å; F39-L41 HydrophobicContact CE1-CD1 3.93Å; F39-L41 HydrophobicContact CE1-CG 3.9Å; F39-L41 HydrophobicContact CZ-CD1 4.14Å; F39-L41 HydrophobicContact CZ-CG 4.04Å; F39-L390 HydrophobicContact CE2-CB 3.88Å; F39-L390 HydrophobicContact CE2-CD1 4.27Å; F39-L390 HydrophobicContact CZ-CB 4.07Å; F39-L390 HydrophobicContact CZ-CD1 3.63Å; F39-I412 HydrophobicContact CE1-CB 4.08Å; F39-I412 HydrophobicContact CE1-CG1 4.18Å; F39-I412 HydrophobicContact CE1-CG2 3.76Å; F39-I412 HydrophobicContact CE2-CG2 4.33Å; F39-I412 HydrophobicContact CZ-CB 4.37Å; F39-I412 HydrophobicContact CZ-CG2 3.55Å; F39-A425 HydrophobicContact CB-CB 4.1Å; F39-A425 HydrophobicContact CD1-CB 4.32Å; F39-A425 HydrophobicContact CD2-CB 4.33Å; F39-A425 HydrophobicContact CG-CB 3.99Å; F39-Q426 HydrophobicContact CD1-CB 3.4Å; F39-Q426 VanDerWaalsContact CD1-CB 3.4Å; F39-Q426 HydrophobicContact CD1-CG 4.28Å; F39-Q426 HydrophobicContact CE1-CB 3.88Å; F39-Q426 HydrophobicContact CG-CB 4.48Å; F39-V615 WeakPolarHBondContact O-CG2 3.32Å; F39-I618 HydrophobicContact CB-CD1 3.34Å; F39-I618 HydrophobicContact CB-CG1 4.12Å
40	N	91.9	Very high	66.7	Low	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.354	C	S	.	.	S	Bend	trans	-155.4	-16.3	162.4	77.7	-15.3	0	0	0	116.7	D42 L390 C471 V473 V615	N40-D42 PolarHBondContact O-N 3.28Å; N40-L390 PolarHBondContact ND2-O 3.03Å; N40-C471 HydrophobicContact CB-CB 4.49Å; N40-C471 WeakPolarHBondContact CB-O 3.33Å; N40-C471 WeakPolarHBondContact O-CB 3.34Å; N40-C471 PolarHBondContact O-N 2.83Å; N40-V473 HydrophobicContact CB-CG2 3.66Å; N40-V615 HydrophobicContact CB-CG2 3.78Å
41	L	93.9	Very high	69.8	Low	0 Å²	0	61 Å²	61	0%	0	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-66.4	119.4	176.2	-73	171.5	0	0	0	111	C38 F39 T43 L390 I412 Q426 L428 V456 F468 S470	C38-L41 WeakPolarHBondContact CB-O 3.48Å; F39-L41 HydrophobicContact CE1-CB 4.2Å; F39-L41 HydrophobicContact CE1-CD1 3.93Å; F39-L41 HydrophobicContact CE1-CG 3.9Å; F39-L41 HydrophobicContact CZ-CD1 4.14Å; F39-L41 HydrophobicContact CZ-CG 4.04Å; L41-T43 PolarHBondContact O-N 3.06Å; L41-L390 HydrophobicContact CD1-CD1 4.03Å; L41-L390 HydrophobicContact CD2-CD1 4.42Å; L41-L390 HydrophobicContact CG-CD1 4.27Å; L41-I412 HydrophobicContact CD1-CD1 3.9Å; L41-I412 HydrophobicContact CD1-CG1 3.89Å; L41-Q426 PolarHBondContact O-NE2 3.4Å; L41-L428 HydrophobicContact CD1-CD1 4.32Å; L41-V456 HydrophobicContact CD1-CB 4.4Å; L41-V456 HydrophobicContact CD1-CG2 4.14Å; L41-V456 HydrophobicContact CD2-CB 4.25Å; L41-V456 HydrophobicContact CD2-CG2 4.03Å; L41-F468 HydrophobicContact CB-CB 4.42Å; L41-F468 HydrophobicContact CD2-CB 4.01Å; L41-S470 WeakPolarHBondContact CD2-OG 3.31Å
42	D	92	Very high	72.9	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.059	33%	0.333	C	S	.	.			trans	-70.5	117.3	-179.6	-176.7	29.3	0	0	0	111.7	N40 T44 H45 T46 R469 L612	N40-D42 PolarHBondContact O-N 3.28Å; D42-T44 WeakPolarHBondContact OD1-CA 3.39Å; D42-T44 WeakPolarHBondContact OD1-CB 3.34Å; D42-T44 PolarHBondContact OD1-N 3.1Å; D42-T44 PolarHBondContact OD1-OG1 3.34Å; D42-H45 WeakPolarHBondContact OD2-CA 3.44Å; D42-H45 VanDerWaalsContact OD2-CB 3.24Å; D42-H45 WeakPolarHBondContact OD2-CB 3.35Å; D42-H45 IonicContact OD2-CG 2.93Å; D42-H45 PolarHBondContact OD2-N 3.33Å; D42-H45 IonicContact OD2-ND1 3.53Å; D42-H45 PolarHBondContact OD2-ND1 3.23Å; D42-T46 WeakPolarHBondContact O-CG2 3.34Å; D42-R469 WeakPolarHBondContact CB-O 3.32Å; D42-R469 PolarHBondContact N-O 2.83Å; D42-L612 HydrophobicContact CB-CD1 4.07Å; D42-L612 HydrophobicContact CB-CD2 4.01Å; D42-L612 VanDerWaalsContact OD2-CD2 3.25Å; D42-L612 WeakPolarHBondContact OD2-CD2 3.07Å
43	T	91.3	Very high	76	Confident	32 Å²	32	67.7 Å²	67.7	20%	0.196	34%	0.344	C	S	.	.	S	Bend	trans	-91.8	-9.5	171.9	56.9	0	0	0	0	112.9	C38 L41 Q426 L428 F433	C38-T43 PolarHBondContact SG-OG1 3.13Å; L41-T43 PolarHBondContact O-N 3.06Å; T43-Q426 VanDerWaalsContact CG2-NE2 3.35Å; T43-L428 HydrophobicContact CG2-CD2 3.88Å; T43-F433 HydrophobicContact CG2-CZ 3.98Å
44	T	86.9	Confident	79.1	Confident	99 Å²	99	62.1 Å²	62.1	61%	0.607	32%	0.322	S	S	*	.	S	Bend	trans	-94.2	-29.9	-171.3	65.6	0	0	0	0	114.5	D42	D42-T44 WeakPolarHBondContact OD1-CA 3.39Å; D42-T44 WeakPolarHBondContact OD1-CB 3.34Å; D42-T44 PolarHBondContact OD1-N 3.1Å; D42-T44 PolarHBondContact OD1-OG1 3.34Å
45	H	86.8	Confident	82.3	Confident	73 Å²	73	57.7 Å²	57.7	34%	0.338	29%	0.291	S	S	.	.	S	Bend	trans	-126.4	49.1	175.8	-45.5	79.4	0	0	0	111.2	D42 R469	D42-H45 WeakPolarHBondContact OD2-CA 3.44Å; D42-H45 VanDerWaalsContact OD2-CB 3.24Å; D42-H45 WeakPolarHBondContact OD2-CB 3.35Å; D42-H45 IonicContact OD2-CG 2.93Å; D42-H45 PolarHBondContact OD2-N 3.33Å; D42-H45 IonicContact OD2-ND1 3.53Å; D42-H45 PolarHBondContact OD2-ND1 3.23Å; H45-R469 PolarHBondContact O-NH2 3.08Å
46	T	91.8	Very high	85.5	Confident	21 Å²	21	53.4 Å²	53.4	13%	0.129	27%	0.27	C	S	.	.			trans	-62.1	153.4	170.9	49	0	0	0	0	111.6	D42 H48 F433 V466 F468	D42-T46 WeakPolarHBondContact O-CG2 3.34Å; T46-H48 VanDerWaalsContact CB-NE2 3.32Å; T46-H48 WeakPolarHBondContact CB-NE2 3.25Å; T46-H48 PolarHBondContact OG1-NE2 3.41Å; T46-F433 HydrophobicContact CG2-CD1 4.44Å; T46-F433 HydrophobicContact CG2-CE1 3.99Å; T46-V466 HydrophobicContact CG2-CG1 4.12Å; T46-F468 HydrophobicContact CG2-CD1 3.56Å; T46-F468 HydrophobicContact CG2-CE1 3.51Å; T46-F468 HydrophobicContact CG2-CG 4.39Å; T46-F468 HydrophobicContact CG2-CZ 4.3Å
47	L	93.4	Very high	88.7	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.052	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.3	175.4	-59.7	177.9	0	0	0	109.6	I101 P103 L467 P609	L47-I101 HydrophobicContact CD1-CG2 3.67Å; L47-P103 HydrophobicContact CD2-CB 4.33Å; L47-L467 HydrophobicContact CB-CB 4.28Å; L47-L467 HydrophobicContact CD1-CD2 4.09Å; L47-L467 PolarHBondContact N-O 2.88Å; L47-L467 PolarHBondContact O-N 3.46Å; L47-P609 HydrophobicContact CD1-CG 4.24Å
48	H	94.9	Very high	91.5	Very high	54 Å²	54	40.8 Å²	40.8	25%	0.25	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139.1	-176.7	-69.5	-124.7	0	0	0	110.2	T46 E105 F433	T46-H48 VanDerWaalsContact CB-NE2 3.32Å; T46-H48 WeakPolarHBondContact CB-NE2 3.25Å; T46-H48 PolarHBondContact OG1-NE2 3.41Å; H48-E105 WeakPolarHBondContact O-CA 3.23Å; H48-F433 WeakPolarHBondContact CE1-CA 3.35Å; H48-F433 WeakPolarHBondContact CE1-CB 3.41Å; H48-F433 AromaticContact CE1-CD1 3.83Å; H48-F433 AromaticContact CE1-CG 3.79Å; H48-F433 PolarHBondContact CE1-O 2.97Å; H48-F433 AromaticContact NE2-CD1 3.59Å
49	K	96.9	Very high	93.5	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.9	175.7	-62.1	-62.5	175.9	-178.4	0	109.6	F57 I75 C99 P100 T102 E104 E105 D107 S464 V465	K49-F57 HydrophobicContact CB-CE1 4.27Å; K49-F57 HydrophobicContact CB-CZ 4.43Å; K49-I75 HydrophobicContact CG-CD1 4.18Å; K49-C99 HydrophobicContact CD-CB 3.94Å; K49-C99 HydrophobicContact CG-CB 3.94Å; K49-P100 WeakPolarHBondContact CE-O 3.42Å; K49-P100 PolarHBondContact NZ-O 2.9Å; K49-T102 WeakPolarHBondContact CE-O 3.39Å; K49-T102 PolarHBondContact NZ-O 3.03Å; K49-T102 PolarHBondContact NZ-OG1 2.99Å; K49-E104 PolarHBondContact NZ-O 3.49Å; K49-E105 WeakPolarHBondContact CA-O 3.5Å; K49-D107 IonicContact NZ-OD1 3.65Å; K49-D107 PolarHBondContact NZ-OD1 2.94Å; K49-D107 IonicContact NZ-OD2 2.99Å; K49-D107 PolarHBondContact NZ-OD2 3.47Å; K49-S464 WeakPolarHBondContact O-CA 3.31Å; K49-V465 HydrophobicContact CB-CB 4.44Å; K49-V465 PolarHBondContact N-O 3.01Å; K49-V465 PolarHBondContact O-N 2.91Å
50	L	96.7	Very high	94.3	Very high	46 Å²	46	40.8 Å²	40.8	24%	0.241	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.6	-171.9	-61.6	179.4	0	0	0	111.3	E105 Y106	L50-E105 HydrophobicContact CD1-CB 4.15Å; L50-E105 HydrophobicContact CD1-CG 4.41Å; L50-E105 HydrophobicContact CG-CB 4.28Å; L50-E105 PolarHBondContact N-O 2.97Å; L50-Y106 HydrophobicContact CB-CD1 4.1Å; L50-Y106 HydrophobicContact CB-CE1 3.62Å; L50-Y106 HydrophobicContact CB-CE2 4.28Å; L50-Y106 HydrophobicContact CD1-CE1 4.37Å; L50-Y106 HydrophobicContact CD1-CE2 3.79Å; L50-Y106 VanDerWaalsContact CD1-OH 3.29Å; L50-Y106 WeakPolarHBondContact CD1-OH 3.41Å
51	G	94.9	Very high	94.6	Very high	17 Å²	17	41.2 Å²	41.2	18%	0.175	21%	0.212	C	C	.	.			trans	-103.6	177.1	176.7	0	0	0	0	0	113.8	D463	G51-D463 PolarHBondContact N-O 2.76Å
52	D	94.6	Very high	94.8	Very high	120 Å²	120	41.3 Å²	41.3	64%	0.642	21%	0.213	S	C	*	.			trans	-66.4	141	170.1	-73.1	-42.8	0	0	0	110.5	G54 T55 D463	D52-G54 PolarHBondContact O-N 3.27Å; D52-T55 HydrophobicContact CB-CG2 3.71Å; D52-T55 WeakPolarHBondContact O-CB 3.49Å; D52-T55 VanDerWaalsContact O-CG2 3.29Å; D52-T55 WeakPolarHBondContact O-CG2 3.27Å; D52-T55 PolarHBondContact O-N 3.43Å; D52-T55 PolarHBondContact O-OG1 2.96Å; D52-D463 VanDerWaalsContact O-CG 3.26Å
53	R	94.2	Very high	95	Very high	236 Å²	236	41 Å²	41	89%	0.891	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	134.8	-178	-69.5	-175.1	177.6	-170.7	-2.5	113.2	D463	R53-D463 WeakPolarHBondContact CA-OD2 3.35Å
54	G	93.8	Very high	95.3	Very high	31 Å²	31	39.5 Å²	39.5	32%	0.32	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	38.2	-179.5	0	0	0	0	0	112.5	D52 R92 D463	D52-G54 PolarHBondContact O-N 3.27Å; G54-R92 PolarHBondContact O-NH1 2.9Å; G54-D463 PolarHBondContact N-OD2 3.49Å
55	T	96	Very high	95.6	Very high	6 Å²	6	36.5 Å²	36.5	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-109.6	-10.7	171.8	64.1	0	0	0	0	113.3	D52 F57 A79 Q81 A82 D463	D52-T55 HydrophobicContact CB-CG2 3.71Å; D52-T55 WeakPolarHBondContact O-CB 3.49Å; D52-T55 VanDerWaalsContact O-CG2 3.29Å; D52-T55 WeakPolarHBondContact O-CG2 3.27Å; D52-T55 PolarHBondContact O-N 3.43Å; D52-T55 PolarHBondContact O-OG1 2.96Å; T55-F57 VanDerWaalsContact C-N 3.26Å; T55-A79 CarbonylContact O-C 3.54Å; T55-Q81 PolarHBondContact O-N 2.69Å; T55-A82 HydrophobicContact CG2-CB 4.3Å; T55-D463 WeakPolarHBondContact CA-OD1 3.47Å; T55-D463 PolarHBondContact N-OD1 2.87Å; T55-D463 PolarHBondContact OG1-OD1 3.32Å
56	F	97	Very high	95.9	Very high	58 Å²	58	33.9 Å²	33.9	25%	0.254	17%	0.169	S	C	.	.			trans	54.5	42.6	-167.7	-56.4	-28.4	0	0	0	111.6	G58 F59 P80 Q81 W128 D463	F56-G58 PolarHBondContact O-N 2.96Å; F56-F59 HydrophobicContact CB-CB 4.13Å; F56-F59 HydrophobicContact CB-CD2 4.3Å; F56-F59 HydrophobicContact CD2-CD2 4.44Å; F56-F59 VanDerWaalsContact O-CB 3.23Å; F56-F59 WeakPolarHBondContact O-CB 3.44Å; F56-F59 PolarHBondContact O-N 2.93Å; F56-P80 WeakPolarHBondContact O-CD 3.24Å; F56-Q81 HydrophobicContact CD2-CG 3.98Å; F56-Q81 HydrophobicContact CE2-CG 4.19Å; F56-Q81 VanDerWaalsContact CE2-NE2 3.29Å; F56-W128 HydrophobicContact CE2-CH2 4.33Å; F56-D463 WeakPolarHBondContact CA-OD1 3.48Å; F56-D463 PolarHBondContact N-OD1 3.45Å
57	F	98.3	Very high	95.9	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	116.6	170.2	179.7	-85	0	0	0	109.3	K49 T55 V77 A79 F97 C108 D463 S464 V465	K49-F57 HydrophobicContact CB-CE1 4.27Å; K49-F57 HydrophobicContact CB-CZ 4.43Å; T55-F57 VanDerWaalsContact C-N 3.26Å; F57-V77 HydrophobicContact CD1-CG1 3.83Å; F57-V77 HydrophobicContact CD2-CB 4.29Å; F57-V77 HydrophobicContact CD2-CG1 3.73Å; F57-V77 HydrophobicContact CE1-CB 4.32Å; F57-V77 HydrophobicContact CE1-CG1 3.75Å; F57-V77 HydrophobicContact CE1-CG2 4.23Å; F57-V77 HydrophobicContact CE2-CB 3.77Å; F57-V77 HydrophobicContact CE2-CG1 3.66Å; F57-V77 HydrophobicContact CE2-CG2 4.28Å; F57-V77 HydrophobicContact CG-CG1 3.81Å; F57-V77 HydrophobicContact CZ-CB 3.77Å; F57-V77 HydrophobicContact CZ-CG1 3.66Å; F57-V77 HydrophobicContact CZ-CG2 3.79Å; F57-A79 HydrophobicContact CB-CB 4.13Å; F57-A79 HydrophobicContact CD2-CB 4.29Å; F57-F97 AromaticContact CD2-CD2 3.91Å; F57-F97 HydrophobicContact CD2-CD2 3.91Å; F57-F97 HydrophobicContact CD2-CE2 4.27Å; F57-F97 HydrophobicContact CD2-CG 4.25Å; F57-F97 HydrophobicContact CE2-CB 3.86Å; F57-F97 HydrophobicContact CE2-CD1 4.44Å; F57-F97 HydrophobicContact CE2-CD2 4.01Å; F57-F97 AromaticContact CE2-CG 3.88Å; F57-F97 HydrophobicContact CE2-CG 3.88Å; F57-C108 HydrophobicContact CE2-CB 4.33Å; F57-C108 HydrophobicContact CZ-CB 4.3Å; F57-D463 HydrophobicContact CB-CB 4.24Å; F57-D463 PolarHBondContact N-OD1 3.18Å; F57-D463 CarbonylContact O-C 3.51Å; F57-D463 WeakPolarHBondContact O-CA 3.42Å; F57-S464 PolarHBondContact O-N 2.9Å; F57-V465 HydrophobicContact CD1-CG2 4.14Å; F57-V465 HydrophobicContact CE1-CB 4.31Å; F57-V465 HydrophobicContact CE1-CG2 3.84Å
58	G	97.5	Very high	95.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.4	1.2	-170.4	0	0	0	0	0	114.3	F56 S60 G78 S441 G459 S460	F56-G58 PolarHBondContact O-N 2.96Å; G58-S60 PolarHBondContact O-N 3.49Å; G58-G78 PolarHBondContact N-O 3.12Å; G58-G78 VanDerWaalsContact N-O 3.13Å; G58-S441 PolarHBondContact O-OG 3.06Å; G58-G459 CarbonylContact O-C 3.2Å; G58-G459 WeakPolarHBondContact O-CA 3.26Å; G58-S460 CarbonylContact C-O 3.59Å; G58-S460 VanDerWaalsContact C-O 3.28Å; G58-S460 WeakPolarHBondContact CA-O 3.34Å
59	F	98.3	Very high	95	Very high	29 Å²	29	43.1 Å²	43.1	13%	0.127	23%	0.225	C	C	.	.	S	Bend	trans	-57.3	-38.4	173.5	-172.2	-82.2	0	0	0	112.4	F56 P80 W128 V131 Y440 S441 L461	F56-F59 HydrophobicContact CB-CB 4.13Å; F56-F59 HydrophobicContact CB-CD2 4.3Å; F56-F59 HydrophobicContact CD2-CD2 4.44Å; F56-F59 VanDerWaalsContact O-CB 3.23Å; F56-F59 WeakPolarHBondContact O-CB 3.44Å; F56-F59 PolarHBondContact O-N 2.93Å; F59-P80 HydrophobicContact CB-CG 3.74Å; F59-P80 HydrophobicContact CD1-CG 3.83Å; F59-P80 HydrophobicContact CD2-CG 4.21Å; F59-P80 HydrophobicContact CG-CG 3.65Å; F59-W128 AromaticContact CE2-CZ3 3.77Å; F59-W128 HydrophobicContact CE2-CZ3 3.77Å; F59-W128 HydrophobicContact CZ-CE3 4.46Å; F59-W128 AromaticContact CZ-CZ3 3.92Å; F59-W128 HydrophobicContact CZ-CZ3 3.92Å; F59-V131 HydrophobicContact CD1-CG2 4.29Å; F59-V131 VanDerWaalsContact CD1-O 3.3Å; F59-V131 WeakPolarHBondContact CD1-O 3.47Å; F59-V131 HydrophobicContact CE1-CB 4.37Å; F59-V131 HydrophobicContact CE1-CG2 3.53Å; F59-V131 VanDerWaalsContact CE1-O 3.32Å; F59-V131 WeakPolarHBondContact CE1-O 3.42Å; F59-V131 HydrophobicContact CZ-CG2 4.13Å; F59-Y440 HydrophobicContact CD1-CE1 4.38Å; F59-Y440 HydrophobicContact CD2-CD1 4.47Å; F59-Y440 AromaticContact CD2-CE1 3.74Å; F59-Y440 HydrophobicContact CD2-CE1 3.74Å; F59-Y440 HydrophobicContact CE1-CE1 4.23Å; F59-Y440 AromaticContact CE2-CE1 3.58Å; F59-Y440 HydrophobicContact CE2-CE1 3.58Å; F59-Y440 AromaticContact CE2-CZ 3.86Å; F59-Y440 WeakPolarHBondContact CE2-OH 3.23Å; F59-Y440 HydrophobicContact CG-CE1 4.13Å; F59-Y440 AromaticContact CZ-CE1 3.84Å; F59-Y440 HydrophobicContact CZ-CE1 3.84Å; F59-S441 WeakPolarHBondContact O-CB 3.47Å; F59-L461 HydrophobicContact CD2-CD2 3.63Å; F59-L461 HydrophobicContact CE2-CD2 4.15Å
60	S	98.4	Very high	94.6	Very high	12 Å²	12	50.3 Å²	50.3	8%	0.084	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.8	167.6	65.3	0	0	0	0	110.2	G58 G78 G130 V131 V133	G58-S60 PolarHBondContact O-N 3.49Å; S60-G78 PolarHBondContact O-N 2.97Å; S60-G130 PolarHBondContact OG-O 2.96Å; S60-V131 WeakPolarHBondContact CB-O 3.48Å; S60-V133 WeakPolarHBondContact OG-CG2 3.44Å; S60-V133 PolarHBondContact OG-N 3.1Å
61	V	98.3	Very high	94.4	Very high	8 Å²	8	53.3 Å²	53.3	5%	0.048	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.9	-178.3	-63.4	0	0	0	0	110.8	L76 V457 V465	V61-L76 CarbonylContact C-O 3.57Å; V61-L76 VanDerWaalsContact CA-O 3.3Å; V61-L76 WeakPolarHBondContact CA-O 3.39Å; V61-V457 HydrophobicContact CB-CG1 4.15Å; V61-V457 HydrophobicContact CG2-CG1 3.98Å; V61-V465 HydrophobicContact CG1-CG1 4.04Å; V61-V465 HydrophobicContact CG1-CG2 3.81Å
62	A	98	Very high	94.2	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.017	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	142.2	169.1	0	0	0	0	0	111.1	L76 V133	A62-L76 HydrophobicContact CB-CB 4.34Å; A62-L76 PolarHBondContact N-O 2.93Å; A62-L76 WeakPolarHBondContact O-CB 3.37Å; A62-L76 PolarHBondContact O-N 3.33Å; A62-V133 HydrophobicContact CB-CG1 3.91Å
63	L	97.5	Very high	94.2	Very high	5 Å²	5	52 Å²	52	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	141.4	167	-63.7	176.9	0	0	0	110.4	I75 S135 S443 L446 I448 D455 V457 L467	L63-I75 HydrophobicContact CD2-CG1 4.4Å; L63-S135 WeakPolarHBondContact O-CB 3.08Å; L63-S135 PolarHBondContact O-OG 2.9Å; L63-S443 PolarHBondContact N-OG 2.77Å; L63-L446 HydrophobicContact CB-CB 4.1Å; L63-L446 HydrophobicContact CB-CD2 3.93Å; L63-L446 HydrophobicContact CB-CG 4.46Å; L63-L446 HydrophobicContact CD1-CB 4.21Å; L63-I448 HydrophobicContact CB-CD1 4.27Å; L63-I448 HydrophobicContact CD2-CD1 4.17Å; L63-I448 HydrophobicContact CD2-CG1 4.23Å; L63-D455 HydrophobicContact CD1-CB 4.44Å; L63-D455 WeakPolarHBondContact CD1-O 3.36Å; L63-V457 HydrophobicContact CD1-CG1 4.49Å; L63-V457 HydrophobicContact CD2-CB 3.95Å; L63-V457 HydrophobicContact CD2-CG1 3.6Å; L63-V457 HydrophobicContact CG-CB 4.45Å; L63-V457 HydrophobicContact CG-CG1 3.72Å; L63-L467 HydrophobicContact CD2-CD1 4.26Å
64	H	96.3	Very high	94.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	139.5	-179.8	-173.4	64.4	0	0	0	111.9	W74 L76 S135 G137 G140 D173	H64-W74 PolarHBondContact N-O 3.31Å; H64-W74 PolarHBondContact O-N 3.37Å; H64-L76 HydrophobicContact CB-CD1 3.66Å; H64-L76 HydrophobicContact CB-CD2 4.48Å; H64-L76 HydrophobicContact CB-CG 3.9Å; H64-S135 PolarHBondContact ND1-OG 2.83Å; H64-G137 PolarHBondContact ND1-O 3.49Å; H64-G140 PolarHBondContact CE1-O 2.92Å; H64-D173 PolarHBondContact NE2-O 3.07Å; H64-D173 VanDerWaalsContact NE2-O 3.15Å
65	Q	94.9	Very high	94.5	Very high	37 Å²	37	40 Å²	40	17%	0.173	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	107.2	171.3	-80.7	-168.7	2.5	0	0	109.1	I138 G139 L446 D447 I448	Q65-I138 HydrophobicContact CB-CB 4.42Å; Q65-I138 HydrophobicContact CB-CG1 4.27Å; Q65-I138 HydrophobicContact CB-CG2 4.29Å; Q65-G139 PolarHBondContact O-N 3.22Å; Q65-L446 HydrophobicContact CG-CD2 4.17Å; Q65-D447 PolarHBondContact NE2-O 3.4Å; Q65-I448 HydrophobicContact CG-CD1 4.4Å
66	Q	92.9	Very high	94.6	Very high	17 Å²	17	39.8 Å²	39.8	8%	0.079	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	138.9	169.8	173.6	176.1	6	0	0	109.1	N68 P71 Q72 D173 D174	Q66-N68 WeakPolarHBondContact CG-O 3.43Å; Q66-N68 PolarHBondContact NE2-O 3.35Å; Q66-P71 CarbonylContact O-C 3.58Å; Q66-P71 VanDerWaalsContact O-CA 3.26Å; Q66-P71 WeakPolarHBondContact O-CA 3.43Å; Q66-Q72 WeakPolarHBondContact CB-O 2.94Å; Q66-Q72 PolarHBondContact N-O 3.36Å; Q66-Q72 PolarHBondContact O-N 3.25Å; Q66-D173 VanDerWaalsContact CB-O 3.29Å; Q66-D173 WeakPolarHBondContact CB-O 3.32Å; Q66-D173 VanDerWaalsContact CG-O 3.25Å; Q66-D173 WeakPolarHBondContact CG-O 3.41Å; Q66-D174 VanDerWaalsContact NE2-CB 3.3Å
67	L	91.8	Very high	94.7	Very high	76 Å²	76	37 Å²	37	40%	0.398	20%	0.199	S	C	.	.			trans	-107	-36.9	173.2	-67	-176.5	0	0	0	112.3	K70 I138 D173	L67-K70 CarbonylContact O-C 3.59Å; L67-K70 PolarHBondContact O-N 3.42Å; L67-I138 HydrophobicContact CD1-CG2 4.16Å; L67-I138 HydrophobicContact CD2-CG2 3.97Å; L67-I138 HydrophobicContact CG-CG2 4.18Å; L67-D173 PolarHBondContact N-OD2 2.85Å
68	N	84.8	Confident	94.7	Very high	94 Å²	94	37 Å²	37	50%	0.503	20%	0.198	S	C	.	.	S	Bend	trans	-115.1	143.4	-176.2	-53.5	-82.7	0	0	0	111	Q66 K70 D173	Q66-N68 WeakPolarHBondContact CG-O 3.43Å; Q66-N68 PolarHBondContact NE2-O 3.35Å; N68-K70 VanDerWaalsContact C-N 3.26Å; N68-D173 WeakPolarHBondContact CB-OD2 3.44Å; N68-D173 PolarHBondContact N-OD2 3.49Å; N68-D173 PolarHBondContact ND2-OD2 2.84Å
69	P	83.8	Confident	94.7	Very high	109 Å²	109	37 Å²	37	71%	0.708	20%	0.198	S	C	*	.	S	Bend	cis	-76.2	-4.8	-5.4	33	-36.6	0	0	0	113.7
70	K	89.1	Confident	94.7	Very high	153 Å²	153	35.6 Å²	35.6	67%	0.665	19%	0.192	S	C	*	.	S	Bend	trans	-145.3	145.5	174.4	-65.8	-175.3	-178	176.4	0	110.5	L67 N68 Q72	L67-K70 CarbonylContact O-C 3.59Å; L67-K70 PolarHBondContact O-N 3.42Å; N68-K70 VanDerWaalsContact C-N 3.26Å; K70-Q72 PolarHBondContact O-N 3.14Å
71	P	91.3	Very high	94.6	Very high	109 Å²	109	37.1 Å²	37.1	71%	0.708	20%	0.198	S	C	*	.			trans	-57.9	121	169.8	-26.4	36	0	0	0	111.4	Q66	Q66-P71 CarbonylContact O-C 3.58Å; Q66-P71 VanDerWaalsContact O-CA 3.26Å; Q66-P71 WeakPolarHBondContact O-CA 3.43Å
72	Q	92.2	Very high	94.4	Very high	84 Å²	84	36.9 Å²	36.9	39%	0.393	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	131.2	175.2	-173	161.5	-4.5	0	0	112	Q66 K70 W74	Q66-Q72 WeakPolarHBondContact CB-O 2.94Å; Q66-Q72 PolarHBondContact N-O 3.36Å; Q66-Q72 PolarHBondContact O-N 3.25Å; K70-Q72 PolarHBondContact O-N 3.14Å; Q72-W74 HydrophobicContact CB-CZ2 4.5Å; Q72-W74 HydrophobicContact CG-CD2 4.28Å; Q72-W74 HydrophobicContact CG-CH2 4.49Å; Q72-W74 HydrophobicContact CG-CZ2 3.83Å; Q72-W74 VanDerWaalsContact NE2-CZ2 3.3Å
73	S	94.4	Very high	94.3	Very high	26 Å²	26	39.6 Å²	39.6	18%	0.182	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	141.3	172.4	-58.6	0	0	0	0	111.7	I448	S73-I448 WeakPolarHBondContact CB-O 3.45Å; S73-I448 PolarHBondContact OG-O 3.05Å
74	W	96	Very high	93.9	Very high	15 Å²	15	39.9 Å²	39.9	6%	0.057	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.4	-178.8	-60.7	106.6	0	0	0	111.5	H64 Q72 L76 R98 P100	H64-W74 PolarHBondContact N-O 3.31Å; H64-W74 PolarHBondContact O-N 3.37Å; Q72-W74 HydrophobicContact CB-CZ2 4.5Å; Q72-W74 HydrophobicContact CG-CD2 4.28Å; Q72-W74 HydrophobicContact CG-CH2 4.49Å; Q72-W74 HydrophobicContact CG-CZ2 3.83Å; Q72-W74 VanDerWaalsContact NE2-CZ2 3.3Å; W74-L76 HydrophobicContact CB-CD2 4.18Å; W74-R98 HydrophobicContact CD2-CB 4.39Å; W74-R98 HydrophobicContact CE3-CB 4.05Å; W74-R98 HydrophobicContact CE3-CG 4.13Å; W74-R98 HydrophobicContact CZ3-CG 4.1Å; W74-P100 HydrophobicContact CE3-CB 4.32Å; W74-P100 HydrophobicContact CZ3-CB 3.93Å; W74-P100 HydrophobicContact CZ3-CG 4.45Å
75	I	97.9	Very high	93.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.6	158.1	-53.2	162.9	0	0	0	106.8	K49 L63 V77 R98 C99 I101 V457 V465 L467	K49-I75 HydrophobicContact CG-CD1 4.18Å; L63-I75 HydrophobicContact CD2-CG1 4.4Å; I75-V77 HydrophobicContact CG2-CG2 3.8Å; I75-R98 CarbonylContact O-C 3.51Å; I75-R98 WeakPolarHBondContact O-CA 3.35Å; I75-C99 HydrophobicContact CB-CB 4.22Å; I75-C99 PolarHBondContact N-O 2.65Å; I75-C99 PolarHBondContact O-N 2.95Å; I75-I101 HydrophobicContact CD1-CD1 4.3Å; I75-I101 HydrophobicContact CG1-CD1 3.81Å; I75-V457 HydrophobicContact CG2-CG2 3.75Å; I75-V465 HydrophobicContact CG2-CG1 4.14Å; I75-L467 HydrophobicContact CD1-CB 3.87Å; I75-L467 HydrophobicContact CD1-CD2 3.85Å; I75-L467 HydrophobicContact CD1-CG 4.44Å; I75-L467 HydrophobicContact CG1-CD2 4.23Å
76	L	98.3	Very high	93.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	129.8	173.4	-55.6	-178.6	0	0	0	109	V61 A62 H64 W74 L96 F97 R98 V133 V142 L175	V61-L76 CarbonylContact C-O 3.57Å; V61-L76 VanDerWaalsContact CA-O 3.3Å; V61-L76 WeakPolarHBondContact CA-O 3.39Å; A62-L76 HydrophobicContact CB-CB 4.34Å; A62-L76 PolarHBondContact N-O 2.93Å; A62-L76 WeakPolarHBondContact O-CB 3.37Å; A62-L76 PolarHBondContact O-N 3.33Å; H64-L76 HydrophobicContact CB-CD1 3.66Å; H64-L76 HydrophobicContact CB-CD2 4.48Å; H64-L76 HydrophobicContact CB-CG 3.9Å; W74-L76 HydrophobicContact CB-CD2 4.18Å; L76-L96 HydrophobicContact CB-CD1 4.31Å; L76-F97 WeakPolarHBondContact CA-O 3.34Å; L76-R98 HydrophobicContact CD2-CB 4.03Å; L76-V133 HydrophobicContact CB-CG1 3.95Å; L76-V133 HydrophobicContact CD1-CG1 4.41Å; L76-V142 HydrophobicContact CD1-CB 4.33Å; L76-V142 HydrophobicContact CD1-CG1 3.66Å; L76-V142 HydrophobicContact CD1-CG2 3.67Å; L76-L175 HydrophobicContact CD1-CD2 4.22Å; L76-L175 HydrophobicContact CD2-CD1 3.75Å; L76-L175 HydrophobicContact CD2-CD2 4.01Å
77	V	98.6	Very high	92.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.9	-174.3	-172.3	0	0	0	0	110.9	F57 I75 F97 V465	F57-V77 HydrophobicContact CD1-CG1 3.83Å; F57-V77 HydrophobicContact CD2-CB 4.29Å; F57-V77 HydrophobicContact CD2-CG1 3.73Å; F57-V77 HydrophobicContact CE1-CB 4.32Å; F57-V77 HydrophobicContact CE1-CG1 3.75Å; F57-V77 HydrophobicContact CE1-CG2 4.23Å; F57-V77 HydrophobicContact CE2-CB 3.77Å; F57-V77 HydrophobicContact CE2-CG1 3.66Å; F57-V77 HydrophobicContact CE2-CG2 4.28Å; F57-V77 HydrophobicContact CG-CG1 3.81Å; F57-V77 HydrophobicContact CZ-CB 3.77Å; F57-V77 HydrophobicContact CZ-CG1 3.66Å; F57-V77 HydrophobicContact CZ-CG2 3.79Å; I75-V77 HydrophobicContact CG2-CG2 3.8Å; V77-F97 HydrophobicContact CB-CB 4.44Å; V77-F97 PolarHBondContact N-O 3.33Å; V77-F97 PolarHBondContact O-N 3.06Å; V77-V465 HydrophobicContact CB-CG2 4.46Å; V77-V465 HydrophobicContact CG1-CG2 3.69Å; V77-V465 HydrophobicContact CG2-CB 4.48Å; V77-V465 HydrophobicContact CG2-CG2 3.88Å
78	G	98.3	Very high	92.3	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	137.1	169.3	0	0	0	0	0	111.5	G58 S60 G130	G58-G78 PolarHBondContact N-O 3.12Å; G58-G78 VanDerWaalsContact N-O 3.13Å; S60-G78 PolarHBondContact O-N 2.97Å; G78-G130 WeakPolarHBondContact CA-O 3.48Å
79	A	98	Very high	92.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	80	175.8	0	0	0	0	0	110.3	T55 F57 Q81 A82 G94 A95 F97	T55-A79 CarbonylContact O-C 3.54Å; F57-A79 HydrophobicContact CB-CB 4.13Å; F57-A79 HydrophobicContact CD2-CB 4.29Å; A79-Q81 PolarHBondContact O-N 2.68Å; A79-Q81 VanDerWaalsContact O-N 3.08Å; A79-A82 HydrophobicContact CB-CB 3.97Å; A79-A82 VanDerWaalsContact O-CB 3.27Å; A79-A82 WeakPolarHBondContact O-CB 3.09Å; A79-A82 PolarHBondContact O-N 2.97Å; A79-G94 CarbonylContact O-C 3.51Å; A79-G94 WeakPolarHBondContact O-CA 3.11Å; A79-A95 PolarHBondContact N-O 3.04Å; A79-A95 PolarHBondContact O-N 3.05Å; A79-F97 HydrophobicContact CB-CD2 3.97Å; A79-F97 HydrophobicContact CB-CE2 3.73Å
80	P	97.2	Very high	92.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.6	-170.8	-29.6	36	0	0	0	116.8	F56 F59 G94 W128 L129	F56-P80 WeakPolarHBondContact O-CD 3.24Å; F59-P80 HydrophobicContact CB-CG 3.74Å; F59-P80 HydrophobicContact CD1-CG 3.83Å; F59-P80 HydrophobicContact CD2-CG 4.21Å; F59-P80 HydrophobicContact CG-CG 3.65Å; P80-G94 VanDerWaalsContact C-CA 3.49Å; P80-G94 WeakPolarHBondContact O-CA 3.21Å; P80-G94 PolarHBondContact O-N 3.44Å; P80-W128 HydrophobicContact CB-CB 3.9Å; P80-W128 HydrophobicContact CB-CD2 3.78Å; P80-W128 HydrophobicContact CB-CE3 3.73Å; P80-W128 HydrophobicContact CB-CG 3.86Å; P80-W128 HydrophobicContact CG-CE3 4.25Å; P80-L129 WeakPolarHBondContact CA-O 3.46Å
81	Q	96.4	Very high	92.5	Very high	45 Å²	45	43.3 Å²	43.3	21%	0.21	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	12.4	179.8	-61.8	-159.6	12.2	0	0	113.9	T55 F56 A79 R92	T55-Q81 PolarHBondContact O-N 2.69Å; F56-Q81 HydrophobicContact CD2-CG 3.98Å; F56-Q81 HydrophobicContact CE2-CG 4.19Å; F56-Q81 VanDerWaalsContact CE2-NE2 3.29Å; A79-Q81 PolarHBondContact O-N 2.68Å; A79-Q81 VanDerWaalsContact O-N 3.08Å; Q81-R92 PolarHBondContact O-NH1 3.16Å
82	A	95.6	Very high	92.7	Very high	3 Å²	3	43.1 Å²	43.1	3%	0.025	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-55.3	138.1	173.4	0	0	0	0	0	112.1	T55 A79 P93 G94 A95 F97	T55-A82 HydrophobicContact CG2-CB 4.3Å; A79-A82 HydrophobicContact CB-CB 3.97Å; A79-A82 VanDerWaalsContact O-CB 3.27Å; A79-A82 WeakPolarHBondContact O-CB 3.09Å; A79-A82 PolarHBondContact O-N 2.97Å; A82-P93 WeakPolarHBondContact O-CD 3.45Å; A82-G94 PolarHBondContact O-N 2.98Å; A82-G94 VanDerWaalsContact O-N 3.11Å; A82-A95 HydrophobicContact CB-CB 3.65Å; A82-F97 HydrophobicContact CB-CE2 4.25Å
83	A	94.1	Very high	92.7	Very high	59 Å²	59	39.2 Å²	39.2	49%	0.488	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-62.8	147.1	-176.9	0	0	0	0	0	112.5	R110	A83-R110 PolarHBondContact O-NH1 2.75Å
84	G	90	Very high	92.8	Very high	10 Å²	10	38 Å²	38	10%	0.103	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-74	154.1	174.8	0	0	0	0	0	112.5	L88 S91 P93	G84-L88 WeakPolarHBondContact CA-O 3.39Å; G84-S91 PolarHBondContact N-O 3.15Å; G84-P93 VanDerWaalsContact N-CD 3.34Å
85	R	88.6	Confident	92.8	Very high	178 Å²	178	37.3 Å²	37.3	67%	0.672	23%	0.232	S	C	*	.			trans	-118.1	159.1	173.8	-66.8	-175.4	176	-178.7	-1	110.1	L88	R85-L88 PolarHBondContact O-N 3.08Å; R85-L88 VanDerWaalsContact O-N 3.15Å
86	G	86.1	Confident	92.8	Very high	54 Å²	54	37.3 Å²	37.3	56%	0.557	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	59.9	-123.1	176.5	0	0	0	0	0	112.2	L88 T89	G86-L88 PolarHBondContact O-N 3.47Å; G86-L88 VanDerWaalsContact O-N 3.15Å; G86-T89 PolarHBondContact N-OG1 3.08Å; G86-T89 WeakPolarHBondContact O-CB 3.42Å; G86-T89 PolarHBondContact O-N 2.56Å; G86-T89 VanDerWaalsContact O-N 3.12Å; G86-T89 PolarHBondContact O-OG1 3.42Å
87	P	82.6	Confident	92.7	Very high	96 Å²	96	38.6 Å²	38.6	62%	0.623	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-64.9	-15.6	180	29.3	-35.8	0	0	0	113.9	V117	P87-V117 HydrophobicContact CB-CG2 4.42Å; P87-V117 HydrophobicContact CG-CG2 3.94Å
88	L	84.6	Confident	92.6	Very high	15 Å²	15	41.8 Å²	41.8	8%	0.079	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-95.2	9	177.2	-65.4	175.4	0	0	0	113.4	G84 R85 G86 G90 S91 P93 V117 K124	G84-L88 WeakPolarHBondContact CA-O 3.39Å; R85-L88 PolarHBondContact O-N 3.08Å; R85-L88 VanDerWaalsContact O-N 3.15Å; G86-L88 PolarHBondContact O-N 3.47Å; G86-L88 VanDerWaalsContact O-N 3.15Å; L88-G90 PolarHBondContact O-N 3.15Å; L88-S91 WeakPolarHBondContact CB-OG 3.4Å; L88-S91 PolarHBondContact O-N 3.24Å; L88-S91 PolarHBondContact O-OG 2.74Å; L88-P93 HydrophobicContact CB-CG 4.46Å; L88-P93 HydrophobicContact CD1-CB 4.07Å; L88-P93 HydrophobicContact CD1-CG 4Å; L88-V117 HydrophobicContact CD1-CG2 3.94Å; L88-V117 HydrophobicContact CD2-CB 4.49Å; L88-V117 HydrophobicContact CD2-CG1 4.08Å; L88-V117 HydrophobicContact CD2-CG2 3.65Å; L88-V117 HydrophobicContact CG-CG2 3.64Å; L88-K124 HydrophobicContact CD1-CB 4.26Å; L88-K124 HydrophobicContact CD1-CD 4.45Å; L88-K124 HydrophobicContact CD2-CB 4.06Å
89	T	86.6	Confident	92.6	Very high	110 Å²	110	41.8 Å²	41.8	68%	0.675	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	123.6	178.8	-56	0	0	0	0	110.5	G86	G86-T89 PolarHBondContact N-OG1 3.08Å; G86-T89 WeakPolarHBondContact O-CB 3.42Å; G86-T89 PolarHBondContact O-N 2.56Å; G86-T89 VanDerWaalsContact O-N 3.12Å; G86-T89 PolarHBondContact O-OG1 3.42Å
90	G	85.4	Confident	92.4	Very high	86 Å²	86	42.8 Å²	42.8	89%	0.887	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.2	-3.5	-174.4	0	0	0	0	0	115.2	L88	L88-G90 PolarHBondContact O-N 3.15Å
91	S	91.3	Very high	92.2	Very high	20 Å²	20	44 Å²	44	14%	0.14	26%	0.263	C	S	.	.	S	Bend	trans	-109.1	167.5	172.4	70.7	0	0	0	0	112.1	G84 L88 P93 D125	G84-S91 PolarHBondContact N-O 3.15Å; L88-S91 WeakPolarHBondContact CB-OG 3.4Å; L88-S91 PolarHBondContact O-N 3.24Å; L88-S91 PolarHBondContact O-OG 2.74Å; S91-P93 VanDerWaalsContact C-CD 3.47Å; S91-P93 WeakPolarHBondContact O-CD 3.27Å; S91-D125 WeakPolarHBondContact CA-OD1 3.38Å; S91-D125 VanDerWaalsContact CB-OD1 3.25Å; S91-D125 WeakPolarHBondContact CB-OD1 3.39Å
92	R	94.1	Very high	92	Very high	105 Å²	105	43.3 Å²	43.3	40%	0.396	26%	0.261	S	S	.	.			trans	-117.6	77	176.5	-69.4	-179.5	176.9	-94.8	8	111.5	G54 Q81 G94 D125 N126	G54-R92 PolarHBondContact O-NH1 2.9Å; Q81-R92 PolarHBondContact O-NH1 3.16Å; R92-G94 VanDerWaalsContact C-N 3.32Å; R92-D125 PolarHBondContact N-OD1 3.46Å; R92-N126 VanDerWaalsContact O-CA 3.27Å; R92-N126 WeakPolarHBondContact O-CA 3.48Å; R92-N126 PolarHBondContact O-N 3.2Å
93	P	93.7	Very high	91.7	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.013	28%	0.281	C	S	.	.			trans	-77.8	-14.8	179.6	33.2	-37	0	0	0	114.2	A82 G84 L88 S91 K124 Q127 L129	A82-P93 WeakPolarHBondContact O-CD 3.45Å; G84-P93 VanDerWaalsContact N-CD 3.34Å; L88-P93 HydrophobicContact CB-CG 4.46Å; L88-P93 HydrophobicContact CD1-CB 4.07Å; L88-P93 HydrophobicContact CD1-CG 4Å; S91-P93 VanDerWaalsContact C-CD 3.47Å; S91-P93 WeakPolarHBondContact O-CD 3.27Å; P93-K124 WeakPolarHBondContact CA-O 3.31Å; P93-K124 HydrophobicContact CB-CB 4.48Å; P93-K124 VanDerWaalsContact CB-O 3.29Å; P93-K124 WeakPolarHBondContact CB-O 3.43Å; P93-Q127 HydrophobicContact CB-CG 4.26Å; P93-Q127 WeakPolarHBondContact O-CG 3.44Å; P93-L129 VanDerWaalsContact O-CB 3.22Å; P93-L129 WeakPolarHBondContact O-CB 3.4Å; P93-L129 PolarHBondContact O-N 3.13Å
94	G	95.5	Very high	91.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	82.8	-180	-170	0	0	0	0	0	113.1	A79 P80 A82 R92 R110 L129	A79-G94 CarbonylContact O-C 3.51Å; A79-G94 WeakPolarHBondContact O-CA 3.11Å; P80-G94 VanDerWaalsContact C-CA 3.49Å; P80-G94 WeakPolarHBondContact O-CA 3.21Å; P80-G94 PolarHBondContact O-N 3.44Å; A82-G94 PolarHBondContact O-N 2.98Å; A82-G94 VanDerWaalsContact O-N 3.11Å; R92-G94 VanDerWaalsContact C-N 3.32Å; G94-R110 PolarHBondContact O-NH2 3.33Å; G94-L129 CarbonylContact C-O 3.55Å; G94-L129 WeakPolarHBondContact CA-O 3.29Å
95	A	95.9	Very high	91.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	158.4	-176.3	0	0	0	0	0	113.1	A79 A82 F97 R110 L129	A79-A95 PolarHBondContact N-O 3.04Å; A79-A95 PolarHBondContact O-N 3.05Å; A82-A95 HydrophobicContact CB-CB 3.65Å; A95-F97 HydrophobicContact CB-CD2 4.08Å; A95-F97 HydrophobicContact CB-CE2 3.65Å; A95-F97 HydrophobicContact CB-CZ 4.37Å; A95-R110 HydrophobicContact CB-CG 4.27Å; A95-R110 VanDerWaalsContact CB-CZ 3.47Å; A95-L129 PolarHBondContact N-O 2.94Å
96	L	97.3	Very high	92.1	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.6	155.2	-179.4	65.6	0	0	0	109.2	L76 V111 I113 V133 V142 T144 L171	L76-L96 HydrophobicContact CB-CD1 4.31Å; L96-V111 HydrophobicContact CB-CB 4.32Å; L96-V111 HydrophobicContact CB-CG2 4.43Å; L96-V111 HydrophobicContact CD2-CB 4.3Å; L96-V111 HydrophobicContact CD2-CG2 4.05Å; L96-V111 HydrophobicContact CG-CB 4.33Å; L96-V111 HydrophobicContact CG-CG2 3.97Å; L96-V111 PolarHBondContact O-N 2.78Å; L96-I113 HydrophobicContact CB-CD1 3.7Å; L96-I113 HydrophobicContact CD2-CD1 3.91Å; L96-I113 HydrophobicContact CG-CD1 4.44Å; L96-V133 HydrophobicContact CD1-CB 4.43Å; L96-V133 HydrophobicContact CD1-CG1 3.9Å; L96-V133 HydrophobicContact CD1-CG2 3.56Å; L96-V142 HydrophobicContact CD2-CG1 4.46Å; L96-T144 HydrophobicContact CB-CG2 4.39Å; L96-T144 HydrophobicContact CD2-CG2 4.14Å; L96-L171 HydrophobicContact CD2-CD1 3.97Å
97	F	97.7	Very high	92.5	Very high	27 Å²	27	51 Å²	51	12%	0.118	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	152.5	169.9	-69.5	-97.8	0	0	0	110.7	F57 L76 V77 A79 A82 A95 C108 E109 R110	F57-F97 AromaticContact CD2-CD2 3.91Å; F57-F97 HydrophobicContact CD2-CD2 3.91Å; F57-F97 HydrophobicContact CD2-CE2 4.27Å; F57-F97 HydrophobicContact CD2-CG 4.25Å; F57-F97 HydrophobicContact CE2-CB 3.86Å; F57-F97 HydrophobicContact CE2-CD1 4.44Å; F57-F97 HydrophobicContact CE2-CD2 4.01Å; F57-F97 AromaticContact CE2-CG 3.88Å; F57-F97 HydrophobicContact CE2-CG 3.88Å; L76-F97 WeakPolarHBondContact CA-O 3.34Å; V77-F97 HydrophobicContact CB-CB 4.44Å; V77-F97 PolarHBondContact N-O 3.33Å; V77-F97 PolarHBondContact O-N 3.06Å; A79-F97 HydrophobicContact CB-CD2 3.97Å; A79-F97 HydrophobicContact CB-CE2 3.73Å; A82-F97 HydrophobicContact CB-CE2 4.25Å; A95-F97 HydrophobicContact CB-CD2 4.08Å; A95-F97 HydrophobicContact CB-CE2 3.65Å; A95-F97 HydrophobicContact CB-CZ 4.37Å; F97-C108 HydrophobicContact CB-CB 4.46Å; F97-C108 HydrophobicContact CD1-CB 4.35Å; F97-E109 CarbonylContact C-O 3.58Å; F97-E109 VanDerWaalsContact CA-O 3.26Å; F97-E109 WeakPolarHBondContact CA-O 3.44Å; F97-R110 HydrophobicContact CD1-CB 4.07Å; F97-R110 HydrophobicContact CE1-CB 3.88Å; F97-R110 HydrophobicContact CZ-CB 4.44Å
98	R	96.7	Very high	93.2	Very high	66 Å²	66	47.6 Å²	47.6	25%	0.249	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.4	166.6	67.2	-176.4	-175.6	-175.4	1.5	108.7	W74 I75 L76 C108 E109 V111 L175	W74-R98 HydrophobicContact CD2-CB 4.39Å; W74-R98 HydrophobicContact CE3-CB 4.05Å; W74-R98 HydrophobicContact CE3-CG 4.13Å; W74-R98 HydrophobicContact CZ3-CG 4.1Å; I75-R98 CarbonylContact O-C 3.51Å; I75-R98 WeakPolarHBondContact O-CA 3.35Å; L76-R98 HydrophobicContact CD2-CB 4.03Å; R98-C108 CarbonylContact O-C 3.59Å; R98-C108 WeakPolarHBondContact O-CA 3.11Å; R98-E109 HydrophobicContact CG-CB 4.05Å; R98-E109 IonicContact CZ-OE2 3.79Å; R98-E109 VanDerWaalsContact CZ-OE2 3.26Å; R98-E109 PolarHBondContact N-O 3.32Å; R98-E109 IonicContact NE-OE2 3.6Å; R98-E109 PolarHBondContact NE-OE2 3.46Å; R98-E109 IonicContact NH2-OE2 3.89Å; R98-E109 PolarHBondContact NH2-OE2 3.15Å; R98-E109 PolarHBondContact O-N 2.92Å; R98-V111 HydrophobicContact CB-CG2 4.17Å; R98-V111 HydrophobicContact CG-CG2 4.25Å; R98-L175 HydrophobicContact CB-CD1 3.79Å; R98-L175 HydrophobicContact CG-CD1 4.29Å
99	C	97.3	Very high	93.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.4	178.5	-49.7	0	0	0	0	109.4	K49 I75 C108	K49-C99 HydrophobicContact CD-CB 3.94Å; K49-C99 HydrophobicContact CG-CB 3.94Å; I75-C99 HydrophobicContact CB-CB 4.22Å; I75-C99 PolarHBondContact N-O 2.65Å; I75-C99 PolarHBondContact O-N 2.95Å; C99-C108 HydrophobicContact CB-CB 4.07Å; C99-C108 WeakPolarHBondContact CB-SG 3.49Å; C99-C108 WeakPolarHBondContact SG-CB 3.47Å; C99-C108 CovalentContact SG-SG 2.04Å; C99-C108 PolarHBondContact SG-SG 3.06Å
100	P	94.9	Very high	94.1	Very high	22 Å²	22	49.3 Å²	49.3	14%	0.143	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	161.1	175.1	29	-31.8	0	0	0	111.8	K49 W74 T102 D107	K49-P100 WeakPolarHBondContact CE-O 3.42Å; K49-P100 PolarHBondContact NZ-O 2.9Å; W74-P100 HydrophobicContact CE3-CB 4.32Å; W74-P100 HydrophobicContact CZ3-CB 3.93Å; W74-P100 HydrophobicContact CZ3-CG 4.45Å; P100-T102 VanDerWaalsContact C-N 3.33Å; P100-T102 HydrophobicContact CB-CG2 4.14Å; P100-T102 HydrophobicContact CG-CG2 4.26Å; P100-T102 PolarHBondContact O-N 2.99Å; P100-T102 PolarHBondContact O-OG1 3.25Å; P100-T102 VanDerWaalsContact O-OG1 3.11Å; P100-D107 WeakPolarHBondContact CG-OD2 3.48Å
101	I	92.9	Very high	94.5	Very high	26 Å²	26	45.8 Å²	45.8	13%	0.133	22%	0.215	C	C	.	.	S	Bend	trans	-83.4	79	179.7	-45.5	-54.7	0	0	0	109.9	L47 I75 I448 L467 P609	L47-I101 HydrophobicContact CD1-CG2 3.67Å; I75-I101 HydrophobicContact CD1-CD1 4.3Å; I75-I101 HydrophobicContact CG1-CD1 3.81Å; I101-I448 HydrophobicContact CD1-CG1 3.64Å; I101-I448 HydrophobicContact CD1-CG2 4.36Å; I101-I448 HydrophobicContact CG1-CG1 3.99Å; I101-I448 HydrophobicContact CG1-CG2 4.47Å; I101-I448 HydrophobicContact CG2-CG2 4.2Å; I101-L467 HydrophobicContact CD1-CD2 4.02Å; I101-L467 HydrophobicContact CG2-CD2 4.17Å; I101-P609 HydrophobicContact CG2-CG 4.04Å
102	T	91.1	Very high	94.3	Very high	30 Å²	30	51.6 Å²	51.6	18%	0.184	24%	0.244	C	C	.	.	S	Bend	trans	-143	151.5	-167.3	43.6	0	0	0	0	110.1	K49 P100 E104 D107	K49-T102 WeakPolarHBondContact CE-O 3.39Å; K49-T102 PolarHBondContact NZ-O 3.03Å; K49-T102 PolarHBondContact NZ-OG1 2.99Å; P100-T102 VanDerWaalsContact C-N 3.33Å; P100-T102 HydrophobicContact CB-CG2 4.14Å; P100-T102 HydrophobicContact CG-CG2 4.26Å; P100-T102 PolarHBondContact O-N 2.99Å; P100-T102 PolarHBondContact O-OG1 3.25Å; P100-T102 VanDerWaalsContact O-OG1 3.11Å; T102-E104 VanDerWaalsContact C-N 3.28Å; T102-E104 WeakPolarHBondContact CB-OE2 2.9Å; T102-E104 PolarHBondContact O-N 3.38Å; T102-D107 WeakPolarHBondContact CB-OD2 3.36Å; T102-D107 PolarHBondContact OG1-OD2 3.29Å
103	P	88.8	Confident	93.8	Very high	66 Å²	66	46.7 Å²	46.7	43%	0.429	23%	0.226	S	C	.	.	S	Bend	trans	-73.7	-11.8	177.1	31.4	-36.8	0	0	0	114.4	L47 E105	L47-P103 HydrophobicContact CD2-CB 4.33Å; P103-E105 PolarHBondContact O-N 3.21Å
104	E	92.4	Very high	92.7	Very high	92 Å²	92	47.7 Å²	47.7	43%	0.43	23%	0.231	S	C	.	.			trans	-69.3	125	176.8	-70.1	87.5	159.8	0	0	112.2	K49 T102 D107	K49-E104 PolarHBondContact NZ-O 3.49Å; T102-E104 VanDerWaalsContact C-N 3.28Å; T102-E104 WeakPolarHBondContact CB-OE2 2.9Å; T102-E104 PolarHBondContact O-N 3.38Å; E104-D107 HydrophobicContact CB-CB 4.2Å
105	E	94.1	Very high	91.4	Very high	94 Å²	94	49.7 Å²	49.7	44%	0.439	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-31.7	-172.5	-66.6	167.3	-173.5	0	0	115	H48 K49 L50 P103	H48-E105 WeakPolarHBondContact O-CA 3.23Å; K49-E105 WeakPolarHBondContact CA-O 3.5Å; L50-E105 HydrophobicContact CD1-CB 4.15Å; L50-E105 HydrophobicContact CD1-CG 4.41Å; L50-E105 HydrophobicContact CG-CB 4.28Å; L50-E105 PolarHBondContact N-O 2.97Å; P103-E105 PolarHBondContact O-N 3.21Å
106	Y	94.5	Very high	90.3	Very high	170 Å²	170	57.9 Å²	57.9	67%	0.667	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	34	-168.5	-65.5	-88.3	0	0	0	113.3	L50	L50-Y106 HydrophobicContact CB-CD1 4.1Å; L50-Y106 HydrophobicContact CB-CE1 3.62Å; L50-Y106 HydrophobicContact CB-CE2 4.28Å; L50-Y106 HydrophobicContact CD1-CE1 4.37Å; L50-Y106 HydrophobicContact CD1-CE2 3.79Å; L50-Y106 VanDerWaalsContact CD1-OH 3.29Å; L50-Y106 WeakPolarHBondContact CD1-OH 3.41Å
107	D	95.2	Very high	89.5	Confident	44 Å²	44	59.6 Å²	59.6	24%	0.235	30%	0.301	C	S	.	.			trans	-103	10.3	-178.3	70.9	-3.6	0	0	0	114.4	K49 P100 T102 E104 E109	K49-D107 IonicContact NZ-OD1 3.65Å; K49-D107 PolarHBondContact NZ-OD1 2.94Å; K49-D107 IonicContact NZ-OD2 2.99Å; K49-D107 PolarHBondContact NZ-OD2 3.47Å; P100-D107 WeakPolarHBondContact CG-OD2 3.48Å; T102-D107 WeakPolarHBondContact CB-OD2 3.36Å; T102-D107 PolarHBondContact OG1-OD2 3.29Å; E104-D107 HydrophobicContact CB-CB 4.2Å; D107-E109 PolarHBondContact O-N 2.98Å
108	C	96.6	Very high	88.9	Confident	24 Å²	24	61.2 Å²	61.2	16%	0.162	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-68.4	127.1	176.7	-61.3	0	0	0	0	112.5	F57 F97 R98 C99	F57-C108 HydrophobicContact CE2-CB 4.33Å; F57-C108 HydrophobicContact CZ-CB 4.3Å; F97-C108 HydrophobicContact CB-CB 4.46Å; F97-C108 HydrophobicContact CD1-CB 4.35Å; R98-C108 CarbonylContact O-C 3.59Å; R98-C108 WeakPolarHBondContact O-CA 3.11Å; C99-C108 HydrophobicContact CB-CB 4.07Å; C99-C108 WeakPolarHBondContact CB-SG 3.49Å; C99-C108 WeakPolarHBondContact SG-CB 3.47Å; C99-C108 CovalentContact SG-SG 2.04Å; C99-C108 PolarHBondContact SG-SG 3.06Å
109	E	95.9	Very high	88.2	Confident	98 Å²	98	63.6 Å²	63.6	46%	0.458	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	136.4	178.5	-63.6	-175	158.2	0	0	111.6	F97 R98 D107 V111	F97-E109 CarbonylContact C-O 3.58Å; F97-E109 VanDerWaalsContact CA-O 3.26Å; F97-E109 WeakPolarHBondContact CA-O 3.44Å; R98-E109 HydrophobicContact CG-CB 4.05Å; R98-E109 IonicContact CZ-OE2 3.79Å; R98-E109 VanDerWaalsContact CZ-OE2 3.26Å; R98-E109 PolarHBondContact N-O 3.32Å; R98-E109 IonicContact NE-OE2 3.6Å; R98-E109 PolarHBondContact NE-OE2 3.46Å; R98-E109 IonicContact NH2-OE2 3.89Å; R98-E109 PolarHBondContact NH2-OE2 3.15Å; R98-E109 PolarHBondContact O-N 2.92Å; D107-E109 PolarHBondContact O-N 2.98Å; E109-V111 PolarHBondContact O-N 2.94Å
110	R	94.8	Very high	87.7	Confident	63 Å²	63	68.3 Å²	68.3	24%	0.238	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.6	172.4	-177.3	176.4	-179.8	133.7	2.6	110.6	A83 G94 A95 F97	A83-R110 PolarHBondContact O-NH1 2.75Å; G94-R110 PolarHBondContact O-NH2 3.33Å; A95-R110 HydrophobicContact CB-CG 4.27Å; A95-R110 VanDerWaalsContact CB-CZ 3.47Å; F97-R110 HydrophobicContact CD1-CB 4.07Å; F97-R110 HydrophobicContact CE1-CB 3.88Å; F97-R110 HydrophobicContact CZ-CB 4.44Å
111	V	93.5	Very high	87.4	Confident	11 Å²	11	74.9 Å²	74.9	7%	0.067	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-74	135	175.1	-172.9	0	0	0	0	110	L96 R98 E109 I113 L171 L175	L96-V111 HydrophobicContact CB-CB 4.32Å; L96-V111 HydrophobicContact CB-CG2 4.43Å; L96-V111 HydrophobicContact CD2-CB 4.3Å; L96-V111 HydrophobicContact CD2-CG2 4.05Å; L96-V111 HydrophobicContact CG-CB 4.33Å; L96-V111 HydrophobicContact CG-CG2 3.97Å; L96-V111 PolarHBondContact O-N 2.78Å; R98-V111 HydrophobicContact CB-CG2 4.17Å; R98-V111 HydrophobicContact CG-CG2 4.25Å; E109-V111 PolarHBondContact O-N 2.94Å; V111-I113 HydrophobicContact CB-CD1 4.33Å; V111-I113 HydrophobicContact CB-CG1 4.17Å; V111-I113 HydrophobicContact CG1-CD1 4.17Å; V111-I113 HydrophobicContact CG1-CG1 3.76Å; V111-I113 PolarHBondContact O-N 3.03Å; V111-L171 HydrophobicContact CG1-CD1 4.09Å; V111-L175 HydrophobicContact CG1-CB 4.1Å; V111-L175 WeakPolarHBondContact CG1-O 3.48Å; V111-L175 HydrophobicContact CG2-CD1 4.39Å
112	N	88.7	Confident	87.2	Confident	142 Å²	142	74.4 Å²	74.4	76%	0.759	38%	0.377	S	S	*	.			trans	-87.8	84.3	-176.5	-172.1	29.3	0	0	0	111.9
113	I	83.4	Confident	87.2	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.015	37%	0.371	C	S	.	.			trans	-101.1	-49.3	-174.9	-54.1	-180	0	0	0	111.9	L96 V111 T144 Y169 L171 R177	L96-I113 HydrophobicContact CB-CD1 3.7Å; L96-I113 HydrophobicContact CD2-CD1 3.91Å; L96-I113 HydrophobicContact CG-CD1 4.44Å; V111-I113 HydrophobicContact CB-CD1 4.33Å; V111-I113 HydrophobicContact CB-CG1 4.17Å; V111-I113 HydrophobicContact CG1-CD1 4.17Å; V111-I113 HydrophobicContact CG1-CG1 3.76Å; V111-I113 PolarHBondContact O-N 3.03Å; I113-T144 HydrophobicContact CD1-CG2 3.53Å; I113-Y169 HydrophobicContact CG2-CD1 3.53Å; I113-Y169 HydrophobicContact CG2-CD2 3.54Å; I113-Y169 HydrophobicContact CG2-CE1 4.03Å; I113-Y169 HydrophobicContact CG2-CE2 4.05Å; I113-Y169 HydrophobicContact CG2-CG 3.25Å; I113-L171 HydrophobicContact CD1-CD1 3.93Å; I113-L171 HydrophobicContact CG1-CD1 4.26Å; I113-L171 HydrophobicContact CG1-CD2 4.31Å; I113-R177 PolarHBondContact O-NE 2.82Å; I113-R177 PolarHBondContact O-NH2 2.94Å; I113-R177 VanDerWaalsContact O-NH2 3.09Å
114	D	70.3	Confident	87.3	Confident	23 Å²	23	70.6 Å²	70.6	12%	0.123	35%	0.352	C	S	.	.			trans	-133.1	113	-165.4	-174.4	13.6	0	0	0	110.7	K124 Q127 L129 Y169	D114-K124 WeakPolarHBondContact OD1-CE 3.41Å; D114-K124 IonicContact OD1-NZ 3.69Å; D114-K124 PolarHBondContact OD1-NZ 3.38Å; D114-K124 VanDerWaalsContact OD2-CD 3.29Å; D114-K124 WeakPolarHBondContact OD2-CD 3.25Å; D114-K124 WeakPolarHBondContact OD2-CE 3.38Å; D114-K124 IonicContact OD2-NZ 2.68Å; D114-Q127 PolarHBondContact OD2-NE2 2.77Å; D114-L129 HydrophobicContact CB-CD2 4.31Å; D114-Y169 HydrophobicContact CB-CE2 4.42Å; D114-Y169 PolarHBondContact OD2-OH 2.99Å
115	G	67.3	Low	87.2	Confident	42 Å²	42	69.6 Å²	69.6	43%	0.433	35%	0.35	S	S	.	.			trans	-143	-15.9	-174.2	0	0	0	0	0	115.9
116	E	72.8	Confident	87.2	Confident	171 Å²	171	68.4 Å²	68.4	80%	0.799	35%	0.346	S	S	*	.			trans	-94.8	136.5	173.6	-65.9	-173.1	-178.9	0	0	109.9	K124	E116-K124 PolarHBondContact O-NZ 3.41Å
117	V	80.7	Confident	87.2	Confident	38 Å²	38	60.3 Å²	60.3	23%	0.23	32%	0.315	C	S	.	.			trans	-137.7	125.2	-173.8	-169.3	0	0	0	0	110.7	P87 L88 L119 E122 K124	P87-V117 HydrophobicContact CB-CG2 4.42Å; P87-V117 HydrophobicContact CG-CG2 3.94Å; L88-V117 HydrophobicContact CD1-CG2 3.94Å; L88-V117 HydrophobicContact CD2-CB 4.49Å; L88-V117 HydrophobicContact CD2-CG1 4.08Å; L88-V117 HydrophobicContact CD2-CG2 3.65Å; L88-V117 HydrophobicContact CG-CG2 3.64Å; V117-L119 HydrophobicContact CG1-CD2 3.76Å; V117-L119 HydrophobicContact CG1-CG 4.2Å; V117-E122 WeakPolarHBondContact CA-OE1 3.44Å; V117-K124 HydrophobicContact CG1-CD 4.42Å; V117-K124 HydrophobicContact CG2-CD 4.25Å
118	S	84.9	Confident	87.3	Confident	61 Å²	61	60.9 Å²	60.9	43%	0.427	31%	0.313	S	S	.	.			trans	-105.5	87.8	173.2	-166.2	0	0	0	0	111.1	D120 R121 E122	S118-D120 PolarHBondContact O-N 3.05Å; S118-R121 CarbonylContact O-C 3.58Å; S118-R121 PolarHBondContact O-N 2.9Å; S118-E122 PolarHBondContact N-OE1 2.69Å; S118-E122 WeakPolarHBondContact O-CG 3.29Å; S118-E122 PolarHBondContact O-N 2.79Å
119	L	83.1	Confident	87.2	Confident	115 Å²	115	59.9 Å²	59.9	60%	0.602	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.8	-176.5	-64.1	176.1	0	0	0	114.7	V117 R121	V117-L119 HydrophobicContact CG1-CD2 3.76Å; V117-L119 HydrophobicContact CG1-CG 4.2Å; L119-R121 VanDerWaalsContact C-N 3.33Å
120	D	85.8	Confident	87.3	Confident	100 Å²	100	55.2 Å²	55.2	54%	0.535	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.4	173.7	-65.3	-52.8	0	0	0	113.4	S118 V155 K156	S118-D120 PolarHBondContact O-N 3.05Å; D120-V155 VanDerWaalsContact O-CG2 3.3Å; D120-V155 WeakPolarHBondContact O-CG2 3.32Å; D120-K156 IonicContact OD1-NZ 2.68Å; D120-K156 PolarHBondContact OD1-NZ 2.98Å
121	R	88.1	Confident	87.4	Confident	159 Å²	159	52.7 Å²	52.7	60%	0.6	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144	-20	-174.1	-144.9	176.5	179.5	-160.3	-6.7	115.4	S118 L119 R152	S118-R121 CarbonylContact O-C 3.58Å; S118-R121 PolarHBondContact O-N 2.9Å; L119-R121 VanDerWaalsContact C-N 3.33Å; R121-R152 PolarHBondContact O-N 3.25Å; R121-R152 VanDerWaalsContact O-O 3.05Å
122	E	89.9	Confident	87.6	Confident	16 Å²	16	52.7 Å²	52.7	8%	0.075	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.4	-178.1	60.5	173.8	-162.4	0	0	113	V117 S118 K124 Y149 E150 R167	V117-E122 WeakPolarHBondContact CA-OE1 3.44Å; S118-E122 PolarHBondContact N-OE1 2.69Å; S118-E122 WeakPolarHBondContact O-CG 3.29Å; S118-E122 PolarHBondContact O-N 2.79Å; E122-K124 VanDerWaalsContact CD-CE 3.49Å; E122-K124 WeakPolarHBondContact OE1-CE 3.33Å; E122-K124 IonicContact OE1-NZ 3.18Å; E122-K124 PolarHBondContact OE1-NZ 3.12Å; E122-K124 WeakPolarHBondContact OE2-CE 3.32Å; E122-K124 IonicContact OE2-NZ 2.88Å; E122-Y149 HydrophobicContact CB-CE2 3.82Å; E122-Y149 WeakPolarHBondContact CB-OH 3.33Å; E122-Y149 WeakPolarHBondContact OE2-CE2 3.33Å; E122-Y149 PolarHBondContact OE2-OH 2.75Å; E122-E150 WeakPolarHBondContact CA-O 3.32Å; E122-R167 IonicContact OE2-CZ 3.09Å; E122-R167 IonicContact OE2-NH1 2.64Å; E122-R167 PolarHBondContact OE2-NH1 3.36Å; E122-R167 IonicContact OE2-NH2 3Å; E122-R167 PolarHBondContact OE2-NH2 2.72Å
123	S	90.4	Very high	88	Confident	10 Å²	10	46.1 Å²	46.1	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.3	168	-178.9	0	0	0	0	110.2	E150 R152	S123-E150 WeakPolarHBondContact CB-OE1 3.32Å; S123-E150 PolarHBondContact N-O 3.17Å; S123-E150 PolarHBondContact O-N 2.97Å; S123-R152 VanDerWaalsContact CB-NH2 3.29Å; S123-R152 PolarHBondContact OG-NH2 3.43Å; S123-R152 VanDerWaalsContact OG-NH2 3.16Å
124	K	90.5	Very high	88.6	Confident	6 Å²	6	50 Å²	50	3%	0.026	26%	0.258	C	S	.	.			trans	-101.5	-7.1	177.1	-65	180	159.2	163.2	0	112.7	L88 P93 D114 E116 V117 E122 N126 Q127 Y149	L88-K124 HydrophobicContact CD1-CB 4.26Å; L88-K124 HydrophobicContact CD1-CD 4.45Å; L88-K124 HydrophobicContact CD2-CB 4.06Å; P93-K124 WeakPolarHBondContact CA-O 3.31Å; P93-K124 HydrophobicContact CB-CB 4.48Å; P93-K124 VanDerWaalsContact CB-O 3.29Å; P93-K124 WeakPolarHBondContact CB-O 3.43Å; D114-K124 WeakPolarHBondContact OD1-CE 3.41Å; D114-K124 IonicContact OD1-NZ 3.69Å; D114-K124 PolarHBondContact OD1-NZ 3.38Å; D114-K124 VanDerWaalsContact OD2-CD 3.29Å; D114-K124 WeakPolarHBondContact OD2-CD 3.25Å; D114-K124 WeakPolarHBondContact OD2-CE 3.38Å; D114-K124 IonicContact OD2-NZ 2.68Å; E116-K124 PolarHBondContact O-NZ 3.41Å; V117-K124 HydrophobicContact CG1-CD 4.42Å; V117-K124 HydrophobicContact CG2-CD 4.25Å; E122-K124 VanDerWaalsContact CD-CE 3.49Å; E122-K124 WeakPolarHBondContact OE1-CE 3.33Å; E122-K124 IonicContact OE1-NZ 3.18Å; E122-K124 PolarHBondContact OE1-NZ 3.12Å; E122-K124 WeakPolarHBondContact OE2-CE 3.32Å; E122-K124 IonicContact OE2-NZ 2.88Å; K124-N126 PolarHBondContact O-N 3.38Å; K124-Q127 HydrophobicContact CB-CG 4.49Å; K124-Q127 VanDerWaalsContact O-CG 3.28Å; K124-Q127 WeakPolarHBondContact O-CG 3.38Å; K124-Q127 PolarHBondContact O-N 2.73Å; K124-Y149 HydrophobicContact CG-CD2 4.36Å; K124-Y149 HydrophobicContact CG-CE2 4.36Å
125	D	91.4	Very high	89.8	Confident	71 Å²	71	50.1 Å²	50.1	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	130.9	170.8	-176	50.6	0	0	0	110.3	S91 R92 Q127	S91-D125 WeakPolarHBondContact CA-OD1 3.38Å; S91-D125 VanDerWaalsContact CB-OD1 3.25Å; S91-D125 WeakPolarHBondContact CB-OD1 3.39Å; R92-D125 PolarHBondContact N-OD1 3.46Å; D125-Q127 PolarHBondContact O-N 3.16Å
126	N	93.6	Very high	91	Very high	69 Å²	69	49.5 Å²	49.5	37%	0.369	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	28.9	-174.6	-64.8	-72	0	0	0	114.9	R92 K124 W128 L148	R92-N126 VanDerWaalsContact O-CA 3.27Å; R92-N126 WeakPolarHBondContact O-CA 3.48Å; R92-N126 PolarHBondContact O-N 3.2Å; K124-N126 PolarHBondContact O-N 3.38Å; N126-W128 VanDerWaalsContact O-CD1 3.26Å; N126-W128 PolarHBondContact O-N 3.21Å; N126-L148 WeakPolarHBondContact O-CB 3.41Å
127	Q	93.9	Very high	92	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.216	C	C	.	.			trans	-69.7	-15.6	174.4	71.5	178.1	-8.1	0	0	114.5	P93 D114 K124 D125 L129 A146 L148	P93-Q127 HydrophobicContact CB-CG 4.26Å; P93-Q127 WeakPolarHBondContact O-CG 3.44Å; D114-Q127 PolarHBondContact OD2-NE2 2.77Å; K124-Q127 HydrophobicContact CB-CG 4.49Å; K124-Q127 VanDerWaalsContact O-CG 3.28Å; K124-Q127 WeakPolarHBondContact O-CG 3.38Å; K124-Q127 PolarHBondContact O-N 2.73Å; D125-Q127 PolarHBondContact O-N 3.16Å; Q127-L129 HydrophobicContact CG-CB 4.37Å; Q127-A146 HydrophobicContact CB-CB 4.13Å; Q127-A146 HydrophobicContact CG-CB 3.9Å; Q127-A146 CarbonylContact O-C 3.45Å; Q127-A146 VanDerWaalsContact O-CA 3.29Å; Q127-A146 WeakPolarHBondContact O-CA 3.45Å; Q127-A146 WeakPolarHBondContact O-CB 3.25Å; Q127-L148 PolarHBondContact O-N 2.88Å; Q127-L148 VanDerWaalsContact O-N 3.11Å
128	W	96.8	Very high	92.6	Very high	55 Å²	55	43.8 Å²	43.8	21%	0.208	22%	0.223	C	C	.	.			trans	59.7	48.5	-178.9	-76	43.8	0	0	0	113.6	F56 F59 P80 N126 G130 V131 H147 L148	F56-W128 HydrophobicContact CE2-CH2 4.33Å; F59-W128 AromaticContact CE2-CZ3 3.77Å; F59-W128 HydrophobicContact CE2-CZ3 3.77Å; F59-W128 HydrophobicContact CZ-CE3 4.46Å; F59-W128 AromaticContact CZ-CZ3 3.92Å; F59-W128 HydrophobicContact CZ-CZ3 3.92Å; P80-W128 HydrophobicContact CB-CB 3.9Å; P80-W128 HydrophobicContact CB-CD2 3.78Å; P80-W128 HydrophobicContact CB-CE3 3.73Å; P80-W128 HydrophobicContact CB-CG 3.86Å; P80-W128 HydrophobicContact CG-CE3 4.25Å; N126-W128 VanDerWaalsContact O-CD1 3.26Å; N126-W128 PolarHBondContact O-N 3.21Å; W128-G130 PolarHBondContact O-N 2.75Å; W128-V131 HydrophobicContact CB-CB 4.4Å; W128-V131 HydrophobicContact CE3-CG2 4.25Å; W128-V131 WeakPolarHBondContact O-CB 2.97Å; W128-V131 PolarHBondContact O-N 3.18Å; W128-V131 VanDerWaalsContact O-N 3.08Å; W128-H147 AromaticContact CE3-CE1 3.83Å; W128-L148 HydrophobicContact CB-CD1 4.49Å; W128-L148 HydrophobicContact CD2-CD1 4.24Å; W128-L148 HydrophobicContact CG-CD1 3.97Å
129	L	96.4	Very high	92.8	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	126.1	171.1	177.6	64.7	0	0	0	110	P80 P93 G94 A95 D114 Q127 T144 C145 A146 Y169	P80-L129 WeakPolarHBondContact CA-O 3.46Å; P93-L129 VanDerWaalsContact O-CB 3.22Å; P93-L129 WeakPolarHBondContact O-CB 3.4Å; P93-L129 PolarHBondContact O-N 3.13Å; G94-L129 CarbonylContact C-O 3.55Å; G94-L129 WeakPolarHBondContact CA-O 3.29Å; A95-L129 PolarHBondContact N-O 2.94Å; D114-L129 HydrophobicContact CB-CD2 4.31Å; Q127-L129 HydrophobicContact CG-CB 4.37Å; L129-T144 HydrophobicContact CD1-CG2 4.16Å; L129-C145 WeakPolarHBondContact CA-O 3.01Å; L129-A146 HydrophobicContact CB-CB 4.07Å; L129-A146 HydrophobicContact CD1-CB 4.28Å; L129-Y169 HydrophobicContact CD1-CD2 3.83Å; L129-Y169 HydrophobicContact CD1-CE2 4Å
130	G	96.7	Very high	93.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94	11	-171.8	0	0	0	0	0	114	S60 G78 W128 S132 C145	S60-G130 PolarHBondContact OG-O 2.96Å; G78-G130 WeakPolarHBondContact CA-O 3.48Å; W128-G130 PolarHBondContact O-N 2.75Å; G130-S132 PolarHBondContact O-N 3.21Å; G130-C145 PolarHBondContact N-O 3.17Å
131	V	97.4	Very high	93.4	Very high	9 Å²	9	33.6 Å²	33.6	6%	0.055	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	-38.6	171.2	67.8	0	0	0	0	111.4	F59 S60 W128 C145 H147 L206	F59-V131 HydrophobicContact CD1-CG2 4.29Å; F59-V131 VanDerWaalsContact CD1-O 3.3Å; F59-V131 WeakPolarHBondContact CD1-O 3.47Å; F59-V131 HydrophobicContact CE1-CB 4.37Å; F59-V131 HydrophobicContact CE1-CG2 3.53Å; F59-V131 VanDerWaalsContact CE1-O 3.32Å; F59-V131 WeakPolarHBondContact CE1-O 3.42Å; F59-V131 HydrophobicContact CZ-CG2 4.13Å; S60-V131 WeakPolarHBondContact CB-O 3.48Å; W128-V131 HydrophobicContact CB-CB 4.4Å; W128-V131 HydrophobicContact CE3-CG2 4.25Å; W128-V131 WeakPolarHBondContact O-CB 2.97Å; W128-V131 PolarHBondContact O-N 3.18Å; W128-V131 VanDerWaalsContact O-N 3.08Å; V131-C145 PolarHBondContact N-O 2.63Å; V131-H147 HydrophobicContact CG1-CB 4.04Å; V131-L206 HydrophobicContact CG2-CD1 4.4Å
132	S	97.6	Very high	93.7	Very high	12 Å²	12	26 Å²	26	8%	0.084	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.2	174.3	70.6	0	0	0	0	109.2	G130 T144 C145 G205 V208	G130-S132 PolarHBondContact O-N 3.21Å; S132-T144 VanDerWaalsContact O-CA 3.26Å; S132-T144 WeakPolarHBondContact O-CA 3.26Å; S132-T144 PolarHBondContact O-OG1 3.02Å; S132-C145 PolarHBondContact O-N 2.61Å; S132-C145 WeakPolarHBondContact OG-CB 3.46Å; S132-G205 PolarHBondContact OG-O 3.36Å; S132-V208 WeakPolarHBondContact OG-CG1 3.4Å
133	V	97.6	Very high	93.9	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.024	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.7	173.6	178.4	0	0	0	0	107.1	S60 A62 L76 L96 V143	S60-V133 WeakPolarHBondContact OG-CG2 3.44Å; S60-V133 PolarHBondContact OG-N 3.1Å; A62-V133 HydrophobicContact CB-CG1 3.91Å; L76-V133 HydrophobicContact CB-CG1 3.95Å; L76-V133 HydrophobicContact CD1-CG1 4.41Å; L96-V133 HydrophobicContact CD1-CB 4.43Å; L96-V133 HydrophobicContact CD1-CG1 3.9Å; L96-V133 HydrophobicContact CD1-CG2 3.56Å; V133-V143 WeakPolarHBondContact CA-O 3.46Å
134	K	96.4	Very high	94.1	Very high	83 Å²	83	24.8 Å²	24.8	36%	0.361	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.1	170.8	-70.4	-65.4	-174.5	173.9	0	110.5	V142 V143 V208 F210	K134-V142 WeakPolarHBondContact O-CA 3.36Å; K134-V143 HydrophobicContact CB-CG1 3.95Å; K134-V143 PolarHBondContact N-O 2.91Å; K134-V143 PolarHBondContact O-N 3.1Å; K134-V208 HydrophobicContact CB-CG1 4.25Å; K134-V208 HydrophobicContact CG-CG1 3.89Å; K134-V208 VanDerWaalsContact CG-O 3.28Å; K134-V208 WeakPolarHBondContact CG-O 3.28Å; K134-F210 HydrophobicContact CB-CD2 4.23Å; K134-F210 HydrophobicContact CB-CE2 4.3Å
135	S	95	Very high	94.4	Very high	26 Å²	26	24.5 Å²	24.5	18%	0.182	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	138.4	-175.4	166.6	0	0	0	0	108	L63 H64 G137	L63-S135 WeakPolarHBondContact O-CB 3.08Å; L63-S135 PolarHBondContact O-OG 2.9Å; H64-S135 PolarHBondContact ND1-OG 2.83Å; S135-G137 PolarHBondContact O-N 2.8Å; S135-G137 PolarHBondContact OG-N 2.83Å
136	Q	92.4	Very high	94.6	Very high	29 Å²	29	21.1 Å²	21.1	14%	0.136	12%	0.117	C	C	.	.			trans	-74.9	7.3	168.3	-74.1	-173.1	-32	0	0	112.9	K141 F210 R214	Q136-K141 PolarHBondContact N-O 2.88Å; Q136-F210 HydrophobicContact CB-CD2 4.43Å; Q136-F210 HydrophobicContact CG-CB 3.93Å; Q136-F210 HydrophobicContact CG-CD1 3.47Å; Q136-F210 VanDerWaalsContact CG-CD1 3.47Å; Q136-F210 HydrophobicContact CG-CD2 3.51Å; Q136-F210 HydrophobicContact CG-CE1 3.67Å; Q136-F210 HydrophobicContact CG-CE2 3.72Å; Q136-F210 HydrophobicContact CG-CG 3.37Å; Q136-F210 HydrophobicContact CG-CZ 3.8Å; Q136-R214 PolarHBondContact NE2-O 3.31Å; Q136-R214 VanDerWaalsContact NE2-O 3.14Å; Q136-R214 PolarHBondContact O-NH2 3.01Å
137	G	92.5	Very high	94.8	Very high	15 Å²	15	18.5 Å²	18.5	16%	0.155	10%	0.103	C	C	.	.	S	Bend	trans	75.5	-135.8	-175.7	0	0	0	0	0	112.1	H64 S135 G139 G140	H64-G137 PolarHBondContact ND1-O 3.49Å; S135-G137 PolarHBondContact O-N 2.8Å; S135-G137 PolarHBondContact OG-N 2.83Å; G137-G139 PolarHBondContact O-N 2.79Å; G137-G140 PolarHBondContact O-N 3.43Å
138	I	93.6	Very high	94.9	Very high	74 Å²	74	21 Å²	21	38%	0.379	12%	0.116	S	C	.	.	B	Isolated β-bridge	trans	-64.8	119.8	-170.9	-46.8	-179.1	0	0	0	111.8	Q65 L67 G140 R214 L446	Q65-I138 HydrophobicContact CB-CB 4.42Å; Q65-I138 HydrophobicContact CB-CG1 4.27Å; Q65-I138 HydrophobicContact CB-CG2 4.29Å; L67-I138 HydrophobicContact CD1-CG2 4.16Å; L67-I138 HydrophobicContact CD2-CG2 3.97Å; L67-I138 HydrophobicContact CG-CG2 4.18Å; I138-G140 PolarHBondContact O-N 3.02Å; I138-G140 VanDerWaalsContact O-N 3.16Å; I138-R214 PolarHBondContact O-NH1 3.43Å; I138-R214 PolarHBondContact O-NH2 2.77Å; I138-L446 HydrophobicContact CD1-CD1 3.98Å; I138-L446 HydrophobicContact CG1-CD1 3.56Å
139	G	90.4	Very high	94.8	Very high	29 Å²	29	18.5 Å²	18.5	30%	0.299	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	17.5	175.6	0	0	0	0	0	114.9	Q65 G137	Q65-G139 PolarHBondContact O-N 3.22Å; G137-G139 PolarHBondContact O-N 2.79Å
140	G	90.1	Very high	94.6	Very high	6 Å²	6	19.7 Å²	19.7	6%	0.062	11%	0.112	C	C	.	.			trans	-102	-179.2	-174.7	0	0	0	0	0	113.7	H64 G137 I138 D173	H64-G140 PolarHBondContact CE1-O 2.92Å; G137-G140 PolarHBondContact O-N 3.43Å; I138-G140 PolarHBondContact O-N 3.02Å; I138-G140 VanDerWaalsContact O-N 3.16Å; G140-D173 WeakPolarHBondContact O-CA 3.3Å
141	K	91	Very high	94.4	Very high	27 Å²	27	20.2 Å²	20.2	12%	0.117	11%	0.114	C	C	.	.			trans	-79	159.8	176.2	-61.3	-168.7	-179.3	-168.5	0	112.2	Q136 V170 L171 D182 F210 A236	Q136-K141 PolarHBondContact N-O 2.88Å; K141-V170 HydrophobicContact CB-CG1 4.17Å; K141-V170 HydrophobicContact CD-CG1 3.9Å; K141-L171 WeakPolarHBondContact CA-O 3.49Å; K141-L171 WeakPolarHBondContact CB-O 3.36Å; K141-D182 WeakPolarHBondContact CE-O 3.49Å; K141-D182 WeakPolarHBondContact CE-OD1 3.1Å; K141-D182 PolarHBondContact NZ-O 2.94Å; K141-D182 IonicContact NZ-OD1 3.55Å; K141-D182 PolarHBondContact NZ-OD1 2.84Å; K141-F210 HydrophobicContact CB-CZ 4.29Å; K141-A236 WeakPolarHBondContact CE-O 3.27Å; K141-A236 PolarHBondContact NZ-O 3.24Å
142	V	93.7	Very high	94.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.1	174.8	170.1	0	0	0	0	108.7	L76 L96 K134 V170 L171 L175	L76-V142 HydrophobicContact CD1-CB 4.33Å; L76-V142 HydrophobicContact CD1-CG1 3.66Å; L76-V142 HydrophobicContact CD1-CG2 3.67Å; L96-V142 HydrophobicContact CD2-CG1 4.46Å; K134-V142 WeakPolarHBondContact O-CA 3.36Å; V142-V170 CarbonylContact O-C 3.55Å; V142-V170 WeakPolarHBondContact O-CA 3.17Å; V142-L171 HydrophobicContact CB-CB 4.37Å; V142-L171 HydrophobicContact CG1-CD1 4.46Å; V142-L171 PolarHBondContact N-O 3.03Å; V142-L171 PolarHBondContact O-N 2.94Å; V142-L175 HydrophobicContact CB-CD2 4.02Å; V142-L175 HydrophobicContact CG1-CD2 4.18Å; V142-L175 HydrophobicContact CG2-CD2 3.74Å
143	V	94	Very high	93.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.8	175.5	64.3	0	0	0	0	110.3	V133 K134 Y169 V170 V208 F210 I217 F219	V133-V143 WeakPolarHBondContact CA-O 3.46Å; K134-V143 HydrophobicContact CB-CG1 3.95Å; K134-V143 PolarHBondContact N-O 2.91Å; K134-V143 PolarHBondContact O-N 3.1Å; V143-Y169 WeakPolarHBondContact CA-O 3.27Å; V143-V170 HydrophobicContact CB-CG2 4.34Å; V143-V170 HydrophobicContact CG2-CG2 3.97Å; V143-V208 HydrophobicContact CB-CG2 4.42Å; V143-V208 HydrophobicContact CG1-CB 4.37Å; V143-V208 HydrophobicContact CG1-CG1 3.83Å; V143-V208 HydrophobicContact CG1-CG2 3.55Å; V143-V208 HydrophobicContact CG2-CG2 3.98Å; V143-F210 HydrophobicContact CB-CE2 4.22Å; V143-F210 HydrophobicContact CB-CZ 3.87Å; V143-F210 HydrophobicContact CG1-CD2 4.36Å; V143-F210 HydrophobicContact CG1-CE2 3.57Å; V143-F210 HydrophobicContact CG1-CZ 3.68Å; V143-I217 HydrophobicContact CG1-CG2 4.47Å; V143-F219 HydrophobicContact CG2-CE1 3.98Å; V143-F219 HydrophobicContact CG2-CZ 4.27Å
144	T	95.9	Very high	93.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146.7	171.7	-172.3	0	0	0	0	111.4	L96 I113 L129 S132 C168 Y169	L96-T144 HydrophobicContact CB-CG2 4.39Å; L96-T144 HydrophobicContact CD2-CG2 4.14Å; I113-T144 HydrophobicContact CD1-CG2 3.53Å; L129-T144 HydrophobicContact CD1-CG2 4.16Å; S132-T144 VanDerWaalsContact O-CA 3.26Å; S132-T144 WeakPolarHBondContact O-CA 3.26Å; S132-T144 PolarHBondContact O-OG1 3.02Å; T144-C168 WeakPolarHBondContact O-CA 3.48Å; T144-Y169 PolarHBondContact N-O 3.14Å; T144-Y169 PolarHBondContact O-N 2.69Å
145	C	96.3	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	162.9	-172.2	-59.2	0	0	0	0	113.3	L129 G130 V131 S132 R167 C168 G205	L129-C145 WeakPolarHBondContact CA-O 3.01Å; G130-C145 PolarHBondContact N-O 3.17Å; V131-C145 PolarHBondContact N-O 2.63Å; S132-C145 PolarHBondContact O-N 2.61Å; S132-C145 WeakPolarHBondContact OG-CB 3.46Å; C145-R167 CarbonylContact C-O 3.57Å; C145-R167 WeakPolarHBondContact CA-O 3.06Å; C145-C168 HydrophobicContact CB-CB 4.08Å; C145-C168 WeakPolarHBondContact CB-SG 3.46Å; C145-C168 WeakPolarHBondContact SG-CB 3.1Å; C145-C168 CovalentContact SG-SG 2.04Å; C145-C168 PolarHBondContact SG-SG 3.43Å; C145-G205 WeakPolarHBondContact CB-O 3.11Å
146	A	96.3	Very high	92.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	77.5	177.4	0	0	0	0	0	107.8	Q127 L129 L148 Y149 G166 R167	Q127-A146 HydrophobicContact CB-CB 4.13Å; Q127-A146 HydrophobicContact CG-CB 3.9Å; Q127-A146 CarbonylContact O-C 3.45Å; Q127-A146 VanDerWaalsContact O-CA 3.29Å; Q127-A146 WeakPolarHBondContact O-CA 3.45Å; Q127-A146 WeakPolarHBondContact O-CB 3.25Å; L129-A146 HydrophobicContact CB-CB 4.07Å; L129-A146 HydrophobicContact CD1-CB 4.28Å; A146-L148 PolarHBondContact O-N 2.92Å; A146-L148 VanDerWaalsContact O-N 3.17Å; A146-Y149 VanDerWaalsContact O-CB 3.22Å; A146-Y149 WeakPolarHBondContact O-CB 3.44Å; A146-Y149 PolarHBondContact O-N 3.33Å; A146-G166 WeakPolarHBondContact O-CA 3.32Å; A146-R167 PolarHBondContact N-O 3.13Å; A146-R167 PolarHBondContact O-N 2.81Å
147	H	96.3	Very high	92.5	Very high	15 Å²	15	37.1 Å²	37.1	7%	0.069	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.8	-171.3	77.3	-55.7	0	0	0	114.9	W128 V131 G166 Q203 L206	W128-H147 AromaticContact CE3-CE1 3.83Å; V131-H147 HydrophobicContact CG1-CB 4.04Å; H147-G166 WeakPolarHBondContact O-CA 3.48Å; H147-Q203 WeakPolarHBondContact O-CA 3.49Å; H147-L206 HydrophobicContact CB-CB 4.27Å; H147-L206 VanDerWaalsContact CD2-CD1 3.47Å; H147-L206 WeakPolarHBondContact CD2-CD1 3.36Å
148	L	95.8	Very high	92.4	Very high	54 Å²	54	43.6 Å²	43.6	28%	0.283	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	11.4	175.3	-68.8	172.1	0	0	0	112.6	N126 Q127 W128 A146 E150	N126-L148 WeakPolarHBondContact O-CB 3.41Å; Q127-L148 PolarHBondContact O-N 2.88Å; Q127-L148 VanDerWaalsContact O-N 3.11Å; W128-L148 HydrophobicContact CB-CD1 4.49Å; W128-L148 HydrophobicContact CD2-CD1 4.24Å; W128-L148 HydrophobicContact CG-CD1 3.97Å; A146-L148 PolarHBondContact O-N 2.92Å; A146-L148 VanDerWaalsContact O-N 3.17Å; L148-E150 PolarHBondContact O-N 3.24Å
149	Y	94.5	Very high	92.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.008	22%	0.221	C	C	.	.			trans	-53.4	126.1	171.1	165.9	-90.8	0	0	0	110.4	E122 K124 A146 L151 P164 I165 G166 R167	E122-Y149 HydrophobicContact CB-CE2 3.82Å; E122-Y149 WeakPolarHBondContact CB-OH 3.33Å; E122-Y149 WeakPolarHBondContact OE2-CE2 3.33Å; E122-Y149 PolarHBondContact OE2-OH 2.75Å; K124-Y149 HydrophobicContact CG-CD2 4.36Å; K124-Y149 HydrophobicContact CG-CE2 4.36Å; A146-Y149 VanDerWaalsContact O-CB 3.22Å; A146-Y149 WeakPolarHBondContact O-CB 3.44Å; A146-Y149 PolarHBondContact O-N 3.33Å; Y149-L151 HydrophobicContact CE1-CB 4.36Å; Y149-P164 CarbonylContact O-C 3.21Å; Y149-I165 HydrophobicContact CD1-CD1 4.43Å; Y149-I165 HydrophobicContact CD1-CG1 3.9Å; Y149-I165 HydrophobicContact CE1-CD1 4.04Å; Y149-I165 HydrophobicContact CE1-CG1 3.93Å; Y149-I165 PolarHBondContact O-N 3.43Å; Y149-I165 VanDerWaalsContact O-N 3.16Å; Y149-G166 PolarHBondContact O-N 3.44Å; Y149-R167 HydrophobicContact CD1-CB 3.79Å; Y149-R167 HydrophobicContact CD2-CB 4.39Å; Y149-R167 VanDerWaalsContact CE2-CZ 3.42Å; Y149-R167 VanDerWaalsContact CE2-NH2 3.32Å; Y149-R167 HydrophobicContact CG-CB 3.68Å; Y149-R167 VanDerWaalsContact CZ-CZ 3.5Å; Y149-R167 PolarHBondContact OH-NH2 3.23Å
150	E	92.9	Very high	92.2	Very high	28 Å²	28	44.2 Å²	44.2	13%	0.131	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.9	-171.2	177.8	-164.3	104.7	0	0	110.5	E122 S123 L148 R152 R162 D163	E122-E150 WeakPolarHBondContact CA-O 3.32Å; S123-E150 WeakPolarHBondContact CB-OE1 3.32Å; S123-E150 PolarHBondContact N-O 3.17Å; S123-E150 PolarHBondContact O-N 2.97Å; L148-E150 PolarHBondContact O-N 3.24Å; E150-R152 HydrophobicContact CG-CG 4.47Å; E150-R152 WeakPolarHBondContact OE1-CG 3.05Å; E150-R152 IonicContact OE1-CZ 2.72Å; E150-R152 IonicContact OE1-NE 3.44Å; E150-R152 PolarHBondContact OE1-NE 3.28Å; E150-R152 IonicContact OE1-NH2 3.69Å; E150-R152 PolarHBondContact OE1-NH2 3.35Å; E150-R162 VanDerWaalsContact CD-NH2 3.31Å; E150-R162 HydrophobicContact CG-CB 4.03Å; E150-R162 IonicContact OE1-CZ 3.81Å; E150-R162 IonicContact OE1-NE 3.6Å; E150-R162 PolarHBondContact OE1-NE 2.85Å; E150-R162 IonicContact OE1-NH2 3.47Å; E150-R162 PolarHBondContact OE1-NH2 3.46Å; E150-R162 VanDerWaalsContact OE1-NH2 3.08Å; E150-R162 IonicContact OE2-CZ 2.73Å; E150-R162 IonicContact OE2-NE 3.63Å; E150-R162 PolarHBondContact OE2-NE 2.9Å; E150-R162 IonicContact OE2-NH2 2.72Å; E150-R162 PolarHBondContact OE2-NH2 2.8Å; E150-D163 WeakPolarHBondContact CA-O 3.48Å
151	L	91.8	Very high	92.1	Very high	11 Å²	11	45.9 Å²	45.9	6%	0.058	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	134.5	168.3	-170.5	72.2	0	0	0	109.2	Y149 D163 I165 E190	Y149-L151 HydrophobicContact CE1-CB 4.36Å; L151-D163 PolarHBondContact N-O 3.28Å; L151-D163 PolarHBondContact O-N 3.07Å; L151-I165 HydrophobicContact CB-CD1 3.89Å; L151-I165 HydrophobicContact CB-CG1 4.14Å; L151-I165 HydrophobicContact CD2-CD1 4.15Å; L151-E190 HydrophobicContact CD2-CG 4.05Å
152	R	91.6	Very high	92.2	Very high	49 Å²	49	50.8 Å²	50.8	19%	0.185	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.6	175.5	-60.3	-168.1	174.1	162.9	4.5	111.3	R121 S123 E150 V155 E160 T161 R162	R121-R152 PolarHBondContact O-N 3.25Å; R121-R152 VanDerWaalsContact O-O 3.05Å; S123-R152 VanDerWaalsContact CB-NH2 3.29Å; S123-R152 PolarHBondContact OG-NH2 3.43Å; S123-R152 VanDerWaalsContact OG-NH2 3.16Å; E150-R152 HydrophobicContact CG-CG 4.47Å; E150-R152 WeakPolarHBondContact OE1-CG 3.05Å; E150-R152 IonicContact OE1-CZ 2.72Å; E150-R152 IonicContact OE1-NE 3.44Å; E150-R152 PolarHBondContact OE1-NE 3.28Å; E150-R152 IonicContact OE1-NH2 3.69Å; E150-R152 PolarHBondContact OE1-NH2 3.35Å; R152-V155 HydrophobicContact CB-CG2 3.42Å; R152-V155 VanDerWaalsContact CB-CG2 3.42Å; R152-V155 HydrophobicContact CG-CG2 4.36Å; R152-E160 IonicContact NE-OE1 3.3Å; R152-T161 WeakPolarHBondContact CA-O 3.4Å; R152-R162 HydrophobicContact CG-CG 4.3Å
153	Q	87.3	Confident	92.1	Very high	71 Å²	71	51.4 Å²	51.4	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.6	172.3	-59.6	-171.4	5.8	0	0	110.5	V155 E160 T161	Q153-V155 VanDerWaalsContact C-N 3.29Å; Q153-V155 PolarHBondContact O-N 2.88Å; Q153-E160 VanDerWaalsContact O-CA 3.3Å; Q153-E160 WeakPolarHBondContact O-CA 3.49Å; Q153-T161 PolarHBondContact N-O 2.88Å; Q153-T161 PolarHBondContact O-N 2.82Å
154	R	89.3	Confident	92.1	Very high	108 Å²	108	52.5 Å²	52.5	41%	0.408	26%	0.258	S	S	.	.	S	Bend	trans	57.8	40.8	-178.1	-59.7	163.3	-72.3	-170.8	-4	112.3	K156 Q157 S159 E160 T161	R154-K156 PolarHBondContact O-N 2.85Å; R154-Q157 HydrophobicContact CB-CB 4.21Å; R154-Q157 HydrophobicContact CB-CG 4.33Å; R154-Q157 VanDerWaalsContact O-CB 3.23Å; R154-Q157 WeakPolarHBondContact O-CB 3.49Å; R154-Q157 WeakPolarHBondContact O-CG 3.24Å; R154-Q157 PolarHBondContact O-N 2.88Å; R154-S159 PolarHBondContact NE-O 3.02Å; R154-S159 PolarHBondContact NH2-O 3.5Å; R154-E160 WeakPolarHBondContact O-CB 3.4Å; R154-T161 PolarHBondContact NH2-OG1 2.77Å; R154-T161 VanDerWaalsContact NH2-OG1 3.09Å
155	V	88.9	Confident	92	Very high	23 Å²	23	52.8 Å²	52.8	14%	0.139	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	136.2	-179.4	174.5	0	0	0	0	111.4	D120 R152 Q153 Q157 E160	D120-V155 VanDerWaalsContact O-CG2 3.3Å; D120-V155 WeakPolarHBondContact O-CG2 3.32Å; R152-V155 HydrophobicContact CB-CG2 3.42Å; R152-V155 VanDerWaalsContact CB-CG2 3.42Å; R152-V155 HydrophobicContact CG-CG2 4.36Å; Q153-V155 VanDerWaalsContact C-N 3.29Å; Q153-V155 PolarHBondContact O-N 2.88Å; V155-Q157 PolarHBondContact O-N 2.02Å; V155-E160 WeakPolarHBondContact CA-OE2 3.39Å
156	K	87.5	Confident	91.9	Very high	162 Å²	162	52.8 Å²	52.8	70%	0.704	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	16.6	-174.9	-56	140.8	-176.3	167.1	0	114.5	D120 R154 E160	D120-K156 IonicContact OD1-NZ 2.68Å; D120-K156 PolarHBondContact OD1-NZ 2.98Å; R154-K156 PolarHBondContact O-N 2.85Å; K156-E160 PolarHBondContact N-OE2 3.14Å
157	Q	92.7	Very high	91.6	Very high	106 Å²	106	53 Å²	53	50%	0.495	26%	0.26	S	S	.	.	S	Bend	trans	-108.6	154.7	171.5	-52.8	-176.2	2.4	0	0	110.9	R154 V155 S159 E160	R154-Q157 HydrophobicContact CB-CB 4.21Å; R154-Q157 HydrophobicContact CB-CG 4.33Å; R154-Q157 VanDerWaalsContact O-CB 3.23Å; R154-Q157 WeakPolarHBondContact O-CB 3.49Å; R154-Q157 WeakPolarHBondContact O-CG 3.24Å; R154-Q157 PolarHBondContact O-N 2.88Å; V155-Q157 PolarHBondContact O-N 2.02Å; Q157-S159 PolarHBondContact O-N 2.91Å; Q157-E160 WeakPolarHBondContact O-CB 3.29Å; Q157-E160 PolarHBondContact O-N 3.22Å
158	P	89.9	Confident	91.5	Very high	151 Å²	151	52.2 Å²	52.2	98%	0.981	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-13	175.8	-23.8	34.8	0	0	0	114.9
159	S	90.1	Very high	91.2	Very high	53 Å²	53	49.7 Å²	49.7	37%	0.371	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	19	177	53	0	0	0	0	112.9	R154 Q157 T161	R154-S159 PolarHBondContact NE-O 3.02Å; R154-S159 PolarHBondContact NH2-O 3.5Å; Q157-S159 PolarHBondContact O-N 2.91Å; S159-T161 PolarHBondContact O-N 3.04Å
160	E	90.3	Very high	91	Very high	62 Å²	62	49.8 Å²	49.8	29%	0.29	24%	0.244	S	C	.	.			trans	-56	127	174.1	-174.9	172	153.1	0	0	110.7	R152 Q153 R154 V155 K156 Q157 R162	R152-E160 IonicContact NE-OE1 3.3Å; Q153-E160 VanDerWaalsContact O-CA 3.3Å; Q153-E160 WeakPolarHBondContact O-CA 3.49Å; R154-E160 WeakPolarHBondContact O-CB 3.4Å; V155-E160 WeakPolarHBondContact CA-OE2 3.39Å; K156-E160 PolarHBondContact N-OE2 3.14Å; Q157-E160 WeakPolarHBondContact O-CB 3.29Å; Q157-E160 PolarHBondContact O-N 3.22Å; E160-R162 HydrophobicContact CG-CG 4.46Å
161	T	88.9	Confident	90.8	Very high	42 Å²	42	48.5 Å²	48.5	26%	0.258	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.4	172.5	49.3	0	0	0	0	110.1	R152 Q153 R154 S159 Q194	R152-T161 WeakPolarHBondContact CA-O 3.4Å; Q153-T161 PolarHBondContact N-O 2.88Å; Q153-T161 PolarHBondContact O-N 2.82Å; R154-T161 PolarHBondContact NH2-OG1 2.77Å; R154-T161 VanDerWaalsContact NH2-OG1 3.09Å; S159-T161 PolarHBondContact O-N 3.04Å; T161-Q194 PolarHBondContact OG1-NE2 2.86Å
162	R	91.6	Very high	90.7	Very high	129 Å²	129	48.2 Å²	48.2	49%	0.487	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	99.9	-174.2	-64.5	-177.9	64.2	-177.2	-4.9	107.4	E150 R152 E160 P164	E150-R162 VanDerWaalsContact CD-NH2 3.31Å; E150-R162 HydrophobicContact CG-CB 4.03Å; E150-R162 IonicContact OE1-CZ 3.81Å; E150-R162 IonicContact OE1-NE 3.6Å; E150-R162 PolarHBondContact OE1-NE 2.85Å; E150-R162 IonicContact OE1-NH2 3.47Å; E150-R162 PolarHBondContact OE1-NH2 3.46Å; E150-R162 VanDerWaalsContact OE1-NH2 3.08Å; E150-R162 IonicContact OE2-CZ 2.73Å; E150-R162 IonicContact OE2-NE 3.63Å; E150-R162 PolarHBondContact OE2-NE 2.9Å; E150-R162 IonicContact OE2-NH2 2.72Å; E150-R162 PolarHBondContact OE2-NH2 2.8Å; R152-R162 HydrophobicContact CG-CG 4.3Å; E160-R162 HydrophobicContact CG-CG 4.46Å; R162-P164 WeakPolarHBondContact O-CD 3.47Å
163	D	92.8	Very high	90.6	Very high	13 Å²	13	46.7 Å²	46.7	7%	0.07	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	108.2	-170.4	-61.4	-51.2	0	0	0	109.3	E150 L151 I165 Q194 G200	E150-D163 WeakPolarHBondContact CA-O 3.48Å; L151-D163 PolarHBondContact N-O 3.28Å; L151-D163 PolarHBondContact O-N 3.07Å; D163-I165 HydrophobicContact CB-CG2 3.86Å; D163-I165 PolarHBondContact O-N 3.22Å; D163-Q194 PolarHBondContact OD2-NE2 2.81Å; D163-G200 CarbonylContact C-O 3.59Å; D163-G200 WeakPolarHBondContact CA-O 3.42Å; D163-G200 WeakPolarHBondContact CB-O 3.36Å
164	P	94	Very high	90.7	Very high	24 Å²	24	44.3 Å²	44.3	16%	0.156	22%	0.222	C	C	.	.			trans	-74	73.3	175	31.1	-35	0	0	0	110.6	Y149 R162 G200 F201 Q203	Y149-P164 CarbonylContact O-C 3.21Å; R162-P164 WeakPolarHBondContact O-CD 3.47Å; P164-G200 VanDerWaalsContact CD-O 3.24Å; P164-G200 WeakPolarHBondContact CD-O 3.46Å; P164-F201 HydrophobicContact CG-CD1 3.57Å; P164-F201 HydrophobicContact CG-CE1 3.93Å; P164-F201 HydrophobicContact CG-CG 4.25Å; P164-F201 CarbonylContact O-C 3.18Å; P164-Q203 PolarHBondContact O-N 2.92Å
165	I	93.2	Very high	90.8	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.026	21%	0.205	C	C	.	.			trans	-75.8	-28.4	-177	61.9	169.2	0	0	0	112.6	Y149 L151 D163 C189 E190 C202 Q203 Q204	Y149-I165 HydrophobicContact CD1-CD1 4.43Å; Y149-I165 HydrophobicContact CD1-CG1 3.9Å; Y149-I165 HydrophobicContact CE1-CD1 4.04Å; Y149-I165 HydrophobicContact CE1-CG1 3.93Å; Y149-I165 PolarHBondContact O-N 3.43Å; Y149-I165 VanDerWaalsContact O-N 3.16Å; L151-I165 HydrophobicContact CB-CD1 3.89Å; L151-I165 HydrophobicContact CB-CG1 4.14Å; L151-I165 HydrophobicContact CD2-CD1 4.15Å; D163-I165 HydrophobicContact CB-CG2 3.86Å; D163-I165 PolarHBondContact O-N 3.22Å; I165-C189 HydrophobicContact CB-CB 3.96Å; I165-C189 HydrophobicContact CG2-CB 4.48Å; I165-E190 HydrophobicContact CD1-CB 3.84Å; I165-C202 WeakPolarHBondContact O-CB 3.49Å; I165-C202 PolarHBondContact O-SG 2.79Å; I165-C202 VanDerWaalsContact O-SG 3.34Å; I165-Q203 PolarHBondContact O-N 3.27Å; I165-Q203 VanDerWaalsContact O-N 3.08Å; I165-Q204 VanDerWaalsContact O-CG 3.23Å; I165-Q204 WeakPolarHBondContact O-CG 3.43Å; I165-Q204 PolarHBondContact O-N 3.25Å
166	G	93.9	Very high	90.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.			trans	82.2	160.3	-172.3	0	0	0	0	0	113.7	A146 H147 Y149 Q204	A146-G166 WeakPolarHBondContact O-CA 3.32Å; H147-G166 WeakPolarHBondContact O-CA 3.48Å; Y149-G166 PolarHBondContact O-N 3.44Å; G166-Q204 VanDerWaalsContact C-CG 3.42Å; G166-Q204 WeakPolarHBondContact O-CG 3.44Å
167	R	91.4	Very high	90.2	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.015	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	148.3	-179	-179.9	178	-75.3	-176	7.9	110.7	E122 C145 A146 Y149 Y169 E185 K187	E122-R167 IonicContact OE2-CZ 3.09Å; E122-R167 IonicContact OE2-NH1 2.64Å; E122-R167 PolarHBondContact OE2-NH1 3.36Å; E122-R167 IonicContact OE2-NH2 3Å; E122-R167 PolarHBondContact OE2-NH2 2.72Å; C145-R167 CarbonylContact C-O 3.57Å; C145-R167 WeakPolarHBondContact CA-O 3.06Å; A146-R167 PolarHBondContact N-O 3.13Å; A146-R167 PolarHBondContact O-N 2.81Å; Y149-R167 HydrophobicContact CD1-CB 3.79Å; Y149-R167 HydrophobicContact CD2-CB 4.39Å; Y149-R167 VanDerWaalsContact CE2-CZ 3.42Å; Y149-R167 VanDerWaalsContact CE2-NH2 3.32Å; Y149-R167 HydrophobicContact CG-CB 3.68Å; Y149-R167 VanDerWaalsContact CZ-CZ 3.5Å; Y149-R167 PolarHBondContact OH-NH2 3.23Å; R167-Y169 VanDerWaalsContact CD-OH 3.22Å; R167-Y169 WeakPolarHBondContact CD-OH 3.45Å; R167-Y169 HydrophobicContact CG-CE2 4.29Å; R167-E185 VanDerWaalsContact CD-OE1 3.24Å; R167-E185 WeakPolarHBondContact CD-OE1 3.47Å; R167-E185 HydrophobicContact CG-CG 4.11Å; R167-E185 IonicContact CZ-OE1 2.97Å; R167-E185 VanDerWaalsContact CZ-OE1 3.3Å; R167-E185 IonicContact NE-OE1 3.52Å; R167-E185 PolarHBondContact NE-OE1 2.83Å; R167-E185 IonicContact NH1-OE1 2.69Å; R167-E185 PolarHBondContact NH1-OE1 2.87Å; R167-E185 IonicContact NH1-OE2 3.26Å; R167-K187 HydrophobicContact CG-CG 4.2Å
168	C	92.3	Very high	88.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.5	174.1	-63.9	0	0	0	0	112.4	T144 C145 E185 W186 F219	T144-C168 WeakPolarHBondContact O-CA 3.48Å; C145-C168 HydrophobicContact CB-CB 4.08Å; C145-C168 WeakPolarHBondContact CB-SG 3.46Å; C145-C168 WeakPolarHBondContact SG-CB 3.1Å; C145-C168 CovalentContact SG-SG 2.04Å; C145-C168 PolarHBondContact SG-SG 3.43Å; C168-E185 CarbonylContact O-C 3.25Å; C168-W186 HydrophobicContact CB-CB 4.19Å; C168-W186 PolarHBondContact N-O 2.99Å; C168-W186 PolarHBondContact O-N 2.91Å; C168-F219 HydrophobicContact CB-CD1 4.48Å; C168-F219 HydrophobicContact CB-CE1 3.73Å; C168-F219 HydrophobicContact CB-CZ 4.38Å; C168-F219 VanDerWaalsContact SG-CE1 3.52Å
169	Y	90.9	Very high	87.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.9	177.5	-62.6	-82	0	0	0	109.2	I113 D114 L129 V143 T144 R167 E185	I113-Y169 HydrophobicContact CG2-CD1 3.53Å; I113-Y169 HydrophobicContact CG2-CD2 3.54Å; I113-Y169 HydrophobicContact CG2-CE1 4.03Å; I113-Y169 HydrophobicContact CG2-CE2 4.05Å; I113-Y169 HydrophobicContact CG2-CG 3.25Å; D114-Y169 HydrophobicContact CB-CE2 4.42Å; D114-Y169 PolarHBondContact OD2-OH 2.99Å; L129-Y169 HydrophobicContact CD1-CD2 3.83Å; L129-Y169 HydrophobicContact CD1-CE2 4Å; V143-Y169 WeakPolarHBondContact CA-O 3.27Å; T144-Y169 PolarHBondContact N-O 3.14Å; T144-Y169 PolarHBondContact O-N 2.69Å; R167-Y169 VanDerWaalsContact CD-OH 3.22Å; R167-Y169 WeakPolarHBondContact CD-OH 3.45Å; R167-Y169 HydrophobicContact CG-CE2 4.29Å; Y169-E185 HydrophobicContact CD1-CB 4.29Å; Y169-E185 HydrophobicContact CD1-CG 4.04Å; Y169-E185 HydrophobicContact CE1-CB 4.19Å; Y169-E185 HydrophobicContact CE1-CG 3.56Å; Y169-E185 VanDerWaalsContact CE1-OE1 3.23Å; Y169-E185 WeakPolarHBondContact CE1-OE1 3.3Å; Y169-E185 PolarHBondContact OH-OE1 2.77Å
170	V	89.7	Confident	85.4	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.7	171.7	179.5	0	0	0	0	108.4	K141 V142 V143 G183 G184 I217	K141-V170 HydrophobicContact CB-CG1 4.17Å; K141-V170 HydrophobicContact CD-CG1 3.9Å; V142-V170 CarbonylContact O-C 3.55Å; V142-V170 WeakPolarHBondContact O-CA 3.17Å; V143-V170 HydrophobicContact CB-CG2 4.34Å; V143-V170 HydrophobicContact CG2-CG2 3.97Å; V170-G183 CarbonylContact O-C 3.56Å; V170-G183 VanDerWaalsContact O-C 3.25Å; V170-G183 WeakPolarHBondContact O-CA 3.49Å; V170-G184 PolarHBondContact N-O 2.96Å; V170-I217 HydrophobicContact CG1-CD1 4.28Å; V170-I217 HydrophobicContact CG2-CD1 3.59Å
171	L	89.8	Confident	83.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149.8	-176.4	-50.3	176.2	0	0	0	110.1	L96 V111 I113 K141 V142 L175 T176 R177	L96-L171 HydrophobicContact CD2-CD1 3.97Å; V111-L171 HydrophobicContact CG1-CD1 4.09Å; I113-L171 HydrophobicContact CD1-CD1 3.93Å; I113-L171 HydrophobicContact CG1-CD1 4.26Å; I113-L171 HydrophobicContact CG1-CD2 4.31Å; K141-L171 WeakPolarHBondContact CA-O 3.49Å; K141-L171 WeakPolarHBondContact CB-O 3.36Å; V142-L171 HydrophobicContact CB-CB 4.37Å; V142-L171 HydrophobicContact CG1-CD1 4.46Å; V142-L171 PolarHBondContact N-O 3.03Å; V142-L171 PolarHBondContact O-N 2.94Å; L171-L175 HydrophobicContact CD1-CB 4.44Å; L171-L175 HydrophobicContact CD1-CD2 4.46Å; L171-T176 WeakPolarHBondContact CA-O 3.37Å; L171-R177 HydrophobicContact CD2-CG 3.72Å
172	S	89	Confident	81.4	Confident	6 Å²	6	47.9 Å²	47.9	4%	0.042	23%	0.232	C	C	.	.			trans	-71.3	176.4	171.4	45.4	0	0	0	0	112.6	D174 L175 T176	S172-D174 PolarHBondContact O-N 3.48Å; S172-D174 VanDerWaalsContact O-N 3.16Å; S172-D174 PolarHBondContact OG-OD1 2.87Å; S172-L175 WeakPolarHBondContact O-CA 3.32Å; S172-L175 PolarHBondContact O-N 2.8Å; S172-T176 PolarHBondContact N-O 2.94Å; S172-T176 PolarHBondContact OG-O 2.91Å; S172-T176 VanDerWaalsContact OG-O 3.1Å; S172-T176 PolarHBondContact OG-OG1 2.83Å
173	D	89.6	Confident	79.7	Confident	16 Å²	16	42 Å²	42	9%	0.086	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.5	-178.9	76.5	-33.8	0	0	0	113.8	H64 Q66 L67 N68 G140 L175	H64-D173 PolarHBondContact NE2-O 3.07Å; H64-D173 VanDerWaalsContact NE2-O 3.15Å; Q66-D173 VanDerWaalsContact CB-O 3.29Å; Q66-D173 WeakPolarHBondContact CB-O 3.32Å; Q66-D173 VanDerWaalsContact CG-O 3.25Å; Q66-D173 WeakPolarHBondContact CG-O 3.41Å; L67-D173 PolarHBondContact N-OD2 2.85Å; N68-D173 WeakPolarHBondContact CB-OD2 3.44Å; N68-D173 PolarHBondContact N-OD2 3.49Å; N68-D173 PolarHBondContact ND2-OD2 2.84Å; G140-D173 WeakPolarHBondContact O-CA 3.3Å; D173-L175 VanDerWaalsContact C-N 3.32Å
174	D	89.8	Confident	78.4	Confident	21 Å²	21	42.4 Å²	42.4	11%	0.112	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	8.6	174.5	71.3	-13.4	0	0	0	114.9	Q66 S172 T176 R178	Q66-D174 VanDerWaalsContact NE2-CB 3.3Å; S172-D174 PolarHBondContact O-N 3.48Å; S172-D174 VanDerWaalsContact O-N 3.16Å; S172-D174 PolarHBondContact OG-OD1 2.87Å; D174-T176 VanDerWaalsContact CG-OG1 3.24Å; D174-T176 PolarHBondContact O-N 2.74Å; D174-T176 WeakPolarHBondContact OD1-CB 3.41Å; D174-T176 PolarHBondContact OD1-N 3.42Å; D174-T176 VanDerWaalsContact OD1-N 3.15Å; D174-T176 PolarHBondContact OD1-OG1 3.25Å; D174-T176 WeakPolarHBondContact OD2-CG2 3.5Å; D174-T176 PolarHBondContact OD2-OG1 3.37Å; D174-R178 VanDerWaalsContact CG-NH2 3.34Å; D174-R178 IonicContact OD1-NE 3.88Å; D174-R178 IonicContact OD1-NH2 3.36Å; D174-R178 IonicContact OD2-CZ 3.43Å; D174-R178 IonicContact OD2-NE 2.71Å; D174-R178 IonicContact OD2-NH2 3.65Å; D174-R178 PolarHBondContact OD2-NH2 2.99Å
175	L	91	Very high	77.5	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	23%	0.226	C	C	.	.	S	Bend	trans	62.3	23.3	-177.6	-51.1	168.6	0	0	0	113.7	L76 R98 V111 V142 L171 S172 D173	L76-L175 HydrophobicContact CD1-CD2 4.22Å; L76-L175 HydrophobicContact CD2-CD1 3.75Å; L76-L175 HydrophobicContact CD2-CD2 4.01Å; R98-L175 HydrophobicContact CB-CD1 3.79Å; R98-L175 HydrophobicContact CG-CD1 4.29Å; V111-L175 HydrophobicContact CG1-CB 4.1Å; V111-L175 WeakPolarHBondContact CG1-O 3.48Å; V111-L175 HydrophobicContact CG2-CD1 4.39Å; V142-L175 HydrophobicContact CB-CD2 4.02Å; V142-L175 HydrophobicContact CG1-CD2 4.18Å; V142-L175 HydrophobicContact CG2-CD2 3.74Å; L171-L175 HydrophobicContact CD1-CB 4.44Å; L171-L175 HydrophobicContact CD1-CD2 4.46Å; S172-L175 WeakPolarHBondContact O-CA 3.32Å; S172-L175 PolarHBondContact O-N 2.8Å; D173-L175 VanDerWaalsContact C-N 3.32Å
176	T	87.2	Confident	76.9	Confident	57 Å²	57	45.4 Å²	45.4	35%	0.35	23%	0.229	S	C	.	.			trans	-97.1	171.7	172.7	70.7	0	0	0	0	112.1	L171 S172 D174 R178	L171-T176 WeakPolarHBondContact CA-O 3.37Å; S172-T176 PolarHBondContact N-O 2.94Å; S172-T176 PolarHBondContact OG-O 2.91Å; S172-T176 VanDerWaalsContact OG-O 3.1Å; S172-T176 PolarHBondContact OG-OG1 2.83Å; D174-T176 VanDerWaalsContact CG-OG1 3.24Å; D174-T176 PolarHBondContact O-N 2.74Å; D174-T176 WeakPolarHBondContact OD1-CB 3.41Å; D174-T176 PolarHBondContact OD1-N 3.42Å; D174-T176 VanDerWaalsContact OD1-N 3.15Å; D174-T176 PolarHBondContact OD1-OG1 3.25Å; D174-T176 WeakPolarHBondContact OD2-CG2 3.5Å; D174-T176 PolarHBondContact OD2-OG1 3.37Å; T176-R178 PolarHBondContact OG1-NE 2.82Å
177	R	75.6	Confident	76.3	Confident	125 Å²	125	48.2 Å²	48.2	47%	0.472	24%	0.241	S	C	.	.			trans	-105.8	124.5	167.3	-66.8	-174.2	-67	162.2	1.3	107.6	I113 L171	I113-R177 PolarHBondContact O-NE 2.82Å; I113-R177 PolarHBondContact O-NH2 2.94Å; I113-R177 VanDerWaalsContact O-NH2 3.09Å; L171-R177 HydrophobicContact CD2-CG 3.72Å
178	R	66.2	Low	76.1	Confident	110 Å²	110	48.9 Å²	48.9	42%	0.415	25%	0.245	S	C	.	.			trans	-130.9	111.2	179.9	-60.8	-177.9	-175.5	179.1	3	109.1	D174 T176 D182 G183	D174-R178 VanDerWaalsContact CG-NH2 3.34Å; D174-R178 IonicContact OD1-NE 3.88Å; D174-R178 IonicContact OD1-NH2 3.36Å; D174-R178 IonicContact OD2-CZ 3.43Å; D174-R178 IonicContact OD2-NE 2.71Å; D174-R178 IonicContact OD2-NH2 3.65Å; D174-R178 PolarHBondContact OD2-NH2 2.99Å; T176-R178 PolarHBondContact OG1-NE 2.82Å; R178-D182 HydrophobicContact CB-CB 4.47Å; R178-D182 CarbonylContact O-C 3.06Å; R178-D182 WeakPolarHBondContact O-CA 3.24Å; R178-D182 WeakPolarHBondContact O-CB 3.19Å; R178-D182 PolarHBondContact O-N 2.84Å; R178-G183 PolarHBondContact O-N 2.85Å
179	D	54.5	Low	75.9	Confident	143 Å²	143	49 Å²	49	77%	0.765	25%	0.246	S	C	*	.	H	α-helix	trans	46.2	165.8	176.3	-63.9	-8.7	0	0	0	117.5	L181 D182 G183	D179-L181 PolarHBondContact O-N 2.88Å; D179-D182 PolarHBondContact O-N 2.86Å; D179-G183 PolarHBondContact O-N 2.91Å
180	D	51.1	Low	75.8	Confident	141 Å²	141	51.9 Å²	51.9	75%	0.754	26%	0.259	S	S	*	.	H	α-helix	trans	-64.2	-11	-175.5	-57.7	-40.3	0	0	0	113.6
181	L	48.6	Very low	75.5	Confident	125 Å²	125	55.3 Å²	55.3	65%	0.654	30%	0.295	S	S	*	.	H	α-helix	trans	-99.4	-21.2	-179.5	-66	171	0	0	0	114.2	D179	D179-L181 PolarHBondContact O-N 2.88Å
182	D	47.4	Very low	75.5	Confident	74 Å²	74	59.4 Å²	59.4	40%	0.396	31%	0.311	S	S	.	.	H	α-helix	trans	-120.9	-18.5	-168.9	-136.2	7.7	0	0	0	115.1	K141 R178 D179	K141-D182 WeakPolarHBondContact CE-O 3.49Å; K141-D182 WeakPolarHBondContact CE-OD1 3.1Å; K141-D182 PolarHBondContact NZ-O 2.94Å; K141-D182 IonicContact NZ-OD1 3.55Å; K141-D182 PolarHBondContact NZ-OD1 2.84Å; R178-D182 HydrophobicContact CB-CB 4.47Å; R178-D182 CarbonylContact O-C 3.06Å; R178-D182 WeakPolarHBondContact O-CA 3.24Å; R178-D182 WeakPolarHBondContact O-CB 3.19Å; R178-D182 PolarHBondContact O-N 2.84Å; D179-D182 PolarHBondContact O-N 2.86Å
183	G	55.2	Low	75.5	Confident	6 Å²	6	62.9 Å²	62.9	6%	0.062	33%	0.333	C	S	.	.	S	Bend	trans	-164.6	76.8	175.5	0	0	0	0	0	114.6	V170 R178 D179	V170-G183 CarbonylContact O-C 3.56Å; V170-G183 VanDerWaalsContact O-C 3.25Å; V170-G183 WeakPolarHBondContact O-CA 3.49Å; R178-G183 PolarHBondContact O-N 2.85Å; D179-G183 PolarHBondContact O-N 2.91Å
184	G	65.5	Low	75.3	Confident	21 Å²	21	65.3 Å²	65.3	22%	0.216	34%	0.344	C	S	.	.			trans	-92.6	173.9	-174.4	0	0	0	0	0	116.9	V170	V170-G184 PolarHBondContact N-O 2.96Å
185	E	76.5	Confident	75.3	Confident	66 Å²	66	65.3 Å²	65.3	31%	0.308	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	102.6	176.7	-174.1	178.3	-135.2	0	0	110.4	R167 C168 Y169 K187	R167-E185 VanDerWaalsContact CD-OE1 3.24Å; R167-E185 WeakPolarHBondContact CD-OE1 3.47Å; R167-E185 HydrophobicContact CG-CG 4.11Å; R167-E185 IonicContact CZ-OE1 2.97Å; R167-E185 VanDerWaalsContact CZ-OE1 3.3Å; R167-E185 IonicContact NE-OE1 3.52Å; R167-E185 PolarHBondContact NE-OE1 2.83Å; R167-E185 IonicContact NH1-OE1 2.69Å; R167-E185 PolarHBondContact NH1-OE1 2.87Å; R167-E185 IonicContact NH1-OE2 3.26Å; C168-E185 CarbonylContact O-C 3.25Å; Y169-E185 HydrophobicContact CD1-CB 4.29Å; Y169-E185 HydrophobicContact CD1-CG 4.04Å; Y169-E185 HydrophobicContact CE1-CB 4.19Å; Y169-E185 HydrophobicContact CE1-CG 3.56Å; Y169-E185 VanDerWaalsContact CE1-OE1 3.23Å; Y169-E185 WeakPolarHBondContact CE1-OE1 3.3Å; Y169-E185 PolarHBondContact OH-OE1 2.77Å; E185-K187 HydrophobicContact CG-CG 4.39Å; E185-K187 WeakPolarHBondContact OE2-CE 3.2Å; E185-K187 IonicContact OE2-NZ 4Å; E185-K187 PolarHBondContact OE2-NZ 2.03Å
186	W	79.1	Confident	75.1	Confident	26 Å²	26	69.1 Å²	69.1	10%	0.098	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	118.6	-172.2	-75.6	83.5	0	0	0	112.3	C168 Q204 F219 A234 D239	C168-W186 HydrophobicContact CB-CB 4.19Å; C168-W186 PolarHBondContact N-O 2.99Å; C168-W186 PolarHBondContact O-N 2.91Å; W186-Q204 PolarHBondContact O-NE2 2.82Å; W186-F219 HydrophobicContact CG-CZ 4.39Å; W186-A234 HydrophobicContact CD2-CB 4.44Å; W186-A234 HydrophobicContact CE3-CB 3.97Å; W186-A234 HydrophobicContact CH2-CB 3.34Å; W186-A234 HydrophobicContact CZ2-CB 3.83Å; W186-A234 HydrophobicContact CZ3-CB 3.41Å; W186-A234 VanDerWaalsContact CZ3-CB 3.41Å; W186-D239 HydrophobicContact CH2-CB 4.47Å; W186-D239 WeakPolarHBondContact CH2-OD1 3.47Å; W186-D239 WeakPolarHBondContact CZ3-OD1 3.36Å
187	K	82.3	Confident	75.3	Confident	59 Å²	59	70.7 Å²	70.7	26%	0.257	37%	0.369	S	S	.	.			trans	-134.8	51.2	-177.1	-52.9	178.9	-153.5	177.2	0	111.9	R167 E185 C189 E190 Q204	R167-K187 HydrophobicContact CG-CG 4.2Å; E185-K187 HydrophobicContact CG-CG 4.39Å; E185-K187 WeakPolarHBondContact OE2-CE 3.2Å; E185-K187 IonicContact OE2-NZ 4Å; E185-K187 PolarHBondContact OE2-NZ 2.03Å; K187-C189 PolarHBondContact O-N 2.85Å; K187-E190 HydrophobicContact CB-CB 3.92Å; K187-E190 WeakPolarHBondContact CD-OE2 3.23Å; K187-E190 IonicContact NZ-OE2 2.67Å; K187-E190 PolarHBondContact O-N 2.86Å; K187-Q204 VanDerWaalsContact C-OE1 3.24Å
188	F	86.2	Confident	76	Confident	19 Å²	19	67.9 Å²	67.9	8%	0.083	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-33.1	178.9	165	-96.4	0	0	0	113.9	R192 F199 L230 F232 L241	F188-R192 WeakPolarHBondContact O-CD 3.46Å; F188-R192 PolarHBondContact O-NE 2.75Å; F188-F199 HydrophobicContact CE1-CD1 4.35Å; F188-F199 AromaticContact CE1-CE1 3.8Å; F188-F199 HydrophobicContact CE1-CE1 3.8Å; F188-F199 HydrophobicContact CZ-CE1 4.08Å; F188-L230 HydrophobicContact CD1-CD2 4.45Å; F188-L230 HydrophobicContact CE1-CD2 3.36Å; F188-L230 HydrophobicContact CZ-CD2 3.69Å; F188-F232 HydrophobicContact CB-CD2 4.15Å; F188-F232 HydrophobicContact CB-CE1 4.21Å; F188-F232 HydrophobicContact CB-CE2 3.42Å; F188-F232 VanDerWaalsContact CB-CE2 3.42Å; F188-F232 HydrophobicContact CB-CZ 3.45Å; F188-F232 VanDerWaalsContact CB-CZ 3.45Å; F188-F232 AromaticContact CD1-CD1 3.7Å; F188-F232 HydrophobicContact CD1-CD1 3.7Å; F188-F232 HydrophobicContact CD1-CD2 4.21Å; F188-F232 AromaticContact CD1-CE1 3.47Å; F188-F232 HydrophobicContact CD1-CE1 3.47Å; F188-F232 VanDerWaalsContact CD1-CE1 3.47Å; F188-F232 HydrophobicContact CD1-CE2 4.02Å; F188-F232 HydrophobicContact CD1-CG 4.06Å; F188-F232 AromaticContact CD1-CZ 3.64Å; F188-F232 HydrophobicContact CD1-CZ 3.64Å; F188-F232 AromaticContact CD2-CD2 3.99Å; F188-F232 HydrophobicContact CD2-CD2 3.99Å; F188-F232 HydrophobicContact CD2-CE2 4.15Å; F188-F232 HydrophobicContact CD2-CG 4.3Å; F188-F232 AromaticContact CE1-CD1 3.9Å; F188-F232 HydrophobicContact CE1-CD1 3.9Å; F188-F232 HydrophobicContact CE1-CE1 4.1Å; F188-F232 HydrophobicContact CE1-CG 4.24Å; F188-F232 HydrophobicContact CE2-CG 4.42Å; F188-F232 HydrophobicContact CG-CD1 4.18Å; F188-F232 AromaticContact CG-CD2 3.83Å; F188-F232 HydrophobicContact CG-CD2 3.83Å; F188-F232 AromaticContact CG-CE1 3.94Å; F188-F232 HydrophobicContact CG-CE1 3.94Å; F188-F232 AromaticContact CG-CE2 3.58Å; F188-F232 HydrophobicContact CG-CE2 3.58Å; F188-F232 HydrophobicContact CG-CG 4.12Å; F188-F232 AromaticContact CG-CZ 3.64Å; F188-F232 HydrophobicContact CG-CZ 3.64Å; F188-F232 HydrophobicContact CZ-CD1 4.48Å; F188-F232 HydrophobicContact CZ-CG 4.41Å; F188-L241 HydrophobicContact CD2-CD1 3.75Å; F188-L241 HydrophobicContact CD2-CD2 4.06Å; F188-L241 HydrophobicContact CD2-CG 4.44Å; F188-L241 HydrophobicContact CE2-CD1 3.74Å; F188-L241 HydrophobicContact CE2-CD2 3.61Å; F188-L241 HydrophobicContact CE2-CG 4.3Å
189	C	88.8	Confident	77.2	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.02	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.8	-179.8	-72.1	0	0	0	0	115.8	I165 K187 C202 Q204	I165-C189 HydrophobicContact CB-CB 3.96Å; I165-C189 HydrophobicContact CG2-CB 4.48Å; K187-C189 PolarHBondContact O-N 2.85Å; C189-C202 HydrophobicContact CB-CB 3.47Å; C189-C202 VanDerWaalsContact CB-CB 3.47Å; C189-C202 WeakPolarHBondContact CB-SG 3.44Å; C189-C202 WeakPolarHBondContact SG-CB 3.41Å; C189-C202 CovalentContact SG-SG 2.02Å; C189-C202 PolarHBondContact SG-SG 2.82Å; C189-Q204 VanDerWaalsContact N-OE1 3.14Å
190	E	88.2	Confident	79	Confident	59 Å²	59	56.3 Å²	56.3	28%	0.276	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	143.9	173.8	-175.2	166.7	175.1	0	0	111	L151 I165 K187 R192	L151-E190 HydrophobicContact CD2-CG 4.05Å; I165-E190 HydrophobicContact CD1-CB 3.84Å; K187-E190 HydrophobicContact CB-CB 3.92Å; K187-E190 WeakPolarHBondContact CD-OE2 3.23Å; K187-E190 IonicContact NZ-OE2 2.67Å; K187-E190 PolarHBondContact O-N 2.86Å; E190-R192 PolarHBondContact O-N 2.76Å
191	G	85.1	Confident	81.1	Confident	77 Å²	77	53.1 Å²	53.1	79%	0.794	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	2.1	178.5	0	0	0	0	0	115.7
192	R	87.9	Confident	83.2	Confident	87 Å²	87	47.2 Å²	47.2	33%	0.328	26%	0.256	S	S	.	.	S	Bend	trans	-87.5	165.8	175.3	-63.9	-165	-177.2	-79.3	-11.9	112.3	F188 E190 Q194 F199	F188-R192 WeakPolarHBondContact O-CD 3.46Å; F188-R192 PolarHBondContact O-NE 2.75Å; E190-R192 PolarHBondContact O-N 2.76Å; R192-Q194 PolarHBondContact O-N 2.96Å; R192-F199 HydrophobicContact CB-CB 3.84Å; R192-F199 HydrophobicContact CB-CD1 4.42Å; R192-F199 HydrophobicContact CB-CD2 3.58Å; R192-F199 HydrophobicContact CB-CE2 4.23Å; R192-F199 HydrophobicContact CB-CG 3.68Å; R192-F199 HydrophobicContact CG-CD2 4.31Å; R192-F199 HydrophobicContact CG-CG 4.33Å
193	P	90.1	Very high	85.5	Confident	79 Å²	79	45.7 Å²	45.7	51%	0.513	25%	0.247	S	C	.	.			trans	-54	129.6	175.3	-28.3	37.2	0	0	0	112.8	Q198 F199	P193-Q198 HydrophobicContact CB-CB 3.94Å; P193-Q198 HydrophobicContact CB-CG 3.88Å; P193-Q198 WeakPolarHBondContact O-CB 3.47Å; P193-F199 WeakPolarHBondContact O-CB 3.42Å; P193-F199 PolarHBondContact O-N 2.87Å
194	Q	86.1	Confident	87.4	Confident	67 Å²	67	45.4 Å²	45.4	31%	0.313	24%	0.244	S	C	.	.			trans	-75.9	178	179.3	-66.5	173.7	-58.3	0	0	111.8	T161 D163 R192	T161-Q194 PolarHBondContact OG1-NE2 2.86Å; D163-Q194 PolarHBondContact OD2-NE2 2.81Å; R192-Q194 PolarHBondContact O-N 2.96Å
195	G	88.2	Confident	88.7	Confident	20 Å²	20	44.4 Å²	44.4	21%	0.206	23%	0.234	C	C	.	.	S	Bend	trans	96.3	161.1	-178.4	0	0	0	0	0	112.8	E197 Q198 G200	G195-E197 VanDerWaalsContact C-OE2 3.3Å; G195-E197 VanDerWaalsContact CA-OE2 3.29Å; G195-E197 WeakPolarHBondContact CA-OE2 3.27Å; G195-Q198 PolarHBondContact O-N 2.86Å; G195-G200 WeakPolarHBondContact O-CA 3.34Å; G195-G200 PolarHBondContact O-N 2.86Å
196	H	88.1	Confident	89.7	Confident	88 Å²	88	43.1 Å²	43.1	41%	0.407	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.6	177.7	63.7	77.6	0	0	0	111.7	Q198 F201 N226 W227	H196-Q198 PolarHBondContact O-N 2.89Å; H196-F201 HydrophobicContact CB-CD2 3.76Å; H196-F201 HydrophobicContact CB-CE2 4.09Å; H196-N226 PolarHBondContact CE1-OD1 2.98Å; H196-N226 VanDerWaalsContact CE1-OD1 3.32Å; H196-N226 PolarHBondContact ND1-OD1 2.95Å; H196-N226 WeakPolarHBondContact O-CA 3.31Å; H196-N226 PolarHBondContact O-N 3.06Å; H196-W227 HydrophobicContact CB-CH2 3.64Å; H196-W227 HydrophobicContact CB-CZ2 4.19Å; H196-W227 HydrophobicContact CB-CZ3 4.07Å
197	E	90.4	Very high	90.5	Very high	90 Å²	90	42.5 Å²	42.5	42%	0.421	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.6	175.4	72.3	-70.7	179.1	0	0	114	G195 N226	G195-E197 VanDerWaalsContact C-OE2 3.3Å; G195-E197 VanDerWaalsContact CA-OE2 3.29Å; G195-E197 WeakPolarHBondContact CA-OE2 3.27Å; E197-N226 VanDerWaalsContact CA-OD1 3.29Å; E197-N226 WeakPolarHBondContact CA-OD1 3.42Å; E197-N226 PolarHBondContact N-OD1 2.88Å
198	Q	90.6	Very high	91.2	Very high	66 Å²	66	39.9 Å²	39.9	31%	0.308	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.5	-112.3	178.3	-64.1	-65.7	-46.8	0	0	111.1	P193 G195 H196 T224 Y225	P193-Q198 HydrophobicContact CB-CB 3.94Å; P193-Q198 HydrophobicContact CB-CG 3.88Å; P193-Q198 WeakPolarHBondContact O-CB 3.47Å; G195-Q198 PolarHBondContact O-N 2.86Å; H196-Q198 PolarHBondContact O-N 2.89Å; Q198-T224 WeakPolarHBondContact O-CA 3.29Å; Q198-Y225 PolarHBondContact O-N 3.05Å
199	F	92.2	Very high	91.6	Very high	9 Å²	9	39.6 Å²	39.6	4%	0.039	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-1.3	-170.9	-65.4	-88.8	0	0	0	114.8	F188 R192 P193 F201 C202 T224 Y225 L230	F188-F199 HydrophobicContact CE1-CD1 4.35Å; F188-F199 AromaticContact CE1-CE1 3.8Å; F188-F199 HydrophobicContact CE1-CE1 3.8Å; F188-F199 HydrophobicContact CZ-CE1 4.08Å; R192-F199 HydrophobicContact CB-CB 3.84Å; R192-F199 HydrophobicContact CB-CD1 4.42Å; R192-F199 HydrophobicContact CB-CD2 3.58Å; R192-F199 HydrophobicContact CB-CE2 4.23Å; R192-F199 HydrophobicContact CB-CG 3.68Å; R192-F199 HydrophobicContact CG-CD2 4.31Å; R192-F199 HydrophobicContact CG-CG 4.33Å; P193-F199 WeakPolarHBondContact O-CB 3.42Å; P193-F199 PolarHBondContact O-N 2.87Å; F199-F201 PolarHBondContact O-N 2.91Å; F199-F201 VanDerWaalsContact O-N 3.15Å; F199-C202 WeakPolarHBondContact O-CB 3.41Å; F199-C202 PolarHBondContact O-N 2.84Å; F199-T224 HydrophobicContact CD1-CG2 3.84Å; F199-T224 HydrophobicContact CE1-CG2 4.18Å; F199-Y225 HydrophobicContact CE2-CE1 4.29Å; F199-Y225 HydrophobicContact CZ-CE1 4.43Å; F199-Y225 HydrophobicContact CZ-CE2 4.22Å; F199-Y225 AromaticContact CZ-CZ 3.73Å; F199-Y225 VanDerWaalsContact CZ-OH 3.27Å; F199-Y225 WeakPolarHBondContact CZ-OH 3.27Å; F199-L230 HydrophobicContact CE1-CD2 4.21Å
200	G	91.4	Very high	91.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.01	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.1	-176.1	0	0	0	0	0	114.1	D163 P164 G195	D163-G200 CarbonylContact C-O 3.59Å; D163-G200 WeakPolarHBondContact CA-O 3.42Å; D163-G200 WeakPolarHBondContact CB-O 3.36Å; P164-G200 VanDerWaalsContact CD-O 3.24Å; P164-G200 WeakPolarHBondContact CD-O 3.46Å; G195-G200 WeakPolarHBondContact O-CA 3.34Å; G195-G200 PolarHBondContact O-N 2.86Å
201	F	94.9	Very high	92.1	Very high	74 Å²	74	37.7 Å²	37.7	33%	0.325	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	29	176.5	-69.1	-96.9	0	0	0	112.3	P164 H196 F199 Q203 G223	P164-F201 HydrophobicContact CG-CD1 3.57Å; P164-F201 HydrophobicContact CG-CE1 3.93Å; P164-F201 HydrophobicContact CG-CG 4.25Å; P164-F201 CarbonylContact O-C 3.18Å; H196-F201 HydrophobicContact CB-CD2 3.76Å; H196-F201 HydrophobicContact CB-CE2 4.09Å; F199-F201 PolarHBondContact O-N 2.91Å; F199-F201 VanDerWaalsContact O-N 3.15Å; F201-Q203 VanDerWaalsContact C-N 3.29Å; F201-Q203 PolarHBondContact O-N 3.16Å; F201-Q203 VanDerWaalsContact O-N 3.15Å; F201-G223 CarbonylContact O-C 3.57Å; F201-G223 VanDerWaalsContact O-C 3.23Å; F201-G223 WeakPolarHBondContact O-CA 3.48Å
202	C	93.5	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.			trans	-52.5	-39.9	-170.3	160	0	0	0	0	115.1	I165 C189 F199 Q204 A221 G223 T224	I165-C202 WeakPolarHBondContact O-CB 3.49Å; I165-C202 PolarHBondContact O-SG 2.79Å; I165-C202 VanDerWaalsContact O-SG 3.34Å; C189-C202 HydrophobicContact CB-CB 3.47Å; C189-C202 VanDerWaalsContact CB-CB 3.47Å; C189-C202 WeakPolarHBondContact CB-SG 3.44Å; C189-C202 WeakPolarHBondContact SG-CB 3.41Å; C189-C202 CovalentContact SG-SG 2.02Å; C189-C202 PolarHBondContact SG-SG 2.82Å; F199-C202 WeakPolarHBondContact O-CB 3.41Å; F199-C202 PolarHBondContact O-N 2.84Å; C202-Q204 VanDerWaalsContact C-N 3.29Å; C202-Q204 PolarHBondContact O-N 3.3Å; C202-A221 CarbonylContact O-C 3.59Å; C202-A221 VanDerWaalsContact O-C 3.23Å; C202-A221 WeakPolarHBondContact O-CA 2.95Å; C202-A221 WeakPolarHBondContact O-CB 3.29Å; C202-G223 PolarHBondContact O-N 3.23Å; C202-T224 HydrophobicContact CB-CG2 3.73Å
203	Q	95.6	Very high	92.2	Very high	43 Å²	43	36 Å²	36	20%	0.201	19%	0.192	C	C	.	.			trans	48.9	44.1	-176.4	-59.8	-177.1	-87.6	0	0	113.9	H147 P164 I165 F201 G205 L206	H147-Q203 WeakPolarHBondContact O-CA 3.49Å; P164-Q203 PolarHBondContact O-N 2.92Å; I165-Q203 PolarHBondContact O-N 3.27Å; I165-Q203 VanDerWaalsContact O-N 3.08Å; F201-Q203 VanDerWaalsContact C-N 3.29Å; F201-Q203 PolarHBondContact O-N 3.16Å; F201-Q203 VanDerWaalsContact O-N 3.15Å; Q203-G205 PolarHBondContact O-N 3.31Å; Q203-L206 PolarHBondContact O-N 2.9Å
204	Q	93.8	Very high	92	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	137.6	179	52.2	154.7	92.8	0	0	111.7	I165 G166 W186 K187 C189 C202 A221 F232	I165-Q204 VanDerWaalsContact O-CG 3.23Å; I165-Q204 WeakPolarHBondContact O-CG 3.43Å; I165-Q204 PolarHBondContact O-N 3.25Å; G166-Q204 VanDerWaalsContact C-CG 3.42Å; G166-Q204 WeakPolarHBondContact O-CG 3.44Å; W186-Q204 PolarHBondContact O-NE2 2.82Å; K187-Q204 VanDerWaalsContact C-OE1 3.24Å; C189-Q204 VanDerWaalsContact N-OE1 3.14Å; C202-Q204 VanDerWaalsContact C-N 3.29Å; C202-Q204 PolarHBondContact O-N 3.3Å; Q204-A221 HydrophobicContact CB-CB 4.26Å; Q204-F232 HydrophobicContact CB-CE1 4.11Å; Q204-F232 HydrophobicContact CB-CZ 4.16Å
205	G	93.5	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	27.5	-179.6	0	0	0	0	0	113.9	S132 C145 Q203 G220	S132-G205 PolarHBondContact OG-O 3.36Å; C145-G205 WeakPolarHBondContact CB-O 3.11Å; Q203-G205 PolarHBondContact O-N 3.31Å; G205-G220 PolarHBondContact N-O 3.31Å
206	L	96.6	Very high	91.8	Very high	39 Å²	39	39.6 Å²	39.6	20%	0.204	19%	0.194	C	C	.	.	S	Bend	trans	-60.9	-42.8	156.8	178.9	69.8	0	0	0	109.5	V131 H147 Q203 P222 F263	V131-L206 HydrophobicContact CG2-CD1 4.4Å; H147-L206 HydrophobicContact CB-CB 4.27Å; H147-L206 VanDerWaalsContact CD2-CD1 3.47Å; H147-L206 WeakPolarHBondContact CD2-CD1 3.36Å; Q203-L206 PolarHBondContact O-N 2.9Å; L206-P222 HydrophobicContact CB-CG 4.25Å; L206-P222 HydrophobicContact CD2-CG 3.68Å; L206-F263 HydrophobicContact CD2-CD2 3.57Å; L206-F263 HydrophobicContact CD2-CE2 3.7Å; L206-F263 HydrophobicContact CD2-CG 4.18Å; L206-F263 HydrophobicContact CD2-CZ 4.39Å
207	S	97.4	Very high	91.9	Very high	13 Å²	13	35.4 Å²	35.4	9%	0.091	18%	0.175	C	C	.	.	S	Bend	trans	-125.8	149.8	171.4	70.7	0	0	0	0	110.7	G220 G262 F263 V265	S207-G220 PolarHBondContact O-N 3.4Å; S207-G262 PolarHBondContact OG-O 3.5Å; S207-F263 VanDerWaalsContact CB-O 3.31Å; S207-F263 WeakPolarHBondContact CB-O 3.39Å; S207-V265 WeakPolarHBondContact OG-CG1 3.06Å
208	V	96.2	Very high	92	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.024	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	146.9	178.8	69.1	0	0	0	0	109.1	S132 K134 V143 I217 L218 F219	S132-V208 WeakPolarHBondContact OG-CG1 3.4Å; K134-V208 HydrophobicContact CB-CG1 4.25Å; K134-V208 HydrophobicContact CG-CG1 3.89Å; K134-V208 VanDerWaalsContact CG-O 3.28Å; K134-V208 WeakPolarHBondContact CG-O 3.28Å; V143-V208 HydrophobicContact CB-CG2 4.42Å; V143-V208 HydrophobicContact CG1-CB 4.37Å; V143-V208 HydrophobicContact CG1-CG1 3.83Å; V143-V208 HydrophobicContact CG1-CG2 3.55Å; V143-V208 HydrophobicContact CG2-CG2 3.98Å; V208-I217 HydrophobicContact CG2-CG2 3.81Å; V208-L218 WeakPolarHBondContact CA-O 3.48Å; V208-L218 VanDerWaalsContact CG2-O 3.31Å; V208-L218 WeakPolarHBondContact CG2-O 2.96Å; V208-F219 HydrophobicContact CB-CD1 4.37Å; V208-F219 HydrophobicContact CG2-CD1 3.7Å; V208-F219 HydrophobicContact CG2-CE1 3.64Å; V208-F219 HydrophobicContact CG2-CZ 4.47Å
209	S	95.4	Very high	92.2	Very high	12 Å²	12	28 Å²	28	8%	0.084	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.9	168.3	-164	0	0	0	0	110.8	L218	S209-L218 PolarHBondContact N-O 2.97Å; S209-L218 VanDerWaalsContact N-O 3.09Å; S209-L218 PolarHBondContact O-N 2.86Å
210	F	93.8	Very high	92.4	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.083	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	145.4	172.2	-73.2	-75.5	0	0	0	109.6	K134 Q136 K141 V143 I217	K134-F210 HydrophobicContact CB-CD2 4.23Å; K134-F210 HydrophobicContact CB-CE2 4.3Å; Q136-F210 HydrophobicContact CB-CD2 4.43Å; Q136-F210 HydrophobicContact CG-CB 3.93Å; Q136-F210 HydrophobicContact CG-CD1 3.47Å; Q136-F210 VanDerWaalsContact CG-CD1 3.47Å; Q136-F210 HydrophobicContact CG-CD2 3.51Å; Q136-F210 HydrophobicContact CG-CE1 3.67Å; Q136-F210 HydrophobicContact CG-CE2 3.72Å; Q136-F210 HydrophobicContact CG-CG 3.37Å; Q136-F210 HydrophobicContact CG-CZ 3.8Å; K141-F210 HydrophobicContact CB-CZ 4.29Å; V143-F210 HydrophobicContact CB-CE2 4.22Å; V143-F210 HydrophobicContact CB-CZ 3.87Å; V143-F210 HydrophobicContact CG1-CD2 4.36Å; V143-F210 HydrophobicContact CG1-CE2 3.57Å; V143-F210 HydrophobicContact CG1-CZ 3.68Å; F210-I217 HydrophobicContact CD1-CB 4.42Å; F210-I217 HydrophobicContact CD1-CD1 4.44Å; F210-I217 HydrophobicContact CD1-CG1 3.88Å; F210-I217 HydrophobicContact CD1-CG2 4.26Å; F210-I217 HydrophobicContact CE1-CB 4.44Å; F210-I217 HydrophobicContact CE1-CD1 3.71Å; F210-I217 HydrophobicContact CE1-CG1 3.66Å; F210-I217 HydrophobicContact CE1-CG2 4.17Å
211	T	92.6	Very high	92.6	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.018	14%	0.138	C	C	.	.			trans	-71.4	145.9	172.6	55.5	0	0	0	0	111.2	D213 R214 F216 L218 L277 F279	T211-D213 WeakPolarHBondContact CB-OD1 3.34Å; T211-D213 PolarHBondContact O-N 2.95Å; T211-D213 VanDerWaalsContact O-N 3.11Å; T211-D213 PolarHBondContact OG1-OD1 3.13Å; T211-R214 WeakPolarHBondContact O-CA 3.35Å; T211-R214 PolarHBondContact O-N 2.87Å; T211-F216 HydrophobicContact CG2-CB 3.82Å; T211-F216 HydrophobicContact CG2-CD2 4.37Å; T211-F216 PolarHBondContact N-O 3Å; T211-F216 VanDerWaalsContact N-O 3.08Å; T211-F216 PolarHBondContact OG1-N 2.82Å; T211-F216 PolarHBondContact OG1-O 2.87Å; T211-L218 HydrophobicContact CG2-CD1 4.3Å; T211-L218 HydrophobicContact CG2-CD2 4.45Å; T211-L218 HydrophobicContact CG2-CG 4.3Å; T211-L277 HydrophobicContact CG2-CD1 4.13Å; T211-F279 HydrophobicContact CG2-CE1 3.78Å
212	P	89.5	Confident	92.7	Very high	83 Å²	83	24.2 Å²	24.2	54%	0.539	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.8	-179.4	-28.3	35.5	0	0	0	115	R214 S267	P212-R214 PolarHBondContact O-N 2.84Å; P212-S267 VanDerWaalsContact CD-O 3.29Å; P212-S267 WeakPolarHBondContact CD-O 3.45Å; P212-S267 VanDerWaalsContact CG-O 3.26Å; P212-S267 WeakPolarHBondContact CG-O 3.22Å
213	D	86.8	Confident	92.8	Very high	46 Å²	46	24.2 Å²	24.2	25%	0.246	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	2.8	174	71.7	-15.8	0	0	0	113.7	T211 N215	T211-D213 WeakPolarHBondContact CB-OD1 3.34Å; T211-D213 PolarHBondContact O-N 2.95Å; T211-D213 VanDerWaalsContact O-N 3.11Å; T211-D213 PolarHBondContact OG1-OD1 3.13Å; D213-N215 PolarHBondContact O-N 3.07Å; D213-N215 VanDerWaalsContact O-N 3.13Å; D213-N215 PolarHBondContact OD1-N 2.87Å; D213-N215 PolarHBondContact OD2-ND2 3.12Å
214	R	85.1	Confident	92.7	Very high	118 Å²	118	22.1 Å²	22.1	45%	0.445	11%	0.114	S	C	.	.	S	Bend	trans	62.3	6.8	179.8	-55.1	-176.8	177.1	-155.7	-4.2	115.7	Q136 I138 T211 P212 A236	Q136-R214 PolarHBondContact NE2-O 3.31Å; Q136-R214 VanDerWaalsContact NE2-O 3.14Å; Q136-R214 PolarHBondContact O-NH2 3.01Å; I138-R214 PolarHBondContact O-NH1 3.43Å; I138-R214 PolarHBondContact O-NH2 2.77Å; T211-R214 WeakPolarHBondContact O-CA 3.35Å; T211-R214 PolarHBondContact O-N 2.87Å; P212-R214 PolarHBondContact O-N 2.84Å; R214-A236 WeakPolarHBondContact O-CB 3.47Å
215	N	82.3	Confident	92.7	Very high	89 Å²	89	22.7 Å²	22.7	48%	0.476	12%	0.116	S	C	.	.	S	Bend	trans	-82.7	-30.5	-174	-70.5	-39.5	0	0	0	114.1	D213 A236	D213-N215 PolarHBondContact O-N 3.07Å; D213-N215 VanDerWaalsContact O-N 3.13Å; D213-N215 PolarHBondContact OD1-N 2.87Å; D213-N215 PolarHBondContact OD2-ND2 3.12Å; N215-A236 WeakPolarHBondContact O-CB 3.11Å; N215-A236 PolarHBondContact O-N 3.03Å
216	F	88	Confident	92.7	Very high	34 Å²	34	24.9 Å²	24.9	15%	0.149	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.1	-172.5	-54.6	-78.8	0	0	0	113.3	T211 A234 L242	T211-F216 HydrophobicContact CG2-CB 3.82Å; T211-F216 HydrophobicContact CG2-CD2 4.37Å; T211-F216 PolarHBondContact N-O 3Å; T211-F216 VanDerWaalsContact N-O 3.08Å; T211-F216 PolarHBondContact OG1-N 2.82Å; T211-F216 PolarHBondContact OG1-O 2.87Å; F216-A234 CarbonylContact C-O 3.59Å; F216-A234 VanDerWaalsContact CA-O 3.22Å; F216-A234 WeakPolarHBondContact CA-O 3.33Å; F216-A234 WeakPolarHBondContact CB-O 3.31Å; F216-L242 HydrophobicContact CE1-CB 4.49Å; F216-L242 HydrophobicContact CE1-CD1 4.19Å; F216-L242 HydrophobicContact CE1-CD2 4.41Å
217	I	90.6	Very high	92.7	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.1	170.9	-38.9	-175.3	0	0	0	108.3	V143 V170 V208 F210 F219 M233 A234 A236	V143-I217 HydrophobicContact CG1-CG2 4.47Å; V170-I217 HydrophobicContact CG1-CD1 4.28Å; V170-I217 HydrophobicContact CG2-CD1 3.59Å; V208-I217 HydrophobicContact CG2-CG2 3.81Å; F210-I217 HydrophobicContact CD1-CB 4.42Å; F210-I217 HydrophobicContact CD1-CD1 4.44Å; F210-I217 HydrophobicContact CD1-CG1 3.88Å; F210-I217 HydrophobicContact CD1-CG2 4.26Å; F210-I217 HydrophobicContact CE1-CB 4.44Å; F210-I217 HydrophobicContact CE1-CD1 3.71Å; F210-I217 HydrophobicContact CE1-CG1 3.66Å; F210-I217 HydrophobicContact CE1-CG2 4.17Å; I217-F219 HydrophobicContact CB-CD2 4.48Å; I217-F219 HydrophobicContact CB-CE2 3.79Å; I217-F219 HydrophobicContact CB-CZ 4.07Å; I217-F219 HydrophobicContact CG2-CD2 4.34Å; I217-F219 HydrophobicContact CG2-CE1 4.05Å; I217-F219 HydrophobicContact CG2-CE2 3.7Å; I217-F219 HydrophobicContact CG2-CZ 3.53Å; I217-M233 WeakPolarHBondContact O-CA 3.35Å; I217-A234 HydrophobicContact CB-CB 4.5Å; I217-A234 PolarHBondContact N-O 2.82Å; I217-A234 PolarHBondContact O-N 2.92Å; I217-A236 HydrophobicContact CG1-CB 4.16Å
218	L	93.2	Very high	92.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126	-179.5	-59.8	172.7	0	0	0	109.2	V208 S209 T211 L231 M233 V265 S267 F279	V208-L218 WeakPolarHBondContact CA-O 3.48Å; V208-L218 VanDerWaalsContact CG2-O 3.31Å; V208-L218 WeakPolarHBondContact CG2-O 2.96Å; S209-L218 PolarHBondContact N-O 2.97Å; S209-L218 VanDerWaalsContact N-O 3.09Å; S209-L218 PolarHBondContact O-N 2.86Å; T211-L218 HydrophobicContact CG2-CD1 4.3Å; T211-L218 HydrophobicContact CG2-CD2 4.45Å; T211-L218 HydrophobicContact CG2-CG 4.3Å; L218-L231 HydrophobicContact CB-CD1 4.29Å; L218-M233 HydrophobicContact CD2-CB 4.47Å; L218-M233 HydrophobicContact CD2-CG 3.68Å; L218-M233 HydrophobicContact CD2-SD 3.35Å; L218-M233 WeakPolarHBondContact CD2-SD 3.34Å; L218-V265 HydrophobicContact CB-CG2 4.47Å; L218-S267 WeakPolarHBondContact CD1-OG 3.48Å; L218-F279 HydrophobicContact CD1-CD1 3.92Å; L218-F279 HydrophobicContact CD2-CD1 3.49Å; L218-F279 VanDerWaalsContact CD2-CD1 3.49Å; L218-F279 HydrophobicContact CD2-CE1 3.86Å; L218-F279 HydrophobicContact CD2-CG 4.4Å; L218-F279 HydrophobicContact CG-CD1 4.33Å
219	F	94.4	Very high	92.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.6	-179.8	-66.4	-76.8	0	0	0	111.7	V143 C168 W186 V208 I217 L231 F232 A234	V143-F219 HydrophobicContact CG2-CE1 3.98Å; V143-F219 HydrophobicContact CG2-CZ 4.27Å; C168-F219 HydrophobicContact CB-CD1 4.48Å; C168-F219 HydrophobicContact CB-CE1 3.73Å; C168-F219 HydrophobicContact CB-CZ 4.38Å; C168-F219 VanDerWaalsContact SG-CE1 3.52Å; W186-F219 HydrophobicContact CG-CZ 4.39Å; V208-F219 HydrophobicContact CB-CD1 4.37Å; V208-F219 HydrophobicContact CG2-CD1 3.7Å; V208-F219 HydrophobicContact CG2-CE1 3.64Å; V208-F219 HydrophobicContact CG2-CZ 4.47Å; I217-F219 HydrophobicContact CB-CD2 4.48Å; I217-F219 HydrophobicContact CB-CE2 3.79Å; I217-F219 HydrophobicContact CB-CZ 4.07Å; I217-F219 HydrophobicContact CG2-CD2 4.34Å; I217-F219 HydrophobicContact CG2-CE1 4.05Å; I217-F219 HydrophobicContact CG2-CE2 3.7Å; I217-F219 HydrophobicContact CG2-CZ 3.53Å; F219-L231 WeakPolarHBondContact O-CD1 3.25Å; F219-F232 HydrophobicContact CB-CD1 4.01Å; F219-F232 HydrophobicContact CB-CD2 4.13Å; F219-F232 HydrophobicContact CB-CE1 3.5Å; F219-F232 HydrophobicContact CB-CE2 3.62Å; F219-F232 HydrophobicContact CB-CG 4.31Å; F219-F232 HydrophobicContact CB-CZ 3.28Å; F219-F232 HydrophobicContact CD2-CD2 4.13Å; F219-F232 AromaticContact CD2-CE2 3.52Å; F219-F232 HydrophobicContact CD2-CE2 3.52Å; F219-F232 AromaticContact CD2-CZ 3.98Å; F219-F232 HydrophobicContact CD2-CZ 3.98Å; F219-F232 HydrophobicContact CE2-CE2 4.42Å; F219-F232 HydrophobicContact CG-CE1 4.47Å; F219-F232 AromaticContact CG-CE2 3.83Å; F219-F232 HydrophobicContact CG-CE2 3.83Å; F219-F232 AromaticContact CG-CZ 3.78Å; F219-F232 HydrophobicContact CG-CZ 3.78Å; F219-F232 PolarHBondContact N-O 2.65Å; F219-F232 WeakPolarHBondContact O-CD1 3.18Å; F219-F232 PolarHBondContact O-N 3.13Å; F219-F232 VanDerWaalsContact O-N 3.16Å; F219-A234 HydrophobicContact CD2-CB 4.42Å; F219-A234 HydrophobicContact CE2-CB 3.9Å
220	G	96.1	Very high	92.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.5	170.4	0	0	0	0	0	112.3	G205 S207 G262	G205-G220 PolarHBondContact N-O 3.31Å; S207-G220 PolarHBondContact O-N 3.4Å; G220-G262 VanDerWaalsContact CA-O 3.32Å; G220-G262 WeakPolarHBondContact CA-O 3.45Å
221	A	95.9	Very high	92.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.119	C	C	.	.			trans	-136.7	71.4	178.9	0	0	0	0	0	110.9	C202 Q204 G223 T224 G229 L230 F232	C202-A221 CarbonylContact O-C 3.59Å; C202-A221 VanDerWaalsContact O-C 3.23Å; C202-A221 WeakPolarHBondContact O-CA 2.95Å; C202-A221 WeakPolarHBondContact O-CB 3.29Å; Q204-A221 HydrophobicContact CB-CB 4.26Å; A221-G223 VanDerWaalsContact C-N 3.32Å; A221-G223 PolarHBondContact O-N 2.86Å; A221-T224 HydrophobicContact CB-CG2 4.05Å; A221-T224 PolarHBondContact O-N 3.23Å; A221-T224 PolarHBondContact O-OG1 2.97Å; A221-G229 WeakPolarHBondContact O-CA 3.37Å; A221-L230 HydrophobicContact CB-CB 4.3Å; A221-L230 PolarHBondContact N-O 3Å; A221-L230 PolarHBondContact O-N 3Å; A221-F232 HydrophobicContact CB-CD1 4.5Å; A221-F232 HydrophobicContact CB-CE1 4.15Å
222	P	96.9	Very high	92.2	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.026	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.4	-164.6	28	-36.5	0	0	0	115.1	L206 W227 G229	L206-P222 HydrophobicContact CB-CG 4.25Å; L206-P222 HydrophobicContact CD2-CG 3.68Å; P222-W227 CarbonylContact O-C 3.5Å; P222-W227 WeakPolarHBondContact O-CA 3.48Å; P222-G229 WeakPolarHBondContact O-CA 3.32Å; P222-G229 PolarHBondContact O-N 3.27Å
223	G	95.6	Very high	92.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	1.5	-179.6	0	0	0	0	0	114.9	F201 C202 A221	F201-G223 CarbonylContact O-C 3.57Å; F201-G223 VanDerWaalsContact O-C 3.23Å; F201-G223 WeakPolarHBondContact O-CA 3.48Å; C202-G223 PolarHBondContact O-N 3.23Å; A221-G223 VanDerWaalsContact C-N 3.32Å; A221-G223 PolarHBondContact O-N 2.86Å
224	T	93.9	Very high	91.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.5	150.4	172.3	54.1	0	0	0	0	112.6	Q198 F199 C202 A221 W227 K228 G229 L230	Q198-T224 WeakPolarHBondContact O-CA 3.29Å; F199-T224 HydrophobicContact CD1-CG2 3.84Å; F199-T224 HydrophobicContact CE1-CG2 4.18Å; C202-T224 HydrophobicContact CB-CG2 3.73Å; A221-T224 HydrophobicContact CB-CG2 4.05Å; A221-T224 PolarHBondContact O-N 3.23Å; A221-T224 PolarHBondContact O-OG1 2.97Å; T224-W227 WeakPolarHBondContact O-CA 3.49Å; T224-W227 PolarHBondContact O-N 2.91Å; T224-K228 PolarHBondContact O-N 3.13Å; T224-K228 VanDerWaalsContact O-N 3.1Å; T224-G229 PolarHBondContact O-N 2.9Å; T224-G229 VanDerWaalsContact OG1-C 3.24Å; T224-G229 WeakPolarHBondContact OG1-CA 3.39Å; T224-L230 HydrophobicContact CG2-CB 4.28Å; T224-L230 HydrophobicContact CG2-CD2 4.38Å; T224-L230 WeakPolarHBondContact OG1-CB 3.21Å; T224-L230 PolarHBondContact OG1-N 3.02Å
225	Y	93.2	Very high	91.5	Very high	11 Å²	11	13.5 Å²	13.5	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	49.4	68.8	174	-55.6	-69	0	0	0	113.8	Q198 F199 W227 K228 L230 P248 H257	Q198-Y225 PolarHBondContact O-N 3.05Å; F199-Y225 HydrophobicContact CE2-CE1 4.29Å; F199-Y225 HydrophobicContact CZ-CE1 4.43Å; F199-Y225 HydrophobicContact CZ-CE2 4.22Å; F199-Y225 AromaticContact CZ-CZ 3.73Å; F199-Y225 VanDerWaalsContact CZ-OH 3.27Å; F199-Y225 WeakPolarHBondContact CZ-OH 3.27Å; Y225-W227 VanDerWaalsContact C-N 3.26Å; Y225-W227 PolarHBondContact O-N 2.7Å; Y225-K228 WeakPolarHBondContact O-CB 3.06Å; Y225-K228 PolarHBondContact O-N 2.92Å; Y225-L230 HydrophobicContact CE2-CD1 4.41Å; Y225-P248 HydrophobicContact CD1-CG 4.17Å; Y225-P248 HydrophobicContact CG-CG 4.04Å; Y225-H257 PolarHBondContact O-CD2 2.83Å
226	N	93.9	Very high	90.7	Very high	46 Å²	46	9.8 Å²	9.8	25%	0.246	5%	0.048	C	C	.	.	H	α-helix	trans	47.1	49	-173.6	-54.6	-58.7	0	0	0	112.3	H196 E197 K228 H257 N258	H196-N226 PolarHBondContact CE1-OD1 2.98Å; H196-N226 VanDerWaalsContact CE1-OD1 3.32Å; H196-N226 PolarHBondContact ND1-OD1 2.95Å; H196-N226 WeakPolarHBondContact O-CA 3.31Å; H196-N226 PolarHBondContact O-N 3.06Å; E197-N226 VanDerWaalsContact CA-OD1 3.29Å; E197-N226 WeakPolarHBondContact CA-OD1 3.42Å; E197-N226 PolarHBondContact N-OD1 2.88Å; N226-K228 PolarHBondContact O-N 2.63Å; N226-H257 HydrophobicContact CB-CB 4.43Å; N226-N258 PolarHBondContact O-N 2.89Å
227	W	95.3	Very high	89.4	Confident	73 Å²	73	11.2 Å²	11.2	28%	0.277	7%	0.066	S	C	.	.	H	α-helix	trans	54.1	24.6	-177.4	-52.5	-93.6	0	0	0	114.7	H196 P222 T224 Y225 N258 S259 Y260	H196-W227 HydrophobicContact CB-CH2 3.64Å; H196-W227 HydrophobicContact CB-CZ2 4.19Å; H196-W227 HydrophobicContact CB-CZ3 4.07Å; P222-W227 CarbonylContact O-C 3.5Å; P222-W227 WeakPolarHBondContact O-CA 3.48Å; T224-W227 WeakPolarHBondContact O-CA 3.49Å; T224-W227 PolarHBondContact O-N 2.91Å; Y225-W227 VanDerWaalsContact C-N 3.26Å; Y225-W227 PolarHBondContact O-N 2.7Å; W227-N258 CarbonylContact O-C 3.23Å; W227-N258 WeakPolarHBondContact O-CA 3.01Å; W227-N258 PolarHBondContact O-N 3.15Å; W227-S259 PolarHBondContact O-N 2.71Å; W227-S259 VanDerWaalsContact O-N 3.08Å; W227-Y260 HydrophobicContact CB-CD1 3.8Å; W227-Y260 HydrophobicContact CB-CE1 3.6Å; W227-Y260 HydrophobicContact CG-CE1 4.05Å; W227-Y260 PolarHBondContact O-N 3.37Å
228	K	94.9	Very high	88	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-46.2	163.7	177.6	-175.8	174.3	175	0	108.9	T224 Y225 N226 L246 P248 E253 V255 Y260 L261	T224-K228 PolarHBondContact O-N 3.13Å; T224-K228 VanDerWaalsContact O-N 3.1Å; Y225-K228 WeakPolarHBondContact O-CB 3.06Å; Y225-K228 PolarHBondContact O-N 2.92Å; N226-K228 PolarHBondContact O-N 2.63Å; K228-L246 PolarHBondContact NZ-O 3.21Å; K228-P248 HydrophobicContact CD-CG 4.08Å; K228-E253 IonicContact NZ-OE1 2.68Å; K228-V255 VanDerWaalsContact CE-O 3.25Å; K228-V255 WeakPolarHBondContact CE-O 3.14Å; K228-V255 HydrophobicContact CG-CG2 4.24Å; K228-Y260 PolarHBondContact O-N 3.27Å; K228-L261 VanDerWaalsContact O-CB 3.29Å; K228-L261 WeakPolarHBondContact O-CB 3.34Å; K228-L261 PolarHBondContact O-N 3.4Å
229	G	94.6	Very high	86.1	Confident	1 Å²	1	22 Å²	22	1%	0.01	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	90.9	165.8	-174.1	0	0	0	0	0	113.6	A221 P222 T224 L261	A221-G229 WeakPolarHBondContact O-CA 3.37Å; P222-G229 WeakPolarHBondContact O-CA 3.32Å; P222-G229 PolarHBondContact O-N 3.27Å; T224-G229 PolarHBondContact O-N 2.9Å; T224-G229 VanDerWaalsContact OG1-C 3.24Å; T224-G229 WeakPolarHBondContact OG1-CA 3.39Å; G229-L261 CarbonylContact C-O 3.6Å; G229-L261 VanDerWaalsContact CA-O 3.31Å; G229-L261 WeakPolarHBondContact CA-O 3.38Å
230	L	92	Very high	84.6	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.016	14%	0.141	C	C	.	.			trans	-148.5	137.9	-172.9	177	80	0	0	0	109	F188 F199 A221 T224 Y225 F232 K244 T245 L261	F188-L230 HydrophobicContact CD1-CD2 4.45Å; F188-L230 HydrophobicContact CE1-CD2 3.36Å; F188-L230 HydrophobicContact CZ-CD2 3.69Å; F199-L230 HydrophobicContact CE1-CD2 4.21Å; A221-L230 HydrophobicContact CB-CB 4.3Å; A221-L230 PolarHBondContact N-O 3Å; A221-L230 PolarHBondContact O-N 3Å; T224-L230 HydrophobicContact CG2-CB 4.28Å; T224-L230 HydrophobicContact CG2-CD2 4.38Å; T224-L230 WeakPolarHBondContact OG1-CB 3.21Å; T224-L230 PolarHBondContact OG1-N 3.02Å; Y225-L230 HydrophobicContact CE2-CD1 4.41Å; L230-F232 HydrophobicContact CD2-CD1 4.05Å; L230-K244 HydrophobicContact CD1-CB 4.3Å; L230-T245 WeakPolarHBondContact CD1-OG1 3.49Å; L230-L261 PolarHBondContact N-O 2.9Å
231	L	93.4	Very high	82.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.1	161	178.1	62.7	0	0	0	108.4	L218 F219 K244 T245 V265 F279 A281 L295 L303	L218-L231 HydrophobicContact CB-CD1 4.29Å; F219-L231 WeakPolarHBondContact O-CD1 3.25Å; L231-K244 CarbonylContact O-C 3.55Å; L231-K244 WeakPolarHBondContact O-CA 3.34Å; L231-T245 HydrophobicContact CB-CG2 3.83Å; L231-T245 PolarHBondContact N-OG1 2.75Å; L231-T245 PolarHBondContact O-N 3.24Å; L231-V265 HydrophobicContact CD1-CG1 3.65Å; L231-F279 HydrophobicContact CD2-CB 4.2Å; L231-A281 HydrophobicContact CD2-CB 4.22Å; L231-L295 HydrophobicContact CD2-CD1 3.72Å; L231-L303 HydrophobicContact CB-CD1 4.28Å; L231-L303 HydrophobicContact CD2-CD1 3.82Å; L231-L303 HydrophobicContact CG-CD1 3.79Å
232	F	90.6	Very high	81.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	156.2	173.4	69.5	-87.6	0	0	0	112	F188 Q204 F219 A221 L230 L241 Y243 K244	F188-F232 HydrophobicContact CB-CD2 4.15Å; F188-F232 HydrophobicContact CB-CE1 4.21Å; F188-F232 HydrophobicContact CB-CE2 3.42Å; F188-F232 VanDerWaalsContact CB-CE2 3.42Å; F188-F232 HydrophobicContact CB-CZ 3.45Å; F188-F232 VanDerWaalsContact CB-CZ 3.45Å; F188-F232 AromaticContact CD1-CD1 3.7Å; F188-F232 HydrophobicContact CD1-CD1 3.7Å; F188-F232 HydrophobicContact CD1-CD2 4.21Å; F188-F232 AromaticContact CD1-CE1 3.47Å; F188-F232 HydrophobicContact CD1-CE1 3.47Å; F188-F232 VanDerWaalsContact CD1-CE1 3.47Å; F188-F232 HydrophobicContact CD1-CE2 4.02Å; F188-F232 HydrophobicContact CD1-CG 4.06Å; F188-F232 AromaticContact CD1-CZ 3.64Å; F188-F232 HydrophobicContact CD1-CZ 3.64Å; F188-F232 AromaticContact CD2-CD2 3.99Å; F188-F232 HydrophobicContact CD2-CD2 3.99Å; F188-F232 HydrophobicContact CD2-CE2 4.15Å; F188-F232 HydrophobicContact CD2-CG 4.3Å; F188-F232 AromaticContact CE1-CD1 3.9Å; F188-F232 HydrophobicContact CE1-CD1 3.9Å; F188-F232 HydrophobicContact CE1-CE1 4.1Å; F188-F232 HydrophobicContact CE1-CG 4.24Å; F188-F232 HydrophobicContact CE2-CG 4.42Å; F188-F232 HydrophobicContact CG-CD1 4.18Å; F188-F232 AromaticContact CG-CD2 3.83Å; F188-F232 HydrophobicContact CG-CD2 3.83Å; F188-F232 AromaticContact CG-CE1 3.94Å; F188-F232 HydrophobicContact CG-CE1 3.94Å; F188-F232 AromaticContact CG-CE2 3.58Å; F188-F232 HydrophobicContact CG-CE2 3.58Å; F188-F232 HydrophobicContact CG-CG 4.12Å; F188-F232 AromaticContact CG-CZ 3.64Å; F188-F232 HydrophobicContact CG-CZ 3.64Å; F188-F232 HydrophobicContact CZ-CD1 4.48Å; F188-F232 HydrophobicContact CZ-CG 4.41Å; Q204-F232 HydrophobicContact CB-CE1 4.11Å; Q204-F232 HydrophobicContact CB-CZ 4.16Å; F219-F232 HydrophobicContact CB-CD1 4.01Å; F219-F232 HydrophobicContact CB-CD2 4.13Å; F219-F232 HydrophobicContact CB-CE1 3.5Å; F219-F232 HydrophobicContact CB-CE2 3.62Å; F219-F232 HydrophobicContact CB-CG 4.31Å; F219-F232 HydrophobicContact CB-CZ 3.28Å; F219-F232 HydrophobicContact CD2-CD2 4.13Å; F219-F232 AromaticContact CD2-CE2 3.52Å; F219-F232 HydrophobicContact CD2-CE2 3.52Å; F219-F232 AromaticContact CD2-CZ 3.98Å; F219-F232 HydrophobicContact CD2-CZ 3.98Å; F219-F232 HydrophobicContact CE2-CE2 4.42Å; F219-F232 HydrophobicContact CG-CE1 4.47Å; F219-F232 AromaticContact CG-CE2 3.83Å; F219-F232 HydrophobicContact CG-CE2 3.83Å; F219-F232 AromaticContact CG-CZ 3.78Å; F219-F232 HydrophobicContact CG-CZ 3.78Å; F219-F232 PolarHBondContact N-O 2.65Å; F219-F232 WeakPolarHBondContact O-CD1 3.18Å; F219-F232 PolarHBondContact O-N 3.13Å; F219-F232 VanDerWaalsContact O-N 3.16Å; A221-F232 HydrophobicContact CB-CD1 4.5Å; A221-F232 HydrophobicContact CB-CE1 4.15Å; L230-F232 HydrophobicContact CD2-CD1 4.05Å; F232-L241 HydrophobicContact CB-CD1 4.06Å; F232-L241 HydrophobicContact CD2-CD1 3.93Å; F232-L241 HydrophobicContact CG-CD1 4.4Å; F232-Y243 CarbonylContact C-O 3.59Å; F232-Y243 WeakPolarHBondContact CA-O 3.46Å; F232-K244 HydrophobicContact CB-CB 4.1Å
233	M	87.4	Confident	80.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.8	-174.4	-44.2	-154.6	-59.3	0	0	111.7	I217 L218 L242 Y243 F279 M297 L303	I217-M233 WeakPolarHBondContact O-CA 3.35Å; L218-M233 HydrophobicContact CD2-CB 4.47Å; L218-M233 HydrophobicContact CD2-CG 3.68Å; L218-M233 HydrophobicContact CD2-SD 3.35Å; L218-M233 WeakPolarHBondContact CD2-SD 3.34Å; M233-L242 PolarHBondContact O-N 2.81Å; M233-Y243 HydrophobicContact CE-CD2 3.41Å; M233-Y243 VanDerWaalsContact CE-CD2 3.41Å; M233-Y243 HydrophobicContact CE-CE2 4.3Å; M233-Y243 HydrophobicContact CE-CG 3.64Å; M233-Y243 PolarHBondContact N-O 2.79Å; M233-Y243 PolarHBondContact O-N 2.96Å; M233-F279 HydrophobicContact CE-CE1 4.11Å; M233-F279 HydrophobicContact CE-CE2 4.02Å; M233-F279 HydrophobicContact CE-CZ 3.63Å; M233-F279 HydrophobicContact SD-CD1 3.74Å; M233-F279 HydrophobicContact SD-CD2 4.27Å; M233-F279 HydrophobicContact SD-CE1 3.37Å; M233-F279 WeakPolarHBondContact SD-CE1 3.39Å; M233-F279 HydrophobicContact SD-CE2 3.98Å; M233-F279 HydrophobicContact SD-CG 4.17Å; M233-F279 HydrophobicContact SD-CZ 3.51Å; M233-F279 VanDerWaalsContact SD-CZ 3.51Å; M233-M297 HydrophobicContact CE-CG 3.61Å; M233-M297 HydrophobicContact CE-SD 3.61Å; M233-L303 HydrophobicContact CE-CD2 3.97Å; M233-L303 HydrophobicContact CG-CD1 3.89Å; M233-L303 HydrophobicContact CG-CG 4.48Å; M233-L303 HydrophobicContact SD-CD1 4.2Å; M233-L303 HydrophobicContact SD-CD2 3.94Å
234	A	82.7	Confident	80.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.9	173	0	0	0	0	0	110.4	W186 F216 I217 F219	W186-A234 HydrophobicContact CD2-CB 4.44Å; W186-A234 HydrophobicContact CE3-CB 3.97Å; W186-A234 HydrophobicContact CH2-CB 3.34Å; W186-A234 HydrophobicContact CZ2-CB 3.83Å; W186-A234 HydrophobicContact CZ3-CB 3.41Å; W186-A234 VanDerWaalsContact CZ3-CB 3.41Å; F216-A234 CarbonylContact C-O 3.59Å; F216-A234 VanDerWaalsContact CA-O 3.22Å; F216-A234 WeakPolarHBondContact CA-O 3.33Å; F216-A234 WeakPolarHBondContact CB-O 3.31Å; I217-A234 HydrophobicContact CB-CB 4.5Å; I217-A234 PolarHBondContact N-O 2.82Å; I217-A234 PolarHBondContact O-N 2.92Å; F219-A234 HydrophobicContact CD2-CB 4.42Å; F219-A234 HydrophobicContact CE2-CB 3.9Å
235	S	77.4	Confident	79.8	Confident	18 Å²	18	34.9 Å²	34.9	13%	0.126	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	142	163	168.7	0	0	0	0	110	A237 E238 V240	S235-A237 PolarHBondContact O-N 2.82Å; S235-A237 PolarHBondContact OG-N 2.95Å; S235-A237 VanDerWaalsContact OG-N 3.09Å; S235-E238 WeakPolarHBondContact CB-O 3.38Å; S235-E238 PolarHBondContact OG-N 3.22Å; S235-E238 VanDerWaalsContact OG-N 3.07Å; S235-V240 PolarHBondContact N-O 2.89Å
236	A	64.7	Low	79.2	Confident	12 Å²	12	35 Å²	35	10%	0.099	19%	0.187	C	C	.	.	S	Bend	trans	-77.9	-8.7	173.2	0	0	0	0	0	113.2	K141 R214 N215 I217	K141-A236 WeakPolarHBondContact CE-O 3.27Å; K141-A236 PolarHBondContact NZ-O 3.24Å; R214-A236 WeakPolarHBondContact O-CB 3.47Å; N215-A236 WeakPolarHBondContact O-CB 3.11Å; N215-A236 PolarHBondContact O-N 3.03Å; I217-A236 HydrophobicContact CG1-CB 4.16Å
237	A	61.7	Low	78.6	Confident	64 Å²	64	36.2 Å²	36.2	53%	0.529	19%	0.191	S	C	.	.	S	Bend	trans	-123.7	-11.4	-174.5	0	0	0	0	0	114.8	S235	S235-A237 PolarHBondContact O-N 2.82Å; S235-A237 PolarHBondContact OG-N 2.95Å; S235-A237 VanDerWaalsContact OG-N 3.09Å
238	E	59.9	Low	77.5	Confident	117 Å²	117	34.6 Å²	34.6	55%	0.547	19%	0.19	S	C	.	.	S	Bend	trans	-140.5	140	179	-64.4	-176.1	171.8	0	0	109.9	S235 V240	S235-E238 WeakPolarHBondContact CB-O 3.38Å; S235-E238 PolarHBondContact OG-N 3.22Å; S235-E238 VanDerWaalsContact OG-N 3.07Å; E238-V240 HydrophobicContact CB-CG2 4.29Å; E238-V240 PolarHBondContact O-N 2.87Å
239	D	54.2	Low	76.1	Confident	111 Å²	111	39.4 Å²	39.4	59%	0.594	22%	0.224	S	C	*	.	S	Bend	trans	-77.7	63.4	176.8	-169.9	16.1	0	0	0	111.7	W186	W186-D239 HydrophobicContact CH2-CB 4.47Å; W186-D239 WeakPolarHBondContact CH2-OD1 3.47Å; W186-D239 WeakPolarHBondContact CZ3-OD1 3.36Å
240	V	61.9	Low	74.8	Confident	71 Å²	71	41 Å²	41	43%	0.43	23%	0.234	S	C	.	.			trans	-129.1	126.4	179.5	-176.1	0	0	0	0	109.5	S235 E238 L242	S235-V240 PolarHBondContact N-O 2.89Å; E238-V240 HydrophobicContact CB-CG2 4.29Å; E238-V240 PolarHBondContact O-N 2.87Å; V240-L242 HydrophobicContact CB-CD1 4.44Å; V240-L242 PolarHBondContact O-N 2.82Å
241	L	61.1	Low	73.2	Confident	70 Å²	70	46.6 Å²	46.6	37%	0.366	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117.2	165.8	173.6	75.6	0	0	0	108.9	F188 F232	F188-L241 HydrophobicContact CD2-CD1 3.75Å; F188-L241 HydrophobicContact CD2-CD2 4.06Å; F188-L241 HydrophobicContact CD2-CG 4.44Å; F188-L241 HydrophobicContact CE2-CD1 3.74Å; F188-L241 HydrophobicContact CE2-CD2 3.61Å; F188-L241 HydrophobicContact CE2-CG 4.3Å; F232-L241 HydrophobicContact CB-CD1 4.06Å; F232-L241 HydrophobicContact CD2-CD1 3.93Å; F232-L241 HydrophobicContact CG-CD1 4.4Å
242	L	70.8	Confident	71.6	Confident	43 Å²	43	54.2 Å²	54.2	23%	0.225	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-36.3	-177.8	-86.5	119.9	0	0	0	114.2	F216 M233 V240 H301	F216-L242 HydrophobicContact CE1-CB 4.49Å; F216-L242 HydrophobicContact CE1-CD1 4.19Å; F216-L242 HydrophobicContact CE1-CD2 4.41Å; M233-L242 PolarHBondContact O-N 2.81Å; V240-L242 HydrophobicContact CB-CD1 4.44Å; V240-L242 PolarHBondContact O-N 2.82Å; L242-H301 VanDerWaalsContact O-CB 3.24Å; L242-H301 WeakPolarHBondContact O-CB 3.45Å; L242-H301 PolarHBondContact O-CD2 2.81Å; L242-H301 VanDerWaalsContact O-CD2 3.27Å
243	Y	79.6	Confident	70.6	Confident	40 Å²	40	58.1 Å²	58.1	16%	0.157	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152.4	-178	-61.8	-96	0	0	0	112.6	F232 M233 M297 H301	F232-Y243 CarbonylContact C-O 3.59Å; F232-Y243 WeakPolarHBondContact CA-O 3.46Å; M233-Y243 HydrophobicContact CE-CD2 3.41Å; M233-Y243 VanDerWaalsContact CE-CD2 3.41Å; M233-Y243 HydrophobicContact CE-CE2 4.3Å; M233-Y243 HydrophobicContact CE-CG 3.64Å; M233-Y243 PolarHBondContact N-O 2.79Å; M233-Y243 PolarHBondContact O-N 2.96Å; Y243-M297 HydrophobicContact CD1-CB 4.02Å; Y243-M297 HydrophobicContact CD1-CG 3.68Å; Y243-M297 HydrophobicContact CD1-SD 4.49Å; Y243-M297 HydrophobicContact CD2-CG 4.12Å; Y243-M297 HydrophobicContact CD2-SD 4.01Å; Y243-M297 HydrophobicContact CE1-CB 3.73Å; Y243-M297 HydrophobicContact CE1-CG 3.69Å; Y243-M297 HydrophobicContact CE1-SD 4.18Å; Y243-M297 HydrophobicContact CE2-CG 4.14Å; Y243-M297 HydrophobicContact CE2-SD 3.68Å; Y243-M297 HydrophobicContact CG-CG 3.96Å; Y243-M297 HydrophobicContact CG-SD 4.46Å; Y243-H301 WeakPolarHBondContact CA-O 3.09Å; Y243-H301 VanDerWaalsContact CD1-C 3.45Å; Y243-H301 VanDerWaalsContact CD1-CA 3.49Å
244	K	84	Confident	70.2	Confident	47 Å²	47	58.2 Å²	58.2	20%	0.204	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.6	173.3	68.1	172.6	-171.7	171.8	0	112.8	L230 L231 F232 E247 R302 L303	L230-K244 HydrophobicContact CD1-CB 4.3Å; L231-K244 CarbonylContact O-C 3.55Å; L231-K244 WeakPolarHBondContact O-CA 3.34Å; F232-K244 HydrophobicContact CB-CB 4.1Å; K244-E247 IonicContact NZ-OE1 2.69Å; K244-E247 PolarHBondContact NZ-OE1 3.22Å; K244-R302 CarbonylContact O-C 3.58Å; K244-R302 WeakPolarHBondContact O-CA 3.09Å; K244-L303 PolarHBondContact O-N 2.86Å
245	T	82.2	Confident	70.6	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-69.2	172.1	176.1	53.4	0	0	0	0	113.9	L230 L231 D254 L261 L295 L303	L230-T245 WeakPolarHBondContact CD1-OG1 3.49Å; L231-T245 HydrophobicContact CB-CG2 3.83Å; L231-T245 PolarHBondContact N-OG1 2.75Å; L231-T245 PolarHBondContact O-N 3.24Å; T245-D254 WeakPolarHBondContact CB-OD2 3.36Å; T245-L261 HydrophobicContact CG2-CD2 4.4Å; T245-L295 HydrophobicContact CG2-CD1 3.69Å; T245-L295 HydrophobicContact CG2-CD2 4.05Å; T245-L303 HydrophobicContact CG2-CB 3.7Å; T245-L303 HydrophobicContact CG2-CD1 4.09Å
246	L	80.6	Confident	71.3	Confident	14 Å²	14	60.5 Å²	60.5	7%	0.073	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-75.7	133.6	-168.3	-65.9	180	0	0	0	113.3	K228 F252 D254 R302 V304	K228-L246 PolarHBondContact NZ-O 3.21Å; L246-F252 HydrophobicContact CD1-CB 4.39Å; L246-F252 WeakPolarHBondContact CD1-O 3.22Å; L246-D254 PolarHBondContact N-OD2 3.33Å; L246-R302 HydrophobicContact CD2-CB 4.33Å; L246-V304 HydrophobicContact CD1-CG1 4.31Å; L246-V304 HydrophobicContact CD2-CG1 4.2Å; L246-V304 HydrophobicContact CG-CG1 4.42Å
247	E	80.9	Confident	72.6	Confident	71 Å²	71	63.6 Å²	63.6	33%	0.332	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-69.3	150.2	175.9	-63.7	-175.1	-178	0	0	111.4	K244 S249 T250	K244-E247 IonicContact NZ-OE1 2.69Å; K244-E247 PolarHBondContact NZ-OE1 3.22Å; E247-S249 PolarHBondContact O-N 3.13Å; E247-T250 PolarHBondContact O-N 3.47Å; E247-T250 VanDerWaalsContact O-N 3.12Å; E247-T250 PolarHBondContact O-OG1 3.4Å
248	P	73.6	Confident	74.2	Confident	39 Å²	39	64 Å²	64	25%	0.253	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.1	-175.9	-22.6	32.6	0	0	0	115.8	Y225 K228 T250 E253	Y225-P248 HydrophobicContact CD1-CG 4.17Å; Y225-P248 HydrophobicContact CG-CG 4.04Å; K228-P248 HydrophobicContact CD-CG 4.08Å; P248-T250 VanDerWaalsContact C-N 3.26Å; P248-T250 PolarHBondContact O-N 3.49Å; P248-E253 VanDerWaalsContact CA-OE1 3.26Å; P248-E253 WeakPolarHBondContact CA-OE1 3.22Å; P248-E253 WeakPolarHBondContact CB-OE1 3.49Å
249	S	65.6	Low	75.9	Confident	101 Å²	101	58.6 Å²	58.6	71%	0.706	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.8	178.6	54	0	0	0	0	114	E247	E247-S249 PolarHBondContact O-N 3.13Å
250	T	65.4	Low	78	Confident	36 Å²	36	56.4 Å²	56.4	22%	0.221	31%	0.306	C	S	.	.	S	Bend	trans	-90.4	145.9	-179.1	61.1	0	0	0	0	111.7	E247 P248 F252	E247-T250 PolarHBondContact O-N 3.47Å; E247-T250 VanDerWaalsContact O-N 3.12Å; E247-T250 PolarHBondContact O-OG1 3.4Å; P248-T250 VanDerWaalsContact C-N 3.26Å; P248-T250 PolarHBondContact O-N 3.49Å; T250-F252 PolarHBondContact O-N 2.83Å
251	P	58.4	Low	79.7	Confident	120 Å²	120	53 Å²	53	78%	0.779	29%	0.285	S	S	*	.	S	Bend	trans	-72.2	4.4	-178.1	28.9	-34.9	0	0	0	114.6
252	F	61.5	Low	81.3	Confident	159 Å²	159	49.7 Å²	49.7	70%	0.697	27%	0.268	S	S	*	.	S	Bend	trans	-132	83.3	178	-61.1	-83.3	0	0	0	107.5	L246 T250	L246-F252 HydrophobicContact CD1-CB 4.39Å; L246-F252 WeakPolarHBondContact CD1-O 3.22Å; T250-F252 PolarHBondContact O-N 2.83Å
253	E	69.3	Low	82.6	Confident	84 Å²	84	49.7 Å²	49.7	39%	0.393	27%	0.266	S	S	.	.			trans	-80.5	129.7	175.6	-69.1	-157.8	105	0	0	111.4	K228 P248	K228-E253 IonicContact NZ-OE1 2.68Å; P248-E253 VanDerWaalsContact CA-OE1 3.26Å; P248-E253 WeakPolarHBondContact CA-OE1 3.22Å; P248-E253 WeakPolarHBondContact CB-OE1 3.49Å
254	D	79.3	Confident	83.5	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	26%	0.262	C	S	.	.	S	Bend	trans	-61.2	-48.6	177	-38	-31.2	0	0	0	112.3	T245 L246 L261 P305 I308	T245-D254 WeakPolarHBondContact CB-OD2 3.36Å; L246-D254 PolarHBondContact N-OD2 3.33Å; D254-L261 HydrophobicContact CB-CD2 4.46Å; D254-P305 HydrophobicContact CB-CG 4.43Å; D254-P305 WeakPolarHBondContact OD1-CD 3.43Å; D254-P305 WeakPolarHBondContact OD1-CG 3.47Å; D254-I308 VanDerWaalsContact O-CD1 3.31Å; D254-I308 WeakPolarHBondContact O-CD1 3.49Å
255	V	90.8	Very high	84.2	Confident	7 Å²	7	46.7 Å²	46.7	4%	0.042	26%	0.256	C	S	.	.	S	Bend	trans	-151.1	159.8	177	-64.8	0	0	0	0	109.9	K228 L261 A283 A286 V293	K228-V255 VanDerWaalsContact CE-O 3.25Å; K228-V255 WeakPolarHBondContact CE-O 3.14Å; K228-V255 HydrophobicContact CG-CG2 4.24Å; V255-L261 HydrophobicContact CG2-CB 3.94Å; V255-L261 HydrophobicContact CG2-CD2 4.25Å; V255-L261 HydrophobicContact CG2-CG 4.47Å; V255-A283 HydrophobicContact CG1-CB 4.38Å; V255-A286 HydrophobicContact CG1-CB 4.31Å; V255-V293 HydrophobicContact CG1-CG2 3.85Å
256	A	91.7	Very high	84.9	Confident	59 Å²	59	47.9 Å²	47.9	49%	0.488	26%	0.263	S	S	.	.			trans	-72.3	169.4	177.9	0	0	0	0	0	113.4	S259	A256-S259 VanDerWaalsContact O-CB 3.22Å; A256-S259 WeakPolarHBondContact O-CB 3.39Å; A256-S259 PolarHBondContact O-N 2.89Å; A256-S259 PolarHBondContact O-OG 3.07Å
257	H	92.7	Very high	85.6	Confident	76 Å²	76	47.3 Å²	47.3	35%	0.352	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	151.8	170	-59.5	91.9	0	0	0	112.5	Y225 N226 S259	Y225-H257 PolarHBondContact O-CD2 2.83Å; N226-H257 HydrophobicContact CB-CB 4.43Å; H257-S259 VanDerWaalsContact C-N 3.26Å; H257-S259 PolarHBondContact O-N 2.99Å
258	N	94.7	Very high	86.3	Confident	73 Å²	73	44.4 Å²	44.4	39%	0.39	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	15.4	-173.7	-49.7	-80.7	0	0	0	116.6	N226 W227 R285	N226-N258 PolarHBondContact O-N 2.89Å; W227-N258 CarbonylContact O-C 3.23Å; W227-N258 WeakPolarHBondContact O-CA 3.01Å; W227-N258 PolarHBondContact O-N 3.15Å; N258-R285 WeakPolarHBondContact O-CB 3.16Å
259	S	96.1	Very high	87.3	Confident	3 Å²	3	47 Å²	47	2%	0.021	26%	0.255	C	S	.	.	S	Bend	trans	-80.5	-19.7	-179.3	-63	0	0	0	0	115.2	W227 A256 H257 A283 R285 A286	W227-S259 PolarHBondContact O-N 2.71Å; W227-S259 VanDerWaalsContact O-N 3.08Å; A256-S259 VanDerWaalsContact O-CB 3.22Å; A256-S259 WeakPolarHBondContact O-CB 3.39Å; A256-S259 PolarHBondContact O-N 2.89Å; A256-S259 PolarHBondContact O-OG 3.07Å; H257-S259 VanDerWaalsContact C-N 3.26Å; H257-S259 PolarHBondContact O-N 2.99Å; S259-A283 CarbonylContact O-C 3.23Å; S259-A283 WeakPolarHBondContact O-CA 3.48Å; S259-R285 PolarHBondContact O-N 3.11Å; S259-A286 WeakPolarHBondContact OG-CA 3.45Å
260	Y	97.3	Very high	88.6	Confident	65 Å²	65	42.2 Å²	42.2	26%	0.255	22%	0.222	S	C	.	.			trans	60.6	43.7	-176.2	-60.8	7	0	0	0	113.5	W227 K228 G262 F263 R285	W227-Y260 HydrophobicContact CB-CD1 3.8Å; W227-Y260 HydrophobicContact CB-CE1 3.6Å; W227-Y260 HydrophobicContact CG-CE1 4.05Å; W227-Y260 PolarHBondContact O-N 3.37Å; K228-Y260 PolarHBondContact O-N 3.27Å; Y260-G262 PolarHBondContact O-N 3.23Å; Y260-F263 HydrophobicContact CD2-CD2 4.18Å; Y260-F263 WeakPolarHBondContact O-CB 3.4Å; Y260-F263 PolarHBondContact O-N 3.11Å; Y260-F263 VanDerWaalsContact O-N 3.08Å; Y260-R285 HydrophobicContact CD2-CG 4.04Å; Y260-R285 HydrophobicContact CE2-CG 4.24Å; Y260-R285 HydrophobicContact CG-CG 4.25Å; Y260-R285 VanDerWaalsContact CZ-CD 3.43Å; Y260-R285 PolarHBondContact OH-NH1 2.84Å
261	L	97.4	Very high	90	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-57.3	131.6	175.7	-175.9	67.4	0	0	0	111.7	K228 G229 L230 T245 D254 V255 A281 A283 V293	K228-L261 VanDerWaalsContact O-CB 3.29Å; K228-L261 WeakPolarHBondContact O-CB 3.34Å; K228-L261 PolarHBondContact O-N 3.4Å; G229-L261 CarbonylContact C-O 3.6Å; G229-L261 VanDerWaalsContact CA-O 3.31Å; G229-L261 WeakPolarHBondContact CA-O 3.38Å; L230-L261 PolarHBondContact N-O 2.9Å; T245-L261 HydrophobicContact CG2-CD2 4.4Å; D254-L261 HydrophobicContact CB-CD2 4.46Å; V255-L261 HydrophobicContact CG2-CB 3.94Å; V255-L261 HydrophobicContact CG2-CD2 4.25Å; V255-L261 HydrophobicContact CG2-CG 4.47Å; L261-A281 HydrophobicContact CD1-CB 3.75Å; L261-A283 HydrophobicContact CB-CB 4.37Å; L261-A283 HydrophobicContact CD1-CB 4.09Å; L261-V293 HydrophobicContact CD1-CB 4.26Å; L261-V293 HydrophobicContact CD1-CG2 3.83Å
262	G	96.5	Very high	91.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	20	-173	0	0	0	0	0	113	S207 G220 Y260 S264 G282	S207-G262 PolarHBondContact OG-O 3.5Å; G220-G262 VanDerWaalsContact CA-O 3.32Å; G220-G262 WeakPolarHBondContact CA-O 3.45Å; Y260-G262 PolarHBondContact O-N 3.23Å; G262-S264 VanDerWaalsContact C-N 3.25Å; G262-G282 PolarHBondContact N-O 2.63Å
263	F	98.2	Very high	93.1	Very high	43 Å²	43	31.8 Å²	31.8	19%	0.189	17%	0.165	C	C	.	.	S	Bend	trans	-63.2	-36.9	169.1	-171	-85	0	0	0	111.4	L206 S207 Y260 G282 P284 Y320	L206-F263 HydrophobicContact CD2-CD2 3.57Å; L206-F263 HydrophobicContact CD2-CE2 3.7Å; L206-F263 HydrophobicContact CD2-CG 4.18Å; L206-F263 HydrophobicContact CD2-CZ 4.39Å; S207-F263 VanDerWaalsContact CB-O 3.31Å; S207-F263 WeakPolarHBondContact CB-O 3.39Å; Y260-F263 HydrophobicContact CD2-CD2 4.18Å; Y260-F263 WeakPolarHBondContact O-CB 3.4Å; Y260-F263 PolarHBondContact O-N 3.11Å; Y260-F263 VanDerWaalsContact O-N 3.08Å; F263-G282 PolarHBondContact N-O 3.41Å; F263-G282 VanDerWaalsContact N-O 3.16Å; F263-P284 VanDerWaalsContact CB-CD 3.45Å; F263-P284 HydrophobicContact CB-CG 3.75Å; F263-P284 HydrophobicContact CD1-CG 3.88Å; F263-P284 HydrophobicContact CD2-CG 4.1Å; F263-P284 HydrophobicContact CG-CG 3.63Å; F263-Y320 HydrophobicContact CD1-CD2 4.33Å; F263-Y320 WeakPolarHBondContact CD1-O 3.3Å; F263-Y320 HydrophobicContact CE1-CD1 4.28Å; F263-Y320 AromaticContact CE1-CD2 3.49Å; F263-Y320 HydrophobicContact CE1-CD2 3.49Å; F263-Y320 VanDerWaalsContact CE1-CD2 3.49Å; F263-Y320 HydrophobicContact CE1-CE1 4.17Å; F263-Y320 AromaticContact CE1-CE2 3.38Å; F263-Y320 HydrophobicContact CE1-CE2 3.38Å; F263-Y320 AromaticContact CE1-CG 3.93Å; F263-Y320 HydrophobicContact CE1-CG 3.93Å; F263-Y320 AromaticContact CE1-CZ 3.72Å; F263-Y320 AromaticContact CZ-CD2 3.92Å; F263-Y320 HydrophobicContact CZ-CD2 3.92Å; F263-Y320 AromaticContact CZ-CE2 3.46Å; F263-Y320 HydrophobicContact CZ-CE2 3.46Å; F263-Y320 VanDerWaalsContact CZ-CE2 3.46Å; F263-Y320 AromaticContact CZ-CZ 3.95Å
264	S	98.3	Very high	94.1	Very high	11 Å²	11	32 Å²	32	8%	0.077	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.8	169.3	62.7	0	0	0	0	109.5	G262 G282 G319 Y320	G262-S264 VanDerWaalsContact C-N 3.25Å; S264-G282 PolarHBondContact O-N 3.03Å; S264-G282 WeakPolarHBondContact OG-CA 3.5Å; S264-G319 PolarHBondContact OG-O 3.1Å; S264-Y320 WeakPolarHBondContact CB-O 3.08Å
265	V	97.6	Very high	94.6	Very high	13 Å²	13	40.4 Å²	40.4	8%	0.079	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	141.7	-177.2	-63.6	0	0	0	0	111.4	S207 L218 L231 V280	S207-V265 WeakPolarHBondContact OG-CG1 3.06Å; L218-V265 HydrophobicContact CB-CG2 4.47Å; L231-V265 HydrophobicContact CD1-CG1 3.65Å; V265-V280 WeakPolarHBondContact CA-O 3.45Å
266	D	96.9	Very high	94.6	Very high	29 Å²	29	45.5 Å²	45.5	16%	0.155	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	175	167.7	-161.2	14.8	0	0	0	110.9	V280 V322 T324	D266-V280 HydrophobicContact CB-CB 4.47Å; D266-V280 PolarHBondContact N-O 3.11Å; D266-V280 PolarHBondContact O-N 2.83Å; D266-V322 HydrophobicContact CB-CG2 4.05Å; D266-T324 HydrophobicContact CB-CG2 4.42Å; D266-T324 WeakPolarHBondContact OD2-CB 3.28Å; D266-T324 PolarHBondContact OD2-N 3.34Å; D266-T324 PolarHBondContact OD2-OG1 3.39Å
267	S	95.8	Very high	94.6	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	141.8	173.6	61.4	0	0	0	0	113.6	P212 L218 T278	P212-S267 VanDerWaalsContact CD-O 3.29Å; P212-S267 WeakPolarHBondContact CD-O 3.45Å; P212-S267 VanDerWaalsContact CG-O 3.26Å; P212-S267 WeakPolarHBondContact CG-O 3.22Å; L218-S267 WeakPolarHBondContact CD1-OG 3.48Å; S267-T278 WeakPolarHBondContact CA-O 3.46Å; S267-T278 WeakPolarHBondContact CB-O 3.49Å
268	A	95.6	Very high	94.7	Very high	10 Å²	10	39.7 Å²	39.7	8%	0.083	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	166.4	171.6	0	0	0	0	0	112.4	I271 T278 T333	A268-I271 HydrophobicContact CB-CD1 3.94Å; A268-I271 HydrophobicContact CB-CG1 4.08Å; A268-T278 PolarHBondContact N-O 2.84Å; A268-T278 PolarHBondContact O-N 2.86Å; A268-T333 HydrophobicContact CB-CG2 3.69Å
269	K	94.6	Very high	94.8	Very high	92 Å²	92	36.2 Å²	36.2	40%	0.4	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	163.5	160.9	-62.6	-179.9	-178.8	172.7	0	108.1	I271 E276 L277 T333	K269-I271 VanDerWaalsContact C-N 3.26Å; K269-I271 PolarHBondContact O-N 3.33Å; K269-E276 WeakPolarHBondContact CA-O 3.31Å; K269-L277 HydrophobicContact CG-CD2 3.77Å; K269-L277 HydrophobicContact CG-CG 4.25Å; K269-T333 WeakPolarHBondContact O-CB 3.34Å; K269-T333 PolarHBondContact O-OG1 2.77Å; K269-T333 VanDerWaalsContact O-OG1 3.05Å
270	G	93.4	Very high	94.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	17%	0.172	C	C	.	.	S	Bend	trans	72	14.9	176.4	0	0	0	0	0	115	N273 W332 T333 N358	G270-N273 WeakPolarHBondContact CA-O 3.36Å; G270-N273 PolarHBondContact N-O 2.87Å; G270-W332 WeakPolarHBondContact O-CA 3.46Å; G270-W332 VanDerWaalsContact O-CE3 3.24Å; G270-T333 PolarHBondContact O-N 3.18Å; G270-N358 PolarHBondContact O-ND2 2.87Å
271	I	94.9	Very high	94.9	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-84.8	-59.8	168.4	-56.1	178.8	0	0	0	109.9	A268 K269 T278 V280 L294 T324 T333 V335 N358 W363	A268-I271 HydrophobicContact CB-CD1 3.94Å; A268-I271 HydrophobicContact CB-CG1 4.08Å; K269-I271 VanDerWaalsContact C-N 3.26Å; K269-I271 PolarHBondContact O-N 3.33Å; I271-T278 HydrophobicContact CB-CG2 4.01Å; I271-T278 HydrophobicContact CD1-CG2 4.41Å; I271-T278 HydrophobicContact CG2-CG2 4.04Å; I271-V280 HydrophobicContact CD1-CG2 3.64Å; I271-L294 HydrophobicContact CG2-CD1 3.72Å; I271-L294 HydrophobicContact CG2-CD2 4.21Å; I271-T324 HydrophobicContact CD1-CG2 3.74Å; I271-T333 HydrophobicContact CG1-CG2 4.22Å; I271-V335 HydrophobicContact CD1-CG2 4.44Å; I271-V335 HydrophobicContact CG2-CG2 3.86Å; I271-N358 WeakPolarHBondContact CA-ND2 3.39Å; I271-N358 PolarHBondContact O-ND2 2.85Å; I271-W363 HydrophobicContact CG2-CZ2 3.89Å; I271-W363 PolarHBondContact O-NE1 2.93Å
272	M	93	Very high	94.9	Very high	40 Å²	40	33 Å²	33	20%	0.197	16%	0.16	C	C	.	.	S	Bend	trans	-99.5	-25.1	174.4	-61.2	-67.9	-44.9	0	0	112.8	T278 L294 Q306 H307	M272-T278 HydrophobicContact CG-CG2 3.67Å; M272-T278 PolarHBondContact N-OG1 3.23Å; M272-L294 HydrophobicContact CG-CD1 4.43Å; M272-L294 HydrophobicContact SD-CB 4.43Å; M272-L294 HydrophobicContact SD-CD1 3.75Å; M272-Q306 HydrophobicContact CE-CB 3.98Å; M272-Q306 HydrophobicContact CG-CB 4.49Å; M272-Q306 HydrophobicContact SD-CB 4.25Å; M272-H307 HydrophobicContact SD-CB 4.35Å
273	N	91.8	Very high	95	Very high	56 Å²	56	33 Å²	33	30%	0.299	16%	0.16	S	C	.	.			trans	-158.1	131.2	-175.2	177.1	-22.7	0	0	0	109.3	G270 K275 E276	G270-N273 WeakPolarHBondContact CA-O 3.36Å; G270-N273 PolarHBondContact N-O 2.87Å; N273-K275 PolarHBondContact O-N 2.71Å; N273-K275 PolarHBondContact OD1-N 2.85Å; N273-E276 HydrophobicContact CB-CB 4.15Å; N273-E276 PolarHBondContact ND2-OE2 3.18Å; N273-E276 PolarHBondContact O-N 2.82Å
274	L	90.4	Very high	95	Very high	90 Å²	90	31.3 Å²	31.3	47%	0.471	15%	0.153	S	C	.	.	S	Bend	trans	-54.2	-23.9	-178.7	-67.6	172.7	0	0	0	115.4	G331 W332	L274-G331 VanDerWaalsContact CD2-O 3.3Å; L274-G331 WeakPolarHBondContact CD2-O 3.14Å; L274-W332 HydrophobicContact CD1-CH2 4.45Å; L274-W332 HydrophobicContact CD1-CZ2 3.84Å; L274-W332 HydrophobicContact CD2-CD2 3.68Å; L274-W332 HydrophobicContact CD2-CE3 4.13Å; L274-W332 HydrophobicContact CD2-CG 4.06Å; L274-W332 HydrophobicContact CD2-CH2 4.36Å; L274-W332 HydrophobicContact CD2-CZ2 3.96Å; L274-W332 HydrophobicContact CD2-CZ3 4.43Å; L274-W332 HydrophobicContact CG-CD2 4.23Å; L274-W332 HydrophobicContact CG-CE3 4.43Å; L274-W332 HydrophobicContact CG-CH2 3.85Å; L274-W332 HydrophobicContact CG-CZ2 3.61Å; L274-W332 HydrophobicContact CG-CZ3 4.25Å
275	K	88.7	Confident	94.9	Very high	178 Å²	178	36 Å²	36	77%	0.774	17%	0.169	S	C	*	.	S	Bend	trans	-110.1	-25.4	-175.2	-65	-176.7	-178.4	177.6	0	114.7	N273	N273-K275 PolarHBondContact O-N 2.71Å; N273-K275 PolarHBondContact OD1-N 2.85Å
276	E	90.5	Very high	94.9	Very high	114 Å²	114	35.4 Å²	35.4	53%	0.533	17%	0.166	S	C	.	.	S	Bend	trans	-96.3	144.6	-174	-63.8	174.6	165.7	0	0	110.6	K269 N273 T278	K269-E276 WeakPolarHBondContact CA-O 3.31Å; N273-E276 HydrophobicContact CB-CB 4.15Å; N273-E276 PolarHBondContact ND2-OE2 3.18Å; N273-E276 PolarHBondContact O-N 2.82Å; E276-T278 PolarHBondContact O-N 3.19Å
277	L	92.6	Very high	94.7	Very high	12 Å²	12	39.4 Å²	39.4	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.5	173.2	-75.2	169.2	0	0	0	110	T211 K269 F279	T211-L277 HydrophobicContact CG2-CD1 4.13Å; K269-L277 HydrophobicContact CG-CD2 3.77Å; K269-L277 HydrophobicContact CG-CG 4.25Å; L277-F279 HydrophobicContact CB-CE1 4.18Å; L277-F279 HydrophobicContact CB-CE2 4.24Å; L277-F279 HydrophobicContact CB-CZ 3.75Å; L277-F279 HydrophobicContact CD1-CE1 4.44Å; L277-F279 HydrophobicContact CD1-CZ 4.29Å
278	T	95.5	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	135.1	165.3	-51	0	0	0	0	108.2	S267 A268 I271 M272 E276 L294	S267-T278 WeakPolarHBondContact CA-O 3.46Å; S267-T278 WeakPolarHBondContact CB-O 3.49Å; A268-T278 PolarHBondContact N-O 2.84Å; A268-T278 PolarHBondContact O-N 2.86Å; I271-T278 HydrophobicContact CB-CG2 4.01Å; I271-T278 HydrophobicContact CD1-CG2 4.41Å; I271-T278 HydrophobicContact CG2-CG2 4.04Å; M272-T278 HydrophobicContact CG-CG2 3.67Å; M272-T278 PolarHBondContact N-OG1 3.23Å; E276-T278 PolarHBondContact O-N 3.19Å; T278-L294 HydrophobicContact CG2-CB 4.05Å; T278-L294 HydrophobicContact CG2-CD2 4.35Å
279	F	95.8	Very high	94.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.6	178.2	-48.1	-83	0	0	0	109.2	T211 L218 L231 M233 L277 L295 M297 L303	T211-F279 HydrophobicContact CG2-CE1 3.78Å; L218-F279 HydrophobicContact CD1-CD1 3.92Å; L218-F279 HydrophobicContact CD2-CD1 3.49Å; L218-F279 VanDerWaalsContact CD2-CD1 3.49Å; L218-F279 HydrophobicContact CD2-CE1 3.86Å; L218-F279 HydrophobicContact CD2-CG 4.4Å; L218-F279 HydrophobicContact CG-CD1 4.33Å; L231-F279 HydrophobicContact CD2-CB 4.2Å; M233-F279 HydrophobicContact CE-CE1 4.11Å; M233-F279 HydrophobicContact CE-CE2 4.02Å; M233-F279 HydrophobicContact CE-CZ 3.63Å; M233-F279 HydrophobicContact SD-CD1 3.74Å; M233-F279 HydrophobicContact SD-CD2 4.27Å; M233-F279 HydrophobicContact SD-CE1 3.37Å; M233-F279 WeakPolarHBondContact SD-CE1 3.39Å; M233-F279 HydrophobicContact SD-CE2 3.98Å; M233-F279 HydrophobicContact SD-CG 4.17Å; M233-F279 HydrophobicContact SD-CZ 3.51Å; M233-F279 VanDerWaalsContact SD-CZ 3.51Å; L277-F279 HydrophobicContact CB-CE1 4.18Å; L277-F279 HydrophobicContact CB-CE2 4.24Å; L277-F279 HydrophobicContact CB-CZ 3.75Å; L277-F279 HydrophobicContact CD1-CE1 4.44Å; L277-F279 HydrophobicContact CD1-CZ 4.29Å; F279-L295 HydrophobicContact CB-CB 4.21Å; F279-L295 WeakPolarHBondContact CD2-O 3.38Å; F279-L295 PolarHBondContact N-O 3.2Å; F279-L295 PolarHBondContact O-N 2.84Å; F279-M297 HydrophobicContact CE2-CE 4Å; F279-M297 HydrophobicContact CE2-CG 3.89Å; F279-M297 HydrophobicContact CE2-SD 4.38Å; F279-M297 HydrophobicContact CZ-CE 3.87Å; F279-M297 HydrophobicContact CZ-CG 4.31Å; F279-M297 HydrophobicContact CZ-SD 4.25Å; F279-L303 HydrophobicContact CD2-CD2 3.61Å; F279-L303 HydrophobicContact CE2-CD2 3.89Å; F279-L303 HydrophobicContact CG-CD2 4.33Å
280	V	97.4	Very high	94.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.4	-175.7	-172.3	0	0	0	0	108	V265 D266 I271 V292 L294 V322 T324 V335	V265-V280 WeakPolarHBondContact CA-O 3.45Å; D266-V280 HydrophobicContact CB-CB 4.47Å; D266-V280 PolarHBondContact N-O 3.11Å; D266-V280 PolarHBondContact O-N 2.83Å; I271-V280 HydrophobicContact CD1-CG2 3.64Å; V280-V292 HydrophobicContact CG1-CG1 3.42Å; V280-V292 VanDerWaalsContact CG1-CG1 3.42Å; V280-L294 HydrophobicContact CB-CD2 4.36Å; V280-L294 HydrophobicContact CG1-CD2 4.15Å; V280-L294 HydrophobicContact CG2-CD2 3.8Å; V280-V322 HydrophobicContact CG1-CB 4.16Å; V280-V322 HydrophobicContact CG1-CG1 4.19Å; V280-V322 HydrophobicContact CG1-CG2 4.24Å; V280-T324 HydrophobicContact CG2-CG2 3.78Å; V280-V335 HydrophobicContact CG1-CG1 4.42Å
281	A	98	Very high	95	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.1	-179.3	0	0	0	0	0	111.5	L231 L261 V292 V293 L295	L231-A281 HydrophobicContact CD2-CB 4.22Å; L261-A281 HydrophobicContact CD1-CB 3.75Å; A281-V292 WeakPolarHBondContact O-CA 3.43Å; A281-V293 PolarHBondContact N-O 2.7Å; A281-V293 PolarHBondContact O-N 2.99Å; A281-L295 HydrophobicContact CB-CD1 4.01Å
282	G	98.3	Very high	95.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	140.5	172.5	0	0	0	0	0	112.7	G262 F263 S264 G319	G262-G282 PolarHBondContact N-O 2.63Å; F263-G282 PolarHBondContact N-O 3.41Å; F263-G282 VanDerWaalsContact N-O 3.16Å; S264-G282 PolarHBondContact O-N 3.03Å; S264-G282 WeakPolarHBondContact OG-CA 3.5Å; G282-G319 WeakPolarHBondContact CA-O 3.47Å
283	A	98.1	Very high	95.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	71.9	176.5	0	0	0	0	0	109.3	V255 S259 L261 R285 A286 A291	V255-A283 HydrophobicContact CG1-CB 4.38Å; S259-A283 CarbonylContact O-C 3.23Å; S259-A283 WeakPolarHBondContact O-CA 3.48Å; L261-A283 HydrophobicContact CB-CB 4.37Å; L261-A283 HydrophobicContact CD1-CB 4.09Å; A283-R285 PolarHBondContact O-N 2.79Å; A283-A286 HydrophobicContact CB-CB 4Å; A283-A286 VanDerWaalsContact O-CB 3.26Å; A283-A286 WeakPolarHBondContact O-CB 3.27Å; A283-A286 PolarHBondContact O-N 2.9Å; A283-A291 PolarHBondContact N-O 3.34Å; A283-A291 PolarHBondContact O-N 3.18Å
284	P	97.9	Very high	95.4	Very high	8 Å²	8	37 Å²	37	5%	0.052	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-7.4	-166	25.7	-35.4	0	0	0	115.5	F263 G290 F318	F263-P284 VanDerWaalsContact CB-CD 3.45Å; F263-P284 HydrophobicContact CB-CG 3.75Å; F263-P284 HydrophobicContact CD1-CG 3.88Å; F263-P284 HydrophobicContact CD2-CG 4.1Å; F263-P284 HydrophobicContact CG-CG 3.63Å; P284-G290 WeakPolarHBondContact O-CA 3.4Å; P284-F318 WeakPolarHBondContact CA-O 3.32Å
285	R	97	Very high	95.6	Very high	110 Å²	110	32.7 Å²	32.7	42%	0.415	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-3.2	174.7	-63.9	-167.4	69.4	-157.5	-7.4	113.9	N258 S259 Y260 A283 N287 H288	N258-R285 WeakPolarHBondContact O-CB 3.16Å; S259-R285 PolarHBondContact O-N 3.11Å; Y260-R285 HydrophobicContact CD2-CG 4.04Å; Y260-R285 HydrophobicContact CE2-CG 4.24Å; Y260-R285 HydrophobicContact CG-CG 4.25Å; Y260-R285 VanDerWaalsContact CZ-CD 3.43Å; Y260-R285 PolarHBondContact OH-NH1 2.84Å; A283-R285 PolarHBondContact O-N 2.79Å; R285-N287 PolarHBondContact O-N 2.85Å; R285-H288 PolarHBondContact O-N 2.96Å
286	A	96.2	Very high	95.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-56.4	128.3	179.1	0	0	0	0	0	110.9	V255 S259 A283 H288 T289 G290 A291 W310	V255-A286 HydrophobicContact CG1-CB 4.31Å; S259-A286 WeakPolarHBondContact OG-CA 3.45Å; A283-A286 HydrophobicContact CB-CB 4Å; A283-A286 VanDerWaalsContact O-CB 3.26Å; A283-A286 WeakPolarHBondContact O-CB 3.27Å; A283-A286 PolarHBondContact O-N 2.9Å; A286-H288 PolarHBondContact O-N 2.88Å; A286-T289 PolarHBondContact O-N 2.98Å; A286-G290 WeakPolarHBondContact O-CA 3.21Å; A286-G290 PolarHBondContact O-N 2.84Å; A286-A291 HydrophobicContact CB-CB 3.61Å; A286-W310 HydrophobicContact CB-CZ3 3.92Å
287	N	94	Very high	95.7	Very high	112 Å²	112	26.4 Å²	26.4	60%	0.599	12%	0.121	S	C	*	.	G	3₁₀ helix	trans	51.2	21.7	-176.6	-162.6	31.4	0	0	0	115.1	R285 T289 W310	R285-N287 PolarHBondContact O-N 2.85Å; N287-T289 PolarHBondContact O-N 3.24Å; N287-W310 HydrophobicContact CB-CE3 3.98Å; N287-W310 HydrophobicContact CB-CH2 4.37Å; N287-W310 HydrophobicContact CB-CZ3 3.51Å
288	H	94.4	Very high	95.3	Very high	129 Å²	129	26.6 Å²	26.6	60%	0.597	12%	0.122	S	C	*	.	G	3₁₀ helix	trans	61.9	-8.9	-173.5	-46.7	89.8	0	0	0	116.8	R285 A286 L314 A315	R285-H288 PolarHBondContact O-N 2.96Å; A286-H288 PolarHBondContact O-N 2.88Å; H288-L314 HydrophobicContact CB-CD1 3.55Å; H288-A315 WeakPolarHBondContact O-CA 3.44Å; H288-A315 PolarHBondContact O-N 2.89Å
289	T	95.1	Very high	94.5	Very high	21 Å²	21	34.3 Å²	34.3	13%	0.129	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-31.1	171.5	61.9	0	0	0	0	112.1	A286 N287 G311 E313 S316 F318	A286-T289 PolarHBondContact O-N 2.98Å; N287-T289 PolarHBondContact O-N 3.24Å; T289-G311 WeakPolarHBondContact CB-O 3.32Å; T289-G311 PolarHBondContact OG1-O 2.83Å; T289-E313 WeakPolarHBondContact CA-O 3.4Å; T289-E313 WeakPolarHBondContact CB-O 3.41Å; T289-S316 PolarHBondContact O-OG 2.86Å; T289-S316 VanDerWaalsContact O-OG 3.09Å; T289-F318 WeakPolarHBondContact O-CB 3.31Å; T289-F318 PolarHBondContact O-N 3.33Å
290	G	97.3	Very high	93.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	104.3	157.6	-173.7	0	0	0	0	0	112	P284 A286 G311 F318	P284-G290 WeakPolarHBondContact O-CA 3.4Å; A286-G290 WeakPolarHBondContact O-CA 3.21Å; A286-G290 PolarHBondContact O-N 2.84Å; G290-G311 PolarHBondContact O-N 3.16Å; G290-F318 CarbonylContact C-O 3.53Å; G290-F318 VanDerWaalsContact CA-O 3.23Å; G290-F318 WeakPolarHBondContact CA-O 3.48Å
291	A	97.1	Very high	93	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	160	177.9	0	0	0	0	0	112.5	A283 A286 I308 F309 W310 F318	A283-A291 PolarHBondContact N-O 3.34Å; A283-A291 PolarHBondContact O-N 3.18Å; A286-A291 HydrophobicContact CB-CB 3.61Å; A291-I308 HydrophobicContact CB-CG2 3.97Å; A291-F309 CarbonylContact C-O 3.52Å; A291-F309 WeakPolarHBondContact CA-O 3.49Å; A291-F309 WeakPolarHBondContact CB-O 3.45Å; A291-W310 HydrophobicContact CB-CD2 4.36Å; A291-W310 HydrophobicContact CB-CE3 3.8Å; A291-W310 HydrophobicContact CB-CH2 4.49Å; A291-W310 HydrophobicContact CB-CZ3 3.87Å; A291-F318 PolarHBondContact N-O 2.56Å; A291-F318 VanDerWaalsContact N-O 3.12Å
292	V	97.7	Very high	92.4	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.9	166.5	173.9	0	0	0	0	108.7	V280 A281 I308 F309 F318 V322 V337	V280-V292 HydrophobicContact CG1-CG1 3.42Å; V280-V292 VanDerWaalsContact CG1-CG1 3.42Å; A281-V292 WeakPolarHBondContact O-CA 3.43Å; V292-I308 WeakPolarHBondContact O-CA 3.42Å; V292-F309 HydrophobicContact CB-CB 4.4Å; V292-F309 HydrophobicContact CB-CD2 4.27Å; V292-F309 HydrophobicContact CG1-CD2 4.28Å; V292-F309 PolarHBondContact N-O 2.87Å; V292-F309 PolarHBondContact O-N 2.87Å; V292-F318 HydrophobicContact CB-CE1 4.29Å; V292-F318 HydrophobicContact CG2-CD1 4.37Å; V292-F318 HydrophobicContact CG2-CE1 3.95Å; V292-V322 HydrophobicContact CG1-CG1 4.15Å; V292-V322 HydrophobicContact CG2-CG1 3.75Å; V292-V337 HydrophobicContact CB-CG2 4.39Å; V292-V337 HydrophobicContact CG2-CB 4.35Å; V292-V337 HydrophobicContact CG2-CG1 3.53Å; V292-V337 HydrophobicContact CG2-CG2 3.83Å
293	V	96.7	Very high	92	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.6	-176.5	-172.6	0	0	0	0	109.5	V255 L261 A281 L295 P305 I308	V255-V293 HydrophobicContact CG1-CG2 3.85Å; L261-V293 HydrophobicContact CD1-CB 4.26Å; L261-V293 HydrophobicContact CD1-CG2 3.83Å; A281-V293 PolarHBondContact N-O 2.7Å; A281-V293 PolarHBondContact O-N 2.99Å; V293-L295 HydrophobicContact CG1-CD2 3.76Å; V293-L295 HydrophobicContact CG1-CG 3.88Å; V293-P305 HydrophobicContact CG1-CB 3.97Å; V293-I308 HydrophobicContact CG1-CG1 4.24Å; V293-I308 HydrophobicContact CG2-CG1 4.37Å; V293-I308 HydrophobicContact CG2-CG2 4.43Å
294	L	95.7	Very high	91.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.5	168.9	-59	-171	0	0	0	109.3	I271 M272 T278 V280 Q306 H307 F309	I271-L294 HydrophobicContact CG2-CD1 3.72Å; I271-L294 HydrophobicContact CG2-CD2 4.21Å; M272-L294 HydrophobicContact CG-CD1 4.43Å; M272-L294 HydrophobicContact SD-CB 4.43Å; M272-L294 HydrophobicContact SD-CD1 3.75Å; T278-L294 HydrophobicContact CG2-CB 4.05Å; T278-L294 HydrophobicContact CG2-CD2 4.35Å; V280-L294 HydrophobicContact CB-CD2 4.36Å; V280-L294 HydrophobicContact CG1-CD2 4.15Å; V280-L294 HydrophobicContact CG2-CD2 3.8Å; L294-Q306 PolarHBondContact O-N 3.04Å; L294-H307 HydrophobicContact CB-CB 4.24Å; L294-H307 HydrophobicContact CD1-CB 4.16Å; L294-H307 HydrophobicContact CG-CB 4.42Å; L294-H307 PolarHBondContact N-O 3.29Å; L294-F309 HydrophobicContact CD1-CE2 3.8Å; L294-F309 HydrophobicContact CD1-CZ 4.07Å; L294-F309 HydrophobicContact CD2-CE2 4.16Å; L294-F309 HydrophobicContact CG-CE2 3.96Å
295	L	94.4	Very high	91.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.9	-172.1	-63.8	160.5	0	0	0	110.9	L231 T245 F279 A281 V293 L303 V304 P305	L231-L295 HydrophobicContact CD2-CD1 3.72Å; T245-L295 HydrophobicContact CG2-CD1 3.69Å; T245-L295 HydrophobicContact CG2-CD2 4.05Å; F279-L295 HydrophobicContact CB-CB 4.21Å; F279-L295 WeakPolarHBondContact CD2-O 3.38Å; F279-L295 PolarHBondContact N-O 3.2Å; F279-L295 PolarHBondContact O-N 2.84Å; A281-L295 HydrophobicContact CB-CD1 4.01Å; V293-L295 HydrophobicContact CG1-CD2 3.76Å; V293-L295 HydrophobicContact CG1-CG 3.88Å; L295-L303 HydrophobicContact CB-CB 4.45Å; L295-V304 WeakPolarHBondContact CA-O 3.21Å; L295-P305 HydrophobicContact CD2-CB 4.28Å
296	R	91.8	Very high	91.1	Very high	106 Å²	106	50 Å²	50	40%	0.4	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	160.3	167.8	63.7	174.6	179.8	99.8	-2.9	112.4	L303 V304 Q306	R296-L303 CarbonylContact O-C 3.57Å; R296-L303 VanDerWaalsContact O-CA 3.3Å; R296-L303 WeakPolarHBondContact O-CA 3.38Å; R296-V304 HydrophobicContact CG-CG2 3.64Å; R296-V304 PolarHBondContact N-O 2.86Å; R296-V304 PolarHBondContact O-N 2.73Å; R296-Q306 HydrophobicContact CB-CG 4.2Å; R296-Q306 HydrophobicContact CG-CG 3.72Å
297	M	89.2	Confident	90.9	Very high	55 Å²	55	52.3 Å²	52.3	27%	0.271	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	145.6	164.2	-69.9	170.3	-70.9	0	0	111.2	M233 Y243 F279 R302 L303	M233-M297 HydrophobicContact CE-CG 3.61Å; M233-M297 HydrophobicContact CE-SD 3.61Å; Y243-M297 HydrophobicContact CD1-CB 4.02Å; Y243-M297 HydrophobicContact CD1-CG 3.68Å; Y243-M297 HydrophobicContact CD1-SD 4.49Å; Y243-M297 HydrophobicContact CD2-CG 4.12Å; Y243-M297 HydrophobicContact CD2-SD 4.01Å; Y243-M297 HydrophobicContact CE1-CB 3.73Å; Y243-M297 HydrophobicContact CE1-CG 3.69Å; Y243-M297 HydrophobicContact CE1-SD 4.18Å; Y243-M297 HydrophobicContact CE2-CG 4.14Å; Y243-M297 HydrophobicContact CE2-SD 3.68Å; Y243-M297 HydrophobicContact CG-CG 3.96Å; Y243-M297 HydrophobicContact CG-SD 4.46Å; F279-M297 HydrophobicContact CE2-CE 4Å; F279-M297 HydrophobicContact CE2-CG 3.89Å; F279-M297 HydrophobicContact CE2-SD 4.38Å; F279-M297 HydrophobicContact CZ-CE 3.87Å; F279-M297 HydrophobicContact CZ-CG 4.31Å; F279-M297 HydrophobicContact CZ-SD 4.25Å; M297-R302 CarbonylContact C-O 3.28Å; M297-R302 WeakPolarHBondContact CA-O 3.03Å; M297-L303 HydrophobicContact CG-CD2 4.19Å
298	D	84.8	Confident	90.9	Very high	15 Å²	15	49 Å²	49	8%	0.08	24%	0.24	C	C	.	.			trans	-113.2	171.6	165.6	89.3	-14.6	0	0	0	112.1	V300 H301 R302 V304	D298-V300 PolarHBondContact O-N 3.27Å; D298-V300 VanDerWaalsContact OD1-C 3.24Å; D298-V300 WeakPolarHBondContact OD1-CA 3.3Å; D298-V300 PolarHBondContact OD1-N 2.94Å; D298-H301 PolarHBondContact OD1-N 2.89Å; D298-R302 PolarHBondContact N-O 3.04Å; D298-R302 WeakPolarHBondContact OD1-CB 3.44Å; D298-R302 PolarHBondContact OD1-N 3.42Å; D298-R302 IonicContact OD1-NE 3.42Å; D298-R302 IonicContact OD2-CZ 3.46Å; D298-R302 IonicContact OD2-NE 2.69Å; D298-R302 PolarHBondContact OD2-NE 2.82Å; D298-R302 IonicContact OD2-NH2 3.29Å; D298-R302 PolarHBondContact OD2-NH2 2.87Å; D298-V304 HydrophobicContact CB-CG1 4.22Å; D298-V304 HydrophobicContact CB-CG2 4.28Å
299	N	78.5	Confident	90.9	Very high	165 Å²	165	43.3 Å²	43.3	88%	0.882	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	5.6	-177.9	-61.1	-11.1	0	0	0	113.9
300	V	79.9	Confident	90.8	Very high	93 Å²	93	47.9 Å²	47.9	56%	0.564	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.2	28.7	-173.2	-153.2	0	0	0	0	111	D298 R302	D298-V300 PolarHBondContact O-N 3.27Å; D298-V300 VanDerWaalsContact OD1-C 3.24Å; D298-V300 WeakPolarHBondContact OD1-CA 3.3Å; D298-V300 PolarHBondContact OD1-N 2.94Å; V300-R302 VanDerWaalsContact C-N 3.32Å; V300-R302 PolarHBondContact O-N 2.89Å
301	H	80.4	Confident	90.7	Very high	115 Å²	115	48.2 Å²	48.2	53%	0.532	23%	0.232	S	C	.	.	S	Bend	trans	63.8	33.8	174.5	-58.9	86.1	0	0	0	113.5	L242 Y243 D298	L242-H301 VanDerWaalsContact O-CB 3.24Å; L242-H301 WeakPolarHBondContact O-CB 3.45Å; L242-H301 PolarHBondContact O-CD2 2.81Å; L242-H301 VanDerWaalsContact O-CD2 3.27Å; Y243-H301 WeakPolarHBondContact CA-O 3.09Å; Y243-H301 VanDerWaalsContact CD1-C 3.45Å; Y243-H301 VanDerWaalsContact CD1-CA 3.49Å; D298-H301 PolarHBondContact OD1-N 2.89Å
302	R	87.1	Confident	90.3	Very high	99 Å²	99	53.7 Å²	53.7	37%	0.374	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-119.9	151.9	176	-54.6	177	-61.9	175.2	2.4	112.3	K244 L246 M297 D298 V300 V304	K244-R302 CarbonylContact O-C 3.58Å; K244-R302 WeakPolarHBondContact O-CA 3.09Å; L246-R302 HydrophobicContact CD2-CB 4.33Å; M297-R302 CarbonylContact C-O 3.28Å; M297-R302 WeakPolarHBondContact CA-O 3.03Å; D298-R302 PolarHBondContact N-O 3.04Å; D298-R302 WeakPolarHBondContact OD1-CB 3.44Å; D298-R302 PolarHBondContact OD1-N 3.42Å; D298-R302 IonicContact OD1-NE 3.42Å; D298-R302 IonicContact OD2-CZ 3.46Å; D298-R302 IonicContact OD2-NE 2.69Å; D298-R302 PolarHBondContact OD2-NE 2.82Å; D298-R302 IonicContact OD2-NH2 3.29Å; D298-R302 PolarHBondContact OD2-NH2 2.87Å; V300-R302 VanDerWaalsContact C-N 3.32Å; V300-R302 PolarHBondContact O-N 2.89Å; R302-V304 HydrophobicContact CB-CG1 4.32Å
303	L	89.4	Confident	90	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.1	162.8	-68.9	176.1	0	0	0	108.1	L231 M233 K244 T245 F279 L295 R296 M297	L231-L303 HydrophobicContact CB-CD1 4.28Å; L231-L303 HydrophobicContact CD2-CD1 3.82Å; L231-L303 HydrophobicContact CG-CD1 3.79Å; M233-L303 HydrophobicContact CE-CD2 3.97Å; M233-L303 HydrophobicContact CG-CD1 3.89Å; M233-L303 HydrophobicContact CG-CG 4.48Å; M233-L303 HydrophobicContact SD-CD1 4.2Å; M233-L303 HydrophobicContact SD-CD2 3.94Å; K244-L303 PolarHBondContact O-N 2.86Å; T245-L303 HydrophobicContact CG2-CB 3.7Å; T245-L303 HydrophobicContact CG2-CD1 4.09Å; F279-L303 HydrophobicContact CD2-CD2 3.61Å; F279-L303 HydrophobicContact CE2-CD2 3.89Å; F279-L303 HydrophobicContact CG-CD2 4.33Å; L295-L303 HydrophobicContact CB-CB 4.45Å; R296-L303 CarbonylContact O-C 3.57Å; R296-L303 VanDerWaalsContact O-CA 3.3Å; R296-L303 WeakPolarHBondContact O-CA 3.38Å; M297-L303 HydrophobicContact CG-CD2 4.19Å
304	V	90.6	Very high	89.9	Confident	18 Å²	18	64.5 Å²	64.5	11%	0.109	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.2	-178.2	-60.6	0	0	0	0	110.8	L246 L295 R296 D298 R302	L246-V304 HydrophobicContact CD1-CG1 4.31Å; L246-V304 HydrophobicContact CD2-CG1 4.2Å; L246-V304 HydrophobicContact CG-CG1 4.42Å; L295-V304 WeakPolarHBondContact CA-O 3.21Å; R296-V304 HydrophobicContact CG-CG2 3.64Å; R296-V304 PolarHBondContact N-O 2.86Å; R296-V304 PolarHBondContact O-N 2.73Å; D298-V304 HydrophobicContact CB-CG1 4.22Å; D298-V304 HydrophobicContact CB-CG2 4.28Å; R302-V304 HydrophobicContact CB-CG1 4.32Å
305	P	91.8	Very high	89.8	Confident	45 Å²	45	67.6 Å²	67.6	29%	0.292	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141.9	-177.9	28.9	-34.3	0	0	0	111.1	D254 V293 L295	D254-P305 HydrophobicContact CB-CG 4.43Å; D254-P305 WeakPolarHBondContact OD1-CD 3.43Å; D254-P305 WeakPolarHBondContact OD1-CG 3.47Å; V293-P305 HydrophobicContact CG1-CB 3.97Å; L295-P305 HydrophobicContact CD2-CB 4.28Å
306	Q	90.9	Very high	89.9	Confident	77 Å²	77	67.6 Å²	67.6	36%	0.36	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-39.8	171.7	-63.3	-167.1	-97.7	0	0	112	M272 L294 R296	M272-Q306 HydrophobicContact CE-CB 3.98Å; M272-Q306 HydrophobicContact CG-CB 4.49Å; M272-Q306 HydrophobicContact SD-CB 4.25Å; L294-Q306 PolarHBondContact O-N 3.04Å; R296-Q306 HydrophobicContact CB-CG 4.2Å; R296-Q306 HydrophobicContact CG-CG 3.72Å
307	H	92.2	Very high	90.1	Very high	48 Å²	48	63.7 Å²	63.7	22%	0.222	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	154	-177.9	-173.9	78.6	0	0	0	109.9	M272 L294 F309 W363	M272-H307 HydrophobicContact SD-CB 4.35Å; L294-H307 HydrophobicContact CB-CB 4.24Å; L294-H307 HydrophobicContact CD1-CB 4.16Å; L294-H307 HydrophobicContact CG-CB 4.42Å; L294-H307 PolarHBondContact N-O 3.29Å; H307-F309 AromaticContact CD2-CD1 3.74Å; H307-F309 AromaticContact CD2-CE1 3.52Å; H307-F309 AromaticContact CD2-CZ 3.72Å; H307-F309 AromaticContact NE2-CD1 3.37Å; H307-F309 WeakPolarHBondContact NE2-CD1 3.48Å; H307-F309 AromaticContact NE2-CE1 3.31Å; H307-F309 VanDerWaalsContact NE2-CE1 3.31Å; H307-F309 WeakPolarHBondContact NE2-CE1 3.43Å; H307-W363 PolarHBondContact CE1-O 3.13Å; H307-W363 PolarHBondContact ND1-O 2.68Å
308	I	93.4	Very high	90.6	Very high	44 Å²	44	61.1 Å²	61.1	23%	0.226	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	116.4	179	-55.1	176.5	0	0	0	108.8	D254 A291 V292 V293 W310	D254-I308 VanDerWaalsContact O-CD1 3.31Å; D254-I308 WeakPolarHBondContact O-CD1 3.49Å; A291-I308 HydrophobicContact CB-CG2 3.97Å; V292-I308 WeakPolarHBondContact O-CA 3.42Å; V293-I308 HydrophobicContact CG1-CG1 4.24Å; V293-I308 HydrophobicContact CG2-CG1 4.37Å; V293-I308 HydrophobicContact CG2-CG2 4.43Å; I308-W310 HydrophobicContact CD1-CZ2 4.43Å; I308-W310 HydrophobicContact CG2-CD2 4.15Å; I308-W310 HydrophobicContact CG2-CG 4.49Å; I308-W310 HydrophobicContact CG2-CZ2 3.86Å
309	F	94.7	Very high	91.2	Very high	9 Å²	9	60.4 Å²	60.4	4%	0.039	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.7	166.7	-55.5	-66.9	0	0	0	109.1	A291 V292 L294 H307 F318 V335 Y356 W363	A291-F309 CarbonylContact C-O 3.52Å; A291-F309 WeakPolarHBondContact CA-O 3.49Å; A291-F309 WeakPolarHBondContact CB-O 3.45Å; V292-F309 HydrophobicContact CB-CB 4.4Å; V292-F309 HydrophobicContact CB-CD2 4.27Å; V292-F309 HydrophobicContact CG1-CD2 4.28Å; V292-F309 PolarHBondContact N-O 2.87Å; V292-F309 PolarHBondContact O-N 2.87Å; L294-F309 HydrophobicContact CD1-CE2 3.8Å; L294-F309 HydrophobicContact CD1-CZ 4.07Å; L294-F309 HydrophobicContact CD2-CE2 4.16Å; L294-F309 HydrophobicContact CG-CE2 3.96Å; H307-F309 AromaticContact CD2-CD1 3.74Å; H307-F309 AromaticContact CD2-CE1 3.52Å; H307-F309 AromaticContact CD2-CZ 3.72Å; H307-F309 AromaticContact NE2-CD1 3.37Å; H307-F309 WeakPolarHBondContact NE2-CD1 3.48Å; H307-F309 AromaticContact NE2-CE1 3.31Å; H307-F309 VanDerWaalsContact NE2-CE1 3.31Å; H307-F309 WeakPolarHBondContact NE2-CE1 3.43Å; F309-F318 HydrophobicContact CB-CE1 3.89Å; F309-F318 HydrophobicContact CB-CZ 3.96Å; F309-V335 HydrophobicContact CD2-CG1 4.49Å; F309-V335 HydrophobicContact CE2-CB 4.23Å; F309-V335 HydrophobicContact CE2-CG1 4.05Å; F309-V335 HydrophobicContact CE2-CG2 4.29Å; F309-Y356 AromaticContact CD1-CD1 3.93Å; F309-Y356 HydrophobicContact CD1-CD1 3.93Å; F309-Y356 AromaticContact CD1-CE1 3.73Å; F309-Y356 HydrophobicContact CD1-CE1 3.73Å; F309-Y356 HydrophobicContact CD1-CG 4.4Å; F309-Y356 AromaticContact CE1-CD1 3.81Å; F309-Y356 HydrophobicContact CE1-CD1 3.81Å; F309-Y356 HydrophobicContact CE1-CE1 4.1Å; F309-Y356 HydrophobicContact CE1-CG 4.19Å; F309-Y356 HydrophobicContact CG-CE1 4.43Å; F309-Y356 HydrophobicContact CZ-CG 4.47Å; F309-W363 HydrophobicContact CE1-CD2 4.24Å; F309-W363 AromaticContact CE1-CE3 3.79Å; F309-W363 HydrophobicContact CE1-CE3 3.79Å; F309-W363 HydrophobicContact CE1-CZ3 4.32Å; F309-W363 AromaticContact CZ-CD2 3.79Å; F309-W363 HydrophobicContact CZ-CD2 3.79Å; F309-W363 AromaticContact CZ-CE3 3.59Å; F309-W363 HydrophobicContact CZ-CE3 3.59Å; F309-W363 HydrophobicContact CZ-CG 4.35Å; F309-W363 HydrophobicContact CZ-CH2 4.34Å; F309-W363 AromaticContact CZ-CZ3 3.92Å; F309-W363 HydrophobicContact CZ-CZ3 3.92Å
310	W	94.3	Very high	92.2	Very high	116 Å²	116	55 Å²	55	44%	0.439	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.1	177.4	-66.9	96.7	0	0	0	110.7	A286 N287 A291 I308	A286-W310 HydrophobicContact CB-CZ3 3.92Å; N287-W310 HydrophobicContact CB-CE3 3.98Å; N287-W310 HydrophobicContact CB-CH2 4.37Å; N287-W310 HydrophobicContact CB-CZ3 3.51Å; A291-W310 HydrophobicContact CB-CD2 4.36Å; A291-W310 HydrophobicContact CB-CE3 3.8Å; A291-W310 HydrophobicContact CB-CH2 4.49Å; A291-W310 HydrophobicContact CB-CZ3 3.87Å; I308-W310 HydrophobicContact CD1-CZ2 4.43Å; I308-W310 HydrophobicContact CG2-CD2 4.15Å; I308-W310 HydrophobicContact CG2-CG 4.49Å; I308-W310 HydrophobicContact CG2-CZ2 3.86Å
311	G	93.9	Very high	93	Very high	8 Å²	8	51.1 Å²	51.1	8%	0.082	25%	0.254	C	S	.	.			trans	-67.9	140.6	173.5	0	0	0	0	0	112	T289 G290 F318	T289-G311 WeakPolarHBondContact CB-O 3.32Å; T289-G311 PolarHBondContact OG1-O 2.83Å; G290-G311 PolarHBondContact O-N 3.16Å; G311-F318 VanDerWaalsContact CA-CG 3.47Å
312	E	89.9	Confident	93.9	Very high	114 Å²	114	46.3 Å²	46.3	53%	0.533	23%	0.233	S	C	.	.	S	Bend	trans	-71.2	-38.8	-179.1	-58.6	-176.2	149.9	0	0	112.7	Y354 R371	E312-Y354 HydrophobicContact CG-CE1 4.36Å; E312-R371 IonicContact OE2-NH1 3.63Å
313	E	91.4	Very high	94.4	Very high	102 Å²	102	41.8 Å²	41.8	48%	0.477	22%	0.217	S	C	.	.	S	Bend	trans	-112.4	144.7	-168.8	-80.3	-65.9	176.8	0	0	114.2	T289 S316 F342	T289-E313 WeakPolarHBondContact CA-O 3.4Å; T289-E313 WeakPolarHBondContact CB-O 3.41Å; E313-S316 WeakPolarHBondContact O-CB 3.15Å; E313-S316 PolarHBondContact O-N 2.78Å; E313-S316 PolarHBondContact O-OG 3.39Å; E313-F342 HydrophobicContact CB-CD2 4.03Å; E313-F342 HydrophobicContact CB-CE2 4.12Å; E313-F342 HydrophobicContact CG-CD2 4.02Å; E313-F342 HydrophobicContact CG-CE2 3.59Å
314	L	93.9	Very high	94.8	Very high	125 Å²	125	42.5 Å²	42.5	65%	0.654	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	134.1	179.3	-175.7	69.4	0	0	0	111.3	H288 S316	H288-L314 HydrophobicContact CB-CD1 3.55Å; L314-S316 PolarHBondContact O-N 2.98Å; L314-S316 VanDerWaalsContact O-N 3.14Å
315	A	94.1	Very high	95	Very high	66 Å²	66	42.5 Å²	42.5	55%	0.545	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	18.6	-179.7	0	0	0	0	0	115.1	H288 S317 N341	H288-A315 WeakPolarHBondContact O-CA 3.44Å; H288-A315 PolarHBondContact O-N 2.89Å; A315-S317 PolarHBondContact O-N 3.39Å; A315-N341 WeakPolarHBondContact O-CB 3.39Å
316	S	95.7	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.217	C	C	.	.			trans	-70.9	-10.9	179.2	62.5	0	0	0	0	114.6	T289 E313 L314 F318 A339 N341 F342	T289-S316 PolarHBondContact O-OG 2.86Å; T289-S316 VanDerWaalsContact O-OG 3.09Å; E313-S316 WeakPolarHBondContact O-CB 3.15Å; E313-S316 PolarHBondContact O-N 2.78Å; E313-S316 PolarHBondContact O-OG 3.39Å; L314-S316 PolarHBondContact O-N 2.98Å; L314-S316 VanDerWaalsContact O-N 3.14Å; S316-F318 VanDerWaalsContact C-N 3.31Å; S316-F318 PolarHBondContact O-N 3.04Å; S316-A339 CarbonylContact O-C 3.46Å; S316-A339 VanDerWaalsContact O-C 3.24Å; S316-A339 WeakPolarHBondContact O-CA 3.12Å; S316-A339 WeakPolarHBondContact O-CB 3.31Å; S316-N341 CarbonylContact O-C 3.56Å; S316-N341 PolarHBondContact O-N 2.83Å; S316-N341 VanDerWaalsContact O-N 3.13Å; S316-F342 PolarHBondContact O-N 2.92Å
317	S	97.1	Very high	95.5	Very high	24 Å²	24	38.6 Å²	38.6	17%	0.168	20%	0.2	C	C	.	.			trans	58.3	37.8	-175.4	-59.7	0	0	0	0	113.1	A315 G319 Y320 N341	A315-S317 PolarHBondContact O-N 3.39Å; S317-G319 PolarHBondContact O-N 3.05Å; S317-Y320 VanDerWaalsContact O-CB 3.29Å; S317-Y320 WeakPolarHBondContact O-CB 3.42Å; S317-Y320 PolarHBondContact O-N 3.04Å; S317-N341 VanDerWaalsContact CB-OD1 3.31Å; S317-N341 WeakPolarHBondContact CB-OD1 3.35Å; S317-N341 PolarHBondContact OG-OD1 2.04Å
318	F	98.4	Very high	95.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-59	122.9	178.1	179	-87.9	0	0	0	111.4	P284 T289 G290 A291 V292 F309 G311 S316 V337 A339 Y354 Y356	P284-F318 WeakPolarHBondContact CA-O 3.32Å; T289-F318 WeakPolarHBondContact O-CB 3.31Å; T289-F318 PolarHBondContact O-N 3.33Å; G290-F318 CarbonylContact C-O 3.53Å; G290-F318 VanDerWaalsContact CA-O 3.23Å; G290-F318 WeakPolarHBondContact CA-O 3.48Å; A291-F318 PolarHBondContact N-O 2.56Å; A291-F318 VanDerWaalsContact N-O 3.12Å; V292-F318 HydrophobicContact CB-CE1 4.29Å; V292-F318 HydrophobicContact CG2-CD1 4.37Å; V292-F318 HydrophobicContact CG2-CE1 3.95Å; F309-F318 HydrophobicContact CB-CE1 3.89Å; F309-F318 HydrophobicContact CB-CZ 3.96Å; G311-F318 VanDerWaalsContact CA-CG 3.47Å; S316-F318 VanDerWaalsContact C-N 3.31Å; S316-F318 PolarHBondContact O-N 3.04Å; F318-V337 HydrophobicContact CD1-CG1 4.05Å; F318-V337 HydrophobicContact CD2-CG1 3.86Å; F318-V337 HydrophobicContact CE1-CG1 3.85Å; F318-V337 HydrophobicContact CE2-CB 3.9Å; F318-V337 HydrophobicContact CE2-CG1 3.64Å; F318-V337 HydrophobicContact CE2-CG2 4.48Å; F318-V337 HydrophobicContact CG-CG1 4.06Å; F318-V337 HydrophobicContact CZ-CB 3.92Å; F318-V337 HydrophobicContact CZ-CG1 3.64Å; F318-V337 HydrophobicContact CZ-CG2 4.03Å; F318-A339 HydrophobicContact CB-CB 4.28Å; F318-A339 HydrophobicContact CD2-CB 4.44Å; F318-Y354 AromaticContact CD2-CD2 3.76Å; F318-Y354 HydrophobicContact CD2-CD2 3.76Å; F318-Y354 AromaticContact CD2-CE2 3.99Å; F318-Y354 HydrophobicContact CD2-CE2 3.99Å; F318-Y354 HydrophobicContact CD2-CG 4.31Å; F318-Y354 HydrophobicContact CE2-CD1 4.47Å; F318-Y354 AromaticContact CE2-CD2 3.74Å; F318-Y354 HydrophobicContact CE2-CD2 3.74Å; F318-Y354 HydrophobicContact CE2-CE2 4.33Å; F318-Y354 AromaticContact CE2-CG 3.83Å; F318-Y354 HydrophobicContact CE2-CG 3.83Å; F318-Y356 HydrophobicContact CE2-CE2 4.17Å; F318-Y356 AromaticContact CZ-CE2 3.87Å; F318-Y356 HydrophobicContact CZ-CE2 3.87Å; F318-Y356 WeakPolarHBondContact CZ-OH 3.47Å
319	G	98	Very high	95.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	95	12.1	-171.1	0	0	0	0	0	114	S264 G282 S317 S321 V337 G338	S264-G319 PolarHBondContact OG-O 3.1Å; G282-G319 WeakPolarHBondContact CA-O 3.47Å; S317-G319 PolarHBondContact O-N 3.05Å; G319-S321 VanDerWaalsContact C-N 3.29Å; G319-S321 PolarHBondContact O-N 2.69Å; G319-V337 VanDerWaalsContact N-CG1 3.33Å; G319-G338 PolarHBondContact N-O 3.23Å
320	Y	98.4	Very high	95.7	Very high	52 Å²	52	44.1 Å²	44.1	20%	0.204	23%	0.227	C	C	.	.	S	Bend	trans	-60.7	-40.8	172	-175	-82.7	0	0	0	111.6	F263 S264 S317 G338 P340 M382	F263-Y320 HydrophobicContact CD1-CD2 4.33Å; F263-Y320 WeakPolarHBondContact CD1-O 3.3Å; F263-Y320 HydrophobicContact CE1-CD1 4.28Å; F263-Y320 AromaticContact CE1-CD2 3.49Å; F263-Y320 HydrophobicContact CE1-CD2 3.49Å; F263-Y320 VanDerWaalsContact CE1-CD2 3.49Å; F263-Y320 HydrophobicContact CE1-CE1 4.17Å; F263-Y320 AromaticContact CE1-CE2 3.38Å; F263-Y320 HydrophobicContact CE1-CE2 3.38Å; F263-Y320 AromaticContact CE1-CG 3.93Å; F263-Y320 HydrophobicContact CE1-CG 3.93Å; F263-Y320 AromaticContact CE1-CZ 3.72Å; F263-Y320 AromaticContact CZ-CD2 3.92Å; F263-Y320 HydrophobicContact CZ-CD2 3.92Å; F263-Y320 AromaticContact CZ-CE2 3.46Å; F263-Y320 HydrophobicContact CZ-CE2 3.46Å; F263-Y320 VanDerWaalsContact CZ-CE2 3.46Å; F263-Y320 AromaticContact CZ-CZ 3.95Å; S264-Y320 WeakPolarHBondContact CB-O 3.08Å; S317-Y320 VanDerWaalsContact O-CB 3.29Å; S317-Y320 WeakPolarHBondContact O-CB 3.42Å; S317-Y320 PolarHBondContact O-N 3.04Å; Y320-G338 PolarHBondContact N-O 2.92Å; Y320-P340 VanDerWaalsContact CB-CD 3.48Å; Y320-P340 HydrophobicContact CD1-CG 3.82Å; Y320-P340 HydrophobicContact CD2-CG 4.06Å; Y320-P340 HydrophobicContact CG-CG 3.57Å; Y320-M382 VanDerWaalsContact CD1-O 3.31Å; Y320-M382 WeakPolarHBondContact CD1-O 3.45Å; Y320-M382 HydrophobicContact CD1-SD 4.18Å; Y320-M382 HydrophobicContact CE1-CE 3.99Å; Y320-M382 HydrophobicContact CE1-CG 4.21Å; Y320-M382 VanDerWaalsContact CE1-O 3.25Å; Y320-M382 WeakPolarHBondContact CE1-O 3.31Å; Y320-M382 HydrophobicContact CE1-SD 3.54Å; Y320-M382 VanDerWaalsContact CE1-SD 3.54Å; Y320-M382 HydrophobicContact CE2-CE 4.45Å; Y320-M382 HydrophobicContact CE2-SD 4.38Å; Y320-M382 WeakPolarHBondContact OH-CE 3.37Å
321	S	98.3	Very high	95.6	Very high	11 Å²	11	40.7 Å²	40.7	8%	0.077	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.4	172.2	65.1	0	0	0	0	109.6	G319 G338 G381 V384	G319-S321 VanDerWaalsContact C-N 3.29Å; G319-S321 PolarHBondContact O-N 2.69Å; S321-G338 PolarHBondContact O-N 2.8Å; S321-G338 WeakPolarHBondContact OG-CA 3.42Å; S321-G381 PolarHBondContact OG-O 2.75Å; S321-V384 WeakPolarHBondContact OG-CG2 3.23Å
322	V	98.4	Very high	95.7	Very high	15 Å²	15	42.1 Å²	42.1	9%	0.091	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.7	176.3	-66.1	0	0	0	0	109.7	D266 V280 V292 I336	D266-V322 HydrophobicContact CB-CG2 4.05Å; V280-V322 HydrophobicContact CG1-CB 4.16Å; V280-V322 HydrophobicContact CG1-CG1 4.19Å; V280-V322 HydrophobicContact CG1-CG2 4.24Å; V292-V322 HydrophobicContact CG1-CG1 4.15Å; V292-V322 HydrophobicContact CG2-CG1 3.75Å; V322-I336 WeakPolarHBondContact CA-O 3.17Å
323	A	97.9	Very high	96	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.033	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	154.5	170.1	0	0	0	0	0	110	I336 V384	A323-I336 PolarHBondContact N-O 3.13Å; A323-I336 WeakPolarHBondContact O-CD1 3.45Å; A323-I336 PolarHBondContact O-N 2.97Å; A323-V384 HydrophobicContact CB-CB 4.48Å; A323-V384 HydrophobicContact CB-CG1 3.81Å
324	T	96.9	Very high	96.2	Very high	14 Å²	14	32.9 Å²	32.9	9%	0.086	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.5	179.4	57.8	0	0	0	0	110.3	D266 I271 V280 D334	D266-T324 HydrophobicContact CB-CG2 4.42Å; D266-T324 WeakPolarHBondContact OD2-CB 3.28Å; D266-T324 PolarHBondContact OD2-N 3.34Å; D266-T324 PolarHBondContact OD2-OG1 3.39Å; I271-T324 HydrophobicContact CD1-CG2 3.74Å; V280-T324 HydrophobicContact CG2-CG2 3.78Å; T324-D334 WeakPolarHBondContact CA-O 3.37Å
325	T	96.3	Very high	96.4	Very high	19 Å²	19	26.9 Å²	26.9	12%	0.117	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	156.3	175.6	-168.5	0	0	0	0	109.9	L327 D334 I336 I398	T325-L327 HydrophobicContact CG2-CD2 3.44Å; T325-L327 VanDerWaalsContact CG2-CD2 3.44Å; T325-L327 HydrophobicContact CG2-CG 3.93Å; T325-D334 PolarHBondContact N-O 3.11Å; T325-D334 WeakPolarHBondContact O-CA 3.37Å; T325-D334 VanDerWaalsContact O-CB 3.27Å; T325-D334 WeakPolarHBondContact O-CB 3.4Å; T325-D334 PolarHBondContact O-N 3.3Å; T325-I336 HydrophobicContact CG2-CD1 3.93Å; T325-I398 HydrophobicContact CG2-CG2 3.81Å
326	D	96.2	Very high	96.6	Very high	39 Å²	39	23.8 Å²	23.8	21%	0.209	13%	0.131	C	C	.	.			trans	-84.3	112.6	170.3	-179.8	-10.4	0	0	0	108.1	N328 K329 G331 W332 G396	D326-N328 PolarHBondContact OD1-N 2.9Å; D326-N328 PolarHBondContact OD1-OD1 2.85Å; D326-K329 WeakPolarHBondContact OD1-CA 3.39Å; D326-K329 PolarHBondContact OD1-N 3.12Å; D326-K329 WeakPolarHBondContact OD2-CA 3.23Å; D326-G331 WeakPolarHBondContact OD2-CA 3.39Å; D326-G331 PolarHBondContact OD2-N 3.5Å; D326-W332 VanDerWaalsContact CB-O 3.29Å; D326-W332 WeakPolarHBondContact CB-O 3.32Å; D326-G396 WeakPolarHBondContact O-CA 3.36Å; D326-G396 PolarHBondContact O-N 3.42Å
327	L	97.1	Very high	96.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-94.5	-25.1	-177.2	-58.7	167.8	0	0	0	112.4	T325 D334 I336 V355 L357 Y395 G396 I398 G415 S416 G419 I420	T325-L327 HydrophobicContact CG2-CD2 3.44Å; T325-L327 VanDerWaalsContact CG2-CD2 3.44Å; T325-L327 HydrophobicContact CG2-CG 3.93Å; L327-D334 WeakPolarHBondContact CB-OD2 3.24Å; L327-D334 HydrophobicContact CD1-CB 4.04Å; L327-D334 HydrophobicContact CG-CB 4.28Å; L327-D334 WeakPolarHBondContact CG-OD2 3.45Å; L327-D334 PolarHBondContact N-OD2 3.11Å; L327-I336 HydrophobicContact CD1-CD1 4.35Å; L327-I336 HydrophobicContact CD1-CG1 4.37Å; L327-V355 HydrophobicContact CD1-CG1 3.32Å; L327-L357 HydrophobicContact CB-CD2 4.37Å; L327-L357 HydrophobicContact CD1-CD2 4.13Å; L327-Y395 WeakPolarHBondContact O-CD1 3.38Å; L327-G396 VanDerWaalsContact CD2-O 3.23Å; L327-G396 WeakPolarHBondContact CD2-O 3.48Å; L327-I398 HydrophobicContact CD2-CG2 4.08Å; L327-G415 WeakPolarHBondContact O-CA 3.47Å; L327-S416 PolarHBondContact O-N 3.04Å; L327-G419 VanDerWaalsContact O-O 3.09Å; L327-I420 HydrophobicContact CD1-CB 4.36Å; L327-I420 HydrophobicContact CD1-CD1 4.49Å
328	N	95	Very high	96.8	Very high	34 Å²	34	22.6 Å²	22.6	18%	0.182	12%	0.123	C	C	.	.	S	Bend	trans	-110	-1.6	-173.7	74.3	-4.2	0	0	0	114.8	D326 D330 Y395 S416	D326-N328 PolarHBondContact OD1-N 2.9Å; D326-N328 PolarHBondContact OD1-OD1 2.85Å; N328-D330 VanDerWaalsContact C-N 3.25Å; N328-D330 PolarHBondContact ND2-OD2 3.25Å; N328-D330 PolarHBondContact O-N 2.98Å; N328-D330 WeakPolarHBondContact OD1-CB 3.39Å; N328-D330 PolarHBondContact OD1-N 3.49Å; N328-D330 PolarHBondContact OD1-OD1 2.76Å; N328-D330 PolarHBondContact OD1-OD2 2.98Å; N328-Y395 WeakPolarHBondContact O-CE1 3.41Å; N328-S416 VanDerWaalsContact CA-O 3.31Å; N328-S416 WeakPolarHBondContact CA-O 3.45Å
329	K	94.9	Very high	96.8	Very high	116 Å²	116	22.6 Å²	22.6	50%	0.504	12%	0.123	S	C	.	.	S	Bend	trans	61.7	28	179.4	-158.3	-173.4	-160.7	156.5	0	113.7	D326 G331 D393 G394 Y395	D326-K329 WeakPolarHBondContact OD1-CA 3.39Å; D326-K329 PolarHBondContact OD1-N 3.12Å; D326-K329 WeakPolarHBondContact OD2-CA 3.23Å; K329-G331 VanDerWaalsContact C-N 3.3Å; K329-D393 PolarHBondContact NZ-O 3.03Å; K329-G394 WeakPolarHBondContact CD-O 3.37Å; K329-G394 WeakPolarHBondContact CE-O 3.49Å; K329-G394 WeakPolarHBondContact CG-O 3.49Å; K329-G394 PolarHBondContact NZ-O 2.74Å; K329-Y395 HydrophobicContact CB-CD1 3.59Å; K329-Y395 HydrophobicContact CB-CE1 3.53Å; K329-Y395 HydrophobicContact CD-CD1 4.42Å; K329-Y395 HydrophobicContact CD-CE1 4.13Å
330	D	93.6	Very high	96.8	Very high	67 Å²	67	22.8 Å²	22.8	36%	0.358	13%	0.125	S	C	.	.	S	Bend	trans	-83.4	-7.3	175.2	79	21.2	0	0	0	113.4	N328 W332	N328-D330 VanDerWaalsContact C-N 3.25Å; N328-D330 PolarHBondContact ND2-OD2 3.25Å; N328-D330 PolarHBondContact O-N 2.98Å; N328-D330 WeakPolarHBondContact OD1-CB 3.39Å; N328-D330 PolarHBondContact OD1-N 3.49Å; N328-D330 PolarHBondContact OD1-OD1 2.76Å; N328-D330 PolarHBondContact OD1-OD2 2.98Å; D330-W332 WeakPolarHBondContact OD1-CA 3.41Å; D330-W332 VanDerWaalsContact OD1-CB 3.24Å; D330-W332 WeakPolarHBondContact OD1-CB 3.37Å; D330-W332 VanDerWaalsContact OD1-CD1 3.31Å; D330-W332 PolarHBondContact OD1-N 2.92Å
331	G	92.9	Very high	96.7	Very high	44 Å²	44	23.7 Å²	23.7	45%	0.454	13%	0.133	S	C	.	.	S	Bend	trans	88.9	-1.5	179.1	0	0	0	0	0	114.4	L274 D326 K329	L274-G331 VanDerWaalsContact CD2-O 3.3Å; L274-G331 WeakPolarHBondContact CD2-O 3.14Å; D326-G331 WeakPolarHBondContact OD2-CA 3.39Å; D326-G331 PolarHBondContact OD2-N 3.5Å; K329-G331 VanDerWaalsContact C-N 3.3Å
332	W	94.8	Very high	96.6	Very high	39 Å²	39	23.6 Å²	23.6	15%	0.148	13%	0.131	C	C	.	.	S	Bend	trans	-92.8	157.5	164.1	-62.2	80.4	0	0	0	110	G270 L274 D326 D330 N358 L360 G361	G270-W332 WeakPolarHBondContact O-CA 3.46Å; G270-W332 VanDerWaalsContact O-CE3 3.24Å; L274-W332 HydrophobicContact CD1-CH2 4.45Å; L274-W332 HydrophobicContact CD1-CZ2 3.84Å; L274-W332 HydrophobicContact CD2-CD2 3.68Å; L274-W332 HydrophobicContact CD2-CE3 4.13Å; L274-W332 HydrophobicContact CD2-CG 4.06Å; L274-W332 HydrophobicContact CD2-CH2 4.36Å; L274-W332 HydrophobicContact CD2-CZ2 3.96Å; L274-W332 HydrophobicContact CD2-CZ3 4.43Å; L274-W332 HydrophobicContact CG-CD2 4.23Å; L274-W332 HydrophobicContact CG-CE3 4.43Å; L274-W332 HydrophobicContact CG-CH2 3.85Å; L274-W332 HydrophobicContact CG-CZ2 3.61Å; L274-W332 HydrophobicContact CG-CZ3 4.25Å; D326-W332 VanDerWaalsContact CB-O 3.29Å; D326-W332 WeakPolarHBondContact CB-O 3.32Å; D330-W332 WeakPolarHBondContact OD1-CA 3.41Å; D330-W332 VanDerWaalsContact OD1-CB 3.24Å; D330-W332 WeakPolarHBondContact OD1-CB 3.37Å; D330-W332 VanDerWaalsContact OD1-CD1 3.31Å; D330-W332 PolarHBondContact OD1-N 2.92Å; W332-N358 HydrophobicContact CB-CB 3.78Å; W332-L360 HydrophobicContact CG-CD2 4.36Å; W332-L360 WeakPolarHBondContact CH2-O 3.31Å; W332-L360 HydrophobicContact CZ2-CB 4.16Å; W332-L360 WeakPolarHBondContact CZ2-O 3.47Å; W332-L360 VanDerWaalsContact CZ3-C 3.47Å; W332-G361 VanDerWaalsContact CZ3-CA 3.49Å
333	T	96	Very high	96.4	Very high	21 Å²	21	27.5 Å²	27.5	13%	0.129	15%	0.147	C	C	.	.			trans	-106.5	125.4	-178	-61	0	0	0	0	109.7	A268 K269 G270 I271 N358	A268-T333 HydrophobicContact CB-CG2 3.69Å; K269-T333 WeakPolarHBondContact O-CB 3.34Å; K269-T333 PolarHBondContact O-OG1 2.77Å; K269-T333 VanDerWaalsContact O-OG1 3.05Å; G270-T333 PolarHBondContact O-N 3.18Å; I271-T333 HydrophobicContact CG1-CG2 4.22Å; T333-N358 PolarHBondContact O-ND2 3.35Å
334	D	96.8	Very high	96.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	158.2	179.4	-54.1	-46.5	0	0	0	111	T324 T325 L327 Y356 L357 N358	T324-D334 WeakPolarHBondContact CA-O 3.37Å; T325-D334 PolarHBondContact N-O 3.11Å; T325-D334 WeakPolarHBondContact O-CA 3.37Å; T325-D334 VanDerWaalsContact O-CB 3.27Å; T325-D334 WeakPolarHBondContact O-CB 3.4Å; T325-D334 PolarHBondContact O-N 3.3Å; L327-D334 WeakPolarHBondContact CB-OD2 3.24Å; L327-D334 HydrophobicContact CD1-CB 4.04Å; L327-D334 HydrophobicContact CG-CB 4.28Å; L327-D334 WeakPolarHBondContact CG-OD2 3.45Å; L327-D334 PolarHBondContact N-OD2 3.11Å; D334-Y356 WeakPolarHBondContact CB-O 3.46Å; D334-L357 VanDerWaalsContact OD1-CA 3.25Å; D334-L357 WeakPolarHBondContact OD1-CA 3.29Å; D334-N358 WeakPolarHBondContact OD1-CB 3.46Å; D334-N358 PolarHBondContact OD1-N 3.15Å
335	V	97.6	Very high	95.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.6	-179.2	-177	0	0	0	0	109.4	I271 V280 F309 V337 Y356 W363	I271-V335 HydrophobicContact CD1-CG2 4.44Å; I271-V335 HydrophobicContact CG2-CG2 3.86Å; V280-V335 HydrophobicContact CG1-CG1 4.42Å; F309-V335 HydrophobicContact CD2-CG1 4.49Å; F309-V335 HydrophobicContact CE2-CB 4.23Å; F309-V335 HydrophobicContact CE2-CG1 4.05Å; F309-V335 HydrophobicContact CE2-CG2 4.29Å; V335-V337 HydrophobicContact CG1-CG2 4.04Å; V335-Y356 PolarHBondContact N-O 3.05Å; V335-Y356 VanDerWaalsContact N-O 3.08Å; V335-Y356 WeakPolarHBondContact O-CB 3.41Å; V335-Y356 PolarHBondContact O-N 3.37Å; V335-W363 HydrophobicContact CG2-CH2 4.12Å; V335-W363 HydrophobicContact CG2-CZ2 4.09Å
336	I	98.4	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.4	-179.9	-51.7	87.9	0	0	0	109.2	V322 A323 T325 L327 V353 Y354 V355 V384 I398	V322-I336 WeakPolarHBondContact CA-O 3.17Å; A323-I336 PolarHBondContact N-O 3.13Å; A323-I336 WeakPolarHBondContact O-CD1 3.45Å; A323-I336 PolarHBondContact O-N 2.97Å; T325-I336 HydrophobicContact CG2-CD1 3.93Å; L327-I336 HydrophobicContact CD1-CD1 4.35Å; L327-I336 HydrophobicContact CD1-CG1 4.37Å; I336-V353 HydrophobicContact CG2-CG1 3.33Å; I336-Y354 WeakPolarHBondContact CA-O 3.25Å; I336-V355 HydrophobicContact CG1-CG1 4.29Å; I336-V355 HydrophobicContact CG1-CG2 4.4Å; I336-V355 HydrophobicContact CG2-CG2 4.13Å; I336-V384 HydrophobicContact CB-CG1 4.13Å; I336-V384 HydrophobicContact CG2-CG1 3.59Å; I336-I398 HydrophobicContact CD1-CG2 4.35Å; I336-I398 HydrophobicContact CG1-CD1 4.42Å; I336-I398 HydrophobicContact CG1-CG2 4.44Å; I336-I398 HydrophobicContact CG2-CD1 4.03Å
337	V	98.6	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125	-172.2	-173.3	0	0	0	0	111.5	V292 F318 G319 V335 V353 Y354 Y356	V292-V337 HydrophobicContact CB-CG2 4.39Å; V292-V337 HydrophobicContact CG2-CB 4.35Å; V292-V337 HydrophobicContact CG2-CG1 3.53Å; V292-V337 HydrophobicContact CG2-CG2 3.83Å; F318-V337 HydrophobicContact CD1-CG1 4.05Å; F318-V337 HydrophobicContact CD2-CG1 3.86Å; F318-V337 HydrophobicContact CE1-CG1 3.85Å; F318-V337 HydrophobicContact CE2-CB 3.9Å; F318-V337 HydrophobicContact CE2-CG1 3.64Å; F318-V337 HydrophobicContact CE2-CG2 4.48Å; F318-V337 HydrophobicContact CG-CG1 4.06Å; F318-V337 HydrophobicContact CZ-CB 3.92Å; F318-V337 HydrophobicContact CZ-CG1 3.64Å; F318-V337 HydrophobicContact CZ-CG2 4.03Å; G319-V337 VanDerWaalsContact N-CG1 3.33Å; V335-V337 HydrophobicContact CG1-CG2 4.04Å; V337-V353 CarbonylContact O-C 3.6Å; V337-V353 WeakPolarHBondContact O-CA 3.36Å; V337-Y354 PolarHBondContact N-O 3.35Å; V337-Y354 PolarHBondContact O-N 2.84Å; V337-Y356 HydrophobicContact CG2-CD2 4.34Å; V337-Y356 HydrophobicContact CG2-CE2 4.24Å
338	G	98.4	Very high	95	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	140.3	172.6	0	0	0	0	0	113.6	G319 Y320 S321	G319-G338 PolarHBondContact N-O 3.23Å; Y320-G338 PolarHBondContact N-O 2.92Å; S321-G338 PolarHBondContact O-N 2.8Å; S321-G338 WeakPolarHBondContact OG-CA 3.42Å
339	A	98.2	Very high	94.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	71.4	173.7	0	0	0	0	0	109.6	S316 F318 N341 F342 A352 Y354	S316-A339 CarbonylContact O-C 3.46Å; S316-A339 VanDerWaalsContact O-C 3.24Å; S316-A339 WeakPolarHBondContact O-CA 3.12Å; S316-A339 WeakPolarHBondContact O-CB 3.31Å; F318-A339 HydrophobicContact CB-CB 4.28Å; F318-A339 HydrophobicContact CD2-CB 4.44Å; A339-N341 PolarHBondContact O-N 2.87Å; A339-N341 VanDerWaalsContact O-N 3.13Å; A339-F342 HydrophobicContact CB-CB 4.26Å; A339-F342 VanDerWaalsContact O-CB 3.24Å; A339-F342 WeakPolarHBondContact O-CB 3.39Å; A339-F342 PolarHBondContact O-N 2.84Å; A339-A352 PolarHBondContact N-O 2.93Å; A339-A352 PolarHBondContact O-N 2.89Å; A339-A352 VanDerWaalsContact O-N 3.1Å; A339-Y354 HydrophobicContact CB-CD2 4.29Å; A339-Y354 HydrophobicContact CB-CE2 3.79Å
340	P	97.8	Very high	94.9	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-14.9	-171.5	25.8	-34.9	0	0	0	114.8	Y320 M379 M382	Y320-P340 VanDerWaalsContact CB-CD 3.48Å; Y320-P340 HydrophobicContact CD1-CG 3.82Å; Y320-P340 HydrophobicContact CD2-CG 4.06Å; Y320-P340 HydrophobicContact CG-CG 3.57Å; P340-M379 HydrophobicContact CB-CB 4.16Å; P340-M379 WeakPolarHBondContact CB-O 3.49Å; P340-M379 WeakPolarHBondContact O-CA 3.5Å; P340-M382 HydrophobicContact CB-CB 4.22Å; P340-M382 HydrophobicContact CB-SD 3.96Å; P340-M382 HydrophobicContact CG-SD 4.02Å
341	N	96.7	Very high	95.1	Very high	71 Å²	71	45 Å²	45	38%	0.38	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	4.6	176	-63.7	109.1	0	0	0	112.9	A315 S316 S317 A339 M379	A315-N341 WeakPolarHBondContact O-CB 3.39Å; S316-N341 CarbonylContact O-C 3.56Å; S316-N341 PolarHBondContact O-N 2.83Å; S316-N341 VanDerWaalsContact O-N 3.13Å; S317-N341 VanDerWaalsContact CB-OD1 3.31Å; S317-N341 WeakPolarHBondContact CB-OD1 3.35Å; S317-N341 PolarHBondContact OG-OD1 2.04Å; A339-N341 PolarHBondContact O-N 2.87Å; A339-N341 VanDerWaalsContact O-N 3.13Å; N341-M379 WeakPolarHBondContact ND2-CE 3.19Å
342	F	96.4	Very high	95.3	Very high	8 Å²	8	43 Å²	43	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	139	169	179.9	-87	0	0	0	110.1	E313 S316 A339 D344 I349 G351 A352 Y354	E313-F342 HydrophobicContact CB-CD2 4.03Å; E313-F342 HydrophobicContact CB-CE2 4.12Å; E313-F342 HydrophobicContact CG-CD2 4.02Å; E313-F342 HydrophobicContact CG-CE2 3.59Å; S316-F342 PolarHBondContact O-N 2.92Å; A339-F342 HydrophobicContact CB-CB 4.26Å; A339-F342 VanDerWaalsContact O-CB 3.24Å; A339-F342 WeakPolarHBondContact O-CB 3.39Å; A339-F342 PolarHBondContact O-N 2.84Å; F342-D344 HydrophobicContact CE1-CB 4.43Å; F342-I349 HydrophobicContact CD1-CG2 3.82Å; F342-I349 HydrophobicContact CE1-CB 4.36Å; F342-I349 HydrophobicContact CE1-CG2 3.77Å; F342-G351 PolarHBondContact O-N 2.86Å; F342-A352 HydrophobicContact CB-CB 3.84Å; F342-A352 HydrophobicContact CD1-CB 3.78Å; F342-A352 HydrophobicContact CD2-CB 4.36Å; F342-A352 HydrophobicContact CE1-CB 4.48Å; F342-A352 HydrophobicContact CG-CB 3.72Å; F342-Y354 VanDerWaalsContact CD2-OH 3.32Å; F342-Y354 WeakPolarHBondContact CD2-OH 3.33Å; F342-Y354 WeakPolarHBondContact CE2-OH 3.18Å
343	F	93.9	Very high	95.5	Very high	97 Å²	97	41.1 Å²	41.1	43%	0.425	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	122.5	-175.4	179.1	-109.3	0	0	0	111.9	R345 I349 Y376	F343-R345 HydrophobicContact CE1-CB 3.67Å; F343-R345 HydrophobicContact CE1-CG 4.2Å; F343-R345 HydrophobicContact CZ-CB 3.82Å; F343-R345 HydrophobicContact CZ-CG 4Å; F343-I349 WeakPolarHBondContact CA-O 3.39Å; F343-Y376 HydrophobicContact CE2-CD2 4.18Å; F343-Y376 AromaticContact CE2-CE2 3.56Å; F343-Y376 HydrophobicContact CE2-CE2 3.56Å; F343-Y376 AromaticContact CZ-CE2 3.98Å; F343-Y376 HydrophobicContact CZ-CE2 3.98Å
344	D	92.7	Very high	95.5	Very high	58 Å²	58	40.1 Å²	40.1	31%	0.31	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	106.3	167.3	-174.5	-17.7	0	0	0	109.9	F342 K346 A347 E348 I349	F342-D344 HydrophobicContact CE1-CB 4.43Å; D344-K346 VanDerWaalsContact C-N 3.27Å; D344-K346 PolarHBondContact O-N 3.31Å; D344-K346 WeakPolarHBondContact OD1-CA 3.42Å; D344-K346 WeakPolarHBondContact OD1-CB 3.44Å; D344-K346 PolarHBondContact OD1-N 3Å; D344-A347 HydrophobicContact CB-CB 4.17Å; D344-A347 PolarHBondContact O-N 3.15Å; D344-A347 PolarHBondContact OD1-N 3.31Å; D344-E348 WeakPolarHBondContact O-CA 3.49Å; D344-E348 PolarHBondContact O-N 2.87Å; D344-I349 HydrophobicContact CB-CB 4.25Å; D344-I349 HydrophobicContact CB-CD1 4.4Å; D344-I349 PolarHBondContact N-O 3.2Å; D344-I349 PolarHBondContact O-N 2.89Å
345	R	89.9	Confident	95.6	Very high	196 Å²	196	40.1 Å²	40.1	74%	0.74	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.2	179.1	-161.7	-176.5	66.5	179.9	-1.7	113.9	F343	F343-R345 HydrophobicContact CE1-CB 3.67Å; F343-R345 HydrophobicContact CE1-CG 4.2Å; F343-R345 HydrophobicContact CZ-CB 3.82Å; F343-R345 HydrophobicContact CZ-CG 4Å
346	K	91.3	Very high	95.5	Very high	194 Å²	194	40.9 Å²	40.9	84%	0.843	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-34.5	-179.7	-68.9	-178.5	-179.5	174.3	0	112	D344	D344-K346 VanDerWaalsContact C-N 3.27Å; D344-K346 PolarHBondContact O-N 3.31Å; D344-K346 WeakPolarHBondContact OD1-CA 3.42Å; D344-K346 WeakPolarHBondContact OD1-CB 3.44Å; D344-K346 PolarHBondContact OD1-N 3Å
347	A	89.6	Confident	95.4	Very high	56 Å²	56	43.1 Å²	43.1	46%	0.463	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-0.8	178.2	0	0	0	0	0	113.3	D344 I349	D344-A347 HydrophobicContact CB-CB 4.17Å; D344-A347 PolarHBondContact O-N 3.15Å; D344-A347 PolarHBondContact OD1-N 3.31Å; A347-I349 VanDerWaalsContact C-N 3.27Å; A347-I349 HydrophobicContact CB-CD1 3.6Å; A347-I349 HydrophobicContact CB-CG1 3.79Å; A347-I349 PolarHBondContact O-N 2.93Å
348	E	92.1	Very high	95.2	Very high	139 Å²	139	43.5 Å²	43.5	65%	0.65	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	38.4	-175.9	-59.4	-173.1	154.2	0	0	113.2	D344 Y376	D344-E348 WeakPolarHBondContact O-CA 3.49Å; D344-E348 PolarHBondContact O-N 2.87Å; E348-Y376 HydrophobicContact CB-CD2 4.29Å; E348-Y376 WeakPolarHBondContact O-CA 3.43Å; E348-Y376 WeakPolarHBondContact O-CB 3.36Å; E348-Y376 PolarHBondContact O-N 3.32Å
349	I	93.2	Very high	94.8	Very high	15 Å²	15	45.5 Å²	45.5	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.8	-179.3	-59.8	168.5	0	0	0	110.2	F342 F343 D344 A347 G351 N373	F342-I349 HydrophobicContact CD1-CG2 3.82Å; F342-I349 HydrophobicContact CE1-CB 4.36Å; F342-I349 HydrophobicContact CE1-CG2 3.77Å; F343-I349 WeakPolarHBondContact CA-O 3.39Å; D344-I349 HydrophobicContact CB-CB 4.25Å; D344-I349 HydrophobicContact CB-CD1 4.4Å; D344-I349 PolarHBondContact N-O 3.2Å; D344-I349 PolarHBondContact O-N 2.89Å; A347-I349 VanDerWaalsContact C-N 3.27Å; A347-I349 HydrophobicContact CB-CD1 3.6Å; A347-I349 HydrophobicContact CB-CG1 3.79Å; A347-I349 PolarHBondContact O-N 2.93Å; I349-G351 WeakPolarHBondContact CG2-O 3.28Å; I349-N373 HydrophobicContact CD1-CB 3.98Å; I349-N373 HydrophobicContact CG1-CB 4.14Å; I349-N373 HydrophobicContact CG2-CB 3.9Å
350	G	93.9	Very high	94.5	Very high	4 Å²	4	50.2 Å²	50.2	4%	0.041	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113	169.1	0	0	0	0	0	111.1	T375 S378 F380	G350-T375 CarbonylContact C-O 3.55Å; G350-T375 VanDerWaalsContact CA-O 3.3Å; G350-T375 WeakPolarHBondContact CA-O 3.31Å; G350-T375 PolarHBondContact N-O 3.37Å; G350-T375 VanDerWaalsContact N-O 3.1Å; G350-T375 VanDerWaalsContact O-O 3.05Å; G350-S378 PolarHBondContact O-OG 2.85Å; G350-F380 PolarHBondContact O-N 2.9Å
351	G	97.2	Very high	94.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.4	151.7	-173.7	0	0	0	0	0	113.9	F342 I349 G374 F380	F342-G351 PolarHBondContact O-N 2.86Å; I349-G351 WeakPolarHBondContact CG2-O 3.28Å; G351-G374 PolarHBondContact O-N 3.03Å; G351-F380 CarbonylContact C-O 3.59Å; G351-F380 VanDerWaalsContact CA-O 3.23Å; G351-F380 WeakPolarHBondContact CA-O 3.25Å
352	A	97.4	Very high	93.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	155.7	177.7	0	0	0	0	0	111.5	A339 F342 Y354 R371 L372 F380	A339-A352 PolarHBondContact N-O 2.93Å; A339-A352 PolarHBondContact O-N 2.89Å; A339-A352 VanDerWaalsContact O-N 3.1Å; F342-A352 HydrophobicContact CB-CB 3.84Å; F342-A352 HydrophobicContact CD1-CB 3.78Å; F342-A352 HydrophobicContact CD2-CB 4.36Å; F342-A352 HydrophobicContact CE1-CB 4.48Å; F342-A352 HydrophobicContact CG-CB 3.72Å; A352-Y354 HydrophobicContact CB-CE2 3.9Å; A352-R371 HydrophobicContact CB-CG 4.15Å; A352-L372 WeakPolarHBondContact CA-O 3.44Å; A352-F380 PolarHBondContact N-O 2.79Å; A352-F380 VanDerWaalsContact N-O 3.11Å
353	V	98.4	Very high	93.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.9	167.2	173.3	0	0	0	0	109	I336 V337 V355 R371 L372 F380 G381 V384 V400	I336-V353 HydrophobicContact CG2-CG1 3.33Å; V337-V353 CarbonylContact O-C 3.6Å; V337-V353 WeakPolarHBondContact O-CA 3.36Å; V353-V355 HydrophobicContact CG1-CG2 4.5Å; V353-R371 CarbonylContact O-C 3.39Å; V353-R371 WeakPolarHBondContact O-CA 3.45Å; V353-L372 HydrophobicContact CB-CB 4.33Å; V353-L372 PolarHBondContact N-O 3.12Å; V353-L372 PolarHBondContact O-N 2.88Å; V353-F380 HydrophobicContact CB-CE1 3.9Å; V353-F380 HydrophobicContact CG2-CD1 4.02Å; V353-F380 HydrophobicContact CG2-CE1 3.66Å; V353-F380 HydrophobicContact CG2-CZ 4.41Å; V353-G381 VanDerWaalsContact CG2-CA 3.45Å; V353-V384 HydrophobicContact CG1-CG2 4.18Å; V353-V384 HydrophobicContact CG2-CG2 3.68Å; V353-V400 HydrophobicContact CG2-CG1 3.6Å; V353-V400 HydrophobicContact CG2-CG2 4.09Å
354	Y	97.9	Very high	92.5	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.7	180	-63.5	-100.1	0	0	0	108.8	E312 F318 I336 V337 A339 F342 A352 P369 R371	E312-Y354 HydrophobicContact CG-CE1 4.36Å; F318-Y354 AromaticContact CD2-CD2 3.76Å; F318-Y354 HydrophobicContact CD2-CD2 3.76Å; F318-Y354 AromaticContact CD2-CE2 3.99Å; F318-Y354 HydrophobicContact CD2-CE2 3.99Å; F318-Y354 HydrophobicContact CD2-CG 4.31Å; F318-Y354 HydrophobicContact CE2-CD1 4.47Å; F318-Y354 AromaticContact CE2-CD2 3.74Å; F318-Y354 HydrophobicContact CE2-CD2 3.74Å; F318-Y354 HydrophobicContact CE2-CE2 4.33Å; F318-Y354 AromaticContact CE2-CG 3.83Å; F318-Y354 HydrophobicContact CE2-CG 3.83Å; I336-Y354 WeakPolarHBondContact CA-O 3.25Å; V337-Y354 PolarHBondContact N-O 3.35Å; V337-Y354 PolarHBondContact O-N 2.84Å; A339-Y354 HydrophobicContact CB-CD2 4.29Å; A339-Y354 HydrophobicContact CB-CE2 3.79Å; F342-Y354 VanDerWaalsContact CD2-OH 3.32Å; F342-Y354 WeakPolarHBondContact CD2-OH 3.33Å; F342-Y354 WeakPolarHBondContact CE2-OH 3.18Å; A352-Y354 HydrophobicContact CB-CE2 3.9Å; Y354-P369 HydrophobicContact CD1-CB 4.02Å; Y354-P369 HydrophobicContact CD1-CG 3.78Å; Y354-R371 HydrophobicContact CD1-CB 4.38Å; Y354-R371 HydrophobicContact CD1-CG 4.05Å; Y354-R371 HydrophobicContact CE1-CB 4.4Å; Y354-R371 VanDerWaalsContact CE1-CD 3.44Å; Y354-R371 HydrophobicContact CE1-CG 3.81Å; Y354-R371 HydrophobicContact CE2-CG 4.47Å; Y354-R371 HydrophobicContact CG-CG 4.49Å; Y354-R371 WeakPolarHBondContact OH-CD 3.45Å
355	V	97.9	Very high	91.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.9	177.7	-177	0	0	0	0	108.7	L327 I336 V353 L357 P369 I370 L372 I420	L327-V355 HydrophobicContact CD1-CG1 3.32Å; I336-V355 HydrophobicContact CG1-CG1 4.29Å; I336-V355 HydrophobicContact CG1-CG2 4.4Å; I336-V355 HydrophobicContact CG2-CG2 4.13Å; V353-V355 HydrophobicContact CG1-CG2 4.5Å; V355-L357 HydrophobicContact CG1-CD2 4.2Å; V355-P369 CarbonylContact O-C 3.53Å; V355-P369 VanDerWaalsContact O-CA 3.28Å; V355-P369 WeakPolarHBondContact O-CA 3.18Å; V355-I370 HydrophobicContact CB-CB 4.3Å; V355-I370 PolarHBondContact N-O 2.83Å; V355-I370 PolarHBondContact O-N 2.71Å; V355-L372 HydrophobicContact CG2-CD1 4.3Å; V355-I420 HydrophobicContact CB-CG2 4.37Å; V355-I420 HydrophobicContact CG1-CG2 4.18Å; V355-I420 HydrophobicContact CG2-CD1 4.03Å; V355-I420 HydrophobicContact CG2-CG2 4.28Å
356	Y	96.5	Very high	89.6	Confident	15 Å²	15	59.3 Å²	59.3	6%	0.059	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	98.1	175.7	-66.9	-94.8	0	0	0	109	F309 F318 D334 V335 V337 P369	F309-Y356 AromaticContact CD1-CD1 3.93Å; F309-Y356 HydrophobicContact CD1-CD1 3.93Å; F309-Y356 AromaticContact CD1-CE1 3.73Å; F309-Y356 HydrophobicContact CD1-CE1 3.73Å; F309-Y356 HydrophobicContact CD1-CG 4.4Å; F309-Y356 AromaticContact CE1-CD1 3.81Å; F309-Y356 HydrophobicContact CE1-CD1 3.81Å; F309-Y356 HydrophobicContact CE1-CE1 4.1Å; F309-Y356 HydrophobicContact CE1-CG 4.19Å; F309-Y356 HydrophobicContact CG-CE1 4.43Å; F309-Y356 HydrophobicContact CZ-CG 4.47Å; F318-Y356 HydrophobicContact CE2-CE2 4.17Å; F318-Y356 AromaticContact CZ-CE2 3.87Å; F318-Y356 HydrophobicContact CZ-CE2 3.87Å; F318-Y356 WeakPolarHBondContact CZ-OH 3.47Å; D334-Y356 WeakPolarHBondContact CB-O 3.46Å; V335-Y356 PolarHBondContact N-O 3.05Å; V335-Y356 VanDerWaalsContact N-O 3.08Å; V335-Y356 WeakPolarHBondContact O-CB 3.41Å; V335-Y356 PolarHBondContact O-N 3.37Å; V337-Y356 HydrophobicContact CG2-CD2 4.34Å; V337-Y356 HydrophobicContact CG2-CE2 4.24Å; Y356-P369 HydrophobicContact CD1-CB 3.91Å; Y356-P369 HydrophobicContact CD1-CG 4.4Å; Y356-P369 HydrophobicContact CD2-CB 4.11Å; Y356-P369 HydrophobicContact CE1-CB 3.69Å; Y356-P369 HydrophobicContact CE1-CG 3.74Å; Y356-P369 HydrophobicContact CE2-CB 3.89Å; Y356-P369 HydrophobicContact CE2-CG 4.39Å; Y356-P369 HydrophobicContact CG-CB 4.12Å
357	L	95.1	Very high	88.6	Confident	48 Å²	48	51.2 Å²	51.2	25%	0.251	27%	0.272	S	S	.	.			trans	-64.4	137.7	170.5	-60.2	179.5	0	0	0	109.8	L327 D334 V355 P359 I370	L327-L357 HydrophobicContact CB-CD2 4.37Å; L327-L357 HydrophobicContact CD1-CD2 4.13Å; D334-L357 VanDerWaalsContact OD1-CA 3.25Å; D334-L357 WeakPolarHBondContact OD1-CA 3.29Å; V355-L357 HydrophobicContact CG1-CD2 4.2Å; L357-P359 VanDerWaalsContact O-CD 3.31Å; L357-P359 WeakPolarHBondContact O-CD 3.46Å; L357-I370 HydrophobicContact CD1-CD1 3.83Å; L357-I370 HydrophobicContact CG-CD1 4.24Å
358	N	93.8	Very high	88.5	Confident	7 Å²	7	59.1 Å²	59.1	4%	0.037	29%	0.29	C	S	.	.			trans	-80.3	116.8	-167.9	-165.6	-34.6	0	0	0	112.6	G270 I271 W332 T333 D334 L360 G361 W363	G270-N358 PolarHBondContact O-ND2 2.87Å; I271-N358 WeakPolarHBondContact CA-ND2 3.39Å; I271-N358 PolarHBondContact O-ND2 2.85Å; W332-N358 HydrophobicContact CB-CB 3.78Å; T333-N358 PolarHBondContact O-ND2 3.35Å; D334-N358 WeakPolarHBondContact OD1-CB 3.46Å; D334-N358 PolarHBondContact OD1-N 3.15Å; N358-L360 PolarHBondContact O-N 2.91Å; N358-L360 PolarHBondContact OD1-N 2.79Å; N358-G361 WeakPolarHBondContact OD1-CA 3.26Å; N358-G361 PolarHBondContact OD1-N 3.17Å; N358-W363 HydrophobicContact CB-CH2 3.79Å; N358-W363 HydrophobicContact CB-CZ2 3.96Å; N358-W363 VanDerWaalsContact ND2-CZ2 3.28Å; N358-W363 WeakPolarHBondContact ND2-CZ2 3.45Å
359	P	91.8	Very high	88.5	Confident	43 Å²	43	54.1 Å²	54.1	28%	0.279	27%	0.27	S	S	.	.			trans	-80	55.2	177.3	37.1	-38.8	0	0	0	111.5	L357 G361 H362 W363 A367	L357-P359 VanDerWaalsContact O-CD 3.31Å; L357-P359 WeakPolarHBondContact O-CD 3.46Å; P359-G361 PolarHBondContact O-N 3.5Å; P359-H362 VanDerWaalsContact CG-C 3.46Å; P359-H362 WeakPolarHBondContact CG-O 3.31Å; P359-H362 PolarHBondContact O-N 3.07Å; P359-W363 VanDerWaalsContact CD-CE3 3.43Å; P359-W363 VanDerWaalsContact CD-CZ3 3.46Å; P359-W363 HydrophobicContact CG-CD2 4.28Å; P359-W363 HydrophobicContact CG-CE3 4.01Å; P359-W363 HydrophobicContact CG-CZ3 4.49Å; P359-A367 HydrophobicContact CG-CB 4.29Å
360	L	90.6	Very high	88.7	Confident	98 Å²	98	55.8 Å²	55.8	51%	0.513	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	37.3	179.8	-46.5	176	0	0	0	113.5	W332 N358 H362	W332-L360 HydrophobicContact CG-CD2 4.36Å; W332-L360 WeakPolarHBondContact CH2-O 3.31Å; W332-L360 HydrophobicContact CZ2-CB 4.16Å; W332-L360 WeakPolarHBondContact CZ2-O 3.47Å; W332-L360 VanDerWaalsContact CZ3-C 3.47Å; N358-L360 PolarHBondContact O-N 2.91Å; N358-L360 PolarHBondContact OD1-N 2.79Å; L360-H362 PolarHBondContact O-CD2 2.99Å
361	G	89.3	Confident	88.8	Confident	7 Å²	7	59.8 Å²	59.8	7%	0.072	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-3.7	-178.6	0	0	0	0	0	115.8	W332 N358 P359	W332-G361 VanDerWaalsContact CZ3-CA 3.49Å; N358-G361 WeakPolarHBondContact OD1-CA 3.26Å; N358-G361 PolarHBondContact OD1-N 3.17Å; P359-G361 PolarHBondContact O-N 3.5Å
362	H	88.5	Confident	88.8	Confident	138 Å²	138	60 Å²	60	64%	0.639	29%	0.293	S	S	*	.			trans	-103.4	72.5	-172.9	-70	-73.8	0	0	0	113.2	P359 L360 D364	P359-H362 VanDerWaalsContact CG-C 3.46Å; P359-H362 WeakPolarHBondContact CG-O 3.31Å; P359-H362 PolarHBondContact O-N 3.07Å; L360-H362 PolarHBondContact O-CD2 2.99Å; H362-D364 PolarHBondContact O-N 3.2Å
363	W	88.3	Confident	88.8	Confident	9 Å²	9	63.5 Å²	63.5	3%	0.034	31%	0.312	C	S	.	.			trans	-70.3	30	-176.3	-55.3	98	0	0	0	116	I271 H307 F309 V335 N358 P359 A367	I271-W363 HydrophobicContact CG2-CZ2 3.89Å; I271-W363 PolarHBondContact O-NE1 2.93Å; H307-W363 PolarHBondContact CE1-O 3.13Å; H307-W363 PolarHBondContact ND1-O 2.68Å; F309-W363 HydrophobicContact CE1-CD2 4.24Å; F309-W363 AromaticContact CE1-CE3 3.79Å; F309-W363 HydrophobicContact CE1-CE3 3.79Å; F309-W363 HydrophobicContact CE1-CZ3 4.32Å; F309-W363 AromaticContact CZ-CD2 3.79Å; F309-W363 HydrophobicContact CZ-CD2 3.79Å; F309-W363 AromaticContact CZ-CE3 3.59Å; F309-W363 HydrophobicContact CZ-CE3 3.59Å; F309-W363 HydrophobicContact CZ-CG 4.35Å; F309-W363 HydrophobicContact CZ-CH2 4.34Å; F309-W363 AromaticContact CZ-CZ3 3.92Å; F309-W363 HydrophobicContact CZ-CZ3 3.92Å; V335-W363 HydrophobicContact CG2-CH2 4.12Å; V335-W363 HydrophobicContact CG2-CZ2 4.09Å; N358-W363 HydrophobicContact CB-CH2 3.79Å; N358-W363 HydrophobicContact CB-CZ2 3.96Å; N358-W363 VanDerWaalsContact ND2-CZ2 3.28Å; N358-W363 WeakPolarHBondContact ND2-CZ2 3.45Å; P359-W363 VanDerWaalsContact CD-CE3 3.43Å; P359-W363 VanDerWaalsContact CD-CZ3 3.46Å; P359-W363 HydrophobicContact CG-CD2 4.28Å; P359-W363 HydrophobicContact CG-CE3 4.01Å; P359-W363 HydrophobicContact CG-CZ3 4.49Å; W363-A367 HydrophobicContact CE3-CB 3.92Å; W363-A367 HydrophobicContact CZ3-CB 4.45Å
364	D	77.8	Confident	88.6	Confident	120 Å²	120	63.9 Å²	63.9	64%	0.642	32%	0.316	S	S	*	.	S	Bend	trans	-65.6	174.5	171.3	-64	-39.5	0	0	0	110.6	H362 Q366 A367	H362-D364 PolarHBondContact O-N 3.2Å; D364-Q366 PolarHBondContact O-N 2.87Å; D364-A367 PolarHBondContact O-N 2.84Å
365	D	62.7	Low	88.5	Confident	174 Å²	174	66.8 Å²	66.8	93%	0.93	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	4.4	-168.2	-65.2	-41.5	0	0	0	118.1
366	Q	58.2	Low	88.2	Confident	177 Å²	177	72.4 Å²	72.4	83%	0.827	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-20.8	175.9	-56.7	-175.7	13.9	0	0	113.5	D364 R368	D364-Q366 PolarHBondContact O-N 2.87Å; Q366-R368 VanDerWaalsContact C-N 3.31Å; Q366-R368 PolarHBondContact O-N 3.18Å
367	A	71.4	Confident	87.9	Confident	24 Å²	24	76.3 Å²	76.3	20%	0.198	38%	0.378	C	S	.	.			trans	-74.8	73	-176.7	0	0	0	0	0	113.1	P359 W363 D364	P359-A367 HydrophobicContact CG-CB 4.29Å; W363-A367 HydrophobicContact CE3-CB 3.92Å; W363-A367 HydrophobicContact CZ3-CB 4.45Å; D364-A367 PolarHBondContact O-N 2.84Å
368	R	86.4	Confident	88	Confident	223 Å²	223	74 Å²	74	84%	0.842	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-75.7	126.6	175.5	-68.2	-173.4	175.8	-150.2	-3.2	110.9	Q366	Q366-R368 VanDerWaalsContact C-N 3.31Å; Q366-R368 PolarHBondContact O-N 3.18Å
369	P	93.3	Very high	88.1	Confident	33 Å²	33	75.9 Å²	75.9	21%	0.214	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-73.1	145.9	179.1	28.7	-33.4	0	0	0	112.3	Y354 V355 Y356	Y354-P369 HydrophobicContact CD1-CB 4.02Å; Y354-P369 HydrophobicContact CD1-CG 3.78Å; V355-P369 CarbonylContact O-C 3.53Å; V355-P369 VanDerWaalsContact O-CA 3.28Å; V355-P369 WeakPolarHBondContact O-CA 3.18Å; Y356-P369 HydrophobicContact CD1-CB 3.91Å; Y356-P369 HydrophobicContact CD1-CG 4.4Å; Y356-P369 HydrophobicContact CD2-CB 4.11Å; Y356-P369 HydrophobicContact CE1-CB 3.69Å; Y356-P369 HydrophobicContact CE1-CG 3.74Å; Y356-P369 HydrophobicContact CE2-CB 3.89Å; Y356-P369 HydrophobicContact CE2-CG 4.39Å; Y356-P369 HydrophobicContact CG-CB 4.12Å
370	I	95.9	Very high	88.4	Confident	50 Å²	50	73.9 Å²	73.9	26%	0.256	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	118.4	162.3	-60.3	168.9	0	0	0	106.9	V355 L357 I420 T422	V355-I370 HydrophobicContact CB-CB 4.3Å; V355-I370 PolarHBondContact N-O 2.83Å; V355-I370 PolarHBondContact O-N 2.71Å; L357-I370 HydrophobicContact CD1-CD1 3.83Å; L357-I370 HydrophobicContact CG-CD1 4.24Å; I370-I420 HydrophobicContact CB-CG2 4.46Å; I370-I420 HydrophobicContact CD1-CG2 4.03Å; I370-I420 HydrophobicContact CG2-CG2 4.09Å; I370-T422 HydrophobicContact CG2-CG2 3.65Å
371	R	95.9	Very high	88.8	Confident	89 Å²	89	69.2 Å²	69.2	34%	0.336	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	118.7	-178.8	-162.5	177.2	77.4	-157.2	6.1	111.6	E312 A352 V353 Y354 N373	E312-R371 IonicContact OE2-NH1 3.63Å; A352-R371 HydrophobicContact CB-CG 4.15Å; V353-R371 CarbonylContact O-C 3.39Å; V353-R371 WeakPolarHBondContact O-CA 3.45Å; Y354-R371 HydrophobicContact CD1-CB 4.38Å; Y354-R371 HydrophobicContact CD1-CG 4.05Å; Y354-R371 HydrophobicContact CE1-CB 4.4Å; Y354-R371 VanDerWaalsContact CE1-CD 3.44Å; Y354-R371 HydrophobicContact CE1-CG 3.81Å; Y354-R371 HydrophobicContact CE2-CG 4.47Å; Y354-R371 HydrophobicContact CG-CG 4.49Å; Y354-R371 WeakPolarHBondContact OH-CD 3.45Å; R371-N373 PolarHBondContact NE-OD1 3.08Å
372	L	97.6	Very high	89.2	Confident	5 Å²	5	70 Å²	70	3%	0.026	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.8	168.3	-52	178.1	0	0	0	108.2	A352 V353 V355 F380 I398 Y413 I420 T422	A352-L372 WeakPolarHBondContact CA-O 3.44Å; V353-L372 HydrophobicContact CB-CB 4.33Å; V353-L372 PolarHBondContact N-O 3.12Å; V353-L372 PolarHBondContact O-N 2.88Å; V355-L372 HydrophobicContact CG2-CD1 4.3Å; L372-F380 HydrophobicContact CB-CE1 3.83Å; L372-F380 HydrophobicContact CB-CZ 3.98Å; L372-F380 WeakPolarHBondContact O-CE1 3.26Å; L372-I398 HydrophobicContact CD1-CD1 4.48Å; L372-Y413 HydrophobicContact CD1-CD1 4.08Å; L372-Y413 HydrophobicContact CD1-CD2 3.97Å; L372-Y413 HydrophobicContact CD1-CE1 4.05Å; L372-Y413 HydrophobicContact CD1-CE2 3.93Å; L372-Y413 HydrophobicContact CD1-CG 4.03Å; L372-Y413 HydrophobicContact CD2-CD1 4.45Å; L372-Y413 HydrophobicContact CD2-CE1 4.16Å; L372-I420 HydrophobicContact CD1-CD1 4.15Å; L372-T422 HydrophobicContact CD2-CG2 4.2Å
373	N	96.6	Very high	89.6	Confident	73 Å²	73	64.3 Å²	64.3	39%	0.39	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.9	-174.1	-58.3	-49.4	0	0	0	110.8	I349 R371	I349-N373 HydrophobicContact CD1-CB 3.98Å; I349-N373 HydrophobicContact CG1-CB 4.14Å; I349-N373 HydrophobicContact CG2-CB 3.9Å; R371-N373 PolarHBondContact NE-OD1 3.08Å
374	G	95.8	Very high	90.1	Very high	8 Å²	8	64.3 Å²	64.3	8%	0.082	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	166.8	170.4	0	0	0	0	0	114.1	G351	G351-G374 PolarHBondContact O-N 3.03Å
375	T	94.4	Very high	91	Very high	62 Å²	62	59.3 Å²	59.3	38%	0.38	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	160.5	166.5	49.1	0	0	0	0	110.9	G350 D377 S378 D405	G350-T375 CarbonylContact C-O 3.55Å; G350-T375 VanDerWaalsContact CA-O 3.3Å; G350-T375 WeakPolarHBondContact CA-O 3.31Å; G350-T375 PolarHBondContact N-O 3.37Å; G350-T375 VanDerWaalsContact N-O 3.1Å; G350-T375 VanDerWaalsContact O-O 3.05Å; T375-D377 PolarHBondContact O-N 3.36Å; T375-S378 PolarHBondContact N-OG 2.84Å; T375-S378 VanDerWaalsContact O-CB 3.26Å; T375-S378 WeakPolarHBondContact O-CB 3.45Å; T375-S378 PolarHBondContact O-N 3.12Å; T375-S378 PolarHBondContact O-OG 2.86Å; T375-S378 VanDerWaalsContact OG1-CB 3.22Å; T375-S378 WeakPolarHBondContact OG1-CB 3.44Å; T375-S378 PolarHBondContact OG1-OG 3.06Å; T375-D405 PolarHBondContact OG1-OD2 2.96Å
376	Y	92.8	Very high	92.6	Very high	117 Å²	117	52.9 Å²	52.9	46%	0.459	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	135	179.6	-172.1	-90.6	0	0	0	112.6	F343 E348 S378	F343-Y376 HydrophobicContact CE2-CD2 4.18Å; F343-Y376 AromaticContact CE2-CE2 3.56Å; F343-Y376 HydrophobicContact CE2-CE2 3.56Å; F343-Y376 AromaticContact CZ-CE2 3.98Å; F343-Y376 HydrophobicContact CZ-CE2 3.98Å; E348-Y376 HydrophobicContact CB-CD2 4.29Å; E348-Y376 WeakPolarHBondContact O-CA 3.43Å; E348-Y376 WeakPolarHBondContact O-CB 3.36Å; E348-Y376 PolarHBondContact O-N 3.32Å; Y376-S378 PolarHBondContact O-N 3.39Å
377	D	90.6	Very high	94.5	Very high	98 Å²	98	44.4 Å²	44.4	52%	0.524	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	9.2	-177.7	-73.1	-8.3	0	0	0	117.2	T375 M379 F404	T375-D377 PolarHBondContact O-N 3.36Å; D377-M379 VanDerWaalsContact C-N 3.33Å; D377-M379 PolarHBondContact O-N 2.88Å; D377-F404 WeakPolarHBondContact O-CB 3.22Å
378	S	95.9	Very high	95.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-72.2	-19.1	-173.8	67.2	0	0	0	0	116.5	G350 T375 Y376 F380 A402 F404	G350-S378 PolarHBondContact O-OG 2.85Å; T375-S378 PolarHBondContact N-OG 2.84Å; T375-S378 VanDerWaalsContact O-CB 3.26Å; T375-S378 WeakPolarHBondContact O-CB 3.45Å; T375-S378 PolarHBondContact O-N 3.12Å; T375-S378 PolarHBondContact O-OG 2.86Å; T375-S378 VanDerWaalsContact OG1-CB 3.22Å; T375-S378 WeakPolarHBondContact OG1-CB 3.44Å; T375-S378 PolarHBondContact OG1-OG 3.06Å; Y376-S378 PolarHBondContact O-N 3.39Å; S378-F380 PolarHBondContact O-N 3.16Å; S378-F380 PolarHBondContact OG-N 3.46Å; S378-A402 CarbonylContact O-C 3.35Å; S378-F404 PolarHBondContact O-N 3.24Å
379	M	96.6	Very high	96	Very high	46 Å²	46	35 Å²	35	23%	0.227	19%	0.187	C	C	.	.			trans	53.9	36	-168.2	-48.8	-168.5	74.3	0	0	113.6	P340 N341 D377 G381 M382 F404	P340-M379 HydrophobicContact CB-CB 4.16Å; P340-M379 WeakPolarHBondContact CB-O 3.49Å; P340-M379 WeakPolarHBondContact O-CA 3.5Å; N341-M379 WeakPolarHBondContact ND2-CE 3.19Å; D377-M379 VanDerWaalsContact C-N 3.33Å; D377-M379 PolarHBondContact O-N 2.88Å; M379-G381 PolarHBondContact O-N 2.03Å; M379-M382 HydrophobicContact CE-SD 4.44Å; M379-M382 WeakPolarHBondContact O-CB 3.47Å; M379-M382 PolarHBondContact O-N 2.87Å; M379-M382 VanDerWaalsContact O-N 3.08Å; M379-F404 HydrophobicContact CB-CD2 3.86Å; M379-F404 HydrophobicContact CB-CE2 4.39Å; M379-F404 HydrophobicContact CG-CD2 3.68Å; M379-F404 HydrophobicContact CG-CE2 4.18Å; M379-F404 HydrophobicContact CG-CG 4.28Å; M379-F404 HydrophobicContact SD-CD2 3.56Å; M379-F404 VanDerWaalsContact SD-CD2 3.56Å; M379-F404 HydrophobicContact SD-CE2 3.44Å; M379-F404 WeakPolarHBondContact SD-CE2 3.26Å; M379-F404 HydrophobicContact SD-CG 4.26Å; M379-F404 HydrophobicContact SD-CZ 4.05Å
380	F	98.4	Very high	96.1	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-51.1	132.8	176	179.1	-91.5	0	0	0	112.4	G350 G351 A352 V353 L372 S378 V400 A402 F411 Y413	G350-F380 PolarHBondContact O-N 2.9Å; G351-F380 CarbonylContact C-O 3.59Å; G351-F380 VanDerWaalsContact CA-O 3.23Å; G351-F380 WeakPolarHBondContact CA-O 3.25Å; A352-F380 PolarHBondContact N-O 2.79Å; A352-F380 VanDerWaalsContact N-O 3.11Å; V353-F380 HydrophobicContact CB-CE1 3.9Å; V353-F380 HydrophobicContact CG2-CD1 4.02Å; V353-F380 HydrophobicContact CG2-CE1 3.66Å; V353-F380 HydrophobicContact CG2-CZ 4.41Å; L372-F380 HydrophobicContact CB-CE1 3.83Å; L372-F380 HydrophobicContact CB-CZ 3.98Å; L372-F380 WeakPolarHBondContact O-CE1 3.26Å; S378-F380 PolarHBondContact O-N 3.16Å; S378-F380 PolarHBondContact OG-N 3.46Å; F380-V400 HydrophobicContact CD1-CG1 4.09Å; F380-V400 HydrophobicContact CD2-CG1 3.78Å; F380-V400 HydrophobicContact CE1-CG1 3.85Å; F380-V400 HydrophobicContact CE2-CB 3.89Å; F380-V400 HydrophobicContact CE2-CG1 3.51Å; F380-V400 HydrophobicContact CG-CG1 4.06Å; F380-V400 HydrophobicContact CZ-CB 3.94Å; F380-V400 HydrophobicContact CZ-CG1 3.55Å; F380-V400 HydrophobicContact CZ-CG2 4.23Å; F380-A402 HydrophobicContact CB-CB 4.14Å; F380-A402 HydrophobicContact CD2-CB 4.17Å; F380-F411 AromaticContact CD2-CD2 3.8Å; F380-F411 HydrophobicContact CD2-CD2 3.8Å; F380-F411 AromaticContact CD2-CE2 3.97Å; F380-F411 HydrophobicContact CD2-CE2 3.97Å; F380-F411 HydrophobicContact CD2-CG 4.49Å; F380-F411 HydrophobicContact CE2-CB 4.16Å; F380-F411 AromaticContact CE2-CD2 3.66Å; F380-F411 HydrophobicContact CE2-CD2 3.66Å; F380-F411 HydrophobicContact CE2-CE2 4.21Å; F380-F411 AromaticContact CE2-CG 3.92Å; F380-F411 HydrophobicContact CE2-CG 3.92Å; F380-Y413 HydrophobicContact CE2-CE2 4.13Å; F380-Y413 AromaticContact CZ-CE2 3.85Å; F380-Y413 HydrophobicContact CZ-CE2 3.85Å; F380-Y413 WeakPolarHBondContact CZ-OH 3.38Å
381	G	97.8	Very high	95.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	7.4	-171.7	0	0	0	0	0	114.1	S321 V353 M379 T383 G401	S321-G381 PolarHBondContact OG-O 2.75Å; V353-G381 VanDerWaalsContact CG2-CA 3.45Å; M379-G381 PolarHBondContact O-N 2.03Å; G381-T383 PolarHBondContact O-N 3.46Å; G381-G401 PolarHBondContact N-O 3.38Å; G381-G401 VanDerWaalsContact N-O 3.14Å
382	M	97.6	Very high	95.8	Very high	22 Å²	22	29.3 Å²	29.3	11%	0.108	16%	0.16	C	C	.	.	S	Bend	trans	-57.3	-38.4	172.8	-168.3	67.4	169	0	0	111.4	Y320 P340 M379 G401 P403 Y440	Y320-M382 VanDerWaalsContact CD1-O 3.31Å; Y320-M382 WeakPolarHBondContact CD1-O 3.45Å; Y320-M382 HydrophobicContact CD1-SD 4.18Å; Y320-M382 HydrophobicContact CE1-CE 3.99Å; Y320-M382 HydrophobicContact CE1-CG 4.21Å; Y320-M382 VanDerWaalsContact CE1-O 3.25Å; Y320-M382 WeakPolarHBondContact CE1-O 3.31Å; Y320-M382 HydrophobicContact CE1-SD 3.54Å; Y320-M382 VanDerWaalsContact CE1-SD 3.54Å; Y320-M382 HydrophobicContact CE2-CE 4.45Å; Y320-M382 HydrophobicContact CE2-SD 4.38Å; Y320-M382 WeakPolarHBondContact OH-CE 3.37Å; P340-M382 HydrophobicContact CB-CB 4.22Å; P340-M382 HydrophobicContact CB-SD 3.96Å; P340-M382 HydrophobicContact CG-SD 4.02Å; M379-M382 HydrophobicContact CE-SD 4.44Å; M379-M382 WeakPolarHBondContact O-CB 3.47Å; M379-M382 PolarHBondContact O-N 2.87Å; M379-M382 VanDerWaalsContact O-N 3.08Å; M382-G401 PolarHBondContact N-O 2.75Å; M382-P403 HydrophobicContact CB-CG 4.02Å; M382-P403 HydrophobicContact CG-CG 3.97Å; M382-Y440 HydrophobicContact CE-CD2 4.49Å; M382-Y440 HydrophobicContact CE-CE2 3.68Å
383	T	97.9	Very high	95.4	Very high	19 Å²	19	31.2 Å²	31.2	12%	0.117	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139.4	168	-177.9	0	0	0	0	108.7	G381 G401 G439 I442	G381-T383 PolarHBondContact O-N 3.46Å; T383-G401 PolarHBondContact O-N 2.77Å; T383-G439 WeakPolarHBondContact CG2-O 3.27Å; T383-I442 HydrophobicContact CG2-CD1 3.72Å; T383-I442 HydrophobicContact CG2-CG1 3.81Å
384	V	98.2	Very high	95.2	Very high	10 Å²	10	29 Å²	29	6%	0.061	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134	171.6	178.4	0	0	0	0	105.4	S321 A323 I336 V353 A399 V400	S321-V384 WeakPolarHBondContact OG-CG2 3.23Å; A323-V384 HydrophobicContact CB-CB 4.48Å; A323-V384 HydrophobicContact CB-CG1 3.81Å; I336-V384 HydrophobicContact CB-CG1 4.13Å; I336-V384 HydrophobicContact CG2-CG1 3.59Å; V353-V384 HydrophobicContact CG1-CG2 4.18Å; V353-V384 HydrophobicContact CG2-CG2 3.68Å; V384-A399 WeakPolarHBondContact CA-O 3.49Å; V384-V400 HydrophobicContact CG2-CG1 4.46Å; V384-V400 HydrophobicContact CG2-CG2 4.42Å
385	S	97.6	Very high	95.1	Very high	15 Å²	15	31.3 Å²	31.3	11%	0.105	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	136	177.2	-164.5	0	0	0	0	110.4	I398 A399	S385-I398 WeakPolarHBondContact O-CA 3.3Å; S385-A399 PolarHBondContact N-O 2.73Å; S385-A399 PolarHBondContact O-N 2.83Å
386	S	96.6	Very high	95.2	Very high	38 Å²	38	28.8 Å²	28.8	27%	0.266	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133.7	156.3	175.2	0	0	0	0	107.9
387	I	96.9	Very high	95.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	12	-177.8	59.9	-171.7	0	0	0	112.3	L390 D397 A399 I412 I442 G445 V456	I387-L390 HydrophobicContact CB-CD1 4.45Å; I387-L390 HydrophobicContact CD1-CD1 3.3Å; I387-L390 HydrophobicContact CD1-CG 4.07Å; I387-L390 HydrophobicContact CG1-CD1 3.77Å; I387-L390 HydrophobicContact CG1-CG 3.97Å; I387-D397 HydrophobicContact CD1-CB 4.11Å; I387-D397 HydrophobicContact CG1-CB 3.85Å; I387-D397 PolarHBondContact N-O 2.75Å; I387-A399 HydrophobicContact CD1-CB 3.84Å; I387-A399 HydrophobicContact CG2-CB 3.61Å; I387-I412 HydrophobicContact CD1-CD1 3.99Å; I387-I412 HydrophobicContact CD1-CG2 3.91Å; I387-I442 HydrophobicContact CG2-CG2 4.44Å; I387-G445 VanDerWaalsContact C-CA 3.49Å; I387-G445 VanDerWaalsContact C-N 3.3Å; I387-G445 WeakPolarHBondContact O-CA 3.4Å; I387-G445 PolarHBondContact O-N 2.67Å; I387-V456 HydrophobicContact CB-CG2 4.08Å; I387-V456 HydrophobicContact CD1-CG2 4.45Å; I387-V456 HydrophobicContact CG2-CG2 4.17Å
388	G	94.6	Very high	95.7	Very high	20 Å²	20	18.5 Å²	18.5	21%	0.206	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	78.2	-167.9	-173	0	0	0	0	0	112	D397	G388-D397 WeakPolarHBondContact O-CA 3.23Å; G388-D397 WeakPolarHBondContact O-CB 3.49Å; G388-D397 PolarHBondContact O-N 3.36Å
389	D	95.6	Very high	95.9	Very high	30 Å²	30	18.5 Å²	18.5	16%	0.16	11%	0.111	C	C	.	.			trans	-88.5	99.3	170.9	172.1	0.5	0	0	0	107.5	Q392 D393 G394 Y395 P454	D389-Q392 VanDerWaalsContact CG-CA 3.48Å; D389-Q392 PolarHBondContact O-NE2 3.12Å; D389-Q392 WeakPolarHBondContact OD1-CA 3.16Å; D389-Q392 PolarHBondContact OD1-N 3.2Å; D389-Q392 WeakPolarHBondContact OD2-CA 3.34Å; D389-D393 PolarHBondContact OD1-N 2.63Å; D389-D393 VanDerWaalsContact OD1-N 3.15Å; D389-G394 WeakPolarHBondContact OD2-CA 3.29Å; D389-G394 PolarHBondContact OD2-N 2.77Å; D389-Y395 WeakPolarHBondContact CA-O 3.31Å; D389-Y395 WeakPolarHBondContact CB-O 3.49Å; D389-P454 WeakPolarHBondContact O-CD 3.49Å; D389-P454 WeakPolarHBondContact O-CG 3.37Å
390	L	94.8	Very high	96	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-75.5	-37.4	-171.4	-74.2	-178.8	0	0	0	112.3	F39 N40 L41 I387 D397 I412 Y453 P454 V456	F39-L390 HydrophobicContact CE2-CB 3.88Å; F39-L390 HydrophobicContact CE2-CD1 4.27Å; F39-L390 HydrophobicContact CZ-CB 4.07Å; F39-L390 HydrophobicContact CZ-CD1 3.63Å; N40-L390 PolarHBondContact ND2-O 3.03Å; L41-L390 HydrophobicContact CD1-CD1 4.03Å; L41-L390 HydrophobicContact CD2-CD1 4.42Å; L41-L390 HydrophobicContact CG-CD1 4.27Å; I387-L390 HydrophobicContact CB-CD1 4.45Å; I387-L390 HydrophobicContact CD1-CD1 3.3Å; I387-L390 HydrophobicContact CD1-CG 4.07Å; I387-L390 HydrophobicContact CG1-CD1 3.77Å; I387-L390 HydrophobicContact CG1-CG 3.97Å; L390-D397 WeakPolarHBondContact CB-OD2 3.43Å; L390-D397 PolarHBondContact N-OD2 2.71Å; L390-I412 HydrophobicContact CD1-CG2 4.18Å; L390-Y453 WeakPolarHBondContact O-CD1 3.33Å; L390-P454 HydrophobicContact CD2-CB 4.13Å; L390-P454 HydrophobicContact CD2-CG 3.96Å; L390-P454 WeakPolarHBondContact CD2-O 3.14Å; L390-V456 HydrophobicContact CD1-CG2 4Å; L390-V456 HydrophobicContact CD2-CG2 3.98Å
391	D	91.9	Very high	96	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	10%	0.1	C	C	.	.	S	Bend	trans	-96	1.7	179.3	65.1	-73	0	0	0	115.9	D393 R414 V473	D391-D393 VanDerWaalsContact C-N 3.33Å; D391-R414 IonicContact OD1-CZ 3.23Å; D391-R414 IonicContact OD1-NE 3.83Å; D391-R414 PolarHBondContact OD1-NE 2.86Å; D391-R414 IonicContact OD1-NH2 3.12Å; D391-R414 PolarHBondContact OD1-NH2 3.11Å; D391-R414 IonicContact OD2-CZ 2.67Å; D391-R414 IonicContact OD2-NE 2.77Å; D391-R414 PolarHBondContact OD2-NE 2.84Å; D391-R414 IonicContact OD2-NH2 3.67Å; D391-R414 PolarHBondContact OD2-NH2 2.81Å; D391-V473 HydrophobicContact CB-CB 4.43Å; D391-V473 HydrophobicContact CB-CG1 4.46Å; D391-V473 HydrophobicContact CB-CG2 3.78Å
392	Q	92.7	Very high	96	Very high	50 Å²	50	16.3 Å²	16.3	23%	0.234	10%	0.1	C	C	.	.	S	Bend	trans	63.4	33	178.5	-63	-69.4	-63.5	0	0	113.6	D389 Y453 H513	D389-Q392 VanDerWaalsContact CG-CA 3.48Å; D389-Q392 PolarHBondContact O-NE2 3.12Å; D389-Q392 WeakPolarHBondContact OD1-CA 3.16Å; D389-Q392 PolarHBondContact OD1-N 3.2Å; D389-Q392 WeakPolarHBondContact OD2-CA 3.34Å; Q392-Y453 HydrophobicContact CB-CD1 4.23Å; Q392-Y453 HydrophobicContact CB-CE1 3.82Å; Q392-Y453 HydrophobicContact CG-CD1 3.51Å; Q392-Y453 HydrophobicContact CG-CE1 3.55Å; Q392-Y453 HydrophobicContact CG-CG 4.15Å; Q392-H513 HydrophobicContact CB-CB 3.72Å; Q392-H513 HydrophobicContact CG-CB 4.23Å
393	D	90.1	Very high	96	Very high	45 Å²	45	15.3 Å²	15.3	24%	0.241	10%	0.095	C	C	.	.	S	Bend	trans	-85.3	-13.5	173.8	81.3	-3.2	0	0	0	112.7	K329 D389 D391 Y395 R414	K329-D393 PolarHBondContact NZ-O 3.03Å; D389-D393 PolarHBondContact OD1-N 2.63Å; D389-D393 VanDerWaalsContact OD1-N 3.15Å; D391-D393 VanDerWaalsContact C-N 3.33Å; D393-Y395 WeakPolarHBondContact OD1-CD2 3.38Å; D393-Y395 PolarHBondContact OD1-N 3.32Å; D393-R414 IonicContact OD2-CZ 3.71Å; D393-R414 IonicContact OD2-NH2 3.95Å; D393-R414 PolarHBondContact OD2-NH2 3.11Å
394	G	91.5	Very high	95.9	Very high	27 Å²	27	17.9 Å²	17.9	28%	0.278	11%	0.105	S	C	.	.	S	Bend	trans	90.9	17	175.3	0	0	0	0	0	115	K329 D389	K329-G394 WeakPolarHBondContact CD-O 3.37Å; K329-G394 WeakPolarHBondContact CE-O 3.49Å; K329-G394 WeakPolarHBondContact CG-O 3.49Å; K329-G394 PolarHBondContact NZ-O 2.74Å; D389-G394 WeakPolarHBondContact OD2-CA 3.29Å; D389-G394 PolarHBondContact OD2-N 2.77Å
395	Y	94.8	Very high	95.8	Very high	56 Å²	56	18.5 Å²	18.5	22%	0.22	11%	0.108	C	C	.	.	S	Bend	trans	-102.6	156.1	162.3	-57.8	-80.2	0	0	0	110.2	L327 N328 K329 D389 D393	L327-Y395 WeakPolarHBondContact O-CD1 3.38Å; N328-Y395 WeakPolarHBondContact O-CE1 3.41Å; K329-Y395 HydrophobicContact CB-CD1 3.59Å; K329-Y395 HydrophobicContact CB-CE1 3.53Å; K329-Y395 HydrophobicContact CD-CD1 4.42Å; K329-Y395 HydrophobicContact CD-CE1 4.13Å; D389-Y395 WeakPolarHBondContact CA-O 3.31Å; D389-Y395 WeakPolarHBondContact CB-O 3.49Å; D393-Y395 WeakPolarHBondContact OD1-CD2 3.38Å; D393-Y395 PolarHBondContact OD1-N 3.32Å
396	G	95.3	Very high	95.7	Very high	9 Å²	9	21 Å²	21	9%	0.093	14%	0.136	C	C	.	.			trans	-83.6	140.5	174.7	0	0	0	0	0	112.2	D326 L327 G415	D326-G396 WeakPolarHBondContact O-CA 3.36Å; D326-G396 PolarHBondContact O-N 3.42Å; L327-G396 VanDerWaalsContact CD2-O 3.23Å; L327-G396 WeakPolarHBondContact CD2-O 3.48Å; G396-G415 WeakPolarHBondContact O-CA 3.38Å; G396-G415 PolarHBondContact O-N 2.86Å
397	D	97.2	Very high	95.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	159.9	177.4	-56.6	-36.9	0	0	0	112.3	I387 G388 L390 R414 G415	I387-D397 HydrophobicContact CD1-CB 4.11Å; I387-D397 HydrophobicContact CG1-CB 3.85Å; I387-D397 PolarHBondContact N-O 2.75Å; G388-D397 WeakPolarHBondContact O-CA 3.23Å; G388-D397 WeakPolarHBondContact O-CB 3.49Å; G388-D397 PolarHBondContact O-N 3.36Å; L390-D397 WeakPolarHBondContact CB-OD2 3.43Å; L390-D397 PolarHBondContact N-OD2 2.71Å; D397-R414 WeakPolarHBondContact OD1-CA 3.46Å; D397-G415 PolarHBondContact OD1-N 3.24Å
398	I	98.3	Very high	95.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.8	175.2	66.2	169.6	0	0	0	112.7	T325 L327 I336 L372 S385 V400 Y413 I420	T325-I398 HydrophobicContact CG2-CG2 3.81Å; L327-I398 HydrophobicContact CD2-CG2 4.08Å; I336-I398 HydrophobicContact CD1-CG2 4.35Å; I336-I398 HydrophobicContact CG1-CD1 4.42Å; I336-I398 HydrophobicContact CG1-CG2 4.44Å; I336-I398 HydrophobicContact CG2-CD1 4.03Å; L372-I398 HydrophobicContact CD1-CD1 4.48Å; S385-I398 WeakPolarHBondContact O-CA 3.3Å; I398-V400 HydrophobicContact CD1-CG2 4.28Å; I398-Y413 PolarHBondContact N-O 2.92Å; I398-Y413 PolarHBondContact O-N 3.2Å; I398-I420 HydrophobicContact CD1-CD1 3.52Å; I398-I420 HydrophobicContact CG1-CD1 3.86Å
399	A	98.6	Very high	95.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.3	169.2	0	0	0	0	0	109.6	V384 S385 I387 V410 F411 I412 I442	V384-A399 WeakPolarHBondContact CA-O 3.49Å; S385-A399 PolarHBondContact N-O 2.73Å; S385-A399 PolarHBondContact O-N 2.83Å; I387-A399 HydrophobicContact CD1-CB 3.84Å; I387-A399 HydrophobicContact CG2-CB 3.61Å; A399-V410 HydrophobicContact CB-CG1 4.02Å; A399-F411 WeakPolarHBondContact CA-O 3.46Å; A399-I412 HydrophobicContact CB-CD1 3.82Å; A399-I442 HydrophobicContact CB-CD1 3.94Å; A399-I442 HydrophobicContact CB-CG2 3.95Å
400	V	98.8	Very high	96	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.8	176	-176	0	0	0	0	109.8	V353 F380 V384 I398 V410 F411 Y413	V353-V400 HydrophobicContact CG2-CG1 3.6Å; V353-V400 HydrophobicContact CG2-CG2 4.09Å; F380-V400 HydrophobicContact CD1-CG1 4.09Å; F380-V400 HydrophobicContact CD2-CG1 3.78Å; F380-V400 HydrophobicContact CE1-CG1 3.85Å; F380-V400 HydrophobicContact CE2-CB 3.89Å; F380-V400 HydrophobicContact CE2-CG1 3.51Å; F380-V400 HydrophobicContact CG-CG1 4.06Å; F380-V400 HydrophobicContact CZ-CB 3.94Å; F380-V400 HydrophobicContact CZ-CG1 3.55Å; F380-V400 HydrophobicContact CZ-CG2 4.23Å; V384-V400 HydrophobicContact CG2-CG1 4.46Å; V384-V400 HydrophobicContact CG2-CG2 4.42Å; I398-V400 HydrophobicContact CD1-CG2 4.28Å; V400-V410 WeakPolarHBondContact O-CA 3.39Å; V400-F411 PolarHBondContact N-O 2.89Å; V400-F411 PolarHBondContact O-N 2.78Å; V400-Y413 HydrophobicContact CB-CE2 4.3Å; V400-Y413 HydrophobicContact CG2-CD2 4.06Å; V400-Y413 HydrophobicContact CG2-CE2 4.05Å
401	G	98.4	Very high	96.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	140.7	175.7	0	0	0	0	0	113.1	G381 M382 T383 G439	G381-G401 PolarHBondContact N-O 3.38Å; G381-G401 VanDerWaalsContact N-O 3.14Å; M382-G401 PolarHBondContact N-O 2.75Å; T383-G401 PolarHBondContact O-N 2.77Å; G401-G439 WeakPolarHBondContact CA-O 3.45Å
402	A	98.2	Very high	96.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	73.3	174.9	0	0	0	0	0	109.4	S378 F380 F404 D405 G408 K409 F411	S378-A402 CarbonylContact O-C 3.35Å; F380-A402 HydrophobicContact CB-CB 4.14Å; F380-A402 HydrophobicContact CD2-CB 4.17Å; A402-F404 PolarHBondContact O-N 3.04Å; A402-D405 HydrophobicContact CB-CB 4.28Å; A402-D405 PolarHBondContact O-N 2.78Å; A402-D405 VanDerWaalsContact O-N 3.14Å; A402-G408 WeakPolarHBondContact O-CA 3.22Å; A402-K409 PolarHBondContact N-O 3.38Å; A402-K409 PolarHBondContact O-N 3.32Å; A402-F411 HydrophobicContact CB-CD2 4.34Å; A402-F411 HydrophobicContact CB-CE2 3.81Å
403	P	97.6	Very high	96.7	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	8.5	-167.8	27.7	-34	0	0	0	115.8	M382 R437 F438 Y440	M382-P403 HydrophobicContact CB-CG 4.02Å; M382-P403 HydrophobicContact CG-CG 3.97Å; P403-R437 WeakPolarHBondContact O-CA 3.21Å; P403-F438 VanDerWaalsContact CA-O 3.27Å; P403-F438 WeakPolarHBondContact CA-O 3.45Å; P403-Y440 HydrophobicContact CB-CD2 4.49Å; P403-Y440 HydrophobicContact CG-CD2 4.16Å
404	F	96.8	Very high	96.9	Very high	74 Å²	74	18.9 Å²	18.9	33%	0.325	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	5.5	175.2	-55.4	-96.6	0	0	0	112.8	D377 S378 M379 A402 G406	D377-F404 WeakPolarHBondContact O-CB 3.22Å; S378-F404 PolarHBondContact O-N 3.24Å; M379-F404 HydrophobicContact CB-CD2 3.86Å; M379-F404 HydrophobicContact CB-CE2 4.39Å; M379-F404 HydrophobicContact CG-CD2 3.68Å; M379-F404 HydrophobicContact CG-CE2 4.18Å; M379-F404 HydrophobicContact CG-CG 4.28Å; M379-F404 HydrophobicContact SD-CD2 3.56Å; M379-F404 VanDerWaalsContact SD-CD2 3.56Å; M379-F404 HydrophobicContact SD-CE2 3.44Å; M379-F404 WeakPolarHBondContact SD-CE2 3.26Å; M379-F404 HydrophobicContact SD-CG 4.26Å; M379-F404 HydrophobicContact SD-CZ 4.05Å; A402-F404 PolarHBondContact O-N 3.04Å; F404-G406 PolarHBondContact O-N 2.72Å; F404-G406 VanDerWaalsContact O-N 3.15Å
405	D	96.3	Very high	97.1	Very high	23 Å²	23	17.6 Å²	17.6	12%	0.123	10%	0.1	C	C	.	.	S	Bend	trans	-76.6	92.2	167.8	-167.3	-23.1	0	0	0	110.1	T375 A402 D407 G408 K409	T375-D405 PolarHBondContact OG1-OD2 2.96Å; A402-D405 HydrophobicContact CB-CB 4.28Å; A402-D405 PolarHBondContact O-N 2.78Å; A402-D405 VanDerWaalsContact O-N 3.14Å; D405-D407 PolarHBondContact O-N 2.98Å; D405-G408 WeakPolarHBondContact O-CA 3.48Å; D405-G408 PolarHBondContact O-N 3.44Å; D405-K409 HydrophobicContact CB-CB 4.39Å; D405-K409 HydrophobicContact CB-CD 4.04Å; D405-K409 HydrophobicContact CB-CG 4.18Å; D405-K409 IonicContact OD1-NZ 2.74Å; D405-K409 PolarHBondContact OD1-NZ 3.06Å; D405-K409 WeakPolarHBondContact OD2-CD 3.48Å; D405-K409 IonicContact OD2-NZ 3.78Å; D405-K409 PolarHBondContact OD2-NZ 3.37Å
406	G	94.8	Very high	97.1	Very high	67 Å²	67	15.7 Å²	15.7	69%	0.691	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	-123.3	-174.7	0	0	0	0	0	111.4	F404 G408	F404-G406 PolarHBondContact O-N 2.72Å; F404-G406 VanDerWaalsContact O-N 3.15Å; G406-G408 PolarHBondContact O-N 2.84Å
407	D	96	Very high	97	Very high	55 Å²	55	21.6 Å²	21.6	29%	0.294	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.6	171.6	-71.1	-34.1	0	0	0	112.4	D405 H431 T436 R437 F438	D405-D407 PolarHBondContact O-N 2.98Å; D407-H431 HydrophobicContact CB-CB 4.35Å; D407-H431 IonicContact OD2-CG 2.71Å; D407-H431 IonicContact OD2-ND1 2.75Å; D407-H431 PolarHBondContact OD2-ND1 3.49Å; D407-T436 CarbonylContact O-C 3.53Å; D407-T436 VanDerWaalsContact O-CA 3.24Å; D407-T436 WeakPolarHBondContact O-CA 3.43Å; D407-R437 PolarHBondContact O-N 3.37Å; D407-F438 PolarHBondContact O-N 2.95Å; D407-F438 VanDerWaalsContact O-N 3.09Å
408	G	97.4	Very high	96.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.154	C	C	.	.			trans	103.5	141	178	0	0	0	0	0	111.3	A402 D405 G406 G430 F438	A402-G408 WeakPolarHBondContact O-CA 3.22Å; D405-G408 WeakPolarHBondContact O-CA 3.48Å; D405-G408 PolarHBondContact O-N 3.44Å; G406-G408 PolarHBondContact O-N 2.84Å; G408-G430 WeakPolarHBondContact O-CA 3.24Å; G408-G430 PolarHBondContact O-N 2.87Å; G408-F438 CarbonylContact C-O 3.52Å; G408-F438 WeakPolarHBondContact CA-O 3.41Å
409	K	97.9	Very high	96.5	Very high	40 Å²	40	25.1 Å²	25.1	17%	0.174	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.4	-173.5	-67	179.3	-175.1	146.1	0	112.7	A402 D405 F411 V427 L428 D429 F438	A402-K409 PolarHBondContact N-O 3.38Å; A402-K409 PolarHBondContact O-N 3.32Å; D405-K409 HydrophobicContact CB-CB 4.39Å; D405-K409 HydrophobicContact CB-CD 4.04Å; D405-K409 HydrophobicContact CB-CG 4.18Å; D405-K409 IonicContact OD1-NZ 2.74Å; D405-K409 PolarHBondContact OD1-NZ 3.06Å; D405-K409 WeakPolarHBondContact OD2-CD 3.48Å; D405-K409 IonicContact OD2-NZ 3.78Å; D405-K409 PolarHBondContact OD2-NZ 3.37Å; K409-F411 HydrophobicContact CB-CD2 4.38Å; K409-F411 HydrophobicContact CB-CE2 3.75Å; K409-F411 HydrophobicContact CB-CZ 4.18Å; K409-F411 HydrophobicContact CD-CZ 4.15Å; K409-V427 HydrophobicContact CB-CG1 4.23Å; K409-V427 HydrophobicContact CD-CG1 4.07Å; K409-V427 HydrophobicContact CG-CG1 4.39Å; K409-L428 WeakPolarHBondContact CA-O 3.31Å; K409-D429 WeakPolarHBondContact CE-OD2 3.48Å; K409-D429 HydrophobicContact CG-CB 4.49Å; K409-D429 IonicContact NZ-OD2 3.42Å; K409-F438 PolarHBondContact N-O 3.27Å
410	V	98.4	Very high	96.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.5	165.4	175.9	0	0	0	0	109.5	A399 V400 I412 V427 L428 F438 G439 I442 V458	A399-V410 HydrophobicContact CB-CG1 4.02Å; V400-V410 WeakPolarHBondContact O-CA 3.39Å; V410-I412 HydrophobicContact CG1-CD1 3.95Å; V410-V427 WeakPolarHBondContact O-CA 3.42Å; V410-L428 HydrophobicContact CB-CB 4.27Å; V410-L428 HydrophobicContact CB-CD1 4.41Å; V410-L428 PolarHBondContact N-O 3.47Å; V410-L428 PolarHBondContact O-N 2.89Å; V410-F438 HydrophobicContact CB-CE1 4.15Å; V410-F438 HydrophobicContact CG2-CD1 4.17Å; V410-F438 HydrophobicContact CG2-CE1 3.77Å; V410-F438 HydrophobicContact CG2-CZ 4.41Å; V410-G439 VanDerWaalsContact CG2-CA 3.46Å; V410-I442 HydrophobicContact CB-CD1 4.39Å; V410-I442 HydrophobicContact CG1-CD1 3.68Å; V410-I442 HydrophobicContact CG2-CD1 3.78Å; V410-I442 HydrophobicContact CG2-CG1 4.29Å; V410-V458 HydrophobicContact CG2-CG1 3.72Å; V410-V458 HydrophobicContact CG2-CG2 4.07Å
411	F	98.3	Very high	96.2	Very high	25 Å²	25	28.8 Å²	28.8	11%	0.11	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.7	178.7	-62.6	-97.5	0	0	0	109	F380 A399 V400 A402 K409 Y413 P424 V427	F380-F411 AromaticContact CD2-CD2 3.8Å; F380-F411 HydrophobicContact CD2-CD2 3.8Å; F380-F411 AromaticContact CD2-CE2 3.97Å; F380-F411 HydrophobicContact CD2-CE2 3.97Å; F380-F411 HydrophobicContact CD2-CG 4.49Å; F380-F411 HydrophobicContact CE2-CB 4.16Å; F380-F411 AromaticContact CE2-CD2 3.66Å; F380-F411 HydrophobicContact CE2-CD2 3.66Å; F380-F411 HydrophobicContact CE2-CE2 4.21Å; F380-F411 AromaticContact CE2-CG 3.92Å; F380-F411 HydrophobicContact CE2-CG 3.92Å; A399-F411 WeakPolarHBondContact CA-O 3.46Å; V400-F411 PolarHBondContact N-O 2.89Å; V400-F411 PolarHBondContact O-N 2.78Å; A402-F411 HydrophobicContact CB-CD2 4.34Å; A402-F411 HydrophobicContact CB-CE2 3.81Å; K409-F411 HydrophobicContact CB-CD2 4.38Å; K409-F411 HydrophobicContact CB-CE2 3.75Å; K409-F411 HydrophobicContact CB-CZ 4.18Å; K409-F411 HydrophobicContact CD-CZ 4.15Å; F411-Y413 HydrophobicContact CB-CD2 4.2Å; F411-Y413 HydrophobicContact CB-CE2 3.46Å; F411-Y413 VanDerWaalsContact CB-CE2 3.46Å; F411-Y413 HydrophobicContact CG-CE2 4.45Å; F411-P424 HydrophobicContact CB-CB 4.35Å; F411-P424 HydrophobicContact CD1-CB 4.21Å; F411-P424 HydrophobicContact CD1-CG 4.12Å; F411-V427 HydrophobicContact CD1-CB 4.45Å; F411-V427 HydrophobicContact CD1-CG1 4.05Å; F411-V427 HydrophobicContact CD1-CG2 3.62Å; F411-V427 HydrophobicContact CE1-CG1 3.92Å; F411-V427 HydrophobicContact CE1-CG2 3.86Å; F411-V427 HydrophobicContact CZ-CG1 4.29Å
412	I	97.9	Very high	96	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.8	176.3	-50.4	-60.5	0	0	0	108.8	F39 L41 I387 L390 A399 V410 P424 A425 Q426	F39-I412 HydrophobicContact CE1-CB 4.08Å; F39-I412 HydrophobicContact CE1-CG1 4.18Å; F39-I412 HydrophobicContact CE1-CG2 3.76Å; F39-I412 HydrophobicContact CE2-CG2 4.33Å; F39-I412 HydrophobicContact CZ-CB 4.37Å; F39-I412 HydrophobicContact CZ-CG2 3.55Å; L41-I412 HydrophobicContact CD1-CD1 3.9Å; L41-I412 HydrophobicContact CD1-CG1 3.89Å; I387-I412 HydrophobicContact CD1-CD1 3.99Å; I387-I412 HydrophobicContact CD1-CG2 3.91Å; L390-I412 HydrophobicContact CD1-CG2 4.18Å; A399-I412 HydrophobicContact CB-CD1 3.82Å; V410-I412 HydrophobicContact CG1-CD1 3.95Å; I412-P424 CarbonylContact O-C 3.55Å; I412-P424 WeakPolarHBondContact O-CA 3.4Å; I412-P424 WeakPolarHBondContact O-CB 3.2Å; I412-A425 PolarHBondContact O-N 3.47Å; I412-Q426 PolarHBondContact N-O 3.44Å
413	Y	97.4	Very high	95.8	Very high	11 Å²	11	40.9 Å²	40.9	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.5	177.9	-64.4	-88.5	0	0	0	109.7	L372 F380 I398 V400 F411 E421 P424	L372-Y413 HydrophobicContact CD1-CD1 4.08Å; L372-Y413 HydrophobicContact CD1-CD2 3.97Å; L372-Y413 HydrophobicContact CD1-CE1 4.05Å; L372-Y413 HydrophobicContact CD1-CE2 3.93Å; L372-Y413 HydrophobicContact CD1-CG 4.03Å; L372-Y413 HydrophobicContact CD2-CD1 4.45Å; L372-Y413 HydrophobicContact CD2-CE1 4.16Å; F380-Y413 HydrophobicContact CE2-CE2 4.13Å; F380-Y413 AromaticContact CZ-CE2 3.85Å; F380-Y413 HydrophobicContact CZ-CE2 3.85Å; F380-Y413 WeakPolarHBondContact CZ-OH 3.38Å; I398-Y413 PolarHBondContact N-O 2.92Å; I398-Y413 PolarHBondContact O-N 3.2Å; V400-Y413 HydrophobicContact CB-CE2 4.3Å; V400-Y413 HydrophobicContact CG2-CD2 4.06Å; V400-Y413 HydrophobicContact CG2-CE2 4.05Å; F411-Y413 HydrophobicContact CB-CD2 4.2Å; F411-Y413 HydrophobicContact CB-CE2 3.46Å; F411-Y413 VanDerWaalsContact CB-CE2 3.46Å; F411-Y413 HydrophobicContact CG-CE2 4.45Å; Y413-E421 WeakPolarHBondContact CD1-O 3.08Å; Y413-P424 HydrophobicContact CD1-CB 4.31Å; Y413-P424 HydrophobicContact CE1-CB 4Å; Y413-P424 HydrophobicContact CE1-CG 4.44Å
414	R	95.1	Very high	95.7	Very high	8 Å²	8	43.2 Å²	43.2	3%	0.03	25%	0.247	C	C	.	.			trans	-91.6	145.6	-177.4	-73.6	173.1	70.7	-104	0.6	112.6	D391 D393 D397 E421 A425	D391-R414 IonicContact OD1-CZ 3.23Å; D391-R414 IonicContact OD1-NE 3.83Å; D391-R414 PolarHBondContact OD1-NE 2.86Å; D391-R414 IonicContact OD1-NH2 3.12Å; D391-R414 PolarHBondContact OD1-NH2 3.11Å; D391-R414 IonicContact OD2-CZ 2.67Å; D391-R414 IonicContact OD2-NE 2.77Å; D391-R414 PolarHBondContact OD2-NE 2.84Å; D391-R414 IonicContact OD2-NH2 3.67Å; D391-R414 PolarHBondContact OD2-NH2 2.81Å; D393-R414 IonicContact OD2-CZ 3.71Å; D393-R414 IonicContact OD2-NH2 3.95Å; D393-R414 PolarHBondContact OD2-NH2 3.11Å; D397-R414 WeakPolarHBondContact OD1-CA 3.46Å; R414-E421 IonicContact NH1-OE1 3.06Å; R414-E421 PolarHBondContact NH1-OE1 3Å; R414-E421 IonicContact NH1-OE2 2.84Å; R414-E421 PolarHBondContact O-N 3.16Å; R414-A425 HydrophobicContact CG-CB 3.82Å
415	G	95.4	Very high	95.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	166	164.7	0	0	0	0	0	112.2	L327 G396 D397 G419	L327-G415 WeakPolarHBondContact O-CA 3.47Å; G396-G415 WeakPolarHBondContact O-CA 3.38Å; G396-G415 PolarHBondContact O-N 2.86Å; D397-G415 PolarHBondContact OD1-N 3.24Å; G415-G419 CarbonylContact C-O 3.55Å; G415-G419 WeakPolarHBondContact CA-O 3.49Å
416	S	94.8	Very high	95.5	Very high	16 Å²	16	39.8 Å²	39.8	11%	0.112	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	165.1	-178.6	59.8	0	0	0	0	110.9	L327 N328 A418 G419	L327-S416 PolarHBondContact O-N 3.04Å; N328-S416 VanDerWaalsContact CA-O 3.31Å; N328-S416 WeakPolarHBondContact CA-O 3.45Å; S416-A418 PolarHBondContact O-N 2.72Å; S416-G419 PolarHBondContact N-O 3.39Å; S416-G419 PolarHBondContact O-N 3.28Å; S416-G419 PolarHBondContact OG-N 3.09Å; S416-G419 PolarHBondContact OG-O 2.88Å; S416-G419 VanDerWaalsContact OG-O 3.14Å
417	D	92.9	Very high	95.6	Very high	133 Å²	133	39 Å²	39	71%	0.711	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.7	172.9	65.3	-30.8	0	0	0	113.9
418	A	91.8	Very high	95.7	Very high	75 Å²	75	36.4 Å²	36.4	62%	0.62	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	3.9	174.4	0	0	0	0	0	114.6	S416	S416-A418 PolarHBondContact O-N 2.72Å
419	G	93.4	Very high	95.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.5	-102.2	-170.3	0	0	0	0	0	111.5	L327 G415 S416	L327-G419 VanDerWaalsContact O-O 3.09Å; G415-G419 CarbonylContact C-O 3.55Å; G415-G419 WeakPolarHBondContact CA-O 3.49Å; S416-G419 PolarHBondContact N-O 3.39Å; S416-G419 PolarHBondContact O-N 3.28Å; S416-G419 PolarHBondContact OG-N 3.09Å; S416-G419 PolarHBondContact OG-O 2.88Å; S416-G419 VanDerWaalsContact OG-O 3.14Å
420	I	95.6	Very high	95.5	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.051	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.3	-175.7	-166.6	167.3	0	0	0	112.3	L327 V355 I370 L372 I398 T422	L327-I420 HydrophobicContact CD1-CB 4.36Å; L327-I420 HydrophobicContact CD1-CD1 4.49Å; V355-I420 HydrophobicContact CB-CG2 4.37Å; V355-I420 HydrophobicContact CG1-CG2 4.18Å; V355-I420 HydrophobicContact CG2-CD1 4.03Å; V355-I420 HydrophobicContact CG2-CG2 4.28Å; I370-I420 HydrophobicContact CB-CG2 4.46Å; I370-I420 HydrophobicContact CD1-CG2 4.03Å; I370-I420 HydrophobicContact CG2-CG2 4.09Å; L372-I420 HydrophobicContact CD1-CD1 4.15Å; I398-I420 HydrophobicContact CD1-CD1 3.52Å; I398-I420 HydrophobicContact CG1-CD1 3.86Å; I420-T422 PolarHBondContact O-N 2.83Å; I420-T422 VanDerWaalsContact O-N 3.16Å
421	E	94.9	Very high	95.4	Very high	66 Å²	66	42 Å²	42	31%	0.308	23%	0.23	S	C	.	.			trans	-66.9	112.1	169	-69.1	-170.9	-176.6	0	0	109	Y413 R414 K423	Y413-E421 WeakPolarHBondContact CD1-O 3.08Å; R414-E421 IonicContact NH1-OE1 3.06Å; R414-E421 PolarHBondContact NH1-OE1 3Å; R414-E421 IonicContact NH1-OE2 2.84Å; R414-E421 PolarHBondContact O-N 3.16Å; E421-K423 PolarHBondContact O-N 2.64Å; E421-K423 VanDerWaalsContact O-N 3.12Å
422	T	95.4	Very high	95.1	Very high	89 Å²	89	45.7 Å²	45.7	55%	0.546	25%	0.251	S	S	.	.	S	Bend	trans	-72	-4.7	-175.6	54.9	0	0	0	0	114.5	I370 L372 I420	I370-T422 HydrophobicContact CG2-CG2 3.65Å; L372-T422 HydrophobicContact CD2-CG2 4.2Å; I420-T422 PolarHBondContact O-N 2.83Å; I420-T422 VanDerWaalsContact O-N 3.16Å
423	K	94.6	Very high	94.9	Very high	166 Å²	166	46.2 Å²	46.2	72%	0.722	25%	0.253	S	S	*	.	S	Bend	trans	-102.4	133.9	170.4	-67.8	-179.7	179.6	177.2	0	108.5	E421 A425	E421-K423 PolarHBondContact O-N 2.64Å; E421-K423 VanDerWaalsContact O-N 3.12Å; K423-A425 PolarHBondContact O-N 3.43Å
424	P	95.1	Very high	94.6	Very high	50 Å²	50	53.2 Å²	53.2	33%	0.325	29%	0.291	S	S	.	.			trans	-65.5	134.9	177.2	28.9	-35	0	0	0	110.3	F411 I412 Y413 Q426 V427	F411-P424 HydrophobicContact CB-CB 4.35Å; F411-P424 HydrophobicContact CD1-CB 4.21Å; F411-P424 HydrophobicContact CD1-CG 4.12Å; I412-P424 CarbonylContact O-C 3.55Å; I412-P424 WeakPolarHBondContact O-CA 3.4Å; I412-P424 WeakPolarHBondContact O-CB 3.2Å; Y413-P424 HydrophobicContact CD1-CB 4.31Å; Y413-P424 HydrophobicContact CE1-CB 4Å; Y413-P424 HydrophobicContact CE1-CG 4.44Å; P424-Q426 VanDerWaalsContact C-N 3.32Å; P424-V427 HydrophobicContact CB-CG2 4.13Å; P424-V427 HydrophobicContact CG-CG2 3.93Å
425	A	93.4	Very high	94.6	Very high	17 Å²	17	53 Å²	53	14%	0.14	29%	0.291	C	S	.	.	S	Bend	trans	-71.6	-30.2	176	0	0	0	0	0	111.8	F39 I412 R414 K423	F39-A425 HydrophobicContact CB-CB 4.1Å; F39-A425 HydrophobicContact CD1-CB 4.32Å; F39-A425 HydrophobicContact CD2-CB 4.33Å; F39-A425 HydrophobicContact CG-CB 3.99Å; I412-A425 PolarHBondContact O-N 3.47Å; R414-A425 HydrophobicContact CG-CB 3.82Å; K423-A425 PolarHBondContact O-N 3.43Å
426	Q	95.1	Very high	94.6	Very high	7 Å²	7	55.4 Å²	55.4	3%	0.033	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152	170.1	172.7	170.5	-11.3	0	0	110	F39 L41 T43 I412 P424 L428	F39-Q426 HydrophobicContact CD1-CB 3.4Å; F39-Q426 VanDerWaalsContact CD1-CB 3.4Å; F39-Q426 HydrophobicContact CD1-CG 4.28Å; F39-Q426 HydrophobicContact CE1-CB 3.88Å; F39-Q426 HydrophobicContact CG-CB 4.48Å; L41-Q426 PolarHBondContact O-NE2 3.4Å; T43-Q426 VanDerWaalsContact CG2-NE2 3.35Å; I412-Q426 PolarHBondContact N-O 3.44Å; P424-Q426 VanDerWaalsContact C-N 3.32Å; Q426-L428 HydrophobicContact CG-CD2 4.07Å; Q426-L428 VanDerWaalsContact NE2-CD2 3.27Å
427	V	97.2	Very high	94.6	Very high	50 Å²	50	60.3 Å²	60.3	30%	0.303	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.6	170.5	-173.9	0	0	0	0	107	K409 V410 F411 P424	K409-V427 HydrophobicContact CB-CG1 4.23Å; K409-V427 HydrophobicContact CD-CG1 4.07Å; K409-V427 HydrophobicContact CG-CG1 4.39Å; V410-V427 WeakPolarHBondContact O-CA 3.42Å; F411-V427 HydrophobicContact CD1-CB 4.45Å; F411-V427 HydrophobicContact CD1-CG1 4.05Å; F411-V427 HydrophobicContact CD1-CG2 3.62Å; F411-V427 HydrophobicContact CE1-CG1 3.92Å; F411-V427 HydrophobicContact CE1-CG2 3.86Å; F411-V427 HydrophobicContact CZ-CG1 4.29Å; P424-V427 HydrophobicContact CB-CG2 4.13Å; P424-V427 HydrophobicContact CG-CG2 3.93Å
428	L	97	Very high	94.9	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.9	172.9	-54.5	176.4	0	0	0	107	L41 T43 K409 V410 Q426 F433 F438 F468	L41-L428 HydrophobicContact CD1-CD1 4.32Å; T43-L428 HydrophobicContact CG2-CD2 3.88Å; K409-L428 WeakPolarHBondContact CA-O 3.31Å; V410-L428 HydrophobicContact CB-CB 4.27Å; V410-L428 HydrophobicContact CB-CD1 4.41Å; V410-L428 PolarHBondContact N-O 3.47Å; V410-L428 PolarHBondContact O-N 2.89Å; Q426-L428 HydrophobicContact CG-CD2 4.07Å; Q426-L428 VanDerWaalsContact NE2-CD2 3.27Å; L428-F433 HydrophobicContact CB-CE2 4.5Å; L428-F438 HydrophobicContact CB-CE1 3.82Å; L428-F438 HydrophobicContact CB-CZ 4.25Å; L428-F468 HydrophobicContact CD1-CD1 4.06Å; L428-F468 HydrophobicContact CD1-CD2 3.96Å; L428-F468 HydrophobicContact CD1-CE1 4.07Å; L428-F468 HydrophobicContact CD1-CE2 4Å; L428-F468 HydrophobicContact CD1-CG 4.01Å; L428-F468 HydrophobicContact CD1-CZ 4.05Å; L428-F468 HydrophobicContact CD2-CD1 4.01Å; L428-F468 HydrophobicContact CD2-CE1 3.91Å; L428-F468 HydrophobicContact CG-CE1 4.44Å
429	D	96.1	Very high	95.1	Very high	40 Å²	40	50.4 Å²	50.4	21%	0.214	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.8	178.4	-159.8	-40.3	0	0	0	110.2	K409 H431 D432 F433	K409-D429 WeakPolarHBondContact CE-OD2 3.48Å; K409-D429 HydrophobicContact CG-CB 4.49Å; K409-D429 IonicContact NZ-OD2 3.42Å; D429-H431 PolarHBondContact O-N 2.82Å; D429-H431 VanDerWaalsContact O-N 3.16Å; D429-H431 VanDerWaalsContact OD1-CB 3.28Å; D429-H431 WeakPolarHBondContact OD1-CB 3.39Å; D429-H431 PolarHBondContact OD1-N 3.33Å; D429-D432 PolarHBondContact O-N 3.42Å; D429-D432 VanDerWaalsContact O-N 3.15Å; D429-F433 WeakPolarHBondContact O-CD2 3.42Å; D429-F433 VanDerWaalsContact O-CE2 3.24Å; D429-F433 WeakPolarHBondContact O-CE2 3.45Å
430	G	95.4	Very high	95.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58	-25.9	176.2	0	0	0	0	0	113	G408 D432 F433 D434 V435	G408-G430 WeakPolarHBondContact O-CA 3.24Å; G408-G430 PolarHBondContact O-N 2.87Å; G430-D432 PolarHBondContact O-N 2.81Å; G430-F433 CarbonylContact O-C 3.6Å; G430-F433 PolarHBondContact O-N 3.32Å; G430-D434 PolarHBondContact O-N 3.18Å; G430-V435 CarbonylContact C-O 3.56Å; G430-V435 VanDerWaalsContact CA-O 3.28Å; G430-V435 WeakPolarHBondContact CA-O 3.39Å; G430-V435 PolarHBondContact O-N 2.85Å
431	H	95.4	Very high	95.5	Very high	118 Å²	118	52.4 Å²	52.4	55%	0.546	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-60.3	-40.9	175.8	-168.2	69.2	0	0	0	113	D407 D429 F433 D434	D407-H431 HydrophobicContact CB-CB 4.35Å; D407-H431 IonicContact OD2-CG 2.71Å; D407-H431 IonicContact OD2-ND1 2.75Å; D407-H431 PolarHBondContact OD2-ND1 3.49Å; D429-H431 PolarHBondContact O-N 2.82Å; D429-H431 VanDerWaalsContact O-N 3.16Å; D429-H431 VanDerWaalsContact OD1-CB 3.28Å; D429-H431 WeakPolarHBondContact OD1-CB 3.39Å; D429-H431 PolarHBondContact OD1-N 3.33Å; H431-F433 PolarHBondContact O-N 2.88Å; H431-D434 PolarHBondContact O-N 3.09Å
432	D	93.8	Very high	95.7	Very high	103 Å²	103	49.7 Å²	49.7	55%	0.551	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-66.2	-11.7	-180	-67.4	-23.9	0	0	0	112.7	D429 G430	D429-D432 PolarHBondContact O-N 3.42Å; D429-D432 VanDerWaalsContact O-N 3.15Å; G430-D432 PolarHBondContact O-N 2.81Å
433	F	92.1	Very high	95.8	Very high	10 Å²	10	46.5 Å²	46.5	4%	0.044	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-121.1	6.9	-174	-53.5	-56.8	0	0	0	113.4	T43 T46 H48 L428 D429 G430 H431 V435 F468	T43-F433 HydrophobicContact CG2-CZ 3.98Å; T46-F433 HydrophobicContact CG2-CD1 4.44Å; T46-F433 HydrophobicContact CG2-CE1 3.99Å; H48-F433 WeakPolarHBondContact CE1-CA 3.35Å; H48-F433 WeakPolarHBondContact CE1-CB 3.41Å; H48-F433 AromaticContact CE1-CD1 3.83Å; H48-F433 AromaticContact CE1-CG 3.79Å; H48-F433 PolarHBondContact CE1-O 2.97Å; H48-F433 AromaticContact NE2-CD1 3.59Å; L428-F433 HydrophobicContact CB-CE2 4.5Å; D429-F433 WeakPolarHBondContact O-CD2 3.42Å; D429-F433 VanDerWaalsContact O-CE2 3.24Å; D429-F433 WeakPolarHBondContact O-CE2 3.45Å; G430-F433 CarbonylContact O-C 3.6Å; G430-F433 PolarHBondContact O-N 3.32Å; H431-F433 PolarHBondContact O-N 2.88Å; F433-V435 HydrophobicContact CB-CG2 4.3Å; F433-V435 WeakPolarHBondContact O-CG2 3.1Å; F433-V435 PolarHBondContact O-N 3Å; F433-F468 HydrophobicContact CD2-CE1 4.33Å; F433-F468 AromaticContact CD2-CZ 3.94Å; F433-F468 HydrophobicContact CD2-CZ 3.94Å; F433-F468 AromaticContact CE1-CE1 4Å; F433-F468 HydrophobicContact CE1-CE1 4Å; F433-F468 HydrophobicContact CE1-CZ 4.45Å; F433-F468 AromaticContact CE2-CE1 3.66Å; F433-F468 HydrophobicContact CE2-CE1 3.66Å; F433-F468 AromaticContact CE2-CZ 3.67Å; F433-F468 HydrophobicContact CE2-CZ 3.67Å; F433-F468 HydrophobicContact CG-CZ 4.49Å; F433-F468 AromaticContact CZ-CE1 3.5Å; F433-F468 HydrophobicContact CZ-CE1 3.5Å; F433-F468 VanDerWaalsContact CZ-CE1 3.5Å; F433-F468 AromaticContact CZ-CZ 3.97Å; F433-F468 HydrophobicContact CZ-CZ 3.97Å
434	D	92.9	Very high	95.8	Very high	158 Å²	158	39.3 Å²	39.3	85%	0.845	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	28.8	-171.9	-72	-51.2	0	0	0	113.8	G430 H431	G430-D434 PolarHBondContact O-N 3.18Å; H431-D434 PolarHBondContact O-N 3.09Å
435	V	94.2	Very high	95.7	Very high	5 Å²	5	39 Å²	39	3%	0.03	21%	0.214	C	C	.	.			trans	-113.6	112.5	-178.6	-179.7	0	0	0	0	112	G430 F433 F438 S460 S464 V466	G430-V435 CarbonylContact C-O 3.56Å; G430-V435 VanDerWaalsContact CA-O 3.28Å; G430-V435 WeakPolarHBondContact CA-O 3.39Å; G430-V435 PolarHBondContact O-N 2.85Å; F433-V435 HydrophobicContact CB-CG2 4.3Å; F433-V435 WeakPolarHBondContact O-CG2 3.1Å; F433-V435 PolarHBondContact O-N 3Å; V435-F438 HydrophobicContact CB-CB 4.43Å; V435-F438 HydrophobicContact CB-CD2 4.24Å; V435-F438 HydrophobicContact CG1-CB 3.98Å; V435-F438 HydrophobicContact CG1-CD2 3.96Å; V435-F438 HydrophobicContact CG1-CG 4.46Å; V435-S460 VanDerWaalsContact CG1-CB 3.44Å; V435-S464 WeakPolarHBondContact CG1-OG 3.28Å; V435-S464 WeakPolarHBondContact CG2-OG 3.5Å; V435-V466 HydrophobicContact CG2-CG2 3.94Å
436	T	95.6	Very high	95.8	Very high	50 Å²	50	39.1 Å²	39.1	31%	0.307	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	156.4	169.2	70.9	0	0	0	0	111.9	D407 F438 S460 N462	D407-T436 CarbonylContact O-C 3.53Å; D407-T436 VanDerWaalsContact O-CA 3.24Å; D407-T436 WeakPolarHBondContact O-CA 3.43Å; T436-F438 PolarHBondContact O-N 2.84Å; T436-S460 PolarHBondContact O-OG 2.82Å; T436-N462 WeakPolarHBondContact O-CB 3.5Å; T436-N462 WeakPolarHBondContact OG1-CB 3.19Å; T436-N462 VanDerWaalsContact OG1-CG 3.3Å; T436-N462 PolarHBondContact OG1-ND2 3.3Å
437	R	95.6	Very high	95.7	Very high	119 Å²	119	40 Å²	40	45%	0.449	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	32.3	-175.6	-52.6	-174.7	-173.9	-68.8	-2.7	113.7	P403 D407 L461	P403-R437 WeakPolarHBondContact O-CA 3.21Å; D407-R437 PolarHBondContact O-N 3.37Å; R437-L461 HydrophobicContact CB-CB 3.97Å; R437-L461 HydrophobicContact CG-CB 4.5Å
438	F	97.9	Very high	95.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	142	-179.4	-179.8	-103.4	0	0	0	111.6	P403 D407 G408 K409 V410 L428 V435 T436 V458 V466 F468	P403-F438 VanDerWaalsContact CA-O 3.27Å; P403-F438 WeakPolarHBondContact CA-O 3.45Å; D407-F438 PolarHBondContact O-N 2.95Å; D407-F438 VanDerWaalsContact O-N 3.09Å; G408-F438 CarbonylContact C-O 3.52Å; G408-F438 WeakPolarHBondContact CA-O 3.41Å; K409-F438 PolarHBondContact N-O 3.27Å; V410-F438 HydrophobicContact CB-CE1 4.15Å; V410-F438 HydrophobicContact CG2-CD1 4.17Å; V410-F438 HydrophobicContact CG2-CE1 3.77Å; V410-F438 HydrophobicContact CG2-CZ 4.41Å; L428-F438 HydrophobicContact CB-CE1 3.82Å; L428-F438 HydrophobicContact CB-CZ 4.25Å; V435-F438 HydrophobicContact CB-CB 4.43Å; V435-F438 HydrophobicContact CB-CD2 4.24Å; V435-F438 HydrophobicContact CG1-CB 3.98Å; V435-F438 HydrophobicContact CG1-CD2 3.96Å; V435-F438 HydrophobicContact CG1-CG 4.46Å; T436-F438 PolarHBondContact O-N 2.84Å; F438-V458 HydrophobicContact CD1-CG1 4.32Å; F438-V458 HydrophobicContact CD2-CB 4.39Å; F438-V458 HydrophobicContact CD2-CG1 3.78Å; F438-V458 HydrophobicContact CE1-CG1 3.98Å; F438-V458 HydrophobicContact CE2-CB 3.57Å; F438-V458 HydrophobicContact CE2-CG1 3.4Å; F438-V458 VanDerWaalsContact CE2-CG1 3.4Å; F438-V458 HydrophobicContact CE2-CG2 4.32Å; F438-V458 HydrophobicContact CG-CG1 4.23Å; F438-V458 HydrophobicContact CZ-CB 3.64Å; F438-V458 HydrophobicContact CZ-CG1 3.51Å; F438-V458 HydrophobicContact CZ-CG2 3.89Å; F438-V466 HydrophobicContact CE2-CB 4.2Å; F438-V466 HydrophobicContact CE2-CG2 4.21Å; F438-F468 HydrophobicContact CE2-CE2 4.01Å; F438-F468 HydrophobicContact CE2-CZ 4.16Å; F438-F468 AromaticContact CZ-CE2 3.59Å; F438-F468 HydrophobicContact CZ-CE2 3.59Å; F438-F468 AromaticContact CZ-CZ 3.64Å; F438-F468 HydrophobicContact CZ-CZ 3.64Å
439	G	97.4	Very high	95.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	83.2	25.9	-176.5	0	0	0	0	0	114.4	T383 G401 V410 G459	T383-G439 WeakPolarHBondContact CG2-O 3.27Å; G401-G439 WeakPolarHBondContact CA-O 3.45Å; V410-G439 VanDerWaalsContact CG2-CA 3.46Å; G439-G459 PolarHBondContact N-O 3.25Å
440	Y	97.9	Very high	94.8	Very high	39 Å²	39	44.8 Å²	44.8	15%	0.153	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-36.3	173	-172.9	-95.3	0	0	0	112.1	F59 M382 P403 G459 L461	F59-Y440 HydrophobicContact CD1-CE1 4.38Å; F59-Y440 HydrophobicContact CD2-CD1 4.47Å; F59-Y440 AromaticContact CD2-CE1 3.74Å; F59-Y440 HydrophobicContact CD2-CE1 3.74Å; F59-Y440 HydrophobicContact CE1-CE1 4.23Å; F59-Y440 AromaticContact CE2-CE1 3.58Å; F59-Y440 HydrophobicContact CE2-CE1 3.58Å; F59-Y440 AromaticContact CE2-CZ 3.86Å; F59-Y440 WeakPolarHBondContact CE2-OH 3.23Å; F59-Y440 HydrophobicContact CG-CE1 4.13Å; F59-Y440 AromaticContact CZ-CE1 3.84Å; F59-Y440 HydrophobicContact CZ-CE1 3.84Å; M382-Y440 HydrophobicContact CE-CD2 4.49Å; M382-Y440 HydrophobicContact CE-CE2 3.68Å; P403-Y440 HydrophobicContact CB-CD2 4.49Å; P403-Y440 HydrophobicContact CG-CD2 4.16Å; Y440-G459 PolarHBondContact N-O 2.68Å; Y440-G459 VanDerWaalsContact N-O 3.1Å; Y440-L461 HydrophobicContact CD1-CD2 3.7Å; Y440-L461 HydrophobicContact CD1-CG 3.98Å; Y440-L461 HydrophobicContact CD2-CD1 3.53Å; Y440-L461 HydrophobicContact CD2-CD2 4.13Å; Y440-L461 HydrophobicContact CD2-CG 3.68Å; Y440-L461 HydrophobicContact CE1-CD2 3.74Å; Y440-L461 HydrophobicContact CE1-CG 4.35Å; Y440-L461 HydrophobicContact CE2-CD1 3.66Å; Y440-L461 HydrophobicContact CE2-CD2 4.16Å; Y440-L461 HydrophobicContact CE2-CG 4.08Å; Y440-L461 HydrophobicContact CG-CD1 4.04Å; Y440-L461 HydrophobicContact CG-CD2 3.89Å; Y440-L461 HydrophobicContact CG-CG 3.61Å
441	S	98.3	Very high	94.5	Very high	12 Å²	12	45.8 Å²	45.8	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.5	172.4	70.6	0	0	0	0	110.6	G58 F59 G459	G58-S441 PolarHBondContact O-OG 3.06Å; F59-S441 WeakPolarHBondContact O-CB 3.47Å; S441-G459 PolarHBondContact N-O 3.45Å; S441-G459 PolarHBondContact O-N 2.95Å
442	I	98.5	Very high	94.4	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.046	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.8	-178	-55.4	172.6	0	0	0	108.7	T383 I387 A399 V410 V456 V457 V458	T383-I442 HydrophobicContact CG2-CD1 3.72Å; T383-I442 HydrophobicContact CG2-CG1 3.81Å; I387-I442 HydrophobicContact CG2-CG2 4.44Å; A399-I442 HydrophobicContact CB-CD1 3.94Å; A399-I442 HydrophobicContact CB-CG2 3.95Å; V410-I442 HydrophobicContact CB-CD1 4.39Å; V410-I442 HydrophobicContact CG1-CD1 3.68Å; V410-I442 HydrophobicContact CG2-CD1 3.78Å; V410-I442 HydrophobicContact CG2-CG1 4.29Å; I442-V456 HydrophobicContact CG2-CG1 3.91Å; I442-V457 WeakPolarHBondContact CA-O 3.38Å; I442-V458 HydrophobicContact CG1-CG1 4.43Å; I442-V458 HydrophobicContact CG1-CG2 4.49Å
443	S	97.6	Very high	94.4	Very high	22 Å²	22	38.9 Å²	38.9	15%	0.154	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.8	165.5	177.9	0	0	0	0	108.7	L63 V457	L63-S443 PolarHBondContact N-OG 2.77Å; S443-V457 PolarHBondContact N-O 3Å; S443-V457 WeakPolarHBondContact O-CG1 3.41Å; S443-V457 PolarHBondContact O-N 2.8Å
444	G	95.6	Very high	94.5	Very high	15 Å²	15	39 Å²	39	16%	0.155	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	-157.2	171.7	0	0	0	0	0	111.9	L446 D455	G444-L446 VanDerWaalsContact C-N 3.33Å; G444-L446 PolarHBondContact O-N 3.09Å; G444-D455 WeakPolarHBondContact CA-O 3.38Å
445	G	92.5	Very high	94.7	Very high	43 Å²	43	31.5 Å²	31.5	44%	0.443	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.9	10.6	173.9	0	0	0	0	0	115.2	I387	I387-G445 VanDerWaalsContact C-CA 3.49Å; I387-G445 VanDerWaalsContact C-N 3.3Å; I387-G445 WeakPolarHBondContact O-CA 3.4Å; I387-G445 PolarHBondContact O-N 2.67Å
446	L	94.9	Very high	94.9	Very high	20 Å²	20	31.3 Å²	31.3	11%	0.105	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	122.6	177.4	-177.1	60.2	0	0	0	110.5	L63 Q65 I138 G444 I448 D455	L63-L446 HydrophobicContact CB-CB 4.1Å; L63-L446 HydrophobicContact CB-CD2 3.93Å; L63-L446 HydrophobicContact CB-CG 4.46Å; L63-L446 HydrophobicContact CD1-CB 4.21Å; Q65-L446 HydrophobicContact CG-CD2 4.17Å; I138-L446 HydrophobicContact CD1-CD1 3.98Å; I138-L446 HydrophobicContact CG1-CD1 3.56Å; G444-L446 VanDerWaalsContact C-N 3.33Å; G444-L446 PolarHBondContact O-N 3.09Å; L446-I448 HydrophobicContact CD2-CD1 4.38Å; L446-D455 PolarHBondContact O-N 2.79Å
447	D	94.8	Very high	95	Very high	27 Å²	27	28.9 Å²	28.9	14%	0.144	16%	0.157	C	C	.	.			trans	-64.3	127.4	166.7	174.8	-3.1	0	0	0	108.9	Q65 D449 D450 N451 H452 Y453	Q65-D447 PolarHBondContact NE2-O 3.4Å; D447-D449 PolarHBondContact OD1-N 3.14Å; D447-D450 WeakPolarHBondContact OD1-CA 3.39Å; D447-D450 PolarHBondContact OD1-N 3.27Å; D447-D450 WeakPolarHBondContact OD2-CA 3.32Å; D447-N451 PolarHBondContact OD1-N 3.38Å; D447-N451 PolarHBondContact OD2-N 2.78Å; D447-N451 VanDerWaalsContact OD2-N 3.08Å; D447-H452 VanDerWaalsContact OD2-CA 3.3Å; D447-H452 WeakPolarHBondContact OD2-CA 3.3Å; D447-H452 PolarHBondContact OD2-N 3.1Å; D447-Y453 WeakPolarHBondContact CB-O 3.43Å
448	I	92.6	Very high	95.2	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	14%	0.136	C	C	.	.	S	Bend	trans	-110.2	-15.3	-175.9	-139.4	55.6	0	0	0	112.7	L63 Q65 S73 I101 L446 D455 L467 R469	L63-I448 HydrophobicContact CB-CD1 4.27Å; L63-I448 HydrophobicContact CD2-CD1 4.17Å; L63-I448 HydrophobicContact CD2-CG1 4.23Å; Q65-I448 HydrophobicContact CG-CD1 4.4Å; S73-I448 WeakPolarHBondContact CB-O 3.45Å; S73-I448 PolarHBondContact OG-O 3.05Å; I101-I448 HydrophobicContact CD1-CG1 3.64Å; I101-I448 HydrophobicContact CD1-CG2 4.36Å; I101-I448 HydrophobicContact CG1-CG1 3.99Å; I101-I448 HydrophobicContact CG1-CG2 4.47Å; I101-I448 HydrophobicContact CG2-CG2 4.2Å; L446-I448 HydrophobicContact CD2-CD1 4.38Å; I448-D455 WeakPolarHBondContact CA-OD2 3.39Å; I448-D455 HydrophobicContact CB-CB 4.4Å; I448-D455 WeakPolarHBondContact CB-OD2 3.5Å; I448-D455 HydrophobicContact CG2-CB 4.3Å; I448-D455 WeakPolarHBondContact CG2-OD2 3.48Å; I448-D455 PolarHBondContact N-OD2 3.21Å; I448-L467 HydrophobicContact CG2-CD1 4.41Å; I448-L467 HydrophobicContact CG2-CD2 3.93Å; I448-R469 HydrophobicContact CG2-CG 4.48Å
449	D	89.6	Confident	95.2	Very high	50 Å²	50	23.2 Å²	23.2	27%	0.267	14%	0.136	S	C	.	.	S	Bend	trans	-125.4	10.4	-173.7	93.1	-10.5	0	0	0	116.6	D447 N451 R469	D447-D449 PolarHBondContact OD1-N 3.14Å; D449-N451 VanDerWaalsContact OD1-CB 3.29Å; D449-N451 WeakPolarHBondContact OD1-CB 3.42Å; D449-N451 VanDerWaalsContact OD1-CG 3.23Å; D449-N451 PolarHBondContact OD1-ND2 3.49Å; D449-R469 WeakPolarHBondContact OD2-CD 3.34Å; D449-R469 IonicContact OD2-CZ 2.7Å; D449-R469 IonicContact OD2-NE 2.63Å; D449-R469 IonicContact OD2-NH1 3.41Å; D449-R469 PolarHBondContact OD2-NH1 3.03Å
450	D	89.2	Confident	95.1	Very high	136 Å²	136	23.2 Å²	23.2	73%	0.727	14%	0.136	S	C	*	.	S	Bend	trans	68.7	35.3	173.6	-166.9	39.8	0	0	0	113.1	D447	D447-D450 WeakPolarHBondContact OD1-CA 3.39Å; D447-D450 PolarHBondContact OD1-N 3.27Å; D447-D450 WeakPolarHBondContact OD2-CA 3.32Å
451	N	89.1	Confident	94.9	Very high	21 Å²	21	22.9 Å²	22.9	11%	0.112	14%	0.137	C	C	.	.	S	Bend	trans	-98.6	-7.6	179.5	81.5	39.5	0	0	0	114.6	D447 D449 Y453 S470	D447-N451 PolarHBondContact OD1-N 3.38Å; D447-N451 PolarHBondContact OD2-N 2.78Å; D447-N451 VanDerWaalsContact OD2-N 3.08Å; D449-N451 VanDerWaalsContact OD1-CB 3.29Å; D449-N451 WeakPolarHBondContact OD1-CB 3.42Å; D449-N451 VanDerWaalsContact OD1-CG 3.23Å; D449-N451 PolarHBondContact OD1-ND2 3.49Å; N451-Y453 WeakPolarHBondContact O-CD2 3.31Å; N451-Y453 WeakPolarHBondContact OD1-CA 3.43Å; N451-Y453 VanDerWaalsContact OD1-CB 3.26Å; N451-Y453 WeakPolarHBondContact OD1-CB 3.48Å; N451-Y453 WeakPolarHBondContact OD1-CD2 3.29Å; N451-Y453 PolarHBondContact OD1-N 3.27Å; N451-Y453 PolarHBondContact OD1-O 3.39Å; N451-S470 PolarHBondContact ND2-O 3.16Å; N451-S470 VanDerWaalsContact ND2-O 3.1Å
452	H	91.8	Very high	94.7	Very high	76 Å²	76	26.2 Å²	26.2	35%	0.352	15%	0.153	S	C	.	.	S	Bend	trans	75.3	8.1	-176.7	-56.5	47.6	0	0	0	116.7	D447 P514 H516	D447-H452 VanDerWaalsContact OD2-CA 3.3Å; D447-H452 WeakPolarHBondContact OD2-CA 3.3Å; D447-H452 PolarHBondContact OD2-N 3.1Å; H452-P514 HydrophobicContact CB-CG 4.33Å; H452-H516 AromaticContact NE2-CE1 3.61Å
453	Y	94.1	Very high	94.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-110.8	137.1	171.9	-60.2	-106.8	0	0	0	108.1	L390 Q392 D447 N451 P472 V473 H513	L390-Y453 WeakPolarHBondContact O-CD1 3.33Å; Q392-Y453 HydrophobicContact CB-CD1 4.23Å; Q392-Y453 HydrophobicContact CB-CE1 3.82Å; Q392-Y453 HydrophobicContact CG-CD1 3.51Å; Q392-Y453 HydrophobicContact CG-CE1 3.55Å; Q392-Y453 HydrophobicContact CG-CG 4.15Å; D447-Y453 WeakPolarHBondContact CB-O 3.43Å; N451-Y453 WeakPolarHBondContact O-CD2 3.31Å; N451-Y453 WeakPolarHBondContact OD1-CA 3.43Å; N451-Y453 VanDerWaalsContact OD1-CB 3.26Å; N451-Y453 WeakPolarHBondContact OD1-CB 3.48Å; N451-Y453 WeakPolarHBondContact OD1-CD2 3.29Å; N451-Y453 PolarHBondContact OD1-N 3.27Å; N451-Y453 PolarHBondContact OD1-O 3.39Å; Y453-P472 HydrophobicContact CD2-CB 4.28Å; Y453-P472 HydrophobicContact CD2-CG 4.33Å; Y453-P472 HydrophobicContact CE2-CB 3.66Å; Y453-P472 HydrophobicContact CE2-CG 4.13Å; Y453-V473 HydrophobicContact CE1-CB 4.14Å; Y453-V473 HydrophobicContact CE1-CG2 4.04Å; Y453-V473 PolarHBondContact OH-N 2.89Å; Y453-H513 WeakPolarHBondContact CE2-O 3.29Å; Y453-H513 PolarHBondContact OH-N 3.28Å; Y453-H513 PolarHBondContact OH-O 3.04Å
454	P	95.6	Very high	94.6	Very high	13 Å²	13	25.7 Å²	25.7	8%	0.084	15%	0.149	C	C	.	.			trans	-67.6	145.9	179.4	13.4	-10.7	0	0	0	111.1	D389 L390 S470	D389-P454 WeakPolarHBondContact O-CD 3.49Å; D389-P454 WeakPolarHBondContact O-CG 3.37Å; L390-P454 HydrophobicContact CD2-CB 4.13Å; L390-P454 HydrophobicContact CD2-CG 3.96Å; L390-P454 WeakPolarHBondContact CD2-O 3.14Å; P454-S470 WeakPolarHBondContact O-CB 3.2Å; P454-S470 PolarHBondContact O-OG 3.03Å
455	D	96.4	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	164.9	178.9	-62.4	-50.6	0	0	0	111.5	L63 G444 L446 I448 L467 R469 S470	L63-D455 HydrophobicContact CD1-CB 4.44Å; L63-D455 WeakPolarHBondContact CD1-O 3.36Å; G444-D455 WeakPolarHBondContact CA-O 3.38Å; L446-D455 PolarHBondContact O-N 2.79Å; I448-D455 WeakPolarHBondContact CA-OD2 3.39Å; I448-D455 HydrophobicContact CB-CB 4.4Å; I448-D455 WeakPolarHBondContact CB-OD2 3.5Å; I448-D455 HydrophobicContact CG2-CB 4.3Å; I448-D455 WeakPolarHBondContact CG2-OD2 3.48Å; I448-D455 PolarHBondContact N-OD2 3.21Å; D455-L467 HydrophobicContact CB-CD1 4.18Å; D455-R469 WeakPolarHBondContact OD1-CA 3.48Å; D455-S470 PolarHBondContact OD1-N 2.86Å
456	V	97.9	Very high	94.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.9	-177.8	-178.4	0	0	0	0	110.7	L41 I387 L390 I442 V458 F468	L41-V456 HydrophobicContact CD1-CB 4.4Å; L41-V456 HydrophobicContact CD1-CG2 4.14Å; L41-V456 HydrophobicContact CD2-CB 4.25Å; L41-V456 HydrophobicContact CD2-CG2 4.03Å; I387-V456 HydrophobicContact CB-CG2 4.08Å; I387-V456 HydrophobicContact CD1-CG2 4.45Å; I387-V456 HydrophobicContact CG2-CG2 4.17Å; L390-V456 HydrophobicContact CD1-CG2 4Å; L390-V456 HydrophobicContact CD2-CG2 3.98Å; I442-V456 HydrophobicContact CG2-CG1 3.91Å; V456-V458 HydrophobicContact CG1-CG2 4.16Å; V456-F468 PolarHBondContact N-O 3.04Å; V456-F468 PolarHBondContact O-N 2.87Å; V456-F468 VanDerWaalsContact O-O 3.14Å
457	V	98.3	Very high	95	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.2	171.5	65.9	0	0	0	0	110.9	V61 L63 I75 I442 S443 V465 L467	V61-V457 HydrophobicContact CB-CG1 4.15Å; V61-V457 HydrophobicContact CG2-CG1 3.98Å; L63-V457 HydrophobicContact CD1-CG1 4.49Å; L63-V457 HydrophobicContact CD2-CB 3.95Å; L63-V457 HydrophobicContact CD2-CG1 3.6Å; L63-V457 HydrophobicContact CG-CB 4.45Å; L63-V457 HydrophobicContact CG-CG1 3.72Å; I75-V457 HydrophobicContact CG2-CG2 3.75Å; I442-V457 WeakPolarHBondContact CA-O 3.38Å; S443-V457 PolarHBondContact N-O 3Å; S443-V457 WeakPolarHBondContact O-CG1 3.41Å; S443-V457 PolarHBondContact O-N 2.8Å; V457-V465 HydrophobicContact CG2-CG1 3.23Å; V457-L467 HydrophobicContact CB-CD1 4.2Å; V457-L467 HydrophobicContact CG2-CB 4.36Å
458	V	98.6	Very high	95.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126	-177.4	-175.9	0	0	0	0	109.6	V410 F438 I442 V456 V465 V466 F468	V410-V458 HydrophobicContact CG2-CG1 3.72Å; V410-V458 HydrophobicContact CG2-CG2 4.07Å; F438-V458 HydrophobicContact CD1-CG1 4.32Å; F438-V458 HydrophobicContact CD2-CB 4.39Å; F438-V458 HydrophobicContact CD2-CG1 3.78Å; F438-V458 HydrophobicContact CE1-CG1 3.98Å; F438-V458 HydrophobicContact CE2-CB 3.57Å; F438-V458 HydrophobicContact CE2-CG1 3.4Å; F438-V458 VanDerWaalsContact CE2-CG1 3.4Å; F438-V458 HydrophobicContact CE2-CG2 4.32Å; F438-V458 HydrophobicContact CG-CG1 4.23Å; F438-V458 HydrophobicContact CZ-CB 3.64Å; F438-V458 HydrophobicContact CZ-CG1 3.51Å; F438-V458 HydrophobicContact CZ-CG2 3.89Å; I442-V458 HydrophobicContact CG1-CG1 4.43Å; I442-V458 HydrophobicContact CG1-CG2 4.49Å; V456-V458 HydrophobicContact CG1-CG2 4.16Å; V458-V465 WeakPolarHBondContact O-CA 3.38Å; V458-V466 PolarHBondContact N-O 3.3Å; V458-V466 PolarHBondContact O-N 3.24Å; V458-F468 HydrophobicContact CB-CE2 4.27Å; V458-F468 HydrophobicContact CG2-CD2 4.13Å; V458-F468 HydrophobicContact CG2-CE2 3.97Å
459	G	97.9	Very high	95.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	153.2	175.1	0	0	0	0	0	113.4	G58 G439 Y440 S441	G58-G459 CarbonylContact O-C 3.2Å; G58-G459 WeakPolarHBondContact O-CA 3.26Å; G439-G459 PolarHBondContact N-O 3.25Å; Y440-G459 PolarHBondContact N-O 2.68Å; Y440-G459 VanDerWaalsContact N-O 3.1Å; S441-G459 PolarHBondContact N-O 3.45Å; S441-G459 PolarHBondContact O-N 2.95Å
460	S	96.8	Very high	95.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	159.9	177.5	166.4	0	0	0	0	111.7	G58 V435 T436 N462 S464	G58-S460 CarbonylContact C-O 3.59Å; G58-S460 VanDerWaalsContact C-O 3.28Å; G58-S460 WeakPolarHBondContact CA-O 3.34Å; V435-S460 VanDerWaalsContact CG1-CB 3.44Å; T436-S460 PolarHBondContact O-OG 2.82Å; S460-N462 VanDerWaalsContact C-N 3.27Å; S460-N462 WeakPolarHBondContact OG-CB 3.29Å; S460-N462 PolarHBondContact OG-N 3Å; S460-S464 PolarHBondContact N-O 2.78Å
461	L	93.3	Very high	95.6	Very high	32 Å²	32	12.1 Å²	12.1	17%	0.168	6%	0.064	C	C	.	.	S	Bend	trans	-79.6	-4.3	166.4	-69.6	178.3	0	0	0	114	F59 R437 Y440	F59-L461 HydrophobicContact CD2-CD2 3.63Å; F59-L461 HydrophobicContact CE2-CD2 4.15Å; R437-L461 HydrophobicContact CB-CB 3.97Å; R437-L461 HydrophobicContact CG-CB 4.5Å; Y440-L461 HydrophobicContact CD1-CD2 3.7Å; Y440-L461 HydrophobicContact CD1-CG 3.98Å; Y440-L461 HydrophobicContact CD2-CD1 3.53Å; Y440-L461 HydrophobicContact CD2-CD2 4.13Å; Y440-L461 HydrophobicContact CD2-CG 3.68Å; Y440-L461 HydrophobicContact CE1-CD2 3.74Å; Y440-L461 HydrophobicContact CE1-CG 4.35Å; Y440-L461 HydrophobicContact CE2-CD1 3.66Å; Y440-L461 HydrophobicContact CE2-CD2 4.16Å; Y440-L461 HydrophobicContact CE2-CG 4.08Å; Y440-L461 HydrophobicContact CG-CD1 4.04Å; Y440-L461 HydrophobicContact CG-CD2 3.89Å; Y440-L461 HydrophobicContact CG-CG 3.61Å
462	N	94.1	Very high	95.7	Very high	81 Å²	81	11.3 Å²	11.3	43%	0.433	6%	0.059	S	C	.	.	S	Bend	trans	-98.8	34.1	-178.2	-166.9	53.1	0	0	0	112.8	T436 S460 S464	T436-N462 WeakPolarHBondContact O-CB 3.5Å; T436-N462 WeakPolarHBondContact OG1-CB 3.19Å; T436-N462 VanDerWaalsContact OG1-CG 3.3Å; T436-N462 PolarHBondContact OG1-ND2 3.3Å; S460-N462 VanDerWaalsContact C-N 3.27Å; S460-N462 WeakPolarHBondContact OG-CB 3.29Å; S460-N462 PolarHBondContact OG-N 3Å; N462-S464 VanDerWaalsContact C-N 3.33Å; N462-S464 PolarHBondContact O-N 3.05Å
463	D	96.6	Very high	95.8	Very high	16 Å²	16	7.8 Å²	7.8	9%	0.086	4%	0.043	C	C	.	.	S	Bend	trans	61	32.5	176.4	-52.1	-65.6	0	0	0	115.1	G51 D52 R53 G54 T55 F56 F57	G51-D463 PolarHBondContact N-O 2.76Å; D52-D463 VanDerWaalsContact O-CG 3.26Å; R53-D463 WeakPolarHBondContact CA-OD2 3.35Å; G54-D463 PolarHBondContact N-OD2 3.49Å; T55-D463 WeakPolarHBondContact CA-OD1 3.47Å; T55-D463 PolarHBondContact N-OD1 2.87Å; T55-D463 PolarHBondContact OG1-OD1 3.32Å; F56-D463 WeakPolarHBondContact CA-OD1 3.48Å; F56-D463 PolarHBondContact N-OD1 3.45Å; F57-D463 HydrophobicContact CB-CB 4.24Å; F57-D463 PolarHBondContact N-OD1 3.18Å; F57-D463 CarbonylContact O-C 3.51Å; F57-D463 WeakPolarHBondContact O-CA 3.42Å
464	S	96.7	Very high	95.6	Very high	5 Å²	5	7.8 Å²	7.8	4%	0.035	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157	-179.4	68	0	0	0	0	114.2	K49 F57 V435 S460 N462	K49-S464 WeakPolarHBondContact O-CA 3.31Å; F57-S464 PolarHBondContact O-N 2.9Å; V435-S464 WeakPolarHBondContact CG1-OG 3.28Å; V435-S464 WeakPolarHBondContact CG2-OG 3.5Å; S460-S464 PolarHBondContact N-O 2.78Å; N462-S464 VanDerWaalsContact C-N 3.33Å; N462-S464 PolarHBondContact O-N 3.05Å
465	V	97.7	Very high	95.4	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.012	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.4	175.8	176.4	0	0	0	0	109.1	K49 F57 V61 I75 V77 V457 V458	K49-V465 HydrophobicContact CB-CB 4.44Å; K49-V465 PolarHBondContact N-O 3.01Å; K49-V465 PolarHBondContact O-N 2.91Å; F57-V465 HydrophobicContact CD1-CG2 4.14Å; F57-V465 HydrophobicContact CE1-CB 4.31Å; F57-V465 HydrophobicContact CE1-CG2 3.84Å; V61-V465 HydrophobicContact CG1-CG1 4.04Å; V61-V465 HydrophobicContact CG1-CG2 3.81Å; I75-V465 HydrophobicContact CG2-CG1 4.14Å; V77-V465 HydrophobicContact CB-CG2 4.46Å; V77-V465 HydrophobicContact CG1-CG2 3.69Å; V77-V465 HydrophobicContact CG2-CB 4.48Å; V77-V465 HydrophobicContact CG2-CG2 3.88Å; V457-V465 HydrophobicContact CG2-CG1 3.23Å; V458-V465 WeakPolarHBondContact O-CA 3.38Å
466	V	97.7	Very high	95.1	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.2	176.8	-171.2	0	0	0	0	109.5	T46 V435 F438 V458 F468	T46-V466 HydrophobicContact CG2-CG1 4.12Å; V435-V466 HydrophobicContact CG2-CG2 3.94Å; F438-V466 HydrophobicContact CE2-CB 4.2Å; F438-V466 HydrophobicContact CE2-CG2 4.21Å; V458-V466 PolarHBondContact N-O 3.3Å; V458-V466 PolarHBondContact O-N 3.24Å; V466-F468 HydrophobicContact CB-CE2 3.76Å; V466-F468 HydrophobicContact CB-CZ 4.07Å; V466-F468 HydrophobicContact CG1-CD2 4.3Å; V466-F468 HydrophobicContact CG1-CE1 4.25Å; V466-F468 HydrophobicContact CG1-CE2 3.58Å; V466-F468 HydrophobicContact CG1-CZ 3.55Å
467	L	97.1	Very high	94.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.9	173.3	167.9	65.8	0	0	0	109.8	L47 L63 I75 I101 I448 D455 V457 R469	L47-L467 HydrophobicContact CB-CB 4.28Å; L47-L467 HydrophobicContact CD1-CD2 4.09Å; L47-L467 PolarHBondContact N-O 2.88Å; L47-L467 PolarHBondContact O-N 3.46Å; L63-L467 HydrophobicContact CD2-CD1 4.26Å; I75-L467 HydrophobicContact CD1-CB 3.87Å; I75-L467 HydrophobicContact CD1-CD2 3.85Å; I75-L467 HydrophobicContact CD1-CG 4.44Å; I75-L467 HydrophobicContact CG1-CD2 4.23Å; I101-L467 HydrophobicContact CD1-CD2 4.02Å; I101-L467 HydrophobicContact CG2-CD2 4.17Å; I448-L467 HydrophobicContact CG2-CD1 4.41Å; I448-L467 HydrophobicContact CG2-CD2 3.93Å; D455-L467 HydrophobicContact CB-CD1 4.18Å; V457-L467 HydrophobicContact CB-CD1 4.2Å; V457-L467 HydrophobicContact CG2-CB 4.36Å; L467-R469 HydrophobicContact CG-CG 4.33Å
468	F	96.5	Very high	94.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.8	172.8	-59.5	-92.3	0	0	0	108.2	L41 T46 L428 F433 F438 V456 V458 V466	L41-F468 HydrophobicContact CB-CB 4.42Å; L41-F468 HydrophobicContact CD2-CB 4.01Å; T46-F468 HydrophobicContact CG2-CD1 3.56Å; T46-F468 HydrophobicContact CG2-CE1 3.51Å; T46-F468 HydrophobicContact CG2-CG 4.39Å; T46-F468 HydrophobicContact CG2-CZ 4.3Å; L428-F468 HydrophobicContact CD1-CD1 4.06Å; L428-F468 HydrophobicContact CD1-CD2 3.96Å; L428-F468 HydrophobicContact CD1-CE1 4.07Å; L428-F468 HydrophobicContact CD1-CE2 4Å; L428-F468 HydrophobicContact CD1-CG 4.01Å; L428-F468 HydrophobicContact CD1-CZ 4.05Å; L428-F468 HydrophobicContact CD2-CD1 4.01Å; L428-F468 HydrophobicContact CD2-CE1 3.91Å; L428-F468 HydrophobicContact CG-CE1 4.44Å; F433-F468 HydrophobicContact CD2-CE1 4.33Å; F433-F468 AromaticContact CD2-CZ 3.94Å; F433-F468 HydrophobicContact CD2-CZ 3.94Å; F433-F468 AromaticContact CE1-CE1 4Å; F433-F468 HydrophobicContact CE1-CE1 4Å; F433-F468 HydrophobicContact CE1-CZ 4.45Å; F433-F468 AromaticContact CE2-CE1 3.66Å; F433-F468 HydrophobicContact CE2-CE1 3.66Å; F433-F468 AromaticContact CE2-CZ 3.67Å; F433-F468 HydrophobicContact CE2-CZ 3.67Å; F433-F468 HydrophobicContact CG-CZ 4.49Å; F433-F468 AromaticContact CZ-CE1 3.5Å; F433-F468 HydrophobicContact CZ-CE1 3.5Å; F433-F468 VanDerWaalsContact CZ-CE1 3.5Å; F433-F468 AromaticContact CZ-CZ 3.97Å; F433-F468 HydrophobicContact CZ-CZ 3.97Å; F438-F468 HydrophobicContact CE2-CE2 4.01Å; F438-F468 HydrophobicContact CE2-CZ 4.16Å; F438-F468 AromaticContact CZ-CE2 3.59Å; F438-F468 HydrophobicContact CZ-CE2 3.59Å; F438-F468 AromaticContact CZ-CZ 3.64Å; F438-F468 HydrophobicContact CZ-CZ 3.64Å; V456-F468 PolarHBondContact N-O 3.04Å; V456-F468 PolarHBondContact O-N 2.87Å; V456-F468 VanDerWaalsContact O-O 3.14Å; V458-F468 HydrophobicContact CB-CE2 4.27Å; V458-F468 HydrophobicContact CG2-CD2 4.13Å; V458-F468 HydrophobicContact CG2-CE2 3.97Å; V466-F468 HydrophobicContact CB-CE2 3.76Å; V466-F468 HydrophobicContact CB-CZ 4.07Å; V466-F468 HydrophobicContact CG1-CD2 4.3Å; V466-F468 HydrophobicContact CG1-CE1 4.25Å; V466-F468 HydrophobicContact CG1-CE2 3.58Å; V466-F468 HydrophobicContact CG1-CZ 3.55Å
469	R	94.5	Very high	94.2	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.011	12%	0.115	C	C	.	.			trans	-107	140.3	178.6	-69.5	179.2	-62.3	127.7	7.5	110.3	D42 H45 I448 D449 D455 L467 Q610 L612	D42-R469 WeakPolarHBondContact CB-O 3.32Å; D42-R469 PolarHBondContact N-O 2.83Å; H45-R469 PolarHBondContact O-NH2 3.08Å; I448-R469 HydrophobicContact CG2-CG 4.48Å; D449-R469 WeakPolarHBondContact OD2-CD 3.34Å; D449-R469 IonicContact OD2-CZ 2.7Å; D449-R469 IonicContact OD2-NE 2.63Å; D449-R469 IonicContact OD2-NH1 3.41Å; D449-R469 PolarHBondContact OD2-NH1 3.03Å; D455-R469 WeakPolarHBondContact OD1-CA 3.48Å; L467-R469 HydrophobicContact CG-CG 4.33Å; R469-Q610 PolarHBondContact NH1-O 2.87Å; R469-Q610 VanDerWaalsContact NH1-O 3.07Å; R469-L612 HydrophobicContact CB-CD1 3.69Å
470	S	94.4	Very high	94	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-81.7	123.4	-175.5	-69.4	0	0	0	0	111.5	L41 N451 P454 D455	L41-S470 WeakPolarHBondContact CD2-OG 3.31Å; N451-S470 PolarHBondContact ND2-O 3.16Å; N451-S470 VanDerWaalsContact ND2-O 3.1Å; P454-S470 WeakPolarHBondContact O-CB 3.2Å; P454-S470 PolarHBondContact O-OG 3.03Å; D455-S470 PolarHBondContact OD1-N 2.86Å
471	C	92.3	Very high	94	Very high	6 Å²	6	27.7 Å²	27.7	4%	0.041	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-70.8	137.1	171.8	-69.8	0	0	0	0	110.5	N40 V473 V615	N40-C471 HydrophobicContact CB-CB 4.49Å; N40-C471 WeakPolarHBondContact CB-O 3.33Å; N40-C471 WeakPolarHBondContact O-CB 3.34Å; N40-C471 PolarHBondContact O-N 2.83Å; C471-V473 PolarHBondContact O-N 3.46Å; C471-V615 HydrophobicContact CB-CB 4.44Å; C471-V615 HydrophobicContact CB-CG1 3.76Å; C471-V615 HydrophobicContact CB-CG2 3.94Å
472	P	92.1	Very high	94	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.026	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-59	134.6	173.4	-27.1	36.1	0	0	0	112.6	Y453 Y517 P614 V615	Y453-P472 HydrophobicContact CD2-CB 4.28Å; Y453-P472 HydrophobicContact CD2-CG 4.33Å; Y453-P472 HydrophobicContact CE2-CB 3.66Å; Y453-P472 HydrophobicContact CE2-CG 4.13Å; P472-Y517 HydrophobicContact CB-CD1 4.23Å; P472-Y517 HydrophobicContact CB-CE1 3.53Å; P472-Y517 HydrophobicContact CB-CE2 4.28Å; P472-Y517 HydrophobicContact CG-CE1 4.29Å; P472-Y517 HydrophobicContact CG-CE2 4.15Å; P472-P614 HydrophobicContact CB-CB 4.49Å; P472-P614 CarbonylContact O-C 3.58Å; P472-P614 WeakPolarHBondContact O-CA 3.5Å; P472-P614 WeakPolarHBondContact O-CB 3.29Å; P472-V615 PolarHBondContact O-N 3.28Å
473	V	92.6	Very high	94	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.7	-173.2	-176.1	0	0	0	0	111.1	N40 D391 Y453 C471 A512 V615 N617	N40-V473 HydrophobicContact CB-CG2 3.66Å; D391-V473 HydrophobicContact CB-CB 4.43Å; D391-V473 HydrophobicContact CB-CG1 4.46Å; D391-V473 HydrophobicContact CB-CG2 3.78Å; Y453-V473 HydrophobicContact CE1-CB 4.14Å; Y453-V473 HydrophobicContact CE1-CG2 4.04Å; Y453-V473 PolarHBondContact OH-N 2.89Å; C471-V473 PolarHBondContact O-N 3.46Å; V473-A512 WeakPolarHBondContact O-CB 3.5Å; V473-V615 HydrophobicContact CG2-CG2 3.99Å; V473-N617 HydrophobicContact CG1-CB 3.8Å
474	I	91.1	Very high	93.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.8	179.3	-67.1	-176.6	0	0	0	109.1	V476 F510 A512 P519 I521 I596 P614 V615 L616 N617	I474-V476 HydrophobicContact CG2-CG2 4.01Å; I474-F510 HydrophobicContact CD1-CD2 4.46Å; I474-F510 HydrophobicContact CG2-CB 3.76Å; I474-F510 HydrophobicContact CG2-CD2 3.81Å; I474-F510 HydrophobicContact CG2-CG 4.09Å; I474-A512 HydrophobicContact CG1-CB 4.3Å; I474-P519 HydrophobicContact CD1-CG 4.09Å; I474-I521 HydrophobicContact CD1-CD1 3.9Å; I474-I521 HydrophobicContact CD1-CG2 3.83Å; I474-I521 HydrophobicContact CG2-CD1 4.07Å; I474-I596 HydrophobicContact CD1-CD1 4.16Å; I474-P614 HydrophobicContact CD1-CB 3.41Å; I474-P614 VanDerWaalsContact CD1-CB 3.41Å; I474-P614 HydrophobicContact CD1-CG 3.58Å; I474-P614 HydrophobicContact CG1-CB 3.81Å; I474-V615 WeakPolarHBondContact CB-O 3.09Å; I474-V615 PolarHBondContact N-O 2.95Å; I474-L616 HydrophobicContact CG2-CD2 4.36Å; I474-N617 PolarHBondContact O-N 3.39Å
475	H	90.4	Very high	93.3	Very high	44 Å²	44	33.4 Å²	33.4	20%	0.204	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.2	172	-44.5	-91.6	0	0	0	108.1	F510 T511 N617	H475-F510 WeakPolarHBondContact O-CA 3.5Å; H475-T511 PolarHBondContact CD2-O 2.9Å; H475-T511 PolarHBondContact N-O 3.12Å; H475-T511 PolarHBondContact O-N 3.01Å; H475-N617 PolarHBondContact CE1-ND2 3.36Å; H475-N617 PolarHBondContact ND1-ND2 3.31Å
476	V	90.9	Very high	92.8	Very high	13 Å²	13	37.2 Å²	37.2	8%	0.079	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.7	177.2	177.8	0	0	0	0	109.2	I474 F508 F510 L523 L616	I474-V476 HydrophobicContact CG2-CG2 4.01Å; V476-F508 HydrophobicContact CG1-CB 4.39Å; V476-F508 HydrophobicContact CG1-CD1 3.85Å; V476-F510 HydrophobicContact CG2-CB 4.38Å; V476-L523 HydrophobicContact CG1-CD1 4.1Å; V476-L523 HydrophobicContact CG2-CD1 4.28Å; V476-L616 HydrophobicContact CG2-CD2 3.44Å; V476-L616 VanDerWaalsContact CG2-CD2 3.44Å
477	V	91.6	Very high	92.3	Very high	75 Å²	75	37.3 Å²	37.3	46%	0.455	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	134.1	165.4	-178.1	0	0	0	0	107.6	M509	V477-M509 HydrophobicContact CB-CE 3.8Å; V477-M509 HydrophobicContact CG1-CE 4.08Å; V477-M509 HydrophobicContact CG2-CE 3.84Å; V477-M509 PolarHBondContact N-O 3.25Å; V477-M509 PolarHBondContact O-N 2.89Å
478	R	91.4	Very high	91.8	Very high	52 Å²	52	38.6 Å²	38.6	20%	0.196	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.7	-178.5	63.9	-173.3	175.7	-158.7	-4.3	111.1	C507 F508 S621 K622 T623	R478-C507 CarbonylContact C-O 3.58Å; R478-C507 VanDerWaalsContact CA-O 3.25Å; R478-C507 WeakPolarHBondContact CA-O 3.47Å; R478-F508 HydrophobicContact CB-CD1 4.01Å; R478-F508 HydrophobicContact CB-CE1 4.13Å; R478-S621 PolarHBondContact NH1-O 2.88Å; R478-S621 PolarHBondContact NH2-O 3.12Å; R478-K622 PolarHBondContact NH1-O 2.86Å; R478-T623 PolarHBondContact NH2-O 3.39Å
479	E	93.3	Very high	91.1	Very high	143 Å²	143	41.5 Å²	41.5	67%	0.668	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	136.1	175.6	-175.8	175.6	-169	0	0	108	C507	E479-C507 PolarHBondContact N-O 3.18Å; E479-C507 PolarHBondContact O-N 3.26Å
480	V	93.9	Very high	90.4	Very high	39 Å²	39	48.9 Å²	48.9	24%	0.236	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.9	-178.7	177.2	0	0	0	0	109.9	I482 V504 K505 A506 I592 L624	V480-I482 HydrophobicContact CG1-CG1 4.24Å; V480-V504 HydrophobicContact CG1-CG1 4.31Å; V480-K505 WeakPolarHBondContact CA-O 3.41Å; V480-A506 HydrophobicContact CG2-CB 3.86Å; V480-I592 HydrophobicContact CB-CD1 4.47Å; V480-I592 HydrophobicContact CG1-CD1 3.75Å; V480-I592 HydrophobicContact CG2-CD1 3.9Å; V480-L624 HydrophobicContact CB-CD2 4.1Å; V480-L624 HydrophobicContact CG2-CD2 3.5Å; V480-L624 VanDerWaalsContact CG2-CD2 3.5Å
481	S	95.1	Very high	89.7	Confident	65 Å²	65	54.6 Å²	54.6	46%	0.455	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.7	175.7	57.8	0	0	0	0	109.6	K505	S481-K505 PolarHBondContact N-O 3.22Å; S481-K505 PolarHBondContact O-N 3.39Å
482	I	95	Very high	89.2	Confident	16 Å²	16	61 Å²	61	8%	0.082	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.7	-176.1	-60.5	173	0	0	0	108.3	V480 Q485 V502 E503 V504 L590 S626 V628	V480-I482 HydrophobicContact CG1-CG1 4.24Å; I482-Q485 PolarHBondContact O-N 3.03Å; I482-V502 HydrophobicContact CG2-CG1 3.49Å; I482-V502 VanDerWaalsContact CG2-CG1 3.49Å; I482-E503 WeakPolarHBondContact CA-O 2.91Å; I482-V504 HydrophobicContact CG1-CG1 4.41Å; I482-L590 HydrophobicContact CD1-CD1 3.81Å; I482-S626 WeakPolarHBondContact CD1-OG 3.19Å; I482-V628 HydrophobicContact CD1-CG2 4.2Å; I482-V628 HydrophobicContact CG2-CG1 4.22Å; I482-V628 HydrophobicContact CG2-CG2 3.87Å
483	D	92.7	Very high	89	Confident	115 Å²	115	64 Å²	64	62%	0.615	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	118.7	178.7	-169.9	28.5	0	0	0	111.7	E503	D483-E503 PolarHBondContact N-O 2.73Å; D483-E503 PolarHBondContact O-N 3.25Å
484	P	91.6	Very high	88.6	Confident	32 Å²	32	64.6 Å²	64.6	21%	0.208	33%	0.328	C	S	.	.	S	Bend	cis	-78.5	146	-6.8	33.4	-35.8	0	0	0	112.6	N486	P484-N486 WeakPolarHBondContact CB-O 3.44Å; P484-N486 PolarHBondContact O-N 3.16Å
485	Q	86.9	Confident	88	Confident	92 Å²	92	74 Å²	74	43%	0.43	37%	0.369	S	S	.	.	S	Bend	trans	-64.6	-23.1	175.2	-169.8	66.4	56.6	0	0	113.5	I482 E627 N629	I482-Q485 PolarHBondContact O-N 3.03Å; Q485-E627 PolarHBondContact NE2-O 3.04Å; Q485-N629 PolarHBondContact O-N 3.26Å
486	N	87.8	Confident	87.2	Confident	82 Å²	82	75.9 Å²	75.9	44%	0.439	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.3	174.6	-58.3	-82.4	0	0	0	109.7	P484 D488 N629	P484-N486 WeakPolarHBondContact CB-O 3.44Å; P484-N486 PolarHBondContact O-N 3.16Å; N486-D488 PolarHBondContact O-N 3.34Å; N486-N629 CarbonylContact C-O 3.6Å; N486-N629 VanDerWaalsContact CA-O 3.31Å; N486-N629 WeakPolarHBondContact CA-O 3.08Å
487	I	88.3	Confident	86.6	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.005	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	107.1	179.9	-65	168	0	0	0	108.9	L489 V500 V502 L577 I588 V628 N629 F630 L631	I487-L489 HydrophobicContact CG2-CD2 3.86Å; I487-V500 HydrophobicContact CG2-CG1 4.08Å; I487-V502 HydrophobicContact CD1-CG2 4.06Å; I487-V502 HydrophobicContact CG1-CG2 3.82Å; I487-L577 HydrophobicContact CG2-CD2 4.1Å; I487-I588 HydrophobicContact CD1-CD1 3.39Å; I487-I588 HydrophobicContact CD1-CG1 4.13Å; I487-V628 HydrophobicContact CD1-CB 4.27Å; I487-V628 HydrophobicContact CD1-CG1 3.83Å; I487-V628 HydrophobicContact CG1-CG1 3.79Å; I487-N629 PolarHBondContact N-O 3.26Å; I487-F630 HydrophobicContact CB-CD1 4.01Å; I487-F630 HydrophobicContact CB-CE1 4.32Å; I487-F630 HydrophobicContact CD1-CE1 4.21Å; I487-F630 HydrophobicContact CD1-CZ 4.36Å; I487-F630 HydrophobicContact CG2-CD1 3.83Å; I487-F630 HydrophobicContact CG2-CE1 3.88Å; I487-L631 WeakPolarHBondContact O-CB 3.41Å; I487-L631 PolarHBondContact O-N 2.69Å
488	D	85.2	Confident	86	Confident	28 Å²	28	83.1 Å²	83.1	15%	0.15	43%	0.426	C	S	.	.			trans	-84.2	128	163.3	-177.4	-23.1	0	0	0	108.5	N486 E490 Q491 V500 L631	N486-D488 PolarHBondContact O-N 3.34Å; D488-E490 PolarHBondContact OD1-N 3.49Å; D488-Q491 HydrophobicContact CB-CB 4.26Å; D488-Q491 HydrophobicContact CB-CG 4.32Å; D488-Q491 PolarHBondContact OD1-N 2.88Å; D488-Q491 WeakPolarHBondContact OD2-CG 3.41Å; D488-Q491 PolarHBondContact OD2-NE2 3.49Å; D488-V500 WeakPolarHBondContact O-CG2 3.49Å; D488-L631 HydrophobicContact CB-CD1 4.28Å
489	L	81.8	Confident	85.8	Confident	60 Å²	60	81.1 Å²	81.1	31%	0.314	42%	0.421	S	S	.	.	S	Bend	trans	-87.8	-18.1	-177.2	-63.3	178.3	0	0	0	113.7	I487 L577 I581 K584 F630	I487-L489 HydrophobicContact CG2-CD2 3.86Å; L489-L577 HydrophobicContact CD2-CD2 3.31Å; L489-I581 HydrophobicContact CD2-CD1 4.36Å; L489-K584 HydrophobicContact CD1-CB 4.48Å; L489-K584 HydrophobicContact CD1-CD 3.57Å; L489-K584 HydrophobicContact CD1-CG 3.92Å; L489-F630 HydrophobicContact CD2-CD1 4.25Å; L489-F630 HydrophobicContact CD2-CE1 4.21Å
490	E	79.3	Confident	85.6	Confident	158 Å²	158	74.9 Å²	74.9	74%	0.738	39%	0.393	S	S	*	.	S	Bend	trans	-83	-22.6	177.4	-60.6	-62.3	138.9	0	0	111	D488	D488-E490 PolarHBondContact OD1-N 3.49Å
491	Q	79.9	Confident	85.6	Confident	120 Å²	120	73.9 Å²	73.9	56%	0.561	39%	0.387	S	S	*	.			trans	-88.2	110.8	178.5	-70.4	-173.6	52.2	0	0	113.4	D488 N493	D488-Q491 HydrophobicContact CB-CB 4.26Å; D488-Q491 HydrophobicContact CB-CG 4.32Å; D488-Q491 PolarHBondContact OD1-N 2.88Å; D488-Q491 WeakPolarHBondContact OD2-CG 3.41Å; D488-Q491 PolarHBondContact OD2-NE2 3.49Å; Q491-N493 PolarHBondContact O-N 2.62Å
492	K	83.3	Confident	85.5	Confident	142 Å²	142	70.9 Å²	70.9	62%	0.617	37%	0.366	S	S	*	.			trans	-81	96.2	168.2	-66.3	-177.1	172.6	-172.5	0	110.8	D498 G499	K492-D498 WeakPolarHBondContact CD-OD1 3.36Å; K492-D498 WeakPolarHBondContact CE-OD1 3.47Å; K492-D498 IonicContact NZ-OD1 2.92Å; K492-D498 PolarHBondContact NZ-OD1 2.82Å; K492-G499 WeakPolarHBondContact CA-O 3.3Å
493	N	86.8	Confident	85.4	Confident	66 Å²	66	73.5 Å²	73.5	35%	0.353	38%	0.378	S	S	.	.			trans	-103.9	-4.5	-178.2	71	-16.8	0	0	0	114.4	Q491 K495 G499 V500 C501	Q491-N493 PolarHBondContact O-N 2.62Å; N493-K495 PolarHBondContact O-N 3.02Å; N493-G499 PolarHBondContact N-O 2.96Å; N493-V500 WeakPolarHBondContact OD1-CA 3.37Å; N493-C501 PolarHBondContact ND2-O 2.85Å; N493-C501 PolarHBondContact OD1-N 3.03Å; N493-C501 PolarHBondContact OD1-O 2.84Å
494	C	84.7	Confident	85.6	Confident	13 Å²	13	68.1 Å²	68.1	9%	0.088	35%	0.349	C	S	.	.			trans	-63.1	123.2	175.8	-70.2	0	0	0	0	112.4	G496 R497 G499 C501	C494-G496 PolarHBondContact O-N 3.12Å; C494-R497 HydrophobicContact CB-CB 4.13Å; C494-R497 WeakPolarHBondContact CB-O 3.04Å; C494-G499 PolarHBondContact SG-O 2.97Å; C494-G499 VanDerWaalsContact SG-O 3.36Å; C494-C501 VanDerWaalsContact CA-SG 3.57Å; C494-C501 HydrophobicContact CB-CB 4.06Å; C494-C501 WeakPolarHBondContact CB-SG 3.15Å; C494-C501 WeakPolarHBondContact SG-CB 3.19Å; C494-C501 PolarHBondContact SG-N 3.25Å; C494-C501 CovalentContact SG-SG 2.04Å; C494-C501 PolarHBondContact SG-SG 2.9Å
495	K	78.4	Confident	85.8	Confident	197 Å²	197	70.2 Å²	70.2	86%	0.857	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	97.7	179.1	-66.7	168.6	-171.5	152.8	0	110.9	N493	N493-K495 PolarHBondContact O-N 3.02Å
496	G	73.6	Confident	86.2	Confident	84 Å²	84	65.9 Å²	65.9	87%	0.866	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	17.5	175.3	0	0	0	0	0	115.4	C494	C494-G496 PolarHBondContact O-N 3.12Å
497	R	78.1	Confident	86.6	Confident	144 Å²	144	62.8 Å²	62.8	54%	0.543	32%	0.32	S	S	.	.	S	Bend	trans	-137.6	154.2	170	-59.3	-175.4	-175.2	-166.5	4.6	109.4	C494 L545	C494-R497 HydrophobicContact CB-CB 4.13Å; C494-R497 WeakPolarHBondContact CB-O 3.04Å; R497-L545 VanDerWaalsContact NH1-CD2 3.25Å
498	D	80	Confident	86.9	Confident	97 Å²	97	62.9 Å²	62.9	52%	0.519	32%	0.32	S	S	.	.	S	Bend	trans	-74.4	140	165.5	-81.9	-62.3	0	0	0	110.4	K492 Q576	K492-D498 WeakPolarHBondContact CD-OD1 3.36Å; K492-D498 WeakPolarHBondContact CE-OD1 3.47Å; K492-D498 IonicContact NZ-OD1 2.92Å; K492-D498 PolarHBondContact NZ-OD1 2.82Å; D498-Q576 PolarHBondContact O-NE2 3.43Å
499	G	85.5	Confident	87.3	Confident	10 Å²	10	63.8 Å²	63.8	10%	0.103	32%	0.324	C	S	.	.	S	Bend	trans	123.1	-174.7	176.7	0	0	0	0	0	114.2	K492 N493 C494	K492-G499 WeakPolarHBondContact CA-O 3.3Å; N493-G499 PolarHBondContact N-O 2.96Å; C494-G499 PolarHBondContact SG-O 2.97Å; C494-G499 VanDerWaalsContact SG-O 3.36Å
500	V	90.4	Very high	87.9	Confident	12 Å²	12	61 Å²	61	7%	0.073	31%	0.309	C	S	.	.			trans	-106.5	131.8	178.7	-163	0	0	0	0	109.8	I487 D488 N493 Q576 L577	I487-V500 HydrophobicContact CG2-CG1 4.08Å; D488-V500 WeakPolarHBondContact O-CG2 3.49Å; N493-V500 WeakPolarHBondContact OD1-CA 3.37Å; V500-Q576 WeakPolarHBondContact O-CA 3.27Å; V500-L577 HydrophobicContact CB-CB 4.38Å; V500-L577 PolarHBondContact O-N 2.8Å
501	C	92.3	Very high	88.5	Confident	17 Å²	17	55.3 Å²	55.3	12%	0.115	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.1	179.6	-73.8	0	0	0	0	110.1	N493 C494 F575	N493-C501 PolarHBondContact ND2-O 2.85Å; N493-C501 PolarHBondContact OD1-N 3.03Å; N493-C501 PolarHBondContact OD1-O 2.84Å; C494-C501 VanDerWaalsContact CA-SG 3.57Å; C494-C501 HydrophobicContact CB-CB 4.06Å; C494-C501 WeakPolarHBondContact CB-SG 3.15Å; C494-C501 WeakPolarHBondContact SG-CB 3.19Å; C494-C501 PolarHBondContact SG-N 3.25Å; C494-C501 CovalentContact SG-SG 2.04Å; C494-C501 PolarHBondContact SG-SG 2.9Å; C501-F575 CarbonylContact C-O 3.41Å; C501-F575 VanDerWaalsContact CA-O 3.28Å; C501-F575 WeakPolarHBondContact CA-O 3.17Å
502	V	93.6	Very high	89	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.3	174.6	-177.1	0	0	0	0	108.6	I482 I487 V504 D574 F575 V628	I482-V502 HydrophobicContact CG2-CG1 3.49Å; I482-V502 VanDerWaalsContact CG2-CG1 3.49Å; I487-V502 HydrophobicContact CD1-CG2 4.06Å; I487-V502 HydrophobicContact CG1-CG2 3.82Å; V502-V504 HydrophobicContact CG1-CG2 4.49Å; V502-D574 WeakPolarHBondContact O-CA 3.25Å; V502-F575 HydrophobicContact CB-CD1 4.31Å; V502-F575 HydrophobicContact CB-CD2 4.28Å; V502-F575 HydrophobicContact CB-CE1 3.79Å; V502-F575 HydrophobicContact CB-CE2 3.75Å; V502-F575 HydrophobicContact CB-CZ 3.5Å; V502-F575 HydrophobicContact CG1-CE1 3.97Å; V502-F575 HydrophobicContact CG1-CZ 3.87Å; V502-F575 HydrophobicContact CG2-CD2 4.47Å; V502-F575 HydrophobicContact CG2-CE2 3.69Å; V502-F575 HydrophobicContact CG2-CZ 3.72Å; V502-F575 PolarHBondContact N-O 2.82Å; V502-F575 PolarHBondContact O-N 3.35Å; V502-V628 HydrophobicContact CG1-CG1 4.28Å; V502-V628 HydrophobicContact CG1-CG2 4.46Å; V502-V628 HydrophobicContact CG2-CG1 4.44Å
503	E	94.3	Very high	89.3	Confident	71 Å²	71	46.5 Å²	46.5	33%	0.332	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.6	172.3	-178.8	178.3	123.9	0	0	108.5	I482 D483 D574	I482-E503 WeakPolarHBondContact CA-O 2.91Å; D483-E503 PolarHBondContact N-O 2.73Å; D483-E503 PolarHBondContact O-N 3.25Å; E503-D574 WeakPolarHBondContact CA-OD1 3.36Å; E503-D574 WeakPolarHBondContact CB-OD1 3.44Å; E503-D574 WeakPolarHBondContact CG-OD1 3.46Å
504	V	95.5	Very high	89.3	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	107.2	172.5	-175.8	0	0	0	0	108.3	V480 I482 V502 F527 T572 A573 F575 L590 I592	V480-V504 HydrophobicContact CG1-CG1 4.31Å; I482-V504 HydrophobicContact CG1-CG1 4.41Å; V502-V504 HydrophobicContact CG1-CG2 4.49Å; V504-F527 HydrophobicContact CG1-CD1 4.02Å; V504-F527 HydrophobicContact CG1-CE1 3.97Å; V504-T572 WeakPolarHBondContact O-CA 3.44Å; V504-A573 WeakPolarHBondContact CB-O 3.49Å; V504-A573 PolarHBondContact N-O 3.01Å; V504-A573 PolarHBondContact O-N 2.9Å; V504-F575 HydrophobicContact CG2-CD1 3.93Å; V504-F575 HydrophobicContact CG2-CE1 3.65Å; V504-L590 HydrophobicContact CG1-CD1 4.16Å; V504-L590 HydrophobicContact CG2-CD1 3.67Å; V504-I592 HydrophobicContact CG1-CD1 3.91Å
505	K	96	Very high	89.3	Confident	76 Å²	76	50.4 Å²	50.4	33%	0.33	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.6	-179.9	179.3	178.1	-179.8	-179.1	0	110.3	V480 S481 C570 A571 T572	V480-K505 WeakPolarHBondContact CA-O 3.41Å; S481-K505 PolarHBondContact N-O 3.22Å; S481-K505 PolarHBondContact O-N 3.39Å; K505-C570 HydrophobicContact CG-CB 4.24Å; K505-A571 WeakPolarHBondContact CA-O 3.36Å; K505-T572 HydrophobicContact CB-CG2 3.96Å; K505-T572 HydrophobicContact CD-CG2 4.24Å; K505-T572 HydrophobicContact CG-CG2 3.83Å
506	A	95.9	Very high	89.6	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118	176.6	0	0	0	0	0	110.2	V480 F508 F527 C570 A571 I592	V480-A506 HydrophobicContact CG2-CB 3.86Å; A506-F508 HydrophobicContact CB-CE2 3.62Å; A506-F508 HydrophobicContact CB-CZ 3.77Å; A506-F508 WeakPolarHBondContact O-CD2 3.47Å; A506-F508 WeakPolarHBondContact O-CE2 3.3Å; A506-F527 HydrophobicContact CB-CE1 3.85Å; A506-F527 HydrophobicContact CB-CZ 3.88Å; A506-C570 CarbonylContact O-C 3.28Å; A506-C570 WeakPolarHBondContact O-CA 3.18Å; A506-A571 PolarHBondContact N-O 3.08Å; A506-A571 PolarHBondContact O-N 2.98Å; A506-I592 HydrophobicContact CB-CG2 4.29Å
507	C	95.6	Very high	90.4	Very high	18 Å²	18	45 Å²	45	12%	0.122	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137	177.6	-64.5	0	0	0	0	110.4	R478 E479 T568 C570	R478-C507 CarbonylContact C-O 3.58Å; R478-C507 VanDerWaalsContact CA-O 3.25Å; R478-C507 WeakPolarHBondContact CA-O 3.47Å; E479-C507 PolarHBondContact N-O 3.18Å; E479-C507 PolarHBondContact O-N 3.26Å; C507-T568 HydrophobicContact CB-CG2 3.94Å; C507-C570 HydrophobicContact CB-CB 3.98Å; C507-C570 WeakPolarHBondContact CB-SG 3.41Å; C507-C570 WeakPolarHBondContact SG-CB 3.43Å; C507-C570 CovalentContact SG-SG 2.04Å; C507-C570 PolarHBondContact SG-SG 2.87Å
508	F	95.1	Very high	90.9	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.7	-175.6	-58.2	-89	0	0	0	110.1	V476 R478 A506 L523 V525 V560 L562 T568 H569 I592 H594	V476-F508 HydrophobicContact CG1-CB 4.39Å; V476-F508 HydrophobicContact CG1-CD1 3.85Å; R478-F508 HydrophobicContact CB-CD1 4.01Å; R478-F508 HydrophobicContact CB-CE1 4.13Å; A506-F508 HydrophobicContact CB-CE2 3.62Å; A506-F508 HydrophobicContact CB-CZ 3.77Å; A506-F508 WeakPolarHBondContact O-CD2 3.47Å; A506-F508 WeakPolarHBondContact O-CE2 3.3Å; F508-L523 HydrophobicContact CB-CD1 4.01Å; F508-L523 HydrophobicContact CD1-CD1 4.05Å; F508-L523 HydrophobicContact CG-CD1 4.1Å; F508-V525 HydrophobicContact CD2-CG2 4.29Å; F508-V525 HydrophobicContact CE1-CG2 4.37Å; F508-V525 HydrophobicContact CE2-CB 4.4Å; F508-V525 HydrophobicContact CE2-CG1 3.93Å; F508-V525 HydrophobicContact CE2-CG2 3.63Å; F508-V525 HydrophobicContact CZ-CB 4.33Å; F508-V525 HydrophobicContact CZ-CG1 3.61Å; F508-V525 HydrophobicContact CZ-CG2 3.68Å; F508-V560 HydrophobicContact CD2-CG1 4.45Å; F508-V560 HydrophobicContact CD2-CG2 4.13Å; F508-V560 HydrophobicContact CE2-CG2 4.38Å; F508-L562 HydrophobicContact CB-CD1 4.43Å; F508-T568 WeakPolarHBondContact O-CA 3.25Å; F508-H569 PolarHBondContact N-O 3.48Å; F508-H569 PolarHBondContact O-N 3.4Å; F508-I592 HydrophobicContact CZ-CG2 4.47Å; F508-H594 HydrophobicContact CE1-CB 4.06Å
509	M	94.3	Very high	91.3	Very high	48 Å²	48	37.1 Å²	37.1	24%	0.236	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	142.8	174.1	179.4	-169.4	66.2	0	0	107.3	V477 R566	V477-M509 HydrophobicContact CB-CE 3.8Å; V477-M509 HydrophobicContact CG1-CE 4.08Å; V477-M509 HydrophobicContact CG2-CE 3.84Å; V477-M509 PolarHBondContact N-O 3.25Å; V477-M509 PolarHBondContact O-N 2.89Å; M509-R566 HydrophobicContact SD-CB 4.27Å
510	F	93.2	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	152.7	178.4	84.9	-85	0	0	0	114	I474 H475 V476 P519 I521 L562 R564 Q565 R566	I474-F510 HydrophobicContact CD1-CD2 4.46Å; I474-F510 HydrophobicContact CG2-CB 3.76Å; I474-F510 HydrophobicContact CG2-CD2 3.81Å; I474-F510 HydrophobicContact CG2-CG 4.09Å; H475-F510 WeakPolarHBondContact O-CA 3.5Å; V476-F510 HydrophobicContact CG2-CB 4.38Å; F510-P519 HydrophobicContact CE2-CG 4.28Å; F510-P519 VanDerWaalsContact CZ-O 3.29Å; F510-P519 WeakPolarHBondContact CZ-O 3.45Å; F510-I521 HydrophobicContact CB-CD1 4.3Å; F510-I521 HydrophobicContact CD1-CD1 3.77Å; F510-I521 HydrophobicContact CD1-CG1 4.33Å; F510-I521 HydrophobicContact CD2-CD1 4.13Å; F510-I521 HydrophobicContact CE1-CD1 4.03Å; F510-I521 HydrophobicContact CE1-CG1 4.22Å; F510-I521 HydrophobicContact CE2-CD1 4.37Å; F510-I521 HydrophobicContact CG-CD1 3.81Å; F510-I521 HydrophobicContact CZ-CD1 4.33Å; F510-L562 HydrophobicContact CB-CD1 4.4Å; F510-L562 HydrophobicContact CD1-CB 3.77Å; F510-L562 HydrophobicContact CD1-CD1 3.87Å; F510-L562 HydrophobicContact CD1-CG 4.4Å; F510-L562 HydrophobicContact CE1-CB 3.8Å; F510-R564 WeakPolarHBondContact CE1-O 3.33Å; F510-Q565 HydrophobicContact CD2-CG 4.09Å; F510-Q565 HydrophobicContact CE2-CB 4.45Å; F510-Q565 HydrophobicContact CE2-CG 3.57Å; F510-Q565 HydrophobicContact CZ-CG 4.01Å; F510-Q565 WeakPolarHBondContact O-CA 3.46Å; F510-R566 PolarHBondContact O-N 2.83Å
511	T	92.3	Very high	91.6	Very high	39 Å²	39	41.5 Å²	41.5	24%	0.239	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.2	169.3	53.6	0	0	0	0	110.2	H475 R566	H475-T511 PolarHBondContact CD2-O 2.9Å; H475-T511 PolarHBondContact N-O 3.12Å; H475-T511 PolarHBondContact O-N 3.01Å; T511-R566 HydrophobicContact CG2-CG 3.98Å
512	A	90.9	Very high	91.7	Very high	6 Å²	6	41.9 Å²	41.9	5%	0.05	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	152.8	178.6	0	0	0	0	0	110.9	V473 I474 P514 Y517 Q565	V473-A512 WeakPolarHBondContact O-CB 3.5Å; I474-A512 HydrophobicContact CG1-CB 4.3Å; A512-P514 CarbonylContact O-C 3.55Å; A512-Y517 HydrophobicContact CB-CD1 3.89Å; A512-Y517 HydrophobicContact CB-CE1 4.4Å; A512-Q565 VanDerWaalsContact N-CD 3.31Å; A512-Q565 PolarHBondContact O-NE2 3.13Å; A512-Q565 PolarHBondContact O-OE1 3Å
513	H	88.6	Confident	91.7	Very high	71 Å²	71	41.7 Å²	41.7	33%	0.329	21%	0.209	S	C	.	.	S	Bend	trans	-86	145.6	168.7	-165.7	99	0	0	0	110.4	Q392 Y453	Q392-H513 HydrophobicContact CB-CB 3.72Å; Q392-H513 HydrophobicContact CG-CB 4.23Å; Y453-H513 WeakPolarHBondContact CE2-O 3.29Å; Y453-H513 PolarHBondContact OH-N 3.28Å; Y453-H513 PolarHBondContact OH-O 3.04Å
514	P	86.9	Confident	91.7	Very high	11 Å²	11	40 Å²	40	7%	0.071	20%	0.203	C	C	.	.	S	Bend	cis	-72.2	167.8	-20.1	31.8	-37.7	0	0	0	111.3	H452 A512 H516 Y517	H452-P514 HydrophobicContact CB-CG 4.33Å; A512-P514 CarbonylContact O-C 3.55Å; P514-H516 WeakPolarHBondContact CG-CE1 3.34Å; P514-H516 WeakPolarHBondContact CG-NE2 3.32Å; P514-H516 PolarHBondContact O-N 3.1Å; P514-Y517 WeakPolarHBondContact O-CB 3.44Å; P514-Y517 PolarHBondContact O-N 3.13Å
515	H	84.4	Confident	91.7	Very high	151 Å²	151	40 Å²	40	70%	0.699	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-18.6	-178	-72.1	-29.8	0	0	0	116.1
516	H	86.2	Confident	91.7	Very high	138 Å²	138	39.9 Å²	39.9	64%	0.639	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-11.6	176.5	65.7	-101.2	0	0	0	113.4	H452 P514 S518	H452-H516 AromaticContact NE2-CE1 3.61Å; P514-H516 WeakPolarHBondContact CG-CE1 3.34Å; P514-H516 WeakPolarHBondContact CG-NE2 3.32Å; P514-H516 PolarHBondContact O-N 3.1Å; H516-S518 PolarHBondContact O-N 3.11Å; H516-S518 VanDerWaalsContact O-N 3.08Å
517	Y	88.6	Confident	91.7	Very high	29 Å²	29	40 Å²	40	11%	0.114	20%	0.204	C	C	.	.			trans	-78.5	88.7	175.2	178.7	-99.4	0	0	0	110	P472 A512 P514 P519 Q565	P472-Y517 HydrophobicContact CB-CD1 4.23Å; P472-Y517 HydrophobicContact CB-CE1 3.53Å; P472-Y517 HydrophobicContact CB-CE2 4.28Å; P472-Y517 HydrophobicContact CG-CE1 4.29Å; P472-Y517 HydrophobicContact CG-CE2 4.15Å; A512-Y517 HydrophobicContact CB-CD1 3.89Å; A512-Y517 HydrophobicContact CB-CE1 4.4Å; P514-Y517 WeakPolarHBondContact O-CB 3.44Å; P514-Y517 PolarHBondContact O-N 3.13Å; Y517-P519 VanDerWaalsContact C-CD 3.46Å; Y517-P519 HydrophobicContact CD1-CG 4.24Å; Y517-P519 HydrophobicContact CE1-CB 4.49Å; Y517-P519 HydrophobicContact CE1-CG 3.59Å; Y517-P519 VanDerWaalsContact O-CD 3.26Å; Y517-P519 WeakPolarHBondContact O-CD 3.47Å; Y517-Q565 PolarHBondContact O-NE2 2.87Å
518	S	88.7	Confident	91.6	Very high	50 Å²	50	41 Å²	41	35%	0.35	21%	0.207	S	C	.	.			trans	-116.8	75.3	-179	-177.9	0	0	0	0	111	H516 R564 Q565	H516-S518 PolarHBondContact O-N 3.11Å; H516-S518 VanDerWaalsContact O-N 3.08Å; S518-R564 VanDerWaalsContact OG-CA 3.31Å; S518-R564 WeakPolarHBondContact OG-CA 3.13Å; S518-Q565 PolarHBondContact OG-N 2.88Å; S518-Q565 VanDerWaalsContact OG-N 3.11Å
519	P	89.3	Confident	91.6	Very high	26 Å²	26	40.9 Å²	40.9	17%	0.169	21%	0.206	C	C	.	.			trans	-65.4	149.9	174.4	30.6	-36.5	0	0	0	110.8	I474 F510 Y517 I521	I474-P519 HydrophobicContact CD1-CG 4.09Å; F510-P519 HydrophobicContact CE2-CG 4.28Å; F510-P519 VanDerWaalsContact CZ-O 3.29Å; F510-P519 WeakPolarHBondContact CZ-O 3.45Å; Y517-P519 VanDerWaalsContact C-CD 3.46Å; Y517-P519 HydrophobicContact CD1-CG 4.24Å; Y517-P519 HydrophobicContact CE1-CB 4.49Å; Y517-P519 HydrophobicContact CE1-CG 3.59Å; Y517-P519 VanDerWaalsContact O-CD 3.26Å; Y517-P519 WeakPolarHBondContact O-CD 3.47Å; P519-I521 HydrophobicContact CB-CG2 4.16Å; P519-I521 HydrophobicContact CG-CG2 4.06Å
520	H	90.9	Very high	91.6	Very high	106 Å²	106	38.6 Å²	38.6	49%	0.491	20%	0.195	S	C	.	.			trans	-81	125.6	162.4	170.9	45.2	0	0	0	108.3	E561 L562 H563	H520-E561 IonicContact CE1-OE2 2.73Å; H520-L562 PolarHBondContact ND1-O 2.97Å; H520-L562 VanDerWaalsContact ND1-O 3.11Å; H520-H563 AromaticContact CE1-CE1 3.75Å; H520-H563 AromaticContact CE1-ND1 3.34Å; H520-H563 PolarHBondContact CE1-ND1 3.09Å; H520-H563 VanDerWaalsContact CE1-ND1 3.34Å; H520-H563 AromaticContact ND1-ND1 3.33Å; H520-H563 PolarHBondContact ND1-ND1 3.36Å
521	I	91.6	Very high	91.5	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	151.6	-179.1	66.3	-176.4	0	0	0	110	I474 F510 P519 L562 P614	I474-I521 HydrophobicContact CD1-CD1 3.9Å; I474-I521 HydrophobicContact CD1-CG2 3.83Å; I474-I521 HydrophobicContact CG2-CD1 4.07Å; F510-I521 HydrophobicContact CB-CD1 4.3Å; F510-I521 HydrophobicContact CD1-CD1 3.77Å; F510-I521 HydrophobicContact CD1-CG1 4.33Å; F510-I521 HydrophobicContact CD2-CD1 4.13Å; F510-I521 HydrophobicContact CE1-CD1 4.03Å; F510-I521 HydrophobicContact CE1-CG1 4.22Å; F510-I521 HydrophobicContact CE2-CD1 4.37Å; F510-I521 HydrophobicContact CG-CD1 3.81Å; F510-I521 HydrophobicContact CZ-CD1 4.33Å; P519-I521 HydrophobicContact CB-CG2 4.16Å; P519-I521 HydrophobicContact CG-CG2 4.06Å; I521-L562 HydrophobicContact CD1-CB 4.42Å; I521-L562 HydrophobicContact CD1-CD1 4.13Å; I521-L562 HydrophobicContact CG1-CB 3.83Å; I521-L562 HydrophobicContact CG1-CD1 4.27Å; I521-L562 HydrophobicContact CG1-CG 4.48Å; I521-L562 PolarHBondContact N-O 2.99Å; I521-L562 PolarHBondContact O-N 3.37Å; I521-P614 HydrophobicContact CG2-CG 4.32Å
522	T	93.5	Very high	91.5	Very high	24 Å²	24	41.7 Å²	41.7	15%	0.147	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.4	169.4	-48.4	0	0	0	0	107.6	E559 V560 E561 K597	T522-E559 HydrophobicContact CG2-CB 3.97Å; T522-E559 HydrophobicContact CG2-CG 4.41Å; T522-V560 WeakPolarHBondContact CA-O 3.44Å; T522-E561 HydrophobicContact CG2-CG 4.21Å; T522-K597 HydrophobicContact CG2-CB 4.48Å; T522-K597 HydrophobicContact CG2-CD 4.09Å; T522-K597 WeakPolarHBondContact O-CB 3.49Å; T522-K597 PolarHBondContact O-N 2.97Å
523	L	93.9	Very high	91.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130	170.5	-61.1	-178	0	0	0	109.4	V476 F508 V525 E559 V560 L562 S595 I596 L616	V476-L523 HydrophobicContact CG1-CD1 4.1Å; V476-L523 HydrophobicContact CG2-CD1 4.28Å; F508-L523 HydrophobicContact CB-CD1 4.01Å; F508-L523 HydrophobicContact CD1-CD1 4.05Å; F508-L523 HydrophobicContact CG-CD1 4.1Å; L523-V525 HydrophobicContact CB-CG2 4.25Å; L523-E559 CarbonylContact O-C 3.59Å; L523-E559 WeakPolarHBondContact O-CA 3.21Å; L523-V560 HydrophobicContact CB-CB 4.4Å; L523-V560 PolarHBondContact N-O 2.99Å; L523-V560 PolarHBondContact O-N 2.83Å; L523-L562 HydrophobicContact CD1-CD1 3.66Å; L523-L562 HydrophobicContact CG-CD1 3.99Å; L523-S595 CarbonylContact C-O 3.48Å; L523-S595 VanDerWaalsContact CA-O 3.27Å; L523-S595 WeakPolarHBondContact CA-O 3.33Å; L523-I596 HydrophobicContact CD2-CG1 3.82Å; L523-L616 HydrophobicContact CD2-CD2 4.38Å
524	V	94.9	Very high	91.5	Very high	35 Å²	35	42.3 Å²	42.3	21%	0.212	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.2	164.3	-175.7	0	0	0	0	107	T557 H594 S595 K597	V524-T557 HydrophobicContact CG1-CG2 3.44Å; V524-T557 VanDerWaalsContact CG1-CG2 3.44Å; V524-H594 WeakPolarHBondContact O-CA 3.46Å; V524-S595 PolarHBondContact N-O 2.98Å; V524-S595 PolarHBondContact O-N 3.48Å; V524-K597 HydrophobicContact CG2-CB 3.9Å; V524-K597 HydrophobicContact CG2-CD 4.34Å; V524-K597 HydrophobicContact CG2-CG 4.22Å
525	V	95.1	Very high	91.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114	-176	-175.8	0	0	0	0	108.8	F508 L523 F527 T557 E558 V560 I592 T593 H594	F508-V525 HydrophobicContact CD2-CG2 4.29Å; F508-V525 HydrophobicContact CE1-CG2 4.37Å; F508-V525 HydrophobicContact CE2-CB 4.4Å; F508-V525 HydrophobicContact CE2-CG1 3.93Å; F508-V525 HydrophobicContact CE2-CG2 3.63Å; F508-V525 HydrophobicContact CZ-CB 4.33Å; F508-V525 HydrophobicContact CZ-CG1 3.61Å; F508-V525 HydrophobicContact CZ-CG2 3.68Å; L523-V525 HydrophobicContact CB-CG2 4.25Å; V525-F527 HydrophobicContact CB-CE2 4.3Å; V525-F527 HydrophobicContact CG1-CD2 4.15Å; V525-F527 HydrophobicContact CG1-CE2 3.59Å; V525-F527 HydrophobicContact CG1-CZ 3.85Å; V525-T557 WeakPolarHBondContact O-CA 3.4Å; V525-E558 PolarHBondContact N-O 2.82Å; V525-E558 PolarHBondContact O-N 2.72Å; V525-V560 HydrophobicContact CG2-CG2 3.88Å; V525-I592 HydrophobicContact CG1-CG2 3.96Å; V525-T593 CarbonylContact C-O 3.58Å; V525-T593 WeakPolarHBondContact CA-O 3.42Å; V525-H594 HydrophobicContact CG2-CB 4.35Å
526	Q	95.2	Very high	91.8	Very high	75 Å²	75	47.1 Å²	47.1	35%	0.35	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.7	178.5	-177.9	175.9	-14.1	0	0	109.2	E528 T555 T593	Q526-E528 HydrophobicContact CG-CG 4.17Å; Q526-E528 PolarHBondContact NE2-OE1 3.48Å; Q526-T555 HydrophobicContact CG-CG2 3.87Å; Q526-T593 PolarHBondContact N-O 3.23Å; Q526-T593 PolarHBondContact O-N 3.01Å
527	F	95.5	Very high	91.9	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.1	171.3	-61.2	-98.2	0	0	0	108.5	V504 A506 V525 F544 T555 Q556 E558 A571 A573 I592	V504-F527 HydrophobicContact CG1-CD1 4.02Å; V504-F527 HydrophobicContact CG1-CE1 3.97Å; A506-F527 HydrophobicContact CB-CE1 3.85Å; A506-F527 HydrophobicContact CB-CZ 3.88Å; V525-F527 HydrophobicContact CB-CE2 4.3Å; V525-F527 HydrophobicContact CG1-CD2 4.15Å; V525-F527 HydrophobicContact CG1-CE2 3.59Å; V525-F527 HydrophobicContact CG1-CZ 3.85Å; F527-F544 HydrophobicContact CB-CE1 4.12Å; F527-F544 HydrophobicContact CB-CZ 3.88Å; F527-T555 VanDerWaalsContact O-CA 3.3Å; F527-T555 WeakPolarHBondContact O-CA 3.35Å; F527-Q556 PolarHBondContact N-O 2.8Å; F527-Q556 PolarHBondContact O-N 3.29Å; F527-E558 HydrophobicContact CE2-CB 4.32Å; F527-E558 HydrophobicContact CE2-CG 4.15Å; F527-A571 HydrophobicContact CE2-CB 4.01Å; F527-A571 HydrophobicContact CZ-CB 3.97Å; F527-A573 HydrophobicContact CB-CB 4.08Å; F527-A573 HydrophobicContact CD1-CB 3.86Å; F527-A573 HydrophobicContact CD2-CB 3.66Å; F527-A573 HydrophobicContact CE1-CB 4.15Å; F527-A573 HydrophobicContact CE2-CB 3.96Å; F527-A573 HydrophobicContact CG-CB 3.6Å; F527-A573 HydrophobicContact CZ-CB 4.2Å; F527-I592 HydrophobicContact CD1-CD1 4.19Å; F527-I592 HydrophobicContact CD1-CG1 3.87Å; F527-I592 HydrophobicContact CD1-CG2 4.19Å; F527-I592 HydrophobicContact CE1-CD1 4.19Å; F527-I592 HydrophobicContact CE1-CG1 4.25Å; F527-I592 HydrophobicContact CE1-CG2 4.07Å
528	E	95.4	Very high	91.8	Very high	40 Å²	40	45.3 Å²	45.3	19%	0.187	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146	170.3	-60.4	-153	159.7	0	0	111.6	Q526 R534 Y554 T555 L590 A591	Q526-E528 HydrophobicContact CG-CG 4.17Å; Q526-E528 PolarHBondContact NE2-OE1 3.48Å; E528-R534 IonicContact OE2-CZ 2.65Å; E528-R534 IonicContact OE2-NH1 3.26Å; E528-R534 PolarHBondContact OE2-NH1 2.73Å; E528-R534 IonicContact OE2-NH2 2.71Å; E528-R534 PolarHBondContact OE2-NH2 2.82Å; E528-Y554 WeakPolarHBondContact CA-O 3.43Å; E528-T555 HydrophobicContact CG-CG2 4.32Å; E528-L590 CarbonylContact O-C 3.58Å; E528-L590 VanDerWaalsContact O-CA 3.29Å; E528-L590 WeakPolarHBondContact O-CA 3.24Å; E528-A591 HydrophobicContact CB-CB 4.45Å; E528-A591 PolarHBondContact N-O 3.1Å; E528-A591 PolarHBondContact O-N 3.06Å
529	A	95	Very high	91.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	162.2	177.6	0	0	0	0	0	113.7	T531 R534 V542 F544 Y554 I588 S589 L590	A529-T531 PolarHBondContact O-N 2.64Å; A529-T531 VanDerWaalsContact O-N 3.16Å; A529-R534 PolarHBondContact O-NE 3.27Å; A529-R534 PolarHBondContact O-NH2 2.77Å; A529-V542 HydrophobicContact CB-CG2 3.35Å; A529-F544 HydrophobicContact CB-CE2 3.82Å; A529-F544 HydrophobicContact CB-CZ 4.26Å; A529-Y554 PolarHBondContact N-O 3.47Å; A529-I588 HydrophobicContact CB-CG2 4.25Å; A529-S589 CarbonylContact C-O 3.58Å; A529-S589 WeakPolarHBondContact CA-O 3.43Å; A529-L590 HydrophobicContact CB-CD2 3.81Å
530	D	94.1	Very high	92	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	50.9	32.6	-175.3	-98.8	-18.6	0	0	0	113	E532 R533 R534 H540 R541 S589	D530-E532 PolarHBondContact O-N 2.98Å; D530-R533 HydrophobicContact CB-CB 4.05Å; D530-R533 CarbonylContact O-C 3.6Å; D530-R533 WeakPolarHBondContact O-CA 3.41Å; D530-R533 WeakPolarHBondContact O-CB 3.3Å; D530-R533 PolarHBondContact O-N 3.47Å; D530-R533 VanDerWaalsContact O-N 3.09Å; D530-R533 WeakPolarHBondContact OD2-CD 3.44Å; D530-R534 WeakPolarHBondContact O-CG 3.47Å; D530-R534 PolarHBondContact O-N 3Å; D530-H540 HydrophobicContact CB-CB 4.48Å; D530-R541 IonicContact OD1-CZ 3.22Å; D530-R541 IonicContact OD1-NE 3.37Å; D530-R541 PolarHBondContact OD1-NE 2.96Å; D530-R541 IonicContact OD1-NH2 4Å; D530-R541 PolarHBondContact OD1-NH2 3.22Å; D530-R541 VanDerWaalsContact OD2-CB 3.23Å; D530-R541 WeakPolarHBondContact OD2-CB 3.47Å; D530-R541 WeakPolarHBondContact OD2-CG 3.38Å; D530-R541 IonicContact OD2-CZ 2.76Å; D530-R541 PolarHBondContact OD2-N 3.48Å; D530-R541 IonicContact OD2-NE 3.05Å; D530-R541 PolarHBondContact OD2-NE 2.85Å; D530-R541 VanDerWaalsContact OD2-NE 3.09Å; D530-R541 IonicContact OD2-NH2 2.75Å; D530-S589 PolarHBondContact N-O 2.78Å
531	T	91.4	Very high	92.1	Very high	20 Å²	20	43.7 Å²	43.7	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-47.6	-170.3	-50.6	0	0	0	0	113	A529 R533 R534 K535 S589 A591	A529-T531 PolarHBondContact O-N 2.64Å; A529-T531 VanDerWaalsContact O-N 3.16Å; T531-R533 VanDerWaalsContact C-N 3.33Å; T531-R533 PolarHBondContact O-N 2.82Å; T531-R534 PolarHBondContact O-N 2.87Å; T531-R534 PolarHBondContact OG1-NH2 2.86Å; T531-K535 WeakPolarHBondContact O-CG 3.18Å; T531-K535 PolarHBondContact O-N 3.46Å; T531-S589 PolarHBondContact N-O 2.95Å; T531-S589 PolarHBondContact N-OG 3.28Å; T531-A591 HydrophobicContact CG2-CB 4.15Å
532	E	90.3	Very high	92.2	Very high	83 Å²	83	43.3 Å²	43.3	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-32.5	176.4	-60.6	-48.1	124	0	0	112.1	D530 K535 L536 S589	D530-E532 PolarHBondContact O-N 2.98Å; E532-K535 PolarHBondContact O-N 2.81Å; E532-K535 WeakPolarHBondContact OE1-CE 3.5Å; E532-K535 IonicContact OE1-NZ 2.7Å; E532-K535 PolarHBondContact OE1-NZ 3.48Å; E532-K535 WeakPolarHBondContact OE2-CD 3.43Å; E532-K535 IonicContact OE2-NZ 3.19Å; E532-K535 PolarHBondContact OE2-NZ 3.36Å; E532-L536 PolarHBondContact O-N 3.31Å; E532-S589 PolarHBondContact N-OG 2.94Å
533	R	89.5	Confident	92.2	Very high	32 Å²	32	43.4 Å²	43.4	12%	0.121	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-43	175.6	178.5	-178.8	-171.3	79.4	4.1	111.3	D530 T531 L536 L538 P539 D583	D530-R533 HydrophobicContact CB-CB 4.05Å; D530-R533 CarbonylContact O-C 3.6Å; D530-R533 WeakPolarHBondContact O-CA 3.41Å; D530-R533 WeakPolarHBondContact O-CB 3.3Å; D530-R533 PolarHBondContact O-N 3.47Å; D530-R533 VanDerWaalsContact O-N 3.09Å; D530-R533 WeakPolarHBondContact OD2-CD 3.44Å; T531-R533 VanDerWaalsContact C-N 3.33Å; T531-R533 PolarHBondContact O-N 2.82Å; R533-L536 WeakPolarHBondContact O-CB 3.4Å; R533-L536 PolarHBondContact O-N 3.01Å; R533-L538 HydrophobicContact CG-CB 3.66Å; R533-L538 HydrophobicContact CG-CD1 4.3Å; R533-L538 PolarHBondContact O-N 3.36Å; R533-P539 WeakPolarHBondContact CD-O 3.32Å; R533-P539 PolarHBondContact NE-O 3.31Å; R533-D583 IonicContact CZ-OD2 3.88Å; R533-D583 IonicContact NH1-OD2 3.74Å; R533-D583 PolarHBondContact NH1-OD2 3.34Å
534	R	91.1	Very high	92.2	Very high	59 Å²	59	43.6 Å²	43.6	22%	0.223	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-35.5	177.5	-73.2	-173.7	-68.8	122.8	3.2	112.2	E528 A529 D530 T531 L536 G537 Y554	E528-R534 IonicContact OE2-CZ 2.65Å; E528-R534 IonicContact OE2-NH1 3.26Å; E528-R534 PolarHBondContact OE2-NH1 2.73Å; E528-R534 IonicContact OE2-NH2 2.71Å; E528-R534 PolarHBondContact OE2-NH2 2.82Å; A529-R534 PolarHBondContact O-NE 3.27Å; A529-R534 PolarHBondContact O-NH2 2.77Å; D530-R534 WeakPolarHBondContact O-CG 3.47Å; D530-R534 PolarHBondContact O-N 3Å; T531-R534 PolarHBondContact O-N 2.87Å; T531-R534 PolarHBondContact OG1-NH2 2.86Å; R534-L536 PolarHBondContact O-N 3.33Å; R534-G537 PolarHBondContact O-N 2.94Å; R534-Y554 VanDerWaalsContact CZ-CD2 3.43Å
535	K	89.7	Confident	92	Very high	143 Å²	143	44.5 Å²	44.5	62%	0.622	24%	0.239	S	C	*	.	H	α-helix	trans	-60	-28.3	172.6	-70.7	175	-169.6	168.6	0	113.4	T531 E532 G537	T531-K535 WeakPolarHBondContact O-CG 3.18Å; T531-K535 PolarHBondContact O-N 3.46Å; E532-K535 PolarHBondContact O-N 2.81Å; E532-K535 WeakPolarHBondContact OE1-CE 3.5Å; E532-K535 IonicContact OE1-NZ 2.7Å; E532-K535 PolarHBondContact OE1-NZ 3.48Å; E532-K535 WeakPolarHBondContact OE2-CD 3.43Å; E532-K535 IonicContact OE2-NZ 3.19Å; E532-K535 PolarHBondContact OE2-NZ 3.36Å; K535-G537 PolarHBondContact O-N 3.27Å
536	L	87.4	Confident	91.4	Very high	120 Å²	120	46.8 Å²	46.8	63%	0.628	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	6.8	174.1	-60	173.9	0	0	0	113.4	E532 R533 R534 L538	E532-L536 PolarHBondContact O-N 3.31Å; R533-L536 WeakPolarHBondContact O-CB 3.4Å; R533-L536 PolarHBondContact O-N 3.01Å; R534-L536 PolarHBondContact O-N 3.33Å; L536-L538 VanDerWaalsContact C-N 3.26Å; L536-L538 HydrophobicContact CB-CD1 4.29Å; L536-L538 HydrophobicContact CB-CG 4.32Å; L536-L538 PolarHBondContact O-N 2.68Å
537	G	87.9	Confident	91	Very high	70 Å²	70	47.4 Å²	47.4	72%	0.722	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	11.7	-177.9	0	0	0	0	0	114.7	R534 K535	R534-G537 PolarHBondContact O-N 2.94Å; K535-G537 PolarHBondContact O-N 3.27Å
538	L	86.9	Confident	90.6	Very high	59 Å²	59	50 Å²	50	31%	0.309	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-89.9	147.6	-178.5	-63.4	173.2	0	0	0	111.7	R533 L536	R533-L538 HydrophobicContact CG-CB 3.66Å; R533-L538 HydrophobicContact CG-CD1 4.3Å; R533-L538 PolarHBondContact O-N 3.36Å; L536-L538 VanDerWaalsContact C-N 3.26Å; L536-L538 HydrophobicContact CB-CD1 4.29Å; L536-L538 HydrophobicContact CB-CG 4.32Å; L536-L538 PolarHBondContact O-N 2.68Å
539	P	89.4	Confident	89.9	Confident	92 Å²	92	53.7 Å²	53.7	60%	0.597	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-68.9	148.6	-179.3	28.4	-35.7	0	0	0	112.5	R533	R533-P539 WeakPolarHBondContact CD-O 3.32Å; R533-P539 PolarHBondContact NE-O 3.31Å
540	H	92.6	Very high	89.4	Confident	48 Å²	48	61.4 Å²	61.4	22%	0.222	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-68.1	149.9	176.2	60.1	-75.3	0	0	0	112.5	D530 V542 E553 Y554 H578	D530-H540 HydrophobicContact CB-CB 4.48Å; H540-V542 PolarHBondContact CD2-O 2.95Å; H540-E553 IonicContact CD2-OE2 2.82Å; H540-E553 IonicContact CE1-OE2 2.69Å; H540-E553 IonicContact NE2-OE2 3.93Å; H540-E553 PolarHBondContact NE2-OE2 2.89Å; H540-Y554 HydrophobicContact CB-CD1 4.15Å; H540-Y554 HydrophobicContact CB-CG 4.5Å; H540-Y554 AromaticContact CG-CD1 3.84Å; H540-Y554 AromaticContact ND1-CD1 3.85Å; H540-H578 AromaticContact CD2-CE1 3.55Å; H540-H578 AromaticContact NE2-CE1 3.77Å; H540-H578 PolarHBondContact O-ND1 3.15Å
541	R	93.9	Very high	89.1	Confident	8 Å²	8	63.2 Å²	63.2	3%	0.03	36%	0.358	C	S	.	.			trans	-105.7	-5.6	-178	-64.8	176.7	-69.9	178.2	0.4	114.4	D530 L577 H578 I581 D583 R586 P587 F630	D530-R541 IonicContact OD1-CZ 3.22Å; D530-R541 IonicContact OD1-NE 3.37Å; D530-R541 PolarHBondContact OD1-NE 2.96Å; D530-R541 IonicContact OD1-NH2 4Å; D530-R541 PolarHBondContact OD1-NH2 3.22Å; D530-R541 VanDerWaalsContact OD2-CB 3.23Å; D530-R541 WeakPolarHBondContact OD2-CB 3.47Å; D530-R541 WeakPolarHBondContact OD2-CG 3.38Å; D530-R541 IonicContact OD2-CZ 2.76Å; D530-R541 PolarHBondContact OD2-N 3.48Å; D530-R541 IonicContact OD2-NE 3.05Å; D530-R541 PolarHBondContact OD2-NE 2.85Å; D530-R541 VanDerWaalsContact OD2-NE 3.09Å; D530-R541 IonicContact OD2-NH2 2.75Å; R541-L577 HydrophobicContact CB-CD1 4.35Å; R541-H578 WeakPolarHBondContact O-CB 3.42Å; R541-H578 VanDerWaalsContact O-CG 3.23Å; R541-H578 PolarHBondContact O-N 3.46Å; R541-I581 HydrophobicContact CB-CG2 3.74Å; R541-I581 HydrophobicContact CG-CG2 3.85Å; R541-D583 PolarHBondContact NH1-O 3.36Å; R541-D583 IonicContact NH1-OD1 2.64Å; R541-R586 PolarHBondContact NH1-O 3.3Å; R541-R586 PolarHBondContact NH2-O 2.89Å; R541-R586 VanDerWaalsContact NH2-O 3.11Å; R541-P587 PolarHBondContact NH2-O 2.98Å; R541-F630 VanDerWaalsContact NH1-CE2 3.29Å
542	V	93.6	Very high	89	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.7	-171.9	-60.4	0	0	0	0	112.4	A529 H540 F575 Q576 L577 I588	A529-V542 HydrophobicContact CB-CG2 3.35Å; H540-V542 PolarHBondContact CD2-O 2.95Å; V542-F575 HydrophobicContact CB-CB 4.26Å; V542-F575 HydrophobicContact CB-CD2 3.65Å; V542-F575 HydrophobicContact CB-CE2 4.31Å; V542-F575 HydrophobicContact CB-CG 4.21Å; V542-F575 HydrophobicContact CG1-CD2 3.42Å; V542-F575 VanDerWaalsContact CG1-CD2 3.42Å; V542-F575 HydrophobicContact CG1-CE2 3.62Å; V542-F575 HydrophobicContact CG1-CG 4.39Å; V542-F575 HydrophobicContact CG2-CB 4.47Å; V542-F575 HydrophobicContact CG2-CD2 4.15Å; V542-F575 HydrophobicContact CG2-CG 4.37Å; V542-Q576 CarbonylContact C-O 3.49Å; V542-Q576 VanDerWaalsContact CA-O 3.31Å; V542-Q576 WeakPolarHBondContact CA-O 3.35Å; V542-L577 HydrophobicContact CG1-CD1 3.79Å; V542-I588 HydrophobicContact CG1-CD1 3.59Å; V542-I588 HydrophobicContact CG1-CG2 4.33Å; V542-I588 HydrophobicContact CG2-CG2 4.44Å
543	S	92.8	Very high	89.1	Confident	25 Å²	25	64.8 Å²	64.8	18%	0.175	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.1	173.1	57.8	0	0	0	0	110.5	E553 F575 Q576	S543-E553 CarbonylContact C-O 3.37Å; S543-E553 VanDerWaalsContact CA-O 3.3Å; S543-E553 WeakPolarHBondContact CA-O 3.27Å; S543-F575 CarbonylContact O-C 3.17Å; S543-F575 WeakPolarHBondContact O-CA 3.45Å; S543-Q576 PolarHBondContact N-O 2.83Å; S543-Q576 PolarHBondContact O-N 2.82Å
544	F	94.1	Very high	89.2	Confident	5 Å²	5	66 Å²	66	2%	0.022	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136.6	173.8	-81.2	-81.5	0	0	0	111	F527 A529 R547 E553 Y554 Q556 A573 D574 F575	F527-F544 HydrophobicContact CB-CE1 4.12Å; F527-F544 HydrophobicContact CB-CZ 3.88Å; A529-F544 HydrophobicContact CB-CE2 3.82Å; A529-F544 HydrophobicContact CB-CZ 4.26Å; F544-R547 HydrophobicContact CB-CB 4.28Å; F544-R547 WeakPolarHBondContact O-CG 3.14Å; F544-E553 PolarHBondContact N-O 2.87Å; F544-Y554 VanDerWaalsContact CD2-C 3.47Å; F544-Y554 VanDerWaalsContact CE2-O 3.32Å; F544-Y554 WeakPolarHBondContact CE2-O 3.32Å; F544-Q556 HydrophobicContact CB-CB 3.8Å; F544-Q556 HydrophobicContact CD1-CB 3.86Å; F544-Q556 HydrophobicContact CD2-CB 4.35Å; F544-Q556 HydrophobicContact CG-CB 3.74Å; F544-A573 HydrophobicContact CD1-CB 3.9Å; F544-A573 HydrophobicContact CE1-CB 3.64Å; F544-D574 WeakPolarHBondContact CA-O 3.33Å; F544-F575 HydrophobicContact CD1-CB 3.83Å; F544-F575 HydrophobicContact CD2-CB 4.47Å; F544-F575 HydrophobicContact CE1-CB 3.89Å; F544-F575 HydrophobicContact CE1-CD1 4.04Å; F544-F575 HydrophobicContact CE1-CG 4.47Å; F544-F575 HydrophobicContact CG-CB 4.13Å; F544-F575 HydrophobicContact CZ-CB 4.27Å; F544-F575 HydrophobicContact CZ-CD1 4.16Å
545	L	90.4	Very high	89.3	Confident	54 Å²	54	63.6 Å²	63.6	28%	0.283	37%	0.366	S	S	.	.	S	Bend	trans	-82.3	-30	-174.7	-63.4	-171.9	0	0	0	113	R497 D574 Q576	R497-L545 VanDerWaalsContact NH1-CD2 3.25Å; L545-D574 HydrophobicContact CB-CB 4.25Å; L545-D574 WeakPolarHBondContact CB-O 3.43Å; L545-D574 HydrophobicContact CD1-CB 4.03Å; L545-D574 HydrophobicContact CG-CB 4.31Å; L545-D574 PolarHBondContact N-O 3.46Å; L545-Q576 HydrophobicContact CD2-CB 3.72Å; L545-Q576 HydrophobicContact CG-CB 4.25Å
546	G	83.8	Confident	89.6	Confident	47 Å²	47	57.1 Å²	57.1	49%	0.485	34%	0.338	S	S	.	.	S	Bend	trans	-92.1	0.4	179.9	0	0	0	0	0	115
547	R	87.3	Confident	89.9	Confident	88 Å²	88	53.8 Å²	53.8	33%	0.332	32%	0.323	S	S	.	.			trans	-59.2	148.8	-174.7	75.1	-179.2	-179.8	110.4	-4.9	113.6	F544 E551 E553 T555	F544-R547 HydrophobicContact CB-CB 4.28Å; F544-R547 WeakPolarHBondContact O-CG 3.14Å; R547-E551 HydrophobicContact CB-CB 4.46Å; R547-E551 PolarHBondContact NH1-O 3.04Å; R547-E553 VanDerWaalsContact CZ-CG 3.4Å; R547-E553 VanDerWaalsContact NH2-CG 3.26Å; R547-E553 IonicContact NH2-OE1 3.14Å; R547-T555 WeakPolarHBondContact CB-O 3.44Å
548	S	85.1	Confident	90.2	Very high	56 Å²	56	53.5 Å²	53.5	39%	0.392	30%	0.302	S	S	.	.			trans	-69.5	153.3	167.4	-177.3	0	0	0	0	111.4	L550 E551	S548-L550 PolarHBondContact O-N 3.23Å; S548-L550 VanDerWaalsContact O-N 3.15Å; S548-E551 WeakPolarHBondContact CB-OE2 3.35Å; S548-E551 PolarHBondContact N-OE2 2.86Å; S548-E551 PolarHBondContact O-N 3.29Å
549	S	81	Confident	90.6	Very high	118 Å²	118	55.5 Å²	55.5	83%	0.825	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-14.8	177.1	57.9	0	0	0	0	114
550	L	86.2	Confident	90.8	Very high	163 Å²	163	51.5 Å²	51.5	85%	0.853	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-13.3	174.5	-64.5	170.9	0	0	0	113.1	S548	S548-L550 PolarHBondContact O-N 3.23Å; S548-L550 VanDerWaalsContact O-N 3.15Å
551	E	85.9	Confident	90.9	Very high	37 Å²	37	53.9 Å²	53.9	17%	0.173	30%	0.295	C	S	.	.	S	Bend	trans	-92.2	148.1	-175.5	-71.4	175.9	134.9	0	0	112.2	R547 S548 T557	R547-E551 HydrophobicContact CB-CB 4.46Å; R547-E551 PolarHBondContact NH1-O 3.04Å; S548-E551 WeakPolarHBondContact CB-OE2 3.35Å; S548-E551 PolarHBondContact N-OE2 2.86Å; S548-E551 PolarHBondContact O-N 3.29Å; E551-T557 WeakPolarHBondContact OE1-CB 3.48Å; E551-T557 PolarHBondContact OE1-N 3.04Å; E551-T557 PolarHBondContact OE1-OG1 2.93Å
552	P	90.4	Very high	90.8	Very high	57 Å²	57	53.5 Å²	53.5	37%	0.37	29%	0.294	S	S	.	.			trans	-55.7	152.3	168.9	-21.9	32.9	0	0	0	112.2	Y554 T555	P552-Y554 HydrophobicContact CB-CD1 4.09Å; P552-Y554 HydrophobicContact CB-CD2 4.14Å; P552-Y554 HydrophobicContact CB-CE1 3.64Å; P552-Y554 HydrophobicContact CB-CE2 3.67Å; P552-Y554 HydrophobicContact CB-CG 4.33Å; P552-Y554 VanDerWaalsContact CB-CZ 3.41Å; P552-Y554 HydrophobicContact CG-CE2 4.14Å; P552-Y554 PolarHBondContact O-N 3.14Å; P552-T555 PolarHBondContact O-N 2.81Å; P552-T555 VanDerWaalsContact O-N 3.15Å
553	E	91.7	Very high	90.7	Very high	79 Å²	79	57.7 Å²	57.7	37%	0.369	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.5	179.5	-79.3	168.2	-178.4	0	0	114	H540 S543 F544 R547 T555	H540-E553 IonicContact CD2-OE2 2.82Å; H540-E553 IonicContact CE1-OE2 2.69Å; H540-E553 IonicContact NE2-OE2 3.93Å; H540-E553 PolarHBondContact NE2-OE2 2.89Å; S543-E553 CarbonylContact C-O 3.37Å; S543-E553 VanDerWaalsContact CA-O 3.3Å; S543-E553 WeakPolarHBondContact CA-O 3.27Å; F544-E553 PolarHBondContact N-O 2.87Å; R547-E553 VanDerWaalsContact CZ-CG 3.4Å; R547-E553 VanDerWaalsContact NH2-CG 3.26Å; R547-E553 IonicContact NH2-OE1 3.14Å; E553-T555 VanDerWaalsContact C-N 3.31Å; E553-T555 PolarHBondContact O-N 3.29Å
554	Y	92.3	Very high	90.5	Very high	59 Å²	59	64.7 Å²	64.7	23%	0.231	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	11.2	-177.5	56.4	-103.8	0	0	0	114.1	E528 A529 R534 H540 F544 P552	E528-Y554 WeakPolarHBondContact CA-O 3.43Å; A529-Y554 PolarHBondContact N-O 3.47Å; R534-Y554 VanDerWaalsContact CZ-CD2 3.43Å; H540-Y554 HydrophobicContact CB-CD1 4.15Å; H540-Y554 HydrophobicContact CB-CG 4.5Å; H540-Y554 AromaticContact CG-CD1 3.84Å; H540-Y554 AromaticContact ND1-CD1 3.85Å; F544-Y554 VanDerWaalsContact CD2-C 3.47Å; F544-Y554 VanDerWaalsContact CE2-O 3.32Å; F544-Y554 WeakPolarHBondContact CE2-O 3.32Å; P552-Y554 HydrophobicContact CB-CD1 4.09Å; P552-Y554 HydrophobicContact CB-CD2 4.14Å; P552-Y554 HydrophobicContact CB-CE1 3.64Å; P552-Y554 HydrophobicContact CB-CE2 3.67Å; P552-Y554 HydrophobicContact CB-CG 4.33Å; P552-Y554 VanDerWaalsContact CB-CZ 3.41Å; P552-Y554 HydrophobicContact CG-CE2 4.14Å; P552-Y554 PolarHBondContact O-N 3.14Å
555	T	93.7	Very high	90.4	Very high	7 Å²	7	65.6 Å²	65.6	4%	0.043	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	143.6	-179.4	-55.4	0	0	0	0	111.4	Q526 F527 E528 R547 P552 E553	Q526-T555 HydrophobicContact CG-CG2 3.87Å; F527-T555 VanDerWaalsContact O-CA 3.3Å; F527-T555 WeakPolarHBondContact O-CA 3.35Å; E528-T555 HydrophobicContact CG-CG2 4.32Å; R547-T555 WeakPolarHBondContact CB-O 3.44Å; P552-T555 PolarHBondContact O-N 2.81Å; P552-T555 VanDerWaalsContact O-N 3.15Å; E553-T555 VanDerWaalsContact C-N 3.31Å; E553-T555 PolarHBondContact O-N 3.29Å
556	Q	94.9	Very high	90.3	Very high	7 Å²	7	70.6 Å²	70.6	3%	0.033	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.5	166.2	178	175.3	-23.1	0	0	109.4	F527 F544 E558 A573	F527-Q556 PolarHBondContact N-O 2.8Å; F527-Q556 PolarHBondContact O-N 3.29Å; F544-Q556 HydrophobicContact CB-CB 3.8Å; F544-Q556 HydrophobicContact CD1-CB 3.86Å; F544-Q556 HydrophobicContact CD2-CB 4.35Å; F544-Q556 HydrophobicContact CG-CB 3.74Å; Q556-E558 PolarHBondContact NE2-OE1 2.04Å; Q556-A573 HydrophobicContact CB-CB 4.5Å; Q556-A573 HydrophobicContact CG-CB 4.42Å
557	T	94.6	Very high	90.7	Very high	51 Å²	51	71.8 Å²	71.8	31%	0.313	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.2	177.1	-50.4	0	0	0	0	111.2	V524 V525 E551	V524-T557 HydrophobicContact CG1-CG2 3.44Å; V524-T557 VanDerWaalsContact CG1-CG2 3.44Å; V525-T557 WeakPolarHBondContact O-CA 3.4Å; E551-T557 WeakPolarHBondContact OE1-CB 3.48Å; E551-T557 PolarHBondContact OE1-N 3.04Å; E551-T557 PolarHBondContact OE1-OG1 2.93Å
558	E	94.7	Very high	91	Very high	63 Å²	63	71.5 Å²	71.5	29%	0.294	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	154.1	177.7	-68.6	-61.4	154.4	0	0	111.4	V525 F527 Q556 A571	V525-E558 PolarHBondContact N-O 2.82Å; V525-E558 PolarHBondContact O-N 2.72Å; F527-E558 HydrophobicContact CE2-CB 4.32Å; F527-E558 HydrophobicContact CE2-CG 4.15Å; Q556-E558 PolarHBondContact NE2-OE1 2.04Å; E558-A571 HydrophobicContact CB-CB 3.82Å; E558-A571 HydrophobicContact CG-CB 4.18Å
559	E	94.6	Very high	91.5	Very high	102 Å²	102	71.4 Å²	71.4	48%	0.477	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	124.6	172.6	-68.1	-167	-170.5	0	0	111	T522 L523 K597	T522-E559 HydrophobicContact CG2-CB 3.97Å; T522-E559 HydrophobicContact CG2-CG 4.41Å; L523-E559 CarbonylContact O-C 3.59Å; L523-E559 WeakPolarHBondContact O-CA 3.21Å; E559-K597 IonicContact OE1-NZ 3.91Å; E559-K597 PolarHBondContact OE1-NZ 2.85Å; E559-K597 IonicContact OE2-NZ 3.97Å; E559-K597 PolarHBondContact OE2-NZ 3.14Å
560	V	94.3	Very high	92.2	Very high	7 Å²	7	68.6 Å²	68.6	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	108.2	178.2	-177.1	0	0	0	0	109.1	F508 T522 L523 V525 L562 H569 A571	F508-V560 HydrophobicContact CD2-CG1 4.45Å; F508-V560 HydrophobicContact CD2-CG2 4.13Å; F508-V560 HydrophobicContact CE2-CG2 4.38Å; T522-V560 WeakPolarHBondContact CA-O 3.44Å; L523-V560 HydrophobicContact CB-CB 4.4Å; L523-V560 PolarHBondContact N-O 2.99Å; L523-V560 PolarHBondContact O-N 2.83Å; V525-V560 HydrophobicContact CG2-CG2 3.88Å; V560-L562 HydrophobicContact CG1-CD2 3.95Å; V560-L562 HydrophobicContact CG1-CG 4.31Å; V560-H569 HydrophobicContact CG1-CB 3.65Å; V560-A571 HydrophobicContact CG2-CB 3.7Å
561	E	94.2	Very high	92.6	Very high	99 Å²	99	61.2 Å²	61.2	46%	0.463	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.2	171.7	-72.8	-170.6	-169.8	0	0	110.7	H520 T522 H563	H520-E561 IonicContact CE1-OE2 2.73Å; T522-E561 HydrophobicContact CG2-CG 4.21Å; E561-H563 IonicContact OE2-CE1 2.68Å; E561-H563 PolarHBondContact OE2-CE1 2.83Å; E561-H563 VanDerWaalsContact OE2-CE1 3.26Å
562	L	92.5	Very high	93	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.7	173.4	-57.4	174.6	0	0	0	107.4	F508 F510 H520 I521 L523 V560 H569	F508-L562 HydrophobicContact CB-CD1 4.43Å; F510-L562 HydrophobicContact CB-CD1 4.4Å; F510-L562 HydrophobicContact CD1-CB 3.77Å; F510-L562 HydrophobicContact CD1-CD1 3.87Å; F510-L562 HydrophobicContact CD1-CG 4.4Å; F510-L562 HydrophobicContact CE1-CB 3.8Å; H520-L562 PolarHBondContact ND1-O 2.97Å; H520-L562 VanDerWaalsContact ND1-O 3.11Å; I521-L562 HydrophobicContact CD1-CB 4.42Å; I521-L562 HydrophobicContact CD1-CD1 4.13Å; I521-L562 HydrophobicContact CG1-CB 3.83Å; I521-L562 HydrophobicContact CG1-CD1 4.27Å; I521-L562 HydrophobicContact CG1-CG 4.48Å; I521-L562 PolarHBondContact N-O 2.99Å; I521-L562 PolarHBondContact O-N 3.37Å; L523-L562 HydrophobicContact CD1-CD1 3.66Å; L523-L562 HydrophobicContact CG-CD1 3.99Å; V560-L562 HydrophobicContact CG1-CD2 3.95Å; V560-L562 HydrophobicContact CG1-CG 4.31Å; L562-H569 HydrophobicContact CD2-CB 3.77Å
563	H	89.8	Confident	93.2	Very high	88 Å²	88	59.9 Å²	59.9	41%	0.407	29%	0.286	S	S	.	.			trans	-85.5	-30.3	-175.9	-58.7	-57.6	0	0	0	112.9	H520 E561	H520-H563 AromaticContact CE1-CE1 3.75Å; H520-H563 AromaticContact CE1-ND1 3.34Å; H520-H563 PolarHBondContact CE1-ND1 3.09Å; H520-H563 VanDerWaalsContact CE1-ND1 3.34Å; H520-H563 AromaticContact ND1-ND1 3.33Å; H520-H563 PolarHBondContact ND1-ND1 3.36Å; E561-H563 IonicContact OE2-CE1 2.68Å; E561-H563 PolarHBondContact OE2-CE1 2.83Å; E561-H563 VanDerWaalsContact OE2-CE1 3.26Å
564	R	89.6	Confident	93.3	Very high	171 Å²	171	59 Å²	59	65%	0.645	28%	0.284	S	S	*	.	S	Bend	trans	-141	154.7	-178.4	-64.3	-178.9	175.9	154.8	0.9	113.4	F510 S518 E567	F510-R564 WeakPolarHBondContact CE1-O 3.33Å; S518-R564 VanDerWaalsContact OG-CA 3.31Å; S518-R564 WeakPolarHBondContact OG-CA 3.13Å; R564-E567 HydrophobicContact CB-CB 4.41Å; R564-E567 PolarHBondContact N-OE2 2.84Å; R564-E567 WeakPolarHBondContact O-CB 3.48Å; R564-E567 PolarHBondContact O-N 2.87Å
565	Q	90.9	Very high	93.4	Very high	25 Å²	25	56.3 Å²	56.3	12%	0.117	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	143.7	166.1	-77	-156.6	45.1	0	0	110.6	F510 A512 Y517 S518 E567	F510-Q565 HydrophobicContact CD2-CG 4.09Å; F510-Q565 HydrophobicContact CE2-CB 4.45Å; F510-Q565 HydrophobicContact CE2-CG 3.57Å; F510-Q565 HydrophobicContact CZ-CG 4.01Å; F510-Q565 WeakPolarHBondContact O-CA 3.46Å; A512-Q565 VanDerWaalsContact N-CD 3.31Å; A512-Q565 PolarHBondContact O-NE2 3.13Å; A512-Q565 PolarHBondContact O-OE1 3Å; Y517-Q565 PolarHBondContact O-NE2 2.87Å; S518-Q565 PolarHBondContact OG-N 2.88Å; S518-Q565 VanDerWaalsContact OG-N 3.11Å; Q565-E567 PolarHBondContact O-N 2.88Å
566	R	89.7	Confident	93.3	Very high	159 Å²	159	57.2 Å²	57.2	60%	0.6	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	17.6	178.5	-52.9	179.8	-176.4	175.2	1.3	115.4	M509 F510 T511	M509-R566 HydrophobicContact SD-CB 4.27Å; F510-R566 PolarHBondContact O-N 2.83Å; T511-R566 HydrophobicContact CG2-CG 3.98Å
567	E	91.6	Very high	93.2	Very high	71 Å²	71	57.4 Å²	57.4	33%	0.332	28%	0.278	S	S	.	.			trans	-96	129.7	169.1	-156.1	171.8	-171.7	0	0	109	R564 Q565 H569	R564-E567 HydrophobicContact CB-CB 4.41Å; R564-E567 PolarHBondContact N-OE2 2.84Å; R564-E567 WeakPolarHBondContact O-CB 3.48Å; R564-E567 PolarHBondContact O-N 2.87Å; Q565-E567 PolarHBondContact O-N 2.88Å; E567-H569 WeakPolarHBondContact CG-NE2 3.42Å; E567-H569 IonicContact OE1-NE2 3.99Å; E567-H569 IonicContact OE2-NE2 3.28Å
568	T	93.6	Very high	93.1	Very high	83 Å²	83	57.8 Å²	57.8	51%	0.509	28%	0.276	S	S	.	.			trans	-101.8	121.6	-176.7	-53.6	0	0	0	0	110.5	C507 F508	C507-T568 HydrophobicContact CB-CG2 3.94Å; F508-T568 WeakPolarHBondContact O-CA 3.25Å
569	H	95.4	Very high	92.3	Very high	53 Å²	53	61.7 Å²	61.7	25%	0.245	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148	174	-62.2	-106.7	0	0	0	109.9	F508 V560 L562 E567	F508-H569 PolarHBondContact N-O 3.48Å; F508-H569 PolarHBondContact O-N 3.4Å; V560-H569 HydrophobicContact CG1-CB 3.65Å; L562-H569 HydrophobicContact CD2-CB 3.77Å; E567-H569 WeakPolarHBondContact CG-NE2 3.42Å; E567-H569 IonicContact OE1-NE2 3.99Å; E567-H569 IonicContact OE2-NE2 3.28Å
570	C	95	Very high	91.5	Very high	59 Å²	59	64.1 Å²	64.1	40%	0.399	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.8	-174.4	-42.5	0	0	0	0	112.3	K505 A506 C507	K505-C570 HydrophobicContact CG-CB 4.24Å; A506-C570 CarbonylContact O-C 3.28Å; A506-C570 WeakPolarHBondContact O-CA 3.18Å; C507-C570 HydrophobicContact CB-CB 3.98Å; C507-C570 WeakPolarHBondContact CB-SG 3.41Å; C507-C570 WeakPolarHBondContact SG-CB 3.43Å; C507-C570 CovalentContact SG-SG 2.04Å; C507-C570 PolarHBondContact SG-SG 2.87Å
571	A	95.1	Very high	91	Very high	8 Å²	8	64.6 Å²	64.6	7%	0.066	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	151.3	162.8	0	0	0	0	0	110	K505 A506 F527 E558 V560	K505-A571 WeakPolarHBondContact CA-O 3.36Å; A506-A571 PolarHBondContact N-O 3.08Å; A506-A571 PolarHBondContact O-N 2.98Å; F527-A571 HydrophobicContact CE2-CB 4.01Å; F527-A571 HydrophobicContact CZ-CB 3.97Å; E558-A571 HydrophobicContact CB-CB 3.82Å; E558-A571 HydrophobicContact CG-CB 4.18Å; V560-A571 HydrophobicContact CG2-CB 3.7Å
572	T	94.7	Very high	90.2	Very high	67 Å²	67	66.3 Å²	66.3	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	125.2	178.1	47.6	0	0	0	0	109.4	V504 K505	V504-T572 WeakPolarHBondContact O-CA 3.44Å; K505-T572 HydrophobicContact CB-CG2 3.96Å; K505-T572 HydrophobicContact CD-CG2 4.24Å; K505-T572 HydrophobicContact CG-CG2 3.83Å
573	A	94.7	Very high	89.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.6	176.4	0	0	0	0	0	109.8	V504 F527 F544 Q556	V504-A573 WeakPolarHBondContact CB-O 3.49Å; V504-A573 PolarHBondContact N-O 3.01Å; V504-A573 PolarHBondContact O-N 2.9Å; F527-A573 HydrophobicContact CB-CB 4.08Å; F527-A573 HydrophobicContact CD1-CB 3.86Å; F527-A573 HydrophobicContact CD2-CB 3.66Å; F527-A573 HydrophobicContact CE1-CB 4.15Å; F527-A573 HydrophobicContact CE2-CB 3.96Å; F527-A573 HydrophobicContact CG-CB 3.6Å; F527-A573 HydrophobicContact CZ-CB 4.2Å; F544-A573 HydrophobicContact CD1-CB 3.9Å; F544-A573 HydrophobicContact CE1-CB 3.64Å; Q556-A573 HydrophobicContact CB-CB 4.5Å; Q556-A573 HydrophobicContact CG-CB 4.42Å
574	D	93.8	Very high	89.4	Confident	61 Å²	61	65.5 Å²	65.5	33%	0.326	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.5	179.2	-66.8	-13.4	0	0	0	109.5	V502 E503 F544 L545	V502-D574 WeakPolarHBondContact O-CA 3.25Å; E503-D574 WeakPolarHBondContact CA-OD1 3.36Å; E503-D574 WeakPolarHBondContact CB-OD1 3.44Å; E503-D574 WeakPolarHBondContact CG-OD1 3.46Å; F544-D574 WeakPolarHBondContact CA-O 3.33Å; L545-D574 HydrophobicContact CB-CB 4.25Å; L545-D574 WeakPolarHBondContact CB-O 3.43Å; L545-D574 HydrophobicContact CD1-CB 4.03Å; L545-D574 HydrophobicContact CG-CB 4.31Å; L545-D574 PolarHBondContact N-O 3.46Å
575	F	93.9	Very high	89	Confident	1 Å²	1	58.1 Å²	58.1	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	141.9	170.1	69.6	-102.7	0	0	0	112.3	C501 V502 V504 V542 S543 F544 I588 L590 V628	C501-F575 CarbonylContact C-O 3.41Å; C501-F575 VanDerWaalsContact CA-O 3.28Å; C501-F575 WeakPolarHBondContact CA-O 3.17Å; V502-F575 HydrophobicContact CB-CD1 4.31Å; V502-F575 HydrophobicContact CB-CD2 4.28Å; V502-F575 HydrophobicContact CB-CE1 3.79Å; V502-F575 HydrophobicContact CB-CE2 3.75Å; V502-F575 HydrophobicContact CB-CZ 3.5Å; V502-F575 HydrophobicContact CG1-CE1 3.97Å; V502-F575 HydrophobicContact CG1-CZ 3.87Å; V502-F575 HydrophobicContact CG2-CD2 4.47Å; V502-F575 HydrophobicContact CG2-CE2 3.69Å; V502-F575 HydrophobicContact CG2-CZ 3.72Å; V502-F575 PolarHBondContact N-O 2.82Å; V502-F575 PolarHBondContact O-N 3.35Å; V504-F575 HydrophobicContact CG2-CD1 3.93Å; V504-F575 HydrophobicContact CG2-CE1 3.65Å; V542-F575 HydrophobicContact CB-CB 4.26Å; V542-F575 HydrophobicContact CB-CD2 3.65Å; V542-F575 HydrophobicContact CB-CE2 4.31Å; V542-F575 HydrophobicContact CB-CG 4.21Å; V542-F575 HydrophobicContact CG1-CD2 3.42Å; V542-F575 VanDerWaalsContact CG1-CD2 3.42Å; V542-F575 HydrophobicContact CG1-CE2 3.62Å; V542-F575 HydrophobicContact CG1-CG 4.39Å; V542-F575 HydrophobicContact CG2-CB 4.47Å; V542-F575 HydrophobicContact CG2-CD2 4.15Å; V542-F575 HydrophobicContact CG2-CG 4.37Å; S543-F575 CarbonylContact O-C 3.17Å; S543-F575 WeakPolarHBondContact O-CA 3.45Å; F544-F575 HydrophobicContact CD1-CB 3.83Å; F544-F575 HydrophobicContact CD2-CB 4.47Å; F544-F575 HydrophobicContact CE1-CB 3.89Å; F544-F575 HydrophobicContact CE1-CD1 4.04Å; F544-F575 HydrophobicContact CE1-CG 4.47Å; F544-F575 HydrophobicContact CG-CB 4.13Å; F544-F575 HydrophobicContact CZ-CB 4.27Å; F544-F575 HydrophobicContact CZ-CD1 4.16Å; F575-I588 HydrophobicContact CE2-CD1 3.92Å; F575-I588 HydrophobicContact CZ-CD1 4.35Å; F575-I588 HydrophobicContact CZ-CG2 4.37Å; F575-L590 HydrophobicContact CD1-CD2 4.33Å; F575-L590 HydrophobicContact CE1-CD1 4.31Å; F575-L590 HydrophobicContact CE1-CD2 3.81Å; F575-V628 HydrophobicContact CE1-CG2 4.31Å; F575-V628 HydrophobicContact CZ-CG2 3.96Å
576	Q	92.8	Very high	88.7	Confident	27 Å²	27	61.6 Å²	61.6	13%	0.126	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.9	175.6	-180	176.2	6.7	0	0	110.1	D498 V500 V542 S543 L545	D498-Q576 PolarHBondContact O-NE2 3.43Å; V500-Q576 WeakPolarHBondContact O-CA 3.27Å; V542-Q576 CarbonylContact C-O 3.49Å; V542-Q576 VanDerWaalsContact CA-O 3.31Å; V542-Q576 WeakPolarHBondContact CA-O 3.35Å; S543-Q576 PolarHBondContact N-O 2.83Å; S543-Q576 PolarHBondContact O-N 2.82Å; L545-Q576 HydrophobicContact CD2-CB 3.72Å; L545-Q576 HydrophobicContact CG-CB 4.25Å
577	L	92.5	Very high	88.7	Confident	10 Å²	10	55.4 Å²	55.4	5%	0.052	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.9	176	-168.1	74.2	0	0	0	111.6	I487 L489 V500 R541 V542 I581 I588 F630	I487-L577 HydrophobicContact CG2-CD2 4.1Å; L489-L577 HydrophobicContact CD2-CD2 3.31Å; V500-L577 HydrophobicContact CB-CB 4.38Å; V500-L577 PolarHBondContact O-N 2.8Å; R541-L577 HydrophobicContact CB-CD1 4.35Å; V542-L577 HydrophobicContact CG1-CD1 3.79Å; L577-I581 HydrophobicContact CD1-CD1 4.18Å; L577-I581 HydrophobicContact CD1-CG2 4.34Å; L577-I581 HydrophobicContact CD2-CD1 3.83Å; L577-I581 HydrophobicContact CD2-CG1 4.29Å; L577-I581 HydrophobicContact CG-CD1 4.29Å; L577-I581 HydrophobicContact CG-CG2 4.45Å; L577-I588 HydrophobicContact CD1-CD1 3.84Å; L577-F630 HydrophobicContact CD1-CE1 4.11Å; L577-F630 HydrophobicContact CD1-CZ 4.04Å; L577-F630 HydrophobicContact CD2-CE1 3.98Å
578	H	91.3	Very high	88.8	Confident	60 Å²	60	52 Å²	52	28%	0.278	26%	0.26	S	S	.	.			trans	-70.3	139.4	174.8	-60.7	169.6	0	0	0	111.5	H540 R541 N580 I581	H540-H578 AromaticContact CD2-CE1 3.55Å; H540-H578 AromaticContact NE2-CE1 3.77Å; H540-H578 PolarHBondContact O-ND1 3.15Å; R541-H578 WeakPolarHBondContact O-CB 3.42Å; R541-H578 VanDerWaalsContact O-CG 3.23Å; R541-H578 PolarHBondContact O-N 3.46Å; H578-N580 VanDerWaalsContact C-N 3.26Å; H578-N580 PolarHBondContact O-N 3.19Å; H578-N580 VanDerWaalsContact O-N 3.16Å; H578-I581 HydrophobicContact CB-CG2 4.15Å; H578-I581 WeakPolarHBondContact O-CG2 3.5Å
579	E	79	Confident	88.9	Confident	145 Å²	145	48.7 Å²	48.7	68%	0.678	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.2	-172.4	-61.3	-166.9	142.9	0	0	114.9
580	N	76.9	Confident	88.8	Confident	152 Å²	152	46.3 Å²	46.3	81%	0.813	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.4	42.1	-173.3	-71	-61.5	0	0	0	113.6	H578 R582	H578-N580 VanDerWaalsContact C-N 3.26Å; H578-N580 PolarHBondContact O-N 3.19Å; H578-N580 VanDerWaalsContact O-N 3.16Å; N580-R582 PolarHBondContact O-N 3.06Å
581	I	83.4	Confident	88.9	Confident	18 Å²	18	43.8 Å²	43.8	9%	0.092	21%	0.213	C	C	.	.			trans	-70.4	123	177.9	55.6	150.2	0	0	0	112.7	L489 R541 L577 H578 K584 F630	L489-I581 HydrophobicContact CD2-CD1 4.36Å; R541-I581 HydrophobicContact CB-CG2 3.74Å; R541-I581 HydrophobicContact CG-CG2 3.85Å; L577-I581 HydrophobicContact CD1-CD1 4.18Å; L577-I581 HydrophobicContact CD1-CG2 4.34Å; L577-I581 HydrophobicContact CD2-CD1 3.83Å; L577-I581 HydrophobicContact CD2-CG1 4.29Å; L577-I581 HydrophobicContact CG-CD1 4.29Å; L577-I581 HydrophobicContact CG-CG2 4.45Å; H578-I581 HydrophobicContact CB-CG2 4.15Å; H578-I581 WeakPolarHBondContact O-CG2 3.5Å; I581-K584 HydrophobicContact CD1-CG 3.78Å; I581-K584 HydrophobicContact CG1-CG 4.23Å; I581-K584 WeakPolarHBondContact O-CE 3.28Å; I581-F630 HydrophobicContact CD1-CD1 4.34Å; I581-F630 HydrophobicContact CD1-CE1 3.46Å; I581-F630 VanDerWaalsContact CD1-CE1 3.46Å; I581-F630 HydrophobicContact CD1-CZ 3.77Å
582	R	78.3	Confident	88.9	Confident	135 Å²	135	43.7 Å²	43.7	51%	0.509	21%	0.211	S	C	.	.	S	Bend	trans	-73.1	-43.5	169.6	-69.6	-174	176.8	-140.3	-5.5	111.7	N580 K584 D743 N746	N580-R582 PolarHBondContact O-N 3.06Å; R582-K584 PolarHBondContact O-N 3.16Å; R582-D743 IonicContact CZ-OD1 3.48Å; R582-D743 IonicContact CZ-OD2 2.77Å; R582-D743 VanDerWaalsContact CZ-OD2 3.23Å; R582-D743 VanDerWaalsContact NH1-CG 3.31Å; R582-D743 IonicContact NH1-OD1 3.34Å; R582-D743 PolarHBondContact NH1-OD1 3.16Å; R582-D743 IonicContact NH1-OD2 2.73Å; R582-D743 PolarHBondContact NH1-OD2 2.97Å; R582-D743 VanDerWaalsContact NH1-OD2 3.12Å; R582-D743 IonicContact NH2-OD1 3.08Å; R582-D743 IonicContact NH2-OD2 2.99Å; R582-D743 PolarHBondContact NH2-OD2 3.09Å; R582-N746 PolarHBondContact O-ND2 2.96Å; R582-N746 PolarHBondContact O-OD1 2.59Å
583	D	81.8	Confident	88.9	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.027	21%	0.205	C	C	.	.			trans	-89.2	103.5	-175.7	-167	-27.9	0	0	0	111.5	R533 R541 L585 R586 I781	R533-D583 IonicContact CZ-OD2 3.88Å; R533-D583 IonicContact NH1-OD2 3.74Å; R533-D583 PolarHBondContact NH1-OD2 3.34Å; R541-D583 PolarHBondContact NH1-O 3.36Å; R541-D583 IonicContact NH1-OD1 2.64Å; D583-L585 PolarHBondContact OD1-N 2.94Å; D583-R586 PolarHBondContact OD1-N 2.88Å; D583-R586 VanDerWaalsContact OD1-N 3.11Å; D583-R586 IonicContact OD2-CZ 3.86Å; D583-R586 IonicContact OD2-NE 2.99Å; D583-R586 PolarHBondContact OD2-NE 3.49Å; D583-R586 IonicContact OD2-NH2 2.69Å; D583-R586 PolarHBondContact OD2-NH2 2.84Å; D583-I781 HydrophobicContact CB-CD1 4.43Å
584	K	82.8	Confident	88.8	Confident	66 Å²	66	43.1 Å²	43.1	29%	0.287	21%	0.207	S	C	.	.			trans	-111.8	9.1	-178.1	-61.3	177.5	172.5	-171.3	0	113	L489 I581 R582 F630	L489-K584 HydrophobicContact CD1-CB 4.48Å; L489-K584 HydrophobicContact CD1-CD 3.57Å; L489-K584 HydrophobicContact CD1-CG 3.92Å; I581-K584 HydrophobicContact CD1-CG 3.78Å; I581-K584 HydrophobicContact CG1-CG 4.23Å; I581-K584 WeakPolarHBondContact O-CE 3.28Å; R582-K584 PolarHBondContact O-N 3.16Å; K584-F630 WeakPolarHBondContact O-CB 3.35Å; K584-F630 WeakPolarHBondContact O-CG 3.35Å
585	L	80.9	Confident	88.7	Confident	16 Å²	16	42.9 Å²	42.9	8%	0.084	21%	0.21	C	C	.	.	S	Bend	trans	-112.5	-42.7	-178.2	-69.9	-169.2	0	0	0	113.3	D583 R632 C641 H706 I781	D583-L585 PolarHBondContact OD1-N 2.94Å; L585-R632 HydrophobicContact CD2-CG 4.35Å; L585-C641 HydrophobicContact CD1-CB 4.05Å; L585-C641 HydrophobicContact CD2-CB 4.46Å; L585-C641 VanDerWaalsContact CD2-SG 3.51Å; L585-H706 HydrophobicContact CD1-CB 3.84Å; L585-H706 HydrophobicContact CG-CB 3.92Å; L585-I781 HydrophobicContact CB-CD1 4.15Å; L585-I781 HydrophobicContact CD1-CD1 4.4Å; L585-I781 HydrophobicContact CD1-CG1 4.13Å; L585-I781 HydrophobicContact CG-CD1 4.22Å; L585-I781 HydrophobicContact CG-CG1 4.49Å
586	R	86	Confident	88.6	Confident	98 Å²	98	44.5 Å²	44.5	37%	0.37	22%	0.218	S	C	.	.	S	Bend	trans	-72.8	131.8	179.5	-75.5	-174	-72.9	-163.1	-11.9	109.9	R541 D583 F630	R541-R586 PolarHBondContact NH1-O 3.3Å; R541-R586 PolarHBondContact NH2-O 2.89Å; R541-R586 VanDerWaalsContact NH2-O 3.11Å; D583-R586 PolarHBondContact OD1-N 2.88Å; D583-R586 VanDerWaalsContact OD1-N 3.11Å; D583-R586 IonicContact OD2-CZ 3.86Å; D583-R586 IonicContact OD2-NE 2.99Å; D583-R586 PolarHBondContact OD2-NE 3.49Å; D583-R586 IonicContact OD2-NH2 2.69Å; D583-R586 PolarHBondContact OD2-NH2 2.84Å; R586-F630 WeakPolarHBondContact O-CD2 3.49Å; R586-F630 WeakPolarHBondContact O-CE2 3.35Å
587	P	89.9	Confident	88.4	Confident	29 Å²	29	47 Å²	47	19%	0.188	23%	0.229	C	C	.	.			trans	-59.3	159.8	178.9	24.8	-33.3	0	0	0	111.7	R541 S589 E627 V628	R541-P587 PolarHBondContact NH2-O 2.98Å; P587-S589 PolarHBondContact O-N 2.83Å; P587-E627 HydrophobicContact CB-CB 4.04Å; P587-E627 HydrophobicContact CB-CG 4.42Å; P587-E627 HydrophobicContact CG-CG 4.44Å; P587-E627 WeakPolarHBondContact CG-OE2 3.42Å; P587-V628 CarbonylContact C-O 3.55Å; P587-V628 VanDerWaalsContact CA-O 3.31Å; P587-V628 WeakPolarHBondContact CA-O 3.04Å; P587-V628 WeakPolarHBondContact CB-O 3.34Å
588	I	93.4	Very high	87.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	102.5	169.3	-50.4	-172.7	0	0	0	106.5	I487 A529 V542 F575 L577 L590 V628 F630	I487-I588 HydrophobicContact CD1-CD1 3.39Å; I487-I588 HydrophobicContact CD1-CG1 4.13Å; A529-I588 HydrophobicContact CB-CG2 4.25Å; V542-I588 HydrophobicContact CG1-CD1 3.59Å; V542-I588 HydrophobicContact CG1-CG2 4.33Å; V542-I588 HydrophobicContact CG2-CG2 4.44Å; F575-I588 HydrophobicContact CE2-CD1 3.92Å; F575-I588 HydrophobicContact CZ-CD1 4.35Å; F575-I588 HydrophobicContact CZ-CG2 4.37Å; L577-I588 HydrophobicContact CD1-CD1 3.84Å; I588-L590 HydrophobicContact CG2-CD2 4.5Å; I588-L590 PolarHBondContact O-N 2.83Å; I588-V628 HydrophobicContact CB-CB 4.38Å; I588-V628 PolarHBondContact N-O 3.03Å; I588-V628 PolarHBondContact O-N 2.87Å; I588-F630 HydrophobicContact CD1-CE2 4.16Å; I588-F630 HydrophobicContact CD1-CZ 3.74Å; I588-F630 HydrophobicContact CG1-CE2 3.68Å; I588-F630 HydrophobicContact CG1-CZ 3.79Å
589	S	94.5	Very high	87	Confident	12 Å²	12	55.2 Å²	55.2	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	123.3	176.7	41.7	0	0	0	0	110.1	A529 D530 T531 E532 P587	A529-S589 CarbonylContact C-O 3.58Å; A529-S589 WeakPolarHBondContact CA-O 3.43Å; D530-S589 PolarHBondContact N-O 2.78Å; T531-S589 PolarHBondContact N-O 2.95Å; T531-S589 PolarHBondContact N-OG 3.28Å; E532-S589 PolarHBondContact N-OG 2.94Å; P587-S589 PolarHBondContact O-N 2.83Å
590	L	94.9	Very high	86.3	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.3	176.7	-61.3	175.2	0	0	0	109.5	I482 V504 E528 A529 F575 I588 N625 S626 V628	I482-L590 HydrophobicContact CD1-CD1 3.81Å; V504-L590 HydrophobicContact CG1-CD1 4.16Å; V504-L590 HydrophobicContact CG2-CD1 3.67Å; E528-L590 CarbonylContact O-C 3.58Å; E528-L590 VanDerWaalsContact O-CA 3.29Å; E528-L590 WeakPolarHBondContact O-CA 3.24Å; A529-L590 HydrophobicContact CB-CD2 3.81Å; F575-L590 HydrophobicContact CD1-CD2 4.33Å; F575-L590 HydrophobicContact CE1-CD1 4.31Å; F575-L590 HydrophobicContact CE1-CD2 3.81Å; I588-L590 HydrophobicContact CG2-CD2 4.5Å; I588-L590 PolarHBondContact O-N 2.83Å; L590-N625 CarbonylContact O-C 3.58Å; L590-N625 WeakPolarHBondContact O-CA 3.26Å; L590-S626 PolarHBondContact N-O 3.45Å; L590-S626 PolarHBondContact O-N 3.5Å; L590-V628 HydrophobicContact CD1-CG2 3.64Å; L590-V628 HydrophobicContact CG-CG2 4.19Å
591	A	95.7	Very high	85.5	Confident	6 Å²	6	50 Å²	50	5%	0.05	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117	169.1	0	0	0	0	0	108.9	E528 T531 T623	E528-A591 HydrophobicContact CB-CB 4.45Å; E528-A591 PolarHBondContact N-O 3.1Å; E528-A591 PolarHBondContact O-N 3.06Å; T531-A591 HydrophobicContact CG2-CB 4.15Å; A591-T623 HydrophobicContact CB-CG2 4.04Å
592	I	94.9	Very high	84.4	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	103	-178.1	-55.9	170.3	0	0	0	107.3	V480 V504 A506 F508 V525 F527 T623 L624	V480-I592 HydrophobicContact CB-CD1 4.47Å; V480-I592 HydrophobicContact CG1-CD1 3.75Å; V480-I592 HydrophobicContact CG2-CD1 3.9Å; V504-I592 HydrophobicContact CG1-CD1 3.91Å; A506-I592 HydrophobicContact CB-CG2 4.29Å; F508-I592 HydrophobicContact CZ-CG2 4.47Å; V525-I592 HydrophobicContact CG1-CG2 3.96Å; F527-I592 HydrophobicContact CD1-CD1 4.19Å; F527-I592 HydrophobicContact CD1-CG1 3.87Å; F527-I592 HydrophobicContact CD1-CG2 4.19Å; F527-I592 HydrophobicContact CE1-CD1 4.19Å; F527-I592 HydrophobicContact CE1-CG1 4.25Å; F527-I592 HydrophobicContact CE1-CG2 4.07Å; I592-T623 CarbonylContact O-C 3.52Å; I592-T623 WeakPolarHBondContact O-CA 3.21Å; I592-L624 HydrophobicContact CB-CB 4.48Å; I592-L624 PolarHBondContact N-O 2.92Å; I592-L624 PolarHBondContact O-N 3.02Å
593	T	94.8	Very high	83.1	Confident	46 Å²	46	64.7 Å²	64.7	28%	0.282	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.2	-176.6	-57.2	0	0	0	0	110.1	V525 Q526 T623	V525-T593 CarbonylContact C-O 3.58Å; V525-T593 WeakPolarHBondContact CA-O 3.42Å; Q526-T593 PolarHBondContact N-O 3.23Å; Q526-T593 PolarHBondContact O-N 3.01Å; T593-T623 WeakPolarHBondContact OG1-CG2 3.24Å; T593-T623 PolarHBondContact OG1-OG1 3.34Å
594	H	93.2	Very high	81.5	Confident	9 Å²	9	71.3 Å²	71.3	4%	0.042	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	146.6	176.7	71.5	-68.5	0	0	0	112	F508 V524 V525 K622	F508-H594 HydrophobicContact CE1-CB 4.06Å; V524-H594 WeakPolarHBondContact O-CA 3.46Å; V525-H594 HydrophobicContact CG2-CB 4.35Å; H594-K622 PolarHBondContact CE1-O 3.08Å; H594-K622 PolarHBondContact N-O 3.04Å; H594-K622 VanDerWaalsContact N-O 3.1Å; H594-K622 PolarHBondContact ND1-O 3.14Å
595	S	92.8	Very high	79.8	Confident	55 Å²	55	72.6 Å²	72.6	39%	0.385	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.2	177.3	60.6	0	0	0	0	110.5	L523 V524	L523-S595 CarbonylContact C-O 3.48Å; L523-S595 VanDerWaalsContact CA-O 3.27Å; L523-S595 WeakPolarHBondContact CA-O 3.33Å; V524-S595 PolarHBondContact N-O 2.98Å; V524-S595 PolarHBondContact O-N 3.48Å
596	I	90.7	Very high	78.6	Confident	35 Å²	35	76.1 Å²	76.1	18%	0.179	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129	170.4	-68.5	166.2	0	0	0	108.4	I474 L523 P598 L616	I474-I596 HydrophobicContact CD1-CD1 4.16Å; L523-I596 HydrophobicContact CD2-CG1 3.82Å; I596-P598 WeakPolarHBondContact O-CD 3.49Å; I596-L616 HydrophobicContact CD1-CD2 3.74Å; I596-L616 HydrophobicContact CD1-CG 3.7Å; I596-L616 HydrophobicContact CG1-CD1 4.32Å; I596-L616 HydrophobicContact CG1-CD2 3.79Å; I596-L616 HydrophobicContact CG1-CG 3.75Å
597	K	89.1	Confident	77.1	Confident	81 Å²	81	80 Å²	80	35%	0.352	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-62	118.9	174.1	-172.4	163.9	172.9	166.7	0	109.9	T522 V524 E559 V599	T522-K597 HydrophobicContact CG2-CB 4.48Å; T522-K597 HydrophobicContact CG2-CD 4.09Å; T522-K597 WeakPolarHBondContact O-CB 3.49Å; T522-K597 PolarHBondContact O-N 2.97Å; V524-K597 HydrophobicContact CG2-CB 3.9Å; V524-K597 HydrophobicContact CG2-CD 4.34Å; V524-K597 HydrophobicContact CG2-CG 4.22Å; E559-K597 IonicContact OE1-NZ 3.91Å; E559-K597 PolarHBondContact OE1-NZ 2.85Å; E559-K597 IonicContact OE2-NZ 3.97Å; E559-K597 PolarHBondContact OE2-NZ 3.14Å; K597-V599 PolarHBondContact O-N 3.33Å
598	P	80.8	Confident	75.8	Confident	118 Å²	118	88.8 Å²	88.8	77%	0.766	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-62.6	124.9	-179	-23.8	34.5	0	0	0	111.5	I596	I596-P598 WeakPolarHBondContact O-CD 3.49Å
599	V	72.7	Confident	74.5	Confident	123 Å²	123	90.7 Å²	90.7	75%	0.745	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-91.7	119.9	174.7	-178.7	0	0	0	0	108.7	K597	K597-V599 PolarHBondContact O-N 3.33Å
600	P	65.1	Low	73.4	Confident	105 Å²	105	94 Å²	94	68%	0.682	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-58.3	137.9	178.6	-25.1	34.4	0	0	0	111.9	R602	P600-R602 PolarHBondContact O-N 3.49Å
601	P	60	Low	72.7	Confident	82 Å²	82	101.2 Å²	101.2	53%	0.532	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-60.9	126.8	-178.2	23.8	-33.7	0	0	0	111	R603	P601-R603 PolarHBondContact O-N 3.41Å; P601-R603 VanDerWaalsContact O-N 3.12Å
602	R	59.1	Low	72.2	Confident	215 Å²	215	101.4 Å²	101.4	81%	0.811	52%	0.517	S	S	*	.			trans	-70.1	108.4	174.4	-75.1	-173.7	174.5	-172.5	-0.6	109	P600 N604	P600-R602 PolarHBondContact O-N 3.49Å; R602-N604 PolarHBondContact O-N 3.32Å
603	R	51.5	Low	71.8	Confident	247 Å²	247	104.6 Å²	104.6	93%	0.932	54%	0.538	S	S	*	.			trans	-52.8	98.2	168.8	-81.3	-178.1	165	177.9	-4.1	110.8	P601	P601-R603 PolarHBondContact O-N 3.41Å; P601-R603 VanDerWaalsContact O-N 3.12Å
604	N	49.1	Very low	71.5	Confident	144 Å²	144	103.6 Å²	103.6	77%	0.77	53%	0.533	S	S	*	.			trans	-154.1	131.1	170.7	-101.8	-24.7	0	0	0	113.3	R602	R602-N604 PolarHBondContact O-N 3.32Å
605	S	46.8	Very low	71.5	Confident	94 Å²	94	104.8 Å²	104.8	66%	0.657	54%	0.54	S	S	*	.			trans	45.8	100.4	167.1	59.8	0	0	0	0	118.8	K607	S605-K607 PolarHBondContact O-N 2.75Å
606	A	54.8	Low	71.3	Confident	89 Å²	89	102.9 Å²	102.9	74%	0.736	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	47.2	173.2	0	0	0	0	0	115
607	K	55.8	Low	71.1	Confident	181 Å²	181	102.2 Å²	102.2	79%	0.787	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.3	-1.5	-179.3	-74.1	-162.7	174.3	-167.9	0	115.7	S605	S605-K607 PolarHBondContact O-N 2.75Å
608	R	61.6	Low	70.7	Confident	213 Å²	213	101.6 Å²	101.6	80%	0.804	52%	0.522	S	S	*	.	S	Bend	trans	-142.7	149.4	171	-74.8	-169.4	174.4	-168.7	-4.5	109
609	P	66	Low	70.4	Confident	39 Å²	39	98.7 Å²	98.7	25%	0.253	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-53.6	140.2	169.9	-22.7	32.9	0	0	0	110.7	L47 I101	L47-P609 HydrophobicContact CD1-CG 4.24Å; I101-P609 HydrophobicContact CG2-CG 4.04Å
610	Q	72.7	Confident	70.7	Confident	82 Å²	82	97 Å²	97	38%	0.383	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-70.1	140.1	174.6	-171.7	175.8	-40.1	0	0	109.2	R469 L612	R469-Q610 PolarHBondContact NH1-O 2.87Å; R469-Q610 VanDerWaalsContact NH1-O 3.07Å; Q610-L612 PolarHBondContact O-N 3.26Å
611	K	78.9	Confident	71.6	Confident	155 Å²	155	95.5 Å²	95.5	67%	0.674	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-63.1	125.3	172	-174.9	167.3	-172.4	164.1	0	109.2
612	L	85.7	Confident	72.9	Confident	11 Å²	11	94.6 Å²	94.6	6%	0.058	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-67.8	143.6	-176.5	-64.1	179.9	0	0	0	112	D42 R469 Q610	D42-L612 HydrophobicContact CB-CD1 4.07Å; D42-L612 HydrophobicContact CB-CD2 4.01Å; D42-L612 VanDerWaalsContact OD2-CD2 3.25Å; D42-L612 WeakPolarHBondContact OD2-CD2 3.07Å; R469-L612 HydrophobicContact CB-CD1 3.69Å; Q610-L612 PolarHBondContact O-N 3.26Å
613	P	86.3	Confident	74.4	Confident	72 Å²	72	86.5 Å²	86.5	47%	0.468	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-70.3	149.5	167.9	32.4	-33.7	0	0	0	109.9
614	P	89.8	Confident	76.3	Confident	26 Å²	26	77 Å²	77	17%	0.169	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-73.5	156.2	174.5	30.4	-33.9	0	0	0	112.2	P472 I474 I521	P472-P614 HydrophobicContact CB-CB 4.49Å; P472-P614 CarbonylContact O-C 3.58Å; P472-P614 WeakPolarHBondContact O-CA 3.5Å; P472-P614 WeakPolarHBondContact O-CB 3.29Å; I474-P614 HydrophobicContact CD1-CB 3.41Å; I474-P614 VanDerWaalsContact CD1-CB 3.41Å; I474-P614 HydrophobicContact CD1-CG 3.58Å; I474-P614 HydrophobicContact CG1-CB 3.81Å; I521-P614 HydrophobicContact CG2-CG 4.32Å
615	V	91.4	Very high	78.4	Confident	33 Å²	33	75.4 Å²	75.4	20%	0.2	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	155.9	175.8	-66.5	0	0	0	0	111	F39 N40 C471 P472 V473 I474	F39-V615 WeakPolarHBondContact O-CG2 3.32Å; N40-V615 HydrophobicContact CB-CG2 3.78Å; C471-V615 HydrophobicContact CB-CB 4.44Å; C471-V615 HydrophobicContact CB-CG1 3.76Å; C471-V615 HydrophobicContact CB-CG2 3.94Å; P472-V615 PolarHBondContact O-N 3.28Å; V473-V615 HydrophobicContact CG2-CG2 3.99Å; I474-V615 WeakPolarHBondContact CB-O 3.09Å; I474-V615 PolarHBondContact N-O 2.95Å
616	L	89.6	Confident	80.5	Confident	16 Å²	16	72.6 Å²	72.6	8%	0.084	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.2	169.1	-71.9	175.7	0	0	0	110	I474 V476 L523 I596 K622	I474-L616 HydrophobicContact CG2-CD2 4.36Å; V476-L616 HydrophobicContact CG2-CD2 3.44Å; V476-L616 VanDerWaalsContact CG2-CD2 3.44Å; L523-L616 HydrophobicContact CD2-CD2 4.38Å; I596-L616 HydrophobicContact CD1-CD2 3.74Å; I596-L616 HydrophobicContact CD1-CG 3.7Å; I596-L616 HydrophobicContact CG1-CD1 4.32Å; I596-L616 HydrophobicContact CG1-CD2 3.79Å; I596-L616 HydrophobicContact CG1-CG 3.75Å; L616-K622 HydrophobicContact CD1-CD 4.41Å; L616-K622 HydrophobicContact CD1-CG 4.32Å
617	N	86.3	Confident	82.4	Confident	21 Å²	21	73 Å²	73	11%	0.112	38%	0.376	C	S	.	.			trans	-54.9	148.5	169.9	-161.2	4.4	0	0	0	111.3	V473 I474 H475 S619	V473-N617 HydrophobicContact CG1-CB 3.8Å; I474-N617 PolarHBondContact O-N 3.39Å; H475-N617 PolarHBondContact CE1-ND2 3.36Å; H475-N617 PolarHBondContact ND1-ND2 3.31Å; N617-S619 VanDerWaalsContact CG-O 3.3Å; N617-S619 PolarHBondContact ND2-O 2.71Å
618	I	80.5	Confident	84.1	Confident	67 Å²	67	64.3 Å²	64.3	34%	0.344	34%	0.339	S	S	.	.	S	Bend	trans	-70.2	-38.9	173.6	-68.4	-172.1	0	0	0	110.8	F39 P620	F39-I618 HydrophobicContact CB-CD1 3.34Å; F39-I618 HydrophobicContact CB-CG1 4.12Å; I618-P620 CarbonylContact O-C 3.5Å
619	S	74.9	Confident	85.4	Confident	58 Å²	58	56.7 Å²	56.7	41%	0.406	31%	0.314	S	S	.	.	S	Bend	trans	-115.5	124.2	-175.8	-70.7	0	0	0	0	111.1	N617	N617-S619 VanDerWaalsContact CG-O 3.3Å; N617-S619 PolarHBondContact ND2-O 2.71Å
620	P	79	Confident	86.4	Confident	87 Å²	87	55 Å²	55	57%	0.565	30%	0.303	S	S	*	.	S	Bend	cis	-75.6	159.2	-0.6	33.2	-36.9	0	0	0	113.6	I618	I618-P620 CarbonylContact O-C 3.5Å
621	S	83.1	Confident	86.8	Confident	74 Å²	74	54.9 Å²	54.9	52%	0.517	30%	0.304	S	S	.	.			trans	-47.4	138.9	179.9	175	0	0	0	0	114.1	R478 T623	R478-S621 PolarHBondContact NH1-O 2.88Å; R478-S621 PolarHBondContact NH2-O 3.12Å; S621-T623 PolarHBondContact O-N 3.15Å; S621-T623 VanDerWaalsContact O-N 3.09Å; S621-T623 PolarHBondContact OG-N 2.88Å
622	K	87.6	Confident	86.7	Confident	62 Å²	62	52 Å²	52	27%	0.27	29%	0.289	S	S	.	.	S	Bend	trans	-57.4	-23.7	177.4	-66.1	170.3	-173.2	170.8	0	113.8	R478 H594 L616	R478-K622 PolarHBondContact NH1-O 2.86Å; H594-K622 PolarHBondContact CE1-O 3.08Å; H594-K622 PolarHBondContact N-O 3.04Å; H594-K622 VanDerWaalsContact N-O 3.1Å; H594-K622 PolarHBondContact ND1-O 3.14Å; L616-K622 HydrophobicContact CD1-CD 4.41Å; L616-K622 HydrophobicContact CD1-CG 4.32Å
623	T	90.3	Very high	86	Confident	45 Å²	45	57.2 Å²	57.2	28%	0.276	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.4	173.7	-53.9	0	0	0	0	111.1	R478 A591 I592 T593 S621	R478-T623 PolarHBondContact NH2-O 3.39Å; A591-T623 HydrophobicContact CB-CG2 4.04Å; I592-T623 CarbonylContact O-C 3.52Å; I592-T623 WeakPolarHBondContact O-CA 3.21Å; T593-T623 WeakPolarHBondContact OG1-CG2 3.24Å; T593-T623 PolarHBondContact OG1-OG1 3.34Å; S621-T623 PolarHBondContact O-N 3.15Å; S621-T623 VanDerWaalsContact O-N 3.09Å; S621-T623 PolarHBondContact OG-N 2.88Å
624	L	91.3	Very high	85.4	Confident	49 Å²	49	55.5 Å²	55.5	26%	0.257	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.7	164.8	-174.4	67.3	0	0	0	108.9	V480 I592	V480-L624 HydrophobicContact CB-CD2 4.1Å; V480-L624 HydrophobicContact CG2-CD2 3.5Å; V480-L624 VanDerWaalsContact CG2-CD2 3.5Å; I592-L624 HydrophobicContact CB-CB 4.48Å; I592-L624 PolarHBondContact N-O 2.92Å; I592-L624 PolarHBondContact O-N 3.02Å
625	N	93.2	Very high	84.8	Confident	110 Å²	110	55.3 Å²	55.3	59%	0.588	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	137.1	170	-62.6	-22.2	0	0	0	109.3	L590	L590-N625 CarbonylContact O-C 3.58Å; L590-N625 WeakPolarHBondContact O-CA 3.26Å
626	S	92.8	Very high	83.9	Confident	34 Å²	34	54.5 Å²	54.5	24%	0.238	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	168.7	173.9	-164.8	0	0	0	0	109.6	I482 L590	I482-S626 WeakPolarHBondContact CD1-OG 3.19Å; L590-S626 PolarHBondContact N-O 3.45Å; L590-S626 PolarHBondContact O-N 3.5Å
627	E	93.3	Very high	83.2	Confident	97 Å²	97	59 Å²	59	45%	0.453	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.2	-174.5	-69.4	-170	168.1	0	0	111.6	Q485 P587	Q485-E627 PolarHBondContact NE2-O 3.04Å; P587-E627 HydrophobicContact CB-CB 4.04Å; P587-E627 HydrophobicContact CB-CG 4.42Å; P587-E627 HydrophobicContact CG-CG 4.44Å; P587-E627 WeakPolarHBondContact CG-OE2 3.42Å
628	V	91.8	Very high	82.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.5	170.8	-159.3	0	0	0	0	108.5	I482 I487 V502 F575 P587 I588 L590	I482-V628 HydrophobicContact CD1-CG2 4.2Å; I482-V628 HydrophobicContact CG2-CG1 4.22Å; I482-V628 HydrophobicContact CG2-CG2 3.87Å; I487-V628 HydrophobicContact CD1-CB 4.27Å; I487-V628 HydrophobicContact CD1-CG1 3.83Å; I487-V628 HydrophobicContact CG1-CG1 3.79Å; V502-V628 HydrophobicContact CG1-CG1 4.28Å; V502-V628 HydrophobicContact CG1-CG2 4.46Å; V502-V628 HydrophobicContact CG2-CG1 4.44Å; F575-V628 HydrophobicContact CE1-CG2 4.31Å; F575-V628 HydrophobicContact CZ-CG2 3.96Å; P587-V628 CarbonylContact C-O 3.55Å; P587-V628 VanDerWaalsContact CA-O 3.31Å; P587-V628 WeakPolarHBondContact CA-O 3.04Å; P587-V628 WeakPolarHBondContact CB-O 3.34Å; I588-V628 HydrophobicContact CB-CB 4.38Å; I588-V628 PolarHBondContact N-O 3.03Å; I588-V628 PolarHBondContact O-N 2.87Å; L590-V628 HydrophobicContact CD1-CG2 3.64Å; L590-V628 HydrophobicContact CG-CG2 4.19Å
629	N	88.6	Confident	82.2	Confident	52 Å²	52	65.7 Å²	65.7	28%	0.278	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	152.1	-178.2	-76.2	-66.9	0	0	0	111	Q485 N486 I487	Q485-N629 PolarHBondContact O-N 3.26Å; N486-N629 CarbonylContact C-O 3.6Å; N486-N629 VanDerWaalsContact CA-O 3.31Å; N486-N629 WeakPolarHBondContact CA-O 3.08Å; I487-N629 PolarHBondContact N-O 3.26Å
630	F	87.1	Confident	82.4	Confident	5 Å²	5	66.1 Å²	66.1	2%	0.022	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	147.3	162.2	-68.8	-87.2	0	0	0	109.6	I487 L489 R541 L577 I581 K584 R586 I588 R632	I487-F630 HydrophobicContact CB-CD1 4.01Å; I487-F630 HydrophobicContact CB-CE1 4.32Å; I487-F630 HydrophobicContact CD1-CE1 4.21Å; I487-F630 HydrophobicContact CD1-CZ 4.36Å; I487-F630 HydrophobicContact CG2-CD1 3.83Å; I487-F630 HydrophobicContact CG2-CE1 3.88Å; L489-F630 HydrophobicContact CD2-CD1 4.25Å; L489-F630 HydrophobicContact CD2-CE1 4.21Å; R541-F630 VanDerWaalsContact NH1-CE2 3.29Å; L577-F630 HydrophobicContact CD1-CE1 4.11Å; L577-F630 HydrophobicContact CD1-CZ 4.04Å; L577-F630 HydrophobicContact CD2-CE1 3.98Å; I581-F630 HydrophobicContact CD1-CD1 4.34Å; I581-F630 HydrophobicContact CD1-CE1 3.46Å; I581-F630 VanDerWaalsContact CD1-CE1 3.46Å; I581-F630 HydrophobicContact CD1-CZ 3.77Å; K584-F630 WeakPolarHBondContact O-CB 3.35Å; K584-F630 WeakPolarHBondContact O-CG 3.35Å; R586-F630 WeakPolarHBondContact O-CD2 3.49Å; R586-F630 WeakPolarHBondContact O-CE2 3.35Å; I588-F630 HydrophobicContact CD1-CE2 4.16Å; I588-F630 HydrophobicContact CD1-CZ 3.74Å; I588-F630 HydrophobicContact CG1-CE2 3.68Å; I588-F630 HydrophobicContact CG1-CZ 3.79Å; F630-R632 PolarHBondContact O-N 2.92Å
631	L	82.3	Confident	82.7	Confident	79 Å²	79	62.3 Å²	62.3	41%	0.414	34%	0.341	S	S	.	.			trans	-70.1	111.5	172.1	-165	150	0	0	0	108.6	I487 D488 E633	I487-L631 WeakPolarHBondContact O-CB 3.41Å; I487-L631 PolarHBondContact O-N 2.69Å; D488-L631 HydrophobicContact CB-CD1 4.28Å; L631-E633 VanDerWaalsContact C-N 3.33Å; L631-E633 HydrophobicContact CD2-CB 4.44Å; L631-E633 HydrophobicContact CD2-CG 3.65Å; L631-E633 PolarHBondContact O-N 2.88Å
632	R	76	Confident	83	Confident	94 Å²	94	61.7 Å²	61.7	36%	0.355	33%	0.33	S	S	.	.			trans	-82.6	72.5	-173.5	-65.2	-176.3	-177.1	174.1	1	111.9	L585 F630 C635 K639	L585-R632 HydrophobicContact CD2-CG 4.35Å; F630-R632 PolarHBondContact O-N 2.92Å; R632-C635 HydrophobicContact CB-CB 4.5Å; R632-K639 WeakPolarHBondContact CD-O 3.29Å; R632-K639 PolarHBondContact NH1-O 2.97Å
633	E	70.6	Confident	83.2	Confident	121 Å²	121	59 Å²	59	57%	0.565	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	140.2	168.9	-93.9	168.9	-151.5	0	0	111.9	L631	L631-E633 VanDerWaalsContact C-N 3.33Å; L631-E633 HydrophobicContact CD2-CB 4.44Å; L631-E633 HydrophobicContact CD2-CG 3.65Å; L631-E633 PolarHBondContact O-N 2.88Å
634	G	73.3	Confident	83.3	Confident	36 Å²	36	57.4 Å²	57.4	37%	0.371	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	3.5	178.5	0	0	0	0	0	115.5	D704	G634-D704 WeakPolarHBondContact O-CB 3.36Å; G634-D704 PolarHBondContact O-N 2.92Å
635	C	77.8	Confident	83.4	Confident	22 Å²	22	55.3 Å²	55.3	15%	0.149	30%	0.297	C	S	.	.	S	Bend	trans	-107.3	162.9	177	-45	0	0	0	0	111.6	R632 C641 D703	R632-C635 HydrophobicContact CB-CB 4.5Å; C635-C641 HydrophobicContact CB-CB 3.84Å; C635-C641 WeakPolarHBondContact CB-SG 3.2Å; C635-C641 WeakPolarHBondContact SG-CB 3.34Å; C635-C641 CovalentContact SG-SG 2.03Å; C635-C641 PolarHBondContact SG-SG 2.87Å; C635-D703 WeakPolarHBondContact CA-OD2 3.47Å
636	G	72.3	Confident	83.3	Confident	15 Å²	15	54.7 Å²	54.7	16%	0.155	29%	0.29	C	S	.	.			trans	-58.3	172.2	-177.3	0	0	0	0	0	115.5	D638 K639 D703	G636-D638 PolarHBondContact O-N 2.8Å; G636-D638 VanDerWaalsContact O-N 3.16Å; G636-K639 WeakPolarHBondContact O-CA 3.44Å; G636-K639 PolarHBondContact O-N 2.94Å; G636-D703 PolarHBondContact N-OD1 2.9Å; G636-D703 PolarHBondContact N-OD2 2.86Å
637	S	74.5	Confident	83.4	Confident	112 Å²	112	54.6 Å²	54.6	78%	0.783	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.1	-179.8	58.8	0	0	0	0	114	K639	S637-K639 VanDerWaalsContact C-N 3.34Å
638	D	74.4	Confident	83.3	Confident	89 Å²	89	52.9 Å²	52.9	48%	0.476	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.7	171	67.9	-10.9	0	0	0	114	G636 I640	G636-D638 PolarHBondContact O-N 2.8Å; G636-D638 VanDerWaalsContact O-N 3.16Å; D638-I640 VanDerWaalsContact C-N 3.25Å; D638-I640 HydrophobicContact CB-CG1 4.43Å; D638-I640 PolarHBondContact O-N 2.85Å; D638-I640 PolarHBondContact OD1-N 2.93Å; D638-I640 WeakPolarHBondContact OD2-CB 3.35Å; D638-I640 WeakPolarHBondContact OD2-CG1 3.37Å
639	K	73.4	Confident	83.4	Confident	139 Å²	139	56.7 Å²	56.7	60%	0.604	30%	0.3	S	S	*	.	S	Bend	trans	64.4	21.6	-174.5	-48.2	176.2	-177.6	177.8	0	114.2	R632 G636 S637	R632-K639 WeakPolarHBondContact CD-O 3.29Å; R632-K639 PolarHBondContact NH1-O 2.97Å; G636-K639 WeakPolarHBondContact O-CA 3.44Å; G636-K639 PolarHBondContact O-N 2.94Å; S637-K639 VanDerWaalsContact C-N 3.34Å
640	I	78.4	Confident	83.5	Confident	67 Å²	67	56.8 Å²	56.8	34%	0.344	30%	0.299	S	S	.	.			trans	-97.4	130.7	170.5	-52.3	-178.1	0	0	0	106.9	D638 Q642 E783	D638-I640 VanDerWaalsContact C-N 3.25Å; D638-I640 HydrophobicContact CB-CG1 4.43Å; D638-I640 PolarHBondContact O-N 2.85Å; D638-I640 PolarHBondContact OD1-N 2.93Å; D638-I640 WeakPolarHBondContact OD2-CB 3.35Å; D638-I640 WeakPolarHBondContact OD2-CG1 3.37Å; I640-Q642 HydrophobicContact CB-CG 4.28Å; I640-Q642 HydrophobicContact CG2-CG 3.68Å; I640-Q642 PolarHBondContact O-N 3.41Å; I640-E783 WeakPolarHBondContact CG2-OE2 3.3Å
641	C	85.3	Confident	83.7	Confident	7 Å²	7	56.5 Å²	56.5	5%	0.047	30%	0.298	C	S	.	.			trans	-95.1	87.2	-174.8	-50.8	0	0	0	0	108.6	L585 C635 S782 E783	L585-C641 HydrophobicContact CD1-CB 4.05Å; L585-C641 HydrophobicContact CD2-CB 4.46Å; L585-C641 VanDerWaalsContact CD2-SG 3.51Å; C635-C641 HydrophobicContact CB-CB 3.84Å; C635-C641 WeakPolarHBondContact CB-SG 3.2Å; C635-C641 WeakPolarHBondContact SG-CB 3.34Å; C635-C641 CovalentContact SG-SG 2.03Å; C635-C641 PolarHBondContact SG-SG 2.87Å; C641-S782 VanDerWaalsContact O-CB 3.27Å; C641-S782 WeakPolarHBondContact O-CB 3.14Å; C641-E783 PolarHBondContact O-N 2.91Å
642	Q	89.9	Confident	83.9	Confident	61 Å²	61	52.8 Å²	52.8	29%	0.285	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-95.5	101.9	-173.5	-60.5	-165	-32.8	0	0	111.1	I640 E700 D701 G702 D703 E783	I640-Q642 HydrophobicContact CB-CG 4.28Å; I640-Q642 HydrophobicContact CG2-CG 3.68Å; I640-Q642 PolarHBondContact O-N 3.41Å; Q642-E700 PolarHBondContact OE1-O 3.03Å; Q642-D701 CarbonylContact O-C 3.49Å; Q642-G702 PolarHBondContact O-N 3.27Å; Q642-D703 PolarHBondContact N-OD2 2.83Å; Q642-D703 WeakPolarHBondContact O-CB 3.36Å; Q642-D703 PolarHBondContact O-N 3.48Å; Q642-E783 WeakPolarHBondContact CA-O 3.32Å; Q642-E783 HydrophobicContact CG-CB 4.39Å; Q642-E783 PolarHBondContact NE2-OE2 3.39Å; Q642-E783 VanDerWaalsContact NE2-OE2 3.15Å
643	S	91.8	Very high	84.2	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.035	27%	0.267	C	S	.	.			trans	-89.6	156.8	-175	60.5	0	0	0	0	112.9	S782 E783 Q784	S643-S782 WeakPolarHBondContact OG-CB 3.41Å; S643-E783 PolarHBondContact N-O 3.05Å; S643-E783 VanDerWaalsContact N-O 3.12Å; S643-Q784 WeakPolarHBondContact O-CG 3.34Å; S643-Q784 PolarHBondContact O-OE1 3.34Å; S643-Q784 VanDerWaalsContact O-OE1 3.11Å; S643-Q784 PolarHBondContact OG-OE1 3.02Å; S643-Q784 VanDerWaalsContact OG-OE1 3.11Å
644	N	92	Very high	84.3	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.064	26%	0.255	C	S	.	.			trans	-132.8	62.3	175	-172.1	16.3	0	0	0	111	K646 N690 M691 S693 D701	N644-K646 PolarHBondContact ND2-NZ 2.87Å; N644-K646 PolarHBondContact O-N 2.92Å; N644-K646 WeakPolarHBondContact OD1-CE 3.31Å; N644-K646 PolarHBondContact OD1-NZ 2.9Å; N644-N690 PolarHBondContact N-OD1 2.74Å; N644-M691 WeakPolarHBondContact CB-O 3.38Å; N644-M691 PolarHBondContact ND2-O 3.27Å; N644-S693 PolarHBondContact ND2-N 3.39Å; N644-S693 VanDerWaalsContact ND2-N 3.2Å; N644-S693 PolarHBondContact ND2-OG 2.9Å; N644-D701 HydrophobicContact CB-CB 4.42Å; N644-D701 WeakPolarHBondContact CB-OD2 3.24Å; N644-D701 PolarHBondContact ND2-OD2 3.39Å
645	L	93	Very high	83.9	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	112.2	174.8	-62.5	179	0	0	0	110.1	V688 T689 N690 A705 V748 L778 T780 Q784 L787	L645-V688 HydrophobicContact CD2-CG1 4.3Å; L645-T689 WeakPolarHBondContact CA-O 3.23Å; L645-N690 HydrophobicContact CD2-CB 3.92Å; L645-A705 HydrophobicContact CD1-CB 4.08Å; L645-A705 HydrophobicContact CD2-CB 3.78Å; L645-A705 HydrophobicContact CG-CB 3.96Å; L645-V748 HydrophobicContact CD2-CG1 4.37Å; L645-L778 HydrophobicContact CB-CD1 4Å; L645-T780 HydrophobicContact CD1-CG2 3.9Å; L645-Q784 PolarHBondContact O-NE2 3.45Å; L645-L787 HydrophobicContact CB-CD2 4.35Å
646	K	91.8	Very high	82.9	Confident	98 Å²	98	57.7 Å²	57.7	43%	0.426	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.1	174	-71.8	169.7	173.1	144.9	0	110.2	N644 V688 T689 S693	N644-K646 PolarHBondContact ND2-NZ 2.87Å; N644-K646 PolarHBondContact O-N 2.92Å; N644-K646 WeakPolarHBondContact OD1-CE 3.31Å; N644-K646 PolarHBondContact OD1-NZ 2.9Å; K646-V688 WeakPolarHBondContact O-CA 3.43Å; K646-T689 PolarHBondContact N-O 2.95Å; K646-T689 PolarHBondContact O-N 3.05Å; K646-S693 PolarHBondContact NZ-OG 2.87Å
647	L	93.1	Very high	82.2	Confident	32 Å²	32	64.9 Å²	64.9	17%	0.168	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141.2	179.4	-174.1	144.8	0	0	0	111.5	Y649 I686 V688 L710 L776 L778 V790	L647-Y649 HydrophobicContact CD2-CD1 4.5Å; L647-I686 HydrophobicContact CD1-CG2 4.14Å; L647-I686 HydrophobicContact CG-CG2 4.31Å; L647-V688 HydrophobicContact CD1-CG2 4.4Å; L647-L710 HydrophobicContact CD1-CD1 3.61Å; L647-L710 HydrophobicContact CD1-CD2 4.3Å; L647-L776 HydrophobicContact CD1-CB 3.94Å; L647-L776 HydrophobicContact CD1-CD1 4.31Å; L647-L776 HydrophobicContact CD2-CB 4.25Å; L647-L776 HydrophobicContact CD2-CD1 3.68Å; L647-L778 HydrophobicContact CB-CD1 3.81Å; L647-L778 HydrophobicContact CB-CG 4.35Å; L647-L778 HydrophobicContact CD1-CD1 4.46Å; L647-L778 HydrophobicContact CD1-CD2 4.37Å; L647-L778 HydrophobicContact CD1-CG 4.11Å; L647-V790 HydrophobicContact CD2-CB 4.01Å; L647-V790 HydrophobicContact CD2-CG1 3.94Å; L647-V790 HydrophobicContact CD2-CG2 4.28Å
648	S	92.4	Very high	81.6	Confident	61 Å²	61	61.9 Å²	61.9	43%	0.427	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.4	168.2	54.2	0	0	0	0	110.1	T687	S648-T687 PolarHBondContact N-O 3.3Å; S648-T687 PolarHBondContact O-N 3.05Å; S648-T687 WeakPolarHBondContact OG-CB 3.48Å; S648-T687 PolarHBondContact OG-O 3.01Å
649	Y	93.1	Very high	80.8	Confident	80 Å²	80	63.8 Å²	63.8	31%	0.314	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	158.5	-175	68.9	-95.5	0	0	0	112.2	L647 L684 E685 L776 V790 T791 A792 F793	L647-Y649 HydrophobicContact CD2-CD1 4.5Å; Y649-L684 HydrophobicContact CD2-CD1 4.42Å; Y649-E685 CarbonylContact C-O 3.57Å; Y649-E685 VanDerWaalsContact CA-O 3.29Å; Y649-E685 WeakPolarHBondContact CA-O 3.22Å; Y649-L776 HydrophobicContact CD1-CD1 4.46Å; Y649-V790 HydrophobicContact CD1-CG1 3.78Å; Y649-V790 HydrophobicContact CE1-CG1 3.7Å; Y649-T791 PolarHBondContact OH-O 2.96Å; Y649-A792 HydrophobicContact CD1-CB 4.06Å; Y649-A792 HydrophobicContact CD2-CB 3.58Å; Y649-A792 HydrophobicContact CE1-CB 4.24Å; Y649-A792 HydrophobicContact CE2-CB 3.81Å; Y649-A792 HydrophobicContact CG-CB 3.73Å; Y649-A792 VanDerWaalsContact CZ-CA 3.5Å; Y649-F793 PolarHBondContact OH-N 2.7Å
650	Q	91.1	Very high	80.7	Confident	53 Å²	53	64 Å²	64	25%	0.248	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	127.1	170.1	-168.6	163.3	29.8	0	0	110.9	F661 P663 E685	Q650-F661 HydrophobicContact CB-CE1 4.44Å; Q650-F661 HydrophobicContact CB-CZ 4.24Å; Q650-F661 HydrophobicContact CG-CE1 4.14Å; Q650-F661 HydrophobicContact CG-CZ 4.1Å; Q650-P663 HydrophobicContact CG-CB 4.14Å; Q650-E685 PolarHBondContact N-O 3.5Å; Q650-E685 WeakPolarHBondContact O-CB 3.06Å; Q650-E685 PolarHBondContact O-N 2.96Å
651	F	90.6	Very high	80.7	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	144.1	167.1	-74.2	-78.6	0	0	0	110.9	L664 Q672 V682 V683 L684 L760 A792 A794	F651-L664 HydrophobicContact CB-CD1 3.64Å; F651-L664 HydrophobicContact CB-CG 4.1Å; F651-L664 PolarHBondContact O-N 2.68Å; F651-Q672 PolarHBondContact O-NE2 2.78Å; F651-V682 HydrophobicContact CD1-CG2 4.17Å; F651-V683 CarbonylContact C-O 3.55Å; F651-V683 WeakPolarHBondContact CA-O 3.01Å; F651-L684 HydrophobicContact CD1-CB 4.43Å; F651-L684 HydrophobicContact CD1-CD1 4.1Å; F651-L684 HydrophobicContact CD2-CD1 4.37Å; F651-L684 HydrophobicContact CE1-CB 4.31Å; F651-L684 HydrophobicContact CE1-CD1 3.96Å; F651-L684 HydrophobicContact CE2-CD1 4.24Å; F651-L684 HydrophobicContact CG-CD1 4.31Å; F651-L684 HydrophobicContact CZ-CD1 4.04Å; F651-L760 HydrophobicContact CE1-CD1 4.18Å; F651-A792 HydrophobicContact CE2-CB 3.89Å; F651-A792 HydrophobicContact CZ-CB 4.14Å; F651-A794 HydrophobicContact CD2-CB 3.79Å; F651-A794 HydrophobicContact CE2-CB 4.16Å; F651-A794 HydrophobicContact CG-CB 4.32Å
652	G	87.3	Confident	80.6	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	-174.1	176.5	0	0	0	0	0	112.8	F661 T662 V683	G652-F661 VanDerWaalsContact CA-CE2 3.5Å; G652-T662 CarbonylContact C-O 3.56Å; G652-T662 WeakPolarHBondContact CA-O 3.21Å; G652-V683 PolarHBondContact N-O 3.05Å; G652-V683 PolarHBondContact O-N 2.76Å
653	T	83.4	Confident	80.3	Confident	22 Å²	22	64.6 Å²	64.6	14%	0.135	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151.2	176.5	62.4	0	0	0	0	109.6	T662 L664 Q679	T653-T662 PolarHBondContact N-O 3.18Å; T653-T662 PolarHBondContact O-N 2.8Å; T653-L664 HydrophobicContact CG2-CD2 3.92Å; T653-Q679 VanDerWaalsContact CG2-OE1 3.26Å
654	T	72.6	Confident	80	Confident	49 Å²	49	65.1 Å²	65.1	30%	0.301	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.2	174.3	52.3	0	0	0	0	108.6	V683	T654-V683 HydrophobicContact CG2-CB 4.4Å; T654-V683 HydrophobicContact CG2-CG1 4.45Å; T654-V683 HydrophobicContact CG2-CG2 3.83Å; T654-V683 WeakPolarHBondContact OG1-CG2 3.14Å
655	H	64.8	Low	79.5	Confident	128 Å²	128	68.6 Å²	68.6	59%	0.593	36%	0.363	S	S	*	.			trans	-74.3	142.7	175.3	-78.9	-86.9	0	0	0	110.7	N657 S658	H655-N657 PolarHBondContact O-N 2.75Å; H655-S658 PolarHBondContact O-N 3.3Å; H655-S658 VanDerWaalsContact O-O 3.12Å
656	L	57.1	Low	79.1	Confident	178 Å²	178	76.1 Å²	76.1	93%	0.932	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-21	-174.4	-77.4	145	0	0	0	115.3
657	N	57.6	Low	78.4	Confident	166 Å²	166	73.6 Å²	73.6	89%	0.888	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	16.8	-179	-69.8	-9.7	0	0	0	113.9	H655	H655-N657 PolarHBondContact O-N 2.75Å
658	S	60.2	Low	77.6	Confident	49 Å²	49	80.3 Å²	80.3	34%	0.343	42%	0.418	S	S	.	.			trans	-147.5	147.1	174.3	69.4	0	0	0	0	113.9	H655 F660	H655-S658 PolarHBondContact O-N 3.3Å; H655-S658 VanDerWaalsContact O-O 3.12Å; S658-F660 PolarHBondContact O-N 2.81Å; S658-F660 VanDerWaalsContact O-N 3.11Å
659	D	59.1	Low	76.7	Confident	128 Å²	128	83.5 Å²	83.5	68%	0.684	43%	0.43	S	S	*	.			trans	-78.5	14.6	178.3	-62.2	-14.5	0	0	0	112.9	F661 R724	D659-F661 PolarHBondContact O-N 2.88Å; D659-R724 VanDerWaalsContact CG-NH1 3.27Å; D659-R724 IonicContact OD1-CZ 3.59Å; D659-R724 IonicContact OD1-NH1 2.77Å; D659-R724 PolarHBondContact OD1-NH1 2.79Å; D659-R724 IonicContact OD1-NH2 3.01Å; D659-R724 PolarHBondContact OD1-NH2 2.91Å; D659-R724 IonicContact OD2-NH1 3.21Å
660	F	70.6	Confident	75.8	Confident	144 Å²	144	81.5 Å²	81.5	63%	0.632	43%	0.434	S	S	*	.			trans	-82.9	98.6	-175.6	-161.7	-91.6	0	0	0	110.5	S658 T662	S658-F660 PolarHBondContact O-N 2.81Å; S658-F660 VanDerWaalsContact O-N 3.11Å; F660-T662 PolarHBondContact O-N 2.82Å
661	F	79.1	Confident	75.3	Confident	35 Å²	35	80.6 Å²	80.6	15%	0.154	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	118.6	171.4	178.1	-100.9	0	0	0	110.2	Q650 G652 D659 P663 V683 E685	Q650-F661 HydrophobicContact CB-CE1 4.44Å; Q650-F661 HydrophobicContact CB-CZ 4.24Å; Q650-F661 HydrophobicContact CG-CE1 4.14Å; Q650-F661 HydrophobicContact CG-CZ 4.1Å; G652-F661 VanDerWaalsContact CA-CE2 3.5Å; D659-F661 PolarHBondContact O-N 2.88Å; F661-P663 HydrophobicContact CE1-CB 4.08Å; F661-V683 HydrophobicContact CD2-CB 4.49Å; F661-V683 HydrophobicContact CD2-CG1 4.2Å; F661-V683 HydrophobicContact CE2-CB 4.33Å; F661-V683 HydrophobicContact CE2-CG1 4.18Å; F661-E685 HydrophobicContact CD2-CB 4.31Å; F661-E685 HydrophobicContact CE1-CB 4.1Å; F661-E685 HydrophobicContact CE2-CB 3.7Å; F661-E685 HydrophobicContact CZ-CB 3.57Å; F661-E685 HydrophobicContact CZ-CG 4.47Å
662	T	81.5	Confident	75.1	Confident	51 Å²	51	81.1 Å²	81.1	31%	0.313	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.9	174.9	-52.8	0	0	0	0	108.4	G652 T653 F660	G652-T662 CarbonylContact C-O 3.56Å; G652-T662 WeakPolarHBondContact CA-O 3.21Å; T653-T662 PolarHBondContact N-O 3.18Å; T653-T662 PolarHBondContact O-N 2.8Å; F660-T662 PolarHBondContact O-N 2.82Å
663	P	84.1	Confident	74.9	Confident	62 Å²	62	82.5 Å²	82.5	40%	0.403	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.2	-177.6	28.1	-35.3	0	0	0	111.4	Q650 F661	Q650-P663 HydrophobicContact CG-CB 4.14Å; F661-P663 HydrophobicContact CE1-CB 4.08Å
664	L	85.6	Confident	74.9	Confident	15 Å²	15	81.5 Å²	81.5	8%	0.079	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-62	140.6	175.2	-69.7	-174.7	0	0	0	110.9	F651 T653 Q672 F674 A794	F651-L664 HydrophobicContact CB-CD1 3.64Å; F651-L664 HydrophobicContact CB-CG 4.1Å; F651-L664 PolarHBondContact O-N 2.68Å; T653-L664 HydrophobicContact CG2-CD2 3.92Å; L664-Q672 HydrophobicContact CB-CB 4.12Å; L664-Q672 PolarHBondContact O-NE2 3.1Å; L664-F674 HydrophobicContact CD1-CB 3.89Å; L664-F674 HydrophobicContact CD1-CD2 4.12Å; L664-F674 HydrophobicContact CD2-CD2 4.12Å; L664-A794 HydrophobicContact CD1-CB 4.5Å
665	P	82.6	Confident	75	Confident	86 Å²	86	81.2 Å²	81.2	56%	0.558	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-60.3	152.6	177	28.4	-35.9	0	0	0	110.6	Q672 V673	P665-Q672 CarbonylContact O-C 3.59Å; P665-Q672 WeakPolarHBondContact O-CA 3.5Å; P665-V673 PolarHBondContact O-N 2.89Å
666	R	83.2	Confident	75.2	Confident	162 Å²	162	78.6 Å²	78.6	61%	0.611	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-104.8	146	177.4	-68.5	176.7	178	-166	-0.4	110.9	G670 V671 Q672	R666-G670 VanDerWaalsContact CD-O 3.27Å; R666-G670 WeakPolarHBondContact CD-O 3.47Å; R666-G670 WeakPolarHBondContact CG-O 3.48Å; R666-V671 CarbonylContact C-O 3.51Å; R666-V671 VanDerWaalsContact CA-O 3.23Å; R666-V671 WeakPolarHBondContact CA-O 3.45Å; R666-Q672 HydrophobicContact CG-CG 4.15Å
667	D	78.1	Confident	75.4	Confident	44 Å²	44	72.7 Å²	72.7	24%	0.235	40%	0.4	C	S	.	.			trans	-80.8	-176.5	170.3	66.7	14.5	0	0	0	112.3	D669 G670 V671 V673 K795	D667-D669 PolarHBondContact O-N 3.03Å; D667-D669 WeakPolarHBondContact OD1-CA 3.36Å; D667-D669 WeakPolarHBondContact OD1-CB 3.44Å; D667-D669 PolarHBondContact OD1-N 3.32Å; D667-G670 PolarHBondContact O-N 3.33Å; D667-G670 PolarHBondContact OD1-N 2.74Å; D667-G670 VanDerWaalsContact OD1-N 3.13Å; D667-V671 PolarHBondContact N-O 3.47Å; D667-V671 PolarHBondContact OD1-N 2.74Å; D667-V673 HydrophobicContact CB-CG2 3.9Å; D667-K795 WeakPolarHBondContact OD2-CD 3.15Å; D667-K795 WeakPolarHBondContact OD2-CE 3.41Å; D667-K795 IonicContact OD2-NZ 3.25Å; D667-K795 PolarHBondContact OD2-NZ 3.37Å
668	N	75.3	Confident	75.5	Confident	173 Å²	173	73.1 Å²	73.1	93%	0.925	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.2	179	-66.1	-12	0	0	0	113.4	G670	N668-G670 VanDerWaalsContact C-N 3.32Å
669	D	73.7	Confident	75.9	Confident	128 Å²	128	74.6 Å²	74.6	68%	0.684	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.5	176.6	-49.9	-37.1	0	0	0	111.5	D667 V671 K795	D667-D669 PolarHBondContact O-N 3.03Å; D667-D669 WeakPolarHBondContact OD1-CA 3.36Å; D667-D669 WeakPolarHBondContact OD1-CB 3.44Å; D667-D669 PolarHBondContact OD1-N 3.32Å; D669-V671 VanDerWaalsContact C-N 3.33Å; D669-V671 HydrophobicContact CB-CG2 4.28Å; D669-K795 IonicContact OD2-NZ 3.98Å; D669-K795 PolarHBondContact OD2-NZ 2.86Å
670	G	74	Confident	76.5	Confident	38 Å²	38	78.8 Å²	78.8	39%	0.392	41%	0.41	S	S	.	.	S	Bend	trans	81.4	5.2	-177.2	0	0	0	0	0	114.8	R666 D667 N668	R666-G670 VanDerWaalsContact CD-O 3.27Å; R666-G670 WeakPolarHBondContact CD-O 3.47Å; R666-G670 WeakPolarHBondContact CG-O 3.48Å; D667-G670 PolarHBondContact O-N 3.33Å; D667-G670 PolarHBondContact OD1-N 2.74Å; D667-G670 VanDerWaalsContact OD1-N 3.13Å; N668-G670 VanDerWaalsContact C-N 3.32Å
671	V	81.9	Confident	77.1	Confident	35 Å²	35	75.2 Å²	75.2	21%	0.212	40%	0.397	C	S	.	.			trans	-83.8	139.3	-177.4	179.7	0	0	0	0	110.6	R666 D667 D669 F793 K795	R666-V671 CarbonylContact C-O 3.51Å; R666-V671 VanDerWaalsContact CA-O 3.23Å; R666-V671 WeakPolarHBondContact CA-O 3.45Å; D667-V671 PolarHBondContact N-O 3.47Å; D667-V671 PolarHBondContact OD1-N 2.74Å; D669-V671 VanDerWaalsContact C-N 3.33Å; D669-V671 HydrophobicContact CB-CG2 4.28Å; V671-F793 HydrophobicContact CG1-CD1 3.77Å; V671-F793 HydrophobicContact CG1-CE1 3.66Å; V671-K795 HydrophobicContact CB-CD 4.24Å; V671-K795 HydrophobicContact CG1-CD 3.9Å; V671-K795 HydrophobicContact CG1-CG 3.84Å
672	Q	84.9	Confident	77.6	Confident	11 Å²	11	73.5 Å²	73.5	5%	0.051	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-69.5	136.7	177.6	-62.2	-161	-86.5	0	0	111.8	F651 L664 P665 R666 A794 K795	F651-Q672 PolarHBondContact O-NE2 2.78Å; L664-Q672 HydrophobicContact CB-CB 4.12Å; L664-Q672 PolarHBondContact O-NE2 3.1Å; P665-Q672 CarbonylContact O-C 3.59Å; P665-Q672 WeakPolarHBondContact O-CA 3.5Å; R666-Q672 HydrophobicContact CG-CG 4.15Å; Q672-A794 HydrophobicContact CB-CB 4.12Å; Q672-A794 CarbonylContact O-C 3.59Å; Q672-A794 VanDerWaalsContact O-CA 3.29Å; Q672-A794 WeakPolarHBondContact O-CA 3.44Å; Q672-A794 WeakPolarHBondContact O-CB 3.28Å; Q672-K795 PolarHBondContact O-N 3.41Å
673	V	83.5	Confident	78	Confident	28 Å²	28	71.1 Å²	71.1	17%	0.17	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.5	-177.6	-176.4	0	0	0	0	110.4	P665 D667 K795 V797	P665-V673 PolarHBondContact O-N 2.89Å; D667-V673 HydrophobicContact CB-CG2 3.9Å; V673-K795 CarbonylContact C-O 3.6Å; V673-K795 WeakPolarHBondContact CA-O 3.31Å; V673-V797 HydrophobicContact CG1-CB 4.06Å; V673-V797 HydrophobicContact CG1-CG2 3.6Å
674	F	83.8	Confident	78.4	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.009	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.7	170.8	-176.6	-107.1	0	0	0	109.6	L664 L676 V682 T762 I765 L772 K795 V796 V797	L664-F674 HydrophobicContact CD1-CB 3.89Å; L664-F674 HydrophobicContact CD1-CD2 4.12Å; L664-F674 HydrophobicContact CD2-CD2 4.12Å; F674-L676 HydrophobicContact CE1-CD1 4.35Å; F674-V682 HydrophobicContact CD2-CG2 4.16Å; F674-V682 HydrophobicContact CE2-CB 4.25Å; F674-V682 HydrophobicContact CE2-CG2 4.2Å; F674-T762 HydrophobicContact CE1-CG2 4.4Å; F674-T762 HydrophobicContact CZ-CG2 3.82Å; F674-I765 HydrophobicContact CE1-CD1 3.99Å; F674-L772 HydrophobicContact CB-CD1 3.86Å; F674-L772 HydrophobicContact CD1-CD1 4.04Å; F674-L772 HydrophobicContact CG-CD1 3.88Å; F674-K795 PolarHBondContact N-O 3.11Å; F674-V796 WeakPolarHBondContact O-CA 3.41Å; F674-V797 PolarHBondContact O-N 2.82Å
675	S	75.1	Confident	78.7	Confident	42 Å²	42	68.4 Å²	68.4	29%	0.294	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.3	170.9	58.2	0	0	0	0	110.3	S677 V797	S675-S677 PolarHBondContact O-N 2.91Å; S675-V797 WeakPolarHBondContact CA-O 3.48Å
676	L	68.2	Low	79.2	Confident	73 Å²	73	64.3 Å²	64.3	38%	0.382	33%	0.33	S	S	.	.			trans	-76.6	71.9	-177.9	-156.3	116.9	0	0	0	111.5	F674 I765 V796 V797	F674-L676 HydrophobicContact CE1-CD1 4.35Å; L676-I765 HydrophobicContact CD1-CB 4.07Å; L676-I765 HydrophobicContact CD1-CG2 3.39Å; L676-V796 HydrophobicContact CD1-CG1 4.32Å; L676-V797 PolarHBondContact N-O 3.37Å
677	S	61.9	Low	79.7	Confident	54 Å²	54	57.4 Å²	57.4	38%	0.378	31%	0.306	S	S	.	.	S	Bend	trans	-87.9	174.7	167.3	58	0	0	0	0	110.4	S675 Q679	S675-S677 PolarHBondContact O-N 2.91Å; S677-Q679 PolarHBondContact O-N 2.87Å; S677-Q679 WeakPolarHBondContact OG-CG 3.49Å
678	D	60.1	Low	80.4	Confident	176 Å²	176	55.3 Å²	55.3	94%	0.941	30%	0.295	S	S	*	.	S	Bend	trans	-67.7	25.4	-176.6	-67.5	-53.8	0	0	0	115
679	Q	68.4	Low	81.3	Confident	80 Å²	80	48.2 Å²	48.2	37%	0.374	26%	0.258	S	S	.	.			trans	-77.3	125.1	177	-66.1	178.2	-3.9	0	0	111	T653 S677 T762	T653-Q679 VanDerWaalsContact CG2-OE1 3.26Å; S677-Q679 PolarHBondContact O-N 2.87Å; S677-Q679 WeakPolarHBondContact OG-CG 3.49Å; Q679-T762 PolarHBondContact O-OG1 3.16Å
680	R	72	Confident	82.2	Confident	216 Å²	216	42.1 Å²	42.1	82%	0.815	23%	0.225	S	C	*	.			trans	-88.4	-7.9	-175.3	-62.5	-176.2	-179.7	-176.8	-0.8	115.3	T762	R680-T762 VanDerWaalsContact CA-OG1 3.22Å; R680-T762 WeakPolarHBondContact CA-OG1 3.47Å; R680-T762 PolarHBondContact O-N 2.82Å; R680-T762 PolarHBondContact O-OG1 2.84Å
681	L	82.1	Confident	83	Confident	68 Å²	68	44 Å²	44	36%	0.356	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	144.1	-175.2	-67.4	171.9	0	0	0	109.6	A721 L760	L681-A721 HydrophobicContact CD2-CB 3.68Å; L681-L760 WeakPolarHBondContact CA-O 3.49Å
682	V	88.9	Confident	83.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.6	165.2	67	0	0	0	0	108.2	F651 F674 L718 L760 T762	F651-V682 HydrophobicContact CD1-CG2 4.17Å; F674-V682 HydrophobicContact CD2-CG2 4.16Å; F674-V682 HydrophobicContact CE2-CB 4.25Å; F674-V682 HydrophobicContact CE2-CG2 4.2Å; V682-L718 HydrophobicContact CG1-CD2 3.93Å; V682-L760 HydrophobicContact CG1-CB 3.87Å; V682-L760 HydrophobicContact CG1-CD1 4.47Å; V682-L760 PolarHBondContact N-O 3.28Å; V682-L760 PolarHBondContact O-N 3.01Å; V682-T762 HydrophobicContact CB-CG2 4.03Å; V682-T762 HydrophobicContact CG1-CG2 4.06Å
683	V	90.1	Very high	83.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.4	-173.7	-178.3	0	0	0	0	109.8	F651 G652 T654 F661 T757	F651-V683 CarbonylContact C-O 3.55Å; F651-V683 WeakPolarHBondContact CA-O 3.01Å; G652-V683 PolarHBondContact N-O 3.05Å; G652-V683 PolarHBondContact O-N 2.76Å; T654-V683 HydrophobicContact CG2-CB 4.4Å; T654-V683 HydrophobicContact CG2-CG1 4.45Å; T654-V683 HydrophobicContact CG2-CG2 3.83Å; T654-V683 WeakPolarHBondContact OG1-CG2 3.14Å; F661-V683 HydrophobicContact CD2-CB 4.49Å; F661-V683 HydrophobicContact CD2-CG1 4.2Å; F661-V683 HydrophobicContact CE2-CB 4.33Å; F661-V683 HydrophobicContact CE2-CG1 4.18Å; V683-T757 HydrophobicContact CG1-CG2 4.01Å
684	L	92.5	Very high	83.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	105.3	171.9	-178.7	61.8	0	0	0	108.5	Y649 F651 I686 T757 I758 L760 A774 L776 A792	Y649-L684 HydrophobicContact CD2-CD1 4.42Å; F651-L684 HydrophobicContact CD1-CB 4.43Å; F651-L684 HydrophobicContact CD1-CD1 4.1Å; F651-L684 HydrophobicContact CD2-CD1 4.37Å; F651-L684 HydrophobicContact CE1-CB 4.31Å; F651-L684 HydrophobicContact CE1-CD1 3.96Å; F651-L684 HydrophobicContact CE2-CD1 4.24Å; F651-L684 HydrophobicContact CG-CD1 4.31Å; F651-L684 HydrophobicContact CZ-CD1 4.04Å; L684-I686 HydrophobicContact CD2-CD1 4.15Å; L684-I686 HydrophobicContact CD2-CG1 4.37Å; L684-I686 HydrophobicContact CG-CD1 4.27Å; L684-I686 HydrophobicContact CG-CG1 3.99Å; L684-T757 WeakPolarHBondContact O-CA 2.98Å; L684-I758 PolarHBondContact N-O 2.58Å; L684-I758 PolarHBondContact O-N 3.22Å; L684-L760 HydrophobicContact CB-CD1 4.24Å; L684-A774 HydrophobicContact CD2-CB 4.19Å; L684-L776 HydrophobicContact CD2-CD2 4.34Å; L684-A792 HydrophobicContact CD1-CB 4.02Å
685	E	92.3	Very high	83.5	Confident	19 Å²	19	52.2 Å²	52.2	9%	0.089	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	127.2	171.9	-176.3	175.4	-103.8	0	0	109.5	Y649 Q650 F661 K755 T757	Y649-E685 CarbonylContact C-O 3.57Å; Y649-E685 VanDerWaalsContact CA-O 3.29Å; Y649-E685 WeakPolarHBondContact CA-O 3.22Å; Q650-E685 PolarHBondContact N-O 3.5Å; Q650-E685 WeakPolarHBondContact O-CB 3.06Å; Q650-E685 PolarHBondContact O-N 2.96Å; F661-E685 HydrophobicContact CD2-CB 4.31Å; F661-E685 HydrophobicContact CE1-CB 4.1Å; F661-E685 HydrophobicContact CE2-CB 3.7Å; F661-E685 HydrophobicContact CZ-CB 3.57Å; F661-E685 HydrophobicContact CZ-CG 4.47Å; E685-K755 WeakPolarHBondContact OE1-CE 3.2Å; E685-K755 IonicContact OE1-NZ 2.74Å; E685-K755 PolarHBondContact OE1-NZ 3.32Å; E685-K755 WeakPolarHBondContact OE2-CE 3.44Å; E685-K755 IonicContact OE2-NZ 3.32Å; E685-K755 PolarHBondContact OE2-NZ 2.98Å; E685-T757 HydrophobicContact CB-CG2 4.11Å; E685-T757 HydrophobicContact CG-CG2 4.13Å
686	I	94	Very high	83.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.4	-177.1	-54.6	176.8	0	0	0	108.2	L647 L684 V688 L710 I712 K755 F756 I758 L776	L647-I686 HydrophobicContact CD1-CG2 4.14Å; L647-I686 HydrophobicContact CG-CG2 4.31Å; L684-I686 HydrophobicContact CD2-CD1 4.15Å; L684-I686 HydrophobicContact CD2-CG1 4.37Å; L684-I686 HydrophobicContact CG-CD1 4.27Å; L684-I686 HydrophobicContact CG-CG1 3.99Å; I686-V688 HydrophobicContact CG2-CG2 4.23Å; I686-L710 HydrophobicContact CD1-CD2 4Å; I686-L710 HydrophobicContact CG2-CD2 4.04Å; I686-I712 HydrophobicContact CD1-CD1 3.69Å; I686-K755 WeakPolarHBondContact O-CA 3.4Å; I686-F756 HydrophobicContact CB-CD2 4.49Å; I686-F756 HydrophobicContact CB-CE1 4.24Å; I686-F756 HydrophobicContact CB-CE2 4.07Å; I686-F756 HydrophobicContact CB-CZ 3.93Å; I686-F756 HydrophobicContact CD1-CE2 4.08Å; I686-F756 HydrophobicContact CD1-CZ 4.43Å; I686-F756 HydrophobicContact CG2-CE1 4.1Å; I686-F756 HydrophobicContact CG2-CE2 4.39Å; I686-F756 HydrophobicContact CG2-CZ 3.8Å; I686-F756 PolarHBondContact N-O 3.08Å; I686-F756 PolarHBondContact O-N 2.98Å; I686-I758 HydrophobicContact CD1-CG1 4.02Å; I686-L776 HydrophobicContact CD1-CD2 3.95Å
687	T	92.9	Very high	84.6	Confident	17 Å²	17	57.8 Å²	57.8	10%	0.104	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.1	175.8	-60.9	0	0	0	0	109.2	S648 T689 K753 L754	S648-T687 PolarHBondContact N-O 3.3Å; S648-T687 PolarHBondContact O-N 3.05Å; S648-T687 WeakPolarHBondContact OG-CB 3.48Å; S648-T687 PolarHBondContact OG-O 3.01Å; T687-T689 HydrophobicContact CG2-CG2 4.48Å; T687-K753 HydrophobicContact CG2-CD 4.44Å; T687-K753 HydrophobicContact CG2-CG 4.12Å; T687-L754 CarbonylContact C-O 3.42Å; T687-L754 VanDerWaalsContact CA-O 3.31Å; T687-L754 WeakPolarHBondContact CA-O 3.35Å
688	V	93.7	Very high	85.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.3	175.5	-176.3	0	0	0	0	108.8	L645 K646 L647 I686 L744 L754 F756 L778	L645-V688 HydrophobicContact CD2-CG1 4.3Å; K646-V688 WeakPolarHBondContact O-CA 3.43Å; L647-V688 HydrophobicContact CD1-CG2 4.4Å; I686-V688 HydrophobicContact CG2-CG2 4.23Å; V688-L744 HydrophobicContact CG1-CD1 4.25Å; V688-L744 HydrophobicContact CG2-CD1 4.35Å; V688-L754 HydrophobicContact CB-CB 4.48Å; V688-L754 PolarHBondContact N-O 3.18Å; V688-L754 PolarHBondContact O-N 2.95Å; V688-F756 HydrophobicContact CG2-CE1 4.31Å; V688-L778 HydrophobicContact CG1-CD1 4.41Å; V688-L778 HydrophobicContact CG1-CD2 4.25Å; V688-L778 HydrophobicContact CG2-CD2 4.24Å
689	T	92.6	Very high	86.3	Confident	24 Å²	24	56.4 Å²	56.4	15%	0.147	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.9	178.1	50.6	0	0	0	0	110.9	L645 K646 T687 M691 A752 K753	L645-T689 WeakPolarHBondContact CA-O 3.23Å; K646-T689 PolarHBondContact N-O 2.95Å; K646-T689 PolarHBondContact O-N 3.05Å; T687-T689 HydrophobicContact CG2-CG2 4.48Å; T689-M691 HydrophobicContact CG2-CE 4.1Å; T689-M691 HydrophobicContact CG2-SD 4.29Å; T689-A752 WeakPolarHBondContact CA-O 3.27Å; T689-K753 HydrophobicContact CG2-CB 4.12Å; T689-K753 HydrophobicContact CG2-CD 4.07Å; T689-K753 HydrophobicContact CG2-CG 3.82Å
690	N	92.5	Very high	87	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	79.6	166.7	-169.2	22.4	0	0	0	108.7	N644 L645 D703 V748 K749 N751 A752	N644-N690 PolarHBondContact N-OD1 2.74Å; L645-N690 HydrophobicContact CD2-CB 3.92Å; N690-D703 PolarHBondContact ND2-O 3.18Å; N690-V748 HydrophobicContact CB-CG1 4.14Å; N690-V748 PolarHBondContact ND2-O 3.19Å; N690-K749 PolarHBondContact ND2-O 2.81Å; N690-N751 WeakPolarHBondContact O-CA 3.19Å; N690-N751 PolarHBondContact O-N 3.29Å; N690-A752 PolarHBondContact N-O 2.02Å
691	M	90.8	Very high	87.6	Confident	78 Å²	78	49.8 Å²	49.8	38%	0.384	27%	0.271	S	S	.	.			trans	-116.9	146.6	-177.7	-70.6	176.3	178	0	0	109	N644 T689 K753	N644-M691 WeakPolarHBondContact CB-O 3.38Å; N644-M691 PolarHBondContact ND2-O 3.27Å; T689-M691 HydrophobicContact CG2-CE 4.1Å; T689-M691 HydrophobicContact CG2-SD 4.29Å; M691-K753 HydrophobicContact CE-CB 4.42Å
692	P	89.7	Confident	87.8	Confident	18 Å²	18	46.6 Å²	46.6	12%	0.117	25%	0.254	C	S	.	.			trans	-58.5	145.4	173.7	25.7	-33.9	0	0	0	111.2	P698 D701 N751	P692-P698 HydrophobicContact CB-CB 4.12Å; P692-P698 HydrophobicContact CG-CB 4.02Å; P692-D701 WeakPolarHBondContact CA-OD1 3.34Å; P692-N751 VanDerWaalsContact CD-OD1 3.25Å; P692-N751 WeakPolarHBondContact CD-OD1 3.5Å
693	S	87.2	Confident	87.9	Confident	73 Å²	73	46.9 Å²	46.9	51%	0.51	26%	0.256	S	S	.	.	S	Bend	trans	-66.7	-41.3	177.4	-73.8	0	0	0	0	111.5	N644 K646 D701	N644-S693 PolarHBondContact ND2-N 3.39Å; N644-S693 VanDerWaalsContact ND2-N 3.2Å; N644-S693 PolarHBondContact ND2-OG 2.9Å; K646-S693 PolarHBondContact NZ-OG 2.87Å; S693-D701 WeakPolarHBondContact CB-OD2 3.34Å; S693-D701 PolarHBondContact N-OD1 3.39Å; S693-D701 PolarHBondContact N-OD2 3.04Å; S693-D701 PolarHBondContact OG-OD2 3.38Å
694	D	85.2	Confident	87.9	Confident	50 Å²	50	47.7 Å²	47.7	27%	0.267	26%	0.261	S	S	.	.			trans	-111.9	112.3	171.3	-174.9	4.7	0	0	0	110.7	L696 N697	D694-L696 PolarHBondContact O-N 2.89Å; D694-L696 WeakPolarHBondContact OD1-CB 3.45Å; D694-L696 PolarHBondContact OD1-N 3Å; D694-N697 HydrophobicContact CB-CB 4.34Å; D694-N697 CarbonylContact O-C 3.52Å; D694-N697 VanDerWaalsContact O-C 3.28Å; D694-N697 PolarHBondContact O-N 2.93Å; D694-N697 VanDerWaalsContact O-N 3.16Å; D694-N697 PolarHBondContact OD2-ND2 3.08Å
695	P	83.4	Confident	87.7	Confident	107 Å²	107	47.7 Å²	47.7	70%	0.695	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.4	172.8	-23.7	34.8	0	0	0	114.8
696	L	84.1	Confident	87.5	Confident	149 Å²	149	47.4 Å²	47.4	78%	0.78	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-29.3	176	-61.5	171.1	0	0	0	112.4	D694 P698	D694-L696 PolarHBondContact O-N 2.89Å; D694-L696 WeakPolarHBondContact OD1-CB 3.45Å; D694-L696 PolarHBondContact OD1-N 3Å; L696-P698 WeakPolarHBondContact O-CD 3.39Å
697	N	82.4	Confident	87.1	Confident	82 Å²	82	48.4 Å²	48.4	44%	0.439	27%	0.268	S	S	.	.	S	Bend	trans	-122.7	62.6	179.3	-62.6	-68.4	0	0	0	110.7	D694 E699 E700	D694-N697 HydrophobicContact CB-CB 4.34Å; D694-N697 CarbonylContact O-C 3.52Å; D694-N697 VanDerWaalsContact O-C 3.28Å; D694-N697 PolarHBondContact O-N 2.93Å; D694-N697 VanDerWaalsContact O-N 3.16Å; D694-N697 PolarHBondContact OD2-ND2 3.08Å; N697-E699 PolarHBondContact O-N 2.83Å; N697-E700 HydrophobicContact CB-CG 4.18Å; N697-E700 PolarHBondContact O-N 2.99Å
698	P	79.4	Confident	87	Confident	57 Å²	57	47.7 Å²	47.7	37%	0.37	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.1	-173	30.5	-38	0	0	0	114.1	P692 L696 D701 R750	P692-P698 HydrophobicContact CB-CB 4.12Å; P692-P698 HydrophobicContact CG-CB 4.02Å; L696-P698 WeakPolarHBondContact O-CD 3.39Å; P698-D701 VanDerWaalsContact O-O 3.08Å; P698-R750 VanDerWaalsContact O-CZ 3.22Å; P698-R750 PolarHBondContact O-NH1 3.04Å; P698-R750 PolarHBondContact O-NH2 3.49Å
699	E	78.1	Confident	86.9	Confident	145 Å²	145	49.4 Å²	49.4	68%	0.678	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.7	177	-57.5	-121.3	156	0	0	113	N697	N697-E699 PolarHBondContact O-N 2.83Å
700	E	82.9	Confident	87	Confident	131 Å²	131	48.2 Å²	48.2	61%	0.612	26%	0.264	S	S	*	.	S	Bend	trans	-76.9	-31.1	178.4	-69.7	-169.7	163.6	0	0	113.8	Q642 N697	Q642-E700 PolarHBondContact OE1-O 3.03Å; N697-E700 HydrophobicContact CB-CG 4.18Å; N697-E700 PolarHBondContact O-N 2.99Å
701	D	85.6	Confident	87	Confident	26 Å²	26	50.8 Å²	50.8	14%	0.139	28%	0.275	C	S	.	.	S	Bend	trans	-160	-180	176.6	74.1	-15.1	0	0	0	112.2	Q642 N644 P692 S693 P698 R750	Q642-D701 CarbonylContact O-C 3.49Å; N644-D701 HydrophobicContact CB-CB 4.42Å; N644-D701 WeakPolarHBondContact CB-OD2 3.24Å; N644-D701 PolarHBondContact ND2-OD2 3.39Å; P692-D701 WeakPolarHBondContact CA-OD1 3.34Å; S693-D701 WeakPolarHBondContact CB-OD2 3.34Å; S693-D701 PolarHBondContact N-OD1 3.39Å; S693-D701 PolarHBondContact N-OD2 3.04Å; S693-D701 PolarHBondContact OG-OD2 3.38Å; P698-D701 VanDerWaalsContact O-O 3.08Å; D701-R750 PolarHBondContact O-NH1 3.3Å; D701-R750 PolarHBondContact O-NH2 2.94Å; D701-R750 VanDerWaalsContact O-NH2 3.1Å
702	G	85.2	Confident	87.2	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.			trans	82.6	22	177.9	0	0	0	0	0	114.5	Q642 R750	Q642-G702 PolarHBondContact O-N 3.27Å; G702-R750 VanDerWaalsContact C-CZ 3.42Å; G702-R750 WeakPolarHBondContact O-CA 3.45Å; G702-R750 VanDerWaalsContact O-CB 3.22Å; G702-R750 WeakPolarHBondContact O-CB 3.32Å; G702-R750 WeakPolarHBondContact O-CG 3.15Å; G702-R750 PolarHBondContact O-NE 2.89Å; G702-R750 PolarHBondContact O-NH1 3.31Å
703	D	90.5	Very high	87.3	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.037	27%	0.272	C	S	.	.			trans	-60.8	167.6	167.7	-80.3	-24.5	0	0	0	112.6	C635 G636 Q642 N690 A705 R750	C635-D703 WeakPolarHBondContact CA-OD2 3.47Å; G636-D703 PolarHBondContact N-OD1 2.9Å; G636-D703 PolarHBondContact N-OD2 2.86Å; Q642-D703 PolarHBondContact N-OD2 2.83Å; Q642-D703 WeakPolarHBondContact O-CB 3.36Å; Q642-D703 PolarHBondContact O-N 3.48Å; N690-D703 PolarHBondContact ND2-O 3.18Å; D703-A705 PolarHBondContact O-N 2.83Å; D703-R750 IonicContact OD1-CZ 2.91Å; D703-R750 IonicContact OD1-NE 3.95Å; D703-R750 PolarHBondContact OD1-NE 3Å; D703-R750 IonicContact OD1-NH2 3.94Å; D703-R750 PolarHBondContact OD1-NH2 3.15Å
704	D	90.2	Very high	87.5	Confident	18 Å²	18	46.3 Å²	46.3	10%	0.096	25%	0.249	C	C	.	.			trans	-52.1	121.2	176.3	-85.4	28.5	0	0	0	111.8	G634 H706 P747 K749 R750 S782	G634-D704 WeakPolarHBondContact O-CB 3.36Å; G634-D704 PolarHBondContact O-N 2.92Å; D704-H706 PolarHBondContact O-CD2 3Å; D704-H706 PolarHBondContact O-N 2.93Å; D704-P747 HydrophobicContact CB-CB 3.72Å; D704-P747 HydrophobicContact CB-CG 4.07Å; D704-P747 WeakPolarHBondContact OD2-CG 3.24Å; D704-K749 WeakPolarHBondContact OD1-CA 3.49Å; D704-R750 PolarHBondContact OD1-N 2.73Å; D704-S782 PolarHBondContact O-OG 2.92Å; D704-S782 VanDerWaalsContact O-OG 3.07Å
705	A	88.9	Confident	87.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-93.2	104	-175.2	0	0	0	0	0	110.6	L645 D703 S708 P747 V748 S782	L645-A705 HydrophobicContact CD1-CB 4.08Å; L645-A705 HydrophobicContact CD2-CB 3.78Å; L645-A705 HydrophobicContact CG-CB 3.96Å; D703-A705 PolarHBondContact O-N 2.83Å; A705-S708 VanDerWaalsContact CB-OG 3.32Å; A705-S708 WeakPolarHBondContact CB-OG 3.06Å; A705-S708 PolarHBondContact O-OG 3.46Å; A705-P747 CarbonylContact O-C 3.57Å; A705-P747 WeakPolarHBondContact O-CA 3.28Å; A705-V748 HydrophobicContact CB-CB 4.28Å; A705-V748 PolarHBondContact N-O 2.81Å; A705-V748 PolarHBondContact O-N 2.84Å; A705-S782 WeakPolarHBondContact CA-OG 3.33Å
706	H	88.3	Confident	87.8	Confident	12 Å²	12	47.2 Å²	47.2	6%	0.056	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	149.7	-173	-67.1	-94.8	0	0	0	112.5	L585 D704 S708 T780 I781 S782	L585-H706 HydrophobicContact CD1-CB 3.84Å; L585-H706 HydrophobicContact CG-CB 3.92Å; D704-H706 PolarHBondContact O-CD2 3Å; D704-H706 PolarHBondContact O-N 2.93Å; H706-S708 PolarHBondContact O-N 2.99Å; H706-S708 VanDerWaalsContact O-N 3.12Å; H706-T780 PolarHBondContact O-OG1 3.17Å; H706-I781 HydrophobicContact CB-CD1 4.01Å; H706-I781 HydrophobicContact CB-CG1 3.73Å; H706-I781 WeakPolarHBondContact O-CG1 3.3Å; H706-I781 PolarHBondContact O-N 3.46Å; H706-S782 PolarHBondContact N-OG 3.26Å
707	A	86.4	Confident	87.7	Confident	22 Å²	22	42 Å²	42	18%	0.182	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	38.8	49.6	-176.2	0	0	0	0	0	113.5	N746 I781	A707-N746 PolarHBondContact N-OD1 3.31Å; A707-I781 HydrophobicContact CB-CD1 4Å; A707-I781 HydrophobicContact CB-CG1 3.96Å; A707-I781 HydrophobicContact CB-CG2 4.29Å
708	S	90.4	Very high	88	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129	-175.2	-63.5	0	0	0	0	110.9	A705 H706 L744 G745 A779	A705-S708 VanDerWaalsContact CB-OG 3.32Å; A705-S708 WeakPolarHBondContact CB-OG 3.06Å; A705-S708 PolarHBondContact O-OG 3.46Å; H706-S708 PolarHBondContact O-N 2.99Å; H706-S708 VanDerWaalsContact O-N 3.12Å; S708-L744 WeakPolarHBondContact O-CB 3.46Å; S708-L744 PolarHBondContact O-N 2.72Å; S708-G745 PolarHBondContact N-O 3.37Å; S708-G745 VanDerWaalsContact N-O 3.08Å; S708-A779 CarbonylContact C-O 3.52Å; S708-A779 WeakPolarHBondContact CA-O 3.32Å
709	Q	92	Very high	88.4	Confident	37 Å²	37	36.8 Å²	36.8	17%	0.173	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.3	-177.5	-57.8	-167.8	-68.2	0	0	111.3	F711 E741 C742 D743 A779	Q709-F711 HydrophobicContact CB-CE2 4.2Å; Q709-F711 HydrophobicContact CB-CZ 4.34Å; Q709-E741 PolarHBondContact NE2-OE1 2.91Å; Q709-C742 CarbonylContact C-O 3.59Å; Q709-C742 WeakPolarHBondContact CA-O 3.35Å; Q709-D743 PolarHBondContact NE2-OD1 3.09Å; Q709-A779 PolarHBondContact N-O 3.07Å; Q709-A779 PolarHBondContact O-N 2.91Å
710	L	93.8	Very high	89	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.7	168.9	174	66.9	0	0	0	109.1	L647 I686 I712 C742 L744 F756 L776 L778	L647-L710 HydrophobicContact CD1-CD1 3.61Å; L647-L710 HydrophobicContact CD1-CD2 4.3Å; I686-L710 HydrophobicContact CD1-CD2 4Å; I686-L710 HydrophobicContact CG2-CD2 4.04Å; L710-I712 HydrophobicContact CD2-CD1 3.99Å; L710-I712 HydrophobicContact CD2-CG1 4Å; L710-I712 HydrophobicContact CG-CD1 4.41Å; L710-I712 HydrophobicContact CG-CG1 3.91Å; L710-C742 HydrophobicContact CB-CB 4.25Å; L710-C742 PolarHBondContact N-O 3.5Å; L710-C742 PolarHBondContact O-N 3.26Å; L710-L744 HydrophobicContact CB-CD1 4.19Å; L710-L744 HydrophobicContact CB-CD2 3.94Å; L710-L744 HydrophobicContact CB-CG 4.24Å; L710-F756 HydrophobicContact CD2-CE2 4.22Å; L710-F756 HydrophobicContact CD2-CZ 3.71Å; L710-L776 HydrophobicContact CD1-CB 4.19Å; L710-L778 HydrophobicContact CB-CD2 4.21Å; L710-L778 HydrophobicContact CD1-CD2 4.01Å; L710-L778 HydrophobicContact CD1-CG 4.31Å
711	F	93.6	Very high	89.2	Confident	53 Å²	53	28.8 Å²	28.8	23%	0.232	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.9	169.4	-57.3	-81.4	0	0	0	109.2	Q709 E741 Q777 A779	Q709-F711 HydrophobicContact CB-CE2 4.2Å; Q709-F711 HydrophobicContact CB-CZ 4.34Å; F711-E741 HydrophobicContact CD1-CB 4.24Å; F711-E741 HydrophobicContact CD1-CG 4.06Å; F711-E741 HydrophobicContact CE1-CB 4.26Å; F711-E741 HydrophobicContact CE1-CG 3.66Å; F711-E741 HydrophobicContact CZ-CG 4.46Å; F711-Q777 HydrophobicContact CB-CB 4.42Å; F711-Q777 PolarHBondContact N-O 3.26Å; F711-Q777 PolarHBondContact O-N 2.58Å; F711-A779 HydrophobicContact CD2-CB 4.48Å; F711-A779 HydrophobicContact CE2-CB 3.94Å
712	I	93.8	Very high	89.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	117.5	-179.8	-50.7	-178.5	0	0	0	107.7	I686 L710 L714 Q739 V740 I758 D775 L776	I686-I712 HydrophobicContact CD1-CD1 3.69Å; L710-I712 HydrophobicContact CD2-CD1 3.99Å; L710-I712 HydrophobicContact CD2-CG1 4Å; L710-I712 HydrophobicContact CG-CD1 4.41Å; L710-I712 HydrophobicContact CG-CG1 3.91Å; I712-L714 HydrophobicContact CG2-CD2 3.77Å; I712-L714 HydrophobicContact CG2-CG 4.04Å; I712-Q739 CarbonylContact O-C 3.57Å; I712-Q739 VanDerWaalsContact O-CA 3.31Å; I712-Q739 WeakPolarHBondContact O-CA 3.5Å; I712-V740 HydrophobicContact CB-CB 4.14Å; I712-V740 PolarHBondContact N-O 2.99Å; I712-V740 PolarHBondContact O-N 2.82Å; I712-I758 HydrophobicContact CD1-CD1 4.24Å; I712-I758 HydrophobicContact CD1-CG1 3.76Å; I712-D775 CarbonylContact C-O 3.6Å; I712-D775 WeakPolarHBondContact CA-O 3.26Å; I712-L776 HydrophobicContact CB-CD2 4.12Å; I712-L776 HydrophobicContact CD1-CD2 4.13Å; I712-L776 HydrophobicContact CG1-CD2 3.71Å; I712-L776 HydrophobicContact CG2-CD2 3.75Å
713	T	92.9	Very high	89.3	Confident	70 Å²	70	30.2 Å²	30.2	43%	0.429	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.2	174.5	-53.3	0	0	0	0	109.1	A774 D775	T713-A774 WeakPolarHBondContact O-CA 3.4Å; T713-D775 PolarHBondContact N-O 2.86Å; T713-D775 PolarHBondContact O-N 2.91Å
714	L	91.4	Very high	89.2	Confident	6 Å²	6	36 Å²	36	3%	0.031	20%	0.201	C	C	.	.			trans	-118.7	134.9	-173.6	-61.6	173	0	0	0	110.3	I712 S738 V740 L760 A774	I712-L714 HydrophobicContact CG2-CD2 3.77Å; I712-L714 HydrophobicContact CG2-CG 4.04Å; L714-S738 PolarHBondContact N-O 3.31Å; L714-V740 HydrophobicContact CD1-CG2 3.94Å; L714-L760 HydrophobicContact CD1-CD2 3.58Å; L714-L760 HydrophobicContact CD2-CD1 4.31Å; L714-L760 HydrophobicContact CD2-CD2 3.69Å; L714-L760 HydrophobicContact CG-CD2 4.29Å; L714-A774 HydrophobicContact CD2-CB 3.72Å
715	P	89.4	Confident	89	Confident	39 Å²	39	37.4 Å²	37.4	25%	0.253	21%	0.21	S	C	.	.			trans	-72.9	157.7	173.9	31.5	-35.4	0	0	0	111.4	T717 L718 T773	P715-T717 PolarHBondContact O-N 3.05Å; P715-L718 HydrophobicContact CG-CB 4.3Å; P715-L718 HydrophobicContact CG-CD1 4.41Å; P715-L718 CarbonylContact O-C 3.57Å; P715-L718 PolarHBondContact O-N 3.42Å; P715-T773 WeakPolarHBondContact CD-O 3.38Å; P715-T773 WeakPolarHBondContact CG-O 3.07Å
716	D	83.8	Confident	88.7	Confident	136 Å²	136	38.8 Å²	38.8	73%	0.727	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-17.6	179.4	-63.1	-32.9	0	0	0	114.1	N764	D716-N764 WeakPolarHBondContact O-CB 3.49Å; D716-N764 PolarHBondContact O-ND2 3.04Å
717	T	83.7	Confident	88.1	Confident	41 Å²	41	44.6 Å²	44.6	25%	0.252	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-20.4	174.7	50.9	0	0	0	0	113.8	P715 T769	P715-T717 PolarHBondContact O-N 3.05Å; T717-T769 HydrophobicContact CG2-CG2 4.5Å
718	L	87.1	Confident	87.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-134.3	58.2	-174.7	-69.8	172.4	0	0	0	112.5	V682 P715 L760 I765 L772	V682-L718 HydrophobicContact CG1-CD2 3.93Å; P715-L718 HydrophobicContact CG-CB 4.3Å; P715-L718 HydrophobicContact CG-CD1 4.41Å; P715-L718 CarbonylContact O-C 3.57Å; P715-L718 PolarHBondContact O-N 3.42Å; L718-L760 HydrophobicContact CB-CB 4.49Å; L718-L760 HydrophobicContact CB-CD1 4.49Å; L718-L760 HydrophobicContact CD2-CB 4.44Å; L718-I765 HydrophobicContact CD2-CD1 4.08Å; L718-I765 HydrophobicContact CD2-CG1 4.43Å; L718-L772 HydrophobicContact CD1-CB 3.78Å; L718-L772 HydrophobicContact CD1-CD2 4Å; L718-L772 HydrophobicContact CD1-CG 4.31Å; L718-L772 HydrophobicContact CD2-CD2 4.17Å; L718-L772 HydrophobicContact CG-CD2 4.32Å
719	P	88.1	Confident	87.3	Confident	28 Å²	28	49.6 Å²	49.6	18%	0.182	28%	0.277	C	S	.	.			trans	-66.4	147.5	-177.9	28.5	-33.7	0	0	0	111.6	A721 S761	P719-A721 PolarHBondContact O-N 3.42Å; P719-S761 PolarHBondContact O-N 2.8Å
720	Y	91.3	Very high	87.1	Confident	53 Å²	53	52.5 Å²	52.5	21%	0.208	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	128	177.9	176.8	-101.1	0	0	0	112.7	G722 S723 A733 G737 V740 I758	Y720-G722 VanDerWaalsContact CE2-C 3.41Å; Y720-G722 WeakPolarHBondContact CE2-O 3.45Å; Y720-G722 VanDerWaalsContact CZ-CA 3.42Å; Y720-S723 WeakPolarHBondContact OH-CB 3.45Å; Y720-S723 PolarHBondContact OH-N 3.06Å; Y720-S723 VanDerWaalsContact OH-N 3.15Å; Y720-S723 PolarHBondContact OH-OG 3.19Å; Y720-A733 HydrophobicContact CD1-CB 3.36Å; Y720-A733 HydrophobicContact CE1-CB 3.66Å; Y720-A733 HydrophobicContact CG-CB 3.81Å; Y720-G737 WeakPolarHBondContact CB-O 3.4Å; Y720-G737 PolarHBondContact N-O 3.31Å; Y720-V740 HydrophobicContact CD2-CG1 4.38Å; Y720-V740 HydrophobicContact CD2-CG2 3.59Å; Y720-V740 HydrophobicContact CE2-CG1 4.11Å; Y720-V740 HydrophobicContact CE2-CG2 4.17Å; Y720-V740 HydrophobicContact CG-CG2 3.96Å; Y720-I758 HydrophobicContact CD2-CG2 3.75Å; Y720-I758 HydrophobicContact CE2-CG2 3.93Å
721	A	86.1	Confident	87	Confident	56 Å²	56	53.2 Å²	53.2	46%	0.463	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-12	177.8	0	0	0	0	0	113.7	L681 P719 N759	L681-A721 HydrophobicContact CD2-CB 3.68Å; P719-A721 PolarHBondContact O-N 3.42Å; A721-N759 HydrophobicContact CB-CB 4.39Å; A721-N759 WeakPolarHBondContact CB-O 3.33Å; A721-N759 PolarHBondContact N-O 3.38Å
722	G	87.1	Confident	86.8	Confident	17 Å²	17	57.3 Å²	57.3	18%	0.175	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.9	171.8	177.2	0	0	0	0	0	113.1	Y720 N759	Y720-G722 VanDerWaalsContact CE2-C 3.41Å; Y720-G722 WeakPolarHBondContact CE2-O 3.45Å; Y720-G722 VanDerWaalsContact CZ-CA 3.42Å; G722-N759 PolarHBondContact N-O 3.45Å; G722-N759 WeakPolarHBondContact O-CB 3.22Å; G722-N759 PolarHBondContact O-N 3.34Å
723	S	87.8	Confident	86.6	Confident	38 Å²	38	59 Å²	59	27%	0.266	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.2	177.9	64.3	0	0	0	0	111.3	Y720 T757	Y720-S723 WeakPolarHBondContact OH-CB 3.45Å; Y720-S723 PolarHBondContact OH-N 3.06Å; Y720-S723 VanDerWaalsContact OH-N 3.15Å; Y720-S723 PolarHBondContact OH-OG 3.19Å; S723-T757 WeakPolarHBondContact CA-O 3.32Å
724	R	86.9	Confident	86.4	Confident	129 Å²	129	58.7 Å²	58.7	49%	0.487	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	110.2	163.7	-63.3	175.9	166.9	-149.8	0.6	108.1	D659 F756 T757	D659-R724 VanDerWaalsContact CG-NH1 3.27Å; D659-R724 IonicContact OD1-CZ 3.59Å; D659-R724 IonicContact OD1-NH1 2.77Å; D659-R724 PolarHBondContact OD1-NH1 2.79Å; D659-R724 IonicContact OD1-NH2 3.01Å; D659-R724 PolarHBondContact OD1-NH2 2.91Å; D659-R724 IonicContact OD2-NH1 3.21Å; R724-F756 WeakPolarHBondContact O-CB 3.32Å; R724-T757 PolarHBondContact N-O 3.15Å; R724-T757 PolarHBondContact O-N 3.23Å
725	V	86.7	Confident	86	Confident	47 Å²	47	67.9 Å²	67.9	29%	0.285	37%	0.37	S	S	.	.			trans	-126.5	152.5	-174.6	-66.7	0	0	0	0	110.9	M729 C731 F756	V725-M729 HydrophobicContact CB-CB 4.09Å; V725-M729 WeakPolarHBondContact CG2-O 3.48Å; V725-C731 HydrophobicContact CG1-CB 4.49Å; V725-F756 HydrophobicContact CG1-CB 4.06Å; V725-F756 HydrophobicContact CG1-CD2 4.07Å; V725-F756 HydrophobicContact CG1-CG 4.33Å
726	P	82.5	Confident	85.6	Confident	30 Å²	30	72.4 Å²	72.4	20%	0.195	39%	0.392	C	S	.	.			trans	-56.8	153.8	167.3	-24.1	34.2	0	0	0	112.2	Q728 M729	P726-Q728 HydrophobicContact CB-CG 4.42Å; P726-Q728 PolarHBondContact O-N 2.79Å; P726-Q728 VanDerWaalsContact O-N 3.12Å; P726-M729 HydrophobicContact CG-SD 4.08Å; P726-M729 PolarHBondContact O-N 2.04Å
727	P	76.4	Confident	85.5	Confident	133 Å²	133	66.3 Å²	66.3	86%	0.864	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.2	-177.7	26.3	-35.2	0	0	0	114.4	M729	P727-M729 VanDerWaalsContact C-N 3.28Å
728	Q	75.5	Confident	85.6	Confident	123 Å²	123	66 Å²	66	58%	0.575	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	2.1	172.8	69.5	-89.1	16.4	0	0	114.8	P726	P726-Q728 HydrophobicContact CB-CG 4.42Å; P726-Q728 PolarHBondContact O-N 2.79Å; P726-Q728 VanDerWaalsContact O-N 3.12Å
729	M	84.6	Confident	85.8	Confident	6 Å²	6	70.3 Å²	70.3	3%	0.03	38%	0.381	C	S	.	.			trans	-125.1	146.6	-177	-70.3	178.5	59	0	0	111.3	V725 P726 P727 D743 L744 L754 F756	V725-M729 HydrophobicContact CB-CB 4.09Å; V725-M729 WeakPolarHBondContact CG2-O 3.48Å; P726-M729 HydrophobicContact CG-SD 4.08Å; P726-M729 PolarHBondContact O-N 2.04Å; P727-M729 VanDerWaalsContact C-N 3.28Å; M729-D743 WeakPolarHBondContact CA-O 3.16Å; M729-L744 HydrophobicContact CE-CD2 3.52Å; M729-L744 WeakPolarHBondContact CG-O 3.26Å; M729-L754 HydrophobicContact SD-CB 4.25Å; M729-L754 HydrophobicContact SD-CD1 4.1Å; M729-L754 HydrophobicContact SD-CD2 4.15Å; M729-L754 HydrophobicContact SD-CG 4.4Å; M729-F756 HydrophobicContact CE-CD1 3.52Å; M729-F756 HydrophobicContact CE-CD2 4.28Å; M729-F756 HydrophobicContact CE-CE1 3.54Å; M729-F756 HydrophobicContact CE-CE2 4.27Å; M729-F756 HydrophobicContact CE-CG 3.91Å; M729-F756 HydrophobicContact CE-CZ 3.92Å; M729-F756 HydrophobicContact SD-CD1 4.19Å
730	I	87.8	Confident	86.1	Confident	97 Å²	97	69 Å²	69	50%	0.497	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.7	178.9	-60.4	174.7	0	0	0	108.3	Q732 C742 D743	I730-Q732 HydrophobicContact CG2-CG 4.06Å; I730-C742 CarbonylContact O-C 3.56Å; I730-C742 WeakPolarHBondContact O-CA 3.22Å; I730-D743 PolarHBondContact N-O 2.74Å; I730-D743 PolarHBondContact O-N 2.85Å
731	C	90.6	Very high	86.1	Confident	15 Å²	15	70.4 Å²	70.4	10%	0.101	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.8	170.6	-67.8	0	0	0	0	110.2	V725 V740 E741 C742	V725-C731 HydrophobicContact CG1-CB 4.49Å; C731-V740 HydrophobicContact CB-CG1 4.16Å; C731-E741 CarbonylContact C-O 3.58Å; C731-E741 VanDerWaalsContact CA-O 3.3Å; C731-E741 WeakPolarHBondContact CA-O 3.49Å; C731-C742 HydrophobicContact CB-CB 4.18Å; C731-C742 WeakPolarHBondContact CB-SG 3.34Å; C731-C742 WeakPolarHBondContact SG-CB 3.42Å; C731-C742 CovalentContact SG-SG 2.04Å; C731-C742 PolarHBondContact SG-SG 2.83Å
732	Q	89.9	Confident	86.4	Confident	139 Å²	139	67.8 Å²	67.8	65%	0.65	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.2	175.9	-59.5	-171.8	13.7	0	0	109.7	I730 V740 E741	I730-Q732 HydrophobicContact CG2-CG 4.06Å; Q732-V740 CarbonylContact O-C 3.38Å; Q732-V740 WeakPolarHBondContact O-CA 3.19Å; Q732-V740 WeakPolarHBondContact O-CG1 3.37Å; Q732-E741 PolarHBondContact N-O 3Å; Q732-E741 PolarHBondContact O-N 2.74Å
733	A	89.4	Confident	86.6	Confident	37 Å²	37	68.8 Å²	68.8	31%	0.306	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	149.5	176.2	0	0	0	0	0	111	Y720 Q739 V740	Y720-A733 HydrophobicContact CD1-CB 3.36Å; Y720-A733 HydrophobicContact CE1-CB 3.66Å; Y720-A733 HydrophobicContact CG-CB 3.81Å; A733-Q739 CarbonylContact C-O 3.54Å; A733-Q739 WeakPolarHBondContact CA-O 3.37Å; A733-V740 HydrophobicContact CB-CG1 4.46Å; A733-V740 HydrophobicContact CB-CG2 4.09Å
734	N	88.4	Confident	86.7	Confident	62 Å²	62	67 Å²	67	33%	0.332	35%	0.349	S	S	.	.			trans	-66	167.9	170.3	73.3	4.7	0	0	0	111.5	N736 G737 S738 Q739	N734-N736 PolarHBondContact O-N 3.15Å; N734-N736 PolarHBondContact OD1-N 3.27Å; N734-G737 PolarHBondContact O-N 3.5Å; N734-G737 WeakPolarHBondContact OD1-CA 3.2Å; N734-G737 PolarHBondContact OD1-N 2.82Å; N734-S738 PolarHBondContact ND2-OG 2.86Å; N734-S738 PolarHBondContact OD1-N 2.96Å; N734-Q739 PolarHBondContact N-O 2.81Å; N734-Q739 WeakPolarHBondContact ND2-CB 3.42Å; N734-Q739 PolarHBondContact ND2-N 2.83Å; N734-Q739 PolarHBondContact OD1-N 3.49Å
735	Q	83	Confident	86.5	Confident	199 Å²	199	61.7 Å²	61.7	93%	0.93	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.9	-175.7	-65.7	-176.3	4.5	0	0	114.2
736	N	80.2	Confident	86.3	Confident	134 Å²	134	61.9 Å²	61.9	72%	0.717	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-5.2	-178.2	-65.5	0.6	0	0	0	113.2	N734 S738	N734-N736 PolarHBondContact O-N 3.15Å; N734-N736 PolarHBondContact OD1-N 3.27Å; N736-S738 PolarHBondContact O-N 2.93Å
737	G	82	Confident	86.5	Confident	9 Å²	9	62.4 Å²	62.4	9%	0.093	34%	0.337	C	S	.	.	S	Bend	trans	67.2	15.7	-175.5	0	0	0	0	0	115.1	Y720 N734	Y720-G737 WeakPolarHBondContact CB-O 3.4Å; Y720-G737 PolarHBondContact N-O 3.31Å; N734-G737 PolarHBondContact O-N 3.5Å; N734-G737 WeakPolarHBondContact OD1-CA 3.2Å; N734-G737 PolarHBondContact OD1-N 2.82Å
738	S	87.3	Confident	87.1	Confident	33 Å²	33	56.4 Å²	56.4	23%	0.231	30%	0.298	C	S	.	.	S	Bend	trans	-94.3	-15.2	-177.4	62.8	0	0	0	0	114.2	L714 N734 N736	L714-S738 PolarHBondContact N-O 3.31Å; N734-S738 PolarHBondContact ND2-OG 2.86Å; N734-S738 PolarHBondContact OD1-N 2.96Å; N736-S738 PolarHBondContact O-N 2.93Å
739	Q	90.8	Very high	87.8	Confident	91 Å²	91	57.2 Å²	57.2	43%	0.425	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	134.4	173.6	-165.3	179.8	9	0	0	109.6	I712 A733 N734	I712-Q739 CarbonylContact O-C 3.57Å; I712-Q739 VanDerWaalsContact O-CA 3.31Å; I712-Q739 WeakPolarHBondContact O-CA 3.5Å; A733-Q739 CarbonylContact C-O 3.54Å; A733-Q739 WeakPolarHBondContact CA-O 3.37Å; N734-Q739 PolarHBondContact N-O 2.81Å; N734-Q739 WeakPolarHBondContact ND2-CB 3.42Å; N734-Q739 PolarHBondContact ND2-N 2.83Å; N734-Q739 PolarHBondContact OD1-N 3.49Å
740	V	92.9	Very high	88	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.2	176.4	-165.1	0	0	0	0	108.9	I712 L714 Y720 C731 Q732 A733	I712-V740 HydrophobicContact CB-CB 4.14Å; I712-V740 PolarHBondContact N-O 2.99Å; I712-V740 PolarHBondContact O-N 2.82Å; L714-V740 HydrophobicContact CD1-CG2 3.94Å; Y720-V740 HydrophobicContact CD2-CG1 4.38Å; Y720-V740 HydrophobicContact CD2-CG2 3.59Å; Y720-V740 HydrophobicContact CE2-CG1 4.11Å; Y720-V740 HydrophobicContact CE2-CG2 4.17Å; Y720-V740 HydrophobicContact CG-CG2 3.96Å; C731-V740 HydrophobicContact CB-CG1 4.16Å; Q732-V740 CarbonylContact O-C 3.38Å; Q732-V740 WeakPolarHBondContact O-CA 3.19Å; Q732-V740 WeakPolarHBondContact O-CG1 3.37Å; A733-V740 HydrophobicContact CB-CG1 4.46Å; A733-V740 HydrophobicContact CB-CG2 4.09Å
741	E	93	Very high	88.1	Confident	84 Å²	84	60.1 Å²	60.1	39%	0.393	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.3	173.1	-179.2	177.1	173.6	0	0	108.6	Q709 F711 C731 Q732	Q709-E741 PolarHBondContact NE2-OE1 2.91Å; F711-E741 HydrophobicContact CD1-CB 4.24Å; F711-E741 HydrophobicContact CD1-CG 4.06Å; F711-E741 HydrophobicContact CE1-CB 4.26Å; F711-E741 HydrophobicContact CE1-CG 3.66Å; F711-E741 HydrophobicContact CZ-CG 4.46Å; C731-E741 CarbonylContact C-O 3.58Å; C731-E741 VanDerWaalsContact CA-O 3.3Å; C731-E741 WeakPolarHBondContact CA-O 3.49Å; Q732-E741 PolarHBondContact N-O 3Å; Q732-E741 PolarHBondContact O-N 2.74Å
742	C	92.6	Very high	88.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	113.9	-179.6	-69.9	0	0	0	0	110.7	Q709 L710 I730 C731 L744	Q709-C742 CarbonylContact C-O 3.59Å; Q709-C742 WeakPolarHBondContact CA-O 3.35Å; L710-C742 HydrophobicContact CB-CB 4.25Å; L710-C742 PolarHBondContact N-O 3.5Å; L710-C742 PolarHBondContact O-N 3.26Å; I730-C742 CarbonylContact O-C 3.56Å; I730-C742 WeakPolarHBondContact O-CA 3.22Å; C731-C742 HydrophobicContact CB-CB 4.18Å; C731-C742 WeakPolarHBondContact CB-SG 3.34Å; C731-C742 WeakPolarHBondContact SG-CB 3.42Å; C731-C742 CovalentContact SG-SG 2.04Å; C731-C742 PolarHBondContact SG-SG 2.83Å; C742-L744 HydrophobicContact CB-CD2 4.44Å; C742-L744 PolarHBondContact O-N 2.92Å
743	D	90.7	Very high	88.2	Confident	38 Å²	38	60.4 Å²	60.4	20%	0.203	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	114.9	168	-73.3	-31.2	0	0	0	109.1	R582 Q709 M729 I730	R582-D743 IonicContact CZ-OD1 3.48Å; R582-D743 IonicContact CZ-OD2 2.77Å; R582-D743 VanDerWaalsContact CZ-OD2 3.23Å; R582-D743 VanDerWaalsContact NH1-CG 3.31Å; R582-D743 IonicContact NH1-OD1 3.34Å; R582-D743 PolarHBondContact NH1-OD1 3.16Å; R582-D743 IonicContact NH1-OD2 2.73Å; R582-D743 PolarHBondContact NH1-OD2 2.97Å; R582-D743 VanDerWaalsContact NH1-OD2 3.12Å; R582-D743 IonicContact NH2-OD1 3.08Å; R582-D743 IonicContact NH2-OD2 2.99Å; R582-D743 PolarHBondContact NH2-OD2 3.09Å; Q709-D743 PolarHBondContact NE2-OD1 3.09Å; M729-D743 WeakPolarHBondContact CA-O 3.16Å; I730-D743 PolarHBondContact N-O 2.74Å; I730-D743 PolarHBondContact O-N 2.85Å
744	L	89.2	Confident	88.3	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-29.8	-175.5	-56.7	-178.1	0	0	0	112.8	V688 S708 L710 M729 C742 V748 L754 F756 L778	V688-L744 HydrophobicContact CG1-CD1 4.25Å; V688-L744 HydrophobicContact CG2-CD1 4.35Å; S708-L744 WeakPolarHBondContact O-CB 3.46Å; S708-L744 PolarHBondContact O-N 2.72Å; L710-L744 HydrophobicContact CB-CD1 4.19Å; L710-L744 HydrophobicContact CB-CD2 3.94Å; L710-L744 HydrophobicContact CB-CG 4.24Å; M729-L744 HydrophobicContact CE-CD2 3.52Å; M729-L744 WeakPolarHBondContact CG-O 3.26Å; C742-L744 HydrophobicContact CB-CD2 4.44Å; C742-L744 PolarHBondContact O-N 2.92Å; L744-V748 HydrophobicContact CB-CG2 3.97Å; L744-L754 HydrophobicContact CB-CD1 3.88Å; L744-L754 VanDerWaalsContact O-CD1 3.3Å; L744-L754 WeakPolarHBondContact O-CD1 3.37Å; L744-F756 HydrophobicContact CD2-CE1 4.06Å; L744-F756 HydrophobicContact CD2-CZ 3.94Å; L744-L778 HydrophobicContact CD1-CD2 3.6Å
745	G	82.4	Confident	88.5	Confident	17 Å²	17	61.5 Å²	61.5	18%	0.175	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.2	158.8	179.9	0	0	0	0	0	112.5	S708	S708-G745 PolarHBondContact N-O 3.37Å; S708-G745 VanDerWaalsContact N-O 3.08Å
746	N	83.5	Confident	88.9	Confident	51 Å²	51	52.3 Å²	52.3	27%	0.273	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	83.8	179	-174.9	32.3	0	0	0	112	R582 A707	R582-N746 PolarHBondContact O-ND2 2.96Å; R582-N746 PolarHBondContact O-OD1 2.59Å; A707-N746 PolarHBondContact N-OD1 3.31Å
747	P	87	Confident	89.4	Confident	41 Å²	41	47 Å²	47	27%	0.266	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.3	163.3	1.8	32.6	-34.1	0	0	0	114.7	D704 A705	D704-P747 HydrophobicContact CB-CB 3.72Å; D704-P747 HydrophobicContact CB-CG 4.07Å; D704-P747 WeakPolarHBondContact OD2-CG 3.24Å; A705-P747 CarbonylContact O-C 3.57Å; A705-P747 WeakPolarHBondContact O-CA 3.28Å
748	V	89.1	Confident	89.8	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.042	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-86.7	106.6	156.9	176.8	0	0	0	0	107.4	L645 N690 A705 L744 A752 L754	L645-V748 HydrophobicContact CD2-CG1 4.37Å; N690-V748 HydrophobicContact CB-CG1 4.14Å; N690-V748 PolarHBondContact ND2-O 3.19Å; A705-V748 HydrophobicContact CB-CB 4.28Å; A705-V748 PolarHBondContact N-O 2.81Å; A705-V748 PolarHBondContact O-N 2.84Å; L744-V748 HydrophobicContact CB-CG2 3.97Å; V748-A752 HydrophobicContact CG1-CB 3.91Å; V748-L754 HydrophobicContact CG1-CD1 3.95Å; V748-L754 HydrophobicContact CG1-CG 4.43Å; V748-L754 HydrophobicContact CG2-CD1 3.91Å
749	K	89.7	Confident	90	Very high	139 Å²	139	46.2 Å²	46.2	60%	0.604	23%	0.229	S	C	*	.			trans	-62.1	155.2	-168.5	-61.2	-160.4	169.8	-163.5	0	114.3	N690 D704 N751 A752	N690-K749 PolarHBondContact ND2-O 2.81Å; D704-K749 WeakPolarHBondContact OD1-CA 3.49Å; K749-N751 PolarHBondContact O-N 3.34Å; K749-A752 WeakPolarHBondContact O-CB 3.45Å; K749-A752 PolarHBondContact O-N 3.15Å
750	R	89.4	Confident	90	Very high	65 Å²	65	41.9 Å²	41.9	25%	0.245	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	136.3	165.7	175.3	172.6	-76.1	-82.6	18.6	111.1	P698 D701 G702 D703 D704 A752	P698-R750 VanDerWaalsContact O-CZ 3.22Å; P698-R750 PolarHBondContact O-NH1 3.04Å; P698-R750 PolarHBondContact O-NH2 3.49Å; D701-R750 PolarHBondContact O-NH1 3.3Å; D701-R750 PolarHBondContact O-NH2 2.94Å; D701-R750 VanDerWaalsContact O-NH2 3.1Å; G702-R750 VanDerWaalsContact C-CZ 3.42Å; G702-R750 WeakPolarHBondContact O-CA 3.45Å; G702-R750 VanDerWaalsContact O-CB 3.22Å; G702-R750 WeakPolarHBondContact O-CB 3.32Å; G702-R750 WeakPolarHBondContact O-CG 3.15Å; G702-R750 PolarHBondContact O-NE 2.89Å; G702-R750 PolarHBondContact O-NH1 3.31Å; D703-R750 IonicContact OD1-CZ 2.91Å; D703-R750 IonicContact OD1-NE 3.95Å; D703-R750 PolarHBondContact OD1-NE 3Å; D703-R750 IonicContact OD1-NH2 3.94Å; D703-R750 PolarHBondContact OD1-NH2 3.15Å; D704-R750 PolarHBondContact OD1-N 2.73Å; R750-A752 PolarHBondContact O-N 3.03Å
751	N	89.3	Confident	89.7	Confident	99 Å²	99	43 Å²	43	53%	0.529	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	10.9	-172.2	-60.1	-51.7	0	0	0	116.2	N690 P692 K749	N690-N751 WeakPolarHBondContact O-CA 3.19Å; N690-N751 PolarHBondContact O-N 3.29Å; P692-N751 VanDerWaalsContact CD-OD1 3.25Å; P692-N751 WeakPolarHBondContact CD-OD1 3.5Å; K749-N751 PolarHBondContact O-N 3.34Å
752	A	90.8	Very high	89.3	Confident	24 Å²	24	39.9 Å²	39.9	20%	0.198	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.2	177	0	0	0	0	0	112.3	T689 N690 V748 K749 R750	T689-A752 WeakPolarHBondContact CA-O 3.27Å; N690-A752 PolarHBondContact N-O 2.02Å; V748-A752 HydrophobicContact CG1-CB 3.91Å; K749-A752 WeakPolarHBondContact O-CB 3.45Å; K749-A752 PolarHBondContact O-N 3.15Å; R750-A752 PolarHBondContact O-N 3.03Å
753	K	91.9	Very high	88.7	Confident	137 Å²	137	43.8 Å²	43.8	60%	0.596	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	106.1	171.2	180	166.4	-176.5	171.2	0	109.2	T687 T689 M691	T687-K753 HydrophobicContact CG2-CD 4.44Å; T687-K753 HydrophobicContact CG2-CG 4.12Å; T689-K753 HydrophobicContact CG2-CB 4.12Å; T689-K753 HydrophobicContact CG2-CD 4.07Å; T689-K753 HydrophobicContact CG2-CG 3.82Å; M691-K753 HydrophobicContact CE-CB 4.42Å
754	L	91.8	Very high	88.1	Confident	16 Å²	16	45.7 Å²	45.7	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131.9	176.4	-58.8	175.9	0	0	0	108.9	T687 V688 M729 L744 V748	T687-L754 CarbonylContact C-O 3.42Å; T687-L754 VanDerWaalsContact CA-O 3.31Å; T687-L754 WeakPolarHBondContact CA-O 3.35Å; V688-L754 HydrophobicContact CB-CB 4.48Å; V688-L754 PolarHBondContact N-O 3.18Å; V688-L754 PolarHBondContact O-N 2.95Å; M729-L754 HydrophobicContact SD-CB 4.25Å; M729-L754 HydrophobicContact SD-CD1 4.1Å; M729-L754 HydrophobicContact SD-CD2 4.15Å; M729-L754 HydrophobicContact SD-CG 4.4Å; L744-L754 HydrophobicContact CB-CD1 3.88Å; L744-L754 VanDerWaalsContact O-CD1 3.3Å; L744-L754 WeakPolarHBondContact O-CD1 3.37Å; V748-L754 HydrophobicContact CG1-CD1 3.95Å; V748-L754 HydrophobicContact CG1-CG 4.43Å; V748-L754 HydrophobicContact CG2-CD1 3.91Å
755	K	91.1	Very high	87.7	Confident	105 Å²	105	46.6 Å²	46.6	46%	0.457	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	124	178.7	-172.5	174.3	-172.4	-168.2	0	109.6	E685 I686	E685-K755 WeakPolarHBondContact OE1-CE 3.2Å; E685-K755 IonicContact OE1-NZ 2.74Å; E685-K755 PolarHBondContact OE1-NZ 3.32Å; E685-K755 WeakPolarHBondContact OE2-CE 3.44Å; E685-K755 IonicContact OE2-NZ 3.32Å; E685-K755 PolarHBondContact OE2-NZ 2.98Å; I686-K755 WeakPolarHBondContact O-CA 3.4Å
756	F	91.4	Very high	87.3	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	167.8	-174.2	59.8	-80.8	0	0	0	110.9	I686 V688 L710 R724 V725 M729 L744 I758	I686-F756 HydrophobicContact CB-CD2 4.49Å; I686-F756 HydrophobicContact CB-CE1 4.24Å; I686-F756 HydrophobicContact CB-CE2 4.07Å; I686-F756 HydrophobicContact CB-CZ 3.93Å; I686-F756 HydrophobicContact CD1-CE2 4.08Å; I686-F756 HydrophobicContact CD1-CZ 4.43Å; I686-F756 HydrophobicContact CG2-CE1 4.1Å; I686-F756 HydrophobicContact CG2-CE2 4.39Å; I686-F756 HydrophobicContact CG2-CZ 3.8Å; I686-F756 PolarHBondContact N-O 3.08Å; I686-F756 PolarHBondContact O-N 2.98Å; V688-F756 HydrophobicContact CG2-CE1 4.31Å; L710-F756 HydrophobicContact CD2-CE2 4.22Å; L710-F756 HydrophobicContact CD2-CZ 3.71Å; R724-F756 WeakPolarHBondContact O-CB 3.32Å; V725-F756 HydrophobicContact CG1-CB 4.06Å; V725-F756 HydrophobicContact CG1-CD2 4.07Å; V725-F756 HydrophobicContact CG1-CG 4.33Å; M729-F756 HydrophobicContact CE-CD1 3.52Å; M729-F756 HydrophobicContact CE-CD2 4.28Å; M729-F756 HydrophobicContact CE-CE1 3.54Å; M729-F756 HydrophobicContact CE-CE2 4.27Å; M729-F756 HydrophobicContact CE-CG 3.91Å; M729-F756 HydrophobicContact CE-CZ 3.92Å; M729-F756 HydrophobicContact SD-CD1 4.19Å; L744-F756 HydrophobicContact CD2-CE1 4.06Å; L744-F756 HydrophobicContact CD2-CZ 3.94Å; F756-I758 HydrophobicContact CD2-CD1 4.35Å; F756-I758 HydrophobicContact CE2-CD1 4.42Å
757	T	90.6	Very high	86.5	Confident	23 Å²	23	51.3 Å²	51.3	14%	0.141	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.2	-176.3	64	0	0	0	0	112.6	V683 L684 E685 S723 R724	V683-T757 HydrophobicContact CG1-CG2 4.01Å; L684-T757 WeakPolarHBondContact O-CA 2.98Å; E685-T757 HydrophobicContact CB-CG2 4.11Å; E685-T757 HydrophobicContact CG-CG2 4.13Å; S723-T757 WeakPolarHBondContact CA-O 3.32Å; R724-T757 PolarHBondContact N-O 3.15Å; R724-T757 PolarHBondContact O-N 3.23Å
758	I	91.8	Very high	85.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.4	170.8	-54.5	-58.6	0	0	0	108.7	L684 I686 I712 Y720 F756 L760	L684-I758 PolarHBondContact N-O 2.58Å; L684-I758 PolarHBondContact O-N 3.22Å; I686-I758 HydrophobicContact CD1-CG1 4.02Å; I712-I758 HydrophobicContact CD1-CD1 4.24Å; I712-I758 HydrophobicContact CD1-CG1 3.76Å; Y720-I758 HydrophobicContact CD2-CG2 3.75Å; Y720-I758 HydrophobicContact CE2-CG2 3.93Å; F756-I758 HydrophobicContact CD2-CD1 4.35Å; F756-I758 HydrophobicContact CE2-CD1 4.42Å; I758-L760 HydrophobicContact CG2-CD2 3.84Å
759	N	90.3	Very high	85.2	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.139	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	129.2	175.8	-62.3	-14.9	0	0	0	109	A721 G722	A721-N759 HydrophobicContact CB-CB 4.39Å; A721-N759 WeakPolarHBondContact CB-O 3.33Å; A721-N759 PolarHBondContact N-O 3.38Å; G722-N759 PolarHBondContact N-O 3.45Å; G722-N759 WeakPolarHBondContact O-CB 3.22Å; G722-N759 PolarHBondContact O-N 3.34Å
760	L	90.6	Very high	84.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.2	-178.6	-54.6	175.1	0	0	0	109.4	F651 L681 V682 L684 L714 L718 I758	F651-L760 HydrophobicContact CE1-CD1 4.18Å; L681-L760 WeakPolarHBondContact CA-O 3.49Å; V682-L760 HydrophobicContact CG1-CB 3.87Å; V682-L760 HydrophobicContact CG1-CD1 4.47Å; V682-L760 PolarHBondContact N-O 3.28Å; V682-L760 PolarHBondContact O-N 3.01Å; L684-L760 HydrophobicContact CB-CD1 4.24Å; L714-L760 HydrophobicContact CD1-CD2 3.58Å; L714-L760 HydrophobicContact CD2-CD1 4.31Å; L714-L760 HydrophobicContact CD2-CD2 3.69Å; L714-L760 HydrophobicContact CG-CD2 4.29Å; L718-L760 HydrophobicContact CB-CB 4.49Å; L718-L760 HydrophobicContact CB-CD1 4.49Å; L718-L760 HydrophobicContact CD2-CB 4.44Å; I758-L760 HydrophobicContact CG2-CD2 3.84Å
761	S	87.3	Confident	84.5	Confident	24 Å²	24	56 Å²	56	17%	0.168	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135	176.4	-173.1	0	0	0	0	111.1	P719 S763	P719-S761 PolarHBondContact O-N 2.8Å; S761-S763 VanDerWaalsContact C-N 3.33Å; S761-S763 VanDerWaalsContact OG-CB 3.32Å; S761-S763 WeakPolarHBondContact OG-CB 3.49Å; S761-S763 PolarHBondContact OG-N 3.1Å; S761-S763 PolarHBondContact OG-OG 3.43Å
762	T	85.2	Confident	84.4	Confident	17 Å²	17	51.2 Å²	51.2	10%	0.104	28%	0.276	C	S	.	.			trans	-91.6	3.4	172.1	58.8	0	0	0	0	112.6	F674 Q679 R680 V682 N764 I765	F674-T762 HydrophobicContact CE1-CG2 4.4Å; F674-T762 HydrophobicContact CZ-CG2 3.82Å; Q679-T762 PolarHBondContact O-OG1 3.16Å; R680-T762 VanDerWaalsContact CA-OG1 3.22Å; R680-T762 WeakPolarHBondContact CA-OG1 3.47Å; R680-T762 PolarHBondContact O-N 2.82Å; R680-T762 PolarHBondContact O-OG1 2.84Å; V682-T762 HydrophobicContact CB-CG2 4.03Å; V682-T762 HydrophobicContact CG1-CG2 4.06Å; T762-N764 PolarHBondContact O-N 2.72Å; T762-N764 VanDerWaalsContact O-N 3.11Å; T762-I765 HydrophobicContact CG2-CD1 3.88Å; T762-I765 PolarHBondContact O-N 3.34Å
763	S	79.3	Confident	84.4	Confident	82 Å²	82	51.9 Å²	51.9	57%	0.573	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26	-173.5	59	0	0	0	0	115.1	S761	S761-S763 VanDerWaalsContact C-N 3.33Å; S761-S763 VanDerWaalsContact OG-CB 3.32Å; S761-S763 WeakPolarHBondContact OG-CB 3.49Å; S761-S763 PolarHBondContact OG-N 3.1Å; S761-S763 PolarHBondContact OG-OG 3.43Å
764	N	79.4	Confident	84.4	Confident	78 Å²	78	45.4 Å²	45.4	42%	0.417	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	3.6	-172.2	-62.3	6.7	0	0	0	112.6	D716 T762	D716-N764 WeakPolarHBondContact O-CB 3.49Å; D716-N764 PolarHBondContact O-ND2 3.04Å; T762-N764 PolarHBondContact O-N 2.72Å; T762-N764 VanDerWaalsContact O-N 3.11Å
765	I	80.3	Confident	84.5	Confident	21 Å²	21	48 Å²	48	11%	0.108	26%	0.264	C	S	.	.			trans	-75.3	126.4	177	-54.4	176.9	0	0	0	109	F674 L676 L718 T762 T769 L772	F674-I765 HydrophobicContact CE1-CD1 3.99Å; L676-I765 HydrophobicContact CD1-CB 4.07Å; L676-I765 HydrophobicContact CD1-CG2 3.39Å; L718-I765 HydrophobicContact CD2-CD1 4.08Å; L718-I765 HydrophobicContact CD2-CG1 4.43Å; T762-I765 HydrophobicContact CG2-CD1 3.88Å; T762-I765 PolarHBondContact O-N 3.34Å; I765-T769 HydrophobicContact CG2-CG2 4.03Å; I765-L772 HydrophobicContact CD1-CD2 3.93Å
766	T	74.3	Confident	84.7	Confident	72 Å²	72	43 Å²	43	44%	0.442	24%	0.242	S	C	.	.			trans	-109.3	174.6	-179.2	74.1	0	0	0	0	111.2	E768 T769	T766-E768 PolarHBondContact O-N 3.25Å; T766-E768 VanDerWaalsContact O-N 3.13Å; T766-E768 PolarHBondContact OG1-N 3.09Å; T766-T769 PolarHBondContact N-OG1 3.16Å; T766-T769 VanDerWaalsContact N-OG1 3.11Å; T766-T769 PolarHBondContact O-N 3.15Å; T766-T769 PolarHBondContact O-OG1 3.42Å; T766-T769 PolarHBondContact OG1-OG1 3.36Å
767	T	66.8	Low	84.8	Confident	96 Å²	96	45.9 Å²	45.9	59%	0.589	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-4.8	173.1	49	0	0	0	0	114.2	I798	T767-I798 HydrophobicContact CG2-CD1 4.26Å
768	E	70.1	Confident	84.9	Confident	169 Å²	169	45.4 Å²	45.4	79%	0.79	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-14.3	176.9	-61.1	-179.7	168.8	0	0	112.3	T766 T770	T766-E768 PolarHBondContact O-N 3.25Å; T766-E768 VanDerWaalsContact O-N 3.13Å; T766-E768 PolarHBondContact OG1-N 3.09Å; E768-T770 PolarHBondContact O-N 3.09Å
769	T	77.2	Confident	84.9	Confident	24 Å²	24	46.8 Å²	46.8	15%	0.147	26%	0.264	C	S	.	.			trans	-71.7	111.9	178.4	-48.1	0	0	0	0	110.5	T717 I765 T766 E771 L772 V796	T717-T769 HydrophobicContact CG2-CG2 4.5Å; I765-T769 HydrophobicContact CG2-CG2 4.03Å; T766-T769 PolarHBondContact N-OG1 3.16Å; T766-T769 VanDerWaalsContact N-OG1 3.11Å; T766-T769 PolarHBondContact O-N 3.15Å; T766-T769 PolarHBondContact O-OG1 3.42Å; T766-T769 PolarHBondContact OG1-OG1 3.36Å; T769-E771 WeakPolarHBondContact CG2-O 3.35Å; T769-L772 HydrophobicContact CG2-CD2 4.44Å; T769-V796 HydrophobicContact CG2-CG2 4.46Å; T769-V796 WeakPolarHBondContact O-CB 3.42Å
770	T	80.3	Confident	84.9	Confident	65 Å²	65	46.9 Å²	46.9	40%	0.399	27%	0.265	S	S	.	.			trans	-91.8	-22.7	179.7	50.4	0	0	0	0	113.9	E768 V796	E768-T770 PolarHBondContact O-N 3.09Å; T770-V796 PolarHBondContact O-N 2.87Å
771	E	85.7	Confident	84.7	Confident	91 Å²	91	49.7 Å²	49.7	43%	0.425	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	154.7	-171.2	59.5	-168.3	-142.9	0	0	112.1	T769 T773 F793 A794	T769-E771 WeakPolarHBondContact CG2-O 3.35Å; E771-T773 HydrophobicContact CG-CG2 4.48Å; E771-F793 HydrophobicContact CB-CD2 4.36Å; E771-F793 HydrophobicContact CB-CE2 3.63Å; E771-F793 HydrophobicContact CB-CZ 4.35Å; E771-F793 HydrophobicContact CG-CE2 4.32Å; E771-A794 CarbonylContact C-O 3.57Å; E771-A794 WeakPolarHBondContact CA-O 3.29Å
772	L	87.2	Confident	84.7	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.9	172.6	-55.6	-170.6	0	0	0	107.4	F674 L718 I765 T769 F793 A794 V796	F674-L772 HydrophobicContact CB-CD1 3.86Å; F674-L772 HydrophobicContact CD1-CD1 4.04Å; F674-L772 HydrophobicContact CG-CD1 3.88Å; L718-L772 HydrophobicContact CD1-CB 3.78Å; L718-L772 HydrophobicContact CD1-CD2 4Å; L718-L772 HydrophobicContact CD1-CG 4.31Å; L718-L772 HydrophobicContact CD2-CD2 4.17Å; L718-L772 HydrophobicContact CG-CD2 4.32Å; I765-L772 HydrophobicContact CD1-CD2 3.93Å; T769-L772 HydrophobicContact CG2-CD2 4.44Å; L772-F793 WeakPolarHBondContact O-CA 3.22Å; L772-A794 HydrophobicContact CB-CB 4.3Å; L772-A794 PolarHBondContact N-O 2.57Å; L772-A794 PolarHBondContact O-N 3.29Å; L772-V796 HydrophobicContact CD2-CG2 3.54Å; L772-V796 HydrophobicContact CG-CG2 3.7Å
773	T	90.6	Very high	84.7	Confident	38 Å²	38	53 Å²	53	23%	0.233	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.9	179.5	48	0	0	0	0	111.1	P715 E771 T791 A792 F793	P715-T773 WeakPolarHBondContact CD-O 3.38Å; P715-T773 WeakPolarHBondContact CG-O 3.07Å; E771-T773 HydrophobicContact CG-CG2 4.48Å; T773-T791 HydrophobicContact CG2-CG2 4.26Å; T773-A792 CarbonylContact C-O 3.6Å; T773-A792 VanDerWaalsContact CA-O 3.28Å; T773-A792 WeakPolarHBondContact CA-O 3.37Å; T773-F793 HydrophobicContact CG2-CD2 4.07Å
774	A	92	Very high	85	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	124.4	168.9	0	0	0	0	0	109.4	L684 T713 L714 A792	L684-A774 HydrophobicContact CD2-CB 4.19Å; T713-A774 WeakPolarHBondContact O-CA 3.4Å; L714-A774 HydrophobicContact CD2-CB 3.72Å; A774-A792 HydrophobicContact CB-CB 4.39Å; A774-A792 PolarHBondContact N-O 3.47Å; A774-A792 PolarHBondContact O-N 2.79Å
775	D	93.4	Very high	84.9	Confident	70 Å²	70	54.4 Å²	54.4	37%	0.374	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	129.4	-177.1	-61.6	-46.7	0	0	0	110.8	I712 T713 T791	I712-D775 CarbonylContact C-O 3.6Å; I712-D775 WeakPolarHBondContact CA-O 3.26Å; T713-D775 PolarHBondContact N-O 2.86Å; T713-D775 PolarHBondContact O-N 2.91Å; D775-T791 VanDerWaalsContact OD1-CB 3.31Å; D775-T791 WeakPolarHBondContact OD1-CB 3.32Å; D775-T791 VanDerWaalsContact OD1-CG2 3.27Å; D775-T791 WeakPolarHBondContact OD1-CG2 3.43Å; D775-T791 PolarHBondContact OD1-OG1 2.97Å
776	L	94.3	Very high	84.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.3	-174.1	-57	172.6	0	0	0	109.8	L647 Y649 L684 I686 L710 I712 V790 A792	L647-L776 HydrophobicContact CD1-CB 3.94Å; L647-L776 HydrophobicContact CD1-CD1 4.31Å; L647-L776 HydrophobicContact CD2-CB 4.25Å; L647-L776 HydrophobicContact CD2-CD1 3.68Å; Y649-L776 HydrophobicContact CD1-CD1 4.46Å; L684-L776 HydrophobicContact CD2-CD2 4.34Å; I686-L776 HydrophobicContact CD1-CD2 3.95Å; L710-L776 HydrophobicContact CD1-CB 4.19Å; I712-L776 HydrophobicContact CB-CD2 4.12Å; I712-L776 HydrophobicContact CD1-CD2 4.13Å; I712-L776 HydrophobicContact CG1-CD2 3.71Å; I712-L776 HydrophobicContact CG2-CD2 3.75Å; L776-V790 HydrophobicContact CB-CB 4.42Å; L776-V790 VanDerWaalsContact CB-O 3.27Å; L776-V790 WeakPolarHBondContact CB-O 3.49Å; L776-V790 PolarHBondContact N-O 2.91Å; L776-V790 PolarHBondContact O-N 3.28Å; L776-A792 HydrophobicContact CD1-CB 4.15Å
777	Q	93.9	Very high	85.4	Confident	66 Å²	66	57.9 Å²	57.9	31%	0.308	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.2	-179.8	180	62.7	58.8	0	0	110.6	F711 L787 P789	F711-Q777 HydrophobicContact CB-CB 4.42Å; F711-Q777 PolarHBondContact N-O 3.26Å; F711-Q777 PolarHBondContact O-N 2.58Å; Q777-L787 PolarHBondContact NE2-O 2.9Å; Q777-P789 VanDerWaalsContact OE1-CB 3.31Å
778	L	93.5	Very high	86.3	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	149.8	171.1	-76.2	174.9	0	0	0	111.3	L645 L647 V688 L710 L744 L787	L645-L778 HydrophobicContact CB-CD1 4Å; L647-L778 HydrophobicContact CB-CD1 3.81Å; L647-L778 HydrophobicContact CB-CG 4.35Å; L647-L778 HydrophobicContact CD1-CD1 4.46Å; L647-L778 HydrophobicContact CD1-CD2 4.37Å; L647-L778 HydrophobicContact CD1-CG 4.11Å; V688-L778 HydrophobicContact CG1-CD1 4.41Å; V688-L778 HydrophobicContact CG1-CD2 4.25Å; V688-L778 HydrophobicContact CG2-CD2 4.24Å; L710-L778 HydrophobicContact CB-CD2 4.21Å; L710-L778 HydrophobicContact CD1-CD2 4.01Å; L710-L778 HydrophobicContact CD1-CG 4.31Å; L744-L778 HydrophobicContact CD1-CD2 3.6Å; L778-L787 HydrophobicContact CB-CD2 3.79Å; L778-L787 HydrophobicContact CD1-CD2 4.34Å
779	A	90.5	Very high	87.2	Confident	29 Å²	29	55.3 Å²	55.3	24%	0.24	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.4	171.2	0	0	0	0	0	110.9	S708 Q709 F711	S708-A779 CarbonylContact C-O 3.52Å; S708-A779 WeakPolarHBondContact CA-O 3.32Å; Q709-A779 PolarHBondContact N-O 3.07Å; Q709-A779 PolarHBondContact O-N 2.91Å; F711-A779 HydrophobicContact CD2-CB 4.48Å; F711-A779 HydrophobicContact CE2-CB 3.94Å
780	T	90.3	Very high	87.9	Confident	27 Å²	27	56.4 Å²	56.4	17%	0.166	31%	0.307	C	S	.	.			trans	-154	163.5	173.5	176.6	0	0	0	0	109.2	L645 H706 S782 L787	L645-T780 HydrophobicContact CD1-CG2 3.9Å; H706-T780 PolarHBondContact O-OG1 3.17Å; T780-S782 PolarHBondContact OG1-N 3.33Å; T780-S782 VanDerWaalsContact OG1-N 3.13Å; T780-L787 HydrophobicContact CG2-CD1 4.01Å
781	I	86.6	Confident	88.4	Confident	60 Å²	60	56.7 Å²	56.7	31%	0.308	31%	0.308	S	S	.	.	S	Bend	trans	-96.2	-4.7	169.8	64.8	170.4	0	0	0	113.1	D583 L585 H706 A707	D583-I781 HydrophobicContact CB-CD1 4.43Å; L585-I781 HydrophobicContact CB-CD1 4.15Å; L585-I781 HydrophobicContact CD1-CD1 4.4Å; L585-I781 HydrophobicContact CD1-CG1 4.13Å; L585-I781 HydrophobicContact CG-CD1 4.22Å; L585-I781 HydrophobicContact CG-CG1 4.49Å; H706-I781 HydrophobicContact CB-CD1 4.01Å; H706-I781 HydrophobicContact CB-CG1 3.73Å; H706-I781 WeakPolarHBondContact O-CG1 3.3Å; H706-I781 PolarHBondContact O-N 3.46Å; A707-I781 HydrophobicContact CB-CD1 4Å; A707-I781 HydrophobicContact CB-CG1 3.96Å; A707-I781 HydrophobicContact CB-CG2 4.29Å
782	S	88.2	Confident	88.7	Confident	10 Å²	10	52.3 Å²	52.3	7%	0.07	29%	0.288	C	S	.	.	S	Bend	trans	-71.8	158.9	167.7	-71.1	0	0	0	0	110.3	C641 S643 D704 A705 H706 T780 Q784	C641-S782 VanDerWaalsContact O-CB 3.27Å; C641-S782 WeakPolarHBondContact O-CB 3.14Å; S643-S782 WeakPolarHBondContact OG-CB 3.41Å; D704-S782 PolarHBondContact O-OG 2.92Å; D704-S782 VanDerWaalsContact O-OG 3.07Å; A705-S782 WeakPolarHBondContact CA-OG 3.33Å; H706-S782 PolarHBondContact N-OG 3.26Å; T780-S782 PolarHBondContact OG1-N 3.33Å; T780-S782 VanDerWaalsContact OG1-N 3.13Å; S782-Q784 PolarHBondContact O-N 2.96Å
783	E	85.9	Confident	88.8	Confident	100 Å²	100	55.5 Å²	55.5	47%	0.467	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-76.1	115.4	-178.8	-174.8	173.6	-161.7	0	0	110.3	I640 C641 Q642 S643	I640-E783 WeakPolarHBondContact CG2-OE2 3.3Å; C641-E783 PolarHBondContact O-N 2.91Å; Q642-E783 WeakPolarHBondContact CA-O 3.32Å; Q642-E783 HydrophobicContact CG-CB 4.39Å; Q642-E783 PolarHBondContact NE2-OE2 3.39Å; Q642-E783 VanDerWaalsContact NE2-OE2 3.15Å; S643-E783 PolarHBondContact N-O 3.05Å; S643-E783 VanDerWaalsContact N-O 3.12Å
784	Q	85.6	Confident	88.6	Confident	32 Å²	32	53.7 Å²	53.7	15%	0.15	29%	0.291	C	S	.	.			trans	-156.8	115	173.1	-174.3	177	-23.4	0	0	109.9	S643 L645 S782 N786 L787	S643-Q784 WeakPolarHBondContact O-CG 3.34Å; S643-Q784 PolarHBondContact O-OE1 3.34Å; S643-Q784 VanDerWaalsContact O-OE1 3.11Å; S643-Q784 PolarHBondContact OG-OE1 3.02Å; S643-Q784 VanDerWaalsContact OG-OE1 3.11Å; L645-Q784 PolarHBondContact O-NE2 3.45Å; S782-Q784 PolarHBondContact O-N 2.96Å; Q784-N786 PolarHBondContact NE2-O 2.98Å; Q784-N786 VanDerWaalsContact NE2-O 3.13Å; Q784-L787 HydrophobicContact CB-CD1 4.22Å; Q784-L787 HydrophobicContact CB-CG 4.38Å; Q784-L787 HydrophobicContact CG-CD1 4.4Å; Q784-L787 HydrophobicContact CG-CD2 4.34Å; Q784-L787 HydrophobicContact CG-CG 4.02Å; Q784-L787 VanDerWaalsContact NE2-CD2 3.27Å
785	L	75.6	Confident	88.3	Confident	158 Å²	158	56.5 Å²	56.5	83%	0.827	30%	0.303	S	S	*	.	S	Bend	trans	-80.1	-25.2	-178.4	-65.4	171.3	0	0	0	113.5	L787	L785-L787 PolarHBondContact O-N 3.4Å
786	N	80.4	Confident	87.8	Confident	129 Å²	129	53.5 Å²	53.5	69%	0.69	29%	0.287	S	S	*	.			trans	-100.8	77.4	-171.8	-58.2	-20.3	0	0	0	110.6	Q784	Q784-N786 PolarHBondContact NE2-O 2.98Å; Q784-N786 VanDerWaalsContact NE2-O 3.13Å
787	L	85.3	Confident	87	Confident	37 Å²	37	55 Å²	55	19%	0.194	30%	0.296	C	S	.	.			trans	-125.7	54.6	178.3	-72.2	170.9	0	0	0	110.8	L645 Q777 L778 T780 Q784 L785	L645-L787 HydrophobicContact CB-CD2 4.35Å; Q777-L787 PolarHBondContact NE2-O 2.9Å; L778-L787 HydrophobicContact CB-CD2 3.79Å; L778-L787 HydrophobicContact CD1-CD2 4.34Å; T780-L787 HydrophobicContact CG2-CD1 4.01Å; Q784-L787 HydrophobicContact CB-CD1 4.22Å; Q784-L787 HydrophobicContact CB-CG 4.38Å; Q784-L787 HydrophobicContact CG-CD1 4.4Å; Q784-L787 HydrophobicContact CG-CD2 4.34Å; Q784-L787 HydrophobicContact CG-CG 4.02Å; Q784-L787 VanDerWaalsContact NE2-CD2 3.27Å; L785-L787 PolarHBondContact O-N 3.4Å
788	D	84.8	Confident	86	Confident	127 Å²	127	53.2 Å²	53.2	68%	0.679	29%	0.288	S	S	*	.			trans	-67.6	145.8	179.4	-61.6	-64.4	0	0	0	112.6
789	P	89.1	Confident	84.8	Confident	84 Å²	84	56.4 Å²	56.4	55%	0.545	30%	0.303	S	S	.	.			trans	-63.8	136.5	172.8	23.5	-31.5	0	0	0	111.5	Q777	Q777-P789 VanDerWaalsContact OE1-CB 3.31Å
790	V	91.9	Very high	83.8	Confident	47 Å²	47	56 Å²	56	29%	0.285	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.5	178.6	179.6	0	0	0	0	109.8	L647 Y649 L776 A792	L647-V790 HydrophobicContact CD2-CB 4.01Å; L647-V790 HydrophobicContact CD2-CG1 3.94Å; L647-V790 HydrophobicContact CD2-CG2 4.28Å; Y649-V790 HydrophobicContact CD1-CG1 3.78Å; Y649-V790 HydrophobicContact CE1-CG1 3.7Å; L776-V790 HydrophobicContact CB-CB 4.42Å; L776-V790 VanDerWaalsContact CB-O 3.27Å; L776-V790 WeakPolarHBondContact CB-O 3.49Å; L776-V790 PolarHBondContact N-O 2.91Å; L776-V790 PolarHBondContact O-N 3.28Å; V790-A792 PolarHBondContact O-N 2.86Å
791	T	92	Very high	82.9	Confident	70 Å²	70	58 Å²	58	43%	0.429	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115	171.6	-53.9	0	0	0	0	110.4	Y649 T773 D775	Y649-T791 PolarHBondContact OH-O 2.96Å; T773-T791 HydrophobicContact CG2-CG2 4.26Å; D775-T791 VanDerWaalsContact OD1-CB 3.31Å; D775-T791 WeakPolarHBondContact OD1-CB 3.32Å; D775-T791 VanDerWaalsContact OD1-CG2 3.27Å; D775-T791 WeakPolarHBondContact OD1-CG2 3.43Å; D775-T791 PolarHBondContact OD1-OG1 2.97Å
792	A	90.9	Very high	82.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.7	168.7	0	0	0	0	0	110.3	Y649 F651 L684 T773 A774 L776 V790	Y649-A792 HydrophobicContact CD1-CB 4.06Å; Y649-A792 HydrophobicContact CD2-CB 3.58Å; Y649-A792 HydrophobicContact CE1-CB 4.24Å; Y649-A792 HydrophobicContact CE2-CB 3.81Å; Y649-A792 HydrophobicContact CG-CB 3.73Å; Y649-A792 VanDerWaalsContact CZ-CA 3.5Å; F651-A792 HydrophobicContact CE2-CB 3.89Å; F651-A792 HydrophobicContact CZ-CB 4.14Å; L684-A792 HydrophobicContact CD1-CB 4.02Å; T773-A792 CarbonylContact C-O 3.6Å; T773-A792 VanDerWaalsContact CA-O 3.28Å; T773-A792 WeakPolarHBondContact CA-O 3.37Å; A774-A792 HydrophobicContact CB-CB 4.39Å; A774-A792 PolarHBondContact N-O 3.47Å; A774-A792 PolarHBondContact O-N 2.79Å; L776-A792 HydrophobicContact CD1-CB 4.15Å; V790-A792 PolarHBondContact O-N 2.86Å
793	F	89.6	Confident	82.2	Confident	66 Å²	66	56.4 Å²	56.4	29%	0.289	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.6	-171.9	179.5	-107.8	0	0	0	113.9	Y649 V671 E771 L772 T773 K795	Y649-F793 PolarHBondContact OH-N 2.7Å; V671-F793 HydrophobicContact CG1-CD1 3.77Å; V671-F793 HydrophobicContact CG1-CE1 3.66Å; E771-F793 HydrophobicContact CB-CD2 4.36Å; E771-F793 HydrophobicContact CB-CE2 3.63Å; E771-F793 HydrophobicContact CB-CZ 4.35Å; E771-F793 HydrophobicContact CG-CE2 4.32Å; L772-F793 WeakPolarHBondContact O-CA 3.22Å; T773-F793 HydrophobicContact CG2-CD2 4.07Å; F793-K795 HydrophobicContact CE1-CG 4.12Å; F793-K795 HydrophobicContact CZ-CG 4.19Å
794	A	87.7	Confident	82.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.5	167.2	0	0	0	0	0	112.4	F651 L664 Q672 E771 L772	F651-A794 HydrophobicContact CD2-CB 3.79Å; F651-A794 HydrophobicContact CE2-CB 4.16Å; F651-A794 HydrophobicContact CG-CB 4.32Å; L664-A794 HydrophobicContact CD1-CB 4.5Å; Q672-A794 HydrophobicContact CB-CB 4.12Å; Q672-A794 CarbonylContact O-C 3.59Å; Q672-A794 VanDerWaalsContact O-CA 3.29Å; Q672-A794 WeakPolarHBondContact O-CA 3.44Å; Q672-A794 WeakPolarHBondContact O-CB 3.28Å; E771-A794 CarbonylContact C-O 3.57Å; E771-A794 WeakPolarHBondContact CA-O 3.29Å; L772-A794 HydrophobicContact CB-CB 4.3Å; L772-A794 PolarHBondContact N-O 2.57Å; L772-A794 PolarHBondContact O-N 3.29Å
795	K	85	Confident	82.4	Confident	61 Å²	61	55 Å²	55	27%	0.265	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	141	177.6	-69.2	169.4	-176.3	172.1	0	110.9	D667 D669 V671 Q672 V673 F674 F793	D667-K795 WeakPolarHBondContact OD2-CD 3.15Å; D667-K795 WeakPolarHBondContact OD2-CE 3.41Å; D667-K795 IonicContact OD2-NZ 3.25Å; D667-K795 PolarHBondContact OD2-NZ 3.37Å; D669-K795 IonicContact OD2-NZ 3.98Å; D669-K795 PolarHBondContact OD2-NZ 2.86Å; V671-K795 HydrophobicContact CB-CD 4.24Å; V671-K795 HydrophobicContact CG1-CD 3.9Å; V671-K795 HydrophobicContact CG1-CG 3.84Å; Q672-K795 PolarHBondContact O-N 3.41Å; V673-K795 CarbonylContact C-O 3.6Å; V673-K795 WeakPolarHBondContact CA-O 3.31Å; F674-K795 PolarHBondContact N-O 3.11Å; F793-K795 HydrophobicContact CE1-CG 4.12Å; F793-K795 HydrophobicContact CZ-CG 4.19Å
796	V	83	Confident	82.9	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.6	175.6	-177.8	0	0	0	0	110.8	F674 L676 T769 T770 L772	F674-V796 WeakPolarHBondContact O-CA 3.41Å; L676-V796 HydrophobicContact CD1-CG1 4.32Å; T769-V796 HydrophobicContact CG2-CG2 4.46Å; T769-V796 WeakPolarHBondContact O-CB 3.42Å; T770-V796 PolarHBondContact O-N 2.87Å; L772-V796 HydrophobicContact CD2-CG2 3.54Å; L772-V796 HydrophobicContact CG-CG2 3.7Å
797	V	77.6	Confident	83.3	Confident	31 Å²	31	46.6 Å²	46.6	19%	0.188	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.7	179	175.2	0	0	0	0	111.4	V673 F674 S675 L676 V1009	V673-V797 HydrophobicContact CG1-CB 4.06Å; V673-V797 HydrophobicContact CG1-CG2 3.6Å; F674-V797 PolarHBondContact O-N 2.82Å; S675-V797 WeakPolarHBondContact CA-O 3.48Å; L676-V797 PolarHBondContact N-O 3.37Å; V797-V1009 HydrophobicContact CG1-CB 4.27Å; V797-V1009 HydrophobicContact CG1-CG2 3.64Å
798	I	72	Confident	83.3	Confident	30 Å²	30	45.1 Å²	45.1	15%	0.154	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.6	176.1	-58.2	172.2	0	0	0	109	T767 I1005 H1007 L1008 V1009	T767-I798 HydrophobicContact CG2-CD1 4.26Å; I798-I1005 HydrophobicContact CD1-CG2 4.36Å; I798-H1007 PolarHBondContact N-O 2.74Å; I798-L1008 WeakPolarHBondContact O-CA 3.48Å; I798-V1009 PolarHBondContact O-N 3.33Å
799	E	68.7	Low	83.4	Confident	79 Å²	79	45 Å²	45	37%	0.369	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.7	177.8	-59.6	-165.3	128.2	0	0	111.2	R1011	E799-R1011 IonicContact OE1-CZ 2.99Å; E799-R1011 IonicContact OE1-NE 3.73Å; E799-R1011 PolarHBondContact OE1-NE 2.83Å; E799-R1011 IonicContact OE1-NH2 3.49Å; E799-R1011 PolarHBondContact OE1-NH2 3.07Å
800	L	70.4	Confident	83.1	Confident	21 Å²	21	44.2 Å²	44.2	11%	0.11	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123	170.8	-76.4	-163	0	0	0	111.6	L802 L848 L851 L1008 V1009 L1010	L800-L802 HydrophobicContact CD1-CD1 4.46Å; L800-L802 PolarHBondContact O-N 3.06Å; L800-L802 VanDerWaalsContact O-N 3.12Å; L800-L848 HydrophobicContact CD1-CD2 4.14Å; L800-L851 HydrophobicContact CD2-CD1 4Å; L800-L1008 HydrophobicContact CD1-CD1 3.81Å; L800-L1008 HydrophobicContact CD1-CD2 3.96Å; L800-L1008 HydrophobicContact CD1-CG 4.24Å; L800-L1008 HydrophobicContact CG-CD1 3.96Å; L800-L1008 HydrophobicContact CG-CD2 4.09Å; L800-L1008 HydrophobicContact CG-CG 4.08Å; L800-V1009 PolarHBondContact N-O 3.17Å; L800-L1010 HydrophobicContact CB-CD2 3.9Å; L800-L1010 HydrophobicContact CD1-CD2 4.49Å
801	P	70.4	Confident	82.4	Confident	69 Å²	69	47.2 Å²	47.2	45%	0.448	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	84.6	176.5	34.4	-34.2	0	0	0	110.6	P844	P801-P844 HydrophobicContact CB-CG 4Å; P801-P844 HydrophobicContact CG-CG 4.19Å; P801-P844 WeakPolarHBondContact O-CD 3.37Å
802	L	77.7	Confident	81.9	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	25%	0.248	C	C	.	.			trans	-122.4	117.3	175.4	-69.9	-179.8	0	0	0	110.6	L800 N843 L848 I999 V1001 L1010	L800-L802 HydrophobicContact CD1-CD1 4.46Å; L800-L802 PolarHBondContact O-N 3.06Å; L800-L802 VanDerWaalsContact O-N 3.12Å; L802-N843 HydrophobicContact CD2-CB 3.55Å; L802-N843 VanDerWaalsContact CD2-CG 3.5Å; L802-L848 HydrophobicContact CD1-CD1 4.25Å; L802-L848 HydrophobicContact CD1-CD2 4.13Å; L802-L848 HydrophobicContact CD2-CD1 4.17Å; L802-I999 HydrophobicContact CB-CD1 4.39Å; L802-I999 HydrophobicContact CD1-CG2 4.45Å; L802-V1001 HydrophobicContact CD1-CG2 3.83Å; L802-L1010 HydrophobicContact CB-CD2 4.23Å; L802-L1010 HydrophobicContact CD1-CD2 3.88Å; L802-L1010 HydrophobicContact CG-CD2 4.37Å
803	S	83.3	Confident	81.6	Confident	33 Å²	33	47.9 Å²	47.9	23%	0.231	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.5	-179.4	63.3	0	0	0	0	114.3	S842 D1012	S803-S842 PolarHBondContact N-O 3.45Å; S803-S842 VanDerWaalsContact N-O 3.07Å; S803-S842 PolarHBondContact O-N 2.92Å; S803-D1012 WeakPolarHBondContact CA-O 3.13Å
804	V	87.4	Confident	81.2	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.6	174.7	58.4	0	0	0	0	110.5	V840 L841 L856 I999 D1012 V1015	V804-V840 WeakPolarHBondContact CA-O 3.48Å; V804-L841 HydrophobicContact CB-CD2 3.91Å; V804-L841 HydrophobicContact CG2-CD2 3.77Å; V804-L856 HydrophobicContact CG2-CD1 4.15Å; V804-I999 HydrophobicContact CB-CD1 3.96Å; V804-I999 HydrophobicContact CB-CG1 4.05Å; V804-I999 HydrophobicContact CG1-CD1 4.35Å; V804-I999 HydrophobicContact CG1-CG1 4.12Å; V804-D1012 PolarHBondContact N-O 3.27Å; V804-V1015 HydrophobicContact CG1-CG1 4.25Å; V804-V1015 HydrophobicContact CG2-CG1 4Å
805	N	87.3	Confident	81	Confident	102 Å²	102	49.1 Å²	49.1	55%	0.545	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	159.6	172.7	-71.8	-33.9	0	0	0	109.9	F839 V840	N805-F839 CarbonylContact O-C 3.48Å; N805-F839 WeakPolarHBondContact O-CA 3.23Å; N805-V840 HydrophobicContact CB-CB 4.41Å; N805-V840 PolarHBondContact N-O 3.37Å; N805-V840 PolarHBondContact O-N 3.08Å
806	G	85.9	Confident	80.4	Confident	26 Å²	26	48.1 Å²	48.1	27%	0.268	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.1	-175.1	0	0	0	0	0	113.3	E838	G806-E838 CarbonylContact C-O 3.35Å; G806-E838 WeakPolarHBondContact CA-O 3.39Å
807	L	88.6	Confident	80	Confident	84 Å²	84	50.9 Å²	50.9	44%	0.44	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	140.8	-178	-177.6	66.4	0	0	0	111.1	R809 L837 E838	L807-R809 HydrophobicContact CD2-CG 4.31Å; L807-R809 HydrophobicContact CG-CG 4.39Å; L807-L837 WeakPolarHBondContact O-CA 3.49Å; L807-E838 PolarHBondContact N-O 3.04Å; L807-E838 PolarHBondContact O-N 2.71Å
808	A	86.8	Confident	79.7	Confident	6 Å²	6	55.7 Å²	55.7	5%	0.05	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138	171.4	0	0	0	0	0	111.4	H811 V835 D836 L837 I1017 V1019	A808-H811 PolarHBondContact O-N 3.41Å; A808-V835 HydrophobicContact CB-CG2 4.43Å; A808-D836 CarbonylContact C-O 3.24Å; A808-D836 WeakPolarHBondContact CA-O 3.4Å; A808-L837 HydrophobicContact CB-CD2 4.02Å; A808-L837 HydrophobicContact CB-CG 4.05Å; A808-I1017 HydrophobicContact CB-CG2 3.94Å; A808-V1019 HydrophobicContact CB-CG2 3.79Å
809	R	85.4	Confident	80	Confident	125 Å²	125	57.7 Å²	57.7	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	119.7	179.2	-66.3	-171.5	-174.6	136.1	14.3	111.2	L807 D836 E838	L807-R809 HydrophobicContact CD2-CG 4.31Å; L807-R809 HydrophobicContact CG-CG 4.39Å; R809-D836 PolarHBondContact N-O 3.23Å; R809-D836 PolarHBondContact O-N 3.24Å; R809-E838 IonicContact CZ-OE1 3.67Å; R809-E838 IonicContact CZ-OE2 2.74Å; R809-E838 IonicContact NE-OE2 3.64Å; R809-E838 IonicContact NH1-OE1 2.66Å; R809-E838 PolarHBondContact NH1-OE1 3.38Å; R809-E838 IonicContact NH1-OE2 2.58Å; R809-E838 PolarHBondContact NH1-OE2 2.83Å; R809-E838 IonicContact NH2-OE2 3.47Å; R809-E838 PolarHBondContact NH2-OE2 2.98Å
810	P	83.2	Confident	80.5	Confident	67 Å²	67	57.1 Å²	57.1	44%	0.435	33%	0.325	S	S	.	.	S	Bend	cis	-67	153.8	-14.4	32.4	-35.8	0	0	0	111.2	Q812 L813	P810-Q812 VanDerWaalsContact C-N 3.27Å; P810-Q812 WeakPolarHBondContact CB-O 2.91Å; P810-Q812 WeakPolarHBondContact CG-O 3.02Å; P810-Q812 PolarHBondContact O-N 2.95Å; P810-L813 HydrophobicContact CG-CD2 3.75Å
811	H	76.6	Confident	80.7	Confident	110 Å²	110	58.1 Å²	58.1	51%	0.509	34%	0.34	S	S	.	.	S	Bend	trans	-79.7	-10.3	177	70	-80.1	0	0	0	113.2	A808 M1020	A808-H811 PolarHBondContact O-N 3.41Å; H811-M1020 PolarHBondContact O-N 3.35Å
812	Q	82.9	Confident	81.1	Confident	80 Å²	80	59.3 Å²	59.3	37%	0.374	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.6	173.8	-60	179.9	15.3	0	0	109.3	P810 M1020 Y1022	P810-Q812 VanDerWaalsContact C-N 3.27Å; P810-Q812 WeakPolarHBondContact CB-O 2.91Å; P810-Q812 WeakPolarHBondContact CG-O 3.02Å; P810-Q812 PolarHBondContact O-N 2.95Å; Q812-M1020 CarbonylContact C-O 3.59Å; Q812-M1020 VanDerWaalsContact CA-O 3.29Å; Q812-M1020 WeakPolarHBondContact CA-O 3.29Å; Q812-M1020 HydrophobicContact CG-CB 4.33Å; Q812-Y1022 HydrophobicContact CB-CE2 4.32Å; Q812-Y1022 HydrophobicContact CG-CE2 4.17Å
813	L	84.9	Confident	81	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.7	179.1	-64.2	167.5	0	0	0	109.8	P810 N833 V835 L976 V1019 M1020 I1021 Y1022	P810-L813 HydrophobicContact CG-CD2 3.75Å; L813-N833 HydrophobicContact CD2-CB 4.25Å; L813-V835 HydrophobicContact CD1-CB 3.96Å; L813-V835 HydrophobicContact CD1-CG1 4.14Å; L813-V835 HydrophobicContact CD1-CG2 4.23Å; L813-V835 HydrophobicContact CD2-CB 4.19Å; L813-L976 HydrophobicContact CB-CD2 4.02Å; L813-L976 HydrophobicContact CD1-CB 4.26Å; L813-L976 HydrophobicContact CD1-CD1 4.34Å; L813-L976 HydrophobicContact CD1-CD2 4.4Å; L813-V1019 HydrophobicContact CD1-CG1 3.66Å; L813-V1019 HydrophobicContact CG-CG1 4.28Å; L813-M1020 PolarHBondContact N-O 2.82Å; L813-I1021 HydrophobicContact CB-CG1 4.17Å; L813-I1021 HydrophobicContact CD1-CG1 4.39Å; L813-I1021 CarbonylContact O-C 3.52Å; L813-I1021 VanDerWaalsContact O-CA 3.29Å; L813-I1021 WeakPolarHBondContact O-CA 3.26Å; L813-Y1022 PolarHBondContact O-N 2.8Å
814	F	81.4	Confident	80.7	Confident	82 Å²	82	66 Å²	66	36%	0.36	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.6	177.4	-60.8	-88	0	0	0	111	N833 Y1022	F814-N833 PolarHBondContact O-ND2 3.07Å; F814-Y1022 CarbonylContact C-O 3.58Å; F814-Y1022 VanDerWaalsContact CA-O 3.24Å; F814-Y1022 WeakPolarHBondContact CA-O 3.43Å; F814-Y1022 HydrophobicContact CE1-CD2 4.04Å; F814-Y1022 HydrophobicContact CE1-CG 4.22Å; F814-Y1022 HydrophobicContact CZ-CD2 4.31Å
815	F	81.9	Confident	80.4	Confident	10 Å²	10	66.7 Å²	66.7	4%	0.044	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.1	173.4	68.3	-88.6	0	0	0	112.1	K978 F981 I982 L991 I1021 Y1022 P1023 E1024	F815-K978 HydrophobicContact CB-CG 4.32Å; F815-F981 HydrophobicContact CB-CB 4.14Å; F815-F981 HydrophobicContact CD1-CB 3.87Å; F815-F981 HydrophobicContact CD1-CG 4.44Å; F815-F981 HydrophobicContact CD2-CB 3.66Å; F815-F981 HydrophobicContact CE1-CB 4.11Å; F815-F981 HydrophobicContact CE2-CB 3.92Å; F815-F981 VanDerWaalsContact CE2-O 3.27Å; F815-F981 WeakPolarHBondContact CE2-O 3.29Å; F815-F981 HydrophobicContact CG-CB 3.62Å; F815-F981 HydrophobicContact CZ-CB 4.13Å; F815-I982 HydrophobicContact CD2-CG1 3.88Å; F815-L991 HydrophobicContact CE1-CD1 4.12Å; F815-I1021 HydrophobicContact CD1-CG2 3.6Å; F815-I1021 HydrophobicContact CE1-CG2 3.97Å; F815-Y1022 WeakPolarHBondContact CD1-O 3.4Å; F815-Y1022 VanDerWaalsContact CE1-C 3.48Å; F815-Y1022 PolarHBondContact N-O 2.93Å; F815-P1023 HydrophobicContact CE1-CB 4.18Å; F815-P1023 HydrophobicContact CE2-CB 4.14Å; F815-P1023 HydrophobicContact CZ-CB 3.82Å; F815-P1023 HydrophobicContact CZ-CG 4.48Å; F815-E1024 PolarHBondContact O-N 2.97Å
816	S	73.3	Confident	79.9	Confident	40 Å²	40	67.1 Å²	67.1	28%	0.28	40%	0.399	S	S	.	.			trans	-170.9	164.1	-171.9	57	0	0	0	0	109.5	E1024	S816-E1024 VanDerWaalsContact CB-OE2 3.26Å; S816-E1024 WeakPolarHBondContact CB-OE2 3.3Å; S816-E1024 PolarHBondContact OG-OE2 2.85Å
817	G	73.8	Confident	79.8	Confident	64 Å²	64	67.1 Å²	67.1	66%	0.66	40%	0.395	S	S	*	.	S	Bend	trans	110	-163.1	176.1	0	0	0	0	0	114.3
818	T	72.2	Confident	79.5	Confident	133 Å²	133	64 Å²	64	82%	0.816	38%	0.378	S	S	*	.			trans	-95.8	145.2	-179.8	49.8	0	0	0	0	111.9	K820	T818-K820 PolarHBondContact O-N 2.81Å
819	V	77.6	Confident	79.2	Confident	72 Å²	72	66.7 Å²	66.7	44%	0.436	39%	0.39	S	S	.	.			trans	-68.1	120.3	177.4	175.1	0	0	0	0	110	I982 E983	V819-I982 HydrophobicContact CG2-CB 4.38Å; V819-I982 HydrophobicContact CG2-CG2 3.9Å; V819-E983 HydrophobicContact CG1-CG 4.18Å; V819-E983 VanDerWaalsContact CG1-OE1 3.25Å; V819-E983 WeakPolarHBondContact CG1-OE1 3.29Å; V819-E983 HydrophobicContact CG2-CG 3.92Å
820	K	78.8	Confident	79	Confident	67 Å²	67	63 Å²	63	29%	0.291	38%	0.38	S	S	.	.			trans	-119.1	123.8	174.7	-166.1	172.1	-179.8	-176.5	0	109.1	T818 A824 M825 D830 S979	T818-K820 PolarHBondContact O-N 2.81Å; K820-A824 WeakPolarHBondContact CE-O 3.13Å; K820-A824 HydrophobicContact CG-CB 4.09Å; K820-A824 PolarHBondContact NZ-O 2.85Å; K820-M825 WeakPolarHBondContact O-CE 3.41Å; K820-D830 HydrophobicContact CD-CB 4.35Å; K820-D830 IonicContact NZ-OD1 2.92Å; K820-D830 PolarHBondContact NZ-OD1 2.84Å; K820-D830 IonicContact NZ-OD2 2.68Å; K820-D830 PolarHBondContact NZ-OD2 3.02Å; K820-S979 PolarHBondContact N-OG 2.87Å; K820-S979 VanDerWaalsContact N-OG 3.07Å; K820-S979 PolarHBondContact O-OG 2.84Å
821	G	74.9	Confident	79	Confident	42 Å²	42	59.9 Å²	59.9	43%	0.433	36%	0.36	S	S	.	.			trans	-75.9	157.1	-179.2	0	0	0	0	0	113.1	S823 A824	G821-S823 PolarHBondContact O-N 2.85Å; G821-A824 WeakPolarHBondContact O-CB 3.5Å; G821-A824 PolarHBondContact O-N 3.47Å
822	E	79.6	Confident	79.4	Confident	94 Å²	94	55 Å²	55	44%	0.439	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-51.5	-50.2	-175.6	-177.3	177.2	139.3	0	0	113.3	A824 M825 W869 L895 W977	E822-A824 PolarHBondContact O-N 2.62Å; E822-M825 PolarHBondContact O-N 2.98Å; E822-W869 PolarHBondContact OE2-NE1 3.26Å; E822-L895 HydrophobicContact CG-CD1 4.03Å; E822-L895 HydrophobicContact CG-CD2 4.26Å; E822-W977 HydrophobicContact CB-CH2 4.34Å; E822-W977 HydrophobicContact CB-CZ2 4.01Å; E822-W977 HydrophobicContact CG-CH2 4.07Å; E822-W977 HydrophobicContact CG-CZ2 4.24Å
823	S	76.3	Confident	79.5	Confident	130 Å²	130	53.5 Å²	53.5	91%	0.909	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-67.8	-5.6	-179.8	60.1	0	0	0	0	114.9	G821	G821-S823 PolarHBondContact O-N 2.85Å
824	A	75.8	Confident	79.6	Confident	47 Å²	47	56.6 Å²	56.6	39%	0.388	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-101.8	-6.4	174.5	0	0	0	0	0	113	K820 G821 E822	K820-A824 WeakPolarHBondContact CE-O 3.13Å; K820-A824 HydrophobicContact CG-CB 4.09Å; K820-A824 PolarHBondContact NZ-O 2.85Å; G821-A824 WeakPolarHBondContact O-CB 3.5Å; G821-A824 PolarHBondContact O-N 3.47Å; E822-A824 PolarHBondContact O-N 2.62Å
825	M	81	Confident	80	Confident	16 Å²	16	52.7 Å²	52.7	8%	0.079	34%	0.337	C	S	.	.			trans	-78.6	131.6	179	-61	-164.9	177.2	0	0	110.9	K820 E822 D830 I831 L897 W977	K820-M825 WeakPolarHBondContact O-CE 3.41Å; E822-M825 PolarHBondContact O-N 2.98Å; M825-D830 HydrophobicContact CB-CB 4.08Å; M825-D830 HydrophobicContact CG-CB 4.09Å; M825-I831 HydrophobicContact SD-CB 4.32Å; M825-I831 HydrophobicContact SD-CG1 3.68Å; M825-L897 HydrophobicContact CB-CD1 4.44Å; M825-W977 HydrophobicContact CE-CD2 4.19Å; M825-W977 HydrophobicContact CE-CH2 4.04Å; M825-W977 HydrophobicContact CE-CZ2 3.44Å; M825-W977 VanDerWaalsContact CE-CZ2 3.44Å; M825-W977 HydrophobicContact SD-CD2 4.48Å; M825-W977 HydrophobicContact SD-CE3 4.43Å; M825-W977 HydrophobicContact SD-CH2 3.42Å; M825-W977 WeakPolarHBondContact SD-CH2 3.29Å; M825-W977 HydrophobicContact SD-CZ2 3.49Å; M825-W977 WeakPolarHBondContact SD-CZ2 3.17Å; M825-W977 HydrophobicContact SD-CZ3 3.93Å
826	T	78	Confident	80.3	Confident	111 Å²	111	55 Å²	55	68%	0.681	35%	0.35	S	S	*	.			trans	-127.3	-24.5	-171.6	54.4	0	0	0	0	113.7	D830	T826-D830 PolarHBondContact N-OD2 2.82Å; T826-D830 PolarHBondContact OG1-OD2 2.83Å
827	S	82.9	Confident	81.1	Confident	25 Å²	25	53.1 Å²	53.1	18%	0.175	34%	0.336	C	S	.	.	S	Bend	trans	-130.9	166.1	168.1	91.3	0	0	0	0	111.3	E829 D830 Q898	S827-E829 WeakPolarHBondContact CB-OE2 3.23Å; S827-E829 PolarHBondContact O-N 3.23Å; S827-E829 WeakPolarHBondContact OG-CB 3.47Å; S827-E829 PolarHBondContact OG-N 2.99Å; S827-E829 VanDerWaalsContact OG-N 3.13Å; S827-E829 PolarHBondContact OG-OE2 2.86Å; S827-D830 PolarHBondContact N-OD2 2.6Å; S827-D830 WeakPolarHBondContact O-CB 3.42Å; S827-D830 PolarHBondContact O-N 2.83Å; S827-D830 VanDerWaalsContact O-N 3.12Å; S827-Q898 WeakPolarHBondContact CA-O 3.15Å; S827-Q898 WeakPolarHBondContact CB-O 3.4Å
828	L	82.1	Confident	81.9	Confident	18 Å²	18	51.6 Å²	51.6	9%	0.094	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.7	-25.7	174.4	-72	170.1	0	0	0	112.3	D830 I831 Y872 A874 L897 Q898 R975	L828-D830 VanDerWaalsContact C-N 3.27Å; L828-D830 PolarHBondContact O-N 2.91Å; L828-I831 HydrophobicContact CD2-CD1 3.94Å; L828-I831 PolarHBondContact O-N 3.2Å; L828-Y872 HydrophobicContact CD2-CD1 4.26Å; L828-Y872 HydrophobicContact CD2-CE1 3.83Å; L828-A874 HydrophobicContact CD1-CB 4.2Å; L828-A874 HydrophobicContact CD2-CB 3.92Å; L828-L897 HydrophobicContact CD2-CB 3.76Å; L828-L897 HydrophobicContact CG-CB 3.91Å; L828-Q898 PolarHBondContact N-O 2.66Å; L828-R975 WeakPolarHBondContact O-CD 3.48Å; L828-R975 PolarHBondContact O-NE 2.99Å; L828-R975 PolarHBondContact O-NH1 2.94Å
829	E	80.8	Confident	82.8	Confident	64 Å²	64	45.3 Å²	45.3	30%	0.299	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-68.8	-24.1	177.6	-63.5	72.8	-130.6	0	0	113.1	S827 I831 S899 S900 R975	S827-E829 WeakPolarHBondContact CB-OE2 3.23Å; S827-E829 PolarHBondContact O-N 3.23Å; S827-E829 WeakPolarHBondContact OG-CB 3.47Å; S827-E829 PolarHBondContact OG-N 2.99Å; S827-E829 VanDerWaalsContact OG-N 3.13Å; S827-E829 PolarHBondContact OG-OE2 2.86Å; E829-I831 VanDerWaalsContact C-N 3.27Å; E829-I831 PolarHBondContact O-N 2.89Å; E829-S899 WeakPolarHBondContact OE1-CA 3.19Å; E829-S899 WeakPolarHBondContact OE1-CB 3.18Å; E829-S899 PolarHBondContact OE1-OG 3.27Å; E829-S900 PolarHBondContact OE2-N 2.98Å; E829-S900 VanDerWaalsContact OE2-N 3.16Å; E829-S900 PolarHBondContact OE2-OG 3.03Å; E829-R975 IonicContact OE1-CZ 3.6Å; E829-R975 IonicContact OE1-NH2 3.97Å; E829-R975 PolarHBondContact OE1-NH2 2.87Å
830	D	80.3	Confident	83.3	Confident	48 Å²	48	43.6 Å²	43.6	26%	0.257	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-67.6	-23.2	176.2	-75.3	-40.4	0	0	0	113.8	K820 M825 T826 S827 L828	K820-D830 HydrophobicContact CD-CB 4.35Å; K820-D830 IonicContact NZ-OD1 2.92Å; K820-D830 PolarHBondContact NZ-OD1 2.84Å; K820-D830 IonicContact NZ-OD2 2.68Å; K820-D830 PolarHBondContact NZ-OD2 3.02Å; M825-D830 HydrophobicContact CB-CB 4.08Å; M825-D830 HydrophobicContact CG-CB 4.09Å; T826-D830 PolarHBondContact N-OD2 2.82Å; T826-D830 PolarHBondContact OG1-OD2 2.83Å; S827-D830 PolarHBondContact N-OD2 2.6Å; S827-D830 WeakPolarHBondContact O-CB 3.42Å; S827-D830 PolarHBondContact O-N 2.83Å; S827-D830 VanDerWaalsContact O-N 3.12Å; L828-D830 VanDerWaalsContact C-N 3.27Å; L828-D830 PolarHBondContact O-N 2.91Å
831	I	83.6	Confident	83.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-46	-176.2	-61.2	171.3	0	0	0	111.1	M825 L828 E829 Y872 L897 R975 L976 W977 K978	M825-I831 HydrophobicContact SD-CB 4.32Å; M825-I831 HydrophobicContact SD-CG1 3.68Å; L828-I831 HydrophobicContact CD2-CD1 3.94Å; L828-I831 PolarHBondContact O-N 3.2Å; E829-I831 VanDerWaalsContact C-N 3.27Å; E829-I831 PolarHBondContact O-N 2.89Å; I831-Y872 HydrophobicContact CD1-CD1 3.49Å; I831-Y872 VanDerWaalsContact CD1-CD1 3.49Å; I831-Y872 HydrophobicContact CD1-CD2 4.36Å; I831-Y872 HydrophobicContact CD1-CE1 3.86Å; I831-Y872 HydrophobicContact CD1-CG 3.77Å; I831-L897 HydrophobicContact CD1-CD1 3.84Å; I831-L897 HydrophobicContact CG1-CD1 4.24Å; I831-R975 HydrophobicContact CB-CB 4.29Å; I831-R975 HydrophobicContact CG2-CB 3.89Å; I831-L976 VanDerWaalsContact O-O 3.1Å; I831-W977 HydrophobicContact CB-CE3 4.44Å; I831-W977 HydrophobicContact CD1-CZ3 4.31Å; I831-W977 HydrophobicContact CG1-CE3 4.25Å; I831-W977 HydrophobicContact CG1-CZ3 4.09Å; I831-W977 HydrophobicContact CG2-CB 4.24Å; I831-W977 HydrophobicContact CG2-CD2 4.04Å; I831-W977 HydrophobicContact CG2-CE3 3.53Å; I831-W977 HydrophobicContact CG2-CG 4.36Å; I831-W977 HydrophobicContact CG2-CZ3 4.24Å; I831-K978 PolarHBondContact O-N 3.42Å
832	G	84.5	Confident	84.2	Confident	7 Å²	7	40.2 Å²	40.2	7%	0.072	24%	0.241	C	C	.	.			trans	140.8	-156.1	-174.8	0	0	0	0	0	115.2	R975 L976	G832-R975 PolarHBondContact O-NH1 2.84Å; G832-L976 WeakPolarHBondContact CA-O 3.08Å
833	N	85.2	Confident	84.3	Confident	48 Å²	48	36 Å²	36	26%	0.257	22%	0.222	S	C	.	.			trans	-74	136	-166.4	-73.7	-13	0	0	0	111.5	L813 F814 R975 L976 K978	L813-N833 HydrophobicContact CD2-CB 4.25Å; F814-N833 PolarHBondContact O-ND2 3.07Å; N833-R975 WeakPolarHBondContact O-CA 3.49Å; N833-L976 PolarHBondContact O-N 2.84Å; N833-K978 WeakPolarHBondContact ND2-CE 3.34Å; N833-K978 WeakPolarHBondContact OD1-CE 3.2Å; N833-K978 PolarHBondContact OD1-NZ 3.05Å
834	P	87.8	Confident	84	Confident	70 Å²	70	34.6 Å²	34.6	46%	0.455	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	146	177.6	31.5	-35	0	0	0	112.3	A974 R975	P834-A974 CarbonylContact C-O 3.21Å; P834-A974 WeakPolarHBondContact CA-O 3.35Å; P834-R975 HydrophobicContact CB-CG 4.46Å
835	V	89.2	Confident	83.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	124.6	171.2	60.6	0	0	0	0	109.4	A808 L813 L837 L871 A974	A808-V835 HydrophobicContact CB-CG2 4.43Å; L813-V835 HydrophobicContact CD1-CB 3.96Å; L813-V835 HydrophobicContact CD1-CG1 4.14Å; L813-V835 HydrophobicContact CD1-CG2 4.23Å; L813-V835 HydrophobicContact CD2-CB 4.19Å; V835-L837 HydrophobicContact CG1-CD1 4.47Å; V835-L837 HydrophobicContact CG2-CD1 4.18Å; V835-L871 HydrophobicContact CG1-CD2 3.83Å; V835-A974 HydrophobicContact CG1-CB 4.05Å; V835-A974 PolarHBondContact N-O 2.04Å; V835-A974 WeakPolarHBondContact O-CA 3.17Å; V835-A974 PolarHBondContact O-N 2.78Å
836	D	89.4	Confident	82.7	Confident	59 Å²	59	42.1 Å²	42.1	32%	0.316	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.2	178.7	-70.3	-10.5	0	0	0	109.2	A808 R809 H973	A808-D836 CarbonylContact C-O 3.24Å; A808-D836 WeakPolarHBondContact CA-O 3.4Å; R809-D836 PolarHBondContact N-O 3.23Å; R809-D836 PolarHBondContact O-N 3.24Å; D836-H973 IonicContact OD1-CE1 2.75Å; D836-H973 IonicContact OD1-CG 2.69Å; D836-H973 IonicContact OD1-ND1 3.32Å; D836-H973 PolarHBondContact OD1-ND1 2.84Å; D836-H973 IonicContact OD2-CE1 2.94Å; D836-H973 PolarHBondContact OD2-CE1 2.9Å; D836-H973 IonicContact OD2-ND1 2.72Å; D836-H973 PolarHBondContact OD2-ND1 3.06Å
837	L	90.1	Very high	81.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.9	174.9	-77.4	112	0	0	0	111	L807 A808 V835 F839 W860 K971 I972 I995 I1017	L807-L837 WeakPolarHBondContact O-CA 3.49Å; A808-L837 HydrophobicContact CB-CD2 4.02Å; A808-L837 HydrophobicContact CB-CG 4.05Å; V835-L837 HydrophobicContact CG1-CD1 4.47Å; V835-L837 HydrophobicContact CG2-CD1 4.18Å; L837-F839 HydrophobicContact CB-CE2 4.05Å; L837-F839 HydrophobicContact CD2-CZ 4.48Å; L837-W860 HydrophobicContact CB-CZ3 4.42Å; L837-W860 HydrophobicContact CD1-CH2 3.57Å; L837-W860 HydrophobicContact CD1-CZ3 3.86Å; L837-K971 CarbonylContact O-C 3.58Å; L837-K971 WeakPolarHBondContact O-CA 3.27Å; L837-I972 PolarHBondContact N-O 3.01Å; L837-I972 PolarHBondContact O-N 3.42Å; L837-I995 HydrophobicContact CD1-CD1 3.91Å; L837-I995 HydrophobicContact CD2-CB 4.48Å; L837-I995 HydrophobicContact CD2-CD1 3.5Å; L837-I995 VanDerWaalsContact CD2-CD1 3.5Å; L837-I995 HydrophobicContact CD2-CG2 4.42Å; L837-I995 HydrophobicContact CG-CD1 4.37Å; L837-I1017 HydrophobicContact CD2-CD1 3.89Å; L837-I1017 HydrophobicContact CD2-CG2 4.14Å
838	E	90.8	Very high	80.9	Confident	32 Å²	32	37.8 Å²	37.8	15%	0.15	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.7	178.2	-55.6	-170.9	146.9	0	0	109.6	G806 L807 R809 V969 K971	G806-E838 CarbonylContact C-O 3.35Å; G806-E838 WeakPolarHBondContact CA-O 3.39Å; L807-E838 PolarHBondContact N-O 3.04Å; L807-E838 PolarHBondContact O-N 2.71Å; R809-E838 IonicContact CZ-OE1 3.67Å; R809-E838 IonicContact CZ-OE2 2.74Å; R809-E838 IonicContact NE-OE2 3.64Å; R809-E838 IonicContact NH1-OE1 2.66Å; R809-E838 PolarHBondContact NH1-OE1 3.38Å; R809-E838 IonicContact NH1-OE2 2.58Å; R809-E838 PolarHBondContact NH1-OE2 2.83Å; R809-E838 IonicContact NH2-OE2 3.47Å; R809-E838 PolarHBondContact NH2-OE2 2.98Å; E838-V969 HydrophobicContact CB-CG1 4.38Å; E838-K971 HydrophobicContact CG-CD 4.43Å; E838-K971 HydrophobicContact CG-CG 4.19Å; E838-K971 WeakPolarHBondContact OE1-CE 3.49Å; E838-K971 IonicContact OE1-NZ 2.91Å
839	F	90.8	Very high	79.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.1	171.8	-59.2	-92.6	0	0	0	109.1	N805 L837 L856 I858 V969 L970 I972 I995 A997 I1017	N805-F839 CarbonylContact O-C 3.48Å; N805-F839 WeakPolarHBondContact O-CA 3.23Å; L837-F839 HydrophobicContact CB-CE2 4.05Å; L837-F839 HydrophobicContact CD2-CZ 4.48Å; F839-L856 HydrophobicContact CB-CD2 4.48Å; F839-I858 HydrophobicContact CD1-CD1 4.25Å; F839-I858 HydrophobicContact CD1-CG1 4.37Å; F839-I858 HydrophobicContact CD2-CD1 3.71Å; F839-I858 HydrophobicContact CE1-CD1 4.2Å; F839-I858 HydrophobicContact CE1-CG1 4.11Å; F839-I858 HydrophobicContact CE1-CG2 4.36Å; F839-I858 HydrophobicContact CE2-CD1 3.67Å; F839-I858 HydrophobicContact CE2-CG1 4.36Å; F839-I858 HydrophobicContact CE2-CG2 4.35Å; F839-I858 HydrophobicContact CG-CD1 4.01Å; F839-I858 HydrophobicContact CZ-CD1 3.92Å; F839-I858 HydrophobicContact CZ-CG1 4.1Å; F839-I858 HydrophobicContact CZ-CG2 3.81Å; F839-V969 CarbonylContact O-C 3.6Å; F839-V969 WeakPolarHBondContact O-CA 3.35Å; F839-L970 HydrophobicContact CB-CB 4.34Å; F839-L970 PolarHBondContact N-O 2.83Å; F839-L970 PolarHBondContact O-N 2.89Å; F839-I972 HydrophobicContact CE2-CD1 4.08Å; F839-I972 HydrophobicContact CE2-CG1 4.48Å; F839-I995 HydrophobicContact CZ-CG2 4.01Å; F839-A997 HydrophobicContact CD1-CB 3.78Å; F839-A997 HydrophobicContact CE1-CB 3.61Å; F839-I1017 HydrophobicContact CD1-CD1 4.01Å; F839-I1017 HydrophobicContact CE1-CD1 3.41Å; F839-I1017 VanDerWaalsContact CE1-CD1 3.41Å; F839-I1017 HydrophobicContact CZ-CD1 3.82Å
840	V	88.7	Confident	78.5	Confident	37 Å²	37	50.5 Å²	50.5	22%	0.224	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.5	-176.4	-179.8	0	0	0	0	108.9	V804 N805 Q967 V969	V804-V840 WeakPolarHBondContact CA-O 3.48Å; N805-V840 HydrophobicContact CB-CB 4.41Å; N805-V840 PolarHBondContact N-O 3.37Å; N805-V840 PolarHBondContact O-N 3.08Å; V840-Q967 HydrophobicContact CG1-CG 4.01Å; V840-V969 HydrophobicContact CG2-CG1 4.37Å; V840-V969 HydrophobicContact CG2-CG2 4.26Å
841	L	87.9	Confident	77.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	143.1	176.3	-60.6	169.8	0	0	0	110	V804 L856 F878 L961 F964 Q967 A968 I999	V804-L841 HydrophobicContact CB-CD2 3.91Å; V804-L841 HydrophobicContact CG2-CD2 3.77Å; L841-L856 HydrophobicContact CD1-CD2 4.1Å; L841-L856 HydrophobicContact CD2-CD1 4.17Å; L841-L856 HydrophobicContact CD2-CD2 4.15Å; L841-L856 HydrophobicContact CG-CD2 4.38Å; L841-F878 HydrophobicContact CD1-CE1 4.21Å; L841-F878 HydrophobicContact CD1-CZ 3.72Å; L841-L961 HydrophobicContact CD1-CD1 4Å; L841-L961 HydrophobicContact CD1-CD2 3.5Å; L841-L961 VanDerWaalsContact CD1-CD2 3.5Å; L841-L961 HydrophobicContact CD1-CG 4.42Å; L841-F964 HydrophobicContact CB-CE1 3.89Å; L841-F964 HydrophobicContact CB-CE2 4.42Å; L841-F964 HydrophobicContact CB-CZ 3.64Å; L841-Q967 VanDerWaalsContact O-CA 3.32Å; L841-Q967 WeakPolarHBondContact O-CA 3.18Å; L841-Q967 WeakPolarHBondContact O-CG 3.42Å; L841-A968 PolarHBondContact N-O 2.92Å; L841-A968 PolarHBondContact O-N 3.04Å; L841-A968 VanDerWaalsContact O-N 3.13Å; L841-I999 HydrophobicContact CD2-CD1 3.79Å; L841-I999 HydrophobicContact CD2-CG1 4.01Å
842	S	84.4	Confident	76.4	Confident	38 Å²	38	51.6 Å²	51.6	27%	0.266	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131	173.7	-168	0	0	0	0	112	S803 G966	S803-S842 PolarHBondContact N-O 3.45Å; S803-S842 VanDerWaalsContact N-O 3.07Å; S803-S842 PolarHBondContact O-N 2.92Å; S842-G966 WeakPolarHBondContact CA-O 3.31Å
843	N	80.3	Confident	75.8	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	91.4	167.4	-179.8	17.5	0	0	0	109.1	L802 G845 K846 F964 G966	L802-N843 HydrophobicContact CD2-CB 3.55Å; L802-N843 VanDerWaalsContact CD2-CG 3.5Å; N843-G845 PolarHBondContact O-N 3.11Å; N843-G845 VanDerWaalsContact OD1-CA 3.3Å; N843-G845 WeakPolarHBondContact OD1-CA 3.37Å; N843-G845 PolarHBondContact OD1-N 3.17Å; N843-K846 PolarHBondContact ND2-O 3.49Å; N843-F964 HydrophobicContact CB-CD1 3.68Å; N843-F964 HydrophobicContact CB-CE1 3.51Å; N843-F964 HydrophobicContact CB-CZ 4.27Å; N843-F964 PolarHBondContact ND2-O 3Å; N843-G966 PolarHBondContact N-O 3.01Å; N843-G966 PolarHBondContact O-N 3.25Å
844	P	70.1	Confident	75.5	Confident	101 Å²	101	52.3 Å²	52.3	66%	0.656	29%	0.294	S	S	*	.			trans	-69.7	-9.1	168.8	29.7	-37.5	0	0	0	113.7	P801	P801-P844 HydrophobicContact CB-CG 4Å; P801-P844 HydrophobicContact CG-CG 4.19Å; P801-P844 WeakPolarHBondContact O-CD 3.37Å
845	G	65.8	Low	75.4	Confident	30 Å²	30	50.9 Å²	50.9	31%	0.309	28%	0.281	S	S	.	.	S	Bend	trans	-83	-174.8	178.8	0	0	0	0	0	114.6	N843	N843-G845 PolarHBondContact O-N 3.11Å; N843-G845 VanDerWaalsContact OD1-CA 3.3Å; N843-G845 WeakPolarHBondContact OD1-CA 3.37Å; N843-G845 PolarHBondContact OD1-N 3.17Å
846	K	63.8	Low	75.4	Confident	190 Å²	190	50.9 Å²	50.9	83%	0.826	28%	0.281	S	S	*	.	S	Bend	trans	-68.2	160.3	176.2	-67.4	172.7	-177.3	164.7	0	111.2	N843 L848	N843-K846 PolarHBondContact ND2-O 3.49Å; K846-L848 PolarHBondContact O-N 2.92Å
847	A	62.6	Low	75.4	Confident	41 Å²	41	48.8 Å²	48.8	34%	0.339	27%	0.27	S	S	.	.			trans	-58.3	130.4	-179.9	0	0	0	0	0	112.7	Q849 T965	A847-Q849 PolarHBondContact O-N 3.08Å; A847-T965 HydrophobicContact CB-CG2 3.47Å; A847-T965 VanDerWaalsContact CB-CG2 3.47Å
848	L	60.5	Low	75.5	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-64.4	-9.7	-175.4	-72.5	164.9	0	0	0	115.1	L800 L802 K846 K850 L851 G852 A854 F964	L800-L848 HydrophobicContact CD1-CD2 4.14Å; L802-L848 HydrophobicContact CD1-CD1 4.25Å; L802-L848 HydrophobicContact CD1-CD2 4.13Å; L802-L848 HydrophobicContact CD2-CD1 4.17Å; K846-L848 PolarHBondContact O-N 2.92Å; L848-K850 PolarHBondContact O-N 2.99Å; L848-L851 PolarHBondContact O-N 3.33Å; L848-G852 PolarHBondContact O-N 3.13Å; L848-A854 HydrophobicContact CD1-CB 3.92Å; L848-F964 HydrophobicContact CD1-CB 4.37Å
849	Q	56.8	Low	75.4	Confident	146 Å²	146	49.7 Å²	49.7	68%	0.682	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-52.3	-27.4	-178.8	-70.4	-175.2	-16	0	0	114.6	A847 S963	A847-Q849 PolarHBondContact O-N 3.08Å; Q849-S963 WeakPolarHBondContact CG-OG 3.45Å; Q849-S963 PolarHBondContact NE2-OG 2.91Å
850	K	56.1	Low	75.4	Confident	202 Å²	202	49.7 Å²	49.7	88%	0.878	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-91.9	-8.8	178.2	-70.8	-168.9	173.7	-170.6	0	114.8	L848	L848-K850 PolarHBondContact O-N 2.99Å
851	L	57	Low	75.5	Confident	42 Å²	42	47.9 Å²	47.9	22%	0.22	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-17.6	-163.9	-70.2	163.1	0	0	0	114.2	L800 L848 S1003 I1005	L800-L851 HydrophobicContact CD2-CD1 4Å; L848-L851 PolarHBondContact O-N 3.33Å; L851-S1003 WeakPolarHBondContact O-CB 3.2Å; L851-S1003 PolarHBondContact O-OG 3.15Å; L851-I1005 HydrophobicContact CD2-CD1 3.69Å
852	G	62.3	Low	75.5	Confident	30 Å²	30	48.6 Å²	48.6	31%	0.309	27%	0.268	S	S	.	.			trans	147.4	-170.1	175.3	0	0	0	0	0	113.8	L848 K1002	L848-G852 PolarHBondContact O-N 3.13Å; G852-K1002 CarbonylContact C-O 3.58Å; G852-K1002 VanDerWaalsContact CA-O 3.24Å; G852-K1002 WeakPolarHBondContact CA-O 3.47Å
853	S	71.8	Confident	75.8	Confident	68 Å²	68	49.4 Å²	49.4	48%	0.476	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.4	172.9	-65.2	0	0	0	0	110.3	F855 K1002	S853-F855 WeakPolarHBondContact O-CE2 3.2Å; S853-K1002 PolarHBondContact N-O 3.37Å; S853-K1002 PolarHBondContact O-N 3.33Å
854	A	80	Confident	76	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	146.7	175.4	0	0	0	0	0	111.2	L848 L961 I999 S1000 V1001	L848-A854 HydrophobicContact CD1-CB 3.92Å; A854-L961 HydrophobicContact CB-CB 4.15Å; A854-L961 HydrophobicContact CB-CD1 4.35Å; A854-L961 PolarHBondContact O-N 3.32Å; A854-I999 HydrophobicContact CB-CG2 4.5Å; A854-S1000 CarbonylContact C-O 3.56Å; A854-S1000 WeakPolarHBondContact CA-O 3.05Å; A854-V1001 HydrophobicContact CB-CG2 4.04Å
855	F	86	Confident	76.7	Confident	39 Å²	39	47.8 Å²	47.8	17%	0.171	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.6	-179.9	-57.2	-94.6	0	0	0	109.4	S853 Q958 P960 I999 S1000 K1002	S853-F855 WeakPolarHBondContact O-CE2 3.2Å; F855-Q958 HydrophobicContact CB-CG 4.25Å; F855-Q958 HydrophobicContact CD1-CG 3.97Å; F855-Q958 HydrophobicContact CG-CG 4.46Å; F855-P960 HydrophobicContact CD1-CB 3.98Å; F855-P960 HydrophobicContact CE1-CB 3.96Å; F855-I999 WeakPolarHBondContact O-CA 3.47Å; F855-S1000 PolarHBondContact N-O 2.91Å; F855-S1000 PolarHBondContact O-N 3.16Å; F855-K1002 HydrophobicContact CE2-CD 4.18Å; F855-K1002 HydrophobicContact CE2-CG 4.43Å
856	L	88.6	Confident	77.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	120.9	163.4	170.5	62.4	0	0	0	107.8	V804 F839 L841 I858 C959 L961 L970 A997 N998	V804-L856 HydrophobicContact CG2-CD1 4.15Å; F839-L856 HydrophobicContact CB-CD2 4.48Å; L841-L856 HydrophobicContact CD1-CD2 4.1Å; L841-L856 HydrophobicContact CD2-CD1 4.17Å; L841-L856 HydrophobicContact CD2-CD2 4.15Å; L841-L856 HydrophobicContact CG-CD2 4.38Å; L856-I858 HydrophobicContact CD1-CG1 4.26Å; L856-I858 HydrophobicContact CD2-CD1 4Å; L856-I858 HydrophobicContact CD2-CG1 4.45Å; L856-I858 HydrophobicContact CG-CD1 4.21Å; L856-I858 HydrophobicContact CG-CG1 4.16Å; L856-C959 HydrophobicContact CB-CB 4.32Å; L856-C959 PolarHBondContact N-O 2.7Å; L856-C959 PolarHBondContact O-N 3.1Å; L856-L961 HydrophobicContact CB-CD1 4.33Å; L856-L961 HydrophobicContact CB-CD2 4.24Å; L856-L961 HydrophobicContact CB-CG 4.42Å; L856-L970 HydrophobicContact CD2-CB 4.46Å; L856-L970 HydrophobicContact CD2-CD2 3.75Å; L856-A997 HydrophobicContact CD1-CB 4.19Å; L856-N998 WeakPolarHBondContact CA-O 3.37Å
857	N	89.9	Confident	78.2	Confident	16 Å²	16	43.6 Å²	43.6	9%	0.086	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.9	176.3	-37.3	-74.8	0	0	0	108.9	L956 F957 Q958 A997 N998 S1000	N857-L956 HydrophobicContact CB-CD1 4.08Å; N857-F957 CarbonylContact C-O 3.6Å; N857-F957 WeakPolarHBondContact CA-O 3.39Å; N857-Q958 PolarHBondContact OD1-NE2 2.74Å; N857-A997 CarbonylContact O-C 3.6Å; N857-A997 VanDerWaalsContact O-CA 3.25Å; N857-A997 WeakPolarHBondContact O-CA 3.39Å; N857-N998 WeakPolarHBondContact CB-OD1 3.23Å; N857-N998 PolarHBondContact N-O 3Å; N857-N998 PolarHBondContact ND2-OD1 3.21Å; N857-N998 PolarHBondContact O-N 2.99Å; N857-S1000 PolarHBondContact ND2-OG 2.91Å
858	I	90.7	Very high	79.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.2	178.9	-64.6	161	0	0	0	109	F839 L856 W860 L956 F957 L970 I972 I995 R996 A997	F839-I858 HydrophobicContact CD1-CD1 4.25Å; F839-I858 HydrophobicContact CD1-CG1 4.37Å; F839-I858 HydrophobicContact CD2-CD1 3.71Å; F839-I858 HydrophobicContact CE1-CD1 4.2Å; F839-I858 HydrophobicContact CE1-CG1 4.11Å; F839-I858 HydrophobicContact CE1-CG2 4.36Å; F839-I858 HydrophobicContact CE2-CD1 3.67Å; F839-I858 HydrophobicContact CE2-CG1 4.36Å; F839-I858 HydrophobicContact CE2-CG2 4.35Å; F839-I858 HydrophobicContact CG-CD1 4.01Å; F839-I858 HydrophobicContact CZ-CD1 3.92Å; F839-I858 HydrophobicContact CZ-CG1 4.1Å; F839-I858 HydrophobicContact CZ-CG2 3.81Å; L856-I858 HydrophobicContact CD1-CG1 4.26Å; L856-I858 HydrophobicContact CD2-CD1 4Å; L856-I858 HydrophobicContact CD2-CG1 4.45Å; L856-I858 HydrophobicContact CG-CD1 4.21Å; L856-I858 HydrophobicContact CG-CG1 4.16Å; I858-W860 HydrophobicContact CG2-CE3 4.48Å; I858-L956 CarbonylContact O-C 3.6Å; I858-L956 WeakPolarHBondContact O-CA 3.37Å; I858-F957 HydrophobicContact CB-CB 4.36Å; I858-F957 PolarHBondContact N-O 3Å; I858-F957 PolarHBondContact O-N 2.91Å; I858-L970 HydrophobicContact CD1-CD2 3.48Å; I858-L970 VanDerWaalsContact CD1-CD2 3.48Å; I858-I972 HydrophobicContact CD1-CD1 4.23Å; I858-I995 HydrophobicContact CG2-CG2 4.22Å; I858-R996 WeakPolarHBondContact CA-O 3.45Å; I858-A997 HydrophobicContact CG1-CB 3.8Å
859	M	90.4	Very high	80.5	Confident	50 Å²	50	45.6 Å²	45.6	25%	0.246	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	108.2	173.6	-64.3	171.7	68.5	0	0	109.2	C947 L948 L956 R996	M859-C947 HydrophobicContact CE-CB 3.43Å; M859-C947 VanDerWaalsContact CE-CB 3.43Å; M859-L948 HydrophobicContact CE-CD2 3.63Å; M859-L948 HydrophobicContact CE-CG 3.96Å; M859-L948 HydrophobicContact SD-CD2 4.36Å; M859-L956 HydrophobicContact CG-CD1 3.75Å; M859-R996 HydrophobicContact CB-CB 4.35Å; M859-R996 PolarHBondContact N-O 2.86Å; M859-R996 HydrophobicContact SD-CB 4.2Å
860	W	90.9	Very high	82	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.4	-172.7	-172.7	-82.1	0	0	0	112.3	L837 I858 V862 L871 P873 C954 V955 F957 I972 A974	L837-W860 HydrophobicContact CB-CZ3 4.42Å; L837-W860 HydrophobicContact CD1-CH2 3.57Å; L837-W860 HydrophobicContact CD1-CZ3 3.86Å; I858-W860 HydrophobicContact CG2-CE3 4.48Å; W860-V862 PolarHBondContact O-N 2.28Å; W860-L871 HydrophobicContact CZ2-CB 3.99Å; W860-L871 HydrophobicContact CZ2-CD1 4.21Å; W860-L871 PolarHBondContact NE1-O 2.88Å; W860-L871 VanDerWaalsContact NE1-O 3.14Å; W860-P873 HydrophobicContact CZ2-CB 4.33Å; W860-C954 CarbonylContact O-C 3.59Å; W860-C954 WeakPolarHBondContact O-CA 3.44Å; W860-C954 VanDerWaalsContact O-CB 3.26Å; W860-C954 WeakPolarHBondContact O-CB 3.25Å; W860-V955 PolarHBondContact N-O 2.77Å; W860-V955 PolarHBondContact O-N 2.99Å; W860-F957 HydrophobicContact CB-CD2 3.72Å; W860-F957 HydrophobicContact CB-CE2 3.71Å; W860-F957 HydrophobicContact CD2-CE2 4.21Å; W860-F957 HydrophobicContact CG-CD2 4.17Å; W860-F957 AromaticContact CG-CE2 3.75Å; W860-F957 HydrophobicContact CG-CE2 3.75Å; W860-I972 HydrophobicContact CE3-CD1 3.9Å; W860-I972 HydrophobicContact CE3-CG2 4.28Å; W860-I972 HydrophobicContact CH2-CB 4.07Å; W860-I972 HydrophobicContact CH2-CG2 3.49Å; W860-I972 VanDerWaalsContact CH2-CG2 3.49Å; W860-I972 HydrophobicContact CZ2-CG2 4.14Å; W860-I972 HydrophobicContact CZ3-CB 3.85Å; W860-I972 HydrophobicContact CZ3-CD1 3.81Å; W860-I972 HydrophobicContact CZ3-CG1 4.41Å; W860-I972 HydrophobicContact CZ3-CG2 3.59Å; W860-A974 HydrophobicContact CH2-CB 3.63Å; W860-A974 HydrophobicContact CZ2-CB 3.42Å; W860-A974 VanDerWaalsContact CZ2-CB 3.42Å
861	P	90.4	Very high	83.6	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	101.1	-179.1	30.9	-33.1	0	0	0	112.2	L870 L871 A952 C954 L993 I995	P861-L870 HydrophobicContact CB-CD1 4.34Å; P861-L871 HydrophobicContact CG-CD1 4.37Å; P861-L871 PolarHBondContact O-N 3.38Å; P861-A952 HydrophobicContact CB-CB 3.97Å; P861-C954 WeakPolarHBondContact CA-SG 3.24Å; P861-L993 HydrophobicContact CB-CD1 3.9Å; P861-L993 HydrophobicContact CG-CD1 3.72Å; P861-L993 HydrophobicContact CG-CD2 4.07Å; P861-L993 HydrophobicContact CG-CG 4Å; P861-I995 HydrophobicContact CG-CG1 4Å
862	V	88.1	Confident	85.1	Confident	14 Å²	14	27 Å²	27	9%	0.085	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-44.1	-176.8	-173.4	0	0	0	0	111.7	W860 W869 L870 R953 V955	W860-V862 PolarHBondContact O-N 2.28Å; V862-W869 HydrophobicContact CG1-CE3 3.66Å; V862-W869 HydrophobicContact CG1-CH2 4.28Å; V862-W869 HydrophobicContact CG1-CZ3 3.33Å; V862-W869 CarbonylContact O-C 3.55Å; V862-L870 PolarHBondContact O-N 2.5Å; V862-R953 PolarHBondContact N-O 3.05Å; V862-V955 HydrophobicContact CG2-CB 3.99Å; V862-V955 HydrophobicContact CG2-CG2 3.67Å
863	E	89.4	Confident	86.5	Confident	55 Å²	55	25.7 Å²	25.7	26%	0.257	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158.3	-172.2	-67.9	169.4	-160.5	0	0	112.3	K868 L870 A952 R953	E863-K868 CarbonylContact C-O 3.56Å; E863-K868 VanDerWaalsContact CA-O 3.27Å; E863-K868 WeakPolarHBondContact CA-O 3.29Å; E863-L870 WeakPolarHBondContact O-CD1 3.35Å; E863-A952 CarbonylContact O-C 3.18Å; E863-R953 HydrophobicContact CB-CB 4.14Å; E863-R953 PolarHBondContact N-O 2.97Å; E863-R953 PolarHBondContact O-N 3.26Å; E863-R953 IonicContact OE2-NH1 2.65Å
864	L	85.8	Confident	87.1	Confident	9 Å²	9	23.1 Å²	23.1	5%	0.047	13%	0.129	C	C	.	.			trans	-74.9	160.4	160.3	-75.6	171	0	0	0	111	N866 G867 K868 L870 L945 D984 F985	L864-N866 WeakPolarHBondContact CB-OD1 3.26Å; L864-N866 PolarHBondContact O-N 3.06Å; L864-G867 PolarHBondContact O-N 3.22Å; L864-K868 PolarHBondContact N-O 3.39Å; L864-L870 HydrophobicContact CD1-CD2 4.3Å; L864-L870 HydrophobicContact CD2-CD1 4.1Å; L864-L870 HydrophobicContact CD2-CD2 3.85Å; L864-L870 HydrophobicContact CD2-CG 4.23Å; L864-L870 HydrophobicContact CG-CD1 4.2Å; L864-L870 HydrophobicContact CG-CD2 3.71Å; L864-L870 HydrophobicContact CG-CG 3.89Å; L864-L945 HydrophobicContact CD2-CD1 4.44Å; L864-L945 HydrophobicContact CD2-CD2 4.09Å; L864-D984 HydrophobicContact CD1-CB 4.4Å; L864-D984 WeakPolarHBondContact CD1-OD2 3.16Å; L864-F985 HydrophobicContact CD1-CE2 3.83Å; L864-F985 HydrophobicContact CD1-CZ 3.88Å; L864-F985 HydrophobicContact CD2-CE2 4.19Å; L864-F985 HydrophobicContact CD2-CZ 3.82Å
865	P	83.2	Confident	87.4	Confident	64 Å²	64	24.8 Å²	24.8	42%	0.416	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.1	177.5	-27.6	36.8	0	0	0	115.2	G950 S951 R953	P865-G950 WeakPolarHBondContact CG-O 3.43Å; P865-S951 VanDerWaalsContact CD-O 3.31Å; P865-S951 WeakPolarHBondContact CD-O 3.43Å; P865-R953 PolarHBondContact O-NE 3.01Å; P865-R953 PolarHBondContact O-NH2 3.45Å
866	N	81.1	Confident	87.5	Confident	94 Å²	94	24.9 Å²	24.9	50%	0.503	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.8	176.3	67.5	-1.1	0	0	0	114.4	L864 K868 D984	L864-N866 WeakPolarHBondContact CB-OD1 3.26Å; L864-N866 PolarHBondContact O-N 3.06Å; N866-K868 PolarHBondContact OD1-N 2.88Å; N866-K868 VanDerWaalsContact OD1-N 3.15Å; N866-D984 PolarHBondContact ND2-OD2 2.88Å
867	G	80.6	Confident	87.4	Confident	38 Å²	38	32.4 Å²	32.4	39%	0.392	17%	0.171	S	C	.	.	S	Bend	trans	88.1	11.4	178.8	0	0	0	0	0	115.6	L864	L864-G867 PolarHBondContact O-N 3.22Å
868	K	85.3	Confident	87.1	Confident	58 Å²	58	32.5 Å²	32.5	25%	0.252	17%	0.171	S	C	.	.			trans	-90.6	141	172	-60	-165.7	-164	174.8	0	111.8	E863 L864 N866 E983 D984	E863-K868 CarbonylContact C-O 3.56Å; E863-K868 VanDerWaalsContact CA-O 3.27Å; E863-K868 WeakPolarHBondContact CA-O 3.29Å; L864-K868 PolarHBondContact N-O 3.39Å; N866-K868 PolarHBondContact OD1-N 2.88Å; N866-K868 VanDerWaalsContact OD1-N 3.15Å; K868-E983 WeakPolarHBondContact CE-OE2 3.43Å; K868-E983 IonicContact NZ-OE2 3.62Å; K868-E983 PolarHBondContact NZ-OE2 3.33Å; K868-D984 WeakPolarHBondContact CD-OD2 3.49Å; K868-D984 IonicContact NZ-OD1 2.85Å; K868-D984 PolarHBondContact NZ-OD1 3.08Å; K868-D984 IonicContact NZ-OD2 2.69Å
869	W	86.8	Confident	86.8	Confident	30 Å²	30	36.8 Å²	36.8	11%	0.114	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-62.2	145.9	179.9	-66.3	93.3	0	0	0	114.3	E822 V862 Y872 P894 W977 S980	E822-W869 PolarHBondContact OE2-NE1 3.26Å; V862-W869 HydrophobicContact CG1-CE3 3.66Å; V862-W869 HydrophobicContact CG1-CH2 4.28Å; V862-W869 HydrophobicContact CG1-CZ3 3.33Å; V862-W869 CarbonylContact O-C 3.55Å; W869-Y872 HydrophobicContact CE3-CD2 4.01Å; W869-Y872 HydrophobicContact CH2-CD2 4.48Å; W869-Y872 HydrophobicContact CH2-CE2 4.46Å; W869-Y872 AromaticContact CZ3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CE2 4.32Å; W869-P894 HydrophobicContact CH2-CG 3.64Å; W869-P894 HydrophobicContact CZ3-CG 4.18Å; W869-W977 HydrophobicContact CB-CB 3.85Å; W869-W977 HydrophobicContact CB-CD2 3.41Å; W869-W977 VanDerWaalsContact CB-CD2 3.41Å; W869-W977 HydrophobicContact CB-CE3 3.67Å; W869-W977 HydrophobicContact CB-CG 3.5Å; W869-W977 HydrophobicContact CB-CZ3 4.36Å; W869-W977 AromaticContact CD1-CE2 3.8Å; W869-W977 AromaticContact CD1-CH2 3.8Å; W869-W977 AromaticContact CD1-CZ2 3.66Å; W869-W977 HydrophobicContact CD2-CE3 4.3Å; W869-W977 HydrophobicContact CD2-CZ3 4.22Å; W869-W977 AromaticContact CG-CD2 3.84Å; W869-W977 HydrophobicContact CG-CD2 3.84Å; W869-W977 AromaticContact CG-CE3 3.78Å; W869-W977 HydrophobicContact CG-CE3 3.78Å; W869-W977 HydrophobicContact CG-CG 4.42Å; W869-W977 HydrophobicContact CG-CH2 4.19Å; W869-W977 HydrophobicContact CG-CZ2 4.21Å; W869-W977 AromaticContact CG-CZ3 3.97Å; W869-W977 HydrophobicContact CG-CZ3 3.97Å; W869-S980 WeakPolarHBondContact O-CB 3.27Å; W869-S980 PolarHBondContact O-OG 3.39Å
870	L	88.6	Confident	85.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-112.6	-79.7	175.1	-76.9	174.3	0	0	0	111.8	P861 V862 E863 L864 L945 A952 W977 F981	P861-L870 HydrophobicContact CB-CD1 4.34Å; V862-L870 PolarHBondContact O-N 2.5Å; E863-L870 WeakPolarHBondContact O-CD1 3.35Å; L864-L870 HydrophobicContact CD1-CD2 4.3Å; L864-L870 HydrophobicContact CD2-CD1 4.1Å; L864-L870 HydrophobicContact CD2-CD2 3.85Å; L864-L870 HydrophobicContact CD2-CG 4.23Å; L864-L870 HydrophobicContact CG-CD1 4.2Å; L864-L870 HydrophobicContact CG-CD2 3.71Å; L864-L870 HydrophobicContact CG-CG 3.89Å; L870-L945 HydrophobicContact CD2-CD1 3.91Å; L870-A952 HydrophobicContact CD1-CB 3.69Å; L870-W977 PolarHBondContact O-N 3.31Å; L870-F981 HydrophobicContact CD2-CE1 4.15Å; L870-F981 HydrophobicContact CD2-CE2 3.94Å; L870-F981 HydrophobicContact CD2-CZ 3.44Å; L870-F981 VanDerWaalsContact CD2-CZ 3.44Å
871	L	89.5	Confident	85.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	112.7	175.1	-74	-178.1	0	0	0	110.1	V835 W860 P861 P873 L976 L993 I995	V835-L871 HydrophobicContact CG1-CD2 3.83Å; W860-L871 HydrophobicContact CZ2-CB 3.99Å; W860-L871 HydrophobicContact CZ2-CD1 4.21Å; W860-L871 PolarHBondContact NE1-O 2.88Å; W860-L871 VanDerWaalsContact NE1-O 3.14Å; P861-L871 HydrophobicContact CG-CD1 4.37Å; P861-L871 PolarHBondContact O-N 3.38Å; L871-P873 VanDerWaalsContact O-CD 3.3Å; L871-P873 WeakPolarHBondContact O-CD 3.48Å; L871-L976 HydrophobicContact CD2-CB 4.45Å; L871-L976 HydrophobicContact CD2-CD1 3.95Å; L871-L993 HydrophobicContact CD1-CD2 3.49Å; L871-L993 VanDerWaalsContact CD1-CD2 3.49Å; L871-L993 HydrophobicContact CD2-CD2 4.39Å; L871-L993 HydrophobicContact CG-CD2 3.62Å; L871-I995 HydrophobicContact CD1-CD1 3.8Å
872	Y	88.8	Confident	83.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.7	176.1	-173.4	-93	0	0	0	110.5	L828 I831 W869 A874 N893 P894 L895 A974 R975 W977	L828-Y872 HydrophobicContact CD2-CD1 4.26Å; L828-Y872 HydrophobicContact CD2-CE1 3.83Å; I831-Y872 HydrophobicContact CD1-CD1 3.49Å; I831-Y872 VanDerWaalsContact CD1-CD1 3.49Å; I831-Y872 HydrophobicContact CD1-CD2 4.36Å; I831-Y872 HydrophobicContact CD1-CE1 3.86Å; I831-Y872 HydrophobicContact CD1-CG 3.77Å; W869-Y872 HydrophobicContact CE3-CD2 4.01Å; W869-Y872 HydrophobicContact CH2-CD2 4.48Å; W869-Y872 HydrophobicContact CH2-CE2 4.46Å; W869-Y872 AromaticContact CZ3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CD2 3.93Å; W869-Y872 HydrophobicContact CZ3-CE2 4.32Å; Y872-A874 HydrophobicContact CD1-CB 4.45Å; Y872-A874 PolarHBondContact O-N 3.05Å; Y872-N893 WeakPolarHBondContact CE1-OD1 3.42Å; Y872-N893 WeakPolarHBondContact OH-CA 3.41Å; Y872-N893 PolarHBondContact OH-OD1 3.08Å; Y872-P894 HydrophobicContact CE2-CG 3.91Å; Y872-L895 HydrophobicContact CE2-CB 4.27Å; Y872-L895 HydrophobicContact CE2-CD1 3.82Å; Y872-L895 HydrophobicContact CE2-CG 3.91Å; Y872-L895 WeakPolarHBondContact OH-CB 3.34Å; Y872-L895 PolarHBondContact OH-N 3.16Å; Y872-A974 CarbonylContact O-C 3.51Å; Y872-A974 WeakPolarHBondContact O-CA 3.35Å; Y872-A974 WeakPolarHBondContact O-CB 3.28Å; Y872-R975 PolarHBondContact N-O 2.83Å; Y872-R975 PolarHBondContact O-N 2.93Å; Y872-W977 HydrophobicContact CD2-CE3 4.25Å; Y872-W977 AromaticContact CD2-CZ3 3.87Å; Y872-W977 HydrophobicContact CD2-CZ3 3.87Å; Y872-W977 HydrophobicContact CE2-CZ3 4.42Å; Y872-W977 HydrophobicContact CG-CZ3 4.43Å
873	P	89.9	Confident	83.1	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108.8	177.3	31.8	-33.9	0	0	0	110	W860 L871 A891 N893 I972	W860-P873 HydrophobicContact CZ2-CB 4.33Å; L871-P873 VanDerWaalsContact O-CD 3.3Å; L871-P873 WeakPolarHBondContact O-CD 3.48Å; P873-A891 WeakPolarHBondContact CG-O 3.3Å; P873-N893 WeakPolarHBondContact O-CA 3.4Å; P873-N893 PolarHBondContact O-N 3.34Å; P873-I972 HydrophobicContact CB-CG2 4.43Å
874	A	85.9	Confident	82.5	Confident	14 Å²	14	48.5 Å²	48.5	12%	0.116	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-35.5	-175.4	0	0	0	0	0	113.2	L828 Y872 H973	L828-A874 HydrophobicContact CD1-CB 4.2Å; L828-A874 HydrophobicContact CD2-CB 3.92Å; Y872-A874 HydrophobicContact CD1-CB 4.45Å; Y872-A874 PolarHBondContact O-N 3.05Å; A874-H973 WeakPolarHBondContact CA-O 3.3Å; A874-H973 PolarHBondContact N-O 3.23Å
875	S	86.1	Confident	82.3	Confident	39 Å²	39	58.7 Å²	58.7	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	155.2	167.3	65.7	0	0	0	0	112.4	H973	S875-H973 PolarHBondContact N-O 2.82Å; S875-H973 VanDerWaalsContact N-O 3.07Å; S875-H973 PolarHBondContact O-N 3.04Å; S875-H973 PolarHBondContact OG-CD2 3.24Å
876	L	87.4	Confident	82.3	Confident	41 Å²	41	56.1 Å²	56.1	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.4	178.6	178.4	153.8	0	0	0	108.7	C886 V892 L970 K971 I972	L876-C886 HydrophobicContact CD1-CB 4.26Å; L876-C886 HydrophobicContact CD2-CB 4.43Å; L876-V892 HydrophobicContact CB-CG1 4.39Å; L876-V892 HydrophobicContact CB-CG2 4.3Å; L876-L970 HydrophobicContact CD1-CD1 4.45Å; L876-L970 HydrophobicContact CD2-CD1 3.78Å; L876-L970 HydrophobicContact CG-CD1 3.93Å; L876-K971 WeakPolarHBondContact CA-O 3.22Å; L876-I972 HydrophobicContact CD1-CD1 4.05Å; L876-I972 HydrophobicContact CD1-CG1 4.07Å; L876-I972 HydrophobicContact CG-CG1 4.17Å
877	R	86.1	Confident	82.6	Confident	157 Å²	157	54.6 Å²	54.6	59%	0.592	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	126.9	-177.9	-66.9	-176.5	177	-172.9	0.4	111	K971	R877-K971 PolarHBondContact N-O 2.81Å; R877-K971 PolarHBondContact O-N 3.05Å
878	F	85.1	Confident	82.6	Confident	18 Å²	18	55.3 Å²	55.3	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	102.6	177.8	-150.1	-27.5	0	0	0	110.5	L841 Q881 T884 C959 L961 A968 L970	L841-F878 HydrophobicContact CD1-CE1 4.21Å; L841-F878 HydrophobicContact CD1-CZ 3.72Å; F878-Q881 HydrophobicContact CD1-CB 4.28Å; F878-Q881 HydrophobicContact CD2-CB 4.49Å; F878-Q881 HydrophobicContact CE1-CB 4.47Å; F878-Q881 HydrophobicContact CG-CB 4.3Å; F878-T884 HydrophobicContact CD2-CG2 3.63Å; F878-T884 HydrophobicContact CE2-CG2 3.8Å; F878-C959 HydrophobicContact CE2-CB 4.17Å; F878-L961 HydrophobicContact CE2-CD2 3.94Å; F878-L961 HydrophobicContact CZ-CD2 3.65Å; F878-A968 HydrophobicContact CE1-CB 3.82Å; F878-L970 HydrophobicContact CB-CD1 3.92Å; F878-L970 HydrophobicContact CD1-CB 4.22Å; F878-L970 HydrophobicContact CD2-CD1 3.99Å; F878-L970 HydrophobicContact CE1-CB 4.25Å; F878-L970 HydrophobicContact CG-CB 4.42Å; F878-L970 HydrophobicContact CG-CD1 3.9Å
879	E	82.6	Confident	82.3	Confident	91 Å²	91	56 Å²	56	43%	0.425	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125	174.3	-64.8	175.7	-173.9	0	0	109.6	V969 K971	E879-V969 WeakPolarHBondContact CA-O 3.42Å; E879-V969 HydrophobicContact CB-CB 4.43Å; E879-V969 WeakPolarHBondContact CB-O 3.46Å; E879-V969 PolarHBondContact N-O 3.22Å; E879-V969 PolarHBondContact O-N 2.85Å; E879-K971 WeakPolarHBondContact OE1-CD 3.41Å; E879-K971 WeakPolarHBondContact OE1-CE 3.46Å; E879-K971 IonicContact OE1-NZ 3.94Å; E879-K971 PolarHBondContact OE1-NZ 2.91Å; E879-K971 VanDerWaalsContact OE2-CE 3.24Å; E879-K971 WeakPolarHBondContact OE2-CE 3.49Å; E879-K971 IonicContact OE2-NZ 3.14Å; E879-K971 PolarHBondContact OE2-NZ 2.86Å
880	G	72	Confident	82.1	Confident	64 Å²	64	62.9 Å²	62.9	66%	0.66	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	-18.8	-174.5	0	0	0	0	0	114.9
881	Q	73.7	Confident	81.7	Confident	21 Å²	21	63.9 Å²	63.9	10%	0.098	35%	0.351	C	S	.	.			trans	-139	73.8	171.2	-64.9	-153.2	-23.1	0	0	111.7	F878 D883 T884 H962	F878-Q881 HydrophobicContact CD1-CB 4.28Å; F878-Q881 HydrophobicContact CD2-CB 4.49Å; F878-Q881 HydrophobicContact CE1-CB 4.47Å; F878-Q881 HydrophobicContact CG-CB 4.3Å; Q881-D883 VanDerWaalsContact C-N 3.27Å; Q881-D883 PolarHBondContact O-N 3.36Å; Q881-T884 WeakPolarHBondContact O-CB 3.42Å; Q881-T884 PolarHBondContact O-N 3Å; Q881-T884 VanDerWaalsContact O-N 3.16Å; Q881-T884 PolarHBondContact OE1-OG1 3.02Å; Q881-H962 PolarHBondContact NE2-O 2.73Å
882	P	65.7	Low	81.5	Confident	113 Å²	113	65.7 Å²	65.7	73%	0.734	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.1	-171.8	27	-35.3	0	0	0	114.3
883	D	71.3	Confident	81.3	Confident	152 Å²	152	67.2 Å²	67.2	81%	0.813	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-11.6	179	-60.3	-54.2	0	0	0	113.4	Q881 R885	Q881-D883 VanDerWaalsContact C-N 3.27Å; Q881-D883 PolarHBondContact O-N 3.36Å; D883-R885 PolarHBondContact O-N 3.47Å
884	T	77.5	Confident	81	Confident	15 Å²	15	69.8 Å²	69.8	9%	0.092	39%	0.387	C	S	.	.			trans	-74.9	112.8	-178.1	-69.4	0	0	0	0	110.9	F878 Q881 P960	F878-T884 HydrophobicContact CD2-CG2 3.63Å; F878-T884 HydrophobicContact CE2-CG2 3.8Å; Q881-T884 WeakPolarHBondContact O-CB 3.42Å; Q881-T884 PolarHBondContact O-N 3Å; Q881-T884 VanDerWaalsContact O-N 3.16Å; Q881-T884 PolarHBondContact OE1-OG1 3.02Å; T884-P960 HydrophobicContact CG2-CG 4.16Å; T884-P960 WeakPolarHBondContact CG2-O 3.35Å; T884-P960 PolarHBondContact OG1-O 2.64Å
885	R	80.6	Confident	80.8	Confident	223 Å²	223	71.8 Å²	71.8	84%	0.842	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-97.1	124	172.2	-61.3	-173.6	-177.7	-155.1	-0	110.4	D883 P960	D883-R885 PolarHBondContact O-N 3.47Å; R885-P960 WeakPolarHBondContact O-CD 3.1Å
886	C	84.7	Confident	80.6	Confident	10 Å²	10	76.3 Å²	76.3	7%	0.068	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-81.3	143.3	172.4	-51.4	0	0	0	0	110.9	L876 Q958 C959	L876-C886 HydrophobicContact CD1-CB 4.26Å; L876-C886 HydrophobicContact CD2-CB 4.43Å; C886-Q958 CarbonylContact C-O 3.51Å; C886-Q958 VanDerWaalsContact CA-O 3.29Å; C886-Q958 WeakPolarHBondContact CA-O 3.22Å; C886-C959 HydrophobicContact CB-CB 4.07Å; C886-C959 WeakPolarHBondContact CB-SG 3.43Å; C886-C959 WeakPolarHBondContact SG-CB 3.47Å; C886-C959 CovalentContact SG-SG 2.03Å; C886-C959 PolarHBondContact SG-SG 3.26Å
887	S	85.6	Confident	80.4	Confident	62 Å²	62	75.1 Å²	75.1	43%	0.434	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-103	148.1	172.5	55.6	0	0	0	0	111.2	F957 Q958	S887-F957 CarbonylContact O-C 3.57Å; S887-F957 WeakPolarHBondContact O-CA 3.24Å; S887-Q958 PolarHBondContact N-O 2.99Å; S887-Q958 PolarHBondContact O-N 2.77Å
888	P	82.6	Confident	80	Confident	53 Å²	53	75.2 Å²	75.2	34%	0.344	42%	0.417	S	S	.	.	P	Polyproline II helix	cis	-79.8	130.8	-10.9	32.2	-31.9	0	0	0	111.7	E890 A891 V955 L956	P888-E890 VanDerWaalsContact C-N 3.3Å; P888-E890 PolarHBondContact O-N 2.8Å; P888-A891 HydrophobicContact CG-CB 4.01Å; P888-A891 PolarHBondContact O-N 2.99Å; P888-V955 HydrophobicContact CG-CG1 3.66Å; P888-L956 WeakPolarHBondContact CD-O 2.84Å
889	A	78.7	Confident	79.2	Confident	71 Å²	71	76.9 Å²	76.9	59%	0.587	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-68.9	-28.5	179.6	0	0	0	0	0	113.1	A891 V892	A889-A891 PolarHBondContact O-N 2.73Å; A889-V892 PolarHBondContact O-N 3.08Å; A889-V892 VanDerWaalsContact O-N 3.13Å
890	E	81.3	Confident	77.9	Confident	175 Å²	175	76.9 Å²	76.9	82%	0.818	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.1	179	-65.2	167.2	-165.9	0	0	113.4	P888 V892	P888-E890 VanDerWaalsContact C-N 3.3Å; P888-E890 PolarHBondContact O-N 2.8Å; E890-V892 VanDerWaalsContact C-N 3.27Å; E890-V892 PolarHBondContact O-N 2.77Å
891	A	81.8	Confident	77	Confident	21 Å²	21	78.9 Å²	78.9	17%	0.174	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-80.2	-3.2	177.1	0	0	0	0	0	113.7	P873 P888 A889 V955 F957	P873-A891 WeakPolarHBondContact CG-O 3.3Å; P888-A891 HydrophobicContact CG-CB 4.01Å; P888-A891 PolarHBondContact O-N 2.99Å; A889-A891 PolarHBondContact O-N 2.73Å; A891-V955 HydrophobicContact CB-CG1 3.92Å; A891-F957 HydrophobicContact CB-CE1 3.96Å; A891-F957 HydrophobicContact CB-CZ 3.99Å
892	V	83.9	Confident	75.4	Confident	39 Å²	39	82.5 Å²	82.5	24%	0.236	48%	0.479	C	S	.	.	S	Bend	trans	-99.2	122.7	177.1	-174.6	0	0	0	0	109.8	L876 A889 E890 F957	L876-V892 HydrophobicContact CB-CG1 4.39Å; L876-V892 HydrophobicContact CB-CG2 4.3Å; A889-V892 PolarHBondContact O-N 3.08Å; A889-V892 VanDerWaalsContact O-N 3.13Å; E890-V892 VanDerWaalsContact C-N 3.27Å; E890-V892 PolarHBondContact O-N 2.77Å; V892-F957 HydrophobicContact CG2-CE1 3.73Å; V892-F957 HydrophobicContact CG2-CZ 3.92Å
893	N	85.3	Confident	73.8	Confident	32 Å²	32	81.2 Å²	81.2	17%	0.171	48%	0.478	C	S	.	.	S	Bend	trans	48.9	51.9	-174.5	-160.7	15.3	0	0	0	114.9	Y872 P873 L895 N896 L897	Y872-N893 WeakPolarHBondContact CE1-OD1 3.42Å; Y872-N893 WeakPolarHBondContact OH-CA 3.41Å; Y872-N893 PolarHBondContact OH-OD1 3.08Å; P873-N893 WeakPolarHBondContact O-CA 3.4Å; P873-N893 PolarHBondContact O-N 3.34Å; N893-L895 PolarHBondContact O-N 2.92Å; N893-L895 VanDerWaalsContact O-N 3.1Å; N893-N896 PolarHBondContact O-N 2.72Å; N893-L897 PolarHBondContact ND2-O 2.86Å; N893-L897 PolarHBondContact OD1-N 2.69Å; N893-L897 VanDerWaalsContact OD1-N 3.17Å
894	P	82.6	Confident	71.9	Confident	54 Å²	54	81 Å²	81	35%	0.351	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.6	-173.9	23.2	-33.7	0	0	0	114.6	W869 Y872 N896	W869-P894 HydrophobicContact CH2-CG 3.64Å; W869-P894 HydrophobicContact CZ3-CG 4.18Å; Y872-P894 HydrophobicContact CE2-CG 3.91Å; P894-N896 VanDerWaalsContact C-N 3.34Å
895	L	82.4	Confident	69.6	Low	56 Å²	56	88.6 Å²	88.6	29%	0.293	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	1.1	175.7	-55.8	173.7	0	0	0	113.5	E822 Y872 N893 L897 W977	E822-L895 HydrophobicContact CG-CD1 4.03Å; E822-L895 HydrophobicContact CG-CD2 4.26Å; Y872-L895 HydrophobicContact CE2-CB 4.27Å; Y872-L895 HydrophobicContact CE2-CD1 3.82Å; Y872-L895 HydrophobicContact CE2-CG 3.91Å; Y872-L895 WeakPolarHBondContact OH-CB 3.34Å; Y872-L895 PolarHBondContact OH-N 3.16Å; N893-L895 PolarHBondContact O-N 2.92Å; N893-L895 VanDerWaalsContact O-N 3.1Å; L895-L897 HydrophobicContact CB-CD1 3.93Å; L895-L897 HydrophobicContact CB-CG 3.92Å; L895-L897 HydrophobicContact CD1-CD1 4.19Å; L895-L897 PolarHBondContact O-N 2.91Å; L895-W977 HydrophobicContact CD1-CH2 3.66Å; L895-W977 HydrophobicContact CD1-CZ3 3.89Å
896	N	82.2	Confident	67.3	Low	134 Å²	134	84 Å²	84	72%	0.717	51%	0.507	S	S	*	.			trans	52.8	33.4	178.9	-70.5	-72.6	0	0	0	115.1	N893 P894	N893-N896 PolarHBondContact O-N 2.72Å; P894-N896 VanDerWaalsContact C-N 3.34Å
897	L	81.9	Confident	64.8	Low	17 Å²	17	90.3 Å²	90.3	9%	0.089	55%	0.545	C	S	.	.			trans	-76	144.7	-177.8	-64.7	167.7	0	0	0	111.4	M825 L828 I831 N893 L895	M825-L897 HydrophobicContact CB-CD1 4.44Å; L828-L897 HydrophobicContact CD2-CB 3.76Å; L828-L897 HydrophobicContact CG-CB 3.91Å; I831-L897 HydrophobicContact CD1-CD1 3.84Å; I831-L897 HydrophobicContact CG1-CD1 4.24Å; N893-L897 PolarHBondContact ND2-O 2.86Å; N893-L897 PolarHBondContact OD1-N 2.69Å; N893-L897 VanDerWaalsContact OD1-N 3.17Å; L895-L897 HydrophobicContact CB-CD1 3.93Å; L895-L897 HydrophobicContact CB-CG 3.92Å; L895-L897 HydrophobicContact CD1-CD1 4.19Å; L895-L897 PolarHBondContact O-N 2.91Å
898	Q	78.6	Confident	62	Low	159 Å²	159	90.9 Å²	90.9	74%	0.743	56%	0.561	S	S	*	*			trans	-109.1	163.2	177	-61	-162.7	11.4	0	0	111.9	S827 L828	S827-Q898 WeakPolarHBondContact CA-O 3.15Å; S827-Q898 WeakPolarHBondContact CB-O 3.4Å; L828-Q898 PolarHBondContact N-O 2.66Å
899	S	69.1	Low	59.5	Low	52 Å²	52	100.3 Å²	100.3	36%	0.364	59%	0.59	S	S	.	*			trans	-101.8	137.8	176.4	-175	0	0	0	0	111	E829 S901	E829-S899 WeakPolarHBondContact OE1-CA 3.19Å; E829-S899 WeakPolarHBondContact OE1-CB 3.18Å; E829-S899 PolarHBondContact OE1-OG 3.27Å; S899-S901 VanDerWaalsContact C-N 3.31Å; S899-S901 PolarHBondContact O-N 3.5Å
900	S	55.4	Low	57.1	Low	91 Å²	91	103 Å²	103	64%	0.636	60%	0.604	S	S	*	*	S	Bend	trans	-75.8	-6.6	-171	48.1	0	0	0	0	115.8	E829 A902	E829-S900 PolarHBondContact OE2-N 2.98Å; E829-S900 VanDerWaalsContact OE2-N 3.16Å; E829-S900 PolarHBondContact OE2-OG 3.03Å; S900-A902 VanDerWaalsContact C-N 3.34Å; S900-A902 PolarHBondContact O-N 3.41Å
901	S	51.9	Low	54.6	Low	107 Å²	107	105.7 Å²	105.7	75%	0.748	61%	0.607	S	S	*	*			trans	-91.8	45.5	-174.8	64.3	0	0	0	0	114.5	S899	S899-S901 VanDerWaalsContact C-N 3.31Å; S899-S901 PolarHBondContact O-N 3.5Å
902	A	41.5	Very low	52	Low	97 Å²	97	116.2 Å²	116.2	80%	0.802	64%	0.642	S	S	*	*			trans	-121.2	45.7	177.5	0	0	0	0	0	112.7	S900	S900-A902 VanDerWaalsContact C-N 3.34Å; S900-A902 PolarHBondContact O-N 3.41Å
903	A	31.4	Very low	49.3	Very low	86 Å²	86	118.7 Å²	118.7	71%	0.711	66%	0.661	S	S	*	*			trans	-142.8	126.4	175.5	0	0	0	0	0	112.9
904	N	30.6	Very low	46.5	Very low	146 Å²	146	125.7 Å²	125.7	78%	0.781	69%	0.692	S	S	*	*			trans	72.7	112.7	166.4	-71.3	-22.4	0	0	0	121.4
905	Q	30.1	Very low	44.4	Very low	175 Å²	175	127.6 Å²	127.6	82%	0.818	71%	0.705	S	S	*	*			trans	75.7	150.8	133.6	-68	-170.3	7.4	0	0	119.8
906	V	31.7	Very low	41.7	Very low	127 Å²	127	133.3 Å²	133.3	77%	0.77	73%	0.73	S	S	*	*			cis	-157.4	159.4	-28.7	120.4	0	0	0	0	106.8	G908	V906-G908 PolarHBondContact O-N 3.39Å
907	V	32	Very low	39	Very low	143 Å²	143	135.4 Å²	135.4	87%	0.867	74%	0.736	S	S	*	*			trans	-59.7	125.4	179.6	177.3	0	0	0	0	112.6
908	G	27.8	Very low	36.3	Very low	74 Å²	74	143.1 Å²	143.1	76%	0.763	77%	0.771	S	S	*	*			trans	-156.9	93.6	173	0	0	0	0	0	113.1	V906	V906-G908 PolarHBondContact O-N 3.39Å
909	R	29.5	Very low	33.9	Very low	251 Å²	251	142.1 Å²	142.1	95%	0.947	77%	0.771	S	S	*	*			trans	-75.2	131	172.8	-83.6	176	166.4	157.7	-5	110.9
910	S	27.7	Very low	31.8	Very low	128 Å²	128	147.2 Å²	147.2	90%	0.895	79%	0.789	S	S	*	*			trans	-144.6	152	144.5	-166.1	0	0	0	0	110.7
911	R	28.7	Very low	30.5	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	79%	0.794	S	S	*	*			trans	-146.4	118.8	-162.7	178.1	-168.3	-170.4	-170.4	4.7	109
912	R	28.8	Very low	29.1	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	80%	0.795	S	S	*	*			trans	173.7	145.3	162.8	-98.8	157	-176.7	-170.8	1.5	108
913	S	26.6	Very low	28.4	Very low	91 Å²	91	151.2 Å²	151.2	64%	0.636	79%	0.789	S	S	*	*			cis	157.1	109.6	-33.4	49.8	0	0	0	0	107.8
914	H	25.5	Very low	28.1	Very low	178 Å²	178	156.4 Å²	156.4	82%	0.824	80%	0.795	S	S	*	*			trans	55.9	172.3	159.2	-76.4	-69.5	0	0	0	119.4
915	P	38.8	Very low	27.9	Very low	95 Å²	95	153.5 Å²	153.5	62%	0.617	80%	0.8	S	S	*	*			cis	-115.9	170.7	-7	9.2	17.7	0	0	0	113.4
916	E	25.5	Very low	27.7	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	79%	0.793	S	S	*	*				56.3	142.9	102	-46.8	164.7	150.4	0	0	113.6
917	E	25.1	Very low	27.4	Very low	178 Å²	178	150.8 Å²	150.8	83%	0.832	80%	0.795	S	S	*	*			cis	-136.5	149.7	31.9	-71.9	163.5	145.5	0	0	110
918	E	26.3	Very low	27.2	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	79%	0.791	S	S	*	*				69.2	108.7	73.1	-142.5	179.8	-135.3	0	0	115.4
919	D	27.9	Very low	27.1	Very low	138 Å²	138	149.8 Å²	149.8	74%	0.738	79%	0.786	S	S	*	*			trans	-165.9	107.6	147.8	-116.3	-5.3	0	0	0	108.2
920	Q	25.8	Very low	26.9	Very low	158 Å²	158	144.1 Å²	144.1	74%	0.738	78%	0.78	S	S	*	*				82.1	100.8	89.8	-78.3	-166.9	70.7	0	0	116.4
921	V	27	Very low	27	Very low	123 Å²	123	144.3 Å²	144.3	75%	0.745	78%	0.776	S	S	*	*				44.8	153.5	125.4	-166.6	0	0	0	0	120.5
922	L	23.8	Very low	27.6	Very low	148 Å²	148	139 Å²	139	78%	0.775	77%	0.771	S	S	*	*			trans	82.4	134.5	179.1	-60.6	102.3	0	0	0	113.3
923	T	25.6	Very low	27.6	Very low	109 Å²	109	131.6 Å²	131.6	67%	0.669	76%	0.762	S	S	*	*			cis	-158.5	157	12.7	-6.7	0	0	0	0	113.6
924	K	26	Very low	28.1	Very low	194 Å²	194	134.2 Å²	134.2	84%	0.843	77%	0.774	S	S	*	*			trans	35.5	121.5	145.4	-76.9	171.5	177.6	-175.6	0	120
925	G	25.9	Very low	28.3	Very low	86 Å²	86	130.3 Å²	130.3	89%	0.887	77%	0.772	S	S	*	*			trans	-130.8	95	146.7	0	0	0	0	0	110
926	S	25.9	Very low	28.2	Very low	94 Å²	94	130.2 Å²	130.2	66%	0.657	78%	0.779	S	S	*	*			trans	-105.6	134.5	168	54.1	0	0	0	0	109.2
927	D	25	Very low	28.6	Very low	151 Å²	151	126.9 Å²	126.9	81%	0.807	78%	0.776	S	S	*	*			trans	43.8	154.4	149.3	-65.6	-42.4	0	0	0	123.1
928	V	27.2	Very low	29.3	Very low	132 Å²	132	127.3 Å²	127.3	80%	0.8	78%	0.777	S	S	*	*			trans	73.7	120.1	170.3	-156.1	0	0	0	0	111.8
929	G	25.5	Very low	30	Very low	64 Å²	64	129.2 Å²	129.2	66%	0.66	78%	0.777	S	S	*	*				69.2	127.6	72.3	0	0	0	0	0	108.7
930	T	27.1	Very low	31	Very low	131 Å²	131	133 Å²	133	80%	0.804	78%	0.781	S	S	*	*			cis	-170	157.2	45.3	-18.1	0	0	0	0	107.8
931	T	29	Very low	32.4	Very low	133 Å²	133	132.4 Å²	132.4	82%	0.816	78%	0.776	S	S	*	*			trans	-95.2	147.7	145	56.3	0	0	0	0	107.1
932	P	40.9	Very low	34.2	Very low	118 Å²	118	130.9 Å²	130.9	77%	0.766	77%	0.771	S	S	*	*				-149.7	165	85.3	38.3	-19.9	0	0	0	117
933	A	28.9	Very low	37	Very low	88 Å²	88	127.1 Å²	127.1	73%	0.727	75%	0.751	S	S	*	*			trans	70.3	109.3	145.3	0	0	0	0	0	122.4
934	V	36.4	Very low	39.8	Very low	146 Å²	146	125.9 Å²	125.9	89%	0.885	74%	0.737	S	S	*	*				47.1	108.3	122.2	-172.1	0	0	0	0	119.8
935	A	31.3	Very low	42.6	Very low	96 Å²	96	116.9 Å²	116.9	79%	0.793	70%	0.697	S	S	*	*			trans	-164.1	148.8	131.4	0	0	0	0	0	111.3
936	A	36.7	Very low	45.5	Very low	92 Å²	92	113 Å²	113	76%	0.76	66%	0.656	S	S	*	*			trans	6	118.6	169.3	0	0	0	0	0	118.3
937	S	33.7	Very low	48.3	Very low	107 Å²	107	109.4 Å²	109.4	75%	0.748	63%	0.631	S	S	*	*			cis	59.1	56.5	27.7	-146.6	0	0	0	0	115.7
938	E	39.3	Very low	51.1	Low	186 Å²	186	107.6 Å²	107.6	87%	0.869	62%	0.621	S	S	*	*			trans	-91.2	122.4	137.2	-74.5	-163.2	148.3	0	0	108.9	R940	E938-R940 PolarHBondContact O-N 3.38Å
939	R	40.9	Very low	53.6	Low	220 Å²	220	107 Å²	107	83%	0.83	61%	0.613	S	S	*	*			trans	-71.5	95.1	-169.1	-72.6	172	167.3	165.6	-6.8	112	K941	R939-K941 PolarHBondContact O-N 3.22Å
940	R	48.8	Very low	56.1	Low	218 Å²	218	106.4 Å²	106.4	82%	0.823	61%	0.607	S	S	*	*			trans	-59.9	103.5	146.6	-73.2	-175.1	-176.2	177.8	1.5	107.4	E938 S942 S989	E938-R940 PolarHBondContact O-N 3.38Å; R940-S942 PolarHBondContact O-N 2.86Å; R940-S989 WeakPolarHBondContact CA-OG 3.49Å; R940-S989 WeakPolarHBondContact CB-OG 3.34Å
941	K	55.3	Low	58.8	Low	144 Å²	144	101.7 Å²	101.7	63%	0.626	58%	0.579	S	S	*	*			trans	-68.3	101.4	173.6	-71.4	-179.4	-178.9	175.3	0	107.5	R939 V988 S989	R939-K941 PolarHBondContact O-N 3.22Å; K941-V988 WeakPolarHBondContact O-CG1 3.16Å; K941-S989 PolarHBondContact N-OG 3.11Å; K941-S989 PolarHBondContact O-N 3.43Å; K941-S989 PolarHBondContact O-OG 3.13Å
942	S	65.6	Low	61.5	Low	92 Å²	92	95.6 Å²	95.6	64%	0.643	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.6	160.9	50	0	0	0	0	109.1	R940 A990	R940-S942 PolarHBondContact O-N 2.86Å; S942-A990 VanDerWaalsContact CA-O 3.25Å; S942-A990 WeakPolarHBondContact CA-O 3.35Å
943	L	81.4	Confident	63.7	Low	69 Å²	69	96.3 Å²	96.3	36%	0.361	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.6	176.9	-175.2	64.9	0	0	0	109.9	L945 F985 V988 A990 L991 E992	L943-L945 HydrophobicContact CD2-CD2 4.31Å; L943-L945 HydrophobicContact CG-CD2 4.45Å; L943-F985 HydrophobicContact CD2-CD1 3.89Å; L943-F985 HydrophobicContact CD2-CE1 3.37Å; L943-F985 HydrophobicContact CD2-CZ 4.02Å; L943-V988 HydrophobicContact CB-CG1 4.11Å; L943-A990 PolarHBondContact N-O 2.69Å; L943-A990 VanDerWaalsContact N-O 3.1Å; L943-L991 HydrophobicContact CB-CD2 4.34Å; L943-L991 HydrophobicContact CB-CG 4.35Å; L943-L991 HydrophobicContact CD2-CD2 4.23Å; L943-L991 CarbonylContact O-C 3.48Å; L943-L991 WeakPolarHBondContact O-CA 3.12Å; L943-E992 PolarHBondContact O-N 2.69Å
944	K	84.2	Confident	66.6	Low	83 Å²	83	94.3 Å²	94.3	36%	0.361	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.5	179.5	-166.4	173.2	-170.9	119.3	0	111	S951 E992	K944-S951 PolarHBondContact O-OG 2.81Å; K944-E992 CarbonylContact C-O 3.35Å; K944-E992 WeakPolarHBondContact CA-O 3.29Å; K944-E992 WeakPolarHBondContact CD-OE2 3.07Å; K944-E992 WeakPolarHBondContact CE-OE2 3.49Å; K944-E992 HydrophobicContact CG-CB 4.46Å; K944-E992 IonicContact NZ-OE1 3.7Å; K944-E992 PolarHBondContact NZ-OE1 2.89Å; K944-E992 IonicContact NZ-OE2 3.84Å; K944-E992 PolarHBondContact NZ-OE2 3.45Å
945	L	85.9	Confident	69.1	Low	4 Å²	4	89.3 Å²	89.3	2%	0.021	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.2	177.5	-61.2	177.9	0	0	0	108.4	L864 L870 L943 S951 F981 F985 L991 E992 L993 L994	L864-L945 HydrophobicContact CD2-CD1 4.44Å; L864-L945 HydrophobicContact CD2-CD2 4.09Å; L870-L945 HydrophobicContact CD2-CD1 3.91Å; L943-L945 HydrophobicContact CD2-CD2 4.31Å; L943-L945 HydrophobicContact CG-CD2 4.45Å; L945-S951 WeakPolarHBondContact CA-OG 3.43Å; L945-F981 HydrophobicContact CD1-CE1 4.46Å; L945-F985 HydrophobicContact CD1-CE2 4.46Å; L945-L991 HydrophobicContact CD1-CD2 4.07Å; L945-E992 PolarHBondContact N-O 2.77Å; L945-L993 HydrophobicContact CB-CD1 3.51Å; L945-L993 HydrophobicContact CD1-CD1 4.28Å; L945-L994 PolarHBondContact O-N 3.11Å
946	D	86.1	Confident	71.9	Confident	4 Å²	4	89 Å²	89	2%	0.021	46%	0.464	C	S	.	.			trans	-143.4	137.3	-179.4	-174.9	-8.8	0	0	0	109.2	L948 L949 G950 S951 L994 R996	D946-L948 VanDerWaalsContact C-N 3.32Å; D946-L948 PolarHBondContact O-N 3.03Å; D946-L948 PolarHBondContact OD1-N 2.84Å; D946-L949 HydrophobicContact CB-CB 4.23Å; D946-L949 HydrophobicContact CB-CD1 3.99Å; D946-L949 HydrophobicContact CB-CG 4.03Å; D946-L949 PolarHBondContact O-N 2.86Å; D946-G950 PolarHBondContact O-N 3.14Å; D946-S951 PolarHBondContact N-OG 3.44Å; D946-S951 PolarHBondContact O-N 3.08Å; D946-S951 PolarHBondContact O-OG 2.92Å; D946-L994 HydrophobicContact CB-CB 4.28Å; D946-L994 HydrophobicContact CB-CD1 4.45Å; D946-R996 IonicContact OD1-CZ 3.33Å; D946-R996 IonicContact OD1-NE 2.74Å; D946-R996 PolarHBondContact OD1-NE 3.09Å; D946-R996 IonicContact OD2-CZ 2.7Å; D946-R996 IonicContact OD2-NE 3.51Å; D946-R996 PolarHBondContact OD2-NE 3.49Å; D946-R996 VanDerWaalsContact OD2-NE 3.14Å; D946-R996 IonicContact OD2-NH2 3.47Å; D946-R996 PolarHBondContact OD2-NH2 2.88Å
947	C	85.9	Confident	74.5	Confident	19 Å²	19	84.7 Å²	84.7	13%	0.128	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-56.9	-42	175	-54.2	0	0	0	0	112.9	M859 L949 G950 C954	M859-C947 HydrophobicContact CE-CB 3.43Å; M859-C947 VanDerWaalsContact CE-CB 3.43Å; C947-L949 VanDerWaalsContact C-N 3.28Å; C947-L949 PolarHBondContact O-N 3.07Å; C947-G950 PolarHBondContact O-N 3.34Å; C947-C954 WeakPolarHBondContact CA-SG 3.35Å; C947-C954 HydrophobicContact CB-CB 3.71Å; C947-C954 WeakPolarHBondContact CB-SG 3Å; C947-C954 WeakPolarHBondContact SG-CB 3.39Å; C947-C954 CovalentContact SG-SG 2.02Å; C947-C954 PolarHBondContact SG-SG 2.84Å
948	L	83.4	Confident	77.1	Confident	114 Å²	114	82.6 Å²	82.6	60%	0.597	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-72.8	-22.3	-177.7	-68.8	-177.6	0	0	0	113	M859 D946 G950	M859-L948 HydrophobicContact CE-CD2 3.63Å; M859-L948 HydrophobicContact CE-CG 3.96Å; M859-L948 HydrophobicContact SD-CD2 4.36Å; D946-L948 VanDerWaalsContact C-N 3.32Å; D946-L948 PolarHBondContact O-N 3.03Å; D946-L948 PolarHBondContact OD1-N 2.84Å; L948-G950 VanDerWaalsContact C-N 3.31Å
949	L	79.4	Confident	79.4	Confident	119 Å²	119	73.7 Å²	73.7	62%	0.623	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-87.7	-0.5	176	-62.1	178.1	0	0	0	112.6	D946 C947 S951	D946-L949 HydrophobicContact CB-CB 4.23Å; D946-L949 HydrophobicContact CB-CD1 3.99Å; D946-L949 HydrophobicContact CB-CG 4.03Å; D946-L949 PolarHBondContact O-N 2.86Å; C947-L949 VanDerWaalsContact C-N 3.28Å; C947-L949 PolarHBondContact O-N 3.07Å; L949-S951 PolarHBondContact O-N 2.76Å; L949-S951 VanDerWaalsContact O-N 3.17Å
950	G	77.6	Confident	81.6	Confident	52 Å²	52	64.3 Å²	64.3	54%	0.536	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	5.1	-176.1	0	0	0	0	0	114.6	P865 D946 C947 L948 A952	P865-G950 WeakPolarHBondContact CG-O 3.43Å; D946-G950 PolarHBondContact O-N 3.14Å; C947-G950 PolarHBondContact O-N 3.34Å; L948-G950 VanDerWaalsContact C-N 3.31Å; G950-A952 VanDerWaalsContact C-N 3.29Å; G950-A952 PolarHBondContact O-N 3.46Å
951	S	83.1	Confident	83.2	Confident	31 Å²	31	54.3 Å²	54.3	22%	0.217	30%	0.295	C	S	.	.	S	Bend	trans	-80.5	-9.1	-179.2	55.5	0	0	0	0	113.8	P865 K944 L945 D946 L949	P865-S951 VanDerWaalsContact CD-O 3.31Å; P865-S951 WeakPolarHBondContact CD-O 3.43Å; K944-S951 PolarHBondContact O-OG 2.81Å; L945-S951 WeakPolarHBondContact CA-OG 3.43Å; D946-S951 PolarHBondContact N-OG 3.44Å; D946-S951 PolarHBondContact O-N 3.08Å; D946-S951 PolarHBondContact O-OG 2.92Å; L949-S951 PolarHBondContact O-N 2.76Å; L949-S951 VanDerWaalsContact O-N 3.17Å
952	A	86	Confident	83.9	Confident	5 Å²	5	53.2 Å²	53.2	4%	0.041	29%	0.292	C	S	.	.	S	Bend	trans	-137.8	144.3	166.8	0	0	0	0	0	110.1	P861 E863 L870 G950	P861-A952 HydrophobicContact CB-CB 3.97Å; E863-A952 CarbonylContact O-C 3.18Å; L870-A952 HydrophobicContact CD1-CB 3.69Å; G950-A952 VanDerWaalsContact C-N 3.29Å; G950-A952 PolarHBondContact O-N 3.46Å
953	R	88.3	Confident	84	Confident	134 Å²	134	51.6 Å²	51.6	51%	0.506	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	127.6	168.3	-66.4	179	177.8	-172.4	3.3	108.7	V862 E863 P865	V862-R953 PolarHBondContact N-O 3.05Å; E863-R953 HydrophobicContact CB-CB 4.14Å; E863-R953 PolarHBondContact N-O 2.97Å; E863-R953 PolarHBondContact O-N 3.26Å; E863-R953 IonicContact OE2-NH1 2.65Å; P865-R953 PolarHBondContact O-NE 3.01Å; P865-R953 PolarHBondContact O-NH2 3.45Å
954	C	89.2	Confident	83.5	Confident	46 Å²	46	48.6 Å²	48.6	31%	0.311	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.6	-170.2	-57.3	0	0	0	0	112.8	W860 P861 C947	W860-C954 CarbonylContact O-C 3.59Å; W860-C954 WeakPolarHBondContact O-CA 3.44Å; W860-C954 VanDerWaalsContact O-CB 3.26Å; W860-C954 WeakPolarHBondContact O-CB 3.25Å; P861-C954 WeakPolarHBondContact CA-SG 3.24Å; C947-C954 WeakPolarHBondContact CA-SG 3.35Å; C947-C954 HydrophobicContact CB-CB 3.71Å; C947-C954 WeakPolarHBondContact CB-SG 3Å; C947-C954 WeakPolarHBondContact SG-CB 3.39Å; C947-C954 CovalentContact SG-SG 2.02Å; C947-C954 PolarHBondContact SG-SG 2.84Å
955	V	90.1	Very high	82.8	Confident	41 Å²	41	48.4 Å²	48.4	25%	0.248	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	137.4	170.1	173.4	0	0	0	0	108.4	W860 V862 P888 A891	W860-V955 PolarHBondContact N-O 2.77Å; W860-V955 PolarHBondContact O-N 2.99Å; V862-V955 HydrophobicContact CG2-CB 3.99Å; V862-V955 HydrophobicContact CG2-CG2 3.67Å; P888-V955 HydrophobicContact CG-CG1 3.66Å; A891-V955 HydrophobicContact CB-CG1 3.92Å
956	L	90.1	Very high	82.4	Confident	89 Å²	89	50 Å²	50	47%	0.466	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.8	174.1	-171.4	73.6	0	0	0	109.1	N857 I858 M859 P888	N857-L956 HydrophobicContact CB-CD1 4.08Å; I858-L956 CarbonylContact O-C 3.6Å; I858-L956 WeakPolarHBondContact O-CA 3.37Å; M859-L956 HydrophobicContact CG-CD1 3.75Å; P888-L956 WeakPolarHBondContact CD-O 2.84Å
957	F	90.1	Very high	82.2	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114	167.1	-71.7	-63.2	0	0	0	109.4	N857 I858 W860 S887 A891 V892	N857-F957 CarbonylContact C-O 3.6Å; N857-F957 WeakPolarHBondContact CA-O 3.39Å; I858-F957 HydrophobicContact CB-CB 4.36Å; I858-F957 PolarHBondContact N-O 3Å; I858-F957 PolarHBondContact O-N 2.91Å; W860-F957 HydrophobicContact CB-CD2 3.72Å; W860-F957 HydrophobicContact CB-CE2 3.71Å; W860-F957 HydrophobicContact CD2-CE2 4.21Å; W860-F957 HydrophobicContact CG-CD2 4.17Å; W860-F957 AromaticContact CG-CE2 3.75Å; W860-F957 HydrophobicContact CG-CE2 3.75Å; S887-F957 CarbonylContact O-C 3.57Å; S887-F957 WeakPolarHBondContact O-CA 3.24Å; A891-F957 HydrophobicContact CB-CE1 3.96Å; A891-F957 HydrophobicContact CB-CZ 3.99Å; V892-F957 HydrophobicContact CG2-CE1 3.73Å; V892-F957 HydrophobicContact CG2-CZ 3.92Å
958	Q	88.9	Confident	82.1	Confident	63 Å²	63	55.6 Å²	55.6	29%	0.294	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.1	175.6	-178.2	162.5	60.4	0	0	109.9	F855 N857 C886 S887	F855-Q958 HydrophobicContact CB-CG 4.25Å; F855-Q958 HydrophobicContact CD1-CG 3.97Å; F855-Q958 HydrophobicContact CG-CG 4.46Å; N857-Q958 PolarHBondContact OD1-NE2 2.74Å; C886-Q958 CarbonylContact C-O 3.51Å; C886-Q958 VanDerWaalsContact CA-O 3.29Å; C886-Q958 WeakPolarHBondContact CA-O 3.22Å; S887-Q958 PolarHBondContact N-O 2.99Å; S887-Q958 PolarHBondContact O-N 2.77Å
959	C	88.3	Confident	82.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	112.9	-178.3	-56.6	0	0	0	0	109.8	L856 F878 C886 L970	L856-C959 HydrophobicContact CB-CB 4.32Å; L856-C959 PolarHBondContact N-O 2.7Å; L856-C959 PolarHBondContact O-N 3.1Å; F878-C959 HydrophobicContact CE2-CB 4.17Å; C886-C959 HydrophobicContact CB-CB 4.07Å; C886-C959 WeakPolarHBondContact CB-SG 3.43Å; C886-C959 WeakPolarHBondContact SG-CB 3.47Å; C886-C959 CovalentContact SG-SG 2.03Å; C886-C959 PolarHBondContact SG-SG 3.26Å; C959-L970 VanDerWaalsContact SG-CD2 3.6Å
960	P	85.4	Confident	82.8	Confident	23 Å²	23	45.9 Å²	45.9	15%	0.149	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.5	-179.7	29.4	-34	0	0	0	111.9	F855 T884 R885 H962	F855-P960 HydrophobicContact CD1-CB 3.98Å; F855-P960 HydrophobicContact CE1-CB 3.96Å; T884-P960 HydrophobicContact CG2-CG 4.16Å; T884-P960 WeakPolarHBondContact CG2-O 3.35Å; T884-P960 PolarHBondContact OG1-O 2.64Å; R885-P960 WeakPolarHBondContact O-CD 3.1Å; P960-H962 PolarHBondContact O-N 2.99Å
961	L	82.1	Confident	83.4	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	76.3	-177.1	-57.2	-178.9	0	0	0	110.5	L841 A854 L856 F878 S963 F964 I999	L841-L961 HydrophobicContact CD1-CD1 4Å; L841-L961 HydrophobicContact CD1-CD2 3.5Å; L841-L961 VanDerWaalsContact CD1-CD2 3.5Å; L841-L961 HydrophobicContact CD1-CG 4.42Å; A854-L961 HydrophobicContact CB-CB 4.15Å; A854-L961 HydrophobicContact CB-CD1 4.35Å; A854-L961 PolarHBondContact O-N 3.32Å; L856-L961 HydrophobicContact CB-CD1 4.33Å; L856-L961 HydrophobicContact CB-CD2 4.24Å; L856-L961 HydrophobicContact CB-CG 4.42Å; F878-L961 HydrophobicContact CE2-CD2 3.94Å; F878-L961 HydrophobicContact CZ-CD2 3.65Å; L961-S963 PolarHBondContact O-N 2.81Å; L961-F964 HydrophobicContact CB-CB 4.21Å; L961-I999 HydrophobicContact CD1-CG2 4.34Å
962	H	71.4	Confident	83.8	Confident	120 Å²	120	44 Å²	44	56%	0.556	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	118.3	-177.3	-64.9	-67.3	0	0	0	111.3	Q881 P960 F964	Q881-H962 PolarHBondContact NE2-O 2.73Å; P960-H962 PolarHBondContact O-N 2.99Å; H962-F964 VanDerWaalsContact C-N 3.27Å; H962-F964 PolarHBondContact O-N 2.79Å
963	S	67.1	Low	84	Confident	58 Å²	58	46.3 Å²	46.3	41%	0.406	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	31.6	173	-41.7	0	0	0	0	115.1	Q849 L961 T965	Q849-S963 WeakPolarHBondContact CG-OG 3.45Å; Q849-S963 PolarHBondContact NE2-OG 2.91Å; L961-S963 PolarHBondContact O-N 2.81Å; S963-T965 PolarHBondContact O-N 2.83Å
964	F	71	Confident	84.1	Confident	6 Å²	6	40 Å²	40	3%	0.026	22%	0.223	C	C	.	.			trans	-67.9	125.2	-172.8	178	-122.3	0	0	0	113.5	L841 N843 L848 L961 H962 G966 A968	L841-F964 HydrophobicContact CB-CE1 3.89Å; L841-F964 HydrophobicContact CB-CE2 4.42Å; L841-F964 HydrophobicContact CB-CZ 3.64Å; N843-F964 HydrophobicContact CB-CD1 3.68Å; N843-F964 HydrophobicContact CB-CE1 3.51Å; N843-F964 HydrophobicContact CB-CZ 4.27Å; N843-F964 PolarHBondContact ND2-O 3Å; L848-F964 HydrophobicContact CD1-CB 4.37Å; L961-F964 HydrophobicContact CB-CB 4.21Å; H962-F964 VanDerWaalsContact C-N 3.27Å; H962-F964 PolarHBondContact O-N 2.79Å; F964-G966 WeakPolarHBondContact CZ-O 3.42Å; F964-A968 HydrophobicContact CD2-CB 4.12Å; F964-A968 HydrophobicContact CE2-CB 3.5Å; F964-A968 HydrophobicContact CZ-CB 4.33Å
965	T	69.8	Low	84.1	Confident	80 Å²	80	39.6 Å²	39.6	49%	0.491	22%	0.215	S	C	.	.			trans	-140.4	140.2	173.1	49.5	0	0	0	0	109.9	A847 S963	A847-T965 HydrophobicContact CB-CG2 3.47Å; A847-T965 VanDerWaalsContact CB-CG2 3.47Å; S963-T965 PolarHBondContact O-N 2.83Å
966	G	76.6	Confident	84	Confident	38 Å²	38	37.6 Å²	37.6	39%	0.392	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	81.5	-135.4	-178.4	0	0	0	0	0	111.7	S842 N843 F964	S842-G966 WeakPolarHBondContact CA-O 3.31Å; N843-G966 PolarHBondContact N-O 3.01Å; N843-G966 PolarHBondContact O-N 3.25Å; F964-G966 WeakPolarHBondContact CZ-O 3.42Å
967	Q	81.9	Confident	84	Confident	136 Å²	136	33.9 Å²	33.9	64%	0.636	18%	0.183	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.6	-173.6	-165.5	179.2	15.3	0	0	110.6	V840 L841	V840-Q967 HydrophobicContact CG1-CG 4.01Å; L841-Q967 VanDerWaalsContact O-CA 3.32Å; L841-Q967 WeakPolarHBondContact O-CA 3.18Å; L841-Q967 WeakPolarHBondContact O-CG 3.42Å
968	A	85.3	Confident	83.7	Confident	4 Å²	4	35.9 Å²	35.9	3%	0.033	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.1	174.6	0	0	0	0	0	110.5	L841 F878 F964	L841-A968 PolarHBondContact N-O 2.92Å; L841-A968 PolarHBondContact O-N 3.04Å; L841-A968 VanDerWaalsContact O-N 3.13Å; F878-A968 HydrophobicContact CE1-CB 3.82Å; F964-A968 HydrophobicContact CD2-CB 4.12Å; F964-A968 HydrophobicContact CE2-CB 3.5Å; F964-A968 HydrophobicContact CZ-CB 4.33Å
969	V	88.1	Confident	83.5	Confident	29 Å²	29	33.3 Å²	33.3	18%	0.176	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	118.8	-172.3	-173.6	0	0	0	0	110.3	E838 F839 V840 E879 K971	E838-V969 HydrophobicContact CB-CG1 4.38Å; F839-V969 CarbonylContact O-C 3.6Å; F839-V969 WeakPolarHBondContact O-CA 3.35Å; V840-V969 HydrophobicContact CG2-CG1 4.37Å; V840-V969 HydrophobicContact CG2-CG2 4.26Å; E879-V969 WeakPolarHBondContact CA-O 3.42Å; E879-V969 HydrophobicContact CB-CB 4.43Å; E879-V969 WeakPolarHBondContact CB-O 3.46Å; E879-V969 PolarHBondContact N-O 3.22Å; E879-V969 PolarHBondContact O-N 2.85Å; V969-K971 HydrophobicContact CG1-CG 4.08Å
970	L	89.1	Confident	83.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.7	172.3	177.4	66.7	0	0	0	109.1	F839 L856 I858 L876 F878 C959	F839-L970 HydrophobicContact CB-CB 4.34Å; F839-L970 PolarHBondContact N-O 2.83Å; F839-L970 PolarHBondContact O-N 2.89Å; L856-L970 HydrophobicContact CD2-CB 4.46Å; L856-L970 HydrophobicContact CD2-CD2 3.75Å; I858-L970 HydrophobicContact CD1-CD2 3.48Å; I858-L970 VanDerWaalsContact CD1-CD2 3.48Å; L876-L970 HydrophobicContact CD1-CD1 4.45Å; L876-L970 HydrophobicContact CD2-CD1 3.78Å; L876-L970 HydrophobicContact CG-CD1 3.93Å; F878-L970 HydrophobicContact CB-CD1 3.92Å; F878-L970 HydrophobicContact CD1-CB 4.22Å; F878-L970 HydrophobicContact CD2-CD1 3.99Å; F878-L970 HydrophobicContact CE1-CB 4.25Å; F878-L970 HydrophobicContact CG-CB 4.42Å; F878-L970 HydrophobicContact CG-CD1 3.9Å; C959-L970 VanDerWaalsContact SG-CD2 3.6Å
971	K	89.8	Confident	83.2	Confident	43 Å²	43	32.4 Å²	32.4	19%	0.187	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.7	178.1	-59.6	-171.8	-178.3	157.2	0	110.4	L837 E838 L876 R877 E879 V969	L837-K971 CarbonylContact O-C 3.58Å; L837-K971 WeakPolarHBondContact O-CA 3.27Å; E838-K971 HydrophobicContact CG-CD 4.43Å; E838-K971 HydrophobicContact CG-CG 4.19Å; E838-K971 WeakPolarHBondContact OE1-CE 3.49Å; E838-K971 IonicContact OE1-NZ 2.91Å; L876-K971 WeakPolarHBondContact CA-O 3.22Å; R877-K971 PolarHBondContact N-O 2.81Å; R877-K971 PolarHBondContact O-N 3.05Å; E879-K971 WeakPolarHBondContact OE1-CD 3.41Å; E879-K971 WeakPolarHBondContact OE1-CE 3.46Å; E879-K971 IonicContact OE1-NZ 3.94Å; E879-K971 PolarHBondContact OE1-NZ 2.91Å; E879-K971 VanDerWaalsContact OE2-CE 3.24Å; E879-K971 WeakPolarHBondContact OE2-CE 3.49Å; E879-K971 IonicContact OE2-NZ 3.14Å; E879-K971 PolarHBondContact OE2-NZ 2.86Å; V969-K971 HydrophobicContact CG1-CG 4.08Å
972	I	90.7	Very high	83.2	Confident	1 Å²	1	34 Å²	34	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.9	172.4	-52.6	-179.1	0	0	0	107.7	L837 F839 I858 W860 P873 L876	L837-I972 PolarHBondContact N-O 3.01Å; L837-I972 PolarHBondContact O-N 3.42Å; F839-I972 HydrophobicContact CE2-CD1 4.08Å; F839-I972 HydrophobicContact CE2-CG1 4.48Å; I858-I972 HydrophobicContact CD1-CD1 4.23Å; W860-I972 HydrophobicContact CE3-CD1 3.9Å; W860-I972 HydrophobicContact CE3-CG2 4.28Å; W860-I972 HydrophobicContact CH2-CB 4.07Å; W860-I972 HydrophobicContact CH2-CG2 3.49Å; W860-I972 VanDerWaalsContact CH2-CG2 3.49Å; W860-I972 HydrophobicContact CZ2-CG2 4.14Å; W860-I972 HydrophobicContact CZ3-CB 3.85Å; W860-I972 HydrophobicContact CZ3-CD1 3.81Å; W860-I972 HydrophobicContact CZ3-CG1 4.41Å; W860-I972 HydrophobicContact CZ3-CG2 3.59Å; P873-I972 HydrophobicContact CB-CG2 4.43Å; L876-I972 HydrophobicContact CD1-CD1 4.05Å; L876-I972 HydrophobicContact CD1-CG1 4.07Å; L876-I972 HydrophobicContact CG-CG1 4.17Å
973	H	90.5	Very high	83.6	Confident	52 Å²	52	32.8 Å²	32.8	24%	0.241	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.7	172.2	-63.8	-72.9	0	0	0	108.4	D836 A874 S875	D836-H973 IonicContact OD1-CE1 2.75Å; D836-H973 IonicContact OD1-CG 2.69Å; D836-H973 IonicContact OD1-ND1 3.32Å; D836-H973 PolarHBondContact OD1-ND1 2.84Å; D836-H973 IonicContact OD2-CE1 2.94Å; D836-H973 PolarHBondContact OD2-CE1 2.9Å; D836-H973 IonicContact OD2-ND1 2.72Å; D836-H973 PolarHBondContact OD2-ND1 3.06Å; A874-H973 WeakPolarHBondContact CA-O 3.3Å; A874-H973 PolarHBondContact N-O 3.23Å; S875-H973 PolarHBondContact N-O 2.82Å; S875-H973 VanDerWaalsContact N-O 3.07Å; S875-H973 PolarHBondContact O-N 3.04Å; S875-H973 PolarHBondContact OG-CD2 3.24Å
974	A	90.6	Very high	84.2	Confident	3 Å²	3	32.5 Å²	32.5	3%	0.025	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	170.2	-176.9	0	0	0	0	0	112.4	P834 V835 W860 Y872	P834-A974 CarbonylContact C-O 3.21Å; P834-A974 WeakPolarHBondContact CA-O 3.35Å; V835-A974 HydrophobicContact CG1-CB 4.05Å; V835-A974 PolarHBondContact N-O 2.04Å; V835-A974 WeakPolarHBondContact O-CA 3.17Å; V835-A974 PolarHBondContact O-N 2.78Å; W860-A974 HydrophobicContact CH2-CB 3.63Å; W860-A974 HydrophobicContact CZ2-CB 3.42Å; W860-A974 VanDerWaalsContact CZ2-CB 3.42Å; Y872-A974 CarbonylContact O-C 3.51Å; Y872-A974 WeakPolarHBondContact O-CA 3.35Å; Y872-A974 WeakPolarHBondContact O-CB 3.28Å
975	R	88.9	Confident	84.7	Confident	36 Å²	36	33.2 Å²	33.2	14%	0.136	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.3	173.6	-69.7	-173.5	176	-117.3	16.7	111.6	L828 E829 I831 G832 N833 P834 Y872	L828-R975 WeakPolarHBondContact O-CD 3.48Å; L828-R975 PolarHBondContact O-NE 2.99Å; L828-R975 PolarHBondContact O-NH1 2.94Å; E829-R975 IonicContact OE1-CZ 3.6Å; E829-R975 IonicContact OE1-NH2 3.97Å; E829-R975 PolarHBondContact OE1-NH2 2.87Å; I831-R975 HydrophobicContact CB-CB 4.29Å; I831-R975 HydrophobicContact CG2-CB 3.89Å; G832-R975 PolarHBondContact O-NH1 2.84Å; N833-R975 WeakPolarHBondContact O-CA 3.49Å; P834-R975 HydrophobicContact CB-CG 4.46Å; Y872-R975 PolarHBondContact N-O 2.83Å; Y872-R975 PolarHBondContact O-N 2.93Å
976	L	89.3	Confident	84.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.1	172.5	-171.4	74.5	0	0	0	110	L813 I831 G832 N833 L871 K978 F981 I1021	L813-L976 HydrophobicContact CB-CD2 4.02Å; L813-L976 HydrophobicContact CD1-CB 4.26Å; L813-L976 HydrophobicContact CD1-CD1 4.34Å; L813-L976 HydrophobicContact CD1-CD2 4.4Å; I831-L976 VanDerWaalsContact O-O 3.1Å; G832-L976 WeakPolarHBondContact CA-O 3.08Å; N833-L976 PolarHBondContact O-N 2.84Å; L871-L976 HydrophobicContact CD2-CB 4.45Å; L871-L976 HydrophobicContact CD2-CD1 3.95Å; L976-K978 PolarHBondContact O-N 3.07Å; L976-F981 HydrophobicContact CD1-CD2 4.05Å; L976-F981 HydrophobicContact CD1-CE1 4.37Å; L976-F981 HydrophobicContact CD1-CE2 3.34Å; L976-F981 HydrophobicContact CD1-CZ 3.53Å; L976-F981 HydrophobicContact CG-CD2 4.1Å; L976-F981 HydrophobicContact CG-CE2 3.86Å; L976-F981 HydrophobicContact CG-CZ 4.45Å; L976-I1021 HydrophobicContact CD1-CD1 3.68Å; L976-I1021 HydrophobicContact CD1-CG1 4.12Å; L976-I1021 HydrophobicContact CD2-CG1 4.4Å; L976-I1021 HydrophobicContact CD2-CG2 3.92Å
977	W	89	Confident	84.2	Confident	10 Å²	10	37.8 Å²	37.8	4%	0.038	20%	0.197	C	C	.	.			trans	-79.8	85.5	-178.3	-164.1	-78.6	0	0	0	111.9	E822 M825 I831 W869 L870 Y872 L895 S979 S980 F981	E822-W977 HydrophobicContact CB-CH2 4.34Å; E822-W977 HydrophobicContact CB-CZ2 4.01Å; E822-W977 HydrophobicContact CG-CH2 4.07Å; E822-W977 HydrophobicContact CG-CZ2 4.24Å; M825-W977 HydrophobicContact CE-CD2 4.19Å; M825-W977 HydrophobicContact CE-CH2 4.04Å; M825-W977 HydrophobicContact CE-CZ2 3.44Å; M825-W977 VanDerWaalsContact CE-CZ2 3.44Å; M825-W977 HydrophobicContact SD-CD2 4.48Å; M825-W977 HydrophobicContact SD-CE3 4.43Å; M825-W977 HydrophobicContact SD-CH2 3.42Å; M825-W977 WeakPolarHBondContact SD-CH2 3.29Å; M825-W977 HydrophobicContact SD-CZ2 3.49Å; M825-W977 WeakPolarHBondContact SD-CZ2 3.17Å; M825-W977 HydrophobicContact SD-CZ3 3.93Å; I831-W977 HydrophobicContact CB-CE3 4.44Å; I831-W977 HydrophobicContact CD1-CZ3 4.31Å; I831-W977 HydrophobicContact CG1-CE3 4.25Å; I831-W977 HydrophobicContact CG1-CZ3 4.09Å; I831-W977 HydrophobicContact CG2-CB 4.24Å; I831-W977 HydrophobicContact CG2-CD2 4.04Å; I831-W977 HydrophobicContact CG2-CE3 3.53Å; I831-W977 HydrophobicContact CG2-CG 4.36Å; I831-W977 HydrophobicContact CG2-CZ3 4.24Å; W869-W977 HydrophobicContact CB-CB 3.85Å; W869-W977 HydrophobicContact CB-CD2 3.41Å; W869-W977 VanDerWaalsContact CB-CD2 3.41Å; W869-W977 HydrophobicContact CB-CE3 3.67Å; W869-W977 HydrophobicContact CB-CG 3.5Å; W869-W977 HydrophobicContact CB-CZ3 4.36Å; W869-W977 AromaticContact CD1-CE2 3.8Å; W869-W977 AromaticContact CD1-CH2 3.8Å; W869-W977 AromaticContact CD1-CZ2 3.66Å; W869-W977 HydrophobicContact CD2-CE3 4.3Å; W869-W977 HydrophobicContact CD2-CZ3 4.22Å; W869-W977 AromaticContact CG-CD2 3.84Å; W869-W977 HydrophobicContact CG-CD2 3.84Å; W869-W977 AromaticContact CG-CE3 3.78Å; W869-W977 HydrophobicContact CG-CE3 3.78Å; W869-W977 HydrophobicContact CG-CG 4.42Å; W869-W977 HydrophobicContact CG-CH2 4.19Å; W869-W977 HydrophobicContact CG-CZ2 4.21Å; W869-W977 AromaticContact CG-CZ3 3.97Å; W869-W977 HydrophobicContact CG-CZ3 3.97Å; L870-W977 PolarHBondContact O-N 3.31Å; Y872-W977 HydrophobicContact CD2-CE3 4.25Å; Y872-W977 AromaticContact CD2-CZ3 3.87Å; Y872-W977 HydrophobicContact CD2-CZ3 3.87Å; Y872-W977 HydrophobicContact CE2-CZ3 4.42Å; Y872-W977 HydrophobicContact CG-CZ3 4.43Å; L895-W977 HydrophobicContact CD1-CH2 3.66Å; L895-W977 HydrophobicContact CD1-CZ3 3.89Å; W977-S979 VanDerWaalsContact C-N 3.31Å; W977-S979 PolarHBondContact O-N 2.72Å; W977-S979 VanDerWaalsContact O-N 3.16Å; W977-S980 PolarHBondContact O-N 2.93Å; W977-S980 VanDerWaalsContact O-N 3.15Å; W977-F981 WeakPolarHBondContact O-CD2 3.37Å
978	K	84.9	Confident	83.9	Confident	43 Å²	43	32.1 Å²	32.1	19%	0.187	17%	0.171	C	C	.	.	H	α-helix	trans	-53.7	-42.1	-167.7	-77.3	-179.4	-179.5	-173.3	0	113.7	F815 I831 N833 L976 S980 F981 I982	F815-K978 HydrophobicContact CB-CG 4.32Å; I831-K978 PolarHBondContact O-N 3.42Å; N833-K978 WeakPolarHBondContact ND2-CE 3.34Å; N833-K978 WeakPolarHBondContact OD1-CE 3.2Å; N833-K978 PolarHBondContact OD1-NZ 3.05Å; L976-K978 PolarHBondContact O-N 3.07Å; K978-S980 VanDerWaalsContact C-N 3.28Å; K978-S980 PolarHBondContact O-N 2.79Å; K978-F981 PolarHBondContact O-N 3.11Å; K978-F981 VanDerWaalsContact O-N 3.15Å; K978-I982 HydrophobicContact CB-CD1 4.38Å; K978-I982 WeakPolarHBondContact O-CG1 3.34Å; K978-I982 PolarHBondContact O-N 2.84Å; K978-I982 VanDerWaalsContact O-N 3.08Å
979	S	83.6	Confident	83.4	Confident	10 Å²	10	34.3 Å²	34.3	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-52.6	-42.6	-179.4	-58.2	0	0	0	0	113.1	K820 W977 F981 I982 E983	K820-S979 PolarHBondContact N-OG 2.87Å; K820-S979 VanDerWaalsContact N-OG 3.07Å; K820-S979 PolarHBondContact O-OG 2.84Å; W977-S979 VanDerWaalsContact C-N 3.31Å; W977-S979 PolarHBondContact O-N 2.72Å; W977-S979 VanDerWaalsContact O-N 3.16Å; S979-F981 PolarHBondContact O-N 3.22Å; S979-I982 PolarHBondContact O-N 2.91Å; S979-E983 WeakPolarHBondContact O-CG 3.47Å; S979-E983 PolarHBondContact O-N 2.96Å; S979-E983 VanDerWaalsContact O-N 3.08Å
980	S	83.9	Confident	83.1	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.028	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-40.1	-178.1	-53.7	0	0	0	0	112.1	W869 W977 K978 D984	W869-S980 WeakPolarHBondContact O-CB 3.27Å; W869-S980 PolarHBondContact O-OG 3.39Å; W977-S980 PolarHBondContact O-N 2.93Å; W977-S980 VanDerWaalsContact O-N 3.15Å; K978-S980 VanDerWaalsContact C-N 3.28Å; K978-S980 PolarHBondContact O-N 2.79Å; S980-D984 WeakPolarHBondContact O-CB 3.46Å; S980-D984 PolarHBondContact O-N 2.91Å
981	F	84.3	Confident	82.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-73.1	-35.1	-179.2	-69.6	-94.7	0	0	0	112	F815 L870 L945 L976 W977 K978 S979 F985 L991 I1021	F815-F981 HydrophobicContact CB-CB 4.14Å; F815-F981 HydrophobicContact CD1-CB 3.87Å; F815-F981 HydrophobicContact CD1-CG 4.44Å; F815-F981 HydrophobicContact CD2-CB 3.66Å; F815-F981 HydrophobicContact CE1-CB 4.11Å; F815-F981 HydrophobicContact CE2-CB 3.92Å; F815-F981 VanDerWaalsContact CE2-O 3.27Å; F815-F981 WeakPolarHBondContact CE2-O 3.29Å; F815-F981 HydrophobicContact CG-CB 3.62Å; F815-F981 HydrophobicContact CZ-CB 4.13Å; L870-F981 HydrophobicContact CD2-CE1 4.15Å; L870-F981 HydrophobicContact CD2-CE2 3.94Å; L870-F981 HydrophobicContact CD2-CZ 3.44Å; L870-F981 VanDerWaalsContact CD2-CZ 3.44Å; L945-F981 HydrophobicContact CD1-CE1 4.46Å; L976-F981 HydrophobicContact CD1-CD2 4.05Å; L976-F981 HydrophobicContact CD1-CE1 4.37Å; L976-F981 HydrophobicContact CD1-CE2 3.34Å; L976-F981 HydrophobicContact CD1-CZ 3.53Å; L976-F981 HydrophobicContact CG-CD2 4.1Å; L976-F981 HydrophobicContact CG-CE2 3.86Å; L976-F981 HydrophobicContact CG-CZ 4.45Å; W977-F981 WeakPolarHBondContact O-CD2 3.37Å; K978-F981 PolarHBondContact O-N 3.11Å; K978-F981 VanDerWaalsContact O-N 3.15Å; S979-F981 PolarHBondContact O-N 3.22Å; F981-F985 AromaticContact CD1-CD2 3.73Å; F981-F985 HydrophobicContact CD1-CD2 3.73Å; F981-F985 HydrophobicContact CD1-CE2 4.22Å; F981-F985 HydrophobicContact CE1-CD2 4.29Å; F981-F985 HydrophobicContact CE1-CE2 4.36Å; F981-F985 HydrophobicContact CG-CD2 4.36Å; F981-F985 CarbonylContact O-C 3.41Å; F981-F985 WeakPolarHBondContact O-CA 3.48Å; F981-F985 WeakPolarHBondContact O-CB 3.25Å; F981-F985 PolarHBondContact O-N 3.34Å; F981-F985 VanDerWaalsContact O-N 3.12Å; F981-L991 HydrophobicContact CD1-CD2 4.32Å; F981-L991 HydrophobicContact CE1-CD2 4.24Å; F981-I1021 HydrophobicContact CD1-CG2 3.96Å; F981-I1021 HydrophobicContact CE1-CD1 3.83Å; F981-I1021 HydrophobicContact CE1-CG2 4.06Å; F981-I1021 HydrophobicContact CZ-CD1 3.92Å
982	I	81.1	Confident	82.9	Confident	42 Å²	42	34 Å²	34	22%	0.215	19%	0.186	C	C	.	.	H	α-helix	trans	-64.2	-43.5	174.1	-63.9	163.5	0	0	0	110.8	F815 V819 K978 S979	F815-I982 HydrophobicContact CD2-CG1 3.88Å; V819-I982 HydrophobicContact CG2-CB 4.38Å; V819-I982 HydrophobicContact CG2-CG2 3.9Å; K978-I982 HydrophobicContact CB-CD1 4.38Å; K978-I982 WeakPolarHBondContact O-CG1 3.34Å; K978-I982 PolarHBondContact O-N 2.84Å; K978-I982 VanDerWaalsContact O-N 3.08Å; S979-I982 PolarHBondContact O-N 2.91Å
983	E	79.4	Confident	82.7	Confident	93 Å²	93	33.9 Å²	33.9	44%	0.435	19%	0.186	S	C	.	.	H	α-helix	trans	-74.6	-50.4	-178.4	-71.5	-176.2	157.4	0	0	113.9	V819 K868 S979 P986	V819-E983 HydrophobicContact CG1-CG 4.18Å; V819-E983 VanDerWaalsContact CG1-OE1 3.25Å; V819-E983 WeakPolarHBondContact CG1-OE1 3.29Å; V819-E983 HydrophobicContact CG2-CG 3.92Å; K868-E983 WeakPolarHBondContact CE-OE2 3.43Å; K868-E983 IonicContact NZ-OE2 3.62Å; K868-E983 PolarHBondContact NZ-OE2 3.33Å; S979-E983 WeakPolarHBondContact O-CG 3.47Å; S979-E983 PolarHBondContact O-N 2.96Å; S979-E983 VanDerWaalsContact O-N 3.08Å; E983-P986 WeakPolarHBondContact O-CD 3.14Å
984	D	80.8	Confident	82.7	Confident	53 Å²	53	31.8 Å²	31.8	28%	0.283	18%	0.176	S	C	.	.	H	α-helix	trans	-91.3	-21.2	-169.2	-70.8	-12.1	0	0	0	113.5	L864 N866 K868 S980	L864-D984 HydrophobicContact CD1-CB 4.4Å; L864-D984 WeakPolarHBondContact CD1-OD2 3.16Å; N866-D984 PolarHBondContact ND2-OD2 2.88Å; K868-D984 WeakPolarHBondContact CD-OD2 3.49Å; K868-D984 IonicContact NZ-OD1 2.85Å; K868-D984 PolarHBondContact NZ-OD1 3.08Å; K868-D984 IonicContact NZ-OD2 2.69Å; S980-D984 WeakPolarHBondContact O-CB 3.46Å; S980-D984 PolarHBondContact O-N 2.91Å
985	F	81.5	Confident	82.7	Confident	20 Å²	20	31.6 Å²	31.6	9%	0.088	18%	0.175	C	C	.	.			trans	-123.9	33.7	-175.4	-52.7	-56.1	0	0	0	116.6	L864 L943 L945 F981 T987 V988 L991	L864-F985 HydrophobicContact CD1-CE2 3.83Å; L864-F985 HydrophobicContact CD1-CZ 3.88Å; L864-F985 HydrophobicContact CD2-CE2 4.19Å; L864-F985 HydrophobicContact CD2-CZ 3.82Å; L943-F985 HydrophobicContact CD2-CD1 3.89Å; L943-F985 HydrophobicContact CD2-CE1 3.37Å; L943-F985 HydrophobicContact CD2-CZ 4.02Å; L945-F985 HydrophobicContact CD1-CE2 4.46Å; F981-F985 AromaticContact CD1-CD2 3.73Å; F981-F985 HydrophobicContact CD1-CD2 3.73Å; F981-F985 HydrophobicContact CD1-CE2 4.22Å; F981-F985 HydrophobicContact CE1-CD2 4.29Å; F981-F985 HydrophobicContact CE1-CE2 4.36Å; F981-F985 HydrophobicContact CG-CD2 4.36Å; F981-F985 CarbonylContact O-C 3.41Å; F981-F985 WeakPolarHBondContact O-CA 3.48Å; F981-F985 WeakPolarHBondContact O-CB 3.25Å; F981-F985 PolarHBondContact O-N 3.34Å; F981-F985 VanDerWaalsContact O-N 3.12Å; F985-T987 PolarHBondContact O-N 3.33Å; F985-V988 HydrophobicContact CB-CB 4.16Å; F985-V988 HydrophobicContact CB-CG2 3.88Å; F985-V988 HydrophobicContact CD1-CG2 4.03Å; F985-V988 HydrophobicContact CG-CG2 4.38Å; F985-V988 PolarHBondContact O-N 3.26Å; F985-L991 HydrophobicContact CB-CD1 4.19Å; F985-L991 HydrophobicContact CB-CD2 4.27Å; F985-L991 HydrophobicContact CD1-CD2 4.05Å; F985-L991 HydrophobicContact CD2-CD2 3.5Å; F985-L991 HydrophobicContact CE1-CD2 4.28Å; F985-L991 HydrophobicContact CE2-CD2 3.75Å; F985-L991 HydrophobicContact CG-CD1 4.48Å; F985-L991 HydrophobicContact CG-CD2 3.67Å; F985-L991 HydrophobicContact CZ-CD2 4.14Å
986	P	68.3	Low	82.8	Confident	91 Å²	91	32.3 Å²	32.3	59%	0.591	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.4	-175.8	28.8	-36.7	0	0	0	114.6	E983	E983-P986 WeakPolarHBondContact O-CD 3.14Å
987	T	67.2	Low	82.8	Confident	124 Å²	124	32.5 Å²	32.5	76%	0.761	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.6	9	-178.7	61.1	0	0	0	0	113.8	F985	F985-T987 PolarHBondContact O-N 3.33Å
988	V	76.4	Confident	82.9	Confident	17 Å²	17	35.6 Å²	35.6	10%	0.103	20%	0.196	C	C	.	.			trans	-99.2	124.1	-172.9	-174.9	0	0	0	0	110.4	K941 L943 F985 A990 L991	K941-V988 WeakPolarHBondContact O-CG1 3.16Å; L943-V988 HydrophobicContact CB-CG1 4.11Å; F985-V988 HydrophobicContact CB-CB 4.16Å; F985-V988 HydrophobicContact CB-CG2 3.88Å; F985-V988 HydrophobicContact CD1-CG2 4.03Å; F985-V988 HydrophobicContact CG-CG2 4.38Å; F985-V988 PolarHBondContact O-N 3.26Å; V988-A990 WeakPolarHBondContact CG1-O 3.37Å; V988-A990 PolarHBondContact O-N 2.89Å; V988-L991 HydrophobicContact CB-CD1 4.08Å; V988-L991 HydrophobicContact CG1-CD1 3.77Å; V988-L991 HydrophobicContact CG1-CG 3.86Å
989	S	74.8	Confident	83	Confident	49 Å²	49	34 Å²	34	34%	0.343	19%	0.19	S	C	.	.	S	Bend	trans	-75.4	-22.5	-174.3	47.9	0	0	0	0	114.9	R940 K941	R940-S989 WeakPolarHBondContact CA-OG 3.49Å; R940-S989 WeakPolarHBondContact CB-OG 3.34Å; K941-S989 PolarHBondContact N-OG 3.11Å; K941-S989 PolarHBondContact O-N 3.43Å; K941-S989 PolarHBondContact O-OG 3.13Å
990	A	80.9	Confident	83	Confident	14 Å²	14	35.3 Å²	35.3	12%	0.116	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	144.2	175.5	0	0	0	0	0	109.6	S942 L943 V988 Y1022	S942-A990 VanDerWaalsContact CA-O 3.25Å; S942-A990 WeakPolarHBondContact CA-O 3.35Å; L943-A990 PolarHBondContact N-O 2.69Å; L943-A990 VanDerWaalsContact N-O 3.1Å; V988-A990 WeakPolarHBondContact CG1-O 3.37Å; V988-A990 PolarHBondContact O-N 2.89Å; A990-Y1022 HydrophobicContact CB-CD1 3.8Å; A990-Y1022 HydrophobicContact CB-CE1 3.55Å
991	L	86.1	Confident	82.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.6	169	-64.4	95	0	0	0	110	F815 L943 L945 F981 F985 V988 M1020 I1021	F815-L991 HydrophobicContact CE1-CD1 4.12Å; L943-L991 HydrophobicContact CB-CD2 4.34Å; L943-L991 HydrophobicContact CB-CG 4.35Å; L943-L991 HydrophobicContact CD2-CD2 4.23Å; L943-L991 CarbonylContact O-C 3.48Å; L943-L991 WeakPolarHBondContact O-CA 3.12Å; L945-L991 HydrophobicContact CD1-CD2 4.07Å; F981-L991 HydrophobicContact CD1-CD2 4.32Å; F981-L991 HydrophobicContact CE1-CD2 4.24Å; F985-L991 HydrophobicContact CB-CD1 4.19Å; F985-L991 HydrophobicContact CB-CD2 4.27Å; F985-L991 HydrophobicContact CD1-CD2 4.05Å; F985-L991 HydrophobicContact CD2-CD2 3.5Å; F985-L991 HydrophobicContact CE1-CD2 4.28Å; F985-L991 HydrophobicContact CE2-CD2 3.75Å; F985-L991 HydrophobicContact CG-CD1 4.48Å; F985-L991 HydrophobicContact CG-CD2 3.67Å; F985-L991 HydrophobicContact CZ-CD2 4.14Å; V988-L991 HydrophobicContact CB-CD1 4.08Å; V988-L991 HydrophobicContact CG1-CD1 3.77Å; V988-L991 HydrophobicContact CG1-CG 3.86Å; L991-M1020 CarbonylContact O-C 3.6Å; L991-M1020 WeakPolarHBondContact O-CA 3.47Å; L991-I1021 HydrophobicContact CB-CB 4.22Å; L991-I1021 PolarHBondContact N-O 2.96Å; L991-I1021 PolarHBondContact O-N 2.82Å
992	E	87.8	Confident	82.2	Confident	51 Å²	51	43.6 Å²	43.6	24%	0.238	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.3	172.7	-178.6	-166.4	179.3	0	0	108	L943 K944 L945 L994 P1018 M1020	L943-E992 PolarHBondContact O-N 2.69Å; K944-E992 CarbonylContact C-O 3.35Å; K944-E992 WeakPolarHBondContact CA-O 3.29Å; K944-E992 WeakPolarHBondContact CD-OE2 3.07Å; K944-E992 WeakPolarHBondContact CE-OE2 3.49Å; K944-E992 HydrophobicContact CG-CB 4.46Å; K944-E992 IonicContact NZ-OE1 3.7Å; K944-E992 PolarHBondContact NZ-OE1 2.89Å; K944-E992 IonicContact NZ-OE2 3.84Å; K944-E992 PolarHBondContact NZ-OE2 3.45Å; L945-E992 PolarHBondContact N-O 2.77Å; E992-L994 HydrophobicContact CG-CD2 4.48Å; E992-P1018 HydrophobicContact CG-CB 4.29Å; E992-M1020 HydrophobicContact CB-CE 4.23Å; E992-M1020 HydrophobicContact CB-SD 3.85Å; E992-M1020 HydrophobicContact CG-SD 3.82Å
993	L	88.3	Confident	81.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.9	176.4	-178.2	64.3	0	0	0	109.6	P861 L871 L945 V1019 I1021	P861-L993 HydrophobicContact CB-CD1 3.9Å; P861-L993 HydrophobicContact CG-CD1 3.72Å; P861-L993 HydrophobicContact CG-CD2 4.07Å; P861-L993 HydrophobicContact CG-CG 4Å; L871-L993 HydrophobicContact CD1-CD2 3.49Å; L871-L993 VanDerWaalsContact CD1-CD2 3.49Å; L871-L993 HydrophobicContact CD2-CD2 4.39Å; L871-L993 HydrophobicContact CG-CD2 3.62Å; L945-L993 HydrophobicContact CB-CD1 3.51Å; L945-L993 HydrophobicContact CD1-CD1 4.28Å; L993-V1019 HydrophobicContact CB-CB 4.45Å; L993-V1019 PolarHBondContact N-O 3.16Å; L993-V1019 PolarHBondContact O-N 3.3Å; L993-I1021 HydrophobicContact CB-CD1 4.04Å; L993-I1021 HydrophobicContact CD2-CD1 4.19Å
994	L	89.6	Confident	80.6	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	132.1	177.5	-72.9	-168.5	0	0	0	112.3	L945 D946 E992 P1018	L945-L994 PolarHBondContact O-N 3.11Å; D946-L994 HydrophobicContact CB-CB 4.28Å; D946-L994 HydrophobicContact CB-CD1 4.45Å; E992-L994 HydrophobicContact CG-CD2 4.48Å; L994-P1018 HydrophobicContact CD2-CB 3.84Å
995	I	89.9	Confident	79.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.9	169.9	-63.6	164.2	0	0	0	107.9	L837 F839 I858 P861 L871 I1017 V1019	L837-I995 HydrophobicContact CD1-CD1 3.91Å; L837-I995 HydrophobicContact CD2-CB 4.48Å; L837-I995 HydrophobicContact CD2-CD1 3.5Å; L837-I995 VanDerWaalsContact CD2-CD1 3.5Å; L837-I995 HydrophobicContact CD2-CG2 4.42Å; L837-I995 HydrophobicContact CG-CD1 4.37Å; F839-I995 HydrophobicContact CZ-CG2 4.01Å; I858-I995 HydrophobicContact CG2-CG2 4.22Å; P861-I995 HydrophobicContact CG-CG1 4Å; L871-I995 HydrophobicContact CD1-CD1 3.8Å; I995-I1017 HydrophobicContact CB-CB 4.49Å; I995-I1017 PolarHBondContact N-O 3.09Å; I995-I1017 PolarHBondContact O-N 2.87Å; I995-V1019 HydrophobicContact CD1-CG2 4.29Å
996	R	90.8	Very high	78.7	Confident	50 Å²	50	52.3 Å²	52.3	19%	0.189	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.2	-173.3	-62.9	174.7	173	-80.2	-6.6	110.3	I858 M859 D946 Q1016	I858-R996 WeakPolarHBondContact CA-O 3.45Å; M859-R996 HydrophobicContact CB-CB 4.35Å; M859-R996 PolarHBondContact N-O 2.86Å; M859-R996 HydrophobicContact SD-CB 4.2Å; D946-R996 IonicContact OD1-CZ 3.33Å; D946-R996 IonicContact OD1-NE 2.74Å; D946-R996 PolarHBondContact OD1-NE 3.09Å; D946-R996 IonicContact OD2-CZ 2.7Å; D946-R996 IonicContact OD2-NE 3.51Å; D946-R996 PolarHBondContact OD2-NE 3.49Å; D946-R996 VanDerWaalsContact OD2-NE 3.14Å; D946-R996 IonicContact OD2-NH2 3.47Å; D946-R996 PolarHBondContact OD2-NH2 2.88Å; R996-Q1016 HydrophobicContact CG-CG 4.44Å; R996-Q1016 VanDerWaalsContact NH1-NE2 3.16Å
997	A	90.4	Very high	78.6	Confident	5 Å²	5	52.5 Å²	52.5	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	143.9	174.7	0	0	0	0	0	112.3	F839 L856 N857 I858 S1014 V1015	F839-A997 HydrophobicContact CD1-CB 3.78Å; F839-A997 HydrophobicContact CE1-CB 3.61Å; L856-A997 HydrophobicContact CD1-CB 4.19Å; N857-A997 CarbonylContact O-C 3.6Å; N857-A997 VanDerWaalsContact O-CA 3.25Å; N857-A997 WeakPolarHBondContact O-CA 3.39Å; I858-A997 HydrophobicContact CG1-CB 3.8Å; A997-S1014 CarbonylContact O-C 3.59Å; A997-S1014 WeakPolarHBondContact O-CA 3.35Å; A997-V1015 HydrophobicContact CB-CG1 3.98Å; A997-V1015 PolarHBondContact N-O 3.38Å; A997-V1015 PolarHBondContact O-N 3.05Å
998	N	90.8	Very high	78.8	Confident	74 Å²	74	48.2 Å²	48.2	40%	0.396	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	158.9	173.7	68.9	15.6	0	0	0	113	L856 N857 A1013	L856-N998 WeakPolarHBondContact CA-O 3.37Å; N857-N998 WeakPolarHBondContact CB-OD1 3.23Å; N857-N998 PolarHBondContact N-O 3Å; N857-N998 PolarHBondContact ND2-OD1 3.21Å; N857-N998 PolarHBondContact O-N 2.99Å; N998-A1013 CarbonylContact C-O 3.49Å; N998-A1013 VanDerWaalsContact CA-O 3.27Å; N998-A1013 WeakPolarHBondContact CA-O 3.22Å
999	I	87.4	Confident	78.5	Confident	10 Å²	10	50.4 Å²	50.4	5%	0.051	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.9	169.7	-54.9	172.2	0	0	0	108.2	L802 V804 L841 A854 F855 L961 A1013	L802-I999 HydrophobicContact CB-CD1 4.39Å; L802-I999 HydrophobicContact CD1-CG2 4.45Å; V804-I999 HydrophobicContact CB-CD1 3.96Å; V804-I999 HydrophobicContact CB-CG1 4.05Å; V804-I999 HydrophobicContact CG1-CD1 4.35Å; V804-I999 HydrophobicContact CG1-CG1 4.12Å; L841-I999 HydrophobicContact CD2-CD1 3.79Å; L841-I999 HydrophobicContact CD2-CG1 4.01Å; A854-I999 HydrophobicContact CB-CG2 4.5Å; F855-I999 WeakPolarHBondContact O-CA 3.47Å; L961-I999 HydrophobicContact CD1-CG2 4.34Å; I999-A1013 HydrophobicContact CB-CB 4.24Å; I999-A1013 PolarHBondContact N-O 2.72Å
1000	S	83.9	Confident	78.3	Confident	38 Å²	38	50.7 Å²	50.7	27%	0.266	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132	171.9	60.3	0	0	0	0	110.6	A854 F855 N857	A854-S1000 CarbonylContact C-O 3.56Å; A854-S1000 WeakPolarHBondContact CA-O 3.05Å; F855-S1000 PolarHBondContact N-O 2.91Å; F855-S1000 PolarHBondContact O-N 3.16Å; N857-S1000 PolarHBondContact ND2-OG 2.91Å
1001	V	79.1	Confident	77.5	Confident	30 Å²	30	57.3 Å²	57.3	18%	0.182	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.8	177.1	-176.7	0	0	0	0	110	L802 A854 L1010	L802-V1001 HydrophobicContact CD1-CG2 3.83Å; A854-V1001 HydrophobicContact CB-CG2 4.04Å; V1001-L1010 HydrophobicContact CB-CD1 4.28Å; V1001-L1010 HydrophobicContact CG2-CD1 3.93Å; V1001-L1010 HydrophobicContact CG2-CD2 4.01Å
1002	K	72.4	Confident	76.5	Confident	148 Å²	148	63.6 Å²	63.6	64%	0.643	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.2	167.6	-67.8	-177.1	178.6	177.8	0	108.6	G852 S853 F855	G852-K1002 CarbonylContact C-O 3.58Å; G852-K1002 VanDerWaalsContact CA-O 3.24Å; G852-K1002 WeakPolarHBondContact CA-O 3.47Å; S853-K1002 PolarHBondContact N-O 3.37Å; S853-K1002 PolarHBondContact O-N 3.33Å; F855-K1002 HydrophobicContact CE2-CD 4.18Å; F855-K1002 HydrophobicContact CE2-CG 4.43Å
1003	S	68.1	Low	75.9	Confident	44 Å²	44	61.9 Å²	61.9	31%	0.308	32%	0.317	S	S	.	.			trans	-127.2	158.8	-177.8	-170.8	0	0	0	0	111.4	L851 I1005	L851-S1003 WeakPolarHBondContact O-CB 3.2Å; L851-S1003 PolarHBondContact O-OG 3.15Å; S1003-I1005 VanDerWaalsContact C-N 3.34Å; S1003-I1005 PolarHBondContact OG-N 2.9Å; S1003-I1005 VanDerWaalsContact OG-N 3.13Å
1004	S	58.8	Low	75.7	Confident	116 Å²	116	66.2 Å²	66.2	81%	0.811	35%	0.347	S	S	*	.	S	Bend	trans	-79.4	-16.5	165.6	47.9	0	0	0	0	113.1
1005	I	62.7	Low	75.7	Confident	38 Å²	38	67.2 Å²	67.2	20%	0.195	35%	0.353	C	S	.	.			trans	-81.4	118.6	-179.1	-58.6	172.8	0	0	0	109.2	I798 L851 S1003 L1008	I798-I1005 HydrophobicContact CD1-CG2 4.36Å; L851-I1005 HydrophobicContact CD2-CD1 3.69Å; S1003-I1005 VanDerWaalsContact C-N 3.34Å; S1003-I1005 PolarHBondContact OG-N 2.9Å; S1003-I1005 VanDerWaalsContact OG-N 3.13Å; I1005-L1008 HydrophobicContact CB-CD1 4.43Å; I1005-L1008 HydrophobicContact CG2-CB 4.2Å
1006	K	58.2	Low	75.6	Confident	192 Å²	192	72.5 Å²	72.5	84%	0.835	38%	0.378	S	S	*	.	S	Bend	trans	-78.4	-24.4	-175.9	-65.5	-179	-178.7	175.2	0	114.6
1007	H	67.6	Low	75.5	Confident	95 Å²	95	70.5 Å²	70.5	44%	0.44	37%	0.371	S	S	.	.	S	Bend	trans	-106.9	41.5	-171.4	-56.4	-80.7	0	0	0	112.5	I798	I798-H1007 PolarHBondContact N-O 2.74Å
1008	L	70.6	Confident	75.4	Confident	34 Å²	34	73.3 Å²	73.3	18%	0.178	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.3	-173.8	-171.7	146.6	0	0	0	110.8	I798 L800 I1005 L1010	I798-L1008 WeakPolarHBondContact O-CA 3.48Å; L800-L1008 HydrophobicContact CD1-CD1 3.81Å; L800-L1008 HydrophobicContact CD1-CD2 3.96Å; L800-L1008 HydrophobicContact CD1-CG 4.24Å; L800-L1008 HydrophobicContact CG-CD1 3.96Å; L800-L1008 HydrophobicContact CG-CD2 4.09Å; L800-L1008 HydrophobicContact CG-CG 4.08Å; I1005-L1008 HydrophobicContact CB-CD1 4.43Å; I1005-L1008 HydrophobicContact CG2-CB 4.2Å; L1008-L1010 HydrophobicContact CD2-CD2 4.31Å; L1008-L1010 HydrophobicContact CD2-CG 4.15Å
1009	V	70.8	Confident	75.2	Confident	64 Å²	64	69.8 Å²	69.8	39%	0.388	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.5	-178	-180	0	0	0	0	110.6	V797 I798 L800	V797-V1009 HydrophobicContact CG1-CB 4.27Å; V797-V1009 HydrophobicContact CG1-CG2 3.64Å; I798-V1009 PolarHBondContact O-N 3.33Å; L800-V1009 PolarHBondContact N-O 3.17Å
1010	L	70.1	Confident	75.2	Confident	55 Å²	55	71.6 Å²	71.6	29%	0.288	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.3	175.6	-66.9	165.4	0	0	0	109.2	L800 L802 V1001 L1008 A1013	L800-L1010 HydrophobicContact CB-CD2 3.9Å; L800-L1010 HydrophobicContact CD1-CD2 4.49Å; L802-L1010 HydrophobicContact CB-CD2 4.23Å; L802-L1010 HydrophobicContact CD1-CD2 3.88Å; L802-L1010 HydrophobicContact CG-CD2 4.37Å; V1001-L1010 HydrophobicContact CB-CD1 4.28Å; V1001-L1010 HydrophobicContact CG2-CD1 3.93Å; V1001-L1010 HydrophobicContact CG2-CD2 4.01Å; L1008-L1010 HydrophobicContact CD2-CD2 4.31Å; L1008-L1010 HydrophobicContact CD2-CG 4.15Å; L1010-A1013 HydrophobicContact CB-CB 4.16Å
1011	R	65.1	Low	75.3	Confident	153 Å²	153	69.8 Å²	69.8	58%	0.577	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.7	168	-62.9	-173.2	-173.7	-149.6	4.9	109.5	E799 A1013	E799-R1011 IonicContact OE1-CZ 2.99Å; E799-R1011 IonicContact OE1-NE 3.73Å; E799-R1011 PolarHBondContact OE1-NE 2.83Å; E799-R1011 IonicContact OE1-NH2 3.49Å; E799-R1011 PolarHBondContact OE1-NH2 3.07Å; R1011-A1013 VanDerWaalsContact C-N 3.33Å; R1011-A1013 PolarHBondContact O-N 2.69Å
1012	D	63.9	Low	75.5	Confident	131 Å²	131	71.4 Å²	71.4	70%	0.701	37%	0.37	S	S	*	.	S	Bend	trans	63.4	24.6	172.8	-48.6	-39.2	0	0	0	117.1	S803 V804 S1014	S803-D1012 WeakPolarHBondContact CA-O 3.13Å; V804-D1012 PolarHBondContact N-O 3.27Å; D1012-S1014 PolarHBondContact O-N 3.47Å
1013	A	74.9	Confident	75.8	Confident	16 Å²	16	66.4 Å²	66.4	13%	0.132	35%	0.352	C	S	.	.			trans	-84.7	18.5	-175.5	0	0	0	0	0	116	N998 I999 L1010 R1011	N998-A1013 CarbonylContact C-O 3.49Å; N998-A1013 VanDerWaalsContact CA-O 3.27Å; N998-A1013 WeakPolarHBondContact CA-O 3.22Å; I999-A1013 HydrophobicContact CB-CB 4.24Å; I999-A1013 PolarHBondContact N-O 2.72Å; L1010-A1013 HydrophobicContact CB-CB 4.16Å; R1011-A1013 VanDerWaalsContact C-N 3.33Å; R1011-A1013 PolarHBondContact O-N 2.69Å
1014	S	85.3	Confident	76	Confident	90 Å²	90	69.8 Å²	69.8	63%	0.629	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.3	144.4	179.4	67.6	0	0	0	0	114.9	A997 D1012	A997-S1014 CarbonylContact O-C 3.59Å; A997-S1014 WeakPolarHBondContact O-CA 3.35Å; D1012-S1014 PolarHBondContact O-N 3.47Å
1015	V	89.2	Confident	76.2	Confident	28 Å²	28	72 Å²	72	17%	0.17	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.5	-179	67.7	0	0	0	0	112.7	V804 A997	V804-V1015 HydrophobicContact CG1-CG1 4.25Å; V804-V1015 HydrophobicContact CG2-CG1 4Å; A997-V1015 HydrophobicContact CB-CG1 3.98Å; A997-V1015 PolarHBondContact N-O 3.38Å; A997-V1015 PolarHBondContact O-N 3.05Å
1016	Q	88.3	Confident	75.5	Confident	112 Å²	112	77.8 Å²	77.8	52%	0.523	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.1	174.2	-54.3	-179	33.6	0	0	108.9	R996	R996-Q1016 HydrophobicContact CG-CG 4.44Å; R996-Q1016 VanDerWaalsContact NH1-NE2 3.16Å
1017	I	88.8	Confident	75.2	Confident	7 Å²	7	77.5 Å²	77.5	4%	0.036	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.7	-177.7	-48.5	172.4	0	0	0	108.6	A808 L837 F839 I995	A808-I1017 HydrophobicContact CB-CG2 3.94Å; L837-I1017 HydrophobicContact CD2-CD1 3.89Å; L837-I1017 HydrophobicContact CD2-CG2 4.14Å; F839-I1017 HydrophobicContact CD1-CD1 4.01Å; F839-I1017 HydrophobicContact CE1-CD1 3.41Å; F839-I1017 VanDerWaalsContact CE1-CD1 3.41Å; F839-I1017 HydrophobicContact CZ-CD1 3.82Å; I995-I1017 HydrophobicContact CB-CB 4.49Å; I995-I1017 PolarHBondContact N-O 3.09Å; I995-I1017 PolarHBondContact O-N 2.87Å
1018	P	87.1	Confident	73.7	Confident	65 Å²	65	77 Å²	77	42%	0.422	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.4	171.5	32.4	-31.4	0	0	0	111.5	E992 L994	E992-P1018 HydrophobicContact CG-CB 4.29Å; L994-P1018 HydrophobicContact CD2-CB 3.84Å
1019	V	87.6	Confident	72.2	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.3	170.2	-176.5	0	0	0	0	108.3	A808 L813 L993 I995	A808-V1019 HydrophobicContact CB-CG2 3.79Å; L813-V1019 HydrophobicContact CD1-CG1 3.66Å; L813-V1019 HydrophobicContact CG-CG1 4.28Å; L993-V1019 HydrophobicContact CB-CB 4.45Å; L993-V1019 PolarHBondContact N-O 3.16Å; L993-V1019 PolarHBondContact O-N 3.3Å; I995-V1019 HydrophobicContact CD1-CG2 4.29Å
1020	M	86.1	Confident	70.7	Confident	47 Å²	47	89.4 Å²	89.4	23%	0.232	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.9	-177.9	-60.6	-57.3	-61	0	0	110.6	H811 Q812 L813 L991 E992 Y1022	H811-M1020 PolarHBondContact O-N 3.35Å; Q812-M1020 CarbonylContact C-O 3.59Å; Q812-M1020 VanDerWaalsContact CA-O 3.29Å; Q812-M1020 WeakPolarHBondContact CA-O 3.29Å; Q812-M1020 HydrophobicContact CG-CB 4.33Å; L813-M1020 PolarHBondContact N-O 2.82Å; L991-M1020 CarbonylContact O-C 3.6Å; L991-M1020 WeakPolarHBondContact O-CA 3.47Å; E992-M1020 HydrophobicContact CB-CE 4.23Å; E992-M1020 HydrophobicContact CB-SD 3.85Å; E992-M1020 HydrophobicContact CG-SD 3.82Å; M1020-Y1022 HydrophobicContact CB-CE2 3.64Å
1021	I	86.6	Confident	69.5	Low	0 Å²	0	97 Å²	97	0%	0	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.7	-175.6	-62.2	153.1	0	0	0	109.3	L813 F815 L976 F981 L991 L993	L813-I1021 HydrophobicContact CB-CG1 4.17Å; L813-I1021 HydrophobicContact CD1-CG1 4.39Å; L813-I1021 CarbonylContact O-C 3.52Å; L813-I1021 VanDerWaalsContact O-CA 3.29Å; L813-I1021 WeakPolarHBondContact O-CA 3.26Å; F815-I1021 HydrophobicContact CD1-CG2 3.6Å; F815-I1021 HydrophobicContact CE1-CG2 3.97Å; L976-I1021 HydrophobicContact CD1-CD1 3.68Å; L976-I1021 HydrophobicContact CD1-CG1 4.12Å; L976-I1021 HydrophobicContact CD2-CG1 4.4Å; L976-I1021 HydrophobicContact CD2-CG2 3.92Å; F981-I1021 HydrophobicContact CD1-CG2 3.96Å; F981-I1021 HydrophobicContact CE1-CD1 3.83Å; F981-I1021 HydrophobicContact CE1-CG2 4.06Å; F981-I1021 HydrophobicContact CZ-CD1 3.92Å; L991-I1021 HydrophobicContact CB-CB 4.22Å; L991-I1021 PolarHBondContact N-O 2.96Å; L991-I1021 PolarHBondContact O-N 2.82Å; L993-I1021 HydrophobicContact CB-CD1 4.04Å; L993-I1021 HydrophobicContact CD2-CD1 4.19Å
1022	Y	82.8	Confident	68.6	Low	65 Å²	65	97.4 Å²	97.4	26%	0.255	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.4	-174.9	-56.9	-84.4	0	0	0	112.1	Q812 L813 F814 F815 A990 M1020	Q812-Y1022 HydrophobicContact CB-CE2 4.32Å; Q812-Y1022 HydrophobicContact CG-CE2 4.17Å; L813-Y1022 PolarHBondContact O-N 2.8Å; F814-Y1022 CarbonylContact C-O 3.58Å; F814-Y1022 VanDerWaalsContact CA-O 3.24Å; F814-Y1022 WeakPolarHBondContact CA-O 3.43Å; F814-Y1022 HydrophobicContact CE1-CD2 4.04Å; F814-Y1022 HydrophobicContact CE1-CG 4.22Å; F814-Y1022 HydrophobicContact CZ-CD2 4.31Å; F815-Y1022 WeakPolarHBondContact CD1-O 3.4Å; F815-Y1022 VanDerWaalsContact CE1-C 3.48Å; F815-Y1022 PolarHBondContact N-O 2.93Å; A990-Y1022 HydrophobicContact CB-CD1 3.8Å; A990-Y1022 HydrophobicContact CB-CE1 3.55Å; M1020-Y1022 HydrophobicContact CB-CE2 3.64Å
1023	P	79.1	Confident	68.5	Low	43 Å²	43	97.1 Å²	97.1	28%	0.279	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	139.3	166.7	30.1	-33.6	0	0	0	110.1	F815	F815-P1023 HydrophobicContact CE1-CB 4.18Å; F815-P1023 HydrophobicContact CE2-CB 4.14Å; F815-P1023 HydrophobicContact CZ-CB 3.82Å; F815-P1023 HydrophobicContact CZ-CG 4.48Å
1024	E	71.9	Confident	68	Low	115 Å²	115	98.9 Å²	98.9	54%	0.537	51%	0.512	S	S	.	.			trans	-79.5	125.3	172.2	-146.7	165.2	-168.9	0	0	109.3	F815 S816 D1026	F815-E1024 PolarHBondContact O-N 2.97Å; S816-E1024 VanDerWaalsContact CB-OE2 3.26Å; S816-E1024 WeakPolarHBondContact CB-OE2 3.3Å; S816-E1024 PolarHBondContact OG-OE2 2.85Å; E1024-D1026 PolarHBondContact O-N 3.44Å
1025	L	62.9	Low	67.2	Low	162 Å²	162	103.2 Å²	103.2	85%	0.848	52%	0.515	S	S	*	.			trans	-85.6	107.2	-176.8	-81.9	154.3	0	0	0	110.6	L1027	L1025-L1027 PolarHBondContact O-N 3.04Å
1026	D	48.7	Very low	66.2	Low	159 Å²	159	110.2 Å²	110.2	85%	0.85	54%	0.538	S	S	*	.			trans	-60.7	124.8	168.1	-87	-34.3	0	0	0	110.5	E1024 A1028	E1024-D1026 PolarHBondContact O-N 3.44Å; D1026-A1028 VanDerWaalsContact C-N 3.35Å; D1026-A1028 PolarHBondContact O-N 3.11Å
1027	L	52.4	Low	65.6	Low	186 Å²	186	109.5 Å²	109.5	97%	0.974	54%	0.537	S	S	*	.			trans	-75.3	80.6	-178	-84.6	159.2	0	0	0	111.5	L1025	L1025-L1027 PolarHBondContact O-N 3.04Å
1028	A	36.1	Very low	64.8	Low	84 Å²	84	113.3 Å²	113.3	69%	0.694	56%	0.556	S	S	*	*			trans	-113.4	123.7	174.4	0	0	0	0	0	112.9	D1026	D1026-A1028 VanDerWaalsContact C-N 3.35Å; D1026-A1028 PolarHBondContact O-N 3.11Å
1029	E	37.6	Very low	64.3	Low	167 Å²	167	114 Å²	114	78%	0.78	56%	0.556	S	S	*	*			trans	66.3	111.7	161.6	-56.1	-164.2	157.1	0	0	120.3	Y1031	E1029-Y1031 PolarHBondContact O-N 3.22Å
1030	Q	41.3	Very low	64	Low	192 Å²	192	119.3 Å²	119.3	90%	0.897	58%	0.584	S	S	*	*			trans	-71.3	109.7	168.7	-67.2	171.9	-28.4	0	0	111.4	M1032	Q1030-M1032 PolarHBondContact O-N 3.12Å
1031	Y	43.6	Very low	63.7	Low	215 Å²	215	120.1 Å²	120.1	84%	0.843	60%	0.597	S	S	*	*			trans	-81.2	104.9	168.6	-96.5	-97.1	0	0	0	111.7	E1029	E1029-Y1031 PolarHBondContact O-N 3.22Å
1032	M	45.8	Very low	63.5	Low	162 Å²	162	124.8 Å²	124.8	80%	0.798	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.5	169.6	-82.3	-100.6	55	0	0	111.4	Q1030	Q1030-M1032 PolarHBondContact O-N 3.12Å
1033	I	62.8	Low	63.5	Low	124 Å²	124	126.8 Å²	126.8	64%	0.636	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-69.8	130.8	-178.8	-59.9	173.5	0	0	0	110.4	I1037	I1033-I1037 HydrophobicContact CG2-CD1 4.43Å
1034	P	64.6	Low	63.6	Low	54 Å²	54	127.6 Å²	127.6	35%	0.351	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-66.9	134.8	-177.9	-22.7	33.4	0	0	0	114.9	W1036 I1037	P1034-W1036 VanDerWaalsContact C-N 3.27Å; P1034-W1036 HydrophobicContact CB-CD2 3.92Å; P1034-W1036 HydrophobicContact CB-CG 4.35Å; P1034-W1036 HydrophobicContact CB-CH2 4.24Å; P1034-W1036 HydrophobicContact CB-CZ2 3.52Å; P1034-W1036 HydrophobicContact CG-CZ2 4.16Å; P1034-W1036 PolarHBondContact O-N 2.93Å; P1034-W1036 VanDerWaalsContact O-N 3.14Å; P1034-I1037 PolarHBondContact O-N 2.67Å; P1034-I1037 VanDerWaalsContact O-N 3.13Å
1035	W	68.4	Low	64	Low	181 Å²	181	124 Å²	124	69%	0.686	64%	0.641	S	S	*	*	H	α-helix	trans	-61.3	-26.6	-172.2	-171.3	65.7	0	0	0	114.9	I1037 I1038 L1039	W1035-I1037 PolarHBondContact O-N 3.49Å; W1035-I1038 WeakPolarHBondContact O-CB 3.06Å; W1035-I1038 PolarHBondContact O-N 2.97Å; W1035-I1038 VanDerWaalsContact O-N 3.1Å; W1035-L1039 HydrophobicContact CH2-CD1 4.15Å; W1035-L1039 HydrophobicContact CZ2-CD1 4.47Å; W1035-L1039 HydrophobicContact CZ3-CD1 4.43Å; W1035-L1039 PolarHBondContact O-N 3.19Å
1036	W	68.4	Low	65	Low	174 Å²	174	121 Å²	121	66%	0.659	62%	0.624	S	S	*	*	H	α-helix	trans	-63.6	-25.8	177	41.6	81.8	0	0	0	113.9	P1034 I1038 L1039 I1040	P1034-W1036 VanDerWaalsContact C-N 3.27Å; P1034-W1036 HydrophobicContact CB-CD2 3.92Å; P1034-W1036 HydrophobicContact CB-CG 4.35Å; P1034-W1036 HydrophobicContact CB-CH2 4.24Å; P1034-W1036 HydrophobicContact CB-CZ2 3.52Å; P1034-W1036 HydrophobicContact CG-CZ2 4.16Å; P1034-W1036 PolarHBondContact O-N 2.93Å; P1034-W1036 VanDerWaalsContact O-N 3.14Å; W1036-I1038 VanDerWaalsContact C-N 3.34Å; W1036-L1039 PolarHBondContact O-N 2.74Å; W1036-I1040 VanDerWaalsContact O-CG1 3.31Å; W1036-I1040 WeakPolarHBondContact O-CG1 3.43Å; W1036-I1040 PolarHBondContact O-N 2.89Å
1037	I	74.9	Confident	66.7	Low	98 Å²	98	119.2 Å²	119.2	50%	0.503	61%	0.614	S	S	.	*	H	α-helix	trans	-68.2	-38.2	174.2	-61.1	176.6	0	0	0	110.3	I1033 P1034 W1035 I1040 A1041	I1033-I1037 HydrophobicContact CG2-CD1 4.43Å; P1034-I1037 PolarHBondContact O-N 2.67Å; P1034-I1037 VanDerWaalsContact O-N 3.13Å; W1035-I1037 PolarHBondContact O-N 3.49Å; I1037-I1040 PolarHBondContact O-N 3.48Å; I1037-A1041 PolarHBondContact O-N 2.71Å; I1037-A1041 VanDerWaalsContact O-N 3.08Å
1038	I	72.4	Confident	68.2	Low	86 Å²	86	116 Å²	116	44%	0.441	60%	0.597	S	S	.	*	H	α-helix	trans	-67.2	-41.3	175	-57.1	174.2	0	0	0	110.2	W1035 W1036 I1040 A1041 I1042	W1035-I1038 WeakPolarHBondContact O-CB 3.06Å; W1035-I1038 PolarHBondContact O-N 2.97Å; W1035-I1038 VanDerWaalsContact O-N 3.1Å; W1036-I1038 VanDerWaalsContact C-N 3.34Å; I1038-I1040 PolarHBondContact O-N 2.82Å; I1038-A1041 PolarHBondContact O-N 3.41Å; I1038-I1042 HydrophobicContact CG2-CD1 4Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.44Å; I1038-I1042 PolarHBondContact O-N 2.7Å
1039	L	76.7	Confident	70.4	Confident	79 Å²	79	117.3 Å²	117.3	41%	0.414	59%	0.592	S	S	.	*	H	α-helix	trans	-61	-44.4	176.8	-163.6	84.1	0	0	0	112.3	W1035 W1036 I1042 L1043	W1035-L1039 HydrophobicContact CH2-CD1 4.15Å; W1035-L1039 HydrophobicContact CZ2-CD1 4.47Å; W1035-L1039 HydrophobicContact CZ3-CD1 4.43Å; W1035-L1039 PolarHBondContact O-N 3.19Å; W1036-L1039 PolarHBondContact O-N 2.74Å; L1039-I1042 PolarHBondContact O-N 3.49Å; L1039-L1043 HydrophobicContact CG-CD1 4.31Å; L1039-L1043 PolarHBondContact O-N 2.79Å
1040	I	81.8	Confident	72.4	Confident	113 Å²	113	113.1 Å²	113.1	58%	0.579	58%	0.578	S	S	*	*	H	α-helix	trans	-64.8	-41.2	177.5	-69.7	166.9	0	0	0	110.9	W1036 I1037 I1038 I1042 L1043 A1044	W1036-I1040 VanDerWaalsContact O-CG1 3.31Å; W1036-I1040 WeakPolarHBondContact O-CG1 3.43Å; W1036-I1040 PolarHBondContact O-N 2.89Å; I1037-I1040 PolarHBondContact O-N 3.48Å; I1038-I1040 PolarHBondContact O-N 2.82Å; I1040-I1042 PolarHBondContact O-N 2.04Å; I1040-L1043 PolarHBondContact O-N 2.63Å; I1040-A1044 WeakPolarHBondContact O-CB 3.44Å; I1040-A1044 PolarHBondContact O-N 3.12Å
1041	A	78.4	Confident	74.3	Confident	63 Å²	63	108.8 Å²	108.8	52%	0.521	56%	0.56	S	S	.	*	H	α-helix	trans	-62.3	-41.1	176.6	0	0	0	0	0	112.5	I1037 I1038 G1045	I1037-A1041 PolarHBondContact O-N 2.71Å; I1037-A1041 VanDerWaalsContact O-N 3.08Å; I1038-A1041 PolarHBondContact O-N 3.41Å; A1041-G1045 PolarHBondContact O-N 3Å
1042	I	82	Confident	76	Confident	98 Å²	98	102.9 Å²	102.9	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-65.8	-45.4	176.3	-67.4	166.9	0	0	0	111	I1038 L1039 I1040 G1045 I1046	I1038-I1042 HydrophobicContact CG2-CD1 4Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.44Å; I1038-I1042 PolarHBondContact O-N 2.7Å; L1039-I1042 PolarHBondContact O-N 3.49Å; I1040-I1042 PolarHBondContact O-N 2.04Å; I1042-G1045 PolarHBondContact O-N 3.03Å; I1042-I1046 HydrophobicContact CG2-CD1 3.86Å; I1042-I1046 WeakPolarHBondContact O-CG1 3.19Å; I1042-I1046 PolarHBondContact O-N 3.24Å
1043	L	83.9	Confident	77.5	Confident	108 Å²	108	98.7 Å²	98.7	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-63.3	-43	178.2	-79.2	164.3	0	0	0	112.4	L1039 I1040 I1046 L1047	L1039-L1043 HydrophobicContact CG-CD1 4.31Å; L1039-L1043 PolarHBondContact O-N 2.79Å; I1040-L1043 PolarHBondContact O-N 2.63Å; L1043-I1046 PolarHBondContact O-N 2.66Å; L1043-L1047 WeakPolarHBondContact O-CB 3.43Å; L1043-L1047 PolarHBondContact O-N 3.15Å
1044	A	80.5	Confident	78.2	Confident	59 Å²	59	96.4 Å²	96.4	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175	0	0	0	0	0	112	I1040 L1047 L1048	I1040-A1044 WeakPolarHBondContact O-CB 3.44Å; I1040-A1044 PolarHBondContact O-N 3.12Å; A1044-L1047 PolarHBondContact O-N 3.15Å; A1044-L1048 WeakPolarHBondContact O-CB 3.25Å; A1044-L1048 PolarHBondContact O-N 2.95Å
1045	G	79.7	Confident	78.7	Confident	41 Å²	41	98.2 Å²	98.2	42%	0.423	53%	0.526	S	S	.	.	H	α-helix	trans	-62.2	-43.4	176.2	0	0	0	0	0	113.2	A1041 I1042 L1048 L1049	A1041-G1045 PolarHBondContact O-N 3Å; I1042-G1045 PolarHBondContact O-N 3.03Å; G1045-L1048 PolarHBondContact O-N 2.99Å; G1045-L1049 WeakPolarHBondContact O-CB 3.29Å; G1045-L1049 PolarHBondContact O-N 3.38Å
1046	I	85.7	Confident	78.9	Confident	97 Å²	97	92.2 Å²	92.2	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-39.9	176.5	-67.4	168	0	0	0	111.1	I1042 L1043 L1049 T1050	I1042-I1046 HydrophobicContact CG2-CD1 3.86Å; I1042-I1046 WeakPolarHBondContact O-CG1 3.19Å; I1042-I1046 PolarHBondContact O-N 3.24Å; L1043-I1046 PolarHBondContact O-N 2.66Å; I1046-L1049 PolarHBondContact O-N 3.24Å; I1046-T1050 HydrophobicContact CG2-CG2 4.45Å; I1046-T1050 WeakPolarHBondContact O-CG2 3.21Å; I1046-T1050 PolarHBondContact O-N 3.23Å; I1046-T1050 PolarHBondContact O-OG1 3.22Å; I1046-T1050 VanDerWaalsContact O-OG1 3.09Å
1047	L	83.8	Confident	78.9	Confident	122 Å²	122	92.9 Å²	92.9	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-68.8	-37.7	179.1	-165.9	146.7	0	0	0	112.1	L1043 A1044 T1050 L1051	L1043-L1047 WeakPolarHBondContact O-CB 3.43Å; L1043-L1047 PolarHBondContact O-N 3.15Å; A1044-L1047 PolarHBondContact O-N 3.15Å; L1047-T1050 PolarHBondContact O-OG1 3.39Å; L1047-L1051 WeakPolarHBondContact O-CB 3.26Å; L1047-L1051 PolarHBondContact O-N 3.17Å
1048	L	82.9	Confident	78.8	Confident	120 Å²	120	97.2 Å²	97.2	63%	0.628	53%	0.525	S	S	*	.	H	α-helix	trans	-64.9	-44.3	172	-165	100.3	0	0	0	111.4	A1044 G1045 L1051 L1052	A1044-L1048 WeakPolarHBondContact O-CB 3.25Å; A1044-L1048 PolarHBondContact O-N 2.95Å; G1045-L1048 PolarHBondContact O-N 2.99Å; L1048-L1051 PolarHBondContact O-N 3.1Å; L1048-L1052 VanDerWaalsContact O-CB 3.31Å; L1048-L1052 WeakPolarHBondContact O-CB 3.45Å; L1048-L1052 PolarHBondContact O-N 2.63Å
1049	L	82.7	Confident	78.4	Confident	110 Å²	110	97.9 Å²	97.9	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-63.9	-44.1	-179.7	-170	76	0	0	0	112	G1045 I1046 L1052 V1053	G1045-L1049 WeakPolarHBondContact O-CB 3.29Å; G1045-L1049 PolarHBondContact O-N 3.38Å; I1046-L1049 PolarHBondContact O-N 3.24Å; L1049-L1052 PolarHBondContact O-N 2.86Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.39Å; L1049-V1053 PolarHBondContact O-N 3.38Å
1050	T	79.9	Confident	77.5	Confident	79 Å²	79	96.8 Å²	96.8	49%	0.485	54%	0.544	S	S	.	.	H	α-helix	trans	-67.8	-37	179.2	52.8	0	0	0	0	112.4	I1046 L1047 C1054	I1046-T1050 HydrophobicContact CG2-CG2 4.45Å; I1046-T1050 WeakPolarHBondContact O-CG2 3.21Å; I1046-T1050 PolarHBondContact O-N 3.23Å; I1046-T1050 PolarHBondContact O-OG1 3.22Å; I1046-T1050 VanDerWaalsContact O-OG1 3.09Å; L1047-T1050 PolarHBondContact O-OG1 3.39Å; T1050-C1054 WeakPolarHBondContact O-CB 3.45Å; T1050-C1054 PolarHBondContact O-N 3.26Å; T1050-C1054 PolarHBondContact O-SG 2.63Å; T1050-C1054 VanDerWaalsContact O-SG 3.41Å
1051	L	81.9	Confident	76.5	Confident	102 Å²	102	98.1 Å²	98.1	53%	0.534	55%	0.546	S	S	.	.	H	α-helix	trans	-63	-44.6	172.4	-168.6	118.4	0	0	0	111.3	L1047 L1048 C1054 I1055	L1047-L1051 WeakPolarHBondContact O-CB 3.26Å; L1047-L1051 PolarHBondContact O-N 3.17Å; L1048-L1051 PolarHBondContact O-N 3.1Å; L1051-C1054 PolarHBondContact O-N 3.15Å; L1051-I1055 HydrophobicContact CD2-CD1 3.71Å; L1051-I1055 HydrophobicContact CG-CD1 4.22Å; L1051-I1055 WeakPolarHBondContact O-CG1 3.33Å; L1051-I1055 PolarHBondContact O-N 2.97Å
1052	L	78.3	Confident	75.6	Confident	90 Å²	90	101.6 Å²	101.6	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-67	-38.1	179.6	-165.3	140.9	0	0	0	112.2	L1048 L1049 I1055 L1056	L1048-L1052 VanDerWaalsContact O-CB 3.31Å; L1048-L1052 WeakPolarHBondContact O-CB 3.45Å; L1048-L1052 PolarHBondContact O-N 2.63Å; L1049-L1052 PolarHBondContact O-N 2.86Å; L1052-I1055 PolarHBondContact O-N 2.69Å; L1052-L1056 HydrophobicContact CD2-CD1 3.64Å; L1052-L1056 HydrophobicContact CD2-CG 4.38Å; L1052-L1056 WeakPolarHBondContact O-CB 3.46Å; L1052-L1056 WeakPolarHBondContact O-CG 3.39Å; L1052-L1056 PolarHBondContact O-N 2.8Å
1053	V	78.3	Confident	74.1	Confident	75 Å²	75	106.7 Å²	106.7	46%	0.455	57%	0.568	S	S	.	*	H	α-helix	trans	-66.1	-40.3	171.8	170.9	0	0	0	0	111.7	L1049 L1056 W1057	L1049-V1053 WeakPolarHBondContact O-CG2 3.39Å; L1049-V1053 PolarHBondContact O-N 3.38Å; V1053-L1056 PolarHBondContact O-N 2.94Å; V1053-W1057 WeakPolarHBondContact O-CB 3.38Å; V1053-W1057 PolarHBondContact O-N 2.89Å
1054	C	76.3	Confident	72.2	Confident	75 Å²	75	113.5 Å²	113.5	51%	0.507	59%	0.586	S	S	.	*	H	α-helix	trans	-63.6	-39.9	174.4	-78.1	0	0	0	0	112.5	T1050 L1051 W1057 K1058	T1050-C1054 WeakPolarHBondContact O-CB 3.45Å; T1050-C1054 PolarHBondContact O-N 3.26Å; T1050-C1054 PolarHBondContact O-SG 2.63Å; T1050-C1054 VanDerWaalsContact O-SG 3.41Å; L1051-C1054 PolarHBondContact O-N 3.15Å; C1054-W1057 PolarHBondContact O-N 3.32Å; C1054-K1058 PolarHBondContact O-N 2.82Å
1055	I	76.3	Confident	70	Confident	92 Å²	92	116.3 Å²	116.3	47%	0.472	60%	0.602	S	S	.	*	H	α-helix	trans	-64.5	-49.4	175.4	-69.7	166.4	0	0	0	110.2	L1051 L1052 W1057 K1058 C1059	L1051-I1055 HydrophobicContact CD2-CD1 3.71Å; L1051-I1055 HydrophobicContact CG-CD1 4.22Å; L1051-I1055 WeakPolarHBondContact O-CG1 3.33Å; L1051-I1055 PolarHBondContact O-N 2.97Å; L1052-I1055 PolarHBondContact O-N 2.69Å; I1055-W1057 VanDerWaalsContact C-N 3.28Å; I1055-W1057 PolarHBondContact O-N 2.56Å; I1055-K1058 PolarHBondContact O-N 2.87Å; I1055-C1059 WeakPolarHBondContact O-CB 3.5Å; I1055-C1059 PolarHBondContact O-N 3.49Å; I1055-C1059 PolarHBondContact O-SG 2.68Å; I1055-C1059 VanDerWaalsContact O-SG 3.35Å
1056	L	71.8	Confident	67.9	Low	56 Å²	56	121.2 Å²	121.2	29%	0.293	61%	0.614	S	S	.	*	H	α-helix	trans	-62.9	-33	178.1	-70.8	173.3	0	0	0	112.9	L1052 V1053 G1060 F1061 F1062	L1052-L1056 HydrophobicContact CD2-CD1 3.64Å; L1052-L1056 HydrophobicContact CD2-CG 4.38Å; L1052-L1056 WeakPolarHBondContact O-CB 3.46Å; L1052-L1056 WeakPolarHBondContact O-CG 3.39Å; L1052-L1056 PolarHBondContact O-N 2.8Å; V1053-L1056 PolarHBondContact O-N 2.94Å; L1056-G1060 PolarHBondContact O-N 3.36Å; L1056-F1061 HydrophobicContact CB-CB 4.25Å; L1056-F1061 HydrophobicContact CD2-CB 4.36Å; L1056-F1061 HydrophobicContact CD2-CD1 4.43Å; L1056-F1061 HydrophobicContact CD2-CG 4.25Å; L1056-F1061 VanDerWaalsContact O-CB 3.23Å; L1056-F1061 WeakPolarHBondContact O-CB 3.41Å; L1056-F1061 PolarHBondContact O-N 3.47Å; L1056-F1062 HydrophobicContact CB-CE2 4.08Å
1057	W	69.4	Low	65.3	Low	188 Å²	188	126.4 Å²	126.4	71%	0.712	63%	0.628	S	S	*	*	H	α-helix	trans	-69.5	-44.4	173.7	-175.3	55.3	0	0	0	112.5	V1053 C1054 I1055 G1060	V1053-W1057 WeakPolarHBondContact O-CB 3.38Å; V1053-W1057 PolarHBondContact O-N 2.89Å; C1054-W1057 PolarHBondContact O-N 3.32Å; I1055-W1057 VanDerWaalsContact C-N 3.28Å; I1055-W1057 PolarHBondContact O-N 2.56Å; W1057-G1060 PolarHBondContact O-N 3.44Å
1058	K	72.6	Confident	62.9	Low	189 Å²	189	132 Å²	132	82%	0.822	64%	0.64	S	S	*	*	H	α-helix	trans	-69.4	-29.5	175	-96.5	-153.7	173.3	-171.2	0	113.8	C1054 I1055 G1060	C1054-K1058 PolarHBondContact O-N 2.82Å; I1055-K1058 PolarHBondContact O-N 2.87Å; K1058-G1060 PolarHBondContact O-N 2.68Å
1059	C	63.7	Low	61.2	Low	100 Å²	100	131.4 Å²	131.4	68%	0.676	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	12.3	173.8	-65.4	0	0	0	0	113.4	I1055 F1061	I1055-C1059 WeakPolarHBondContact O-CB 3.5Å; I1055-C1059 PolarHBondContact O-N 3.49Å; I1055-C1059 PolarHBondContact O-SG 2.68Å; I1055-C1059 VanDerWaalsContact O-SG 3.35Å; C1059-F1061 PolarHBondContact O-N 2.77Å
1060	G	58.8	Low	58.7	Low	56 Å²	56	134.2 Å²	134.2	58%	0.577	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.3	9.6	167.7	0	0	0	0	0	116.3	L1056 W1057 K1058 F1062	L1056-G1060 PolarHBondContact O-N 3.36Å; W1057-G1060 PolarHBondContact O-N 3.44Å; K1058-G1060 PolarHBondContact O-N 2.68Å; G1060-F1062 PolarHBondContact O-N 3.18Å; G1060-F1062 VanDerWaalsContact O-N 3.14Å
1061	F	60.1	Low	56.4	Low	141 Å²	141	139.1 Å²	139.1	62%	0.618	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-16.3	-168.9	-168.1	-106.2	0	0	0	115.1	L1056 C1059	L1056-F1061 HydrophobicContact CB-CB 4.25Å; L1056-F1061 HydrophobicContact CD2-CB 4.36Å; L1056-F1061 HydrophobicContact CD2-CD1 4.43Å; L1056-F1061 HydrophobicContact CD2-CG 4.25Å; L1056-F1061 VanDerWaalsContact O-CB 3.23Å; L1056-F1061 WeakPolarHBondContact O-CB 3.41Å; L1056-F1061 PolarHBondContact O-N 3.47Å; C1059-F1061 PolarHBondContact O-N 2.77Å
1062	F	60	Low	54.2	Low	136 Å²	136	141.9 Å²	141.9	60%	0.596	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	45.2	-174.1	-68.2	-73.1	0	0	0	114.7	L1056 G1060	L1056-F1062 HydrophobicContact CB-CE2 4.08Å; G1060-F1062 PolarHBondContact O-N 3.18Å; G1060-F1062 VanDerWaalsContact O-N 3.14Å
1063	K	50.4	Low	52.1	Low	205 Å²	205	142.6 Å²	142.6	89%	0.891	68%	0.682	S	S	*	*			trans	-125.9	134.6	156.7	-79.3	-172.6	176.2	179.9	0	110.2
1064	R	43.3	Very low	50	Low	250 Å²	250	146.2 Å²	146.2	94%	0.943	69%	0.694	S	S	*	*			trans	-123.1	134.4	-157.1	-165.7	-174.8	-163.8	-176.7	6.1	111.5
1065	S	35.3	Very low	47.7	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	70%	0.703	S	S	*	*			trans	-159.6	91.5	167	-177.2	0	0	0	0	107
1066	E	34.9	Very low	45.7	Very low	144 Å²	144	154 Å²	154	67%	0.673	71%	0.71	S	S	*	*				81	119.7	82.6	-127.5	-154.8	138.5	0	0	115.9
1067	R	30.5	Very low	43.8	Very low	206 Å²	206	161.7 Å²	161.7	78%	0.777	74%	0.735	S	S	*	*			trans	75.7	112.8	161.6	-61	180	-177	-158.7	-3.3	121.7
1068	R	33.8	Very low	41.9	Very low	239 Å²	239	156.5 Å²	156.5	90%	0.902	73%	0.732	S	S	*	*				37.7	160.8	111.3	-64.4	-176.1	179.3	-176.1	-0.3	120.1
1069	P	46.3	Very low	39.9	Very low	108 Å²	108	155.9 Å²	155.9	70%	0.701	73%	0.731	S	S	*	*			cis	-142.8	175.6	-39.6	41.1	-23.9	0	0	0	115.5
1070	H	31.3	Very low	38.2	Very low	169 Å²	169	159.5 Å²	159.5	78%	0.782	74%	0.743	S	S	*	*			trans	74	157.3	149.6	-110.8	-80.2	0	0	0	123.1
1071	Y	32.1	Very low	36.8	Very low	181 Å²	181	159.9 Å²	159.9	71%	0.71	75%	0.747	S	S	*	*			trans	82.7	115.4	174.7	-71.4	-82.5	0	0	0	116.9
1072	E	35.1	Very low	35.3	Very low	161 Å²	161	160.1 Å²	160.1	75%	0.752	76%	0.76	S	S	*	*				72.8	147.2	94.5	-93.1	178.8	-167.1	0	0	113
1073	T	34.7	Very low	34.3	Very low	104 Å²	104	162.3 Å²	162.3	64%	0.638	77%	0.772	S	S	*	*			cis	-155.6	144.2	13.1	8.7	0	0	0	0	107.5
1074	E	33.9	Very low	33.9	Very low	151 Å²	151	157.8 Å²	157.8	71%	0.706	76%	0.764	S	S	*	*				89	167.8	88.6	-150.8	-175.2	-164.5	0	0	116.4
1075	Y	28.6	Very low	33.4	Very low	173 Å²	173	150.8 Å²	150.8	68%	0.678	75%	0.753	S	S	*	*			trans	81.8	90.4	165.4	-82	-94.9	0	0	0	124
1076	Y	33	Very low	33.6	Very low	159 Å²	159	154 Å²	154	62%	0.624	76%	0.755	S	S	*	*				66.5	125.8	111.1	-87.7	-77.2	0	0	0	125.5
1077	R	31.2	Very low	33.5	Very low	216 Å²	216	151.7 Å²	151.7	82%	0.815	76%	0.76	S	S	*	*				63.8	143.7	125.9	-104.8	-179.4	-168.6	154.2	-1.2	125.1
1078	A	30.3	Very low	34.1	Very low	79 Å²	79	150.5 Å²	150.5	65%	0.653	76%	0.764	S	S	*	*			trans	100.2	103.2	130.2	0	0	0	0	0	120.8
1079	H	31.4	Very low	34.2	Very low	176 Å²	176	147.4 Å²	147.4	82%	0.815	76%	0.757	S	S	*	*				47.6	147.2	111.3	-86.7	-49.6	0	0	0	123.4
1080	L	28.3	Very low	33.9	Very low	177 Å²	177	150.7 Å²	150.7	93%	0.927	76%	0.763	S	S	*	*			trans	73.8	138.9	166.2	-58.4	145.6	0	0	0	113.6
1081	G	27.6	Very low	34	Very low	64 Å²	64	146.2 Å²	146.2	66%	0.66	76%	0.755	S	S	*	*			cis	168.4	-156.8	1.6	0	0	0	0	0	109.1
1082	V	30.2	Very low	34.2	Very low	145 Å²	145	144.6 Å²	144.6	88%	0.879	76%	0.758	S	S	*	*			trans	82	108.2	163.2	-171.8	0	0	0	0	117.5
1083	Q	39.3	Very low	34.6	Very low	182 Å²	182	145 Å²	145	85%	0.85	76%	0.76	S	S	*	*			trans	-71.7	159.7	151.5	-72.2	177.7	-45.2	0	0	110.2
1084	P	41.5	Very low	34.8	Very low	111 Å²	111	151.3 Å²	151.3	72%	0.721	79%	0.788	S	S	*	*				-153.8	164.1	98.7	37.8	-19.7	0	0	0	118.5
1085	S	33.3	Very low	34.8	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	79%	0.792	S	S	*	*			trans	60.7	124.8	149.6	58.4	0	0	0	0	120.1
1086	E	38.3	Very low	35.1	Very low	185 Å²	185	150.2 Å²	150.2	86%	0.864	80%	0.798	S	S	*	*				72.3	89	56.5	-75.3	-152.1	134.5	0	0	115.8
1087	A	33.8	Very low	35.2	Very low	96 Å²	96	149.7 Å²	149.7	79%	0.793	81%	0.808	S	S	*	*			trans	-178.3	127.2	148.1	0	0	0	0	0	105.9
1088	E	41.7	Very low	35.5	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	81%	0.808	S	S	*	*			cis	-135	136.9	6.3	-58.3	163.5	110.1	0	0	106.4
1089	K	37.1	Very low	35.8	Very low	174 Å²	174	149.9 Å²	149.9	76%	0.757	82%	0.817	S	S	*	*				40.1	127.4	80.4	-71.3	179.6	179.8	172.4	0	111.6
1090	Q	38.6	Very low	36.1	Very low	177 Å²	177	148.2 Å²	148.2	83%	0.827	82%	0.818	S	S	*	*			cis	-174.8	172.1	29.2	-118.6	161.2	-25.2	0	0	105.4
1091	A	33.6	Very low	36.7	Very low	75 Å²	75	146.1 Å²	146.1	62%	0.62	81%	0.81	S	S	*	*			cis	-162.3	156	17.4	0	0	0	0	0	111.2
1092	L	37.3	Very low	37.4	Very low	147 Å²	147	152.5 Å²	152.5	77%	0.77	82%	0.821	S	S	*	*			trans	52.8	121.2	141.3	-87.7	86.4	0	0	0	119.2
1093	E	43.9	Very low	38	Very low	169 Å²	169	153.1 Å²	153.1	79%	0.79	82%	0.817	S	S	*	*			cis	54.7	132.7	42.9	-53.3	-175.2	153.3	0	0	113.3
1094	L	37.2	Very low	37.8	Very low	236 Å²	236	150.5 Å²	150.5	100%	1.236	81%	0.813	S	S	*	*			cis	-124.3	0	13.7	-77.3	82.9	0	0	0	111.8

Retrieved 1,094 of 1,094 residues in 621.1 ms (Link to these results)

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