A0A087YGD2_POEFO Loading...

Integrin alpha-L-like

AlphaFold DB , UniProt , Accession A0A087YGD2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,175 aa.

						>A0A087YGD2_POEFO|A0A087YGD2
MYAPRRFNLFIYMILAAAAIPTTSAFNVDTTNPSFYKGEQKDFFGYKVLQYKSPKDKGVIVTAPLQQNGSGGISKYGQDETPLWFNGSSHPYSAKHLGLSITMDTESRFIACSPSLAHPCDENVYLNSLCYNFTHDFELLSSFKPLFQKCIKKAVDLVFLFDGSESMTGTEFEQNKKFIIGMMESLKNTSIKFAAVQFSTTYRTVFNFKDYDDGKAEGKLMKEEHMKGLTNTYRALNFTLYELLENKAAGASKDANKAVVIITDGDPSELDKTYRSVETYNSKEIIRVVIGVKIKDDQFDKLRTIASEPKEKNVFKITNYDGLTGLLENFQKQIFAIEGSNGTRSEELSNEMAQSGFSAVSHKDTLILASVGSKTWRGTLNDYQNKNKAIIDPEMQEASYMGYSLSVGERNGTSLYFTGAPRFNHMGEVVVFRRDEDKWPIVQRLTVDQIGSYFGAELCSVDIDSDGNTDFLLVGAPMFFLPEERKEGSIYVYALSDKIDLMSVLHVKAPSMGRFGTTISSLSDLNGDGLRDVAVGAPLEENNAGAVYIYLGQKGTGMRNISSQRIMGAQFDPGLRFFGQSINGDIDLGEDQLPDIVVGSQGAAVVLRSKPVLDVKAKLSFYPSVISIQEINCLDKTEDKPLPMTNITACFEMVEVTNSTTGPGIEISFMIIVDPMRQSSRGFFIENGANSRNIRHTQELTDKETCFNYSISMNKCIQDTLSPVNIKLNFSQDSHENSTAILNIDSQRRAMVEVPFEKRCEKEICIADLKVDFDFLSKELLVTKETTIKTWIKLHNRADDSYNTSLTMLYPEGLSFSMLDQTGNKKLTQICADQEKLNETVCGISLPVYRSKSSAVFTASFRIKDFEWNDTMLMTVFAKSENSNSSESSSVTKSIPVKYSVEMTTSVNDTSVENLEFTPENYKAQKMITVYKIYNAGFKDFPINVSLFFQEQLEHDFEIKNYRVIVEPNNTQCSKMSTPKAEGCPWKENCVAIKCDTFMLKNYSNVYVSLLGVVHFRNLENYESNMPFLKKYTGVHGEVKFNSTIKVHYNGTRYVLSSQKNEKNKDYTVQQSATVTVEFKVPQYRYLIIATGVVLGFILLIILTVIMWKCGCFKRKTIEEFEEKKADFPAQTKTSSVPSHNKSEQVEEEKKPLNADKDKVKPSVNTEGDCEKVGF
					

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(Predicted Aligned Error values between residue pairs)

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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	35.8	Very low	37.7	Very low	234 Å²	234	161.3 Å²	161.3	100%	1.153	76%	0.763	S	S	*	*				0	159.1	0	-147.2	167.7	-170.8	0	0	108.1
2	Y	32.5	Very low	37.8	Very low	227 Å²	227	162.6 Å²	162.6	89%	0.89	76%	0.758	S	S	*	*			trans	74.8	77.3	-173.3	-68.6	-77	0	0	0	118.3
3	A	31.2	Very low	37.7	Very low	95 Å²	95	160.5 Å²	160.5	79%	0.785	75%	0.751	S	S	*	*			trans	-132.8	167.6	132.4	0	0	0	0	0	106.8
4	P	43.9	Very low	37.5	Very low	110 Å²	110	156.3 Å²	156.3	71%	0.714	73%	0.734	S	S	*	*			cis	-122.5	158.6	-2.7	39.5	-26.3	0	0	0	114
5	R	38.5	Very low	37.1	Very low	241 Å²	241	153.6 Å²	153.6	91%	0.909	73%	0.726	S	S	*	*	S	Bend	trans	-149.7	-2.8	161.7	-124.2	180	-171.4	-174.3	2.2	116.6
6	R	37.8	Very low	36.8	Very low	230 Å²	230	148.3 Å²	148.3	87%	0.868	72%	0.716	S	S	*	*	S	Bend	trans	-94.1	-17.8	-179.6	-74.1	-173.2	172.7	-176.4	-2.9	115.1
7	F	38.2	Very low	36.3	Very low	157 Å²	157	143.8 Å²	143.8	69%	0.689	71%	0.709	S	S	*	*	H	α-helix	trans	-68.8	-39.9	-173.8	-138.8	-99.7	0	0	0	112.9	L9 F10 I11	F7-L9 PolarHBondContact O-N 2.6Å; F7-F10 PolarHBondContact O-N 3.02Å; F7-I11 HydrophobicContact CD1-CD1 3.9Å; F7-I11 HydrophobicContact CE1-CD1 4.27Å; F7-I11 PolarHBondContact O-N 2.71Å
8	N	37.1	Very low	35.8	Very low	116 Å²	116	139.9 Å²	139.9	62%	0.62	70%	0.704	S	S	*	*	H	α-helix	trans	-67.5	-31.7	-176.6	-64.5	21.7	0	0	0	113.3	F10 I11 Y12	N8-F10 VanDerWaalsContact C-N 3.33Å; N8-I11 PolarHBondContact O-N 2.88Å; N8-Y12 WeakPolarHBondContact O-CD2 3.49Å; N8-Y12 PolarHBondContact O-N 3.22Å
9	L	40.6	Very low	35.4	Very low	135 Å²	135	136.7 Å²	136.7	71%	0.707	70%	0.7	S	S	*	*	H	α-helix	trans	-67.6	-35.9	178.1	-124.1	77.7	0	0	0	111.8	F7 Y12 M13	F7-L9 PolarHBondContact O-N 2.6Å; L9-Y12 PolarHBondContact O-N 2.85Å; L9-M13 WeakPolarHBondContact O-CG 3.35Å; L9-M13 PolarHBondContact O-N 3.4Å
10	F	36	Very low	35	Very low	150 Å²	150	136.6 Å²	136.6	66%	0.658	70%	0.7	S	S	*	*	H	α-helix	trans	-70.3	-37.7	178.4	-138.3	-98.7	0	0	0	111.5	F7 N8 M13 I14	F7-F10 PolarHBondContact O-N 3.02Å; N8-F10 VanDerWaalsContact C-N 3.33Å; F10-M13 PolarHBondContact O-N 3.15Å; F10-I14 HydrophobicContact CD1-CD1 3.74Å; F10-I14 HydrophobicContact CD1-CG1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 4.08Å; F10-I14 WeakPolarHBondContact O-CG1 3.1Å; F10-I14 PolarHBondContact O-N 2.56Å
11	I	43.5	Very low	34.8	Very low	79 Å²	79	135.5 Å²	135.5	41%	0.405	70%	0.702	S	S	.	*	H	α-helix	trans	-64.9	-42	173.6	-66.5	171.7	0	0	0	111.2	F7 N8 I14 L15	F7-I11 HydrophobicContact CD1-CD1 3.9Å; F7-I11 HydrophobicContact CE1-CD1 4.27Å; F7-I11 PolarHBondContact O-N 2.71Å; N8-I11 PolarHBondContact O-N 2.88Å; I11-I14 PolarHBondContact O-N 2.69Å; I11-L15 HydrophobicContact CG2-CD1 3.88Å; I11-L15 HydrophobicContact CG2-CG 4.44Å; I11-L15 WeakPolarHBondContact O-CB 3.49Å; I11-L15 WeakPolarHBondContact O-CG 2.84Å; I11-L15 PolarHBondContact O-N 2.97Å
12	Y	38.4	Very low	34.6	Very low	177 Å²	177	130.5 Å²	130.5	69%	0.694	68%	0.684	S	S	*	*	H	α-helix	trans	-65.4	-37.4	175	-95.1	-91.6	0	0	0	113	N8 L9 A16	N8-Y12 WeakPolarHBondContact O-CD2 3.49Å; N8-Y12 PolarHBondContact O-N 3.22Å; L9-Y12 PolarHBondContact O-N 2.85Å; Y12-A16 WeakPolarHBondContact O-CB 3.47Å; Y12-A16 PolarHBondContact O-N 2.91Å
13	M	36.5	Very low	34.8	Very low	136 Å²	136	124.8 Å²	124.8	67%	0.67	67%	0.673	S	S	*	*	H	α-helix	trans	-64.7	-41.1	172.8	-77.6	-73.6	-71.1	0	0	112.4	L9 F10 A16 A17	L9-M13 WeakPolarHBondContact O-CG 3.35Å; L9-M13 PolarHBondContact O-N 3.4Å; F10-M13 PolarHBondContact O-N 3.15Å; M13-A16 PolarHBondContact O-N 2.9Å; M13-A17 WeakPolarHBondContact O-CB 3.36Å; M13-A17 PolarHBondContact O-N 2.9Å
14	I	34.5	Very low	35.4	Very low	101 Å²	101	123 Å²	123	52%	0.518	66%	0.656	S	S	.	*	H	α-helix	trans	-69.1	-38.5	177.8	-70.7	169.2	0	0	0	111.2	F10 I11 A16 A17 A18	F10-I14 HydrophobicContact CD1-CD1 3.74Å; F10-I14 HydrophobicContact CD1-CG1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 4.08Å; F10-I14 WeakPolarHBondContact O-CG1 3.1Å; F10-I14 PolarHBondContact O-N 2.56Å; I11-I14 PolarHBondContact O-N 2.69Å; I14-A16 VanDerWaalsContact C-N 3.34Å; I14-A17 PolarHBondContact O-N 2.91Å; I14-A18 WeakPolarHBondContact O-CB 3.07Å; I14-A18 PolarHBondContact O-N 3.03Å
15	L	32.8	Very low	36.1	Very low	116 Å²	116	119.3 Å²	119.3	61%	0.607	63%	0.634	S	S	*	*	H	α-helix	trans	-68.5	-30.8	174.3	-72.9	169.9	0	0	0	112.9	I11	I11-L15 HydrophobicContact CG2-CD1 3.88Å; I11-L15 HydrophobicContact CG2-CG 4.44Å; I11-L15 WeakPolarHBondContact O-CB 3.49Å; I11-L15 WeakPolarHBondContact O-CG 2.84Å; I11-L15 PolarHBondContact O-N 2.97Å
16	A	31	Very low	37.9	Very low	69 Å²	69	108.1 Å²	108.1	57%	0.57	59%	0.592	S	S	*	*	H	α-helix	trans	-72.5	-36	171.3	0	0	0	0	0	112.4	Y12 M13 I14 A18 A19	Y12-A16 WeakPolarHBondContact O-CB 3.47Å; Y12-A16 PolarHBondContact O-N 2.91Å; M13-A16 PolarHBondContact O-N 2.9Å; I14-A16 VanDerWaalsContact C-N 3.34Å; A16-A18 VanDerWaalsContact C-N 3.28Å; A16-A18 PolarHBondContact O-N 3.46Å; A16-A19 PolarHBondContact O-N 2.88Å
17	A	28.1	Very low	40.4	Very low	72 Å²	72	97.3 Å²	97.3	60%	0.595	55%	0.551	S	S	*	*	H	α-helix	trans	-73	-18.1	175	0	0	0	0	0	113.6	M13 I14 A19	M13-A17 WeakPolarHBondContact O-CB 3.36Å; M13-A17 PolarHBondContact O-N 2.9Å; I14-A17 PolarHBondContact O-N 2.91Å; A17-A19 PolarHBondContact O-N 3.44Å
18	A	27.7	Very low	42.9	Very low	74 Å²	74	90 Å²	90	61%	0.612	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	3.6	174.5	0	0	0	0	0	113.9	I14 A16 I20	I14-A18 WeakPolarHBondContact O-CB 3.07Å; I14-A18 PolarHBondContact O-N 3.03Å; A16-A18 VanDerWaalsContact C-N 3.28Å; A16-A18 PolarHBondContact O-N 3.46Å; A18-I20 VanDerWaalsContact C-N 3.33Å
19	A	29	Very low	45.4	Very low	78 Å²	78	85.3 Å²	85.3	65%	0.645	50%	0.495	S	S	*	.			trans	-95.7	37.8	173.9	0	0	0	0	0	112.8	A16 A17	A16-A19 PolarHBondContact O-N 2.88Å; A17-A19 PolarHBondContact O-N 3.44Å
20	I	27.9	Very low	47.8	Very low	135 Å²	135	81 Å²	81	69%	0.692	47%	0.474	S	S	*	.	S	Bend	trans	-60	129.6	154.5	-57.5	175.7	0	0	0	105.8	A18 T22	A18-I20 VanDerWaalsContact C-N 3.33Å; I20-T22 PolarHBondContact O-N 2.76Å
21	P	29.6	Very low	50.2	Low	114 Å²	114	76.4 Å²	76.4	74%	0.74	46%	0.458	S	S	*	.			trans	-63.1	104.2	172.2	26	-32.3	0	0	0	108.3	T23	P21-T23 PolarHBondContact O-N 3.08Å
22	T	31	Very low	52.1	Low	128 Å²	128	78.6 Å²	78.6	79%	0.785	47%	0.47	S	S	*	.			trans	-51.1	128.8	168.5	47.2	0	0	0	0	107.9	I20 S24	I20-T22 PolarHBondContact O-N 2.76Å; T22-S24 PolarHBondContact O-N 3.42Å
23	T	36.6	Very low	54.6	Low	107 Å²	107	71.4 Å²	71.4	66%	0.656	45%	0.445	S	S	*	.			trans	-47.3	102	-173.1	41.2	0	0	0	0	111.7	P21 A25	P21-T23 PolarHBondContact O-N 3.08Å; T23-A25 VanDerWaalsContact C-N 3.3Å; T23-A25 PolarHBondContact O-N 2.94Å
24	S	45.6	Very low	57.3	Low	59 Å²	59	66.4 Å²	66.4	41%	0.413	42%	0.424	S	S	.	.			trans	-70.3	93.1	167.1	47.6	0	0	0	0	107.3	T22 F26 S563 Q564	T22-S24 PolarHBondContact O-N 3.42Å; S24-F26 PolarHBondContact O-N 3.33Å; S24-F26 VanDerWaalsContact O-N 3.11Å; S24-S563 WeakPolarHBondContact CB-O 3.15Å; S24-S563 VanDerWaalsContact O-O 3.04Å; S24-S563 PolarHBondContact OG-O 2.91Å; S24-Q564 WeakPolarHBondContact O-CB 3.43Å; S24-Q564 WeakPolarHBondContact O-CG 3.44Å
25	A	57.6	Low	60	Low	31 Å²	31	64.6 Å²	64.6	26%	0.256	41%	0.413	S	S	.	.			trans	-60.9	111.7	163.1	0	0	0	0	0	106.6	T23 H735	T23-A25 VanDerWaalsContact C-N 3.3Å; T23-A25 PolarHBondContact O-N 2.94Å; A25-H735 HydrophobicContact CB-CB 4.04Å
26	F	76.8	Confident	62.8	Low	7 Å²	7	60.3 Å²	60.3	3%	0.031	39%	0.388	C	S	.	.			trans	-83.8	-62.1	-180	167.9	-105.9	0	0	0	109.4	S24 L525 N526 L551 Q564 V612 I741 I744	S24-F26 PolarHBondContact O-N 3.33Å; S24-F26 VanDerWaalsContact O-N 3.11Å; F26-L525 HydrophobicContact CE1-CB 4.26Å; F26-N526 HydrophobicContact CE1-CB 3.95Å; F26-N526 HydrophobicContact CE2-CB 4.29Å; F26-N526 HydrophobicContact CZ-CB 3.35Å; F26-L551 HydrophobicContact CD1-CD2 4.14Å; F26-L551 HydrophobicContact CD2-CD1 4.29Å; F26-L551 HydrophobicContact CE1-CD2 3.71Å; F26-L551 HydrophobicContact CE2-CD1 4.03Å; F26-L551 HydrophobicContact CZ-CD1 4.26Å; F26-L551 HydrophobicContact CZ-CD2 3.99Å; F26-Q564 HydrophobicContact CB-CB 3.97Å; F26-V612 HydrophobicContact CZ-CG2 4.19Å; F26-I741 WeakPolarHBondContact O-CG2 3.37Å; F26-I744 HydrophobicContact CD2-CB 4.16Å; F26-I744 HydrophobicContact CD2-CG2 4.1Å; F26-I744 HydrophobicContact CE2-CB 4.27Å; F26-I744 HydrophobicContact CE2-CG2 3.91Å
27	N	89.2	Confident	65.7	Low	3 Å²	3	63.2 Å²	63.2	2%	0.016	39%	0.388	C	S	.	.	S	Bend	trans	-157.9	-21.4	169.9	82.5	-39.8	0	0	0	113.6	D29 L525 K610 V612	N27-D29 PolarHBondContact O-N 2.8Å; N27-L525 PolarHBondContact ND2-O 2.79Å; N27-K610 PolarHBondContact ND2-O 3.24Å; N27-K610 WeakPolarHBondContact O-CB 3.31Å; N27-K610 WeakPolarHBondContact O-CG 3.17Å; N27-K610 PolarHBondContact O-N 2.75Å; N27-V612 HydrophobicContact CB-CG2 3.68Å
28	V	91.5	Very high	68.7	Low	3 Å²	3	61.2 Å²	61.2	2%	0.018	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-66.9	119	179	-175.1	0	0	0	0	109.2	T30 L525 I549 Q564 I566 I596 L607	V28-T30 PolarHBondContact O-N 2.83Å; V28-L525 HydrophobicContact CG2-CD1 4.12Å; V28-I549 HydrophobicContact CG2-CG1 4.33Å; V28-Q564 PolarHBondContact O-NE2 3.08Å; V28-I566 HydrophobicContact CB-CD1 4.11Å; V28-I566 HydrophobicContact CG1-CD1 3.82Å; V28-I596 HydrophobicContact CG1-CD1 4.36Å; V28-I596 HydrophobicContact CG2-CD1 3.73Å; V28-L607 HydrophobicContact CG1-CB 3.66Å; V28-L607 HydrophobicContact CG1-CD1 4.05Å; V28-L607 HydrophobicContact CG1-CG 4.49Å
29	D	89.6	Confident	71.8	Confident	18 Å²	18	62.7 Å²	62.7	10%	0.096	37%	0.369	C	S	.	.			trans	-71.1	127.4	180	-174.2	38.1	0	0	0	111.4	N27 T31 N32 R608 K610	N27-D29 PolarHBondContact O-N 2.8Å; D29-T31 WeakPolarHBondContact OD1-CB 3.29Å; D29-T31 PolarHBondContact OD1-N 2.72Å; D29-T31 PolarHBondContact OD1-OG1 3.24Å; D29-T31 PolarHBondContact OD2-OG1 2.74Å; D29-N32 PolarHBondContact OD2-N 3.49Å; D29-R608 PolarHBondContact N-O 3Å; D29-K610 HydrophobicContact CB-CG 4.17Å; D29-K610 VanDerWaalsContact OD1-CE 3.29Å; D29-K610 WeakPolarHBondContact OD1-CE 3.41Å; D29-K610 IonicContact OD1-NZ 2.66Å
30	T	90.1	Very high	74.8	Confident	45 Å²	45	63.3 Å²	63.3	28%	0.276	36%	0.358	S	S	.	.			trans	-111.5	5.6	174	60	0	0	0	0	112.2	V28 I566 F571	V28-T30 PolarHBondContact O-N 2.83Å; T30-I566 HydrophobicContact CG2-CG1 4.25Å; T30-I566 HydrophobicContact CG2-CG2 4.16Å; T30-F571 HydrophobicContact CG2-CE1 4.35Å; T30-F571 HydrophobicContact CG2-CZ 4.13Å; T30-F571 WeakPolarHBondContact O-CE1 3.48Å
31	T	86.4	Confident	78	Confident	53 Å²	53	63.1 Å²	63.1	33%	0.325	35%	0.353	S	S	.	.	S	Bend	trans	-89.7	-40.8	-179	64.7	0	0	0	0	112.9	D29 P33 E736	D29-T31 WeakPolarHBondContact OD1-CB 3.29Å; D29-T31 PolarHBondContact OD1-N 2.72Å; D29-T31 PolarHBondContact OD1-OG1 3.24Å; D29-T31 PolarHBondContact OD2-OG1 2.74Å; T31-P33 WeakPolarHBondContact O-CD 3.38Å; T31-E736 HydrophobicContact CG2-CB 3.9Å; T31-E736 HydrophobicContact CG2-CG 4.25Å
32	N	85.1	Confident	81.1	Confident	124 Å²	124	58.8 Å²	58.8	66%	0.663	32%	0.323	S	S	*	.	S	Bend	trans	-123.6	58.3	-177.4	-62.2	-82.3	0	0	0	113.5	D29	D29-N32 PolarHBondContact OD2-N 3.49Å
33	P	90.9	Very high	84.1	Confident	26 Å²	26	55.5 Å²	55.5	17%	0.169	30%	0.298	C	S	.	.			trans	-66.6	144.5	177.4	31.1	-37.9	0	0	0	112.6	T31 F35 F571 V605 L607	T31-P33 WeakPolarHBondContact O-CD 3.38Å; P33-F35 HydrophobicContact CB-CE2 4.18Å; P33-F35 HydrophobicContact CB-CZ 4.16Å; P33-F35 HydrophobicContact CG-CE2 3.74Å; P33-F35 HydrophobicContact CG-CZ 3.71Å; P33-F35 WeakPolarHBondContact O-CE2 3.4Å; P33-F571 HydrophobicContact CB-CD1 4.29Å; P33-F571 HydrophobicContact CB-CE1 4.14Å; P33-F571 HydrophobicContact CG-CD1 3.68Å; P33-F571 HydrophobicContact CG-CE1 3.88Å; P33-F571 HydrophobicContact CG-CG 4.45Å; P33-V605 HydrophobicContact CB-CG1 3.83Å; P33-L607 HydrophobicContact CB-CD2 3.84Å
34	S	91.6	Very high	87	Confident	31 Å²	31	50.4 Å²	50.4	22%	0.217	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	147.4	171.4	-8	0	0	0	0	110.5	V605 V606	S34-V605 CarbonylContact O-C 3.19Å; S34-V605 WeakPolarHBondContact O-CA 3.28Å; S34-V606 PolarHBondContact N-O 3.37Å; S34-V606 PolarHBondContact O-N 3.21Å
35	F	91.4	Very high	89.4	Confident	64 Å²	64	47.6 Å²	47.6	28%	0.281	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	119	-175.3	-59.9	-94.5	0	0	0	113	P33 K37 F571 L575 V605	P33-F35 HydrophobicContact CB-CE2 4.18Å; P33-F35 HydrophobicContact CB-CZ 4.16Å; P33-F35 HydrophobicContact CG-CE2 3.74Å; P33-F35 HydrophobicContact CG-CZ 3.71Å; P33-F35 WeakPolarHBondContact O-CE2 3.4Å; F35-K37 HydrophobicContact CB-CG 4.08Å; F35-F571 HydrophobicContact CE1-CB 4.24Å; F35-F571 HydrophobicContact CZ-CB 4.04Å; F35-L575 HydrophobicContact CE1-CD1 4.43Å; F35-V605 HydrophobicContact CD1-CG1 4.19Å; F35-V605 HydrophobicContact CD1-CG2 3.89Å; F35-V605 HydrophobicContact CE1-CG1 3.99Å; F35-V605 HydrophobicContact CE1-CG2 3.96Å
36	Y	93	Very high	91.3	Very high	26 Å²	26	49.9 Å²	49.9	10%	0.102	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.9	157.4	-53.8	-53.8	0	0	0	107.8	F44 V59 Y76 A603 A604 V606	Y36-F44 WeakPolarHBondContact O-CE1 3.42Å; Y36-V59 HydrophobicContact CD2-CB 4.3Å; Y36-V59 HydrophobicContact CE2-CB 3.87Å; Y36-V59 HydrophobicContact CE2-CG2 3.75Å; Y36-Y76 AromaticContact CD1-CD1 3.23Å; Y36-Y76 HydrophobicContact CD1-CD1 3.23Å; Y36-Y76 HydrophobicContact CD1-CD2 4.34Å; Y36-Y76 AromaticContact CD1-CE1 3.67Å; Y36-Y76 HydrophobicContact CD1-CE1 3.67Å; Y36-Y76 AromaticContact CD1-CG 3.61Å; Y36-Y76 HydrophobicContact CD1-CG 3.61Å; Y36-Y76 HydrophobicContact CD2-CD2 4.37Å; Y36-Y76 HydrophobicContact CD2-CG 4.22Å; Y36-Y76 AromaticContact CE1-CD1 3.71Å; Y36-Y76 HydrophobicContact CE1-CD1 3.71Å; Y36-Y76 AromaticContact CE1-CG 3.91Å; Y36-Y76 HydrophobicContact CE1-CG 3.91Å; Y36-Y76 HydrophobicContact CE2-CG 4.47Å; Y36-Y76 AromaticContact CG-CD1 3.75Å; Y36-Y76 HydrophobicContact CG-CD1 3.75Å; Y36-Y76 HydrophobicContact CG-CD2 4.06Å; Y36-Y76 AromaticContact CG-CE1 3.98Å; Y36-Y76 HydrophobicContact CG-CE1 3.98Å; Y36-Y76 HydrophobicContact CG-CE2 4.31Å; Y36-Y76 AromaticContact CG-CG 3.78Å; Y36-Y76 HydrophobicContact CG-CG 3.78Å; Y36-A603 CarbonylContact O-C 3.6Å; Y36-A603 VanDerWaalsContact O-CA 3.23Å; Y36-A603 WeakPolarHBondContact O-CA 3.41Å; Y36-A604 HydrophobicContact CD2-CB 4.45Å; Y36-A604 PolarHBondContact N-O 3.03Å; Y36-A604 PolarHBondContact O-N 2.78Å; Y36-V606 HydrophobicContact CD2-CG2 4.21Å; Y36-V606 HydrophobicContact CE2-CG2 3.65Å
37	K	91.6	Very high	92.3	Very high	129 Å²	129	52.3 Å²	52.3	56%	0.561	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	146.9	-177.7	-62.5	-160.9	178.1	-160.1	0	111.8	F35 D572	F35-K37 HydrophobicContact CB-CG 4.08Å; K37-D572 IonicContact NZ-OD2 2.67Å
38	G	91.2	Very high	92.6	Very high	30 Å²	30	52.7 Å²	52.7	31%	0.309	26%	0.263	S	S	.	.			trans	-153.6	-175.6	176.7	0	0	0	0	0	112.2	Q40 G602	G38-Q40 PolarHBondContact O-N 3.42Å; G38-G602 PolarHBondContact N-O 2.72Å
39	E	92.5	Very high	92.7	Very high	105 Å²	105	53.5 Å²	53.5	49%	0.491	27%	0.267	S	S	.	.			trans	-76.1	122.1	-175.4	-74	-71.8	136.3	0	0	112.1	K41 D42	E39-K41 HydrophobicContact CB-CG 4.05Å; E39-K41 VanDerWaalsContact CD-NZ 3.35Å; E39-K41 PolarHBondContact O-N 3.03Å; E39-K41 IonicContact OE2-NZ 2.72Å; E39-K41 PolarHBondContact OE2-NZ 2.84Å; E39-D42 HydrophobicContact CB-CB 3.99Å; E39-D42 WeakPolarHBondContact CB-OD2 3.48Å; E39-D42 PolarHBondContact O-N 3.4Å
40	Q	92.4	Very high	92.8	Very high	91 Å²	91	52.7 Å²	52.7	43%	0.425	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-57.4	-37.1	177.4	-66.9	-167.2	-30.2	0	0	112.6	G38 D42 F43 G574 Q601	G38-Q40 PolarHBondContact O-N 3.42Å; Q40-D42 PolarHBondContact O-N 2.96Å; Q40-F43 PolarHBondContact O-N 3.22Å; Q40-G574 PolarHBondContact NE2-O 2.69Å; Q40-G574 VanDerWaalsContact NE2-O 3.09Å; Q40-Q601 HydrophobicContact CB-CG 4.27Å; Q40-Q601 WeakPolarHBondContact O-CG 3.37Å; Q40-Q601 PolarHBondContact O-NE2 2.78Å
41	K	94	Very high	92.8	Very high	132 Å²	132	50.8 Å²	50.8	57%	0.574	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26	177.4	58.8	152.4	-162.2	-77	0	113.7	E39 F43 L65	E39-K41 HydrophobicContact CB-CG 4.05Å; E39-K41 VanDerWaalsContact CD-NZ 3.35Å; E39-K41 PolarHBondContact O-N 3.03Å; E39-K41 IonicContact OE2-NZ 2.72Å; E39-K41 PolarHBondContact OE2-NZ 2.84Å; K41-F43 VanDerWaalsContact C-N 3.3Å; K41-L65 WeakPolarHBondContact O-CB 3.49Å
42	D	94.6	Very high	92.7	Very high	22 Å²	22	53.2 Å²	53.2	12%	0.118	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-89.7	-2.1	-176.7	-65.4	-10.7	0	0	0	111.6	E39 Q40 F44 A63 L65 Q66	E39-D42 HydrophobicContact CB-CB 3.99Å; E39-D42 WeakPolarHBondContact CB-OD2 3.48Å; E39-D42 PolarHBondContact O-N 3.4Å; Q40-D42 PolarHBondContact O-N 2.96Å; D42-F44 PolarHBondContact O-N 2.94Å; D42-A63 HydrophobicContact CB-CB 4.44Å; D42-A63 CarbonylContact O-C 3.57Å; D42-A63 WeakPolarHBondContact O-CA 3.18Å; D42-L65 PolarHBondContact O-N 3.43Å; D42-Q66 HydrophobicContact CB-CB 3.98Å; D42-Q66 HydrophobicContact CB-CG 4.31Å
43	F	95.3	Very high	92.5	Very high	59 Å²	59	48 Å²	48	26%	0.259	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	34.1	-173.2	-79.1	-111.9	0	0	0	112.7	Q40 K41 G45 Y46 P64 L65 F577 Q601	Q40-F43 PolarHBondContact O-N 3.22Å; K41-F43 VanDerWaalsContact C-N 3.3Å; F43-G45 PolarHBondContact O-N 2.87Å; F43-Y46 WeakPolarHBondContact O-CB 3.16Å; F43-Y46 PolarHBondContact O-N 3.19Å; F43-P64 HydrophobicContact CB-CG 4.19Å; F43-P64 WeakPolarHBondContact O-CD 3.05Å; F43-L65 HydrophobicContact CB-CG 4.42Å; F43-L65 HydrophobicContact CD2-CB 4.33Å; F43-L65 HydrophobicContact CD2-CD1 3.46Å; F43-L65 VanDerWaalsContact CD2-CD1 3.46Å; F43-L65 HydrophobicContact CD2-CG 3.85Å; F43-L65 HydrophobicContact CE2-CD1 3.65Å; F43-L65 HydrophobicContact CE2-CG 4.5Å; F43-L65 HydrophobicContact CG-CD1 4.36Å; F43-L65 HydrophobicContact CG-CG 4.36Å; F43-F577 HydrophobicContact CE1-CD2 4.49Å; F43-F577 HydrophobicContact CE1-CE2 4.19Å; F43-Q601 HydrophobicContact CD1-CG 4.49Å
44	F	96.6	Very high	91.8	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	133.6	168.4	178.9	-92.1	0	0	0	110.3	Y36 D42 V61 T62 A63 Y76 W84 G602	Y36-F44 WeakPolarHBondContact O-CE1 3.42Å; D42-F44 PolarHBondContact O-N 2.94Å; F44-V61 HydrophobicContact CD1-CG1 4.2Å; F44-V61 HydrophobicContact CD2-CG1 3.97Å; F44-V61 HydrophobicContact CE1-CG1 3.8Å; F44-V61 HydrophobicContact CE2-CB 3.8Å; F44-V61 HydrophobicContact CE2-CG1 3.59Å; F44-V61 HydrophobicContact CG-CG1 4.29Å; F44-V61 HydrophobicContact CZ-CB 3.78Å; F44-V61 HydrophobicContact CZ-CG1 3.5Å; F44-V61 VanDerWaalsContact CZ-CG1 3.5Å; F44-V61 HydrophobicContact CZ-CG2 4.11Å; F44-T62 CarbonylContact C-O 3.54Å; F44-T62 WeakPolarHBondContact CA-O 3.46Å; F44-A63 HydrophobicContact CB-CB 4.02Å; F44-A63 HydrophobicContact CD2-CB 4.2Å; F44-Y76 HydrophobicContact CE2-CE2 4.04Å; F44-Y76 AromaticContact CZ-CE2 3.73Å; F44-Y76 HydrophobicContact CZ-CE2 3.73Å; F44-Y76 AromaticContact CZ-CZ 3.85Å; F44-Y76 VanDerWaalsContact CZ-OH 3.26Å; F44-Y76 WeakPolarHBondContact CZ-OH 3.24Å; F44-W84 AromaticContact CD2-CH2 3.73Å; F44-W84 HydrophobicContact CD2-CH2 3.73Å; F44-W84 HydrophobicContact CD2-CZ2 4.29Å; F44-W84 AromaticContact CE2-CH2 3.95Å; F44-W84 HydrophobicContact CE2-CH2 3.95Å; F44-W84 HydrophobicContact CE2-CZ2 4.21Å; F44-G602 PolarHBondContact O-N 2.82Å
45	G	96.6	Very high	91.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	92	13.2	-173.3	0	0	0	0	0	114.2	F43 T62 Q580 S581 G599 S600	F43-G45 PolarHBondContact O-N 2.87Å; G45-T62 PolarHBondContact N-O 3.29Å; G45-Q580 VanDerWaalsContact C-NE2 3.3Å; G45-Q580 PolarHBondContact O-NE2 3.35Å; G45-S581 PolarHBondContact O-OG 2.85Å; G45-G599 WeakPolarHBondContact O-CA 3.48Å; G45-S600 WeakPolarHBondContact CA-O 3.4Å; G45-S600 PolarHBondContact O-N 3.03Å
46	Y	97.6	Very high	90.7	Very high	79 Å²	79	58.1 Å²	58.1	31%	0.31	28%	0.282	S	S	.	.	S	Bend	trans	-65.5	-51.4	-179.1	-176	-102.6	0	0	0	112.4	F43 T62 P64 L99 S581	F43-Y46 WeakPolarHBondContact O-CB 3.16Å; F43-Y46 PolarHBondContact O-N 3.19Å; Y46-T62 PolarHBondContact N-O 2.69Å; Y46-P64 HydrophobicContact CD1-CG 4.03Å; Y46-P64 HydrophobicContact CD2-CG 4.39Å; Y46-P64 HydrophobicContact CG-CG 3.82Å; Y46-L99 HydrophobicContact CD1-CD2 4.05Å; Y46-L99 HydrophobicContact CE1-CB 4.36Å; Y46-L99 HydrophobicContact CE1-CD2 3.45Å; Y46-L99 VanDerWaalsContact CE1-CD2 3.45Å; Y46-L99 HydrophobicContact CE1-CG 4.48Å; Y46-L99 WeakPolarHBondContact CE1-O 3.29Å; Y46-L99 HydrophobicContact CE2-CD2 4.5Å; Y46-S581 VanDerWaalsContact O-CB 3.24Å; Y46-S581 WeakPolarHBondContact O-CB 3.35Å; Y46-S581 PolarHBondContact O-OG 2.94Å
47	K	97.2	Very high	90.5	Very high	58 Å²	58	58.2 Å²	58.2	25%	0.252	28%	0.283	S	S	.	.	S	Bend	trans	-119.5	144.4	162.9	-67.9	-66.7	-176.3	-179.5	0	109.8	T62 I101 S581	K47-T62 HydrophobicContact CB-CG2 4.26Å; K47-T62 PolarHBondContact N-OG1 2.96Å; K47-T62 PolarHBondContact O-N 2.78Å; K47-I101 HydrophobicContact CB-CG2 3.82Å; K47-I101 HydrophobicContact CG-CG2 4.42Å; K47-S581 WeakPolarHBondContact CA-OG 3.25Å
48	V	96.1	Very high	90.4	Very high	11 Å²	11	52.2 Å²	52.2	7%	0.067	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.2	172.7	-62.1	0	0	0	0	109.1	I60 V61 S581 V597 A604	V48-I60 WeakPolarHBondContact CA-O 3.26Å; V48-V61 HydrophobicContact CG1-CG1 4.34Å; V48-V61 HydrophobicContact CG1-CG2 4.45Å; V48-S581 PolarHBondContact N-OG 2.91Å; V48-V597 HydrophobicContact CB-CG1 3.79Å; V48-V597 HydrophobicContact CG1-CG1 4.04Å; V48-V597 HydrophobicContact CG2-CB 4.26Å; V48-V597 HydrophobicContact CG2-CG1 3.92Å; V48-A604 HydrophobicContact CG1-CB 3.78Å
49	L	93.1	Very high	90.5	Very high	20 Å²	20	50.8 Å²	50.8	11%	0.105	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	125.2	180	174.1	65.6	0	0	0	109	V59 I60 I101 M103 F109	L49-V59 WeakPolarHBondContact O-CA 3.19Å; L49-I60 HydrophobicContact CB-CB 4.46Å; L49-I60 PolarHBondContact N-O 2.75Å; L49-I60 PolarHBondContact O-N 2.68Å; L49-I101 HydrophobicContact CD2-CD1 3.81Å; L49-I101 HydrophobicContact CD2-CG1 4Å; L49-M103 HydrophobicContact CD1-CB 4.31Å; L49-M103 HydrophobicContact CD1-CE 4.18Å; L49-M103 HydrophobicContact CD2-CB 4.13Å; L49-M103 HydrophobicContact CD2-SD 4.29Å; L49-F109 HydrophobicContact CD2-CB 4.37Å
50	Q	92	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	148.4	170	-63.7	177.9	-41.9	0	0	110.2	G58 M103 N583 I586 L588 D595 V597	Q50-G58 WeakPolarHBondContact CA-O 3.29Å; Q50-M103 WeakPolarHBondContact O-CE 3.27Å; Q50-N583 WeakPolarHBondContact CB-OD1 3.26Å; Q50-N583 WeakPolarHBondContact CG-OD1 3.48Å; Q50-N583 PolarHBondContact N-OD1 3.47Å; Q50-I586 HydrophobicContact CB-CB 4.22Å; Q50-I586 HydrophobicContact CB-CD1 3.92Å; Q50-I586 HydrophobicContact CB-CG1 4.2Å; Q50-I586 PolarHBondContact NE2-O 2.85Å; Q50-L588 HydrophobicContact CG-CD1 4.22Å; Q50-L588 HydrophobicContact CG-CD2 4.49Å; Q50-D595 PolarHBondContact NE2-O 3.17Å; Q50-V597 HydrophobicContact CG-CG2 3.6Å
51	Y	88.8	Confident	90.7	Very high	5 Å²	5	41.6 Å²	41.6	2%	0.02	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.7	169.7	74.4	-90.2	0	0	0	111.1	D56 K57 G58 V59 I60 K75 Y76 G77	Y51-D56 HydrophobicContact CE2-CB 4.47Å; Y51-D56 WeakPolarHBondContact CE2-OD2 3.15Å; Y51-D56 VanDerWaalsContact CZ-OD2 3.32Å; Y51-D56 VanDerWaalsContact OH-CG 3.29Å; Y51-D56 PolarHBondContact OH-OD1 2.79Å; Y51-D56 PolarHBondContact OH-OD2 2.9Å; Y51-K57 WeakPolarHBondContact O-CA 3.31Å; Y51-G58 VanDerWaalsContact CD1-C 3.4Å; Y51-G58 WeakPolarHBondContact CD1-O 3.32Å; Y51-G58 VanDerWaalsContact CE1-CA 3.45Å; Y51-G58 PolarHBondContact N-O 2.96Å; Y51-G58 PolarHBondContact O-N 2.72Å; Y51-G58 VanDerWaalsContact O-N 3.08Å; Y51-V59 VanDerWaalsContact CE1-N 3.27Å; Y51-I60 HydrophobicContact CD1-CD1 4.34Å; Y51-I60 HydrophobicContact CD1-CG1 4Å; Y51-K75 HydrophobicContact CE1-CD 4.17Å; Y51-K75 HydrophobicContact CE1-CG 3.79Å; Y51-K75 WeakPolarHBondContact OH-CE 3.36Å; Y51-Y76 PolarHBondContact OH-O 2.91Å; Y51-G77 WeakPolarHBondContact OH-CA 3.38Å
52	K	85.8	Confident	90.9	Very high	104 Å²	104	35.3 Å²	35.3	45%	0.452	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	124.6	172.5	-172.2	162.8	-177.7	165.6	0	108.8	K57 I586 D587	K52-K57 HydrophobicContact CB-CB 4.39Å; K52-K57 HydrophobicContact CG-CB 4.29Å; K52-I586 HydrophobicContact CB-CD1 4.05Å; K52-I586 HydrophobicContact CB-CG2 4.16Å; K52-I586 HydrophobicContact CD-CG2 3.84Å; K52-D587 IonicContact NZ-OD2 2.78Å
53	S	79.4	Confident	91	Very high	16 Å²	16	34.2 Å²	34.2	11%	0.112	17%	0.167	C	C	.	.			trans	-115.1	172.7	171.3	90.5	0	0	0	0	109.8	K55 D56	S53-K55 PolarHBondContact O-N 2.04Å; S53-K55 VanDerWaalsContact O-N 3.11Å; S53-K55 PolarHBondContact OG-N 3.12Å; S53-K55 VanDerWaalsContact OG-N 3.11Å; S53-D56 PolarHBondContact N-O 3.08Å; S53-D56 PolarHBondContact OG-N 2.89Å; S53-D56 VanDerWaalsContact OG-N 3.14Å; S53-D56 PolarHBondContact OG-O 2.98Å
54	P	76.9	Confident	91	Very high	133 Å²	133	31.6 Å²	31.6	86%	0.864	16%	0.156	S	C	*	.	S	Bend	trans	-66.1	-3.2	172.9	-21.4	34.5	0	0	0	115.1
55	K	76.8	Confident	90.9	Very high	161 Å²	161	34.7 Å²	34.7	70%	0.7	17%	0.173	S	C	*	.	S	Bend	trans	-125.4	-26.8	-176.3	-53.9	175	-162.6	151.1	0	114.5	S53 D136	S53-K55 PolarHBondContact O-N 2.04Å; S53-K55 VanDerWaalsContact O-N 3.11Å; S53-K55 PolarHBondContact OG-N 3.12Å; S53-K55 VanDerWaalsContact OG-N 3.11Å; K55-D136 IonicContact NZ-OD2 3.46Å; K55-D136 PolarHBondContact NZ-OD2 2.93Å
56	D	83.1	Confident	90.7	Very high	39 Å²	39	35.9 Å²	35.9	21%	0.209	18%	0.178	C	C	.	.			trans	-154.9	151	-163.5	171.5	39.7	0	0	0	110	Y51 S53 K75	Y51-D56 HydrophobicContact CE2-CB 4.47Å; Y51-D56 WeakPolarHBondContact CE2-OD2 3.15Å; Y51-D56 VanDerWaalsContact CZ-OD2 3.32Å; Y51-D56 VanDerWaalsContact OH-CG 3.29Å; Y51-D56 PolarHBondContact OH-OD1 2.79Å; Y51-D56 PolarHBondContact OH-OD2 2.9Å; S53-D56 PolarHBondContact N-O 3.08Å; S53-D56 PolarHBondContact OG-N 2.89Å; S53-D56 VanDerWaalsContact OG-N 3.14Å; S53-D56 PolarHBondContact OG-O 2.98Å; D56-K75 WeakPolarHBondContact OD2-CE 3.47Å; D56-K75 IonicContact OD2-NZ 2.65Å; D56-K75 PolarHBondContact OD2-NZ 2.87Å
57	K	88.1	Confident	90.3	Very high	28 Å²	28	37.7 Å²	37.7	12%	0.122	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	147.5	175.9	65.6	-178.2	-171.4	166.5	0	110.5	Y51 K52 D587 G589	Y51-K57 WeakPolarHBondContact O-CA 3.31Å; K52-K57 HydrophobicContact CB-CB 4.39Å; K52-K57 HydrophobicContact CG-CB 4.29Å; K57-D587 VanDerWaalsContact CD-O 3.31Å; K57-D587 WeakPolarHBondContact CD-O 3.25Å; K57-D587 WeakPolarHBondContact CE-O 3.36Å; K57-D587 PolarHBondContact NZ-O 2.86Å; K57-D587 IonicContact NZ-OD1 2.76Å; K57-D587 PolarHBondContact NZ-OD1 2.76Å; K57-D587 IonicContact NZ-OD2 2.78Å; K57-D587 PolarHBondContact NZ-OD2 3.04Å; K57-G589 WeakPolarHBondContact CE-O 3.29Å; K57-G589 PolarHBondContact NZ-O 2.93Å
58	G	90.6	Very high	89.7	Confident	3 Å²	3	42 Å²	42	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171	-150.4	-172.6	0	0	0	0	0	113.7	Q50 Y51 Y76	Q50-G58 WeakPolarHBondContact CA-O 3.29Å; Y51-G58 VanDerWaalsContact CD1-C 3.4Å; Y51-G58 WeakPolarHBondContact CD1-O 3.32Å; Y51-G58 VanDerWaalsContact CE1-CA 3.45Å; Y51-G58 PolarHBondContact N-O 2.96Å; Y51-G58 PolarHBondContact O-N 2.72Å; Y51-G58 VanDerWaalsContact O-N 3.08Å; G58-Y76 CarbonylContact C-O 3.49Å; G58-Y76 WeakPolarHBondContact CA-O 3.33Å
59	V	92.6	Very high	89.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.5	-170.5	-174.8	0	0	0	0	111.8	Y36 L49 Y51 V61 Y76 L588 V597 V606	Y36-V59 HydrophobicContact CD2-CB 4.3Å; Y36-V59 HydrophobicContact CE2-CB 3.87Å; Y36-V59 HydrophobicContact CE2-CG2 3.75Å; L49-V59 WeakPolarHBondContact O-CA 3.19Å; Y51-V59 VanDerWaalsContact CE1-N 3.27Å; V59-V61 HydrophobicContact CG1-CG2 3.69Å; V59-Y76 PolarHBondContact N-O 3.32Å; V59-Y76 PolarHBondContact O-N 2.89Å; V59-L588 HydrophobicContact CG2-CD1 3.79Å; V59-V597 HydrophobicContact CG1-CG1 3.84Å; V59-V597 HydrophobicContact CG1-CG2 4.45Å; V59-V597 HydrophobicContact CG2-CG1 4.35Å; V59-V597 HydrophobicContact CG2-CG2 3.71Å; V59-V606 HydrophobicContact CG2-CG2 4.37Å
60	I	94.2	Very high	89.1	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.8	164.4	-63	165.6	0	0	0	108.6	V48 L49 Y51 I73 S74 K75 I101 F109 F137	V48-I60 WeakPolarHBondContact CA-O 3.26Å; L49-I60 HydrophobicContact CB-CB 4.46Å; L49-I60 PolarHBondContact N-O 2.75Å; L49-I60 PolarHBondContact O-N 2.68Å; Y51-I60 HydrophobicContact CD1-CD1 4.34Å; Y51-I60 HydrophobicContact CD1-CG1 4Å; I60-I73 HydrophobicContact CG2-CG2 3.52Å; I60-S74 CarbonylContact C-O 3.56Å; I60-S74 WeakPolarHBondContact CA-O 3.49Å; I60-K75 HydrophobicContact CG1-CB 4.31Å; I60-K75 HydrophobicContact CG1-CG 4.45Å; I60-I101 HydrophobicContact CB-CD1 4.44Å; I60-I101 HydrophobicContact CG2-CD1 3.62Å; I60-F109 HydrophobicContact CD1-CD1 3.64Å; I60-F109 HydrophobicContact CD1-CD2 4.29Å; I60-F109 HydrophobicContact CD1-CE1 3.6Å; I60-F109 HydrophobicContact CD1-CE2 4.25Å; I60-F109 HydrophobicContact CD1-CG 4.01Å; I60-F109 HydrophobicContact CD1-CZ 3.93Å; I60-F137 HydrophobicContact CG1-CE2 4.49Å
61	V	96.1	Very high	89.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	136	-177.4	-170.8	0	0	0	0	110.4	F44 V48 V59 S74 Y76 A604	F44-V61 HydrophobicContact CD1-CG1 4.2Å; F44-V61 HydrophobicContact CD2-CG1 3.97Å; F44-V61 HydrophobicContact CE1-CG1 3.8Å; F44-V61 HydrophobicContact CE2-CB 3.8Å; F44-V61 HydrophobicContact CE2-CG1 3.59Å; F44-V61 HydrophobicContact CG-CG1 4.29Å; F44-V61 HydrophobicContact CZ-CB 3.78Å; F44-V61 HydrophobicContact CZ-CG1 3.5Å; F44-V61 VanDerWaalsContact CZ-CG1 3.5Å; F44-V61 HydrophobicContact CZ-CG2 4.11Å; V48-V61 HydrophobicContact CG1-CG1 4.34Å; V48-V61 HydrophobicContact CG1-CG2 4.45Å; V59-V61 HydrophobicContact CG1-CG2 3.69Å; V61-S74 PolarHBondContact N-O 3.34Å; V61-S74 PolarHBondContact O-N 2.79Å; V61-Y76 HydrophobicContact CB-CE2 4.46Å; V61-Y76 HydrophobicContact CG2-CD2 4.19Å; V61-Y76 HydrophobicContact CG2-CE2 4.17Å; V61-A604 HydrophobicContact CG1-CB 4.17Å; V61-A604 HydrophobicContact CG2-CB 3.73Å
62	T	96.9	Very high	89.3	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	150.7	179.1	72.9	0	0	0	0	113.5	F44 G45 Y46 K47 I73 G98	F44-T62 CarbonylContact C-O 3.54Å; F44-T62 WeakPolarHBondContact CA-O 3.46Å; G45-T62 PolarHBondContact N-O 3.29Å; Y46-T62 PolarHBondContact N-O 2.69Å; K47-T62 HydrophobicContact CB-CG2 4.26Å; K47-T62 PolarHBondContact N-OG1 2.96Å; K47-T62 PolarHBondContact O-N 2.78Å; T62-I73 HydrophobicContact CG2-CG1 4.42Å; T62-I73 HydrophobicContact CG2-CG2 4.44Å; T62-G98 WeakPolarHBondContact CB-O 3.4Å; T62-G98 WeakPolarHBondContact CG2-O 3.47Å; T62-G98 PolarHBondContact OG1-O 3.43Å
63	A	96.8	Very high	89.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	79.3	179	0	0	0	0	0	110.4	D42 F44 L65 Q66 G71 G72 W84	D42-A63 HydrophobicContact CB-CB 4.44Å; D42-A63 CarbonylContact O-C 3.57Å; D42-A63 WeakPolarHBondContact O-CA 3.18Å; F44-A63 HydrophobicContact CB-CB 4.02Å; F44-A63 HydrophobicContact CD2-CB 4.2Å; A63-L65 VanDerWaalsContact C-N 3.3Å; A63-L65 PolarHBondContact O-N 3.44Å; A63-Q66 HydrophobicContact CB-CB 4.05Å; A63-Q66 VanDerWaalsContact O-CB 3.23Å; A63-Q66 WeakPolarHBondContact O-CB 3.41Å; A63-Q66 PolarHBondContact O-N 2.9Å; A63-G71 VanDerWaalsContact O-CA 3.29Å; A63-G71 WeakPolarHBondContact O-CA 3.33Å; A63-G72 PolarHBondContact N-O 2.86Å; A63-G72 PolarHBondContact O-N 3.3Å; A63-W84 HydrophobicContact CB-CH2 4.27Å; A63-W84 HydrophobicContact CB-CZ3 4.27Å
64	P	95.8	Very high	90.5	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.026	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.6	-168.3	26.8	-35	0	0	0	115	F43 Y46 G71 H96 L99	F43-P64 HydrophobicContact CB-CG 4.19Å; F43-P64 WeakPolarHBondContact O-CD 3.05Å; Y46-P64 HydrophobicContact CD1-CG 4.03Å; Y46-P64 HydrophobicContact CD2-CG 4.39Å; Y46-P64 HydrophobicContact CG-CG 3.82Å; P64-G71 WeakPolarHBondContact O-CA 3.17Å; P64-H96 HydrophobicContact CB-CB 4.29Å; P64-H96 WeakPolarHBondContact O-CA 3.48Å; P64-L99 HydrophobicContact CB-CD2 3.91Å; P64-L99 HydrophobicContact CB-CG 4.07Å; P64-L99 HydrophobicContact CG-CD2 4.05Å
65	L	94.5	Very high	91.2	Very high	66 Å²	66	30.4 Å²	30.4	35%	0.346	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-1.8	175.2	-60.8	-162.2	0	0	0	114.1	K41 D42 F43 A63 G69	K41-L65 WeakPolarHBondContact O-CB 3.49Å; D42-L65 PolarHBondContact O-N 3.43Å; F43-L65 HydrophobicContact CB-CG 4.42Å; F43-L65 HydrophobicContact CD2-CB 4.33Å; F43-L65 HydrophobicContact CD2-CD1 3.46Å; F43-L65 VanDerWaalsContact CD2-CD1 3.46Å; F43-L65 HydrophobicContact CD2-CG 3.85Å; F43-L65 HydrophobicContact CE2-CD1 3.65Å; F43-L65 HydrophobicContact CE2-CG 4.5Å; F43-L65 HydrophobicContact CG-CD1 4.36Å; F43-L65 HydrophobicContact CG-CG 4.36Å; A63-L65 VanDerWaalsContact C-N 3.3Å; A63-L65 PolarHBondContact O-N 3.44Å; L65-G69 WeakPolarHBondContact O-CA 3.13Å; L65-G69 PolarHBondContact O-N 2.92Å
66	Q	92.7	Very high	91.8	Very high	24 Å²	24	23.3 Å²	23.3	11%	0.112	12%	0.122	C	C	.	.	H	α-helix	trans	-55	150.9	178.2	-159.3	179.7	20.8	0	0	112.8	D42 A63 N68 G69 S70 G71 G72 W84 N86	D42-Q66 HydrophobicContact CB-CB 3.98Å; D42-Q66 HydrophobicContact CB-CG 4.31Å; A63-Q66 HydrophobicContact CB-CB 4.05Å; A63-Q66 VanDerWaalsContact O-CB 3.23Å; A63-Q66 WeakPolarHBondContact O-CB 3.41Å; A63-Q66 PolarHBondContact O-N 2.9Å; Q66-N68 PolarHBondContact O-N 2.93Å; Q66-G69 PolarHBondContact O-N 2.93Å; Q66-G69 VanDerWaalsContact O-N 3.15Å; Q66-S70 PolarHBondContact O-N 2.86Å; Q66-S70 VanDerWaalsContact O-N 3.14Å; Q66-S70 PolarHBondContact O-OG 3.01Å; Q66-G71 PolarHBondContact O-N 3.48Å; Q66-G72 VanDerWaalsContact OE1-CA 3.27Å; Q66-W84 VanDerWaalsContact CD-CZ3 3.43Å; Q66-W84 VanDerWaalsContact NE2-CH2 3.26Å; Q66-N86 PolarHBondContact OE1-OD1 2.91Å
67	Q	88.2	Confident	91.7	Very high	117 Å²	117	22.1 Å²	22.1	55%	0.547	12%	0.119	S	C	.	.	H	α-helix	trans	49.2	54.8	-179	-63.5	-169.4	21	0	0	113.2	G69 S70 N86	Q67-G69 VanDerWaalsContact C-N 3.25Å; Q67-G69 PolarHBondContact O-N 2.98Å; Q67-S70 WeakPolarHBondContact CB-OG 3.27Å; Q67-S70 PolarHBondContact O-N 3.14Å; Q67-N86 PolarHBondContact NE2-OD1 2.96Å; Q67-N86 VanDerWaalsContact NE2-OD1 3.1Å
68	N	85.8	Confident	90.8	Very high	149 Å²	149	26.4 Å²	26.4	80%	0.797	14%	0.139	S	C	*	.	H	α-helix	trans	59.9	34.5	179.8	-164.6	19.3	0	0	0	113.3	Q66 K95	Q66-N68 PolarHBondContact O-N 2.93Å; N68-K95 PolarHBondContact O-NZ 2.85Å
69	G	87	Confident	89.4	Confident	6 Å²	6	33.3 Å²	33.3	6%	0.062	18%	0.176	C	C	.	.	H	α-helix	trans	86.4	10.7	176.6	0	0	0	0	0	116.1	L65 Q66 Q67 K95 H96	L65-G69 WeakPolarHBondContact O-CA 3.13Å; L65-G69 PolarHBondContact O-N 2.92Å; Q66-G69 PolarHBondContact O-N 2.93Å; Q66-G69 VanDerWaalsContact O-N 3.15Å; Q67-G69 VanDerWaalsContact C-N 3.25Å; Q67-G69 PolarHBondContact O-N 2.98Å; G69-K95 CarbonylContact O-C 3.54Å; G69-K95 WeakPolarHBondContact O-CA 3.42Å; G69-K95 WeakPolarHBondContact O-CB 3.27Å; G69-K95 WeakPolarHBondContact O-CD 3.15Å; G69-K95 VanDerWaalsContact O-CG 3.28Å; G69-K95 WeakPolarHBondContact O-CG 3.25Å; G69-H96 PolarHBondContact O-N 2.98Å
70	S	88.6	Confident	88.2	Confident	31 Å²	31	39.5 Å²	39.5	22%	0.217	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-34.8	166	67.5	0	0	0	0	110.9	Q66 Q67 K95 H96 L97	Q66-S70 PolarHBondContact O-N 2.86Å; Q66-S70 VanDerWaalsContact O-N 3.14Å; Q66-S70 PolarHBondContact O-OG 3.01Å; Q67-S70 WeakPolarHBondContact CB-OG 3.27Å; Q67-S70 PolarHBondContact O-N 3.14Å; S70-K95 CarbonylContact O-C 3.52Å; S70-H96 PolarHBondContact O-N 2.8Å; S70-H96 VanDerWaalsContact O-N 3.13Å; S70-L97 WeakPolarHBondContact O-CB 3.31Å; S70-L97 PolarHBondContact O-N 3.37Å
71	G	92.9	Very high	87.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	82.6	163.6	-175.1	0	0	0	0	0	112.7	A63 P64 Q66	A63-G71 VanDerWaalsContact O-CA 3.29Å; A63-G71 WeakPolarHBondContact O-CA 3.33Å; P64-G71 WeakPolarHBondContact O-CA 3.17Å; Q66-G71 PolarHBondContact O-N 3.48Å
72	G	93.4	Very high	87	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	171.2	176.9	0	0	0	0	0	112.9	A63 Q66 F85	A63-G72 PolarHBondContact N-O 2.86Å; A63-G72 PolarHBondContact O-N 3.3Å; Q66-G72 VanDerWaalsContact OE1-CA 3.27Å; G72-F85 CarbonylContact C-O 3.54Å; G72-F85 VanDerWaalsContact CA-O 3.27Å; G72-F85 WeakPolarHBondContact CA-O 3.48Å
73	I	95.2	Very high	86.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	136.4	-174.2	-50.7	163.1	0	0	0	107.7	I60 T62 F85 L97 A111 F133 F137	I60-I73 HydrophobicContact CG2-CG2 3.52Å; T62-I73 HydrophobicContact CG2-CG1 4.42Å; T62-I73 HydrophobicContact CG2-CG2 4.44Å; I73-F85 HydrophobicContact CD1-CD1 4.47Å; I73-F85 PolarHBondContact N-O 3.28Å; I73-F85 PolarHBondContact O-N 2.85Å; I73-L97 HydrophobicContact CD1-CD1 4.04Å; I73-L97 HydrophobicContact CD1-CD2 4.34Å; I73-L97 HydrophobicContact CD1-CG 4.05Å; I73-L97 HydrophobicContact CG1-CG 4.21Å; I73-A111 HydrophobicContact CD1-CB 3.36Å; I73-F133 HydrophobicContact CD1-CE2 4.42Å; I73-F137 HydrophobicContact CB-CZ 4.47Å; I73-F137 HydrophobicContact CG2-CE2 4.12Å; I73-F137 HydrophobicContact CG2-CZ 4.13Å
74	S	93.6	Very high	86.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.6	176.3	-168.7	0	0	0	0	111.5	I60 V61 Y76 P82 L83	I60-S74 CarbonylContact C-O 3.56Å; I60-S74 WeakPolarHBondContact CA-O 3.49Å; V61-S74 PolarHBondContact N-O 3.34Å; V61-S74 PolarHBondContact O-N 2.79Å; S74-Y76 WeakPolarHBondContact OG-CE2 3.17Å; S74-P82 VanDerWaalsContact OG-CB 3.3Å; S74-P82 WeakPolarHBondContact OG-CB 3.33Å; S74-L83 CarbonylContact C-O 3.54Å; S74-L83 VanDerWaalsContact CA-O 3.24Å; S74-L83 WeakPolarHBondContact CA-O 3.1Å; S74-L83 PolarHBondContact OG-O 3.17Å
75	K	91.9	Very high	86.3	Confident	8 Å²	8	57.6 Å²	57.6	4%	0.035	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.4	168.1	173.4	179.7	177.7	-175.4	0	109.8	Y51 D56 I60 L83 H135 F137	Y51-K75 HydrophobicContact CE1-CD 4.17Å; Y51-K75 HydrophobicContact CE1-CG 3.79Å; Y51-K75 WeakPolarHBondContact OH-CE 3.36Å; D56-K75 WeakPolarHBondContact OD2-CE 3.47Å; D56-K75 IonicContact OD2-NZ 2.65Å; D56-K75 PolarHBondContact OD2-NZ 2.87Å; I60-K75 HydrophobicContact CG1-CB 4.31Å; I60-K75 HydrophobicContact CG1-CG 4.45Å; K75-L83 HydrophobicContact CB-CB 4.39Å; K75-L83 PolarHBondContact N-O 2.73Å; K75-L83 PolarHBondContact O-N 2.81Å; K75-H135 PolarHBondContact NZ-O 2.9Å; K75-F137 HydrophobicContact CB-CD1 4.31Å; K75-F137 HydrophobicContact CB-CD2 3.54Å; K75-F137 HydrophobicContact CB-CE1 4.35Å; K75-F137 HydrophobicContact CB-CE2 3.61Å; K75-F137 HydrophobicContact CB-CG 3.93Å; K75-F137 HydrophobicContact CB-CZ 4.02Å; K75-F137 HydrophobicContact CD-CB 3.57Å; K75-F137 HydrophobicContact CD-CD2 3.85Å; K75-F137 HydrophobicContact CD-CG 3.87Å; K75-F137 HydrophobicContact CG-CD2 4.26Å
76	Y	89.5	Confident	85.8	Confident	12 Å²	12	56.8 Å²	56.8	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.2	172.4	-63.3	-99.3	0	0	0	108.3	Y36 F44 Y51 G58 V59 V61 S74 E80 P82	Y36-Y76 AromaticContact CD1-CD1 3.23Å; Y36-Y76 HydrophobicContact CD1-CD1 3.23Å; Y36-Y76 HydrophobicContact CD1-CD2 4.34Å; Y36-Y76 AromaticContact CD1-CE1 3.67Å; Y36-Y76 HydrophobicContact CD1-CE1 3.67Å; Y36-Y76 AromaticContact CD1-CG 3.61Å; Y36-Y76 HydrophobicContact CD1-CG 3.61Å; Y36-Y76 HydrophobicContact CD2-CD2 4.37Å; Y36-Y76 HydrophobicContact CD2-CG 4.22Å; Y36-Y76 AromaticContact CE1-CD1 3.71Å; Y36-Y76 HydrophobicContact CE1-CD1 3.71Å; Y36-Y76 AromaticContact CE1-CG 3.91Å; Y36-Y76 HydrophobicContact CE1-CG 3.91Å; Y36-Y76 HydrophobicContact CE2-CG 4.47Å; Y36-Y76 AromaticContact CG-CD1 3.75Å; Y36-Y76 HydrophobicContact CG-CD1 3.75Å; Y36-Y76 HydrophobicContact CG-CD2 4.06Å; Y36-Y76 AromaticContact CG-CE1 3.98Å; Y36-Y76 HydrophobicContact CG-CE1 3.98Å; Y36-Y76 HydrophobicContact CG-CE2 4.31Å; Y36-Y76 AromaticContact CG-CG 3.78Å; Y36-Y76 HydrophobicContact CG-CG 3.78Å; F44-Y76 HydrophobicContact CE2-CE2 4.04Å; F44-Y76 AromaticContact CZ-CE2 3.73Å; F44-Y76 HydrophobicContact CZ-CE2 3.73Å; F44-Y76 AromaticContact CZ-CZ 3.85Å; F44-Y76 VanDerWaalsContact CZ-OH 3.26Å; F44-Y76 WeakPolarHBondContact CZ-OH 3.24Å; Y51-Y76 PolarHBondContact OH-O 2.91Å; G58-Y76 CarbonylContact C-O 3.49Å; G58-Y76 WeakPolarHBondContact CA-O 3.33Å; V59-Y76 PolarHBondContact N-O 3.32Å; V59-Y76 PolarHBondContact O-N 2.89Å; V61-Y76 HydrophobicContact CB-CE2 4.46Å; V61-Y76 HydrophobicContact CG2-CD2 4.19Å; V61-Y76 HydrophobicContact CG2-CE2 4.17Å; S74-Y76 WeakPolarHBondContact OG-CE2 3.17Å; Y76-E80 WeakPolarHBondContact CD1-O 3.02Å; Y76-P82 HydrophobicContact CD1-CB 4.25Å; Y76-P82 HydrophobicContact CE1-CB 3.67Å; Y76-P82 HydrophobicContact CE1-CG 4.3Å; Y76-P82 HydrophobicContact CE2-CB 4.38Å
77	G	81.1	Confident	85	Confident	14 Å²	14	56.9 Å²	56.9	14%	0.144	30%	0.303	C	S	.	.			trans	-102.2	-164.9	168.2	0	0	0	0	0	111.7	Y51 D79 E80	Y51-G77 WeakPolarHBondContact OH-CA 3.38Å; G77-D79 VanDerWaalsContact C-N 3.25Å; G77-D79 PolarHBondContact O-N 2.95Å; G77-E80 PolarHBondContact O-N 2.8Å; G77-E80 VanDerWaalsContact O-N 3.14Å
78	Q	68.6	Low	84	Confident	118 Å²	118	53.8 Å²	53.8	55%	0.551	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.9	-177.9	-68.8	-173.6	-49.5	0	0	114.1	E80	Q78-E80 PolarHBondContact O-N 3.25Å
79	D	61.8	Low	82.9	Confident	149 Å²	149	52.6 Å²	52.6	80%	0.797	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	6.5	178.9	-68.8	-37.5	0	0	0	114.5	G77 T81	G77-D79 VanDerWaalsContact C-N 3.25Å; G77-D79 PolarHBondContact O-N 2.95Å; D79-T81 PolarHBondContact O-N 2.86Å
80	E	68.4	Low	81.9	Confident	129 Å²	129	55.4 Å²	55.4	60%	0.603	31%	0.309	S	S	*	.			trans	54.3	-10.8	-177.6	-63.1	-162.5	149.4	0	0	117.9	Y76 G77 Q78	Y76-E80 WeakPolarHBondContact CD1-O 3.02Å; G77-E80 PolarHBondContact O-N 2.8Å; G77-E80 VanDerWaalsContact O-N 3.14Å; Q78-E80 PolarHBondContact O-N 3.25Å
81	T	78.1	Confident	80.7	Confident	101 Å²	101	59 Å²	59	62%	0.62	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-72.4	127.4	-177.9	57.8	0	0	0	0	112.3	D79 L83	D79-T81 PolarHBondContact O-N 2.86Å; T81-L83 PolarHBondContact O-N 3.08Å
82	P	86.6	Confident	79.8	Confident	60 Å²	60	63.5 Å²	63.5	39%	0.39	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-80.3	116.8	-174	28.5	-33.9	0	0	0	113.1	S74 Y76	S74-P82 VanDerWaalsContact OG-CB 3.3Å; S74-P82 WeakPolarHBondContact OG-CB 3.33Å; Y76-P82 HydrophobicContact CD1-CB 4.25Å; Y76-P82 HydrophobicContact CE1-CB 3.67Å; Y76-P82 HydrophobicContact CE1-CG 4.3Å; Y76-P82 HydrophobicContact CE2-CB 4.38Å
83	L	89.9	Confident	79.1	Confident	99 Å²	99	66.8 Å²	66.8	52%	0.518	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	117.6	168.1	-71.6	169.9	0	0	0	109.6	S74 K75 T81 F137	S74-L83 CarbonylContact C-O 3.54Å; S74-L83 VanDerWaalsContact CA-O 3.24Å; S74-L83 WeakPolarHBondContact CA-O 3.1Å; S74-L83 PolarHBondContact OG-O 3.17Å; K75-L83 HydrophobicContact CB-CB 4.39Å; K75-L83 PolarHBondContact N-O 2.73Å; K75-L83 PolarHBondContact O-N 2.81Å; T81-L83 PolarHBondContact O-N 3.08Å; L83-F137 HydrophobicContact CB-CD1 4.3Å; L83-F137 HydrophobicContact CB-CE1 4.39Å
84	W	91.8	Very high	78.5	Confident	91 Å²	91	67.8 Å²	67.8	35%	0.345	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	135.2	-173.2	-80.4	98.8	0	0	0	114	F44 A63 Q66	F44-W84 AromaticContact CD2-CH2 3.73Å; F44-W84 HydrophobicContact CD2-CH2 3.73Å; F44-W84 HydrophobicContact CD2-CZ2 4.29Å; F44-W84 AromaticContact CE2-CH2 3.95Å; F44-W84 HydrophobicContact CE2-CH2 3.95Å; F44-W84 HydrophobicContact CE2-CZ2 4.21Å; A63-W84 HydrophobicContact CB-CH2 4.27Å; A63-W84 HydrophobicContact CB-CZ3 4.27Å; Q66-W84 VanDerWaalsContact CD-CZ3 3.43Å; Q66-W84 VanDerWaalsContact NE2-CH2 3.26Å
85	F	92.2	Very high	78.3	Confident	36 Å²	36	71 Å²	71	16%	0.158	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.5	167.8	-177.9	-96.8	0	0	0	110.7	G72 I73 G87 L97 Y131 F133 F137 L139	G72-F85 CarbonylContact C-O 3.54Å; G72-F85 VanDerWaalsContact CA-O 3.27Å; G72-F85 WeakPolarHBondContact CA-O 3.48Å; I73-F85 HydrophobicContact CD1-CD1 4.47Å; I73-F85 PolarHBondContact N-O 3.28Å; I73-F85 PolarHBondContact O-N 2.85Å; F85-G87 VanDerWaalsContact CE1-CA 3.45Å; F85-L97 HydrophobicContact CD1-CD2 3.98Å; F85-L97 HydrophobicContact CE1-CD2 3.93Å; F85-Y131 AromaticContact CE1-CD1 3.76Å; F85-Y131 HydrophobicContact CE1-CD1 3.76Å; F85-Y131 HydrophobicContact CE1-CD2 4.24Å; F85-Y131 AromaticContact CE1-CE1 3.87Å; F85-Y131 HydrophobicContact CE1-CE1 3.87Å; F85-Y131 HydrophobicContact CE1-CE2 4.33Å; F85-Y131 AromaticContact CE1-CG 3.94Å; F85-Y131 HydrophobicContact CE1-CG 3.94Å; F85-Y131 AromaticContact CZ-CD1 3.6Å; F85-Y131 HydrophobicContact CZ-CD1 3.6Å; F85-Y131 AromaticContact CZ-CE1 3.61Å; F85-Y131 HydrophobicContact CZ-CE1 3.61Å; F85-Y131 HydrophobicContact CZ-CG 4.25Å; F85-F133 HydrophobicContact CD1-CE1 4.15Å; F85-F133 AromaticContact CD1-CZ 3.65Å; F85-F133 HydrophobicContact CD1-CZ 3.65Å; F85-F133 HydrophobicContact CD2-CE1 4.2Å; F85-F133 HydrophobicContact CD2-CZ 4.48Å; F85-F133 HydrophobicContact CE1-CE1 4.35Å; F85-F133 AromaticContact CE1-CZ 3.74Å; F85-F133 HydrophobicContact CE1-CZ 3.74Å; F85-F133 HydrophobicContact CE2-CE1 4.42Å; F85-F133 HydrophobicContact CG-CE1 4.06Å; F85-F133 HydrophobicContact CG-CZ 4.03Å; F85-F133 HydrophobicContact CZ-CE1 4.48Å; F85-F133 HydrophobicContact CZ-CZ 4.22Å; F85-F137 HydrophobicContact CB-CE1 3.98Å; F85-F137 HydrophobicContact CB-CZ 4.18Å; F85-L139 HydrophobicContact CE2-CD2 4.01Å; F85-L139 HydrophobicContact CZ-CD2 4.11Å
86	N	85.4	Confident	78.4	Confident	48 Å²	48	73.2 Å²	73.2	26%	0.257	41%	0.405	S	S	.	.			trans	-115	21.7	-172.7	-60.2	-82	0	0	0	112.9	Q66 Q67	Q66-N86 PolarHBondContact OE1-OD1 2.91Å; Q67-N86 PolarHBondContact NE2-OD1 2.96Å; Q67-N86 VanDerWaalsContact NE2-OD1 3.1Å
87	G	75.3	Confident	78.7	Confident	26 Å²	26	72.9 Å²	72.9	27%	0.268	40%	0.403	S	S	.	.			trans	80	168.1	-170.4	0	0	0	0	0	113.7	F85 Y131	F85-G87 VanDerWaalsContact CE1-CA 3.45Å; G87-Y131 WeakPolarHBondContact CA-OH 3.39Å
88	S	67.1	Low	79.2	Confident	53 Å²	53	72.2 Å²	72.2	37%	0.371	40%	0.397	S	S	.	.			trans	-96.8	151.8	171	57.8	0	0	0	0	111	H90 Y131	S88-H90 PolarHBondContact O-N 2.82Å; S88-Y131 PolarHBondContact N-OH 2.94Å; S88-Y131 VanDerWaalsContact N-OH 3.15Å
89	S	62.8	Low	80.5	Confident	124 Å²	124	68.4 Å²	68.4	87%	0.867	38%	0.38	S	S	*	.			trans	-59	136.8	173.9	54.6	0	0	0	0	111.3
90	H	65	Low	82.1	Confident	65 Å²	65	61.7 Å²	61.7	30%	0.301	35%	0.345	S	S	.	.			trans	-141.8	148.8	-174.2	-122.4	52.5	0	0	0	110.7	S88 Y92 K144	S88-H90 PolarHBondContact O-N 2.82Å; H90-Y92 PolarHBondContact O-N 3.27Å; H90-Y92 VanDerWaalsContact O-N 3.13Å; H90-K144 WeakPolarHBondContact NE2-CE 3.44Å; H90-K144 PolarHBondContact NE2-NZ 2.93Å
91	P	65.2	Low	83.3	Confident	107 Å²	107	57 Å²	57	70%	0.695	32%	0.323	S	S	*	.	S	Bend	trans	-71.3	-3.6	-179	30.1	-36.8	0	0	0	113.8
92	Y	73.4	Confident	83.9	Confident	94 Å²	94	53 Å²	53	37%	0.369	30%	0.299	S	S	.	.	S	Bend	trans	-131.4	153.2	179.7	-54.6	-53.9	0	0	0	109.4	H90 A94 H118 F147	H90-Y92 PolarHBondContact O-N 3.27Å; H90-Y92 VanDerWaalsContact O-N 3.13Å; Y92-A94 PolarHBondContact O-N 2.9Å; Y92-H118 HydrophobicContact CD1-CB 3.56Å; Y92-H118 HydrophobicContact CD2-CB 3.94Å; Y92-H118 HydrophobicContact CE1-CB 3.92Å; Y92-H118 HydrophobicContact CE2-CB 4.28Å; Y92-H118 HydrophobicContact CG-CB 3.56Å; Y92-F147 HydrophobicContact CE2-CZ 4.31Å
93	S	77.6	Confident	84	Confident	69 Å²	69	53 Å²	53	48%	0.483	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	100.2	-177.6	-167.2	0	0	0	0	110.3	A117	S93-A117 PolarHBondContact N-O 2.96Å; S93-A117 PolarHBondContact O-N 3.12Å
94	A	83.5	Confident	83.4	Confident	20 Å²	20	49.4 Å²	49.4	17%	0.165	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129	162.6	0	0	0	0	0	108.9	Y92 L116 L129	Y92-A94 PolarHBondContact O-N 2.9Å; A94-L116 HydrophobicContact CB-CD1 3.86Å; A94-L129 HydrophobicContact CB-CD2 4.11Å
95	K	90	Very high	82.1	Confident	69 Å²	69	49.7 Å²	49.7	30%	0.3	29%	0.288	S	S	.	.			trans	-125.4	158.8	175.2	-72	-145.8	174.7	-149.8	0	112.8	N68 G69 S70 L97 S113 S115	N68-K95 PolarHBondContact O-NZ 2.85Å; G69-K95 CarbonylContact O-C 3.54Å; G69-K95 WeakPolarHBondContact O-CA 3.42Å; G69-K95 WeakPolarHBondContact O-CB 3.27Å; G69-K95 WeakPolarHBondContact O-CD 3.15Å; G69-K95 VanDerWaalsContact O-CG 3.28Å; G69-K95 WeakPolarHBondContact O-CG 3.25Å; S70-K95 CarbonylContact O-C 3.52Å; K95-L97 PolarHBondContact O-N 2.86Å; K95-S113 PolarHBondContact N-OG 3.4Å; K95-S113 WeakPolarHBondContact O-CB 3.49Å; K95-S113 PolarHBondContact O-OG 3.04Å; K95-S115 PolarHBondContact N-O 2.04Å; K95-S115 WeakPolarHBondContact O-CB 3.33Å
96	H	93.1	Very high	80.7	Confident	54 Å²	54	53 Å²	53	25%	0.25	30%	0.303	C	S	.	.			trans	58.5	40.6	171.6	-35.6	128.6	0	0	0	114.5	P64 G69 S70 G98 L99 S115	P64-H96 HydrophobicContact CB-CB 4.29Å; P64-H96 WeakPolarHBondContact O-CA 3.48Å; G69-H96 PolarHBondContact O-N 2.98Å; S70-H96 PolarHBondContact O-N 2.8Å; S70-H96 VanDerWaalsContact O-N 3.13Å; H96-G98 PolarHBondContact O-N 3.04Å; H96-L99 HydrophobicContact CB-CD1 3.37Å; H96-L99 HydrophobicContact CB-CG 3.67Å; H96-L99 WeakPolarHBondContact O-CG 3.48Å; H96-L99 PolarHBondContact O-N 3.37Å; H96-S115 WeakPolarHBondContact ND1-CB 3.44Å; H96-S115 PolarHBondContact ND1-OG 3.05Å
97	L	94.9	Very high	79.9	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-57.3	127.3	168.3	175.9	59.3	0	0	0	110.2	S70 I73 F85 K95 Y131	S70-L97 WeakPolarHBondContact O-CB 3.31Å; S70-L97 PolarHBondContact O-N 3.37Å; I73-L97 HydrophobicContact CD1-CD1 4.04Å; I73-L97 HydrophobicContact CD1-CD2 4.34Å; I73-L97 HydrophobicContact CD1-CG 4.05Å; I73-L97 HydrophobicContact CG1-CG 4.21Å; F85-L97 HydrophobicContact CD1-CD2 3.98Å; F85-L97 HydrophobicContact CE1-CD2 3.93Å; K95-L97 PolarHBondContact O-N 2.86Å; L97-Y131 HydrophobicContact CD1-CD2 3.61Å; L97-Y131 HydrophobicContact CD1-CE2 3.73Å; L97-Y131 HydrophobicContact CD2-CD2 4.47Å; L97-Y131 HydrophobicContact CD2-CE2 4.11Å
98	G	93.4	Very high	80.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	14.2	179.9	0	0	0	0	0	114.8	T62 H96 S100 C112	T62-G98 WeakPolarHBondContact CB-O 3.4Å; T62-G98 WeakPolarHBondContact CG2-O 3.47Å; T62-G98 PolarHBondContact OG1-O 3.43Å; H96-G98 PolarHBondContact O-N 3.04Å; G98-S100 VanDerWaalsContact C-N 3.25Å; G98-C112 PolarHBondContact N-O 2.04Å
99	L	94.7	Very high	81.6	Confident	39 Å²	39	53.3 Å²	53.3	20%	0.204	29%	0.292	C	S	.	.	S	Bend	trans	-61.8	-37	163	-78	177	0	0	0	111.6	Y46 P64 H96 P114	Y46-L99 HydrophobicContact CD1-CD2 4.05Å; Y46-L99 HydrophobicContact CE1-CB 4.36Å; Y46-L99 HydrophobicContact CE1-CD2 3.45Å; Y46-L99 VanDerWaalsContact CE1-CD2 3.45Å; Y46-L99 HydrophobicContact CE1-CG 4.48Å; Y46-L99 WeakPolarHBondContact CE1-O 3.29Å; Y46-L99 HydrophobicContact CE2-CD2 4.5Å; P64-L99 HydrophobicContact CB-CD2 3.91Å; P64-L99 HydrophobicContact CB-CG 4.07Å; P64-L99 HydrophobicContact CG-CD2 4.05Å; H96-L99 HydrophobicContact CB-CD1 3.37Å; H96-L99 HydrophobicContact CB-CG 3.67Å; H96-L99 WeakPolarHBondContact O-CG 3.48Å; H96-L99 PolarHBondContact O-N 3.37Å; L99-P114 HydrophobicContact CB-CG 4.05Å; L99-P114 HydrophobicContact CD1-CG 3.73Å
100	S	95	Very high	83	Confident	8 Å²	8	48 Å²	48	6%	0.056	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.7	170.8	76.5	0	0	0	0	110.7	G98 A111 C112 G356	G98-S100 VanDerWaalsContact C-N 3.25Å; S100-A111 WeakPolarHBondContact O-CA 3.31Å; S100-C112 PolarHBondContact O-N 2.69Å; S100-C112 VanDerWaalsContact O-N 3.15Å; S100-C112 WeakPolarHBondContact OG-CB 3.45Å; S100-G356 PolarHBondContact OG-O 2.84Å
101	I	94.3	Very high	84.5	Confident	29 Å²	29	45 Å²	45	15%	0.149	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143.5	168.8	-171.7	168.7	0	0	0	107.7	K47 L49 I60 F109 I110 A111	K47-I101 HydrophobicContact CB-CG2 3.82Å; K47-I101 HydrophobicContact CG-CG2 4.42Å; L49-I101 HydrophobicContact CD2-CD1 3.81Å; L49-I101 HydrophobicContact CD2-CG1 4Å; I60-I101 HydrophobicContact CB-CD1 4.44Å; I60-I101 HydrophobicContact CG2-CD1 3.62Å; I101-F109 HydrophobicContact CD1-CD2 3.8Å; I101-F109 HydrophobicContact CD1-CE2 4.31Å; I101-F109 HydrophobicContact CG1-CD2 4.16Å; I101-I110 CarbonylContact C-O 3.57Å; I101-I110 WeakPolarHBondContact CA-O 3.38Å; I101-A111 HydrophobicContact CB-CB 4.48Å; I101-A111 HydrophobicContact CG1-CB 4.31Å
102	T	91.7	Very high	85.9	Confident	19 Å²	19	39.9 Å²	39.9	12%	0.117	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.7	174.8	-165	0	0	0	0	109.4	F109 I110 A359 L366	T102-F109 CarbonylContact O-C 3.56Å; T102-F109 WeakPolarHBondContact O-CA 3.21Å; T102-F109 WeakPolarHBondContact O-CB 3.39Å; T102-I110 HydrophobicContact CG2-CB 4.2Å; T102-I110 PolarHBondContact N-O 3.03Å; T102-I110 PolarHBondContact O-N 3.3Å; T102-A359 WeakPolarHBondContact CB-O 3.43Å; T102-A359 HydrophobicContact CG2-CB 3.85Å; T102-A359 PolarHBondContact OG1-O 2.98Å; T102-L366 HydrophobicContact CG2-CD1 4.12Å
103	M	86.9	Confident	86.9	Confident	60 Å²	60	35.4 Å²	35.4	30%	0.296	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	147.1	177.7	-162.8	153.8	64.4	0	0	110.1	L49 Q50 R108	L49-M103 HydrophobicContact CD1-CB 4.31Å; L49-M103 HydrophobicContact CD1-CE 4.18Å; L49-M103 HydrophobicContact CD2-CB 4.13Å; L49-M103 HydrophobicContact CD2-SD 4.29Å; Q50-M103 WeakPolarHBondContact O-CE 3.27Å; M103-R108 WeakPolarHBondContact CG-O 3.33Å
104	D	77.7	Confident	87.6	Confident	22 Å²	22	32.2 Å²	32.2	12%	0.118	17%	0.166	C	C	.	.			trans	-106.8	161.6	-177.3	-173.8	41	0	0	0	111.1	E106 S107 R108 S361	D104-E106 PolarHBondContact O-N 2.74Å; D104-E106 VanDerWaalsContact O-N 3.09Å; D104-S107 WeakPolarHBondContact O-CA 3.43Å; D104-S107 PolarHBondContact O-N 2.76Å; D104-R108 HydrophobicContact CB-CB 4.22Å; D104-R108 WeakPolarHBondContact CB-O 3.39Å; D104-R108 PolarHBondContact N-O 2.99Å; D104-S361 WeakPolarHBondContact OD1-CB 3.34Å; D104-S361 PolarHBondContact OD1-OG 2.76Å
105	T	65.4	Low	88	Confident	98 Å²	98	31.9 Å²	31.9	60%	0.601	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.1	-174.5	41.6	0	0	0	0	114.5
106	E	62.8	Low	88.2	Confident	104 Å²	104	28.6 Å²	28.6	49%	0.486	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	21.1	170.9	-60	-163.5	133	0	0	113.5	D104 R108	D104-E106 PolarHBondContact O-N 2.74Å; D104-E106 VanDerWaalsContact O-N 3.09Å; E106-R108 PolarHBondContact O-N 2.74Å; E106-R108 IonicContact OE2-CZ 3.26Å; E106-R108 IonicContact OE2-NE 2.66Å; E106-R108 IonicContact OE2-NH1 3.06Å; E106-R108 PolarHBondContact OE2-NH1 2.88Å; E106-R108 IonicContact OE2-NH2 2.68Å; E106-R108 PolarHBondContact OE2-NH2 3.33Å
107	S	68.8	Low	88	Confident	43 Å²	43	27.6 Å²	27.6	30%	0.301	15%	0.15	S	C	.	.	S	Bend	trans	55.5	19.1	-173.3	-55.8	0	0	0	0	114.6	D104 H135	D104-S107 WeakPolarHBondContact O-CA 3.43Å; D104-S107 PolarHBondContact O-N 2.76Å; S107-H135 WeakPolarHBondContact O-CA 3.04Å; S107-H135 WeakPolarHBondContact O-CB 3.07Å; S107-H135 PolarHBondContact O-N 2.88Å
108	R	86.3	Confident	87.6	Confident	90 Å²	90	27.6 Å²	27.6	34%	0.34	15%	0.15	S	C	.	.			trans	-74.1	151	164.8	-63.1	-173.5	-173.1	112.2	12.4	109	M103 D104 E106 F133	M103-R108 WeakPolarHBondContact CG-O 3.33Å; D104-R108 HydrophobicContact CB-CB 4.22Å; D104-R108 WeakPolarHBondContact CB-O 3.39Å; D104-R108 PolarHBondContact N-O 2.99Å; E106-R108 PolarHBondContact O-N 2.74Å; E106-R108 IonicContact OE2-CZ 3.26Å; E106-R108 IonicContact OE2-NE 2.66Å; E106-R108 IonicContact OE2-NH1 3.06Å; E106-R108 PolarHBondContact OE2-NH1 2.88Å; E106-R108 IonicContact OE2-NH2 2.68Å; E106-R108 PolarHBondContact OE2-NH2 3.33Å; R108-F133 VanDerWaalsContact CA-O 3.32Å; R108-F133 WeakPolarHBondContact CA-O 3.38Å; R108-F133 WeakPolarHBondContact CB-O 3.48Å
109	F	90.9	Very high	87	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149.6	173.5	74.1	-88.2	0	0	0	111.7	L49 I60 I101 T102 F133 T134 F137	L49-F109 HydrophobicContact CD2-CB 4.37Å; I60-F109 HydrophobicContact CD1-CD1 3.64Å; I60-F109 HydrophobicContact CD1-CD2 4.29Å; I60-F109 HydrophobicContact CD1-CE1 3.6Å; I60-F109 HydrophobicContact CD1-CE2 4.25Å; I60-F109 HydrophobicContact CD1-CG 4.01Å; I60-F109 HydrophobicContact CD1-CZ 3.93Å; I101-F109 HydrophobicContact CD1-CD2 3.8Å; I101-F109 HydrophobicContact CD1-CE2 4.31Å; I101-F109 HydrophobicContact CG1-CD2 4.16Å; T102-F109 CarbonylContact O-C 3.56Å; T102-F109 WeakPolarHBondContact O-CA 3.21Å; T102-F109 WeakPolarHBondContact O-CB 3.39Å; F109-F133 HydrophobicContact CD1-CB 3.88Å; F109-F133 HydrophobicContact CD2-CB 4.33Å; F109-F133 AromaticContact CD2-CD2 3.87Å; F109-F133 HydrophobicContact CD2-CD2 3.87Å; F109-F133 HydrophobicContact CD2-CG 4.42Å; F109-F133 HydrophobicContact CE1-CB 3.38Å; F109-F133 HydrophobicContact CE1-CD2 4.38Å; F109-F133 AromaticContact CE1-CG 4Å; F109-F133 HydrophobicContact CE1-CG 4Å; F109-F133 HydrophobicContact CE2-CB 3.89Å; F109-F133 AromaticContact CE2-CD2 3.26Å; F109-F133 HydrophobicContact CE2-CD2 3.26Å; F109-F133 AromaticContact CE2-CE2 3.81Å; F109-F133 HydrophobicContact CE2-CE2 3.81Å; F109-F133 AromaticContact CE2-CG 3.68Å; F109-F133 HydrophobicContact CE2-CG 3.68Å; F109-F133 HydrophobicContact CG-CB 4.32Å; F109-F133 HydrophobicContact CZ-CB 3.37Å; F109-F133 HydrophobicContact CZ-CD1 4.04Å; F109-F133 AromaticContact CZ-CD2 3.55Å; F109-F133 HydrophobicContact CZ-CD2 3.55Å; F109-F133 HydrophobicContact CZ-CE2 4.27Å; F109-F133 AromaticContact CZ-CG 3.41Å; F109-F133 HydrophobicContact CZ-CG 3.41Å; F109-F133 VanDerWaalsContact CZ-CG 3.41Å; F109-F133 PolarHBondContact N-O 2.6Å; F109-F133 PolarHBondContact O-N 3.27Å; F109-T134 WeakPolarHBondContact CE1-O 3.18Å; F109-F137 AromaticContact CE1-CD2 3.74Å; F109-F137 HydrophobicContact CE1-CD2 3.74Å; F109-F137 HydrophobicContact CE1-CE2 4.32Å; F109-F137 HydrophobicContact CE2-CE2 4.32Å; F109-F137 AromaticContact CZ-CD2 3.37Å; F109-F137 HydrophobicContact CZ-CD2 3.37Å; F109-F137 AromaticContact CZ-CE2 3.55Å; F109-F137 HydrophobicContact CZ-CE2 3.55Å; F109-F137 HydrophobicContact CZ-CG 4.37Å
110	I	93.1	Very high	86	Confident	13 Å²	13	30.2 Å²	30.2	7%	0.067	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.9	-178.5	-66	175.6	0	0	0	108.3	I101 T102 C130 Y131 N132 F143 L366	I101-I110 CarbonylContact C-O 3.57Å; I101-I110 WeakPolarHBondContact CA-O 3.38Å; T102-I110 HydrophobicContact CG2-CB 4.2Å; T102-I110 PolarHBondContact N-O 3.03Å; T102-I110 PolarHBondContact O-N 3.3Å; I110-C130 HydrophobicContact CG2-CB 4.48Å; I110-Y131 VanDerWaalsContact CA-O 3.31Å; I110-Y131 WeakPolarHBondContact CA-O 3.35Å; I110-N132 HydrophobicContact CD1-CB 4.43Å; I110-N132 HydrophobicContact CG1-CB 3.97Å; I110-F143 HydrophobicContact CG2-CZ 4.37Å; I110-L366 HydrophobicContact CD1-CD1 3.95Å; I110-L366 HydrophobicContact CD1-CD2 3.57Å; I110-L366 HydrophobicContact CD1-CG 4.31Å
111	A	94.8	Very high	84.9	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.4	177.6	0	0	0	0	0	110.5	I73 S100 I101 C130 Y131	I73-A111 HydrophobicContact CD1-CB 3.36Å; S100-A111 WeakPolarHBondContact O-CA 3.31Å; I101-A111 HydrophobicContact CB-CB 4.48Å; I101-A111 HydrophobicContact CG1-CB 4.31Å; A111-C130 WeakPolarHBondContact O-CA 3.39Å; A111-Y131 PolarHBondContact N-O 3.14Å; A111-Y131 PolarHBondContact O-N 3.21Å
112	C	95.1	Very high	83.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154	-174.5	-60.8	0	0	0	0	113.2	G98 S100 C130	G98-C112 PolarHBondContact N-O 2.04Å; S100-C112 PolarHBondContact O-N 2.69Å; S100-C112 VanDerWaalsContact O-N 3.15Å; S100-C112 WeakPolarHBondContact OG-CB 3.45Å; C112-C130 HydrophobicContact CB-CB 4.12Å; C112-C130 WeakPolarHBondContact CB-SG 3.39Å; C112-C130 WeakPolarHBondContact SG-CB 3.47Å; C112-C130 CovalentContact SG-SG 2.05Å; C112-C130 PolarHBondContact SG-SG 2.95Å
113	S	94.9	Very high	82.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	95.6	164.4	160.6	0	0	0	0	106.9	K95 S115 S128 L129	K95-S113 PolarHBondContact N-OG 3.4Å; K95-S113 WeakPolarHBondContact O-CB 3.49Å; K95-S113 PolarHBondContact O-OG 3.04Å; S113-S115 PolarHBondContact O-N 3.36Å; S113-S128 VanDerWaalsContact O-CA 3.24Å; S113-S128 WeakPolarHBondContact O-CA 3.09Å; S113-S128 WeakPolarHBondContact O-CB 3.46Å; S113-L129 WeakPolarHBondContact CB-O 3.48Å; S113-L129 PolarHBondContact N-O 2.84Å; S113-L129 PolarHBondContact O-N 2.8Å
114	P	92.9	Very high	82.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	37	176.7	34.5	-35.8	0	0	0	111.7	L99 S128 Q354 F357	L99-P114 HydrophobicContact CB-CG 4.05Å; L99-P114 HydrophobicContact CD1-CG 3.73Å; P114-S128 WeakPolarHBondContact CA-OG 3.39Å; P114-Q354 HydrophobicContact CB-CB 4.41Å; P114-Q354 PolarHBondContact O-NE2 2.04Å; P114-F357 HydrophobicContact CB-CB 4.41Å; P114-F357 HydrophobicContact CB-CD2 4.46Å
115	S	92.3	Very high	82.6	Confident	13 Å²	13	44 Å²	44	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	52.4	-177.8	-58.2	0	0	0	0	111.3	K95 H96 S113 A117	K95-S115 PolarHBondContact N-O 2.04Å; K95-S115 WeakPolarHBondContact O-CB 3.33Å; H96-S115 WeakPolarHBondContact ND1-CB 3.44Å; H96-S115 PolarHBondContact ND1-OG 3.05Å; S113-S115 PolarHBondContact O-N 3.36Å; S115-A117 PolarHBondContact O-N 3.07Å
116	L	92.4	Very high	83.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	92.8	169.1	-179.1	69.8	0	0	0	108.7	A94 N127 L129 K144 F147	A94-L116 HydrophobicContact CB-CD1 3.86Å; L116-N127 PolarHBondContact N-O 2.86Å; L116-N127 PolarHBondContact O-N 3.04Å; L116-N127 VanDerWaalsContact O-N 3.08Å; L116-L129 HydrophobicContact CD2-CB 4.37Å; L116-K144 HydrophobicContact CD2-CD 3.99Å; L116-K144 HydrophobicContact CD2-CG 4.38Å; L116-F147 HydrophobicContact CD2-CD2 3.99Å; L116-F147 HydrophobicContact CD2-CE2 3.72Å
117	A	90.1	Very high	85.2	Confident	34 Å²	34	36.4 Å²	36.4	28%	0.281	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.3	-179.6	0	0	0	0	0	111	S93 S115 V124 Y125 L126	S93-A117 PolarHBondContact N-O 2.96Å; S93-A117 PolarHBondContact O-N 3.12Å; S115-A117 PolarHBondContact O-N 3.07Å; A117-V124 HydrophobicContact CB-CG1 4.12Å; A117-Y125 WeakPolarHBondContact CA-O 3.45Å; A117-L126 HydrophobicContact CB-CD1 4.13Å
118	H	85.6	Confident	86.4	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.019	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.8	175	69.1	113.2	0	0	0	112	Y92 Y125 N127 F147 Q148	Y92-H118 HydrophobicContact CD1-CB 3.56Å; Y92-H118 HydrophobicContact CD2-CB 3.94Å; Y92-H118 HydrophobicContact CE1-CB 3.92Å; Y92-H118 HydrophobicContact CE2-CB 4.28Å; Y92-H118 HydrophobicContact CG-CB 3.56Å; H118-Y125 AromaticContact CE1-CD2 3.72Å; H118-Y125 PolarHBondContact N-O 2.84Å; H118-Y125 WeakPolarHBondContact NE2-CB 3.2Å; H118-Y125 AromaticContact NE2-CD2 3.93Å; H118-Y125 PolarHBondContact O-N 2.85Å; H118-N127 PolarHBondContact NE2-OD1 2.86Å; H118-F147 AromaticContact CD2-CE2 3.79Å; H118-F147 AromaticContact CD2-CZ 3.97Å; H118-F147 AromaticContact CE1-CZ 3.53Å; H118-F147 AromaticContact ND1-CZ 3.81Å; H118-F147 AromaticContact NE2-CE2 3.58Å; H118-F147 AromaticContact NE2-CZ 3.6Å; H118-Q148 PolarHBondContact CE1-O 3.36Å; H118-Q148 PolarHBondContact NE2-O 2.94Å
119	P	81.3	Confident	86.7	Confident	90 Å²	90	30.1 Å²	30.1	58%	0.584	17%	0.167	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	143	-176.2	31.7	-34.8	0	0	0	112.2
120	C	73.4	Confident	86.8	Confident	3 Å²	3	30 Å²	30	2%	0.02	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	100.5	167	-171.5	0	0	0	0	109.1	E122 N123 Y125 C150	C120-E122 PolarHBondContact O-N 2.96Å; C120-N123 CarbonylContact C-O 3.58Å; C120-N123 PolarHBondContact N-O 3.26Å; C120-N123 WeakPolarHBondContact O-CA 3.43Å; C120-N123 WeakPolarHBondContact O-CB 3.36Å; C120-N123 PolarHBondContact O-N 3.21Å; C120-Y125 HydrophobicContact CB-CD1 4.08Å; C120-Y125 HydrophobicContact CB-CD2 4.25Å; C120-Y125 HydrophobicContact CB-CE1 3.74Å; C120-Y125 HydrophobicContact CB-CE2 3.93Å; C120-Y125 HydrophobicContact CB-CG 4.31Å; C120-Y125 PolarHBondContact SG-OH 3.02Å; C120-C150 WeakPolarHBondContact CA-SG 3.39Å; C120-C150 HydrophobicContact CB-CB 3.58Å; C120-C150 WeakPolarHBondContact CB-SG 3.25Å; C120-C150 WeakPolarHBondContact SG-CA 3.28Å; C120-C150 WeakPolarHBondContact SG-CB 3.41Å; C120-C150 CovalentContact SG-SG 2.04Å; C120-C150 PolarHBondContact SG-SG 3.29Å
121	D	71.9	Confident	86.8	Confident	55 Å²	55	29.6 Å²	29.6	29%	0.294	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-126.2	-173	-53.6	-30	0	0	0	111.6	N123 K152	D121-N123 PolarHBondContact O-N 2.96Å; D121-K152 VanDerWaalsContact OD1-CE 3.31Å; D121-K152 WeakPolarHBondContact OD1-CE 3.28Å; D121-K152 IonicContact OD1-NZ 3.48Å; D121-K152 PolarHBondContact OD1-NZ 2.92Å
122	E	64.2	Low	86.6	Confident	160 Å²	160	31.2 Å²	31.2	75%	0.748	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.6	174.2	-62.4	-170	165.9	0	0	113.2	C120	C120-E122 PolarHBondContact O-N 2.96Å
123	N	68.3	Low	86.4	Confident	98 Å²	98	31.3 Å²	31.3	52%	0.524	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	160	-178	-61.1	-74.5	0	0	0	112.4	C120 D121 Y125	C120-N123 CarbonylContact C-O 3.58Å; C120-N123 PolarHBondContact N-O 3.26Å; C120-N123 WeakPolarHBondContact O-CA 3.43Å; C120-N123 WeakPolarHBondContact O-CB 3.36Å; C120-N123 PolarHBondContact O-N 3.21Å; D121-N123 PolarHBondContact O-N 2.96Å; N123-Y125 HydrophobicContact CB-CE1 4.35Å
124	V	82.1	Confident	86	Confident	84 Å²	84	32.3 Å²	32.3	51%	0.509	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.3	167.9	179.4	0	0	0	0	108.3	A117 M352	A117-V124 HydrophobicContact CB-CG1 4.12Å; V124-M352 WeakPolarHBondContact O-CE 3.47Å
125	Y	87.8	Confident	85.2	Confident	31 Å²	31	35.1 Å²	35.1	12%	0.122	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	144.9	174.3	-69.6	4.4	0	0	0	109.7	A117 H118 C120 N123 Q148 E351	A117-Y125 WeakPolarHBondContact CA-O 3.45Å; H118-Y125 AromaticContact CE1-CD2 3.72Å; H118-Y125 PolarHBondContact N-O 2.84Å; H118-Y125 WeakPolarHBondContact NE2-CB 3.2Å; H118-Y125 AromaticContact NE2-CD2 3.93Å; H118-Y125 PolarHBondContact O-N 2.85Å; C120-Y125 HydrophobicContact CB-CD1 4.08Å; C120-Y125 HydrophobicContact CB-CD2 4.25Å; C120-Y125 HydrophobicContact CB-CE1 3.74Å; C120-Y125 HydrophobicContact CB-CE2 3.93Å; C120-Y125 HydrophobicContact CB-CG 4.31Å; C120-Y125 PolarHBondContact SG-OH 3.02Å; N123-Y125 HydrophobicContact CB-CE1 4.35Å; Y125-Q148 HydrophobicContact CD2-CB 4.39Å; Y125-Q148 HydrophobicContact CD2-CG 4.05Å; Y125-Q148 HydrophobicContact CE2-CG 3.84Å; Y125-E351 CarbonylContact C-O 3.44Å; Y125-E351 VanDerWaalsContact CA-O 3.27Å; Y125-E351 WeakPolarHBondContact CA-O 3.43Å; Y125-E351 WeakPolarHBondContact CB-O 3.28Å; Y125-E351 HydrophobicContact CD1-CB 3.84Å; Y125-E351 HydrophobicContact CD1-CG 4.03Å; Y125-E351 HydrophobicContact CD2-CB 4.4Å; Y125-E351 HydrophobicContact CD2-CG 4.3Å; Y125-E351 HydrophobicContact CE1-CB 3.97Å; Y125-E351 HydrophobicContact CE1-CG 3.63Å; Y125-E351 HydrophobicContact CE2-CG 3.93Å; Y125-E351 HydrophobicContact CG-CB 4.09Å; Y125-E351 HydrophobicContact CG-CG 4.36Å
126	L	91.3	Very high	84.6	Confident	43 Å²	43	36.9 Å²	36.9	23%	0.225	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	82.6	-177.6	-165.5	67.1	0	0	0	110.4	A117 E351 M352 A353 Q354	A117-L126 HydrophobicContact CB-CD1 4.13Å; L126-E351 PolarHBondContact N-O 2.8Å; L126-M352 HydrophobicContact CB-SD 3.66Å; L126-M352 CarbonylContact O-C 3.46Å; L126-A353 PolarHBondContact O-N 2.94Å; L126-Q354 HydrophobicContact CD2-CG 3.93Å; L126-Q354 HydrophobicContact CG-CG 4.06Å; L126-Q354 PolarHBondContact O-N 2.87Å
127	N	92.1	Very high	84.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-154	174.6	-62.6	102.1	0	0	0	109.9	L116 H118 L146 F147 Q148 N350	L116-N127 PolarHBondContact N-O 2.86Å; L116-N127 PolarHBondContact O-N 3.04Å; L116-N127 VanDerWaalsContact O-N 3.08Å; H118-N127 PolarHBondContact NE2-OD1 2.86Å; N127-L146 PolarHBondContact ND2-O 3.22Å; N127-F147 HydrophobicContact CB-CD2 3.71Å; N127-F147 HydrophobicContact CB-CE2 4.13Å; N127-Q148 PolarHBondContact ND2-N 3.44Å; N127-N350 PolarHBondContact ND2-O 3.46Å
128	S	93.1	Very high	84.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.4	-170	-52	0	0	0	0	113.2	S113 P114 K144 Q354 S355	S113-S128 VanDerWaalsContact O-CA 3.24Å; S113-S128 WeakPolarHBondContact O-CA 3.09Å; S113-S128 WeakPolarHBondContact O-CB 3.46Å; P114-S128 WeakPolarHBondContact CA-OG 3.39Å; S128-K144 WeakPolarHBondContact O-CA 3.18Å; S128-Q354 VanDerWaalsContact OG-CA 3.29Å; S128-Q354 WeakPolarHBondContact OG-CA 3.48Å; S128-S355 WeakPolarHBondContact CB-O 3.41Å; S128-S355 PolarHBondContact OG-N 2.83Å; S128-S355 PolarHBondContact OG-O 2.89Å
129	L	92.9	Very high	84.5	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	117.8	177.7	-179.5	59.8	0	0	0	108.6	A94 S113 L116 Y131 K144	A94-L129 HydrophobicContact CB-CD2 4.11Å; S113-L129 WeakPolarHBondContact CB-O 3.48Å; S113-L129 PolarHBondContact N-O 2.84Å; S113-L129 PolarHBondContact O-N 2.8Å; L116-L129 HydrophobicContact CD2-CB 4.37Å; L129-Y131 HydrophobicContact CD2-CE2 4.1Å; L129-Y131 VanDerWaalsContact CD2-OH 3.3Å; L129-Y131 WeakPolarHBondContact CD2-OH 3.33Å; L129-Y131 HydrophobicContact CG-CE2 3.88Å; L129-K144 HydrophobicContact CD1-CG 3.97Å
130	C	93.1	Very high	84.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	149.8	178.6	-63.7	0	0	0	0	110.7	I110 A111 C112 S142 F143	I110-C130 HydrophobicContact CG2-CB 4.48Å; A111-C130 WeakPolarHBondContact O-CA 3.39Å; C112-C130 HydrophobicContact CB-CB 4.12Å; C112-C130 WeakPolarHBondContact CB-SG 3.39Å; C112-C130 WeakPolarHBondContact SG-CB 3.47Å; C112-C130 CovalentContact SG-SG 2.05Å; C112-C130 PolarHBondContact SG-SG 2.95Å; C130-S142 CarbonylContact O-C 3.57Å; C130-S142 VanDerWaalsContact O-CA 3.23Å; C130-S142 WeakPolarHBondContact O-CA 3.08Å; C130-F143 HydrophobicContact CB-CD1 4.27Å; C130-F143 HydrophobicContact CB-CD2 4.17Å; C130-F143 HydrophobicContact CB-CE1 3.75Å; C130-F143 HydrophobicContact CB-CE2 3.65Å; C130-F143 HydrophobicContact CB-CG 4.46Å; C130-F143 HydrophobicContact CB-CZ 3.42Å; C130-F143 VanDerWaalsContact CB-CZ 3.42Å; C130-F143 PolarHBondContact N-O 3.46Å; C130-F143 PolarHBondContact O-N 2.88Å
131	Y	93	Very high	85.6	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.2	-179.3	-60.4	-94.6	0	0	0	108.9	F85 G87 S88 L97 I110 A111 L129 F133 L139	F85-Y131 AromaticContact CE1-CD1 3.76Å; F85-Y131 HydrophobicContact CE1-CD1 3.76Å; F85-Y131 HydrophobicContact CE1-CD2 4.24Å; F85-Y131 AromaticContact CE1-CE1 3.87Å; F85-Y131 HydrophobicContact CE1-CE1 3.87Å; F85-Y131 HydrophobicContact CE1-CE2 4.33Å; F85-Y131 AromaticContact CE1-CG 3.94Å; F85-Y131 HydrophobicContact CE1-CG 3.94Å; F85-Y131 AromaticContact CZ-CD1 3.6Å; F85-Y131 HydrophobicContact CZ-CD1 3.6Å; F85-Y131 AromaticContact CZ-CE1 3.61Å; F85-Y131 HydrophobicContact CZ-CE1 3.61Å; F85-Y131 HydrophobicContact CZ-CG 4.25Å; G87-Y131 WeakPolarHBondContact CA-OH 3.39Å; S88-Y131 PolarHBondContact N-OH 2.94Å; S88-Y131 VanDerWaalsContact N-OH 3.15Å; L97-Y131 HydrophobicContact CD1-CD2 3.61Å; L97-Y131 HydrophobicContact CD1-CE2 3.73Å; L97-Y131 HydrophobicContact CD2-CD2 4.47Å; L97-Y131 HydrophobicContact CD2-CE2 4.11Å; I110-Y131 VanDerWaalsContact CA-O 3.31Å; I110-Y131 WeakPolarHBondContact CA-O 3.35Å; A111-Y131 PolarHBondContact N-O 3.14Å; A111-Y131 PolarHBondContact O-N 3.21Å; L129-Y131 HydrophobicContact CD2-CE2 4.1Å; L129-Y131 VanDerWaalsContact CD2-OH 3.3Å; L129-Y131 WeakPolarHBondContact CD2-OH 3.33Å; L129-Y131 HydrophobicContact CG-CE2 3.88Å; Y131-F133 VanDerWaalsContact CB-CE2 3.43Å; Y131-F133 HydrophobicContact CG-CZ 4.47Å; Y131-L139 HydrophobicContact CD1-CD1 3.87Å; Y131-L139 HydrophobicContact CD1-CD2 4.42Å; Y131-L139 HydrophobicContact CG-CD1 4.4Å
132	N	91.8	Very high	86.5	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.182	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.5	-178.7	-177.9	0.6	0	0	0	109.7	I110 L140 S141 F143	I110-N132 HydrophobicContact CD1-CB 4.43Å; I110-N132 HydrophobicContact CG1-CB 3.97Å; N132-L140 WeakPolarHBondContact O-CB 3.12Å; N132-L140 PolarHBondContact O-N 2.89Å; N132-S141 PolarHBondContact N-O 2.85Å; N132-S141 PolarHBondContact O-N 2.76Å; N132-F143 HydrophobicContact CB-CE1 4.48Å
133	F	90.8	Very high	87.7	Confident	1 Å²	1	41.9 Å²	41.9	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.8	-169.5	-59	-95.3	0	0	0	113.2	I73 F85 R108 F109 Y131 E138 L139	I73-F133 HydrophobicContact CD1-CE2 4.42Å; F85-F133 HydrophobicContact CD1-CE1 4.15Å; F85-F133 AromaticContact CD1-CZ 3.65Å; F85-F133 HydrophobicContact CD1-CZ 3.65Å; F85-F133 HydrophobicContact CD2-CE1 4.2Å; F85-F133 HydrophobicContact CD2-CZ 4.48Å; F85-F133 HydrophobicContact CE1-CE1 4.35Å; F85-F133 AromaticContact CE1-CZ 3.74Å; F85-F133 HydrophobicContact CE1-CZ 3.74Å; F85-F133 HydrophobicContact CE2-CE1 4.42Å; F85-F133 HydrophobicContact CG-CE1 4.06Å; F85-F133 HydrophobicContact CG-CZ 4.03Å; F85-F133 HydrophobicContact CZ-CE1 4.48Å; F85-F133 HydrophobicContact CZ-CZ 4.22Å; R108-F133 VanDerWaalsContact CA-O 3.32Å; R108-F133 WeakPolarHBondContact CA-O 3.38Å; R108-F133 WeakPolarHBondContact CB-O 3.48Å; F109-F133 HydrophobicContact CD1-CB 3.88Å; F109-F133 HydrophobicContact CD2-CB 4.33Å; F109-F133 AromaticContact CD2-CD2 3.87Å; F109-F133 HydrophobicContact CD2-CD2 3.87Å; F109-F133 HydrophobicContact CD2-CG 4.42Å; F109-F133 HydrophobicContact CE1-CB 3.38Å; F109-F133 HydrophobicContact CE1-CD2 4.38Å; F109-F133 AromaticContact CE1-CG 4Å; F109-F133 HydrophobicContact CE1-CG 4Å; F109-F133 HydrophobicContact CE2-CB 3.89Å; F109-F133 AromaticContact CE2-CD2 3.26Å; F109-F133 HydrophobicContact CE2-CD2 3.26Å; F109-F133 AromaticContact CE2-CE2 3.81Å; F109-F133 HydrophobicContact CE2-CE2 3.81Å; F109-F133 AromaticContact CE2-CG 3.68Å; F109-F133 HydrophobicContact CE2-CG 3.68Å; F109-F133 HydrophobicContact CG-CB 4.32Å; F109-F133 HydrophobicContact CZ-CB 3.37Å; F109-F133 HydrophobicContact CZ-CD1 4.04Å; F109-F133 AromaticContact CZ-CD2 3.55Å; F109-F133 HydrophobicContact CZ-CD2 3.55Å; F109-F133 HydrophobicContact CZ-CE2 4.27Å; F109-F133 AromaticContact CZ-CG 3.41Å; F109-F133 HydrophobicContact CZ-CG 3.41Å; F109-F133 VanDerWaalsContact CZ-CG 3.41Å; F109-F133 PolarHBondContact N-O 2.6Å; F109-F133 PolarHBondContact O-N 3.27Å; Y131-F133 VanDerWaalsContact CB-CE2 3.43Å; Y131-F133 HydrophobicContact CG-CZ 4.47Å; F133-E138 CarbonylContact C-O 3.54Å; F133-E138 WeakPolarHBondContact CA-O 3.38Å; F133-L139 HydrophobicContact CD1-CB 4.13Å; F133-L139 HydrophobicContact CD1-CD1 4.11Å; F133-L139 HydrophobicContact CE1-CB 4.03Å; F133-L139 HydrophobicContact CE1-CD1 3.75Å; F133-L139 HydrophobicContact CE1-CG 4.48Å; F133-L139 HydrophobicContact CE2-CD1 4.49Å; F133-L139 HydrophobicContact CZ-CD1 3.96Å
134	T	86.3	Confident	88.8	Confident	22 Å²	22	40.4 Å²	40.4	14%	0.135	21%	0.213	C	C	.	.			trans	-74.7	164.5	165.2	65.8	0	0	0	0	111.8	F109 D136 F137 E138 L140	F109-T134 WeakPolarHBondContact CE1-O 3.18Å; T134-D136 PolarHBondContact O-N 2.74Å; T134-D136 PolarHBondContact OG1-N 2.96Å; T134-F137 WeakPolarHBondContact O-CA 3.44Å; T134-F137 PolarHBondContact O-N 2.89Å; T134-F137 PolarHBondContact OG1-N 3.2Å; T134-E138 HydrophobicContact CG2-CB 4.23Å; T134-E138 PolarHBondContact N-O 2.04Å; T134-E138 WeakPolarHBondContact OG1-CB 3.37Å; T134-E138 PolarHBondContact OG1-N 3.21Å; T134-L140 HydrophobicContact CG2-CD1 4.01Å; T134-L140 HydrophobicContact CG2-CD2 3.63Å; T134-L140 HydrophobicContact CG2-CG 3.83Å
135	H	75.6	Confident	89	Confident	61 Å²	61	36.5 Å²	36.5	28%	0.282	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29	167.1	48.8	-102.5	0	0	0	112.8	K75 S107 F137	K75-H135 PolarHBondContact NZ-O 2.9Å; S107-H135 WeakPolarHBondContact O-CA 3.04Å; S107-H135 WeakPolarHBondContact O-CB 3.07Å; S107-H135 PolarHBondContact O-N 2.88Å; H135-F137 PolarHBondContact O-N 2.96Å
136	D	79.4	Confident	88.9	Confident	50 Å²	50	36.5 Å²	36.5	27%	0.267	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	3	175.1	-77.5	-10.6	0	0	0	112.6	K55 T134	K55-D136 IonicContact NZ-OD2 3.46Å; K55-D136 PolarHBondContact NZ-OD2 2.93Å; T134-D136 PolarHBondContact O-N 2.74Å; T134-D136 PolarHBondContact OG1-N 2.96Å
137	F	87.8	Confident	88.6	Confident	26 Å²	26	36.9 Å²	36.9	11%	0.114	19%	0.191	C	C	.	.			trans	74.5	17.1	178.2	-152.1	-108.9	0	0	0	115.1	I60 I73 K75 L83 F85 F109 T134 H135	I60-F137 HydrophobicContact CG1-CE2 4.49Å; I73-F137 HydrophobicContact CB-CZ 4.47Å; I73-F137 HydrophobicContact CG2-CE2 4.12Å; I73-F137 HydrophobicContact CG2-CZ 4.13Å; K75-F137 HydrophobicContact CB-CD1 4.31Å; K75-F137 HydrophobicContact CB-CD2 3.54Å; K75-F137 HydrophobicContact CB-CE1 4.35Å; K75-F137 HydrophobicContact CB-CE2 3.61Å; K75-F137 HydrophobicContact CB-CG 3.93Å; K75-F137 HydrophobicContact CB-CZ 4.02Å; K75-F137 HydrophobicContact CD-CB 3.57Å; K75-F137 HydrophobicContact CD-CD2 3.85Å; K75-F137 HydrophobicContact CD-CG 3.87Å; K75-F137 HydrophobicContact CG-CD2 4.26Å; L83-F137 HydrophobicContact CB-CD1 4.3Å; L83-F137 HydrophobicContact CB-CE1 4.39Å; F85-F137 HydrophobicContact CB-CE1 3.98Å; F85-F137 HydrophobicContact CB-CZ 4.18Å; F109-F137 AromaticContact CE1-CD2 3.74Å; F109-F137 HydrophobicContact CE1-CD2 3.74Å; F109-F137 HydrophobicContact CE1-CE2 4.32Å; F109-F137 HydrophobicContact CE2-CE2 4.32Å; F109-F137 AromaticContact CZ-CD2 3.37Å; F109-F137 HydrophobicContact CZ-CD2 3.37Å; F109-F137 AromaticContact CZ-CE2 3.55Å; F109-F137 HydrophobicContact CZ-CE2 3.55Å; F109-F137 HydrophobicContact CZ-CG 4.37Å; T134-F137 WeakPolarHBondContact O-CA 3.44Å; T134-F137 PolarHBondContact O-N 2.89Å; T134-F137 PolarHBondContact OG1-N 3.2Å; H135-F137 PolarHBondContact O-N 2.96Å
138	E	88.5	Confident	88.1	Confident	129 Å²	129	39.2 Å²	39.2	60%	0.603	20%	0.202	S	C	*	.			trans	-81.1	132.4	176.5	-54.1	-177.8	134	0	0	110.7	F133 T134 L140	F133-E138 CarbonylContact C-O 3.54Å; F133-E138 WeakPolarHBondContact CA-O 3.38Å; T134-E138 HydrophobicContact CG2-CB 4.23Å; T134-E138 PolarHBondContact N-O 2.04Å; T134-E138 WeakPolarHBondContact OG1-CB 3.37Å; T134-E138 PolarHBondContact OG1-N 3.21Å; E138-L140 PolarHBondContact O-N 3.14Å
139	L	90.4	Very high	87.2	Confident	77 Å²	77	46.5 Å²	46.5	40%	0.403	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	111.5	178.3	178.6	67.1	0	0	0	110.9	F85 Y131 F133 S141	F85-L139 HydrophobicContact CE2-CD2 4.01Å; F85-L139 HydrophobicContact CZ-CD2 4.11Å; Y131-L139 HydrophobicContact CD1-CD1 3.87Å; Y131-L139 HydrophobicContact CD1-CD2 4.42Å; Y131-L139 HydrophobicContact CG-CD1 4.4Å; F133-L139 HydrophobicContact CD1-CB 4.13Å; F133-L139 HydrophobicContact CD1-CD1 4.11Å; F133-L139 HydrophobicContact CE1-CB 4.03Å; F133-L139 HydrophobicContact CE1-CD1 3.75Å; F133-L139 HydrophobicContact CE1-CG 4.48Å; F133-L139 HydrophobicContact CE2-CD1 4.49Å; F133-L139 HydrophobicContact CZ-CD1 3.96Å; L139-S141 WeakPolarHBondContact CD1-O 3.49Å
140	L	88.4	Confident	86.3	Confident	90 Å²	90	48.8 Å²	48.8	47%	0.471	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-43.9	176.4	-65.1	172.9	0	0	0	112.3	N132 T134 E138	N132-L140 WeakPolarHBondContact O-CB 3.12Å; N132-L140 PolarHBondContact O-N 2.89Å; T134-L140 HydrophobicContact CG2-CD1 4.01Å; T134-L140 HydrophobicContact CG2-CD2 3.63Å; T134-L140 HydrophobicContact CG2-CG 3.83Å; E138-L140 PolarHBondContact O-N 3.14Å
141	S	89.4	Confident	84.6	Confident	52 Å²	52	54.5 Å²	54.5	36%	0.364	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	161.8	-177.1	57.1	0	0	0	0	112.7	N132 L139	N132-S141 PolarHBondContact N-O 2.85Å; N132-S141 PolarHBondContact O-N 2.76Å; L139-S141 WeakPolarHBondContact CD1-O 3.49Å
142	S	90.2	Very high	83	Confident	55 Å²	55	58.6 Å²	58.6	39%	0.385	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146	165.3	63.5	0	0	0	0	110.5	C130	C130-S142 CarbonylContact O-C 3.57Å; C130-S142 VanDerWaalsContact O-CA 3.23Å; C130-S142 WeakPolarHBondContact O-CA 3.08Å
143	F	89.6	Confident	81.4	Confident	21 Å²	21	60.1 Å²	60.1	9%	0.092	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.2	-173	63.1	-86.8	0	0	0	111.9	I110 C130 N132 P145 L366 L368 Y383	I110-F143 HydrophobicContact CG2-CZ 4.37Å; C130-F143 HydrophobicContact CB-CD1 4.27Å; C130-F143 HydrophobicContact CB-CD2 4.17Å; C130-F143 HydrophobicContact CB-CE1 3.75Å; C130-F143 HydrophobicContact CB-CE2 3.65Å; C130-F143 HydrophobicContact CB-CG 4.46Å; C130-F143 HydrophobicContact CB-CZ 3.42Å; C130-F143 VanDerWaalsContact CB-CZ 3.42Å; C130-F143 PolarHBondContact N-O 3.46Å; C130-F143 PolarHBondContact O-N 2.88Å; N132-F143 HydrophobicContact CB-CE1 4.48Å; F143-P145 HydrophobicContact CD2-CB 4.41Å; F143-P145 HydrophobicContact CD2-CG 4.36Å; F143-P145 HydrophobicContact CE2-CB 4.31Å; F143-P145 HydrophobicContact CE2-CG 4.19Å; F143-P145 WeakPolarHBondContact O-CD 3.49Å; F143-L366 HydrophobicContact CZ-CD2 4.03Å; F143-L368 HydrophobicContact CE2-CD1 3.84Å; F143-L368 HydrophobicContact CZ-CD1 4.39Å; F143-Y383 WeakPolarHBondContact CB-OH 3.48Å; F143-Y383 HydrophobicContact CD2-CD2 4.06Å; F143-Y383 HydrophobicContact CD2-CE1 4.37Å; F143-Y383 AromaticContact CD2-CE2 3.31Å; F143-Y383 HydrophobicContact CD2-CE2 3.31Å; F143-Y383 AromaticContact CD2-CZ 3.5Å; F143-Y383 VanDerWaalsContact CD2-CZ 3.5Å; F143-Y383 AromaticContact CE2-CD2 3.89Å; F143-Y383 HydrophobicContact CE2-CD2 3.89Å; F143-Y383 HydrophobicContact CE2-CE1 4.27Å; F143-Y383 AromaticContact CE2-CE2 3.59Å; F143-Y383 HydrophobicContact CE2-CE2 3.59Å; F143-Y383 HydrophobicContact CE2-CG 4.37Å; F143-Y383 AromaticContact CE2-CZ 3.8Å; F143-Y383 HydrophobicContact CG-CE2 4.03Å; F143-Y383 AromaticContact CG-CZ 3.76Å; F143-Y383 WeakPolarHBondContact CG-OH 3.26Å; F143-Y383 HydrophobicContact CZ-CE1 4.41Å; F143-Y383 HydrophobicContact CZ-CE2 4.49Å
144	K	90.4	Very high	80.5	Confident	68 Å²	68	62 Å²	62	30%	0.296	32%	0.317	S	S	.	.			trans	-119.4	89.3	-176.8	-54.4	179.6	-177.5	179.2	0	110	H90 L116 S128 L129 F147	H90-K144 WeakPolarHBondContact NE2-CE 3.44Å; H90-K144 PolarHBondContact NE2-NZ 2.93Å; L116-K144 HydrophobicContact CD2-CD 3.99Å; L116-K144 HydrophobicContact CD2-CG 4.38Å; S128-K144 WeakPolarHBondContact O-CA 3.18Å; L129-K144 HydrophobicContact CD1-CG 3.97Å; K144-F147 HydrophobicContact CB-CB 3.65Å; K144-F147 HydrophobicContact CB-CD2 4.08Å; K144-F147 HydrophobicContact CB-CG 4.05Å; K144-F147 HydrophobicContact CD-CB 4.49Å; K144-F147 HydrophobicContact CD-CD2 3.76Å; K144-F147 HydrophobicContact CD-CE2 4.16Å; K144-F147 HydrophobicContact CD-CG 4Å; K144-F147 HydrophobicContact CG-CD2 4.47Å
145	P	88.3	Confident	80.4	Confident	1 Å²	1	61 Å²	61	1%	0.006	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	139.5	-179.2	29.8	-34.5	0	0	0	110.4	F143 F147 S355 L368	F143-P145 HydrophobicContact CD2-CB 4.41Å; F143-P145 HydrophobicContact CD2-CG 4.36Å; F143-P145 HydrophobicContact CE2-CB 4.31Å; F143-P145 HydrophobicContact CE2-CG 4.19Å; F143-P145 WeakPolarHBondContact O-CD 3.49Å; P145-F147 PolarHBondContact O-N 2.89Å; P145-F147 VanDerWaalsContact O-N 3.1Å; P145-S355 WeakPolarHBondContact CG-O 3.45Å; P145-L368 HydrophobicContact CB-CD1 3.66Å; P145-L368 HydrophobicContact CG-CD1 3.88Å
146	L	83.8	Confident	81.1	Confident	32 Å²	32	58 Å²	58	17%	0.168	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	39	45.1	-171.6	-63.3	-171.6	0	0	0	114.9	N127 Q148 A353 N381 N387	N127-L146 PolarHBondContact ND2-O 3.22Å; L146-Q148 PolarHBondContact O-N 3.23Å; L146-A353 HydrophobicContact CB-CB 4.29Å; L146-N381 WeakPolarHBondContact CD1-OD1 3.35Å; L146-N387 HydrophobicContact CD2-CB 3.82Å
147	F	86.6	Confident	81.7	Confident	51 Å²	51	55.7 Å²	55.7	22%	0.224	29%	0.285	C	S	.	.			trans	-70.5	102.4	179.2	-172.5	-97.1	0	0	0	112.1	Y92 L116 H118 N127 K144 P145 K149	Y92-F147 HydrophobicContact CE2-CZ 4.31Å; L116-F147 HydrophobicContact CD2-CD2 3.99Å; L116-F147 HydrophobicContact CD2-CE2 3.72Å; H118-F147 AromaticContact CD2-CE2 3.79Å; H118-F147 AromaticContact CD2-CZ 3.97Å; H118-F147 AromaticContact CE1-CZ 3.53Å; H118-F147 AromaticContact ND1-CZ 3.81Å; H118-F147 AromaticContact NE2-CE2 3.58Å; H118-F147 AromaticContact NE2-CZ 3.6Å; N127-F147 HydrophobicContact CB-CD2 3.71Å; N127-F147 HydrophobicContact CB-CE2 4.13Å; K144-F147 HydrophobicContact CB-CB 3.65Å; K144-F147 HydrophobicContact CB-CD2 4.08Å; K144-F147 HydrophobicContact CB-CG 4.05Å; K144-F147 HydrophobicContact CD-CB 4.49Å; K144-F147 HydrophobicContact CD-CD2 3.76Å; K144-F147 HydrophobicContact CD-CE2 4.16Å; K144-F147 HydrophobicContact CD-CG 4Å; K144-F147 HydrophobicContact CG-CD2 4.47Å; P145-F147 PolarHBondContact O-N 2.89Å; P145-F147 VanDerWaalsContact O-N 3.1Å; F147-K149 HydrophobicContact CD1-CG 4.17Å; F147-K149 HydrophobicContact CE1-CG 4.19Å; F147-K149 PolarHBondContact O-N 3.29Å
148	Q	80.6	Confident	82.1	Confident	48 Å²	48	54.5 Å²	54.5	22%	0.224	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-71.8	116.3	172.7	-175.5	63.6	-10.7	0	0	109.6	H118 Y125 N127 L146 N350 E351	H118-Q148 PolarHBondContact CE1-O 3.36Å; H118-Q148 PolarHBondContact NE2-O 2.94Å; Y125-Q148 HydrophobicContact CD2-CB 4.39Å; Y125-Q148 HydrophobicContact CD2-CG 4.05Å; Y125-Q148 HydrophobicContact CE2-CG 3.84Å; N127-Q148 PolarHBondContact ND2-N 3.44Å; L146-Q148 PolarHBondContact O-N 3.23Å; Q148-N350 HydrophobicContact CB-CB 4.27Å; Q148-E351 HydrophobicContact CG-CG 4.11Å; Q148-E351 WeakPolarHBondContact CG-OE1 3.46Å; Q148-E351 PolarHBondContact NE2-OE1 2.93Å
149	K	75.3	Confident	82.5	Confident	153 Å²	153	48.3 Å²	48.3	67%	0.665	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-74.1	149.3	172.3	-64.4	-178.3	-178.2	178.5	0	109.1	F147 I151	F147-K149 HydrophobicContact CD1-CG 4.17Å; F147-K149 HydrophobicContact CE1-CG 4.19Å; F147-K149 PolarHBondContact O-N 3.29Å; K149-I151 PolarHBondContact O-N 3.32Å
150	C	72.3	Confident	82.8	Confident	50 Å²	50	44.7 Å²	44.7	34%	0.338	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-62.8	126	167.2	-176.9	0	0	0	0	110.2	C120	C120-C150 WeakPolarHBondContact CA-SG 3.39Å; C120-C150 HydrophobicContact CB-CB 3.58Å; C120-C150 WeakPolarHBondContact CB-SG 3.25Å; C120-C150 WeakPolarHBondContact SG-CA 3.28Å; C120-C150 WeakPolarHBondContact SG-CB 3.41Å; C120-C150 CovalentContact SG-SG 2.04Å; C120-C150 PolarHBondContact SG-SG 3.29Å
151	I	58.4	Low	83.1	Confident	120 Å²	120	40.4 Å²	40.4	62%	0.615	21%	0.209	S	C	*	.			trans	-118.1	90.3	176.7	-55.2	176.5	0	0	0	107.7	K149 K153	K149-I151 PolarHBondContact O-N 3.32Å; I151-K153 PolarHBondContact O-N 2.95Å
152	K	59	Low	83.2	Confident	90 Å²	90	37.9 Å²	37.9	39%	0.391	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-60.7	130.9	170.3	-70.6	175.4	158.9	-68.8	0	109.7	D121 S190 E338	D121-K152 VanDerWaalsContact OD1-CE 3.31Å; D121-K152 WeakPolarHBondContact OD1-CE 3.28Å; D121-K152 IonicContact OD1-NZ 3.48Å; D121-K152 PolarHBondContact OD1-NZ 2.92Å; K152-S190 VanDerWaalsContact CB-OG 3.32Å; K152-S190 WeakPolarHBondContact CB-OG 3.44Å; K152-S190 WeakPolarHBondContact CD-OG 3.13Å; K152-E338 IonicContact NZ-OE2 2.76Å; K152-E338 PolarHBondContact NZ-OE2 2.87Å
153	K	59	Low	83.3	Confident	66 Å²	66	35.3 Å²	35.3	29%	0.287	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-70.3	134.7	169.1	-77.1	168.8	-179.8	160	0	108.3	I151 N341 E346	I151-K153 PolarHBondContact O-N 2.95Å; K153-N341 PolarHBondContact NZ-ND2 2.77Å; K153-E346 IonicContact NZ-OE1 2.66Å; K153-E346 PolarHBondContact NZ-OE1 3.41Å; K153-E346 IonicContact NZ-OE2 2.65Å; K153-E346 PolarHBondContact NZ-OE2 3.47Å
154	A	71.6	Confident	83.4	Confident	39 Å²	39	34.3 Å²	34.3	32%	0.322	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-63.3	152.7	173.1	0	0	0	0	0	110.2	S190 A255 N256	A154-S190 WeakPolarHBondContact CA-O 3.26Å; A154-A255 HydrophobicContact CB-CB 4Å; A154-A255 CarbonylContact O-C 3.58Å; A154-A255 WeakPolarHBondContact O-CA 3.45Å; A154-A255 WeakPolarHBondContact O-CB 3.28Å; A154-N256 PolarHBondContact O-N 2.89Å
155	V	83	Confident	83.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.6	178.1	-176.1	0	0	0	0	110.1	S190 I191 K192 N256 I337 E338	V155-S190 PolarHBondContact N-O 3.21Å; V155-S190 VanDerWaalsContact N-O 3.09Å; V155-I191 HydrophobicContact CB-CB 4.48Å; V155-I191 HydrophobicContact CB-CG1 4.1Å; V155-I191 HydrophobicContact CB-CG2 4.29Å; V155-I191 HydrophobicContact CG1-CG2 4.44Å; V155-I191 HydrophobicContact CG2-CG1 4.49Å; V155-I191 CarbonylContact O-C 3.48Å; V155-I191 WeakPolarHBondContact O-CA 3.33Å; V155-K192 PolarHBondContact O-N 3.17Å; V155-N256 CarbonylContact C-O 3.59Å; V155-N256 VanDerWaalsContact CA-O 3.32Å; V155-N256 WeakPolarHBondContact CA-O 3.18Å; V155-N256 HydrophobicContact CG2-CB 4.39Å; V155-I337 HydrophobicContact CG1-CG2 3.85Å; V155-I337 HydrophobicContact CG2-CG2 4.35Å; V155-E338 HydrophobicContact CG2-CG 3.83Å
156	D	90.9	Very high	83.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	105.7	170.7	-74.3	-3.4	0	0	0	108.5	F208 L244 A251 S252 N256 K257 A258	D156-F208 HydrophobicContact CB-CE1 3.91Å; D156-F208 HydrophobicContact CB-CE2 4.26Å; D156-F208 HydrophobicContact CB-CZ 3.69Å; D156-L244 HydrophobicContact CB-CD2 4.26Å; D156-A251 WeakPolarHBondContact OD2-CA 3.36Å; D156-S252 VanDerWaalsContact OD1-CB 3.25Å; D156-S252 WeakPolarHBondContact OD1-CB 3.38Å; D156-S252 PolarHBondContact OD1-OG 3.38Å; D156-S252 WeakPolarHBondContact OD2-CB 3.32Å; D156-S252 PolarHBondContact OD2-N 3.43Å; D156-N256 PolarHBondContact N-O 2.76Å; D156-K257 HydrophobicContact CB-CG 4.4Å; D156-A258 PolarHBondContact O-N 3.36Å
157	L	92.6	Very high	83.5	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.7	-177.4	-169.7	154.5	0	0	0	111.3	F159 M182 I191 K192 F193 A194 A258 V260 I334	L157-F159 HydrophobicContact CD2-CD2 4.16Å; L157-F159 HydrophobicContact CD2-CE2 4.12Å; L157-F159 HydrophobicContact CD2-CG 4.45Å; L157-F159 HydrophobicContact CD2-CZ 4.38Å; L157-M182 HydrophobicContact CD1-CE 3.76Å; L157-M182 HydrophobicContact CD2-CE 3.78Å; L157-M182 HydrophobicContact CG-CE 4.48Å; L157-I191 HydrophobicContact CB-CG2 3.93Å; L157-K192 PolarHBondContact N-O 3.12Å; L157-F193 HydrophobicContact CB-CD1 4.31Å; L157-F193 HydrophobicContact CB-CE1 4.38Å; L157-F193 HydrophobicContact CD1-CE1 4.32Å; L157-F193 HydrophobicContact CD2-CD1 3.86Å; L157-F193 HydrophobicContact CD2-CE1 3.99Å; L157-F193 HydrophobicContact CG-CE1 4.47Å; L157-F193 CarbonylContact O-C 3.56Å; L157-F193 WeakPolarHBondContact O-CA 3.28Å; L157-A194 PolarHBondContact O-N 2.89Å; L157-A258 WeakPolarHBondContact CA-O 3.09Å; L157-A258 HydrophobicContact CB-CB 4.39Å; L157-A258 HydrophobicContact CD1-CB 4.33Å; L157-A258 HydrophobicContact CG-CB 4.1Å; L157-V260 HydrophobicContact CD1-CG2 4.15Å; L157-V260 HydrophobicContact CD2-CG2 3.77Å; L157-V260 HydrophobicContact CG-CG2 4.12Å; L157-I334 HydrophobicContact CD1-CD1 3.84Å; L157-I334 HydrophobicContact CD1-CG1 4.13Å
158	V	96.3	Very high	83.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.5	173.7	-166.9	0	0	0	0	111.2	A194 V196 F208 T239 L243 L244 A258 V259 V260	V158-A194 WeakPolarHBondContact CA-O 3.45Å; V158-A194 HydrophobicContact CG1-CB 4.3Å; V158-A194 HydrophobicContact CG2-CB 4.28Å; V158-V196 HydrophobicContact CG1-CG2 4.1Å; V158-F208 HydrophobicContact CG2-CE1 4.41Å; V158-F208 HydrophobicContact CG2-CZ 3.7Å; V158-T239 HydrophobicContact CB-CG2 3.9Å; V158-T239 HydrophobicContact CG1-CG2 3.76Å; V158-T239 HydrophobicContact CG2-CG2 3.99Å; V158-L243 HydrophobicContact CG1-CD1 3.69Å; V158-L243 HydrophobicContact CG2-CB 4.37Å; V158-L243 HydrophobicContact CG2-CD1 4.19Å; V158-L244 HydrophobicContact CG2-CD1 4.46Å; V158-L244 HydrophobicContact CG2-CD2 3.77Å; V158-L244 HydrophobicContact CG2-CG 3.93Å; V158-A258 PolarHBondContact N-O 2.88Å; V158-V259 HydrophobicContact CB-CG2 4.34Å; V158-V259 CarbonylContact O-C 3.43Å; V158-V259 WeakPolarHBondContact O-CA 3.44Å; V158-V260 PolarHBondContact O-N 3.26Å
159	F	96	Very high	83.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.2	162.3	-66.3	-84.7	0	0	0	110	L157 F178 I179 M182 M183 F193 A194 A195 V196 V260 I262	L157-F159 HydrophobicContact CD2-CD2 4.16Å; L157-F159 HydrophobicContact CD2-CE2 4.12Å; L157-F159 HydrophobicContact CD2-CG 4.45Å; L157-F159 HydrophobicContact CD2-CZ 4.38Å; F159-F178 HydrophobicContact CE1-CE1 4.47Å; F159-I179 HydrophobicContact CB-CD1 4.09Å; F159-I179 HydrophobicContact CB-CG1 4.34Å; F159-I179 HydrophobicContact CD1-CB 4.5Å; F159-I179 HydrophobicContact CD1-CD1 4.33Å; F159-I179 HydrophobicContact CD1-CG1 3.72Å; F159-I179 HydrophobicContact CD1-CG2 4.4Å; F159-I179 HydrophobicContact CD2-CG1 4.46Å; F159-I179 HydrophobicContact CD2-CG2 3.67Å; F159-I179 HydrophobicContact CE1-CB 4.37Å; F159-I179 HydrophobicContact CE1-CG1 3.93Å; F159-I179 HydrophobicContact CE1-CG2 4.38Å; F159-I179 HydrophobicContact CE2-CB 4.46Å; F159-I179 HydrophobicContact CE2-CG2 3.65Å; F159-I179 HydrophobicContact CG-CD1 4.24Å; F159-I179 HydrophobicContact CG-CG1 3.95Å; F159-I179 HydrophobicContact CG-CG2 4.02Å; F159-I179 HydrophobicContact CZ-CB 4.31Å; F159-I179 HydrophobicContact CZ-CG1 4.35Å; F159-I179 HydrophobicContact CZ-CG2 3.98Å; F159-M182 HydrophobicContact CE1-CE 3.6Å; F159-M182 HydrophobicContact CE1-CG 4.45Å; F159-M182 HydrophobicContact CE1-SD 3.58Å; F159-M182 VanDerWaalsContact CE1-SD 3.58Å; F159-M182 HydrophobicContact CE2-CE 4.2Å; F159-M182 HydrophobicContact CZ-CB 4.01Å; F159-M182 HydrophobicContact CZ-CE 3.35Å; F159-M182 HydrophobicContact CZ-CG 3.88Å; F159-M182 HydrophobicContact CZ-SD 3.55Å; F159-M182 VanDerWaalsContact CZ-SD 3.55Å; F159-M183 HydrophobicContact CE2-CG 4.11Å; F159-F193 HydrophobicContact CD2-CD1 4.32Å; F159-F193 AromaticContact CE2-CD1 3.56Å; F159-F193 HydrophobicContact CE2-CD1 3.56Å; F159-F193 HydrophobicContact CE2-CE1 4.13Å; F159-F193 HydrophobicContact CE2-CG 4.45Å; F159-F193 HydrophobicContact CZ-CD1 4.31Å; F159-F193 HydrophobicContact CZ-CE1 4.45Å; F159-A194 PolarHBondContact N-O 3.21Å; F159-A195 HydrophobicContact CB-CB 4.12Å; F159-A195 CarbonylContact O-C 3.52Å; F159-A195 WeakPolarHBondContact O-CA 3.25Å; F159-V196 PolarHBondContact O-N 3.48Å; F159-V260 HydrophobicContact CD1-CB 4.07Å; F159-V260 HydrophobicContact CD1-CG1 4.06Å; F159-V260 HydrophobicContact CE1-CG1 4.38Å; F159-I262 HydrophobicContact CD1-CD1 4.22Å
160	L	96.3	Very high	84.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	91.3	171.8	179.9	58.3	0	0	0	108.2	V196 F198 A235 L236 V259 V260 I261 I262	L160-V196 HydrophobicContact CD1-CB 3.88Å; L160-V196 HydrophobicContact CD1-CG1 3.71Å; L160-F198 HydrophobicContact CD1-CB 4.08Å; L160-F198 HydrophobicContact CD1-CD1 3.58Å; L160-F198 HydrophobicContact CD1-CE1 4.37Å; L160-F198 HydrophobicContact CD1-CG 4.07Å; L160-F198 HydrophobicContact CG-CD1 3.76Å; L160-F198 HydrophobicContact CG-CE1 4.05Å; L160-A235 HydrophobicContact CD1-CB 3.94Å; L160-A235 HydrophobicContact CD2-CB 4.36Å; L160-L236 HydrophobicContact CD2-CB 4.49Å; L160-L236 HydrophobicContact CD2-CD2 3.72Å; L160-L236 HydrophobicContact CD2-CG 3.76Å; L160-V259 HydrophobicContact CB-CG1 3.7Å; L160-V259 HydrophobicContact CD2-CG1 4.31Å; L160-V260 PolarHBondContact N-O 3.26Å; L160-I261 HydrophobicContact CD2-CG1 4.46Å; L160-I261 VanDerWaalsContact O-CA 3.3Å; L160-I261 WeakPolarHBondContact O-CA 3.48Å; L160-I262 PolarHBondContact O-N 2.86Å
161	F	94.7	Very high	85.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.8	-170.2	72	-80.8	0	0	0	112.2	F172 I179 A195 V196 Q197 F198 V205 L220 E223 I262	F161-F172 HydrophobicContact CD2-CE2 4.32Å; F161-F172 HydrophobicContact CE2-CD2 4.48Å; F161-F172 AromaticContact CE2-CE2 3.69Å; F161-F172 HydrophobicContact CE2-CE2 3.69Å; F161-F172 HydrophobicContact CE2-CZ 4.21Å; F161-I179 HydrophobicContact CB-CD1 4.1Å; F161-I179 HydrophobicContact CD1-CD1 3.66Å; F161-I179 HydrophobicContact CD2-CD1 4.3Å; F161-I179 HydrophobicContact CE1-CD1 4.09Å; F161-I179 HydrophobicContact CG-CD1 3.78Å; F161-A195 HydrophobicContact CD1-CB 4.46Å; F161-A195 HydrophobicContact CE1-CB 4.04Å; F161-V196 VanDerWaalsContact CD1-O 3.23Å; F161-V196 WeakPolarHBondContact CD1-O 3.39Å; F161-V196 PolarHBondContact N-O 3.23Å; F161-Q197 HydrophobicContact CD2-CG 4.48Å; F161-Q197 HydrophobicContact CE1-CB 4.21Å; F161-Q197 HydrophobicContact CE2-CB 4.13Å; F161-Q197 HydrophobicContact CE2-CG 4.1Å; F161-Q197 HydrophobicContact CZ-CB 3.89Å; F161-Q197 HydrophobicContact CZ-CG 4.37Å; F161-Q197 WeakPolarHBondContact O-CA 3.31Å; F161-F198 VanDerWaalsContact C-CD1 3.49Å; F161-F198 VanDerWaalsContact O-CD1 3.25Å; F161-F198 WeakPolarHBondContact O-CD1 3.3Å; F161-F198 PolarHBondContact O-N 3.11Å; F161-V205 HydrophobicContact CE1-CG2 3.86Å; F161-V205 HydrophobicContact CZ-CG2 3.97Å; F161-L220 HydrophobicContact CE1-CD1 4.08Å; F161-L220 HydrophobicContact CZ-CD1 3.76Å; F161-E223 HydrophobicContact CZ-CG 4.31Å; F161-I262 HydrophobicContact CB-CB 4.19Å
162	D	92.1	Very high	86.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	154.8	-177.8	-153.8	-39.8	0	0	0	111.1	S164 M167 F198 T230 I262 T263	D162-S164 WeakPolarHBondContact OD1-CB 3.26Å; D162-S164 PolarHBondContact OD1-N 2.76Å; D162-S164 PolarHBondContact OD1-OG 2.8Å; D162-M167 VanDerWaalsContact O-CE 3.26Å; D162-M167 WeakPolarHBondContact O-CE 3.44Å; D162-F198 CarbonylContact C-O 3.55Å; D162-F198 HydrophobicContact CB-CE1 4.02Å; D162-F198 HydrophobicContact CB-CZ 4.05Å; D162-T230 WeakPolarHBondContact OD2-CG2 3.46Å; D162-I262 VanDerWaalsContact CB-O 3.29Å; D162-I262 WeakPolarHBondContact CB-O 3.4Å; D162-I262 PolarHBondContact N-O 3.32Å; D162-T263 WeakPolarHBondContact OD2-CB 3.4Å; D162-T263 PolarHBondContact OD2-OG1 3.16Å
163	G	92.6	Very high	88.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.			trans	-146.1	15.3	-179.2	0	0	0	0	0	112.2	Q197 F198 H225 M226 K227	G163-Q197 VanDerWaalsContact CA-OE1 3.29Å; G163-F198 PolarHBondContact N-O 3.41Å; G163-H225 PolarHBondContact O-CD2 2.72Å; G163-H225 PolarHBondContact O-NE2 3.4Å; G163-M226 CarbonylContact O-C 3.54Å; G163-M226 PolarHBondContact O-N 2.04Å; G163-K227 PolarHBondContact O-N 2.89Å
164	S	91.6	Very high	89.5	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	18%	0.176	C	C	.	.			trans	-65.8	172.2	-178.5	59.9	0	0	0	0	114.3	D162 S166 S199 H225 G228 L229 T230	D162-S164 WeakPolarHBondContact OD1-CB 3.26Å; D162-S164 PolarHBondContact OD1-N 2.76Å; D162-S164 PolarHBondContact OD1-OG 2.8Å; S164-S166 VanDerWaalsContact C-N 3.35Å; S164-S166 PolarHBondContact OG-OG 2.86Å; S164-S199 WeakPolarHBondContact CA-OG 3.37Å; S164-H225 PolarHBondContact O-CE1 2.87Å; S164-H225 PolarHBondContact O-NE2 2.84Å; S164-G228 CarbonylContact C-O 3.38Å; S164-G228 VanDerWaalsContact CA-O 3.23Å; S164-G228 WeakPolarHBondContact CA-O 3.46Å; S164-G228 WeakPolarHBondContact CB-O 3.2Å; S164-L229 WeakPolarHBondContact CB-O 3.5Å; S164-T230 WeakPolarHBondContact CB-OG1 3.08Å; S164-T230 PolarHBondContact OG-OG1 3.13Å
165	E	89.9	Confident	90.3	Very high	152 Å²	152	27.6 Å²	27.6	71%	0.71	16%	0.16	S	C	*	.	S	Bend	trans	-74.6	-18.1	-176.6	-168.4	174.2	-165.4	0	0	114	G228	E165-G228 PolarHBondContact N-O 3.18Å
166	S	86.7	Confident	90.7	Very high	75 Å²	75	27.7 Å²	27.7	52%	0.524	16%	0.161	S	C	.	.	S	Bend	trans	-70.7	-31	179.8	48.7	0	0	0	0	113.6	S164 D264	S164-S166 VanDerWaalsContact C-N 3.35Å; S164-S166 PolarHBondContact OG-OG 2.86Å; S166-D264 WeakPolarHBondContact CB-OD2 3.42Å; S166-D264 PolarHBondContact OG-OD2 2.93Å
167	M	87.6	Confident	90.7	Very high	4 Å²	4	34 Å²	34	2%	0.02	19%	0.188	C	C	.	.	S	Bend	trans	-80.6	137.5	178.8	-179.4	177.1	44.7	0	0	111.6	D162 E171 F172 H225 D264 Y320	D162-M167 VanDerWaalsContact O-CE 3.26Å; D162-M167 WeakPolarHBondContact O-CE 3.44Å; M167-E171 HydrophobicContact CG-CB 3.58Å; M167-E171 HydrophobicContact SD-CB 4.29Å; M167-F172 HydrophobicContact CE-CB 4.08Å; M167-F172 HydrophobicContact CE-CD2 3.68Å; M167-F172 HydrophobicContact CE-CG 4.36Å; M167-F172 HydrophobicContact SD-CB 4.13Å; M167-H225 PolarHBondContact O-CE1 3.04Å; M167-D264 PolarHBondContact N-OD2 2.79Å; M167-Y320 HydrophobicContact SD-CE1 4.16Å; M167-Y320 PolarHBondContact SD-OH 3.04Å
168	T	87.7	Confident	90.4	Very high	74 Å²	74	34.7 Å²	34.7	45%	0.454	19%	0.191	S	C	.	.			trans	-80.4	160.4	174.3	68.1	0	0	0	0	112.6	T170 E171 F172	T168-T170 PolarHBondContact O-N 2.79Å; T168-E171 VanDerWaalsContact CB-OE2 3.28Å; T168-E171 WeakPolarHBondContact CB-OE2 3.47Å; T168-E171 WeakPolarHBondContact CG2-OE2 3.36Å; T168-E171 PolarHBondContact N-OE2 2.83Å; T168-E171 WeakPolarHBondContact O-CB 3.49Å; T168-E171 PolarHBondContact O-N 2.86Å; T168-E171 WeakPolarHBondContact OG1-CG 3.45Å; T168-E171 PolarHBondContact OG1-OE2 3.37Å; T168-F172 PolarHBondContact O-N 2.78Å
169	G	86.8	Confident	90.2	Very high	40 Å²	40	34.7 Å²	34.7	41%	0.412	19%	0.191	S	C	.	.	H	α-helix	trans	-58.4	-31.9	177.1	0	0	0	0	0	113.9	E173	G169-E173 WeakPolarHBondContact O-CG 3.48Å; G169-E173 PolarHBondContact O-N 2.87Å; G169-E173 VanDerWaalsContact O-N 3.12Å
170	T	87.2	Confident	90	Very high	101 Å²	101	35.6 Å²	35.6	62%	0.62	20%	0.196	S	C	*	.	H	α-helix	trans	-65.2	-40.6	174.7	-50.7	0	0	0	0	111.7	T168 E173 Q174	T168-T170 PolarHBondContact O-N 2.79Å; T170-E173 PolarHBondContact O-N 2.85Å; T170-Q174 WeakPolarHBondContact O-CG 3.15Å; T170-Q174 PolarHBondContact O-N 3.01Å; T170-Q174 PolarHBondContact O-OE1 2.8Å
171	E	87.4	Confident	89.5	Confident	13 Å²	13	36.7 Å²	36.7	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-72.9	-35.1	-179.3	-69	167.1	121.7	0	0	111.6	M167 T168 Q174 N175 K293 Y320	M167-E171 HydrophobicContact CG-CB 3.58Å; M167-E171 HydrophobicContact SD-CB 4.29Å; T168-E171 VanDerWaalsContact CB-OE2 3.28Å; T168-E171 WeakPolarHBondContact CB-OE2 3.47Å; T168-E171 WeakPolarHBondContact CG2-OE2 3.36Å; T168-E171 PolarHBondContact N-OE2 2.83Å; T168-E171 WeakPolarHBondContact O-CB 3.49Å; T168-E171 PolarHBondContact O-N 2.86Å; T168-E171 WeakPolarHBondContact OG1-CG 3.45Å; T168-E171 PolarHBondContact OG1-OE2 3.37Å; E171-Q174 PolarHBondContact O-N 2.83Å; E171-N175 WeakPolarHBondContact O-CB 3.43Å; E171-N175 PolarHBondContact O-N 3.43Å; E171-K293 WeakPolarHBondContact OE1-CD 3.33Å; E171-K293 WeakPolarHBondContact OE1-CE 3.31Å; E171-K293 IonicContact OE1-NZ 2.95Å; E171-K293 PolarHBondContact OE1-NZ 3.42Å; E171-Y320 HydrophobicContact CB-CD1 4.35Å; E171-Y320 HydrophobicContact CB-CD2 3.63Å; E171-Y320 HydrophobicContact CB-CE1 4.37Å; E171-Y320 HydrophobicContact CB-CE2 3.66Å; E171-Y320 HydrophobicContact CB-CG 4.01Å; E171-Y320 HydrophobicContact CG-CD2 3.49Å; E171-Y320 VanDerWaalsContact CG-CD2 3.49Å; E171-Y320 HydrophobicContact CG-CE2 3.82Å; E171-Y320 HydrophobicContact CG-CG 4.13Å; E171-Y320 WeakPolarHBondContact OE1-CD2 3.13Å; E171-Y320 WeakPolarHBondContact OE1-CE2 3.27Å
172	F	91.1	Very high	89	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-41.9	169.6	-176.6	-108	0	0	0	112.2	F161 M167 T168 N175 K176 Q197 E223 H225	F161-F172 HydrophobicContact CD2-CE2 4.32Å; F161-F172 HydrophobicContact CE2-CD2 4.48Å; F161-F172 AromaticContact CE2-CE2 3.69Å; F161-F172 HydrophobicContact CE2-CE2 3.69Å; F161-F172 HydrophobicContact CE2-CZ 4.21Å; M167-F172 HydrophobicContact CE-CB 4.08Å; M167-F172 HydrophobicContact CE-CD2 3.68Å; M167-F172 HydrophobicContact CE-CG 4.36Å; M167-F172 HydrophobicContact SD-CB 4.13Å; T168-F172 PolarHBondContact O-N 2.78Å; F172-N175 WeakPolarHBondContact O-CB 3.25Å; F172-N175 PolarHBondContact O-N 3.18Å; F172-K176 HydrophobicContact CE1-CD 4.05Å; F172-K176 HydrophobicContact CZ-CD 4.4Å; F172-K176 PolarHBondContact O-N 3.35Å; F172-Q197 HydrophobicContact CE2-CG 4.23Å; F172-E223 WeakPolarHBondContact CE1-O 3.44Å; F172-E223 HydrophobicContact CZ-CG 4.21Å; F172-H225 HydrophobicContact CD1-CB 3.7Å; F172-H225 HydrophobicContact CD2-CB 4.28Å; F172-H225 AromaticContact CD2-CD2 3.88Å; F172-H225 HydrophobicContact CE1-CB 3.77Å; F172-H225 HydrophobicContact CE2-CB 4.35Å; F172-H225 HydrophobicContact CG-CB 3.94Å; F172-H225 HydrophobicContact CZ-CB 4.1Å
173	E	90.5	Very high	88.9	Confident	68 Å²	68	37.6 Å²	37.6	32%	0.318	21%	0.211	S	C	.	.	H	α-helix	trans	-67.2	-33.9	172.3	-67.9	-58.8	146.7	0	0	112.9	G169 T170 K176 K177	G169-E173 WeakPolarHBondContact O-CG 3.48Å; G169-E173 PolarHBondContact O-N 2.87Å; G169-E173 VanDerWaalsContact O-N 3.12Å; T170-E173 PolarHBondContact O-N 2.85Å; E173-K176 WeakPolarHBondContact OE1-CE 3.37Å; E173-K176 IonicContact OE1-NZ 3.73Å; E173-K176 PolarHBondContact OE1-NZ 2.83Å; E173-K176 WeakPolarHBondContact OE2-CE 3.35Å; E173-K176 IonicContact OE2-NZ 3.79Å; E173-K176 PolarHBondContact OE2-NZ 3.04Å; E173-K177 WeakPolarHBondContact O-CB 3.38Å; E173-K177 VanDerWaalsContact O-CG 3.28Å; E173-K177 WeakPolarHBondContact O-CG 3.14Å; E173-K177 PolarHBondContact O-N 3.19Å
174	Q	87.4	Confident	88.6	Confident	45 Å²	45	43.4 Å²	43.4	21%	0.21	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-39.4	172.3	-71.9	167.5	-64.5	0	0	111.6	T170 E171 K177 F178 Y320 D321	T170-Q174 WeakPolarHBondContact O-CG 3.15Å; T170-Q174 PolarHBondContact O-N 3.01Å; T170-Q174 PolarHBondContact O-OE1 2.8Å; E171-Q174 PolarHBondContact O-N 2.83Å; Q174-K177 PolarHBondContact O-N 2.82Å; Q174-F178 PolarHBondContact O-N 2.85Å; Q174-Y320 HydrophobicContact CB-CD1 4.45Å; Q174-Y320 HydrophobicContact CB-CG 4.42Å; Q174-D321 PolarHBondContact NE2-OD1 2.9Å
175	N	88.3	Confident	88.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-48.2	175.4	-162.4	-6.8	0	0	0	111	E171 F172 K177 F178 I179 I262 Y320	E171-N175 WeakPolarHBondContact O-CB 3.43Å; E171-N175 PolarHBondContact O-N 3.43Å; F172-N175 WeakPolarHBondContact O-CB 3.25Å; F172-N175 PolarHBondContact O-N 3.18Å; N175-K177 VanDerWaalsContact C-N 3.34Å; N175-K177 PolarHBondContact O-N 3.11Å; N175-F178 PolarHBondContact O-N 3.47Å; N175-I179 WeakPolarHBondContact O-CG1 3.28Å; N175-I179 PolarHBondContact O-N 2.83Å; N175-I179 VanDerWaalsContact O-N 3.16Å; N175-I262 WeakPolarHBondContact OD1-CD1 3.39Å; N175-Y320 HydrophobicContact CB-CD1 4.38Å; N175-Y320 HydrophobicContact CB-CE1 4.18Å
176	K	92.1	Very high	87.5	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-43.1	172.6	-72.4	-168.1	-73	-177.6	0	112.6	F172 E173 I179 I180 L220 M221 E223	F172-K176 HydrophobicContact CE1-CD 4.05Å; F172-K176 HydrophobicContact CZ-CD 4.4Å; F172-K176 PolarHBondContact O-N 3.35Å; E173-K176 WeakPolarHBondContact OE1-CE 3.37Å; E173-K176 IonicContact OE1-NZ 3.73Å; E173-K176 PolarHBondContact OE1-NZ 2.83Å; E173-K176 WeakPolarHBondContact OE2-CE 3.35Å; E173-K176 IonicContact OE2-NZ 3.79Å; E173-K176 PolarHBondContact OE2-NZ 3.04Å; K176-I179 PolarHBondContact O-N 2.86Å; K176-I180 WeakPolarHBondContact O-CG1 3.39Å; K176-I180 PolarHBondContact O-N 3.26Å; K176-I180 VanDerWaalsContact O-N 3.11Å; K176-L220 HydrophobicContact CB-CG 4.34Å; K176-L220 HydrophobicContact CD-CD1 4.3Å; K176-L220 HydrophobicContact CD-CG 4.4Å; K176-L220 WeakPolarHBondContact CD-O 3.28Å; K176-L220 HydrophobicContact CG-CD1 3.97Å; K176-L220 HydrophobicContact CG-CG 4.19Å; K176-M221 PolarHBondContact NZ-O 2.84Å; K176-M221 VanDerWaalsContact NZ-O 3.16Å; K176-E223 HydrophobicContact CD-CB 4.43Å; K176-E223 PolarHBondContact NZ-O 3.18Å; K176-E223 VanDerWaalsContact NZ-O 3.08Å
177	K	89.1	Confident	87.2	Confident	133 Å²	133	42.9 Å²	42.9	58%	0.578	23%	0.233	S	C	*	.	H	α-helix	trans	-65.6	-38.1	177.7	-75.5	170.4	-178.8	177	0	113.6	E173 Q174 N175 I180 G181	E173-K177 WeakPolarHBondContact O-CB 3.38Å; E173-K177 VanDerWaalsContact O-CG 3.28Å; E173-K177 WeakPolarHBondContact O-CG 3.14Å; E173-K177 PolarHBondContact O-N 3.19Å; Q174-K177 PolarHBondContact O-N 2.82Å; N175-K177 VanDerWaalsContact C-N 3.34Å; N175-K177 PolarHBondContact O-N 3.11Å; K177-I180 PolarHBondContact O-N 3.29Å; K177-G181 PolarHBondContact O-N 2.9Å
178	F	87.6	Confident	86.4	Confident	14 Å²	14	50.6 Å²	50.6	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-45.3	174.8	169	-106.5	0	0	0	111.7	F159 Q174 N175 I180 G181 M182 I262 I290 L323 L326 L327	F159-F178 HydrophobicContact CE1-CE1 4.47Å; Q174-F178 PolarHBondContact O-N 2.85Å; N175-F178 PolarHBondContact O-N 3.47Å; F178-I180 VanDerWaalsContact C-N 3.32Å; F178-I180 PolarHBondContact O-N 3.33Å; F178-G181 PolarHBondContact O-N 3.1Å; F178-M182 HydrophobicContact CZ-SD 4.42Å; F178-M182 WeakPolarHBondContact O-CB 3.38Å; F178-M182 PolarHBondContact O-N 3.3Å; F178-I262 HydrophobicContact CD1-CD1 3.74Å; F178-I262 HydrophobicContact CE1-CD1 3.75Å; F178-I290 HydrophobicContact CE1-CD1 3.82Å; F178-I290 HydrophobicContact CZ-CD1 3.94Å; F178-L323 HydrophobicContact CB-CB 4.13Å; F178-L323 HydrophobicContact CB-CD1 3.98Å; F178-L323 HydrophobicContact CD1-CD2 4.04Å; F178-L323 HydrophobicContact CD2-CB 3.66Å; F178-L323 HydrophobicContact CD2-CD2 4.18Å; F178-L323 HydrophobicContact CD2-CG 4.41Å; F178-L323 HydrophobicContact CE1-CD2 4.16Å; F178-L323 HydrophobicContact CE2-CB 4.25Å; F178-L323 HydrophobicContact CE2-CD2 4.28Å; F178-L323 WeakPolarHBondContact CE2-O 3.27Å; F178-L323 HydrophobicContact CG-CB 3.94Å; F178-L323 HydrophobicContact CG-CD1 4.19Å; F178-L323 HydrophobicContact CG-CD2 4.04Å; F178-L323 HydrophobicContact CG-CG 4.29Å; F178-L323 HydrophobicContact CZ-CD2 4.27Å; F178-L326 HydrophobicContact CZ-CD2 4.26Å; F178-L327 HydrophobicContact CD2-CD1 4.16Å; F178-L327 HydrophobicContact CE2-CD1 3.85Å
179	I	91.5	Very high	85.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.9	-45.1	176	-66.9	171.4	0	0	0	110.7	F159 F161 N175 K176 M182 M183 L220 I262	F159-I179 HydrophobicContact CB-CD1 4.09Å; F159-I179 HydrophobicContact CB-CG1 4.34Å; F159-I179 HydrophobicContact CD1-CB 4.5Å; F159-I179 HydrophobicContact CD1-CD1 4.33Å; F159-I179 HydrophobicContact CD1-CG1 3.72Å; F159-I179 HydrophobicContact CD1-CG2 4.4Å; F159-I179 HydrophobicContact CD2-CG1 4.46Å; F159-I179 HydrophobicContact CD2-CG2 3.67Å; F159-I179 HydrophobicContact CE1-CB 4.37Å; F159-I179 HydrophobicContact CE1-CG1 3.93Å; F159-I179 HydrophobicContact CE1-CG2 4.38Å; F159-I179 HydrophobicContact CE2-CB 4.46Å; F159-I179 HydrophobicContact CE2-CG2 3.65Å; F159-I179 HydrophobicContact CG-CD1 4.24Å; F159-I179 HydrophobicContact CG-CG1 3.95Å; F159-I179 HydrophobicContact CG-CG2 4.02Å; F159-I179 HydrophobicContact CZ-CB 4.31Å; F159-I179 HydrophobicContact CZ-CG1 4.35Å; F159-I179 HydrophobicContact CZ-CG2 3.98Å; F161-I179 HydrophobicContact CB-CD1 4.1Å; F161-I179 HydrophobicContact CD1-CD1 3.66Å; F161-I179 HydrophobicContact CD2-CD1 4.3Å; F161-I179 HydrophobicContact CE1-CD1 4.09Å; F161-I179 HydrophobicContact CG-CD1 3.78Å; N175-I179 WeakPolarHBondContact O-CG1 3.28Å; N175-I179 PolarHBondContact O-N 2.83Å; N175-I179 VanDerWaalsContact O-N 3.16Å; K176-I179 PolarHBondContact O-N 2.86Å; I179-M182 PolarHBondContact O-N 3.34Å; I179-M183 HydrophobicContact CG2-SD 3.83Å; I179-M183 VanDerWaalsContact O-CG 3.31Å; I179-M183 WeakPolarHBondContact O-CG 3.47Å; I179-M183 PolarHBondContact O-N 3.46Å; I179-L220 HydrophobicContact CB-CD2 3.85Å; I179-L220 HydrophobicContact CG2-CD2 3.4Å; I179-I262 HydrophobicContact CG1-CD1 4.27Å
180	I	91.1	Very high	85.4	Confident	20 Å²	20	48.8 Å²	48.8	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-52.2	176.8	-66.1	169.4	0	0	0	111.3	K176 K177 F178 M182 M183 E184 E217 L220 M221	K176-I180 WeakPolarHBondContact O-CG1 3.39Å; K176-I180 PolarHBondContact O-N 3.26Å; K176-I180 VanDerWaalsContact O-N 3.11Å; K177-I180 PolarHBondContact O-N 3.29Å; F178-I180 VanDerWaalsContact C-N 3.32Å; F178-I180 PolarHBondContact O-N 3.33Å; I180-M182 PolarHBondContact O-N 3.3Å; I180-M183 WeakPolarHBondContact O-CB 3.19Å; I180-M183 PolarHBondContact O-N 2.9Å; I180-E184 HydrophobicContact CG2-CG 4.18Å; I180-E184 WeakPolarHBondContact O-CG 3.33Å; I180-E184 PolarHBondContact O-N 3.46Å; I180-E217 HydrophobicContact CD1-CG 3.99Å; I180-E217 HydrophobicContact CG1-CG 4.16Å; I180-E217 HydrophobicContact CG2-CG 4.26Å; I180-L220 HydrophobicContact CD1-CD2 4.36Å; I180-L220 HydrophobicContact CG1-CD2 3.79Å; I180-M221 HydrophobicContact CD1-CG 3.78Å; I180-M221 HydrophobicContact CD1-SD 3.47Å; I180-M221 WeakPolarHBondContact CD1-SD 3.49Å
181	G	86.7	Confident	85.3	Confident	23 Å²	23	44.2 Å²	44.2	24%	0.237	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-32.2	-179	0	0	0	0	0	113.4	K177 F178 S185	K177-G181 PolarHBondContact O-N 2.9Å; F178-G181 PolarHBondContact O-N 3.1Å; G181-S185 VanDerWaalsContact O-CB 3.29Å; G181-S185 WeakPolarHBondContact O-CB 3.46Å; G181-S185 PolarHBondContact O-N 2.92Å
182	M	84.3	Confident	85.5	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-71.3	-42	172.7	-179.1	169.9	137.9	0	0	112.5	L157 F159 F178 I179 I180 L186 F193 V260 L327 F330 I334	L157-M182 HydrophobicContact CD1-CE 3.76Å; L157-M182 HydrophobicContact CD2-CE 3.78Å; L157-M182 HydrophobicContact CG-CE 4.48Å; F159-M182 HydrophobicContact CE1-CE 3.6Å; F159-M182 HydrophobicContact CE1-CG 4.45Å; F159-M182 HydrophobicContact CE1-SD 3.58Å; F159-M182 VanDerWaalsContact CE1-SD 3.58Å; F159-M182 HydrophobicContact CE2-CE 4.2Å; F159-M182 HydrophobicContact CZ-CB 4.01Å; F159-M182 HydrophobicContact CZ-CE 3.35Å; F159-M182 HydrophobicContact CZ-CG 3.88Å; F159-M182 HydrophobicContact CZ-SD 3.55Å; F159-M182 VanDerWaalsContact CZ-SD 3.55Å; F178-M182 HydrophobicContact CZ-SD 4.42Å; F178-M182 WeakPolarHBondContact O-CB 3.38Å; F178-M182 PolarHBondContact O-N 3.3Å; I179-M182 PolarHBondContact O-N 3.34Å; I180-M182 PolarHBondContact O-N 3.3Å; M182-L186 HydrophobicContact CE-CD1 4.32Å; M182-L186 HydrophobicContact CG-CD1 3.82Å; M182-L186 WeakPolarHBondContact O-CB 3.32Å; M182-L186 WeakPolarHBondContact O-CG 3.28Å; M182-L186 PolarHBondContact O-N 3.02Å; M182-L186 VanDerWaalsContact O-N 3.17Å; M182-F193 HydrophobicContact CE-CE1 3.89Å; M182-V260 HydrophobicContact CE-CG2 4.45Å; M182-L327 HydrophobicContact CB-CD1 3.83Å; M182-F330 HydrophobicContact CE-CD1 4.15Å; M182-F330 HydrophobicContact CE-CE1 4.01Å; M182-F330 HydrophobicContact SD-CD1 3.66Å; M182-F330 HydrophobicContact SD-CE1 3.95Å; M182-I334 HydrophobicContact CE-CD1 3.31Å; M182-I334 HydrophobicContact SD-CD1 4.06Å
183	M	89.9	Confident	85.7	Confident	16 Å²	16	46 Å²	46	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-43	173.7	-72.5	164.8	50.5	0	0	112.2	F159 I179 I180 L186 K187 F193 F206 Y211 A216	F159-M183 HydrophobicContact CE2-CG 4.11Å; I179-M183 HydrophobicContact CG2-SD 3.83Å; I179-M183 VanDerWaalsContact O-CG 3.31Å; I179-M183 WeakPolarHBondContact O-CG 3.47Å; I179-M183 PolarHBondContact O-N 3.46Å; I180-M183 WeakPolarHBondContact O-CB 3.19Å; I180-M183 PolarHBondContact O-N 2.9Å; M183-L186 PolarHBondContact O-N 2.78Å; M183-K187 PolarHBondContact O-N 2.89Å; M183-K187 VanDerWaalsContact O-N 3.08Å; M183-F193 HydrophobicContact CG-CB 4.15Å; M183-F193 HydrophobicContact CG-CD1 4.1Å; M183-F193 HydrophobicContact CG-CD2 4.16Å; M183-F193 HydrophobicContact CG-CG 3.86Å; M183-F206 HydrophobicContact CE-CE2 4.45Å; M183-F206 HydrophobicContact CE-CZ 4.04Å; M183-F206 HydrophobicContact SD-CE1 4.24Å; M183-F206 HydrophobicContact SD-CE2 4.37Å; M183-F206 HydrophobicContact SD-CZ 3.57Å; M183-F206 VanDerWaalsContact SD-CZ 3.57Å; M183-Y211 HydrophobicContact CE-CD2 4.15Å; M183-Y211 HydrophobicContact CE-CE2 4.35Å; M183-A216 HydrophobicContact CE-CB 3.61Å
184	E	86.5	Confident	86	Confident	123 Å²	123	42.8 Å²	42.8	58%	0.575	22%	0.221	S	C	*	.	H	α-helix	trans	-62.9	-48.2	177	-72.4	-170	117.6	0	0	111.6	I180 L186 K187	I180-E184 HydrophobicContact CG2-CG 4.18Å; I180-E184 WeakPolarHBondContact O-CG 3.33Å; I180-E184 PolarHBondContact O-N 3.46Å; E184-L186 PolarHBondContact O-N 2.98Å; E184-K187 VanDerWaalsContact O-CB 3.23Å; E184-K187 WeakPolarHBondContact O-CB 3.42Å; E184-K187 PolarHBondContact O-N 2.8Å
185	S	79.8	Confident	86.5	Confident	69 Å²	69	40.6 Å²	40.6	48%	0.483	21%	0.211	S	C	.	.	H	α-helix	trans	-70.2	-16.5	-177.9	-168.6	0	0	0	0	114	G181 Q331	G181-S185 VanDerWaalsContact O-CB 3.29Å; G181-S185 WeakPolarHBondContact O-CB 3.46Å; G181-S185 PolarHBondContact O-N 2.92Å; S185-Q331 PolarHBondContact OG-NE2 3.24Å
186	L	78.8	Confident	86.9	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	6.1	178.2	-65.4	171.2	0	0	0	113.1	M182 M183 E184 N188 T189 I191 F193 Q331 I334 F335	M182-L186 HydrophobicContact CE-CD1 4.32Å; M182-L186 HydrophobicContact CG-CD1 3.82Å; M182-L186 WeakPolarHBondContact O-CB 3.32Å; M182-L186 WeakPolarHBondContact O-CG 3.28Å; M182-L186 PolarHBondContact O-N 3.02Å; M182-L186 VanDerWaalsContact O-N 3.17Å; M183-L186 PolarHBondContact O-N 2.78Å; E184-L186 PolarHBondContact O-N 2.98Å; L186-N188 PolarHBondContact O-N 3.06Å; L186-T189 HydrophobicContact CB-CG2 4.37Å; L186-T189 HydrophobicContact CD2-CG2 4.04Å; L186-T189 WeakPolarHBondContact O-CB 3.46Å; L186-T189 WeakPolarHBondContact O-CG2 3.39Å; L186-T189 PolarHBondContact O-N 2.92Å; L186-T189 PolarHBondContact O-OG1 2.91Å; L186-I191 HydrophobicContact CB-CD1 4.37Å; L186-I191 HydrophobicContact CD1-CD1 4.1Å; L186-I191 HydrophobicContact CD2-CD1 4.23Å; L186-I191 HydrophobicContact CG-CD1 4.47Å; L186-F193 HydrophobicContact CB-CE2 4.15Å; L186-F193 HydrophobicContact CB-CZ 3.75Å; L186-F193 HydrophobicContact CD1-CE1 4.31Å; L186-F193 HydrophobicContact CD1-CZ 3.78Å; L186-F193 HydrophobicContact CG-CZ 4.42Å; L186-Q331 HydrophobicContact CD2-CG 4.36Å; L186-I334 HydrophobicContact CD1-CD1 3.82Å; L186-I334 HydrophobicContact CD1-CG2 4.17Å; L186-F335 HydrophobicContact CD2-CE1 4.49Å; L186-F335 HydrophobicContact CD2-CZ 4.1Å
187	K	79.2	Confident	87.1	Confident	146 Å²	146	40.4 Å²	40.4	64%	0.635	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-20.8	-174.2	-172.2	168.9	-177.4	170.3	0	115.9	M183 E184	M183-K187 PolarHBondContact O-N 2.89Å; M183-K187 VanDerWaalsContact O-N 3.08Å; E184-K187 VanDerWaalsContact O-CB 3.23Å; E184-K187 WeakPolarHBondContact O-CB 3.42Å; E184-K187 PolarHBondContact O-N 2.8Å
188	N	72.4	Confident	87.4	Confident	166 Å²	166	34.1 Å²	34.1	89%	0.888	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.4	21.7	-179.1	-63.4	-19	0	0	0	113.4	L186	L186-N188 PolarHBondContact O-N 3.06Å
189	T	74.5	Confident	87.7	Confident	45 Å²	45	33.5 Å²	33.5	28%	0.276	18%	0.18	S	C	.	.	S	Bend	trans	-109.1	-177.7	-177.3	65.5	0	0	0	0	112.4	L186 I191 F335	L186-T189 HydrophobicContact CB-CG2 4.37Å; L186-T189 HydrophobicContact CD2-CG2 4.04Å; L186-T189 WeakPolarHBondContact O-CB 3.46Å; L186-T189 WeakPolarHBondContact O-CG2 3.39Å; L186-T189 PolarHBondContact O-N 2.92Å; L186-T189 PolarHBondContact O-OG1 2.91Å; T189-I191 PolarHBondContact O-N 3.04Å; T189-I191 WeakPolarHBondContact OG1-CB 3.22Å; T189-I191 VanDerWaalsContact OG1-CD1 3.29Å; T189-I191 WeakPolarHBondContact OG1-CD1 3.49Å; T189-I191 WeakPolarHBondContact OG1-CG1 3.5Å; T189-I191 PolarHBondContact OG1-N 2.79Å; T189-F335 HydrophobicContact CG2-CE1 4.01Å; T189-F335 HydrophobicContact CG2-CZ 4.46Å
190	S	78.5	Confident	87.5	Confident	31 Å²	31	36.7 Å²	36.7	22%	0.217	20%	0.199	C	C	.	.	S	Bend	trans	-76	7.1	176.6	-24.5	0	0	0	0	113.8	K152 A154 V155 E338	K152-S190 VanDerWaalsContact CB-OG 3.32Å; K152-S190 WeakPolarHBondContact CB-OG 3.44Å; K152-S190 WeakPolarHBondContact CD-OG 3.13Å; A154-S190 WeakPolarHBondContact CA-O 3.26Å; V155-S190 PolarHBondContact N-O 3.21Å; V155-S190 VanDerWaalsContact N-O 3.09Å; S190-E338 WeakPolarHBondContact CB-OE1 3.17Å; S190-E338 PolarHBondContact N-OE1 2.79Å; S190-E338 PolarHBondContact OG-OE1 3.02Å
191	I	85.5	Confident	87.4	Confident	4 Å²	4	40 Å²	40	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.2	-162.6	-49.6	168.3	0	0	0	110.9	V155 L157 L186 T189 F193 I334	V155-I191 HydrophobicContact CB-CB 4.48Å; V155-I191 HydrophobicContact CB-CG1 4.1Å; V155-I191 HydrophobicContact CB-CG2 4.29Å; V155-I191 HydrophobicContact CG1-CG2 4.44Å; V155-I191 HydrophobicContact CG2-CG1 4.49Å; V155-I191 CarbonylContact O-C 3.48Å; V155-I191 WeakPolarHBondContact O-CA 3.33Å; L157-I191 HydrophobicContact CB-CG2 3.93Å; L186-I191 HydrophobicContact CB-CD1 4.37Å; L186-I191 HydrophobicContact CD1-CD1 4.1Å; L186-I191 HydrophobicContact CD2-CD1 4.23Å; L186-I191 HydrophobicContact CG-CD1 4.47Å; T189-I191 PolarHBondContact O-N 3.04Å; T189-I191 WeakPolarHBondContact OG1-CB 3.22Å; T189-I191 VanDerWaalsContact OG1-CD1 3.29Å; T189-I191 WeakPolarHBondContact OG1-CD1 3.49Å; T189-I191 WeakPolarHBondContact OG1-CG1 3.5Å; T189-I191 PolarHBondContact OG1-N 2.79Å; I191-F193 HydrophobicContact CB-CE2 3.96Å; I191-F193 HydrophobicContact CB-CZ 3.98Å; I191-F193 HydrophobicContact CD1-CZ 4.48Å; I191-F193 HydrophobicContact CG2-CD1 4.39Å; I191-F193 HydrophobicContact CG2-CD2 4.27Å; I191-F193 HydrophobicContact CG2-CE1 3.84Å; I191-F193 HydrophobicContact CG2-CE2 3.7Å; I191-F193 HydrophobicContact CG2-CZ 3.45Å; I191-F193 VanDerWaalsContact CG2-CZ 3.45Å; I191-I334 HydrophobicContact CD1-CG2 3.23Å; I191-I334 HydrophobicContact CG1-CG2 4.47Å
192	K	91.3	Very high	87.6	Confident	55 Å²	55	41.8 Å²	41.8	24%	0.239	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.1	166.2	-63.6	-165.8	175.2	-160.1	0	110.3	V155 L157 F208 Y211 D212	V155-K192 PolarHBondContact O-N 3.17Å; L157-K192 PolarHBondContact N-O 3.12Å; K192-F208 HydrophobicContact CB-CB 4.45Å; K192-F208 HydrophobicContact CB-CD1 3.75Å; K192-F208 HydrophobicContact CB-CE1 4.47Å; K192-F208 HydrophobicContact CB-CG 4.45Å; K192-F208 HydrophobicContact CD-CB 4.41Å; K192-Y211 HydrophobicContact CB-CD1 4.34Å; K192-D212 WeakPolarHBondContact CE-OD1 3.26Å; K192-D212 VanDerWaalsContact NZ-CG 3.27Å; K192-D212 IonicContact NZ-OD1 3.37Å; K192-D212 PolarHBondContact NZ-OD1 3.36Å; K192-D212 IonicContact NZ-OD2 2.61Å; K192-D212 PolarHBondContact NZ-OD2 2.62Å
193	F	94.3	Very high	88.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.6	-178.8	-63.2	-87	0	0	0	112	L157 F159 M182 M183 L186 I191 F206 Y211	L157-F193 HydrophobicContact CB-CD1 4.31Å; L157-F193 HydrophobicContact CB-CE1 4.38Å; L157-F193 HydrophobicContact CD1-CE1 4.32Å; L157-F193 HydrophobicContact CD2-CD1 3.86Å; L157-F193 HydrophobicContact CD2-CE1 3.99Å; L157-F193 HydrophobicContact CG-CE1 4.47Å; L157-F193 CarbonylContact O-C 3.56Å; L157-F193 WeakPolarHBondContact O-CA 3.28Å; F159-F193 HydrophobicContact CD2-CD1 4.32Å; F159-F193 AromaticContact CE2-CD1 3.56Å; F159-F193 HydrophobicContact CE2-CD1 3.56Å; F159-F193 HydrophobicContact CE2-CE1 4.13Å; F159-F193 HydrophobicContact CE2-CG 4.45Å; F159-F193 HydrophobicContact CZ-CD1 4.31Å; F159-F193 HydrophobicContact CZ-CE1 4.45Å; M182-F193 HydrophobicContact CE-CE1 3.89Å; M183-F193 HydrophobicContact CG-CB 4.15Å; M183-F193 HydrophobicContact CG-CD1 4.1Å; M183-F193 HydrophobicContact CG-CD2 4.16Å; M183-F193 HydrophobicContact CG-CG 3.86Å; L186-F193 HydrophobicContact CB-CE2 4.15Å; L186-F193 HydrophobicContact CB-CZ 3.75Å; L186-F193 HydrophobicContact CD1-CE1 4.31Å; L186-F193 HydrophobicContact CD1-CZ 3.78Å; L186-F193 HydrophobicContact CG-CZ 4.42Å; I191-F193 HydrophobicContact CB-CE2 3.96Å; I191-F193 HydrophobicContact CB-CZ 3.98Å; I191-F193 HydrophobicContact CD1-CZ 4.48Å; I191-F193 HydrophobicContact CG2-CD1 4.39Å; I191-F193 HydrophobicContact CG2-CD2 4.27Å; I191-F193 HydrophobicContact CG2-CE1 3.84Å; I191-F193 HydrophobicContact CG2-CE2 3.7Å; I191-F193 HydrophobicContact CG2-CZ 3.45Å; I191-F193 VanDerWaalsContact CG2-CZ 3.45Å; F193-F206 HydrophobicContact CB-CE2 4.09Å; F193-F206 WeakPolarHBondContact O-CE2 3.35Å; F193-Y211 HydrophobicContact CB-CD2 4Å; F193-Y211 HydrophobicContact CB-CE2 4.29Å; F193-Y211 HydrophobicContact CB-CG 4.23Å; F193-Y211 HydrophobicContact CD2-CD2 4.19Å; F193-Y211 HydrophobicContact CD2-CE1 4.05Å; F193-Y211 AromaticContact CD2-CE2 3.62Å; F193-Y211 HydrophobicContact CD2-CE2 3.62Å; F193-Y211 AromaticContact CD2-CZ 3.54Å; F193-Y211 HydrophobicContact CE2-CE2 4.48Å; F193-Y211 HydrophobicContact CG-CE2 4.39Å; F193-Y211 VanDerWaalsContact O-CB 3.23Å; F193-Y211 WeakPolarHBondContact O-CB 3.38Å
194	A	96.9	Very high	88.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	163.5	162.5	0	0	0	0	0	109.2	L157 V158 F159 F206 F208 L243	L157-A194 PolarHBondContact O-N 2.89Å; V158-A194 WeakPolarHBondContact CA-O 3.45Å; V158-A194 HydrophobicContact CG1-CB 4.3Å; V158-A194 HydrophobicContact CG2-CB 4.28Å; F159-A194 PolarHBondContact N-O 3.21Å; A194-F206 VanDerWaalsContact CA-CE2 3.46Å; A194-F206 WeakPolarHBondContact CA-O 3.36Å; A194-F208 HydrophobicContact CB-CD1 3.81Å; A194-F208 HydrophobicContact CB-CD2 4.41Å; A194-F208 HydrophobicContact CB-CE1 3.63Å; A194-F208 HydrophobicContact CB-CE2 4.26Å; A194-F208 HydrophobicContact CB-CG 4.21Å; A194-F208 HydrophobicContact CB-CZ 3.88Å; A194-L243 HydrophobicContact CB-CD1 3.92Å; A194-L243 HydrophobicContact CB-CD2 4.36Å
195	A	97.5	Very high	88.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	143.3	175.2	0	0	0	0	0	113.1	F159 F161 V205 F206	F159-A195 HydrophobicContact CB-CB 4.12Å; F159-A195 CarbonylContact O-C 3.52Å; F159-A195 WeakPolarHBondContact O-CA 3.25Å; F161-A195 HydrophobicContact CD1-CB 4.46Å; F161-A195 HydrophobicContact CE1-CB 4.04Å; A195-V205 HydrophobicContact CB-CB 4.38Å; A195-V205 PolarHBondContact O-N 2.84Å; A195-F206 HydrophobicContact CB-CD1 3.81Å; A195-F206 HydrophobicContact CB-CE1 3.32Å; A195-F206 HydrophobicContact CB-CE2 4.38Å; A195-F206 HydrophobicContact CB-CZ 3.64Å; A195-F206 PolarHBondContact N-O 2.85Å; A195-F206 PolarHBondContact O-N 3.39Å
196	V	97.7	Very high	89.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.9	178.1	176.8	0	0	0	0	108	V158 F159 L160 F161 R203 F238 L243	V158-V196 HydrophobicContact CG1-CG2 4.1Å; F159-V196 PolarHBondContact O-N 3.48Å; L160-V196 HydrophobicContact CD1-CB 3.88Å; L160-V196 HydrophobicContact CD1-CG1 3.71Å; F161-V196 VanDerWaalsContact CD1-O 3.23Å; F161-V196 WeakPolarHBondContact CD1-O 3.39Å; F161-V196 PolarHBondContact N-O 3.23Å; V196-R203 WeakPolarHBondContact CA-O 3.34Å; V196-F238 HydrophobicContact CG1-CD1 3.95Å; V196-F238 HydrophobicContact CG1-CE1 3.85Å; V196-F238 HydrophobicContact CG2-CD1 4.41Å; V196-F238 HydrophobicContact CG2-CE1 4.04Å; V196-L243 HydrophobicContact CG2-CD1 3.44Å; V196-L243 VanDerWaalsContact CG2-CD1 3.44Å
197	Q	96.7	Very high	90.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	136.5	164	-171.1	-173.1	172.3	0	0	108.2	F161 G163 F172 Y202 R203 V205 E223 E224 M226	F161-Q197 HydrophobicContact CD2-CG 4.48Å; F161-Q197 HydrophobicContact CE1-CB 4.21Å; F161-Q197 HydrophobicContact CE2-CB 4.13Å; F161-Q197 HydrophobicContact CE2-CG 4.1Å; F161-Q197 HydrophobicContact CZ-CB 3.89Å; F161-Q197 HydrophobicContact CZ-CG 4.37Å; F161-Q197 WeakPolarHBondContact O-CA 3.31Å; G163-Q197 VanDerWaalsContact CA-OE1 3.29Å; F172-Q197 HydrophobicContact CE2-CG 4.23Å; Q197-Y202 WeakPolarHBondContact O-CA 3.46Å; Q197-R203 PolarHBondContact N-O 2.71Å; Q197-R203 VanDerWaalsContact N-O 3.14Å; Q197-R203 PolarHBondContact O-N 3.42Å; Q197-V205 HydrophobicContact CB-CG2 4.1Å; Q197-E223 PolarHBondContact NE2-OE1 2.81Å; Q197-E224 PolarHBondContact NE2-O 3.45Å; Q197-M226 HydrophobicContact CB-CE 3.95Å; Q197-M226 HydrophobicContact CG-CE 4.09Å; Q197-M226 HydrophobicContact CG-CG 4.37Å; Q197-M226 HydrophobicContact CG-SD 4.05Å
198	F	94.8	Very high	91.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.1	174.2	81.6	-81.9	0	0	0	113.3	L160 F161 D162 G163 T230 T232 A235	L160-F198 HydrophobicContact CD1-CB 4.08Å; L160-F198 HydrophobicContact CD1-CD1 3.58Å; L160-F198 HydrophobicContact CD1-CE1 4.37Å; L160-F198 HydrophobicContact CD1-CG 4.07Å; L160-F198 HydrophobicContact CG-CD1 3.76Å; L160-F198 HydrophobicContact CG-CE1 4.05Å; F161-F198 VanDerWaalsContact C-CD1 3.49Å; F161-F198 VanDerWaalsContact O-CD1 3.25Å; F161-F198 WeakPolarHBondContact O-CD1 3.3Å; F161-F198 PolarHBondContact O-N 3.11Å; D162-F198 CarbonylContact C-O 3.55Å; D162-F198 HydrophobicContact CB-CE1 4.02Å; D162-F198 HydrophobicContact CB-CZ 4.05Å; G163-F198 PolarHBondContact N-O 3.41Å; F198-T230 HydrophobicContact CE2-CG2 3.79Å; F198-T230 HydrophobicContact CZ-CG2 4.25Å; F198-T232 HydrophobicContact CE2-CG2 4.15Å; F198-T232 WeakPolarHBondContact CE2-OG1 3.43Å; F198-T232 HydrophobicContact CZ-CG2 4.01Å; F198-A235 HydrophobicContact CB-CB 3.41Å; F198-A235 VanDerWaalsContact CB-CB 3.41Å; F198-A235 HydrophobicContact CD2-CB 3.91Å; F198-A235 HydrophobicContact CG-CB 3.71Å
199	S	93.4	Very high	92.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	16%	0.161	C	C	.	.	S	Bend	trans	-156.7	-128.6	173.9	-178.6	0	0	0	0	108.4	S164 T201 G228 L229 N231	S164-S199 WeakPolarHBondContact CA-OG 3.37Å; S199-T201 CarbonylContact C-O 3.58Å; S199-T201 PolarHBondContact N-O 3.39Å; S199-T201 PolarHBondContact O-N 2.73Å; S199-G228 WeakPolarHBondContact OG-CA 3.43Å; S199-G228 PolarHBondContact OG-N 2.89Å; S199-L229 CarbonylContact C-O 3.57Å; S199-L229 WeakPolarHBondContact CA-O 3.38Å; S199-L229 WeakPolarHBondContact CB-O 3.34Å; S199-L229 PolarHBondContact OG-N 3.21Å; S199-L229 PolarHBondContact OG-O 3.19Å; S199-N231 WeakPolarHBondContact O-CB 3.35Å; S199-N231 PolarHBondContact O-N 2.69Å
200	T	87.5	Confident	93.4	Very high	67 Å²	67	30.2 Å²	30.2	41%	0.411	15%	0.153	S	C	.	.	S	Bend	trans	-58.6	-39.3	167.4	-52.5	0	0	0	0	111	G228 L229 N231	T200-G228 WeakPolarHBondContact OG1-CA 3.41Å; T200-L229 PolarHBondContact N-O 3.02Å; T200-L229 PolarHBondContact OG1-N 2.85Å; T200-N231 WeakPolarHBondContact CA-ND2 3.49Å; T200-N231 PolarHBondContact O-ND2 2.92Å
201	T	88.4	Confident	94.1	Very high	89 Å²	89	30.8 Å²	30.8	55%	0.546	15%	0.151	S	C	.	.	S	Bend	trans	-114.6	174.5	173.9	51.5	0	0	0	0	109.5	S199	S199-T201 CarbonylContact C-O 3.58Å; S199-T201 PolarHBondContact N-O 3.39Å; S199-T201 PolarHBondContact O-N 2.73Å
202	Y	91.9	Very high	94.4	Very high	62 Å²	62	34.7 Å²	34.7	24%	0.243	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	146.7	-179.3	38	-95.1	0	0	0	109.2	Q197 R234 A235 F238	Q197-Y202 WeakPolarHBondContact O-CA 3.46Å; Y202-R234 HydrophobicContact CE1-CG 3.68Å; Y202-R234 PolarHBondContact OH-NE 2.95Å; Y202-R234 PolarHBondContact OH-NH2 2.97Å; Y202-A235 HydrophobicContact CD1-CB 4.43Å; Y202-F238 HydrophobicContact CD2-CB 3.64Å; Y202-F238 AromaticContact CD2-CD1 3.72Å; Y202-F238 HydrophobicContact CD2-CD1 3.72Å; Y202-F238 AromaticContact CD2-CD2 3.37Å; Y202-F238 HydrophobicContact CD2-CD2 3.37Å; Y202-F238 HydrophobicContact CD2-CE1 4.19Å; Y202-F238 AromaticContact CD2-CE2 3.85Å; Y202-F238 HydrophobicContact CD2-CE2 3.85Å; Y202-F238 AromaticContact CD2-CG 3.28Å; Y202-F238 HydrophobicContact CD2-CG 3.28Å; Y202-F238 HydrophobicContact CD2-CZ 4.24Å; Y202-F238 HydrophobicContact CE2-CB 3.69Å; Y202-F238 HydrophobicContact CE2-CD1 4.48Å; Y202-F238 AromaticContact CE2-CD2 3.38Å; Y202-F238 HydrophobicContact CE2-CD2 3.38Å; Y202-F238 HydrophobicContact CE2-CE2 4.08Å; Y202-F238 AromaticContact CE2-CG 3.61Å; Y202-F238 HydrophobicContact CE2-CG 3.61Å; Y202-F238 HydrophobicContact CG-CB 4.25Å; Y202-F238 HydrophobicContact CG-CD1 4.33Å; Y202-F238 HydrophobicContact CG-CG 4.15Å
203	R	94.5	Very high	94.5	Very high	93 Å²	93	35.7 Å²	35.7	35%	0.351	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	145.3	175	74.1	-163.4	176	-144.5	-8.2	112	V196 Q197 V205 E223 E224 M226	V196-R203 WeakPolarHBondContact CA-O 3.34Å; Q197-R203 PolarHBondContact N-O 2.71Å; Q197-R203 VanDerWaalsContact N-O 3.14Å; Q197-R203 PolarHBondContact O-N 3.42Å; R203-V205 PolarHBondContact O-N 2.81Å; R203-E223 IonicContact CZ-OE1 2.7Å; R203-E223 IonicContact CZ-OE2 3.49Å; R203-E223 IonicContact NE-OE1 2.7Å; R203-E223 PolarHBondContact NE-OE1 2.86Å; R203-E223 IonicContact NE-OE2 3.21Å; R203-E223 PolarHBondContact NE-OE2 2.92Å; R203-E223 IonicContact NH2-OE1 2.7Å; R203-E223 PolarHBondContact NH2-OE1 3.08Å; R203-E223 IonicContact NH2-OE2 3.33Å; R203-E223 PolarHBondContact NH2-OE2 3.14Å; R203-E224 PolarHBondContact NH2-O 3.13Å; R203-M226 HydrophobicContact CB-CE 4.27Å; R203-M226 HydrophobicContact CG-CE 3.55Å
204	T	96.8	Very high	94.3	Very high	53 Å²	53	39 Å²	39	33%	0.325	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	120.7	170.2	-55	0	0	0	0	109.6	N207 L243	T204-N207 HydrophobicContact CG2-CB 4.13Å; T204-L243 HydrophobicContact CG2-CD1 4.45Å; T204-L243 HydrophobicContact CG2-CD2 3.91Å
205	V	96.9	Very high	94.2	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.055	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-45.7	176.5	-171	0	0	0	0	109.8	F161 A195 Q197 R203 K219 L220 E223	F161-V205 HydrophobicContact CE1-CG2 3.86Å; F161-V205 HydrophobicContact CZ-CG2 3.97Å; A195-V205 HydrophobicContact CB-CB 4.38Å; A195-V205 PolarHBondContact O-N 2.84Å; Q197-V205 HydrophobicContact CB-CG2 4.1Å; R203-V205 PolarHBondContact O-N 2.81Å; V205-K219 WeakPolarHBondContact O-CD 3.47Å; V205-L220 HydrophobicContact CG1-CB 4.45Å; V205-L220 HydrophobicContact CG1-CD1 4.1Å; V205-E223 HydrophobicContact CB-CG 4.48Å; V205-E223 HydrophobicContact CG1-CB 3.74Å; V205-E223 HydrophobicContact CG1-CG 3.79Å; V205-E223 HydrophobicContact CG2-CG 3.84Å
206	F	97.5	Very high	94	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	147.5	168.7	66.2	-95.9	0	0	0	109.5	M183 F193 A194 A195 D210 A216 K219 L220	M183-F206 HydrophobicContact CE-CE2 4.45Å; M183-F206 HydrophobicContact CE-CZ 4.04Å; M183-F206 HydrophobicContact SD-CE1 4.24Å; M183-F206 HydrophobicContact SD-CE2 4.37Å; M183-F206 HydrophobicContact SD-CZ 3.57Å; M183-F206 VanDerWaalsContact SD-CZ 3.57Å; F193-F206 HydrophobicContact CB-CE2 4.09Å; F193-F206 WeakPolarHBondContact O-CE2 3.35Å; A194-F206 VanDerWaalsContact CA-CE2 3.46Å; A194-F206 WeakPolarHBondContact CA-O 3.36Å; A195-F206 HydrophobicContact CB-CD1 3.81Å; A195-F206 HydrophobicContact CB-CE1 3.32Å; A195-F206 HydrophobicContact CB-CE2 4.38Å; A195-F206 HydrophobicContact CB-CZ 3.64Å; A195-F206 PolarHBondContact N-O 2.85Å; A195-F206 PolarHBondContact O-N 3.39Å; F206-D210 WeakPolarHBondContact CA-OD2 3.48Å; F206-D210 HydrophobicContact CB-CB 3.78Å; F206-A216 HydrophobicContact CB-CB 4.27Å; F206-A216 HydrophobicContact CD1-CB 3.99Å; F206-A216 HydrophobicContact CD2-CB 3.38Å; F206-A216 HydrophobicContact CE1-CB 4.13Å; F206-A216 HydrophobicContact CE2-CB 3.54Å; F206-A216 HydrophobicContact CG-CB 3.63Å; F206-A216 HydrophobicContact CZ-CB 3.94Å; F206-K219 HydrophobicContact CB-CB 4.35Å; F206-K219 HydrophobicContact CB-CD 4.07Å; F206-L220 HydrophobicContact CD1-CB 4.26Å; F206-L220 HydrophobicContact CE1-CB 4.14Å; F206-L220 HydrophobicContact CE1-CD2 4.26Å
207	N	97	Very high	93.8	Very high	36 Å²	36	49 Å²	49	19%	0.193	26%	0.259	C	S	.	.			trans	-103.2	177.9	175	65.5	25.1	0	0	0	112.1	T204 K209 D210 Y211 L243 A249	T204-N207 HydrophobicContact CG2-CB 4.13Å; N207-K209 PolarHBondContact O-N 3.4Å; N207-K209 WeakPolarHBondContact OD1-CB 3.37Å; N207-K209 PolarHBondContact OD1-N 3.35Å; N207-K209 VanDerWaalsContact OD1-N 3.17Å; N207-D210 PolarHBondContact N-OD2 3.18Å; N207-D210 VanDerWaalsContact N-OD2 3.08Å; N207-D210 WeakPolarHBondContact O-CB 3.38Å; N207-D210 PolarHBondContact O-N 2.87Å; N207-D210 PolarHBondContact OD1-N 3.36Å; N207-D210 PolarHBondContact OD1-OD2 3.08Å; N207-Y211 PolarHBondContact O-N 3.38Å; N207-L243 HydrophobicContact CB-CD2 3.64Å; N207-A249 HydrophobicContact CB-CB 4.08Å; N207-A249 WeakPolarHBondContact CB-O 3.27Å
208	F	95.4	Very high	93.7	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-34	-179.2	-56.9	-65.1	0	0	0	112.6	D156 V158 K192 A194 Y211 D212 L243 L244 A249 A251	D156-F208 HydrophobicContact CB-CE1 3.91Å; D156-F208 HydrophobicContact CB-CE2 4.26Å; D156-F208 HydrophobicContact CB-CZ 3.69Å; V158-F208 HydrophobicContact CG2-CE1 4.41Å; V158-F208 HydrophobicContact CG2-CZ 3.7Å; K192-F208 HydrophobicContact CB-CB 4.45Å; K192-F208 HydrophobicContact CB-CD1 3.75Å; K192-F208 HydrophobicContact CB-CE1 4.47Å; K192-F208 HydrophobicContact CB-CG 4.45Å; K192-F208 HydrophobicContact CD-CB 4.41Å; A194-F208 HydrophobicContact CB-CD1 3.81Å; A194-F208 HydrophobicContact CB-CD2 4.41Å; A194-F208 HydrophobicContact CB-CE1 3.63Å; A194-F208 HydrophobicContact CB-CE2 4.26Å; A194-F208 HydrophobicContact CB-CG 4.21Å; A194-F208 HydrophobicContact CB-CZ 3.88Å; F208-Y211 WeakPolarHBondContact O-CB 3.25Å; F208-Y211 PolarHBondContact O-N 2.96Å; F208-D212 PolarHBondContact O-N 2.89Å; F208-L243 HydrophobicContact CE2-CB 4.25Å; F208-L244 HydrophobicContact CE2-CD2 4.48Å; F208-L244 HydrophobicContact CZ-CD2 4.08Å; F208-A249 PolarHBondContact N-O 3.26Å; F208-A249 VanDerWaalsContact N-O 3.16Å; F208-A251 HydrophobicContact CD2-CB 3.91Å; F208-A251 HydrophobicContact CE2-CB 3.98Å
209	K	94	Very high	93.7	Very high	115 Å²	115	54.8 Å²	54.8	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-67.8	-38.6	172.9	-175.8	178.3	178.2	179.9	0	112.7	N207 Y211 D212 D213 A249	N207-K209 PolarHBondContact O-N 3.4Å; N207-K209 WeakPolarHBondContact OD1-CB 3.37Å; N207-K209 PolarHBondContact OD1-N 3.35Å; N207-K209 VanDerWaalsContact OD1-N 3.17Å; K209-Y211 PolarHBondContact O-N 3.27Å; K209-D212 PolarHBondContact O-N 3.31Å; K209-D213 WeakPolarHBondContact O-CB 3.37Å; K209-D213 PolarHBondContact O-N 2.81Å; K209-A249 PolarHBondContact N-O 2.82Å; K209-A249 VanDerWaalsContact N-O 3.13Å
210	D	94.9	Very high	93.8	Very high	20 Å²	20	54.7 Å²	54.7	11%	0.107	30%	0.295	C	S	.	.	H	α-helix	trans	-65.5	-27.3	173.7	-68.9	-53.4	0	0	0	112.4	F206 N207 G214 K215 A216 K219	F206-D210 WeakPolarHBondContact CA-OD2 3.48Å; F206-D210 HydrophobicContact CB-CB 3.78Å; N207-D210 PolarHBondContact N-OD2 3.18Å; N207-D210 VanDerWaalsContact N-OD2 3.08Å; N207-D210 WeakPolarHBondContact O-CB 3.38Å; N207-D210 PolarHBondContact O-N 2.87Å; N207-D210 PolarHBondContact OD1-N 3.36Å; N207-D210 PolarHBondContact OD1-OD2 3.08Å; D210-G214 PolarHBondContact O-N 3.21Å; D210-K215 HydrophobicContact CB-CB 4.49Å; D210-K215 WeakPolarHBondContact O-CA 3.43Å; D210-K215 WeakPolarHBondContact O-CB 3.35Å; D210-K215 PolarHBondContact O-N 2.69Å; D210-A216 PolarHBondContact O-N 2.73Å; D210-A216 VanDerWaalsContact O-N 3.13Å; D210-K219 WeakPolarHBondContact OD1-CE 3.18Å; D210-K219 IonicContact OD1-NZ 3.79Å; D210-K219 PolarHBondContact OD1-NZ 2.69Å; D210-K219 IonicContact OD2-NZ 2.61Å; D210-K219 PolarHBondContact OD2-NZ 2.76Å
211	Y	94.1	Very high	94.1	Very high	43 Å²	43	55.3 Å²	55.3	17%	0.169	29%	0.294	C	S	.	.	H	α-helix	trans	-72.7	-50.2	170.7	176.4	-101.6	0	0	0	111.6	M183 K192 F193 N207 F208 K209 D213 G214 A216	M183-Y211 HydrophobicContact CE-CD2 4.15Å; M183-Y211 HydrophobicContact CE-CE2 4.35Å; K192-Y211 HydrophobicContact CB-CD1 4.34Å; F193-Y211 HydrophobicContact CB-CD2 4Å; F193-Y211 HydrophobicContact CB-CE2 4.29Å; F193-Y211 HydrophobicContact CB-CG 4.23Å; F193-Y211 HydrophobicContact CD2-CD2 4.19Å; F193-Y211 HydrophobicContact CD2-CE1 4.05Å; F193-Y211 AromaticContact CD2-CE2 3.62Å; F193-Y211 HydrophobicContact CD2-CE2 3.62Å; F193-Y211 AromaticContact CD2-CZ 3.54Å; F193-Y211 HydrophobicContact CE2-CE2 4.48Å; F193-Y211 HydrophobicContact CG-CE2 4.39Å; F193-Y211 VanDerWaalsContact O-CB 3.23Å; F193-Y211 WeakPolarHBondContact O-CB 3.38Å; N207-Y211 PolarHBondContact O-N 3.38Å; F208-Y211 WeakPolarHBondContact O-CB 3.25Å; F208-Y211 PolarHBondContact O-N 2.96Å; K209-Y211 PolarHBondContact O-N 3.27Å; Y211-D213 VanDerWaalsContact C-N 3.25Å; Y211-D213 PolarHBondContact O-N 2.64Å; Y211-G214 PolarHBondContact O-N 2.74Å; Y211-A216 HydrophobicContact CD2-CB 4.22Å
212	D	90.9	Very high	94.3	Very high	85 Å²	85	59.4 Å²	59.4	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-56	-39.6	174	-67	-26	0	0	0	111.9	K192 F208 K209 G214	K192-D212 WeakPolarHBondContact CE-OD1 3.26Å; K192-D212 VanDerWaalsContact NZ-CG 3.27Å; K192-D212 IonicContact NZ-OD1 3.37Å; K192-D212 PolarHBondContact NZ-OD1 3.36Å; K192-D212 IonicContact NZ-OD2 2.61Å; K192-D212 PolarHBondContact NZ-OD2 2.62Å; F208-D212 PolarHBondContact O-N 2.89Å; K209-D212 PolarHBondContact O-N 3.31Å; D212-G214 PolarHBondContact O-N 2.91Å
213	D	92.7	Very high	94.5	Very high	76 Å²	76	57.6 Å²	57.6	41%	0.406	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-3.2	176.6	-82.2	-0.1	0	0	0	113.6	K209 Y211 K215	K209-D213 WeakPolarHBondContact O-CB 3.37Å; K209-D213 PolarHBondContact O-N 2.81Å; Y211-D213 VanDerWaalsContact C-N 3.25Å; Y211-D213 PolarHBondContact O-N 2.64Å; D213-K215 VanDerWaalsContact C-N 3.34Å; D213-K215 HydrophobicContact CB-CD 3.73Å; D213-K215 HydrophobicContact CB-CG 4.13Å; D213-K215 PolarHBondContact O-N 3.24Å; D213-K215 IonicContact OD2-NZ 3.38Å; D213-K215 PolarHBondContact OD2-NZ 2.95Å
214	G	91.3	Very high	94.4	Very high	69 Å²	69	60.1 Å²	60.1	71%	0.711	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	19.2	-179.2	0	0	0	0	0	115.5	D210 Y211 D212	D210-G214 PolarHBondContact O-N 3.21Å; Y211-G214 PolarHBondContact O-N 2.74Å; D212-G214 PolarHBondContact O-N 2.91Å
215	K	94	Very high	94.3	Very high	104 Å²	104	59.2 Å²	59.2	45%	0.452	31%	0.306	S	S	.	.			trans	-98.9	-15.6	-173.5	-65.5	163.5	-170.8	161.1	0	114	D210 D213 E217 G218 K219	D210-K215 HydrophobicContact CB-CB 4.49Å; D210-K215 WeakPolarHBondContact O-CA 3.43Å; D210-K215 WeakPolarHBondContact O-CB 3.35Å; D210-K215 PolarHBondContact O-N 2.69Å; D213-K215 VanDerWaalsContact C-N 3.34Å; D213-K215 HydrophobicContact CB-CD 3.73Å; D213-K215 HydrophobicContact CB-CG 4.13Å; D213-K215 PolarHBondContact O-N 3.24Å; D213-K215 IonicContact OD2-NZ 3.38Å; D213-K215 PolarHBondContact OD2-NZ 2.95Å; K215-E217 PolarHBondContact O-N 3.03Å; K215-G218 PolarHBondContact O-N 2.85Å; K215-K219 PolarHBondContact O-N 2.85Å
216	A	93.9	Very high	94.1	Very high	3 Å²	3	60.6 Å²	60.6	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-50.8	-55	-171	0	0	0	0	0	114.6	M183 F206 D210 Y211 G218 K219 L220	M183-A216 HydrophobicContact CE-CB 3.61Å; F206-A216 HydrophobicContact CB-CB 4.27Å; F206-A216 HydrophobicContact CD1-CB 3.99Å; F206-A216 HydrophobicContact CD2-CB 3.38Å; F206-A216 HydrophobicContact CE1-CB 4.13Å; F206-A216 HydrophobicContact CE2-CB 3.54Å; F206-A216 HydrophobicContact CG-CB 3.63Å; F206-A216 HydrophobicContact CZ-CB 3.94Å; D210-A216 PolarHBondContact O-N 2.73Å; D210-A216 VanDerWaalsContact O-N 3.13Å; Y211-A216 HydrophobicContact CD2-CB 4.22Å; A216-G218 PolarHBondContact O-N 2.85Å; A216-K219 PolarHBondContact O-N 2.85Å; A216-L220 WeakPolarHBondContact O-CB 3.44Å; A216-L220 PolarHBondContact O-N 3.44Å
217	E	94	Very high	93.6	Very high	105 Å²	105	66.8 Å²	66.8	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-47.6	179.6	-172.4	-157.1	142	0	0	112	I180 K215 K219 L220 M221	I180-E217 HydrophobicContact CD1-CG 3.99Å; I180-E217 HydrophobicContact CG1-CG 4.16Å; I180-E217 HydrophobicContact CG2-CG 4.26Å; K215-E217 PolarHBondContact O-N 3.03Å; E217-K219 VanDerWaalsContact C-N 3.27Å; E217-K219 PolarHBondContact O-N 2.86Å; E217-L220 PolarHBondContact O-N 3.01Å; E217-M221 PolarHBondContact O-N 3.38Å
218	G	92.9	Very high	93.2	Very high	40 Å²	40	65.9 Å²	65.9	41%	0.412	34%	0.339	S	S	.	.	H	α-helix	trans	-71.1	-15.7	-179.7	0	0	0	0	0	114.9	K215 A216 K222	K215-G218 PolarHBondContact O-N 2.85Å; A216-G218 PolarHBondContact O-N 2.85Å; G218-K222 VanDerWaalsContact O-CD 3.29Å; G218-K222 WeakPolarHBondContact O-CD 3.4Å; G218-K222 WeakPolarHBondContact O-CE 3.28Å; G218-K222 WeakPolarHBondContact O-CG 3.39Å
219	K	96	Very high	92.9	Very high	80 Å²	80	70.5 Å²	70.5	35%	0.348	36%	0.363	S	S	.	.	H	α-helix	trans	-82.7	-50	164.1	-71.3	-163.1	-175.9	-175.1	0	110.9	V205 F206 D210 K215 A216 E217 M221 K222 E223	V205-K219 WeakPolarHBondContact O-CD 3.47Å; F206-K219 HydrophobicContact CB-CB 4.35Å; F206-K219 HydrophobicContact CB-CD 4.07Å; D210-K219 WeakPolarHBondContact OD1-CE 3.18Å; D210-K219 IonicContact OD1-NZ 3.79Å; D210-K219 PolarHBondContact OD1-NZ 2.69Å; D210-K219 IonicContact OD2-NZ 2.61Å; D210-K219 PolarHBondContact OD2-NZ 2.76Å; K215-K219 PolarHBondContact O-N 2.85Å; A216-K219 PolarHBondContact O-N 2.85Å; E217-K219 VanDerWaalsContact C-N 3.27Å; E217-K219 PolarHBondContact O-N 2.86Å; K219-M221 PolarHBondContact O-N 3.34Å; K219-K222 PolarHBondContact O-N 2.96Å; K219-E223 PolarHBondContact O-N 3.46Å
220	L	95.9	Very high	92.6	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56.5	-47.2	-177.2	-178.7	62.5	0	0	0	112.2	F161 K176 I179 I180 V205 F206 A216 E217 K222 E223	F161-L220 HydrophobicContact CE1-CD1 4.08Å; F161-L220 HydrophobicContact CZ-CD1 3.76Å; K176-L220 HydrophobicContact CB-CG 4.34Å; K176-L220 HydrophobicContact CD-CD1 4.3Å; K176-L220 HydrophobicContact CD-CG 4.4Å; K176-L220 WeakPolarHBondContact CD-O 3.28Å; K176-L220 HydrophobicContact CG-CD1 3.97Å; K176-L220 HydrophobicContact CG-CG 4.19Å; I179-L220 HydrophobicContact CB-CD2 3.85Å; I179-L220 HydrophobicContact CG2-CD2 3.4Å; I180-L220 HydrophobicContact CD1-CD2 4.36Å; I180-L220 HydrophobicContact CG1-CD2 3.79Å; V205-L220 HydrophobicContact CG1-CB 4.45Å; V205-L220 HydrophobicContact CG1-CD1 4.1Å; F206-L220 HydrophobicContact CD1-CB 4.26Å; F206-L220 HydrophobicContact CE1-CB 4.14Å; F206-L220 HydrophobicContact CE1-CD2 4.26Å; A216-L220 WeakPolarHBondContact O-CB 3.44Å; A216-L220 PolarHBondContact O-N 3.44Å; E217-L220 PolarHBondContact O-N 3.01Å; L220-K222 PolarHBondContact O-N 3.42Å; L220-E223 WeakPolarHBondContact O-CB 3.49Å; L220-E223 PolarHBondContact O-N 3.21Å
221	M	92.5	Very high	92.4	Very high	80 Å²	80	65.4 Å²	65.4	39%	0.394	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.7	178.6	-75.1	-57.5	-60.8	0	0	113.5	K176 I180 E217 K219 E223	K176-M221 PolarHBondContact NZ-O 2.84Å; K176-M221 VanDerWaalsContact NZ-O 3.16Å; I180-M221 HydrophobicContact CD1-CG 3.78Å; I180-M221 HydrophobicContact CD1-SD 3.47Å; I180-M221 WeakPolarHBondContact CD1-SD 3.49Å; E217-M221 PolarHBondContact O-N 3.38Å; K219-M221 PolarHBondContact O-N 3.34Å; M221-E223 VanDerWaalsContact C-N 3.35Å
222	K	93.5	Very high	92.2	Very high	174 Å²	174	63.3 Å²	63.3	76%	0.757	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.8	178.1	-63.6	177.2	-173.8	169.7	0	113.9	G218 K219 L220 E224	G218-K222 VanDerWaalsContact O-CD 3.29Å; G218-K222 WeakPolarHBondContact O-CD 3.4Å; G218-K222 WeakPolarHBondContact O-CE 3.28Å; G218-K222 WeakPolarHBondContact O-CG 3.39Å; K219-K222 PolarHBondContact O-N 2.96Å; L220-K222 PolarHBondContact O-N 3.42Å; K222-E224 PolarHBondContact O-N 2.94Å
223	E	95.1	Very high	92.1	Very high	25 Å²	25	60.4 Å²	60.4	12%	0.117	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-67.7	130.2	-177.9	-177.3	62.6	-175.6	0	0	110.8	F161 F172 K176 Q197 R203 V205 K219 L220 M221	F161-E223 HydrophobicContact CZ-CG 4.31Å; F172-E223 WeakPolarHBondContact CE1-O 3.44Å; F172-E223 HydrophobicContact CZ-CG 4.21Å; K176-E223 HydrophobicContact CD-CB 4.43Å; K176-E223 PolarHBondContact NZ-O 3.18Å; K176-E223 VanDerWaalsContact NZ-O 3.08Å; Q197-E223 PolarHBondContact NE2-OE1 2.81Å; R203-E223 IonicContact CZ-OE1 2.7Å; R203-E223 IonicContact CZ-OE2 3.49Å; R203-E223 IonicContact NE-OE1 2.7Å; R203-E223 PolarHBondContact NE-OE1 2.86Å; R203-E223 IonicContact NE-OE2 3.21Å; R203-E223 PolarHBondContact NE-OE2 2.92Å; R203-E223 IonicContact NH2-OE1 2.7Å; R203-E223 PolarHBondContact NH2-OE1 3.08Å; R203-E223 IonicContact NH2-OE2 3.33Å; R203-E223 PolarHBondContact NH2-OE2 3.14Å; V205-E223 HydrophobicContact CB-CG 4.48Å; V205-E223 HydrophobicContact CG1-CB 3.74Å; V205-E223 HydrophobicContact CG1-CG 3.79Å; V205-E223 HydrophobicContact CG2-CG 3.84Å; K219-E223 PolarHBondContact O-N 3.46Å; L220-E223 WeakPolarHBondContact O-CB 3.49Å; L220-E223 PolarHBondContact O-N 3.21Å; M221-E223 VanDerWaalsContact C-N 3.35Å
224	E	93.3	Very high	91.9	Very high	146 Å²	146	61.9 Å²	61.9	68%	0.682	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-92.8	137.9	-177	-62.6	-177.1	158.8	0	0	112.1	Q197 R203 K222 M226	Q197-E224 PolarHBondContact NE2-O 3.45Å; R203-E224 PolarHBondContact NH2-O 3.13Å; K222-E224 PolarHBondContact O-N 2.94Å; E224-M226 PolarHBondContact O-N 3.49Å
225	H	94.4	Very high	91.9	Very high	34 Å²	34	58.6 Å²	58.6	16%	0.157	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-69.1	122.6	-179.1	-178.3	-152.1	0	0	0	112.6	G163 S164 M167 F172 K227	G163-H225 PolarHBondContact O-CD2 2.72Å; G163-H225 PolarHBondContact O-NE2 3.4Å; S164-H225 PolarHBondContact O-CE1 2.87Å; S164-H225 PolarHBondContact O-NE2 2.84Å; M167-H225 PolarHBondContact O-CE1 3.04Å; F172-H225 HydrophobicContact CD1-CB 3.7Å; F172-H225 HydrophobicContact CD2-CB 4.28Å; F172-H225 AromaticContact CD2-CD2 3.88Å; F172-H225 HydrophobicContact CE1-CB 3.77Å; F172-H225 HydrophobicContact CE2-CB 4.35Å; F172-H225 HydrophobicContact CG-CB 3.94Å; F172-H225 HydrophobicContact CZ-CB 4.1Å; H225-K227 VanDerWaalsContact CE1-CG 3.42Å; H225-K227 WeakPolarHBondContact CE1-CG 3.49Å; H225-K227 WeakPolarHBondContact ND1-CE 3.38Å; H225-K227 WeakPolarHBondContact ND1-CG 2.72Å
226	M	92.6	Very high	91.8	Very high	38 Å²	38	53.7 Å²	53.7	19%	0.187	26%	0.26	C	S	.	.			trans	-71.5	-36.2	-170.2	-75.6	177.4	-176.9	0	0	116.3	G163 Q197 R203 E224	G163-M226 CarbonylContact O-C 3.54Å; G163-M226 PolarHBondContact O-N 2.04Å; Q197-M226 HydrophobicContact CB-CE 3.95Å; Q197-M226 HydrophobicContact CG-CE 4.09Å; Q197-M226 HydrophobicContact CG-CG 4.37Å; Q197-M226 HydrophobicContact CG-SD 4.05Å; R203-M226 HydrophobicContact CB-CE 4.27Å; R203-M226 HydrophobicContact CG-CE 3.55Å; E224-M226 PolarHBondContact O-N 3.49Å
227	K	88.1	Confident	91.7	Very high	130 Å²	130	55.9 Å²	55.9	57%	0.565	27%	0.272	S	S	*	.			trans	53.6	64.8	178.3	-61	177	-176.5	178.1	0	114.8	G163 H225	G163-K227 PolarHBondContact O-N 2.89Å; H225-K227 VanDerWaalsContact CE1-CG 3.42Å; H225-K227 WeakPolarHBondContact CE1-CG 3.49Å; H225-K227 WeakPolarHBondContact ND1-CE 3.38Å; H225-K227 WeakPolarHBondContact ND1-CG 2.72Å
228	G	88.3	Confident	91.7	Very high	17 Å²	17	52.9 Å²	52.9	18%	0.175	26%	0.257	C	S	.	.	S	Bend	trans	-141.4	-146.2	172.2	0	0	0	0	0	113.3	S164 E165 S199 T200	S164-G228 CarbonylContact C-O 3.38Å; S164-G228 VanDerWaalsContact CA-O 3.23Å; S164-G228 WeakPolarHBondContact CA-O 3.46Å; S164-G228 WeakPolarHBondContact CB-O 3.2Å; E165-G228 PolarHBondContact N-O 3.18Å; S199-G228 WeakPolarHBondContact OG-CA 3.43Å; S199-G228 PolarHBondContact OG-N 2.89Å; T200-G228 WeakPolarHBondContact OG1-CA 3.41Å
229	L	88.8	Confident	91.9	Very high	97 Å²	97	51 Å²	51	51%	0.508	24%	0.237	S	C	.	.			trans	-74.2	-176.2	177.5	-58.4	178.6	0	0	0	112.4	S164 S199 T200	S164-L229 WeakPolarHBondContact CB-O 3.5Å; S199-L229 CarbonylContact C-O 3.57Å; S199-L229 WeakPolarHBondContact CA-O 3.38Å; S199-L229 WeakPolarHBondContact CB-O 3.34Å; S199-L229 PolarHBondContact OG-N 3.21Å; S199-L229 PolarHBondContact OG-O 3.19Å; T200-L229 PolarHBondContact N-O 3.02Å; T200-L229 PolarHBondContact OG1-N 2.85Å
230	T	88.3	Confident	91.8	Very high	9 Å²	9	47.2 Å²	47.2	6%	0.055	22%	0.221	C	C	.	.			trans	-121.9	76.9	-178	-53.3	0	0	0	0	110.4	D162 S164 F198 T232 P267 S268	D162-T230 WeakPolarHBondContact OD2-CG2 3.46Å; S164-T230 WeakPolarHBondContact CB-OG1 3.08Å; S164-T230 PolarHBondContact OG-OG1 3.13Å; F198-T230 HydrophobicContact CE2-CG2 3.79Å; F198-T230 HydrophobicContact CZ-CG2 4.25Å; T230-T232 PolarHBondContact O-N 2.66Å; T230-T232 VanDerWaalsContact O-N 3.14Å; T230-P267 WeakPolarHBondContact O-CA 3.24Å; T230-S268 PolarHBondContact N-OG 3.38Å; T230-S268 PolarHBondContact O-N 3.27Å
231	N	90.3	Very high	91.6	Very high	18 Å²	18	52.7 Å²	52.7	10%	0.096	24%	0.243	C	C	.	.			trans	-88.7	67.5	-174.8	-65.7	-23	0	0	0	113	S199 T200 A235 E269	S199-N231 WeakPolarHBondContact O-CB 3.35Å; S199-N231 PolarHBondContact O-N 2.69Å; T200-N231 WeakPolarHBondContact CA-ND2 3.49Å; T200-N231 PolarHBondContact O-ND2 2.92Å; N231-A235 VanDerWaalsContact O-CB 3.3Å; N231-A235 WeakPolarHBondContact O-CB 3.4Å; N231-A235 PolarHBondContact O-N 3.16Å; N231-A235 VanDerWaalsContact O-N 3.11Å; N231-E269 HydrophobicContact CB-CG 4.4Å
232	T	89.1	Confident	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-40.5	-168.7	-39.9	0	0	0	0	114.6	F198 T230 A235 L236 I261 I305	F198-T232 HydrophobicContact CE2-CG2 4.15Å; F198-T232 WeakPolarHBondContact CE2-OG1 3.43Å; F198-T232 HydrophobicContact CZ-CG2 4.01Å; T230-T232 PolarHBondContact O-N 2.66Å; T230-T232 VanDerWaalsContact O-N 3.14Å; T232-A235 PolarHBondContact O-N 2.91Å; T232-L236 PolarHBondContact O-N 3.36Å; T232-I261 HydrophobicContact CG2-CG2 4.05Å; T232-I305 HydrophobicContact CG2-CD1 4.29Å
233	Y	89.2	Confident	91.8	Very high	23 Å²	23	45.5 Å²	45.5	9%	0.09	21%	0.211	C	C	.	.	H	α-helix	trans	-71.7	-41.2	-175.5	-64.7	-70.6	0	0	0	111.4	A235 L236 N237 P267 E269 D271 S276 V277 I305	Y233-A235 VanDerWaalsContact C-N 3.33Å; Y233-A235 PolarHBondContact O-N 3.42Å; Y233-L236 WeakPolarHBondContact O-CB 3.33Å; Y233-L236 PolarHBondContact O-N 3.2Å; Y233-N237 PolarHBondContact O-N 2.88Å; Y233-P267 HydrophobicContact CD2-CB 4.06Å; Y233-P267 HydrophobicContact CE2-CB 3.65Å; Y233-P267 HydrophobicContact CE2-CG 4.01Å; Y233-E269 HydrophobicContact CD2-CG 4.32Å; Y233-E269 WeakPolarHBondContact CD2-O 3.39Å; Y233-E269 VanDerWaalsContact CE2-O 3.31Å; Y233-E269 WeakPolarHBondContact CE2-O 2.93Å; Y233-E269 PolarHBondContact N-OE1 2.86Å; Y233-E269 VanDerWaalsContact N-OE1 3.11Å; Y233-D271 HydrophobicContact CD1-CB 3.6Å; Y233-D271 VanDerWaalsContact CD1-CG 3.49Å; Y233-D271 WeakPolarHBondContact CD1-OD1 3.09Å; Y233-D271 HydrophobicContact CD2-CB 4.21Å; Y233-D271 HydrophobicContact CE1-CB 3.6Å; Y233-D271 HydrophobicContact CE2-CB 4.2Å; Y233-D271 HydrophobicContact CG-CB 3.93Å; Y233-S276 PolarHBondContact O-OG 2.89Å; Y233-V277 HydrophobicContact CE1-CG2 4.05Å; Y233-I305 HydrophobicContact CE1-CD1 4.16Å; Y233-I305 HydrophobicContact CE1-CG1 3.97Å
234	R	88.3	Confident	91.7	Very high	108 Å²	108	44.3 Å²	44.3	41%	0.408	21%	0.205	S	C	.	.	H	α-helix	trans	-67.5	-34.2	174.5	-170.9	178	167.8	171.4	-4.6	112.2	Y202 N237 F238 E269 Y274	Y202-R234 HydrophobicContact CE1-CG 3.68Å; Y202-R234 PolarHBondContact OH-NE 2.95Å; Y202-R234 PolarHBondContact OH-NH2 2.97Å; R234-N237 PolarHBondContact O-N 2.82Å; R234-F238 PolarHBondContact O-N 2.74Å; R234-E269 VanDerWaalsContact CB-OE1 3.28Å; R234-E269 WeakPolarHBondContact CB-OE1 3.29Å; R234-E269 PolarHBondContact N-OE1 2.93Å; R234-Y274 HydrophobicContact CB-CE2 4.17Å; R234-Y274 HydrophobicContact CG-CE1 4.46Å
235	A	91.8	Very high	91.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-72.5	-31.9	175.6	0	0	0	0	0	113.1	L160 F198 Y202 N231 T232 Y233 T239	L160-A235 HydrophobicContact CD1-CB 3.94Å; L160-A235 HydrophobicContact CD2-CB 4.36Å; F198-A235 HydrophobicContact CB-CB 3.41Å; F198-A235 VanDerWaalsContact CB-CB 3.41Å; F198-A235 HydrophobicContact CD2-CB 3.91Å; F198-A235 HydrophobicContact CG-CB 3.71Å; Y202-A235 HydrophobicContact CD1-CB 4.43Å; N231-A235 VanDerWaalsContact O-CB 3.3Å; N231-A235 WeakPolarHBondContact O-CB 3.4Å; N231-A235 PolarHBondContact O-N 3.16Å; N231-A235 VanDerWaalsContact O-N 3.11Å; T232-A235 PolarHBondContact O-N 2.91Å; Y233-A235 VanDerWaalsContact C-N 3.33Å; Y233-A235 PolarHBondContact O-N 3.42Å; A235-T239 WeakPolarHBondContact O-CB 3.22Å; A235-T239 PolarHBondContact O-N 2.94Å; A235-T239 PolarHBondContact O-OG1 3.12Å
236	L	92.5	Very high	91.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-49.6	164.3	-79.8	167.3	0	0	0	111.2	L160 T232 Y233 F238 T239 L240 V259 I261 Y280 I305	L160-L236 HydrophobicContact CD2-CB 4.49Å; L160-L236 HydrophobicContact CD2-CD2 3.72Å; L160-L236 HydrophobicContact CD2-CG 3.76Å; T232-L236 PolarHBondContact O-N 3.36Å; Y233-L236 WeakPolarHBondContact O-CB 3.33Å; Y233-L236 PolarHBondContact O-N 3.2Å; L236-F238 VanDerWaalsContact C-N 3.28Å; L236-F238 PolarHBondContact O-N 2.86Å; L236-T239 WeakPolarHBondContact O-CB 3.32Å; L236-T239 PolarHBondContact O-N 2.86Å; L236-L240 PolarHBondContact O-N 2.93Å; L236-V259 HydrophobicContact CD2-CG1 4.11Å; L236-I261 HydrophobicContact CD1-CD1 4.02Å; L236-I261 HydrophobicContact CD2-CD1 3.87Å; L236-I261 HydrophobicContact CD2-CG1 4.46Å; L236-I261 HydrophobicContact CG-CD1 4.25Å; L236-Y280 HydrophobicContact CB-CE2 4.06Å; L236-Y280 HydrophobicContact CD2-CE1 4.05Å; L236-Y280 HydrophobicContact CD2-CE2 4.24Å; L236-Y280 PolarHBondContact O-OH 2.77Å; L236-I305 HydrophobicContact CD1-CG2 3.77Å
237	N	91.4	Very high	91.1	Very high	49 Å²	49	47 Å²	47	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-37.1	179.3	-165	47.1	0	0	0	112.9	Y233 R234 Y241	Y233-N237 PolarHBondContact O-N 2.88Å; R234-N237 PolarHBondContact O-N 2.82Å; N237-Y241 WeakPolarHBondContact O-CD2 3.36Å; N237-Y241 PolarHBondContact O-N 3.3Å; N237-Y241 WeakPolarHBondContact OD1-CE2 3.41Å
238	F	94.2	Very high	91.2	Very high	42 Å²	42	45 Å²	45	18%	0.184	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-48.3	169.9	170.9	-98.3	0	0	0	112.3	V196 Y202 R234 L236 L240 Y241 E242	V196-F238 HydrophobicContact CG1-CD1 3.95Å; V196-F238 HydrophobicContact CG1-CE1 3.85Å; V196-F238 HydrophobicContact CG2-CD1 4.41Å; V196-F238 HydrophobicContact CG2-CE1 4.04Å; Y202-F238 HydrophobicContact CD2-CB 3.64Å; Y202-F238 AromaticContact CD2-CD1 3.72Å; Y202-F238 HydrophobicContact CD2-CD1 3.72Å; Y202-F238 AromaticContact CD2-CD2 3.37Å; Y202-F238 HydrophobicContact CD2-CD2 3.37Å; Y202-F238 HydrophobicContact CD2-CE1 4.19Å; Y202-F238 AromaticContact CD2-CE2 3.85Å; Y202-F238 HydrophobicContact CD2-CE2 3.85Å; Y202-F238 AromaticContact CD2-CG 3.28Å; Y202-F238 HydrophobicContact CD2-CG 3.28Å; Y202-F238 HydrophobicContact CD2-CZ 4.24Å; Y202-F238 HydrophobicContact CE2-CB 3.69Å; Y202-F238 HydrophobicContact CE2-CD1 4.48Å; Y202-F238 AromaticContact CE2-CD2 3.38Å; Y202-F238 HydrophobicContact CE2-CD2 3.38Å; Y202-F238 HydrophobicContact CE2-CE2 4.08Å; Y202-F238 AromaticContact CE2-CG 3.61Å; Y202-F238 HydrophobicContact CE2-CG 3.61Å; Y202-F238 HydrophobicContact CG-CB 4.25Å; Y202-F238 HydrophobicContact CG-CD1 4.33Å; Y202-F238 HydrophobicContact CG-CG 4.15Å; R234-F238 PolarHBondContact O-N 2.74Å; L236-F238 VanDerWaalsContact C-N 3.28Å; L236-F238 PolarHBondContact O-N 2.86Å; F238-L240 VanDerWaalsContact C-N 3.26Å; F238-L240 PolarHBondContact O-N 2.93Å; F238-Y241 PolarHBondContact O-N 2.93Å; F238-E242 HydrophobicContact CD2-CB 4.13Å; F238-E242 HydrophobicContact CD2-CG 3.67Å; F238-E242 HydrophobicContact CE2-CB 3.91Å; F238-E242 HydrophobicContact CE2-CG 3.6Å; F238-E242 HydrophobicContact CG-CG 4.49Å; F238-E242 HydrophobicContact CZ-CB 4.15Å; F238-E242 HydrophobicContact CZ-CG 4.33Å; F238-E242 WeakPolarHBondContact O-CB 3.31Å; F238-E242 PolarHBondContact O-N 3.23Å
239	T	95.8	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-36.6	-179.1	-62.3	0	0	0	0	112.3	V158 A235 L236 L243 L244 V259	V158-T239 HydrophobicContact CB-CG2 3.9Å; V158-T239 HydrophobicContact CG1-CG2 3.76Å; V158-T239 HydrophobicContact CG2-CG2 3.99Å; A235-T239 WeakPolarHBondContact O-CB 3.22Å; A235-T239 PolarHBondContact O-N 2.94Å; A235-T239 PolarHBondContact O-OG1 3.12Å; L236-T239 WeakPolarHBondContact O-CB 3.32Å; L236-T239 PolarHBondContact O-N 2.86Å; T239-L243 WeakPolarHBondContact O-CB 3.24Å; T239-L243 PolarHBondContact O-N 2.91Å; T239-L244 HydrophobicContact CG2-CD1 4.41Å; T239-L244 PolarHBondContact O-N 2.9Å; T239-L244 VanDerWaalsContact O-N 3.11Å; T239-V259 HydrophobicContact CG2-CG2 3.93Å
240	L	93.9	Very high	91.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.204	C	C	.	.	I	π-helix	trans	-60.3	-60.8	174.6	179.9	58.6	0	0	0	111.7	L236 F238 L244 E245 T279 Y280 K283 I285	L236-L240 PolarHBondContact O-N 2.93Å; F238-L240 VanDerWaalsContact C-N 3.26Å; F238-L240 PolarHBondContact O-N 2.93Å; L240-L244 CarbonylContact O-C 3.59Å; L240-L244 PolarHBondContact O-N 3.4Å; L240-L244 VanDerWaalsContact O-N 3.14Å; L240-E245 HydrophobicContact CD1-CG 3.8Å; L240-E245 HydrophobicContact CG-CG 4.26Å; L240-E245 WeakPolarHBondContact O-CG 3.34Å; L240-E245 PolarHBondContact O-N 3.26Å; L240-T279 HydrophobicContact CD2-CG2 3.73Å; L240-Y280 HydrophobicContact CB-CE2 3.8Å; L240-Y280 HydrophobicContact CD2-CD2 4.42Å; L240-Y280 HydrophobicContact CD2-CE2 4.22Å; L240-Y280 HydrophobicContact CG-CE2 4.42Å; L240-Y280 PolarHBondContact N-OH 2.97Å; L240-K283 HydrophobicContact CD1-CD 3.89Å; L240-K283 HydrophobicContact CD2-CD 4.14Å; L240-I285 HydrophobicContact CD1-CD1 3.41Å; L240-I285 VanDerWaalsContact CD1-CD1 3.41Å
241	Y	92.5	Very high	91.3	Very high	115 Å²	115	40.9 Å²	40.9	45%	0.451	21%	0.205	S	C	.	.	I	π-helix	trans	-81.4	-33.9	-169	-67.6	-61.9	0	0	0	114.4	N237 F238 E245 N246	N237-Y241 WeakPolarHBondContact O-CD2 3.36Å; N237-Y241 PolarHBondContact O-N 3.3Å; N237-Y241 WeakPolarHBondContact OD1-CE2 3.41Å; F238-Y241 PolarHBondContact O-N 2.93Å; Y241-E245 WeakPolarHBondContact CE1-OE2 3.16Å; Y241-N246 WeakPolarHBondContact O-CB 3.17Å
242	E	94.8	Very high	91.1	Very high	101 Å²	101	41.3 Å²	41.3	47%	0.472	21%	0.21	S	C	.	.	I	π-helix	trans	-89.2	-17.6	-176.1	-67.3	-64.6	161.2	0	0	113.7	F238 N246	F238-E242 HydrophobicContact CD2-CB 4.13Å; F238-E242 HydrophobicContact CD2-CG 3.67Å; F238-E242 HydrophobicContact CE2-CB 3.91Å; F238-E242 HydrophobicContact CE2-CG 3.6Å; F238-E242 HydrophobicContact CG-CG 4.49Å; F238-E242 HydrophobicContact CZ-CB 4.15Å; F238-E242 HydrophobicContact CZ-CG 4.33Å; F238-E242 WeakPolarHBondContact O-CB 3.31Å; F238-E242 PolarHBondContact O-N 3.23Å; E242-N246 WeakPolarHBondContact O-CB 3.39Å; E242-N246 PolarHBondContact O-ND2 2.9Å
243	L	94.8	Very high	90.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	24%	0.239	C	C	.	.	I	π-helix	trans	-120.5	-68.9	174.4	-66	175.7	0	0	0	112.1	V158 A194 V196 T204 N207 F208 T239 E245 N246 A249 A251	V158-L243 HydrophobicContact CG1-CD1 3.69Å; V158-L243 HydrophobicContact CG2-CB 4.37Å; V158-L243 HydrophobicContact CG2-CD1 4.19Å; A194-L243 HydrophobicContact CB-CD1 3.92Å; A194-L243 HydrophobicContact CB-CD2 4.36Å; V196-L243 HydrophobicContact CG2-CD1 3.44Å; V196-L243 VanDerWaalsContact CG2-CD1 3.44Å; T204-L243 HydrophobicContact CG2-CD1 4.45Å; T204-L243 HydrophobicContact CG2-CD2 3.91Å; N207-L243 HydrophobicContact CB-CD2 3.64Å; F208-L243 HydrophobicContact CE2-CB 4.25Å; T239-L243 WeakPolarHBondContact O-CB 3.24Å; T239-L243 PolarHBondContact O-N 2.91Å; L243-E245 VanDerWaalsContact C-N 3.33Å; L243-E245 PolarHBondContact O-N 2.98Å; L243-N246 PolarHBondContact O-N 2.77Å; L243-A249 HydrophobicContact CD2-CB 3.87Å; L243-A251 VanDerWaalsContact O-CB 3.25Å; L243-A251 WeakPolarHBondContact O-CB 3.31Å
244	L	92.6	Very high	89.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.265	C	S	.	.	I	π-helix	trans	-66.8	-27	-165.6	-72	174.8	0	0	0	115	D156 V158 F208 T239 L240 K257 V259 Y280 I285	D156-L244 HydrophobicContact CB-CD2 4.26Å; V158-L244 HydrophobicContact CG2-CD1 4.46Å; V158-L244 HydrophobicContact CG2-CD2 3.77Å; V158-L244 HydrophobicContact CG2-CG 3.93Å; F208-L244 HydrophobicContact CE2-CD2 4.48Å; F208-L244 HydrophobicContact CZ-CD2 4.08Å; T239-L244 HydrophobicContact CG2-CD1 4.41Å; T239-L244 PolarHBondContact O-N 2.9Å; T239-L244 VanDerWaalsContact O-N 3.11Å; L240-L244 CarbonylContact O-C 3.59Å; L240-L244 PolarHBondContact O-N 3.4Å; L240-L244 VanDerWaalsContact O-N 3.14Å; L244-K257 HydrophobicContact CB-CD 4.4Å; L244-K257 HydrophobicContact CD2-CB 4.13Å; L244-K257 HydrophobicContact CD2-CD 4.31Å; L244-K257 HydrophobicContact CD2-CG 4.21Å; L244-K257 PolarHBondContact O-NZ 2.85Å; L244-V259 HydrophobicContact CD1-CG2 3.67Å; L244-Y280 HydrophobicContact CD1-CE1 4.28Å; L244-I285 HydrophobicContact CD1-CD1 4.26Å; L244-I285 HydrophobicContact CD1-CG2 3.91Å
245	E	90.3	Very high	89.4	Confident	83 Å²	83	48 Å²	48	39%	0.388	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-6.9	172.6	-49.8	-144.7	118.1	0	0	112.6	L240 Y241 L243 K247 K283	L240-E245 HydrophobicContact CD1-CG 3.8Å; L240-E245 HydrophobicContact CG-CG 4.26Å; L240-E245 WeakPolarHBondContact O-CG 3.34Å; L240-E245 PolarHBondContact O-N 3.26Å; Y241-E245 WeakPolarHBondContact CE1-OE2 3.16Å; L243-E245 VanDerWaalsContact C-N 3.33Å; L243-E245 PolarHBondContact O-N 2.98Å; E245-K247 PolarHBondContact O-N 3.06Å; E245-K283 IonicContact OE1-NZ 2.95Å; E245-K283 PolarHBondContact OE1-NZ 2.84Å; E245-K283 IonicContact OE2-NZ 2.95Å; E245-K283 PolarHBondContact OE2-NZ 2.94Å
246	N	90.7	Very high	89	Confident	44 Å²	44	49.4 Å²	49.4	24%	0.235	26%	0.258	C	S	.	.			trans	-91.8	96.6	-173.3	-170.2	-3.9	0	0	0	112.8	Y241 E242 L243 A248 A249	Y241-N246 WeakPolarHBondContact O-CB 3.17Å; E242-N246 WeakPolarHBondContact O-CB 3.39Å; E242-N246 PolarHBondContact O-ND2 2.9Å; L243-N246 PolarHBondContact O-N 2.77Å; N246-A248 PolarHBondContact O-N 3.31Å; N246-A248 VanDerWaalsContact O-N 3.16Å; N246-A248 WeakPolarHBondContact OD1-CB 3.22Å; N246-A248 PolarHBondContact OD1-N 3.29Å; N246-A249 HydrophobicContact CB-CB 3.98Å; N246-A249 WeakPolarHBondContact O-CB 3.16Å; N246-A249 PolarHBondContact O-N 3.5Å
247	K	87.7	Confident	88.8	Confident	148 Å²	148	51.4 Å²	51.4	64%	0.643	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.4	174.4	-64.7	-178.9	-177.8	174.9	0	113.6	E245 A249 G250	E245-K247 PolarHBondContact O-N 3.06Å; K247-A249 VanDerWaalsContact C-N 3.28Å; K247-A249 PolarHBondContact O-N 3.4Å; K247-G250 PolarHBondContact O-N 2.85Å
248	A	89.8	Confident	88.7	Confident	88 Å²	88	49.1 Å²	49.1	73%	0.727	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-74.1	-20	176.9	0	0	0	0	0	112.9	N246 G250	N246-A248 PolarHBondContact O-N 3.31Å; N246-A248 VanDerWaalsContact O-N 3.16Å; N246-A248 WeakPolarHBondContact OD1-CB 3.22Å; N246-A248 PolarHBondContact OD1-N 3.29Å; A248-G250 PolarHBondContact O-N 2.86Å
249	A	89.6	Confident	88.7	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.033	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-79.1	-4	170.2	0	0	0	0	0	113.4	N207 F208 K209 L243 N246 K247	N207-A249 HydrophobicContact CB-CB 4.08Å; N207-A249 WeakPolarHBondContact CB-O 3.27Å; F208-A249 PolarHBondContact N-O 3.26Å; F208-A249 VanDerWaalsContact N-O 3.16Å; K209-A249 PolarHBondContact N-O 2.82Å; K209-A249 VanDerWaalsContact N-O 3.13Å; L243-A249 HydrophobicContact CD2-CB 3.87Å; N246-A249 HydrophobicContact CB-CB 3.98Å; N246-A249 WeakPolarHBondContact O-CB 3.16Å; N246-A249 PolarHBondContact O-N 3.5Å; K247-A249 VanDerWaalsContact C-N 3.28Å; K247-A249 PolarHBondContact O-N 3.4Å
250	G	89.1	Confident	88.5	Confident	21 Å²	21	47.2 Å²	47.2	22%	0.216	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	6.4	-178.4	0	0	0	0	0	114.9	K247 A248	K247-G250 PolarHBondContact O-N 2.85Å; A248-G250 PolarHBondContact O-N 2.86Å
251	A	89.5	Confident	88.5	Confident	11 Å²	11	47.2 Å²	47.2	9%	0.091	25%	0.246	C	C	.	.			trans	-64.7	136	-178.7	0	0	0	0	0	112.8	D156 F208 L243	D156-A251 WeakPolarHBondContact OD2-CA 3.36Å; F208-A251 HydrophobicContact CD2-CB 3.91Å; F208-A251 HydrophobicContact CE2-CB 3.98Å; L243-A251 VanDerWaalsContact O-CB 3.25Å; L243-A251 WeakPolarHBondContact O-CB 3.31Å
252	S	85	Confident	88.4	Confident	27 Å²	27	41.7 Å²	41.7	19%	0.189	23%	0.225	C	C	.	.			trans	-76.2	134.8	-177.6	-53.1	0	0	0	0	110.4	D156 A255	D156-S252 VanDerWaalsContact OD1-CB 3.25Å; D156-S252 WeakPolarHBondContact OD1-CB 3.38Å; D156-S252 PolarHBondContact OD1-OG 3.38Å; D156-S252 WeakPolarHBondContact OD2-CB 3.32Å; D156-S252 PolarHBondContact OD2-N 3.43Å; S252-A255 VanDerWaalsContact CB-CB 3.42Å
253	K	77.7	Confident	88.3	Confident	139 Å²	139	36.9 Å²	36.9	60%	0.604	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-42.1	-176	-179.2	-174.8	155.6	-71.7	0	112.6
254	D	73.1	Confident	87.8	Confident	122 Å²	122	37.9 Å²	37.9	65%	0.652	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.8	31	-165.7	-57.4	-60.6	0	0	0	111.7
255	A	80.5	Confident	86.9	Confident	12 Å²	12	38.2 Å²	38.2	10%	0.099	21%	0.211	C	C	.	.			trans	-96.7	153	177.1	0	0	0	0	0	112.1	A154 S252	A154-A255 HydrophobicContact CB-CB 4Å; A154-A255 CarbonylContact O-C 3.58Å; A154-A255 WeakPolarHBondContact O-CA 3.45Å; A154-A255 WeakPolarHBondContact O-CB 3.28Å; S252-A255 VanDerWaalsContact CB-CB 3.42Å
256	N	82.7	Confident	86.4	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.15	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	145.2	166.4	-66.2	0.7	0	0	0	109	A154 V155 D156 I337	A154-N256 PolarHBondContact O-N 2.89Å; V155-N256 CarbonylContact C-O 3.59Å; V155-N256 VanDerWaalsContact CA-O 3.32Å; V155-N256 WeakPolarHBondContact CA-O 3.18Å; V155-N256 HydrophobicContact CG2-CB 4.39Å; D156-N256 PolarHBondContact N-O 2.76Å; N256-I337 HydrophobicContact CB-CG2 4.36Å; N256-I337 PolarHBondContact ND2-O 3.29Å
257	K	88.6	Confident	86	Confident	43 Å²	43	35.4 Å²	35.4	19%	0.187	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.8	-168.7	-66.9	-178.1	-177.1	-174.9	0	111.5	D156 L244 I285 I286	D156-K257 HydrophobicContact CB-CG 4.4Å; L244-K257 HydrophobicContact CB-CD 4.4Å; L244-K257 HydrophobicContact CD2-CB 4.13Å; L244-K257 HydrophobicContact CD2-CD 4.31Å; L244-K257 HydrophobicContact CD2-CG 4.21Å; L244-K257 PolarHBondContact O-NZ 2.85Å; K257-I285 HydrophobicContact CB-CG1 4.15Å; K257-I285 HydrophobicContact CB-CG2 4.04Å; K257-I286 PolarHBondContact O-N 3.48Å
258	A	90.1	Very high	85.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.2	-175.7	0	0	0	0	0	112.4	D156 L157 V158 I286 I337	D156-A258 PolarHBondContact O-N 3.36Å; L157-A258 WeakPolarHBondContact CA-O 3.09Å; L157-A258 HydrophobicContact CB-CB 4.39Å; L157-A258 HydrophobicContact CD1-CB 4.33Å; L157-A258 HydrophobicContact CG-CB 4.1Å; V158-A258 PolarHBondContact N-O 2.88Å; A258-I286 CarbonylContact C-O 3.6Å; A258-I286 VanDerWaalsContact CA-O 3.29Å; A258-I286 WeakPolarHBondContact CA-O 3.47Å; A258-I337 HydrophobicContact CB-CD1 3.95Å; A258-I337 HydrophobicContact CB-CG2 4.4Å
259	V	93.3	Very high	85	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.3	167.6	-178	0	0	0	0	110.2	V158 L160 L236 T239 L244 I261 Y280 I286 R287 V288	V158-V259 HydrophobicContact CB-CG2 4.34Å; V158-V259 CarbonylContact O-C 3.43Å; V158-V259 WeakPolarHBondContact O-CA 3.44Å; L160-V259 HydrophobicContact CB-CG1 3.7Å; L160-V259 HydrophobicContact CD2-CG1 4.31Å; L236-V259 HydrophobicContact CD2-CG1 4.11Å; T239-V259 HydrophobicContact CG2-CG2 3.93Å; L244-V259 HydrophobicContact CD1-CG2 3.67Å; V259-I261 HydrophobicContact CG1-CG1 3.99Å; V259-Y280 HydrophobicContact CB-CE1 4.42Å; V259-Y280 HydrophobicContact CG2-CE1 3.69Å; V259-I286 PolarHBondContact N-O 3.29Å; V259-R287 WeakPolarHBondContact O-CA 3.39Å; V259-V288 PolarHBondContact O-N 3.29Å
260	V	92.1	Very high	84.2	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	106	176.5	178.1	0	0	0	0	108	L157 V158 F159 L160 M182 I262 V288 I290 F330	L157-V260 HydrophobicContact CD1-CG2 4.15Å; L157-V260 HydrophobicContact CD2-CG2 3.77Å; L157-V260 HydrophobicContact CG-CG2 4.12Å; V158-V260 PolarHBondContact O-N 3.26Å; F159-V260 HydrophobicContact CD1-CB 4.07Å; F159-V260 HydrophobicContact CD1-CG1 4.06Å; F159-V260 HydrophobicContact CE1-CG1 4.38Å; L160-V260 PolarHBondContact N-O 3.26Å; M182-V260 HydrophobicContact CE-CG2 4.45Å; V260-I262 HydrophobicContact CG1-CD1 4.39Å; V260-I262 HydrophobicContact CG1-CG1 4.1Å; V260-V288 WeakPolarHBondContact CA-O 3.42Å; V260-I290 HydrophobicContact CG1-CD1 3.85Å; V260-F330 HydrophobicContact CB-CE1 4.43Å; V260-F330 HydrophobicContact CB-CZ 4.2Å; V260-F330 HydrophobicContact CG1-CE1 3.92Å; V260-F330 HydrophobicContact CG1-CE2 4.44Å; V260-F330 HydrophobicContact CG1-CZ 3.52Å; V260-F330 HydrophobicContact CG2-CE1 3.61Å; V260-F330 HydrophobicContact CG2-CZ 3.67Å
261	I	93.1	Very high	83.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	120.9	-177	-48.1	-179.7	0	0	0	108.5	L160 T232 L236 V259 T263 V288 V289 I290 I305	L160-I261 HydrophobicContact CD2-CG1 4.46Å; L160-I261 VanDerWaalsContact O-CA 3.3Å; L160-I261 WeakPolarHBondContact O-CA 3.48Å; T232-I261 HydrophobicContact CG2-CG2 4.05Å; L236-I261 HydrophobicContact CD1-CD1 4.02Å; L236-I261 HydrophobicContact CD2-CD1 3.87Å; L236-I261 HydrophobicContact CD2-CG1 4.46Å; L236-I261 HydrophobicContact CG-CD1 4.25Å; V259-I261 HydrophobicContact CG1-CG1 3.99Å; I261-T263 HydrophobicContact CG2-CG2 4.4Å; I261-V288 PolarHBondContact N-O 2.9Å; I261-V289 HydrophobicContact CB-CG2 4.33Å; I261-V289 HydrophobicContact CD1-CG2 4.14Å; I261-I290 PolarHBondContact O-N 3.07Å; I261-I305 HydrophobicContact CD1-CG2 3.57Å
262	I	92.3	Very high	82	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.3	-179.2	-45.3	-179	0	0	0	108.7	F159 L160 F161 D162 N175 F178 I179 V260 I290 V292	F159-I262 HydrophobicContact CD1-CD1 4.22Å; L160-I262 PolarHBondContact O-N 2.86Å; F161-I262 HydrophobicContact CB-CB 4.19Å; D162-I262 VanDerWaalsContact CB-O 3.29Å; D162-I262 WeakPolarHBondContact CB-O 3.4Å; D162-I262 PolarHBondContact N-O 3.32Å; N175-I262 WeakPolarHBondContact OD1-CD1 3.39Å; F178-I262 HydrophobicContact CD1-CD1 3.74Å; F178-I262 HydrophobicContact CE1-CD1 3.75Å; I179-I262 HydrophobicContact CG1-CD1 4.27Å; V260-I262 HydrophobicContact CG1-CD1 4.39Å; V260-I262 HydrophobicContact CG1-CG1 4.1Å; I262-I290 WeakPolarHBondContact CA-O 3.49Å; I262-I290 HydrophobicContact CD1-CD1 4.46Å; I262-I290 HydrophobicContact CG1-CB 4.44Å; I262-I290 HydrophobicContact CG1-CD1 4.19Å; I262-I290 HydrophobicContact CG2-CB 4.4Å; I262-I290 HydrophobicContact CG2-CG2 4.42Å; I262-V292 HydrophobicContact CG2-CG2 4.47Å
263	T	90.9	Very high	80.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.5	-172.5	178.6	0	0	0	0	113.2	D162 I261 G265 I290 G291 V292 L302	D162-T263 WeakPolarHBondContact OD2-CB 3.4Å; D162-T263 PolarHBondContact OD2-OG1 3.16Å; I261-T263 HydrophobicContact CG2-CG2 4.4Å; T263-G265 PolarHBondContact OG1-N 2.96Å; T263-G265 VanDerWaalsContact OG1-N 3.08Å; T263-G265 PolarHBondContact OG1-O 2.85Å; T263-I290 PolarHBondContact N-O 2.91Å; T263-G291 WeakPolarHBondContact O-CA 3.38Å; T263-V292 PolarHBondContact O-N 2.97Å; T263-L302 HydrophobicContact CG2-CD1 4.26Å; T263-L302 HydrophobicContact CG2-CD2 3.87Å
264	D	85	Confident	80.3	Confident	23 Å²	23	44.4 Å²	44.4	12%	0.123	23%	0.234	C	C	.	.	S	Bend	trans	-104.9	-4.8	169.9	63.5	-51.9	0	0	0	113.3	S166 M167 V292 I294	S166-D264 WeakPolarHBondContact CB-OD2 3.42Å; S166-D264 PolarHBondContact OG-OD2 2.93Å; M167-D264 PolarHBondContact N-OD2 2.79Å; D264-V292 VanDerWaalsContact CA-O 3.26Å; D264-V292 WeakPolarHBondContact CA-O 3.07Å; D264-V292 WeakPolarHBondContact CB-O 3.4Å; D264-I294 WeakPolarHBondContact O-CG2 3.26Å
265	G	72.9	Confident	80.6	Confident	7 Å²	7	45.6 Å²	45.6	7%	0.072	23%	0.229	C	C	.	.	S	Bend	trans	-104.4	158.3	-174.2	0	0	0	0	0	115	T263	T263-G265 PolarHBondContact OG1-N 2.96Å; T263-G265 VanDerWaalsContact OG1-N 3.08Å; T263-G265 PolarHBondContact OG1-O 2.85Å
266	D	80.1	Confident	80.7	Confident	51 Å²	51	45.1 Å²	45.1	27%	0.273	23%	0.225	S	C	.	.			trans	-83	134.8	160.8	-166.9	25.2	0	0	0	107.9	S268 Q298 K301	D266-S268 PolarHBondContact O-N 2.82Å; D266-Q298 HydrophobicContact CB-CG 4.39Å; D266-K301 WeakPolarHBondContact OD1-CD 3.49Å; D266-K301 IonicContact OD1-NZ 2.77Å; D266-K301 WeakPolarHBondContact OD2-CD 3.49Å; D266-K301 IonicContact OD2-NZ 2.82Å; D266-K301 PolarHBondContact OD2-NZ 2.93Å
267	P	82.4	Confident	80.8	Confident	17 Å²	17	44.8 Å²	44.8	11%	0.11	22%	0.224	C	C	.	.			trans	-54.8	127.6	-178	-26.5	33.9	0	0	0	112.1	T230 Y233 E269 L302 I305	T230-P267 WeakPolarHBondContact O-CA 3.24Å; Y233-P267 HydrophobicContact CD2-CB 4.06Å; Y233-P267 HydrophobicContact CE2-CB 3.65Å; Y233-P267 HydrophobicContact CE2-CG 4.01Å; P267-E269 PolarHBondContact O-N 2.95Å; P267-L302 HydrophobicContact CG-CD2 4.32Å; P267-I305 HydrophobicContact CG-CD1 3.88Å
268	S	78.8	Confident	80.6	Confident	65 Å²	65	48 Å²	48	46%	0.455	24%	0.239	S	C	.	.	S	Bend	trans	-72.4	4	-176.9	-56.4	0	0	0	0	114	T230 D266	T230-S268 PolarHBondContact N-OG 3.38Å; T230-S268 PolarHBondContact O-N 3.27Å; D266-S268 PolarHBondContact O-N 2.82Å
269	E	79.1	Confident	80.5	Confident	30 Å²	30	49.3 Å²	49.3	14%	0.14	25%	0.248	C	C	.	.	S	Bend	trans	-145.4	157.8	-173.6	46.7	169.3	-161.6	0	0	110.9	N231 Y233 R234 P267 Y274	N231-E269 HydrophobicContact CB-CG 4.4Å; Y233-E269 HydrophobicContact CD2-CG 4.32Å; Y233-E269 WeakPolarHBondContact CD2-O 3.39Å; Y233-E269 VanDerWaalsContact CE2-O 3.31Å; Y233-E269 WeakPolarHBondContact CE2-O 2.93Å; Y233-E269 PolarHBondContact N-OE1 2.86Å; Y233-E269 VanDerWaalsContact N-OE1 3.11Å; R234-E269 VanDerWaalsContact CB-OE1 3.28Å; R234-E269 WeakPolarHBondContact CB-OE1 3.29Å; R234-E269 PolarHBondContact N-OE1 2.93Å; P267-E269 PolarHBondContact O-N 2.95Å; E269-Y274 VanDerWaalsContact OE2-CE2 3.24Å; E269-Y274 WeakPolarHBondContact OE2-CE2 3.35Å; E269-Y274 PolarHBondContact OE2-OH 3.41Å
270	L	72.6	Confident	80.4	Confident	128 Å²	128	49.4 Å²	49.4	67%	0.67	25%	0.248	S	C	*	.			trans	-102.1	133.5	-178.2	-61.6	174.1	0	0	0	111.3	K272	L270-K272 PolarHBondContact O-N 2.85Å
271	D	68.6	Low	79.9	Confident	33 Å²	33	53.4 Å²	53.4	18%	0.176	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-61.8	-11.9	-178	-160.9	28.8	0	0	0	114.7	Y233 T273 Y274 R275 S276 V277	Y233-D271 HydrophobicContact CD1-CB 3.6Å; Y233-D271 VanDerWaalsContact CD1-CG 3.49Å; Y233-D271 WeakPolarHBondContact CD1-OD1 3.09Å; Y233-D271 HydrophobicContact CD2-CB 4.21Å; Y233-D271 HydrophobicContact CE1-CB 3.6Å; Y233-D271 HydrophobicContact CE2-CB 4.2Å; Y233-D271 HydrophobicContact CG-CB 3.93Å; D271-T273 PolarHBondContact O-N 2.98Å; D271-Y274 PolarHBondContact O-N 3.18Å; D271-R275 PolarHBondContact O-N 2.9Å; D271-R275 PolarHBondContact OD1-N 3.27Å; D271-S276 PolarHBondContact OD1-N 3.48Å; D271-S276 PolarHBondContact OD2-N 2.85Å; D271-V277 PolarHBondContact OD2-N 2.81Å
272	K	63.4	Low	79.5	Confident	188 Å²	188	57.9 Å²	57.9	82%	0.817	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-51.4	-25.8	178.4	-69.1	-174	176.9	-179.3	0	114	L270	L270-K272 PolarHBondContact O-N 2.85Å
273	T	60.1	Low	79	Confident	113 Å²	113	61.6 Å²	61.6	69%	0.693	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-87	-29.2	-179.5	-50.3	0	0	0	0	113.4	D271	D271-T273 PolarHBondContact O-N 2.98Å
274	Y	65.9	Low	78.5	Confident	69 Å²	69	69.3 Å²	69.3	27%	0.271	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-23.6	-168.5	-51.2	-70.8	0	0	0	114.5	R234 E269 D271 S276	R234-Y274 HydrophobicContact CB-CE2 4.17Å; R234-Y274 HydrophobicContact CG-CE1 4.46Å; E269-Y274 VanDerWaalsContact OE2-CE2 3.24Å; E269-Y274 WeakPolarHBondContact OE2-CE2 3.35Å; E269-Y274 PolarHBondContact OE2-OH 3.41Å; D271-Y274 PolarHBondContact O-N 3.18Å; Y274-S276 PolarHBondContact O-N 3.03Å
275	R	80.1	Confident	78.7	Confident	148 Å²	148	68.3 Å²	68.3	56%	0.558	35%	0.348	S	S	*	.			trans	52.1	37.9	-177.5	-59.7	167.6	170.1	-117.7	11.3	112.4	D271 V277 E278 T279	D271-R275 PolarHBondContact O-N 2.9Å; D271-R275 PolarHBondContact OD1-N 3.27Å; R275-V277 VanDerWaalsContact C-N 3.3Å; R275-V277 PolarHBondContact O-N 2.75Å; R275-E278 HydrophobicContact CB-CB 4.21Å; R275-E278 VanDerWaalsContact CD-OE2 3.28Å; R275-E278 WeakPolarHBondContact CD-OE2 2.98Å; R275-E278 IonicContact CZ-OE2 2.66Å; R275-E278 IonicContact NE-OE2 3Å; R275-E278 IonicContact NH1-OE1 3.24Å; R275-E278 PolarHBondContact NH1-OE1 2.9Å; R275-E278 IonicContact NH1-OE2 2.77Å; R275-E278 PolarHBondContact NH1-OE2 3.41Å; R275-E278 PolarHBondContact O-N 2.89Å; R275-T279 WeakPolarHBondContact O-CB 3.35Å; R275-T279 PolarHBondContact O-N 3.48Å; R275-T279 PolarHBondContact O-OG1 3.25Å
276	S	82.1	Confident	79.3	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.007	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-36.2	-174	-65.7	0	0	0	0	111.6	Y233 D271 Y274 Y280	Y233-S276 PolarHBondContact O-OG 2.89Å; D271-S276 PolarHBondContact OD1-N 3.48Å; D271-S276 PolarHBondContact OD2-N 2.85Å; Y274-S276 PolarHBondContact O-N 3.03Å; S276-Y280 WeakPolarHBondContact O-CB 3.13Å; S276-Y280 VanDerWaalsContact O-CD2 3.23Å; S276-Y280 WeakPolarHBondContact O-CD2 3.3Å; S276-Y280 PolarHBondContact O-N 3.05Å
277	V	85.2	Confident	79.8	Confident	22 Å²	22	67.3 Å²	67.3	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-68.6	-43.5	177.2	-176.2	0	0	0	0	111.5	Y233 D271 R275 N281	Y233-V277 HydrophobicContact CE1-CG2 4.05Å; D271-V277 PolarHBondContact OD2-N 2.81Å; R275-V277 VanDerWaalsContact C-N 3.3Å; R275-V277 PolarHBondContact O-N 2.75Å; V277-N281 WeakPolarHBondContact O-CB 3.47Å; V277-N281 VanDerWaalsContact O-CG 3.23Å; V277-N281 PolarHBondContact O-N 3.38Å; V277-N281 PolarHBondContact O-ND2 3.02Å
278	E	84.8	Confident	80.1	Confident	109 Å²	109	66.7 Å²	66.7	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-45.4	175.6	-173.5	-179.5	-152.9	0	0	111.2	R275 N281 S282	R275-E278 HydrophobicContact CB-CB 4.21Å; R275-E278 VanDerWaalsContact CD-OE2 3.28Å; R275-E278 WeakPolarHBondContact CD-OE2 2.98Å; R275-E278 IonicContact CZ-OE2 2.66Å; R275-E278 IonicContact NE-OE2 3Å; R275-E278 IonicContact NH1-OE1 3.24Å; R275-E278 PolarHBondContact NH1-OE1 2.9Å; R275-E278 IonicContact NH1-OE2 2.77Å; R275-E278 PolarHBondContact NH1-OE2 3.41Å; R275-E278 PolarHBondContact O-N 2.89Å; E278-N281 PolarHBondContact O-N 2.89Å; E278-S282 PolarHBondContact O-N 2.61Å; E278-S282 PolarHBondContact O-OG 1.76Å
279	T	87.2	Confident	80.6	Confident	30 Å²	30	63.6 Å²	63.6	18%	0.184	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-44.4	-179.6	-55.3	0	0	0	0	111.9	L240 R275 S282 K283	L240-T279 HydrophobicContact CD2-CG2 3.73Å; R275-T279 WeakPolarHBondContact O-CB 3.35Å; R275-T279 PolarHBondContact O-N 3.48Å; R275-T279 PolarHBondContact O-OG1 3.25Å; T279-S282 PolarHBondContact O-N 3.28Å; T279-S282 PolarHBondContact O-OG 3.43Å; T279-K283 HydrophobicContact CG2-CD 4.32Å; T279-K283 WeakPolarHBondContact O-CG 3.44Å; T279-K283 PolarHBondContact O-N 2.88Å
280	Y	90.9	Very high	81.1	Confident	1 Å²	1	62.2 Å²	62.2	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-38.6	176	-90.7	-115.1	0	0	0	112.6	L236 L240 L244 V259 S276 K283 E284 I285 R287	L236-Y280 HydrophobicContact CB-CE2 4.06Å; L236-Y280 HydrophobicContact CD2-CE1 4.05Å; L236-Y280 HydrophobicContact CD2-CE2 4.24Å; L236-Y280 PolarHBondContact O-OH 2.77Å; L240-Y280 HydrophobicContact CB-CE2 3.8Å; L240-Y280 HydrophobicContact CD2-CD2 4.42Å; L240-Y280 HydrophobicContact CD2-CE2 4.22Å; L240-Y280 HydrophobicContact CG-CE2 4.42Å; L240-Y280 PolarHBondContact N-OH 2.97Å; L244-Y280 HydrophobicContact CD1-CE1 4.28Å; V259-Y280 HydrophobicContact CB-CE1 4.42Å; V259-Y280 HydrophobicContact CG2-CE1 3.69Å; S276-Y280 WeakPolarHBondContact O-CB 3.13Å; S276-Y280 VanDerWaalsContact O-CD2 3.23Å; S276-Y280 WeakPolarHBondContact O-CD2 3.3Å; S276-Y280 PolarHBondContact O-N 3.05Å; Y280-K283 CarbonylContact O-C 3.57Å; Y280-K283 PolarHBondContact O-N 3.25Å; Y280-E284 PolarHBondContact O-N 3.08Å; Y280-I285 HydrophobicContact CD1-CB 3.57Å; Y280-I285 HydrophobicContact CD1-CD1 4.2Å; Y280-I285 HydrophobicContact CD1-CG1 4.46Å; Y280-I285 HydrophobicContact CD1-CG2 3.42Å; Y280-I285 VanDerWaalsContact CD1-CG2 3.42Å; Y280-I285 HydrophobicContact CE1-CB 4.19Å; Y280-I285 HydrophobicContact CE1-CD1 4.38Å; Y280-I285 HydrophobicContact CE1-CG2 3.58Å; Y280-I285 HydrophobicContact CG-CB 4.28Å; Y280-I285 PolarHBondContact O-N 2.98Å; Y280-R287 VanDerWaalsContact CD1-CD 3.48Å; Y280-R287 HydrophobicContact CD1-CG 3.63Å; Y280-R287 HydrophobicContact CE1-CG 4.23Å; Y280-R287 HydrophobicContact CG-CG 4.37Å
281	N	82.9	Confident	81.9	Confident	87 Å²	87	56.1 Å²	56.1	47%	0.465	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-44	174.4	-74.8	-16.7	0	0	0	111.6	V277 E278 K283 E284 R287	V277-N281 WeakPolarHBondContact O-CB 3.47Å; V277-N281 VanDerWaalsContact O-CG 3.23Å; V277-N281 PolarHBondContact O-N 3.38Å; V277-N281 PolarHBondContact O-ND2 3.02Å; E278-N281 PolarHBondContact O-N 2.89Å; N281-K283 PolarHBondContact O-N 3.16Å; N281-K283 VanDerWaalsContact O-N 3.14Å; N281-E284 PolarHBondContact O-N 2.82Å; N281-E284 VanDerWaalsContact O-N 3.1Å; N281-R287 VanDerWaalsContact OD1-CZ 3.27Å; N281-R287 PolarHBondContact OD1-NH1 3.06Å; N281-R287 PolarHBondContact OD1-NH2 3.44Å
282	S	84.3	Confident	82.7	Confident	94 Å²	94	54.5 Å²	54.5	66%	0.657	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.9	178.1	70.9	0	0	0	0	115	E278 T279	E278-S282 PolarHBondContact O-N 2.61Å; E278-S282 PolarHBondContact O-OG 1.76Å; T279-S282 PolarHBondContact O-N 3.28Å; T279-S282 PolarHBondContact O-OG 3.43Å
283	K	82.8	Confident	83.7	Confident	77 Å²	77	51.3 Å²	51.3	34%	0.335	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	9.2	176.8	-68.2	173.9	177	-78.6	0	112.8	L240 E245 T279 Y280 N281 I285	L240-K283 HydrophobicContact CD1-CD 3.89Å; L240-K283 HydrophobicContact CD2-CD 4.14Å; E245-K283 IonicContact OE1-NZ 2.95Å; E245-K283 PolarHBondContact OE1-NZ 2.84Å; E245-K283 IonicContact OE2-NZ 2.95Å; E245-K283 PolarHBondContact OE2-NZ 2.94Å; T279-K283 HydrophobicContact CG2-CD 4.32Å; T279-K283 WeakPolarHBondContact O-CG 3.44Å; T279-K283 PolarHBondContact O-N 2.88Å; Y280-K283 CarbonylContact O-C 3.57Å; Y280-K283 PolarHBondContact O-N 3.25Å; N281-K283 PolarHBondContact O-N 3.16Å; N281-K283 VanDerWaalsContact O-N 3.14Å; K283-I285 HydrophobicContact CB-CD1 3.82Å; K283-I285 HydrophobicContact CB-CG1 3.8Å; K283-I285 HydrophobicContact CD-CD1 4.27Å; K283-I285 WeakPolarHBondContact O-CG1 3.46Å; K283-I285 PolarHBondContact O-N 3.01Å; K283-I285 VanDerWaalsContact O-N 3.14Å
284	E	80.3	Confident	84.8	Confident	162 Å²	162	46.3 Å²	46.3	76%	0.757	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	24.2	179.5	-59.5	174.5	163.8	0	0	113.9	Y280 N281 I286	Y280-E284 PolarHBondContact O-N 3.08Å; N281-E284 PolarHBondContact O-N 2.82Å; N281-E284 VanDerWaalsContact O-N 3.1Å; E284-I286 PolarHBondContact O-N 2.9Å
285	I	87.8	Confident	85.5	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.015	24%	0.239	C	C	.	.			trans	-84.5	115.5	-176	-53.2	176.1	0	0	0	109.8	L240 L244 K257 Y280 K283 R287	L240-I285 HydrophobicContact CD1-CD1 3.41Å; L240-I285 VanDerWaalsContact CD1-CD1 3.41Å; L244-I285 HydrophobicContact CD1-CD1 4.26Å; L244-I285 HydrophobicContact CD1-CG2 3.91Å; K257-I285 HydrophobicContact CB-CG1 4.15Å; K257-I285 HydrophobicContact CB-CG2 4.04Å; Y280-I285 HydrophobicContact CD1-CB 3.57Å; Y280-I285 HydrophobicContact CD1-CD1 4.2Å; Y280-I285 HydrophobicContact CD1-CG1 4.46Å; Y280-I285 HydrophobicContact CD1-CG2 3.42Å; Y280-I285 VanDerWaalsContact CD1-CG2 3.42Å; Y280-I285 HydrophobicContact CE1-CB 4.19Å; Y280-I285 HydrophobicContact CE1-CD1 4.38Å; Y280-I285 HydrophobicContact CE1-CG2 3.58Å; Y280-I285 HydrophobicContact CG-CB 4.28Å; Y280-I285 PolarHBondContact O-N 2.98Å; K283-I285 HydrophobicContact CB-CD1 3.82Å; K283-I285 HydrophobicContact CB-CG1 3.8Å; K283-I285 HydrophobicContact CD-CD1 4.27Å; K283-I285 WeakPolarHBondContact O-CG1 3.46Å; K283-I285 PolarHBondContact O-N 3.01Å; K283-I285 VanDerWaalsContact O-N 3.14Å; I285-R287 PolarHBondContact O-NH1 2.91Å
286	I	85.3	Confident	85.4	Confident	36 Å²	36	47.7 Å²	47.7	19%	0.185	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.4	-177.1	-67.6	166.9	0	0	0	109.9	K257 A258 V259 E284 V288 S307 I337	K257-I286 PolarHBondContact O-N 3.48Å; A258-I286 CarbonylContact C-O 3.6Å; A258-I286 VanDerWaalsContact CA-O 3.29Å; A258-I286 WeakPolarHBondContact CA-O 3.47Å; V259-I286 PolarHBondContact N-O 3.29Å; E284-I286 PolarHBondContact O-N 2.9Å; I286-V288 HydrophobicContact CG2-CG2 4.12Å; I286-S307 WeakPolarHBondContact CA-OG 3.42Å; I286-I337 HydrophobicContact CB-CD1 4.42Å; I286-I337 HydrophobicContact CD1-CG1 3.99Å; I286-I337 HydrophobicContact CD1-CG2 4.19Å; I286-I337 HydrophobicContact CG2-CD1 3.82Å; I286-I337 HydrophobicContact CG2-CG1 4.28Å
287	R	90.7	Very high	85.2	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.4	-179.7	-59.8	173.1	-52.8	-68.4	-1.7	109.2	V259 Y280 N281 I285 I305 A306 S307	V259-R287 WeakPolarHBondContact O-CA 3.39Å; Y280-R287 VanDerWaalsContact CD1-CD 3.48Å; Y280-R287 HydrophobicContact CD1-CG 3.63Å; Y280-R287 HydrophobicContact CE1-CG 4.23Å; Y280-R287 HydrophobicContact CG-CG 4.37Å; N281-R287 VanDerWaalsContact OD1-CZ 3.27Å; N281-R287 PolarHBondContact OD1-NH1 3.06Å; N281-R287 PolarHBondContact OD1-NH2 3.44Å; I285-R287 PolarHBondContact O-NH1 2.91Å; R287-I305 PolarHBondContact NE-O 2.86Å; R287-I305 PolarHBondContact NH2-O 2.87Å; R287-A306 PolarHBondContact NH2-O 2.95Å; R287-A306 WeakPolarHBondContact O-CA 3.36Å; R287-A306 WeakPolarHBondContact O-CB 3.29Å; R287-S307 PolarHBondContact N-OG 2.61Å; R287-S307 PolarHBondContact NH1-OG 2.84Å; R287-S307 PolarHBondContact O-N 2.85Å
288	V	88.6	Confident	84.7	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.1	178.6	-170.2	0	0	0	0	108.2	V259 V260 I261 I286 N313 F315 F330	V259-V288 PolarHBondContact O-N 3.29Å; V260-V288 WeakPolarHBondContact CA-O 3.42Å; I261-V288 PolarHBondContact N-O 2.9Å; I286-V288 HydrophobicContact CG2-CG2 4.12Å; V288-N313 CarbonylContact C-O 2.97Å; V288-N313 WeakPolarHBondContact CA-O 3.11Å; V288-F315 HydrophobicContact CG1-CD2 4Å; V288-F315 HydrophobicContact CG1-CE2 3.7Å; V288-F330 HydrophobicContact CB-CE2 4.3Å; V288-F330 HydrophobicContact CB-CZ 3.95Å; V288-F330 HydrophobicContact CG1-CE2 3.4Å; V288-F330 VanDerWaalsContact CG1-CE2 3.4Å; V288-F330 HydrophobicContact CG1-CZ 3.56Å
289	V	90.6	Very high	84.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.3	-172.7	178.5	0	0	0	0	110.4	I261 L302 I305 A306 N313 V314 F315	I261-V289 HydrophobicContact CB-CG2 4.33Å; I261-V289 HydrophobicContact CD1-CG2 4.14Å; V289-L302 HydrophobicContact CG1-CB 4.1Å; V289-I305 HydrophobicContact CG2-CB 4.26Å; V289-I305 HydrophobicContact CG2-CG2 4.5Å; V289-A306 HydrophobicContact CB-CB 4.41Å; V289-A306 HydrophobicContact CG2-CB 3.83Å; V289-N313 PolarHBondContact N-O 2.85Å; V289-V314 WeakPolarHBondContact O-CA 3.24Å; V289-F315 PolarHBondContact O-N 2.95Å
290	I	89.4	Confident	84.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	102.3	174.6	-55	174.7	0	0	0	107.7	F178 V260 I261 I262 T263 V292 F315 I317 L323 L326 F330	F178-I290 HydrophobicContact CE1-CD1 3.82Å; F178-I290 HydrophobicContact CZ-CD1 3.94Å; V260-I290 HydrophobicContact CG1-CD1 3.85Å; I261-I290 PolarHBondContact O-N 3.07Å; I262-I290 WeakPolarHBondContact CA-O 3.49Å; I262-I290 HydrophobicContact CD1-CD1 4.46Å; I262-I290 HydrophobicContact CG1-CB 4.44Å; I262-I290 HydrophobicContact CG1-CD1 4.19Å; I262-I290 HydrophobicContact CG2-CB 4.4Å; I262-I290 HydrophobicContact CG2-CG2 4.42Å; T263-I290 PolarHBondContact N-O 2.91Å; I290-V292 HydrophobicContact CG2-CG2 4.22Å; I290-F315 HydrophobicContact CG1-CD2 4.34Å; I290-I317 HydrophobicContact CG2-CD1 3.6Å; I290-I317 HydrophobicContact CG2-CG1 4.19Å; I290-L323 HydrophobicContact CG2-CD2 3.83Å; I290-L326 HydrophobicContact CD1-CD2 3.47Å; I290-L326 VanDerWaalsContact CD1-CD2 3.47Å; I290-L326 HydrophobicContact CG1-CD2 3.82Å; I290-L326 HydrophobicContact CG2-CD2 4.12Å; I290-F330 HydrophobicContact CD1-CD2 4.15Å; I290-F330 HydrophobicContact CD1-CE2 3.6Å; I290-F330 HydrophobicContact CD1-CZ 4Å; I290-F330 HydrophobicContact CG1-CE2 3.85Å; I290-F330 HydrophobicContact CG1-CZ 4.46Å
291	G	88.5	Confident	83.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.9	177.5	0	0	0	0	0	111.8	T263 F315 K316 I317	T263-G291 WeakPolarHBondContact O-CA 3.38Å; G291-F315 PolarHBondContact N-O 2.84Å; G291-K316 WeakPolarHBondContact O-CA 3.29Å; G291-I317 PolarHBondContact O-N 2.86Å
292	V	86.9	Confident	83.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.5	-175.1	-165	0	0	0	0	110.4	I262 T263 D264 I290 I294 I317 Y320	I262-V292 HydrophobicContact CG2-CG2 4.47Å; T263-V292 PolarHBondContact O-N 2.97Å; D264-V292 VanDerWaalsContact CA-O 3.26Å; D264-V292 WeakPolarHBondContact CA-O 3.07Å; D264-V292 WeakPolarHBondContact CB-O 3.4Å; I290-V292 HydrophobicContact CG2-CG2 4.22Å; V292-I294 PolarHBondContact O-N 2.79Å; V292-I317 CarbonylContact C-O 3.57Å; V292-I317 WeakPolarHBondContact CA-O 3.4Å; V292-Y320 HydrophobicContact CB-CD2 4.49Å; V292-Y320 HydrophobicContact CB-CE1 4.37Å; V292-Y320 HydrophobicContact CB-CE2 3.99Å; V292-Y320 HydrophobicContact CG1-CD1 4.33Å; V292-Y320 HydrophobicContact CG1-CD2 3.55Å; V292-Y320 HydrophobicContact CG1-CE1 4.28Å; V292-Y320 HydrophobicContact CG1-CE2 3.48Å; V292-Y320 VanDerWaalsContact CG1-CE2 3.48Å; V292-Y320 HydrophobicContact CG1-CG 3.98Å; V292-Y320 HydrophobicContact CG2-CE1 4.2Å
293	K	83.4	Confident	83.7	Confident	120 Å²	120	53.1 Å²	53.1	52%	0.522	25%	0.248	S	C	.	.	S	Bend	trans	58.6	-2.5	-179.4	-74.1	-179.6	167.2	-175.6	0	117.5	E171 I317 T318	E171-K293 WeakPolarHBondContact OE1-CD 3.33Å; E171-K293 WeakPolarHBondContact OE1-CE 3.31Å; E171-K293 IonicContact OE1-NZ 2.95Å; E171-K293 PolarHBondContact OE1-NZ 3.42Å; K293-I317 PolarHBondContact N-O 2.76Å; K293-T318 WeakPolarHBondContact CG-O 3.39Å
294	I	82.2	Confident	83.8	Confident	9 Å²	9	53 Å²	53	5%	0.046	25%	0.254	C	S	.	.			trans	-62.9	150.5	179.2	52.9	168.9	0	0	0	114.8	D264 V292 Q298 F299 L302 K316	D264-I294 WeakPolarHBondContact O-CG2 3.26Å; V292-I294 PolarHBondContact O-N 2.79Å; I294-Q298 HydrophobicContact CB-CB 4.28Å; I294-F299 HydrophobicContact CD1-CB 3.98Å; I294-F299 HydrophobicContact CD1-CD2 3.59Å; I294-F299 HydrophobicContact CD1-CG 4.25Å; I294-L302 HydrophobicContact CD1-CD1 3.7Å; I294-L302 HydrophobicContact CG2-CD1 4.01Å; I294-K316 HydrophobicContact CD1-CG 4.31Å; I294-K316 HydrophobicContact CG1-CG 4.15Å; I294-K316 WeakPolarHBondContact O-CE 3.34Å
295	K	80.8	Confident	84.2	Confident	139 Å²	139	45.2 Å²	45.2	60%	0.604	22%	0.218	S	C	*	.			trans	-81.4	165.9	170.5	-59.6	172.4	-173.4	170.6	0	111.7	D297 Q298 F299	K295-D297 WeakPolarHBondContact CB-OD1 3.48Å; K295-D297 PolarHBondContact O-N 2.94Å; K295-Q298 HydrophobicContact CB-CG 4.39Å; K295-Q298 PolarHBondContact O-N 3.48Å; K295-F299 WeakPolarHBondContact O-CB 3.28Å; K295-F299 PolarHBondContact O-N 2.94Å
296	D	78.9	Confident	84.3	Confident	106 Å²	106	45.3 Å²	45.3	57%	0.567	22%	0.218	S	C	*	.	H	α-helix	trans	-65.6	-35.8	-177.9	-59.9	-71.9	0	0	0	113.3	Q298 F299 D300 K316	D296-Q298 PolarHBondContact O-N 3.36Å; D296-F299 WeakPolarHBondContact O-CB 3.38Å; D296-F299 PolarHBondContact O-N 3.5Å; D296-F299 VanDerWaalsContact O-N 3.17Å; D296-D300 PolarHBondContact O-N 2.86Å; D296-K316 IonicContact OD1-NZ 3.23Å; D296-K316 PolarHBondContact OD1-NZ 2.83Å; D296-K316 IonicContact OD2-NZ 3.69Å; D296-K316 PolarHBondContact OD2-NZ 3.3Å
297	D	76.9	Confident	84.2	Confident	98 Å²	98	44.2 Å²	44.2	52%	0.524	21%	0.214	S	C	.	.	H	α-helix	trans	-69.2	-19.4	175	67.3	-65.1	0	0	0	113.9	K295 K301	K295-D297 WeakPolarHBondContact CB-OD1 3.48Å; K295-D297 PolarHBondContact O-N 2.94Å; D297-K301 WeakPolarHBondContact O-CE 3.49Å
298	Q	76.3	Confident	83.5	Confident	40 Å²	40	49.9 Å²	49.9	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-89.6	-35.4	170.8	-58	174.5	-79.6	0	0	110.8	D266 I294 K295 D296 K301 L302	D266-Q298 HydrophobicContact CB-CG 4.39Å; I294-Q298 HydrophobicContact CB-CB 4.28Å; K295-Q298 HydrophobicContact CB-CG 4.39Å; K295-Q298 PolarHBondContact O-N 3.48Å; D296-Q298 PolarHBondContact O-N 3.36Å; Q298-K301 WeakPolarHBondContact O-CB 3.26Å; Q298-K301 PolarHBondContact O-N 2.71Å; Q298-L302 PolarHBondContact O-N 3.47Å
299	F	80.8	Confident	82.8	Confident	45 Å²	45	52.7 Å²	52.7	20%	0.197	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-44.7	178.1	-173.9	-121.9	0	0	0	112.3	I294 K295 D296 K301 L302 R303 V314 K316	I294-F299 HydrophobicContact CD1-CB 3.98Å; I294-F299 HydrophobicContact CD1-CD2 3.59Å; I294-F299 HydrophobicContact CD1-CG 4.25Å; K295-F299 WeakPolarHBondContact O-CB 3.28Å; K295-F299 PolarHBondContact O-N 2.94Å; D296-F299 WeakPolarHBondContact O-CB 3.38Å; D296-F299 PolarHBondContact O-N 3.5Å; D296-F299 VanDerWaalsContact O-N 3.17Å; F299-K301 VanDerWaalsContact C-N 3.25Å; F299-K301 PolarHBondContact O-N 3.14Å; F299-L302 PolarHBondContact O-N 2.92Å; F299-R303 VanDerWaalsContact O-CB 3.29Å; F299-R303 WeakPolarHBondContact O-CB 3.29Å; F299-R303 PolarHBondContact O-N 3.16Å; F299-V314 HydrophobicContact CD2-CG1 4.26Å; F299-V314 HydrophobicContact CE2-CG1 3.44Å; F299-V314 VanDerWaalsContact CE2-CG1 3.44Å; F299-V314 HydrophobicContact CZ-CG1 3.71Å; F299-K316 HydrophobicContact CD1-CD 4.42Å; F299-K316 HydrophobicContact CD2-CB 4.02Å; F299-K316 HydrophobicContact CD2-CD 4.33Å; F299-K316 HydrophobicContact CD2-CG 4.11Å; F299-K316 HydrophobicContact CE2-CB 3.58Å; F299-K316 HydrophobicContact CE2-CG 4.19Å; F299-K316 HydrophobicContact CG-CD 4.21Å; F299-K316 HydrophobicContact CG-CG 4.49Å; F299-K316 HydrophobicContact CZ-CB 3.89Å
300	D	79.8	Confident	82.3	Confident	96 Å²	96	55.3 Å²	55.3	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-62.7	-30.2	176.7	-88.1	-35.6	0	0	0	113.1	D296 R303	D296-D300 PolarHBondContact O-N 2.86Å; D300-R303 IonicContact OD1-NH1 2.68Å
301	K	79.4	Confident	81.6	Confident	88 Å²	88	61.5 Å²	61.5	38%	0.383	30%	0.299	S	S	.	.	H	α-helix	trans	-71.3	-49.1	173.3	-62.8	169.5	-173.8	160.8	0	111.1	D266 D297 Q298 F299 R303 T304	D266-K301 WeakPolarHBondContact OD1-CD 3.49Å; D266-K301 IonicContact OD1-NZ 2.77Å; D266-K301 WeakPolarHBondContact OD2-CD 3.49Å; D266-K301 IonicContact OD2-NZ 2.82Å; D266-K301 PolarHBondContact OD2-NZ 2.93Å; D297-K301 WeakPolarHBondContact O-CE 3.49Å; Q298-K301 WeakPolarHBondContact O-CB 3.26Å; Q298-K301 PolarHBondContact O-N 2.71Å; F299-K301 VanDerWaalsContact C-N 3.25Å; F299-K301 PolarHBondContact O-N 3.14Å; K301-R303 PolarHBondContact O-N 3.38Å; K301-T304 WeakPolarHBondContact O-CB 3.5Å; K301-T304 PolarHBondContact O-N 2.82Å; K301-T304 PolarHBondContact O-OG1 3Å
302	L	83.1	Confident	80.7	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-32.9	176.6	-73	171.4	0	0	0	112	T263 P267 V289 I294 Q298 F299 T304 I305	T263-L302 HydrophobicContact CG2-CD1 4.26Å; T263-L302 HydrophobicContact CG2-CD2 3.87Å; P267-L302 HydrophobicContact CG-CD2 4.32Å; V289-L302 HydrophobicContact CG1-CB 4.1Å; I294-L302 HydrophobicContact CD1-CD1 3.7Å; I294-L302 HydrophobicContact CG2-CD1 4.01Å; Q298-L302 PolarHBondContact O-N 3.47Å; F299-L302 PolarHBondContact O-N 2.92Å; L302-T304 PolarHBondContact O-N 2.62Å; L302-I305 HydrophobicContact CD2-CD1 3.94Å; L302-I305 WeakPolarHBondContact O-CB 3.3Å; L302-I305 PolarHBondContact O-N 2.83Å
303	R	85	Confident	80.3	Confident	90 Å²	90	68.4 Å²	68.4	34%	0.34	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.3	171.8	-168.6	-176.1	176	-156.4	-0.5	113.4	F299 D300 K301 I305 K310 E311 V314	F299-R303 VanDerWaalsContact O-CB 3.29Å; F299-R303 WeakPolarHBondContact O-CB 3.29Å; F299-R303 PolarHBondContact O-N 3.16Å; D300-R303 IonicContact OD1-NH1 2.68Å; K301-R303 PolarHBondContact O-N 3.38Å; R303-I305 VanDerWaalsContact C-N 3.34Å; R303-K310 HydrophobicContact CG-CB 3.9Å; R303-K310 HydrophobicContact CG-CD 4Å; R303-K310 HydrophobicContact CG-CG 3.94Å; R303-K310 WeakPolarHBondContact O-CE 3.48Å; R303-E311 IonicContact CZ-OE1 3.85Å; R303-E311 IonicContact NH2-OE1 3.2Å; R303-E311 PolarHBondContact NH2-OE1 2.86Å; R303-V314 HydrophobicContact CB-CG1 4.24Å; R303-V314 HydrophobicContact CB-CG2 4.44Å; R303-V314 HydrophobicContact CG-CG1 4.39Å; R303-V314 HydrophobicContact CG-CG2 4.08Å
304	T	85.6	Confident	80.4	Confident	74 Å²	74	63.4 Å²	63.4	45%	0.454	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-19.6	172.6	71	0	0	0	0	113.8	K301 L302	K301-T304 WeakPolarHBondContact O-CB 3.5Å; K301-T304 PolarHBondContact O-N 2.82Å; K301-T304 PolarHBondContact O-OG1 3Å; L302-T304 PolarHBondContact O-N 2.62Å
305	I	88.6	Confident	80.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-34.2	-176.3	-52.8	179.9	0	0	0	111.2	T232 Y233 L236 I261 P267 R287 V289 L302 R303	T232-I305 HydrophobicContact CG2-CD1 4.29Å; Y233-I305 HydrophobicContact CE1-CD1 4.16Å; Y233-I305 HydrophobicContact CE1-CG1 3.97Å; L236-I305 HydrophobicContact CD1-CG2 3.77Å; I261-I305 HydrophobicContact CD1-CG2 3.57Å; P267-I305 HydrophobicContact CG-CD1 3.88Å; R287-I305 PolarHBondContact NE-O 2.86Å; R287-I305 PolarHBondContact NH2-O 2.87Å; V289-I305 HydrophobicContact CG2-CB 4.26Å; V289-I305 HydrophobicContact CG2-CG2 4.5Å; L302-I305 HydrophobicContact CD2-CD1 3.94Å; L302-I305 WeakPolarHBondContact O-CB 3.3Å; L302-I305 PolarHBondContact O-N 2.83Å; R303-I305 VanDerWaalsContact C-N 3.34Å
306	A	88.4	Confident	80.8	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.033	30%	0.304	C	S	.	.	S	Bend	trans	-66	168.1	-177.9	0	0	0	0	0	114.1	R287 V289 N313 V314	R287-A306 PolarHBondContact NH2-O 2.95Å; R287-A306 WeakPolarHBondContact O-CA 3.36Å; R287-A306 WeakPolarHBondContact O-CB 3.29Å; V289-A306 HydrophobicContact CB-CB 4.41Å; V289-A306 HydrophobicContact CG2-CB 3.83Å; A306-N313 HydrophobicContact CB-CB 4.14Å; A306-V314 HydrophobicContact CB-CG2 3.31Å
307	S	83.9	Confident	80.9	Confident	13 Å²	13	57.8 Å²	57.8	9%	0.091	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-79.8	159.9	168.1	-64.7	0	0	0	0	111.5	I286 R287 N313	I286-S307 WeakPolarHBondContact CA-OG 3.42Å; R287-S307 PolarHBondContact N-OG 2.61Å; R287-S307 PolarHBondContact NH1-OG 2.84Å; R287-S307 PolarHBondContact O-N 2.85Å; S307-N313 VanDerWaalsContact C-ND2 3.35Å; S307-N313 WeakPolarHBondContact O-CB 3.37Å; S307-N313 PolarHBondContact O-ND2 2.87Å
308	E	76.9	Confident	81	Confident	121 Å²	121	59 Å²	59	57%	0.565	29%	0.291	S	S	*	.	S	Bend	trans	-76.3	152.7	168.6	-62.3	-64.6	-179.6	0	0	111.7	K310 N313	E308-K310 WeakPolarHBondContact OE1-CD 3.41Å; E308-K310 WeakPolarHBondContact OE1-CE 3.29Å; E308-K310 IonicContact OE1-NZ 3.81Å; E308-K310 PolarHBondContact OE1-NZ 2.91Å; E308-K310 WeakPolarHBondContact OE2-CD 3.35Å; E308-K310 WeakPolarHBondContact OE2-CG 3.39Å; E308-K310 PolarHBondContact OE2-N 3.47Å; E308-N313 VanDerWaalsContact C-ND2 3.33Å; E308-N313 PolarHBondContact O-ND2 2.89Å; E308-N313 VanDerWaalsContact O-ND2 3.12Å
309	P	74.1	Confident	81	Confident	62 Å²	62	59.9 Å²	59.9	40%	0.403	30%	0.298	S	S	.	.	P	Polyproline II helix	cis	-75.6	127.8	-9.4	31.1	-33	0	0	0	111.2	E311 K312 N313	P309-E311 PolarHBondContact O-N 2.96Å; P309-E311 VanDerWaalsContact O-N 3.1Å; P309-K312 HydrophobicContact CG-CB 4.26Å; P309-K312 HydrophobicContact CG-CD 3.96Å; P309-K312 HydrophobicContact CG-CG 4.06Å; P309-K312 PolarHBondContact O-N 2.85Å; P309-N313 PolarHBondContact O-N 2.67Å; P309-N313 PolarHBondContact O-ND2 2.85Å
310	K	79.1	Confident	80.6	Confident	55 Å²	55	58 Å²	58	24%	0.239	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-27	-177.5	-78.2	152.6	177	151.6	0	114.3	R303 E308 K312 N313 V314	R303-K310 HydrophobicContact CG-CB 3.9Å; R303-K310 HydrophobicContact CG-CD 4Å; R303-K310 HydrophobicContact CG-CG 3.94Å; R303-K310 WeakPolarHBondContact O-CE 3.48Å; E308-K310 WeakPolarHBondContact OE1-CD 3.41Å; E308-K310 WeakPolarHBondContact OE1-CE 3.29Å; E308-K310 IonicContact OE1-NZ 3.81Å; E308-K310 PolarHBondContact OE1-NZ 2.91Å; E308-K310 WeakPolarHBondContact OE2-CD 3.35Å; E308-K310 WeakPolarHBondContact OE2-CG 3.39Å; E308-K310 PolarHBondContact OE2-N 3.47Å; K310-K312 PolarHBondContact O-N 2.86Å; K310-N313 PolarHBondContact O-N 3.42Å; K310-V314 HydrophobicContact CB-CG2 4.3Å; K310-V314 HydrophobicContact CG-CG2 4.46Å; K310-V314 VanDerWaalsContact O-CB 3.31Å; K310-V314 WeakPolarHBondContact O-CB 3.38Å; K310-V314 WeakPolarHBondContact O-CG2 3.13Å; K310-V314 PolarHBondContact O-N 3.3Å
311	E	74.8	Confident	80.1	Confident	130 Å²	130	58 Å²	58	61%	0.607	29%	0.289	S	S	*	.	H	α-helix	trans	-69.4	-17.6	180	-60	61.8	-127.7	0	0	112.1	R303 P309	R303-E311 IonicContact CZ-OE1 3.85Å; R303-E311 IonicContact NH2-OE1 3.2Å; R303-E311 PolarHBondContact NH2-OE1 2.86Å; P309-E311 PolarHBondContact O-N 2.96Å; P309-E311 VanDerWaalsContact O-N 3.1Å
312	K	69.7	Low	79.2	Confident	129 Å²	129	55.1 Å²	55.1	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-98	-51	170.1	-63.4	-172.7	-179	-177.3	0	110.8	P309 K310 V314 Q333	P309-K312 HydrophobicContact CG-CB 4.26Å; P309-K312 HydrophobicContact CG-CD 3.96Å; P309-K312 HydrophobicContact CG-CG 4.06Å; P309-K312 PolarHBondContact O-N 2.85Å; K310-K312 PolarHBondContact O-N 2.86Å; K312-V314 VanDerWaalsContact C-N 3.25Å; K312-V314 PolarHBondContact O-N 2.89Å; K312-V314 VanDerWaalsContact O-N 3.17Å; K312-Q333 PolarHBondContact O-NE2 3.09Å; K312-Q333 PolarHBondContact O-OE1 2.89Å
313	N	79.2	Confident	78.4	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-81.8	9.1	-166.7	-59.1	-37.1	0	0	0	115.1	V288 V289 A306 S307 E308 P309 K310	V288-N313 CarbonylContact C-O 2.97Å; V288-N313 WeakPolarHBondContact CA-O 3.11Å; V289-N313 PolarHBondContact N-O 2.85Å; A306-N313 HydrophobicContact CB-CB 4.14Å; S307-N313 VanDerWaalsContact C-ND2 3.35Å; S307-N313 WeakPolarHBondContact O-CB 3.37Å; S307-N313 PolarHBondContact O-ND2 2.87Å; E308-N313 VanDerWaalsContact C-ND2 3.33Å; E308-N313 PolarHBondContact O-ND2 2.89Å; E308-N313 VanDerWaalsContact O-ND2 3.12Å; P309-N313 PolarHBondContact O-N 2.67Å; P309-N313 PolarHBondContact O-ND2 2.85Å; K310-N313 PolarHBondContact O-N 3.42Å
314	V	85.1	Confident	77.4	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	121.3	-176.5	-170.9	0	0	0	0	110.8	V289 F299 R303 A306 K310 K312	V289-V314 WeakPolarHBondContact O-CA 3.24Å; F299-V314 HydrophobicContact CD2-CG1 4.26Å; F299-V314 HydrophobicContact CE2-CG1 3.44Å; F299-V314 VanDerWaalsContact CE2-CG1 3.44Å; F299-V314 HydrophobicContact CZ-CG1 3.71Å; R303-V314 HydrophobicContact CB-CG1 4.24Å; R303-V314 HydrophobicContact CB-CG2 4.44Å; R303-V314 HydrophobicContact CG-CG1 4.39Å; R303-V314 HydrophobicContact CG-CG2 4.08Å; A306-V314 HydrophobicContact CB-CG2 3.31Å; K310-V314 HydrophobicContact CB-CG2 4.3Å; K310-V314 HydrophobicContact CG-CG2 4.46Å; K310-V314 VanDerWaalsContact O-CB 3.31Å; K310-V314 WeakPolarHBondContact O-CB 3.38Å; K310-V314 WeakPolarHBondContact O-CG2 3.13Å; K310-V314 PolarHBondContact O-N 3.3Å; K312-V314 VanDerWaalsContact C-N 3.25Å; K312-V314 PolarHBondContact O-N 2.89Å; K312-V314 VanDerWaalsContact O-N 3.17Å
315	F	84.8	Confident	76.3	Confident	32 Å²	32	55.3 Å²	55.3	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.2	-176.1	-61.8	-77.9	0	0	0	111.4	V288 V289 I290 G291 L326 F330 Q333	V288-F315 HydrophobicContact CG1-CD2 4Å; V288-F315 HydrophobicContact CG1-CE2 3.7Å; V289-F315 PolarHBondContact O-N 2.95Å; I290-F315 HydrophobicContact CG1-CD2 4.34Å; G291-F315 PolarHBondContact N-O 2.84Å; F315-L326 HydrophobicContact CB-CD1 3.85Å; F315-L326 HydrophobicContact CD1-CD1 3.6Å; F315-L326 HydrophobicContact CD2-CD1 4.47Å; F315-L326 HydrophobicContact CD2-CD2 4.41Å; F315-L326 HydrophobicContact CE1-CD1 4.16Å; F315-L326 HydrophobicContact CG-CD1 3.74Å; F315-L326 HydrophobicContact CG-CD2 4.39Å; F315-L326 HydrophobicContact CG-CG 4.5Å; F315-F330 HydrophobicContact CD2-CD2 4.03Å; F315-F330 AromaticContact CD2-CE2 3.84Å; F315-F330 HydrophobicContact CD2-CE2 3.84Å; F315-F330 AromaticContact CE2-CD2 3.5Å; F315-F330 HydrophobicContact CE2-CD2 3.5Å; F315-F330 VanDerWaalsContact CE2-CD2 3.5Å; F315-F330 AromaticContact CE2-CE2 3.52Å; F315-F330 HydrophobicContact CE2-CE2 3.52Å; F315-F330 HydrophobicContact CZ-CD2 4.07Å; F315-F330 HydrophobicContact CZ-CE2 4.49Å; F315-Q333 VanDerWaalsContact CZ-NE2 3.32Å
316	K	85.4	Confident	75.2	Confident	90 Å²	90	56 Å²	56	39%	0.391	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	172.7	-162	-177.3	-177.1	-168.2	0	109.5	G291 I294 D296 F299	G291-K316 WeakPolarHBondContact O-CA 3.29Å; I294-K316 HydrophobicContact CD1-CG 4.31Å; I294-K316 HydrophobicContact CG1-CG 4.15Å; I294-K316 WeakPolarHBondContact O-CE 3.34Å; D296-K316 IonicContact OD1-NZ 3.23Å; D296-K316 PolarHBondContact OD1-NZ 2.83Å; D296-K316 IonicContact OD2-NZ 3.69Å; D296-K316 PolarHBondContact OD2-NZ 3.3Å; F299-K316 HydrophobicContact CD1-CD 4.42Å; F299-K316 HydrophobicContact CD2-CB 4.02Å; F299-K316 HydrophobicContact CD2-CD 4.33Å; F299-K316 HydrophobicContact CD2-CG 4.11Å; F299-K316 HydrophobicContact CE2-CB 3.58Å; F299-K316 HydrophobicContact CE2-CG 4.19Å; F299-K316 HydrophobicContact CG-CD 4.21Å; F299-K316 HydrophobicContact CG-CG 4.49Å; F299-K316 HydrophobicContact CZ-CB 3.89Å
317	I	82.6	Confident	74.1	Confident	13 Å²	13	57.5 Å²	57.5	7%	0.067	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.7	179	-38.4	-177.4	0	0	0	110.3	I290 G291 V292 K293 N319 L323 L326	I290-I317 HydrophobicContact CG2-CD1 3.6Å; I290-I317 HydrophobicContact CG2-CG1 4.19Å; G291-I317 PolarHBondContact O-N 2.86Å; V292-I317 CarbonylContact C-O 3.57Å; V292-I317 WeakPolarHBondContact CA-O 3.4Å; K293-I317 PolarHBondContact N-O 2.76Å; I317-N319 WeakPolarHBondContact CG2-O 3.42Å; I317-L323 HydrophobicContact CD1-CD2 3.55Å; I317-L323 HydrophobicContact CD1-CG 4.02Å; I317-L326 HydrophobicContact CD1-CB 4.33Å; I317-L326 HydrophobicContact CD1-CD1 4.02Å; I317-L326 HydrophobicContact CD1-CD2 4.12Å; I317-L326 HydrophobicContact CD1-CG 4.39Å; I317-L326 HydrophobicContact CG1-CD1 4.41Å
318	T	78.3	Confident	73.1	Confident	124 Å²	124	62.9 Å²	62.9	76%	0.761	34%	0.341	S	S	*	.	S	Bend	trans	-76	-27	-177	48.1	0	0	0	0	113.9	K293	K293-T318 WeakPolarHBondContact CG-O 3.39Å
319	N	76.8	Confident	72.4	Confident	59 Å²	59	61.1 Å²	61.1	32%	0.316	34%	0.335	S	S	.	.	S	Bend	trans	-153.3	170.4	175.1	65.3	-3.7	0	0	0	110.9	I317 D321 G322	I317-N319 WeakPolarHBondContact CG2-O 3.42Å; N319-D321 VanDerWaalsContact C-N 3.27Å; N319-D321 PolarHBondContact ND2-OD2 3.02Å; N319-D321 PolarHBondContact O-N 2.95Å; N319-G322 PolarHBondContact O-N 2.82Å; N319-G322 PolarHBondContact OD1-N 2.83Å
320	Y	72.4	Confident	72	Confident	6 Å²	6	58.2 Å²	58.2	2%	0.024	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-72	-17.5	179.6	-74	-100	0	0	0	113.5	M167 E171 Q174 N175 V292 G322 L323	M167-Y320 HydrophobicContact SD-CE1 4.16Å; M167-Y320 PolarHBondContact SD-OH 3.04Å; E171-Y320 HydrophobicContact CB-CD1 4.35Å; E171-Y320 HydrophobicContact CB-CD2 3.63Å; E171-Y320 HydrophobicContact CB-CE1 4.37Å; E171-Y320 HydrophobicContact CB-CE2 3.66Å; E171-Y320 HydrophobicContact CB-CG 4.01Å; E171-Y320 HydrophobicContact CG-CD2 3.49Å; E171-Y320 VanDerWaalsContact CG-CD2 3.49Å; E171-Y320 HydrophobicContact CG-CE2 3.82Å; E171-Y320 HydrophobicContact CG-CG 4.13Å; E171-Y320 WeakPolarHBondContact OE1-CD2 3.13Å; E171-Y320 WeakPolarHBondContact OE1-CE2 3.27Å; Q174-Y320 HydrophobicContact CB-CD1 4.45Å; Q174-Y320 HydrophobicContact CB-CG 4.42Å; N175-Y320 HydrophobicContact CB-CD1 4.38Å; N175-Y320 HydrophobicContact CB-CE1 4.18Å; V292-Y320 HydrophobicContact CB-CD2 4.49Å; V292-Y320 HydrophobicContact CB-CE1 4.37Å; V292-Y320 HydrophobicContact CB-CE2 3.99Å; V292-Y320 HydrophobicContact CG1-CD1 4.33Å; V292-Y320 HydrophobicContact CG1-CD2 3.55Å; V292-Y320 HydrophobicContact CG1-CE1 4.28Å; V292-Y320 HydrophobicContact CG1-CE2 3.48Å; V292-Y320 VanDerWaalsContact CG1-CE2 3.48Å; V292-Y320 HydrophobicContact CG1-CG 3.98Å; V292-Y320 HydrophobicContact CG2-CE1 4.2Å; Y320-G322 VanDerWaalsContact C-N 3.3Å; Y320-G322 PolarHBondContact O-N 3.38Å; Y320-L323 HydrophobicContact CD1-CD1 3.68Å; Y320-L323 HydrophobicContact CG-CD1 4.34Å; Y320-L323 VanDerWaalsContact O-CB 3.3Å; Y320-L323 WeakPolarHBondContact O-CB 3.35Å; Y320-L323 WeakPolarHBondContact O-CD1 3.12Å; Y320-L323 WeakPolarHBondContact O-CG 3.38Å; Y320-L323 PolarHBondContact O-N 2.75Å
321	D	67.8	Low	71.2	Confident	95 Å²	95	57.4 Å²	57.4	51%	0.508	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-66.6	-33.7	174.1	-52.9	-64.4	0	0	0	112	Q174 N319 L323 T324	Q174-D321 PolarHBondContact NE2-OD1 2.9Å; N319-D321 VanDerWaalsContact C-N 3.27Å; N319-D321 PolarHBondContact ND2-OD2 3.02Å; N319-D321 PolarHBondContact O-N 2.95Å; D321-L323 PolarHBondContact O-N 2.83Å; D321-T324 WeakPolarHBondContact O-CB 3.39Å; D321-T324 PolarHBondContact O-N 3.01Å; D321-T324 VanDerWaalsContact O-N 3.16Å; D321-T324 PolarHBondContact O-OG1 3.49Å
322	G	61.9	Low	70.5	Confident	28 Å²	28	57.2 Å²	57.2	29%	0.289	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-64.1	-15.2	176.6	0	0	0	0	0	114.9	N319 Y320 T324 G325 L326	N319-G322 PolarHBondContact O-N 2.82Å; N319-G322 PolarHBondContact OD1-N 2.83Å; Y320-G322 VanDerWaalsContact C-N 3.3Å; Y320-G322 PolarHBondContact O-N 3.38Å; G322-T324 PolarHBondContact O-N 2.7Å; G322-G325 PolarHBondContact O-N 2.8Å; G322-L326 PolarHBondContact O-N 3.01Å; G322-L326 VanDerWaalsContact O-N 3.17Å
323	L	66.7	Low	70.1	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-31.1	170.8	-73.4	167.3	0	0	0	112	F178 I290 I317 Y320 D321 G325 L326 L327	F178-L323 HydrophobicContact CB-CB 4.13Å; F178-L323 HydrophobicContact CB-CD1 3.98Å; F178-L323 HydrophobicContact CD1-CD2 4.04Å; F178-L323 HydrophobicContact CD2-CB 3.66Å; F178-L323 HydrophobicContact CD2-CD2 4.18Å; F178-L323 HydrophobicContact CD2-CG 4.41Å; F178-L323 HydrophobicContact CE1-CD2 4.16Å; F178-L323 HydrophobicContact CE2-CB 4.25Å; F178-L323 HydrophobicContact CE2-CD2 4.28Å; F178-L323 WeakPolarHBondContact CE2-O 3.27Å; F178-L323 HydrophobicContact CG-CB 3.94Å; F178-L323 HydrophobicContact CG-CD1 4.19Å; F178-L323 HydrophobicContact CG-CD2 4.04Å; F178-L323 HydrophobicContact CG-CG 4.29Å; F178-L323 HydrophobicContact CZ-CD2 4.27Å; I290-L323 HydrophobicContact CG2-CD2 3.83Å; I317-L323 HydrophobicContact CD1-CD2 3.55Å; I317-L323 HydrophobicContact CD1-CG 4.02Å; Y320-L323 HydrophobicContact CD1-CD1 3.68Å; Y320-L323 HydrophobicContact CG-CD1 4.34Å; Y320-L323 VanDerWaalsContact O-CB 3.3Å; Y320-L323 WeakPolarHBondContact O-CB 3.35Å; Y320-L323 WeakPolarHBondContact O-CD1 3.12Å; Y320-L323 WeakPolarHBondContact O-CG 3.38Å; Y320-L323 PolarHBondContact O-N 2.75Å; D321-L323 PolarHBondContact O-N 2.83Å; L323-G325 PolarHBondContact O-N 2.85Å; L323-L326 VanDerWaalsContact O-CB 3.27Å; L323-L326 WeakPolarHBondContact O-CB 3.39Å; L323-L326 PolarHBondContact O-N 3.4Å; L323-L326 VanDerWaalsContact O-N 3.17Å; L323-L327 PolarHBondContact O-N 2.86Å
324	T	63.4	Low	69.1	Low	111 Å²	111	52.1 Å²	52.1	68%	0.681	29%	0.289	S	S	*	.	H	α-helix	trans	-62.6	-43.9	178.1	-37.9	0	0	0	0	111.8	D321 G322 L326 L327	D321-T324 WeakPolarHBondContact O-CB 3.39Å; D321-T324 PolarHBondContact O-N 3.01Å; D321-T324 VanDerWaalsContact O-N 3.16Å; D321-T324 PolarHBondContact O-OG1 3.49Å; G322-T324 PolarHBondContact O-N 2.7Å; T324-L326 VanDerWaalsContact C-N 3.3Å; T324-L327 WeakPolarHBondContact O-CB 3.41Å; T324-L327 PolarHBondContact O-N 2.99Å
325	G	61.8	Low	67.8	Low	55 Å²	55	55.6 Å²	55.6	57%	0.567	30%	0.303	S	S	*	.	H	α-helix	trans	-77	-15.7	176	0	0	0	0	0	113.6	G322 L323	G322-G325 PolarHBondContact O-N 2.8Å; L323-G325 PolarHBondContact O-N 2.85Å
326	L	66.6	Low	66.1	Low	15 Å²	15	55.3 Å²	55.3	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-69.3	-36.7	171.2	-157.5	83.9	0	0	0	111.5	F178 I290 F315 I317 G322 L323 T324 E328 N329 F330	F178-L326 HydrophobicContact CZ-CD2 4.26Å; I290-L326 HydrophobicContact CD1-CD2 3.47Å; I290-L326 VanDerWaalsContact CD1-CD2 3.47Å; I290-L326 HydrophobicContact CG1-CD2 3.82Å; I290-L326 HydrophobicContact CG2-CD2 4.12Å; F315-L326 HydrophobicContact CB-CD1 3.85Å; F315-L326 HydrophobicContact CD1-CD1 3.6Å; F315-L326 HydrophobicContact CD2-CD1 4.47Å; F315-L326 HydrophobicContact CD2-CD2 4.41Å; F315-L326 HydrophobicContact CE1-CD1 4.16Å; F315-L326 HydrophobicContact CG-CD1 3.74Å; F315-L326 HydrophobicContact CG-CD2 4.39Å; F315-L326 HydrophobicContact CG-CG 4.5Å; I317-L326 HydrophobicContact CD1-CB 4.33Å; I317-L326 HydrophobicContact CD1-CD1 4.02Å; I317-L326 HydrophobicContact CD1-CD2 4.12Å; I317-L326 HydrophobicContact CD1-CG 4.39Å; I317-L326 HydrophobicContact CG1-CD1 4.41Å; G322-L326 PolarHBondContact O-N 3.01Å; G322-L326 VanDerWaalsContact O-N 3.17Å; L323-L326 VanDerWaalsContact O-CB 3.27Å; L323-L326 WeakPolarHBondContact O-CB 3.39Å; L323-L326 PolarHBondContact O-N 3.4Å; L323-L326 VanDerWaalsContact O-N 3.17Å; T324-L326 VanDerWaalsContact C-N 3.3Å; L326-E328 VanDerWaalsContact C-N 3.34Å; L326-E328 PolarHBondContact O-N 3.01Å; L326-N329 PolarHBondContact O-N 3.44Å; L326-F330 HydrophobicContact CD2-CD2 3.66Å; L326-F330 HydrophobicContact CD2-CE2 4.23Å; L326-F330 HydrophobicContact CD2-CG 4.41Å; L326-F330 HydrophobicContact CG-CD2 4.25Å; L326-F330 WeakPolarHBondContact O-CB 3.22Å; L326-F330 PolarHBondContact O-N 3.33Å
327	L	64.1	Low	64.5	Low	35 Å²	35	51.4 Å²	51.4	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-47.4	-49.8	-169.8	-159.5	84.6	0	0	0	113.2	F178 M182 L323 T324 N329 F330 Q331	F178-L327 HydrophobicContact CD2-CD1 4.16Å; F178-L327 HydrophobicContact CE2-CD1 3.85Å; M182-L327 HydrophobicContact CB-CD1 3.83Å; L323-L327 PolarHBondContact O-N 2.86Å; T324-L327 WeakPolarHBondContact O-CB 3.41Å; T324-L327 PolarHBondContact O-N 2.99Å; L327-N329 PolarHBondContact O-N 2.97Å; L327-F330 PolarHBondContact O-N 3.38Å; L327-Q331 WeakPolarHBondContact O-CB 3.32Å; L327-Q331 WeakPolarHBondContact O-CG 3.4Å; L327-Q331 PolarHBondContact O-N 3.29Å
328	E	62.8	Low	63	Low	126 Å²	126	51 Å²	51	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-65.9	-32.8	-178.8	-62.4	-175	-176.9	0	0	113.9	L326 K332	L326-E328 VanDerWaalsContact C-N 3.34Å; L326-E328 PolarHBondContact O-N 3.01Å; E328-K332 WeakPolarHBondContact O-CD 3.28Å; E328-K332 WeakPolarHBondContact O-CE 3.47Å; E328-K332 WeakPolarHBondContact O-CG 3.29Å
329	N	63.9	Low	61.4	Low	83 Å²	83	47 Å²	47	44%	0.444	27%	0.271	S	S	.	.	H	α-helix	trans	-80.3	-33.1	176.4	-70.8	-36.5	0	0	0	111	L326 L327 K332 Q333	L326-N329 PolarHBondContact O-N 3.44Å; L327-N329 PolarHBondContact O-N 2.97Å; N329-K332 PolarHBondContact O-N 2.96Å; N329-Q333 PolarHBondContact O-N 3.09Å
330	F	64.2	Low	59.7	Low	2 Å²	2	47.1 Å²	47.1	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-67.8	-42.2	176.6	-145.2	-94.5	0	0	0	111.7	M182 V260 V288 I290 F315 L326 L327 K332 Q333 I334	M182-F330 HydrophobicContact CE-CD1 4.15Å; M182-F330 HydrophobicContact CE-CE1 4.01Å; M182-F330 HydrophobicContact SD-CD1 3.66Å; M182-F330 HydrophobicContact SD-CE1 3.95Å; V260-F330 HydrophobicContact CB-CE1 4.43Å; V260-F330 HydrophobicContact CB-CZ 4.2Å; V260-F330 HydrophobicContact CG1-CE1 3.92Å; V260-F330 HydrophobicContact CG1-CE2 4.44Å; V260-F330 HydrophobicContact CG1-CZ 3.52Å; V260-F330 HydrophobicContact CG2-CE1 3.61Å; V260-F330 HydrophobicContact CG2-CZ 3.67Å; V288-F330 HydrophobicContact CB-CE2 4.3Å; V288-F330 HydrophobicContact CB-CZ 3.95Å; V288-F330 HydrophobicContact CG1-CE2 3.4Å; V288-F330 VanDerWaalsContact CG1-CE2 3.4Å; V288-F330 HydrophobicContact CG1-CZ 3.56Å; I290-F330 HydrophobicContact CD1-CD2 4.15Å; I290-F330 HydrophobicContact CD1-CE2 3.6Å; I290-F330 HydrophobicContact CD1-CZ 4Å; I290-F330 HydrophobicContact CG1-CE2 3.85Å; I290-F330 HydrophobicContact CG1-CZ 4.46Å; F315-F330 HydrophobicContact CD2-CD2 4.03Å; F315-F330 AromaticContact CD2-CE2 3.84Å; F315-F330 HydrophobicContact CD2-CE2 3.84Å; F315-F330 AromaticContact CE2-CD2 3.5Å; F315-F330 HydrophobicContact CE2-CD2 3.5Å; F315-F330 VanDerWaalsContact CE2-CD2 3.5Å; F315-F330 AromaticContact CE2-CE2 3.52Å; F315-F330 HydrophobicContact CE2-CE2 3.52Å; F315-F330 HydrophobicContact CZ-CD2 4.07Å; F315-F330 HydrophobicContact CZ-CE2 4.49Å; L326-F330 HydrophobicContact CD2-CD2 3.66Å; L326-F330 HydrophobicContact CD2-CE2 4.23Å; L326-F330 HydrophobicContact CD2-CG 4.41Å; L326-F330 HydrophobicContact CG-CD2 4.25Å; L326-F330 WeakPolarHBondContact O-CB 3.22Å; L326-F330 PolarHBondContact O-N 3.33Å; L327-F330 PolarHBondContact O-N 3.38Å; F330-K332 PolarHBondContact O-N 3.29Å; F330-Q333 PolarHBondContact O-N 2.76Å; F330-I334 HydrophobicContact CD1-CD1 3.57Å; F330-I334 HydrophobicContact CD1-CG1 4.2Å; F330-I334 HydrophobicContact CE1-CD1 3.83Å; F330-I334 HydrophobicContact CE1-CG1 4.32Å; F330-I334 WeakPolarHBondContact O-CG1 3.28Å; F330-I334 PolarHBondContact O-N 3.29Å
331	Q	62.8	Low	58.2	Low	38 Å²	38	49.4 Å²	49.4	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-55.1	-47.6	172.2	-74.7	164.9	5.2	0	0	112.2	S185 L186 L327 Q333 I334 F335	S185-Q331 PolarHBondContact OG-NE2 3.24Å; L186-Q331 HydrophobicContact CD2-CG 4.36Å; L327-Q331 WeakPolarHBondContact O-CB 3.32Å; L327-Q331 WeakPolarHBondContact O-CG 3.4Å; L327-Q331 PolarHBondContact O-N 3.29Å; Q331-Q333 VanDerWaalsContact C-N 3.27Å; Q331-Q333 PolarHBondContact O-N 3.22Å; Q331-I334 PolarHBondContact O-N 2.86Å; Q331-I334 VanDerWaalsContact O-N 3.1Å; Q331-F335 HydrophobicContact CB-CE2 4.25Å; Q331-F335 WeakPolarHBondContact O-CD2 3.46Å; Q331-F335 PolarHBondContact O-N 2.91Å
332	K	60.6	Low	56.9	Low	125 Å²	125	47.8 Å²	47.8	54%	0.543	29%	0.294	S	S	.	.	H	α-helix	trans	-59.5	-37	178.6	-68.1	164	-165.4	158.6	0	112.3	E328 N329 F330 A336	E328-K332 WeakPolarHBondContact O-CD 3.28Å; E328-K332 WeakPolarHBondContact O-CE 3.47Å; E328-K332 WeakPolarHBondContact O-CG 3.29Å; N329-K332 PolarHBondContact O-N 2.96Å; F330-K332 PolarHBondContact O-N 3.29Å; K332-A336 PolarHBondContact O-N 2.59Å
333	Q	60.2	Low	55.5	Low	37 Å²	37	53.8 Å²	53.8	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-73.7	-36.4	174.8	-67.8	-172.9	3.1	0	0	112.6	K312 F315 N329 F330 Q331 F335 A336 I337	K312-Q333 PolarHBondContact O-NE2 3.09Å; K312-Q333 PolarHBondContact O-OE1 2.89Å; F315-Q333 VanDerWaalsContact CZ-NE2 3.32Å; N329-Q333 PolarHBondContact O-N 3.09Å; F330-Q333 PolarHBondContact O-N 2.76Å; Q331-Q333 VanDerWaalsContact C-N 3.27Å; Q331-Q333 PolarHBondContact O-N 3.22Å; Q333-F335 PolarHBondContact O-N 2.87Å; Q333-A336 CarbonylContact O-C 3.56Å; Q333-A336 WeakPolarHBondContact O-CA 2.85Å; Q333-A336 WeakPolarHBondContact O-CB 2.78Å; Q333-A336 PolarHBondContact O-N 2.78Å; Q333-A336 VanDerWaalsContact O-N 3.09Å; Q333-I337 WeakPolarHBondContact O-CG1 3.18Å; Q333-I337 PolarHBondContact O-N 3.42Å
334	I	59.7	Low	54.2	Low	3 Å²	3	62.3 Å²	62.3	2%	0.015	36%	0.358	C	S	.	.	H	α-helix	trans	-64.1	-38.4	175.5	-75.9	172.7	0	0	0	112	L157 M182 L186 I191 F330 Q331 A336 I337 E338	L157-I334 HydrophobicContact CD1-CD1 3.84Å; L157-I334 HydrophobicContact CD1-CG1 4.13Å; M182-I334 HydrophobicContact CE-CD1 3.31Å; M182-I334 HydrophobicContact SD-CD1 4.06Å; L186-I334 HydrophobicContact CD1-CD1 3.82Å; L186-I334 HydrophobicContact CD1-CG2 4.17Å; I191-I334 HydrophobicContact CD1-CG2 3.23Å; I191-I334 HydrophobicContact CG1-CG2 4.47Å; F330-I334 HydrophobicContact CD1-CD1 3.57Å; F330-I334 HydrophobicContact CD1-CG1 4.2Å; F330-I334 HydrophobicContact CE1-CD1 3.83Å; F330-I334 HydrophobicContact CE1-CG1 4.32Å; F330-I334 WeakPolarHBondContact O-CG1 3.28Å; F330-I334 PolarHBondContact O-N 3.29Å; Q331-I334 PolarHBondContact O-N 2.86Å; Q331-I334 VanDerWaalsContact O-N 3.1Å; I334-A336 VanDerWaalsContact C-N 3.28Å; I334-A336 PolarHBondContact O-N 3.01Å; I334-I337 WeakPolarHBondContact O-CA 3.11Å; I334-I337 WeakPolarHBondContact O-CB 2.9Å; I334-I337 PolarHBondContact O-N 2.78Å; I334-E338 PolarHBondContact O-N 2.68Å
335	F	56.3	Low	53	Low	87 Å²	87	62.8 Å²	62.8	38%	0.382	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-33.9	171.3	-66.1	-55.8	0	0	0	112	L186 T189 Q331 Q333 I337 E338 G339	L186-F335 HydrophobicContact CD2-CE1 4.49Å; L186-F335 HydrophobicContact CD2-CZ 4.1Å; T189-F335 HydrophobicContact CG2-CE1 4.01Å; T189-F335 HydrophobicContact CG2-CZ 4.46Å; Q331-F335 HydrophobicContact CB-CE2 4.25Å; Q331-F335 WeakPolarHBondContact O-CD2 3.46Å; Q331-F335 PolarHBondContact O-N 2.91Å; Q333-F335 PolarHBondContact O-N 2.87Å; F335-I337 VanDerWaalsContact C-N 3.26Å; F335-I337 PolarHBondContact O-N 2.95Å; F335-E338 WeakPolarHBondContact O-CB 3.06Å; F335-E338 PolarHBondContact O-N 3.37Å; F335-E338 VanDerWaalsContact O-N 3.17Å; F335-G339 PolarHBondContact O-N 2.87Å
336	A	51	Low	52.3	Low	26 Å²	26	64.7 Å²	64.7	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-65.6	-26.1	168.7	0	0	0	0	0	112.6	K332 Q333 I334 G339 S340	K332-A336 PolarHBondContact O-N 2.59Å; Q333-A336 CarbonylContact O-C 3.56Å; Q333-A336 WeakPolarHBondContact O-CA 2.85Å; Q333-A336 WeakPolarHBondContact O-CB 2.78Å; Q333-A336 PolarHBondContact O-N 2.78Å; Q333-A336 VanDerWaalsContact O-N 3.09Å; I334-A336 VanDerWaalsContact C-N 3.28Å; I334-A336 PolarHBondContact O-N 3.01Å; A336-G339 PolarHBondContact O-N 2.95Å; A336-S340 WeakPolarHBondContact O-CB 3.38Å; A336-S340 PolarHBondContact O-N 2.94Å; A336-S340 PolarHBondContact O-OG 3.05Å
337	I	51.9	Low	51.9	Low	9 Å²	9	71.8 Å²	71.8	5%	0.046	39%	0.393	C	S	.	.	H	α-helix	trans	-71.5	-27.6	172.6	-61	178.2	0	0	0	111.8	V155 N256 A258 I286 Q333 I334 F335 G339	V155-I337 HydrophobicContact CG1-CG2 3.85Å; V155-I337 HydrophobicContact CG2-CG2 4.35Å; N256-I337 HydrophobicContact CB-CG2 4.36Å; N256-I337 PolarHBondContact ND2-O 3.29Å; A258-I337 HydrophobicContact CB-CD1 3.95Å; A258-I337 HydrophobicContact CB-CG2 4.4Å; I286-I337 HydrophobicContact CB-CD1 4.42Å; I286-I337 HydrophobicContact CD1-CG1 3.99Å; I286-I337 HydrophobicContact CD1-CG2 4.19Å; I286-I337 HydrophobicContact CG2-CD1 3.82Å; I286-I337 HydrophobicContact CG2-CG1 4.28Å; Q333-I337 WeakPolarHBondContact O-CG1 3.18Å; Q333-I337 PolarHBondContact O-N 3.42Å; I334-I337 WeakPolarHBondContact O-CA 3.11Å; I334-I337 WeakPolarHBondContact O-CB 2.9Å; I334-I337 PolarHBondContact O-N 2.78Å; F335-I337 VanDerWaalsContact C-N 3.26Å; F335-I337 PolarHBondContact O-N 2.95Å; I337-G339 VanDerWaalsContact C-N 3.26Å; I337-G339 PolarHBondContact O-N 2.8Å
338	E	49.6	Very low	51.9	Low	4 Å²	4	72.6 Å²	72.6	2%	0.019	40%	0.397	C	S	.	.	H	α-helix	trans	-65.6	-30.1	169.9	-62.1	-167.6	129.6	0	0	111.6	K152 V155 S190 I334 F335	K152-E338 IonicContact NZ-OE2 2.76Å; K152-E338 PolarHBondContact NZ-OE2 2.87Å; V155-E338 HydrophobicContact CG2-CG 3.83Å; S190-E338 WeakPolarHBondContact CB-OE1 3.17Å; S190-E338 PolarHBondContact N-OE1 2.79Å; S190-E338 PolarHBondContact OG-OE1 3.02Å; I334-E338 PolarHBondContact O-N 2.68Å; F335-E338 WeakPolarHBondContact O-CB 3.06Å; F335-E338 PolarHBondContact O-N 3.37Å; F335-E338 VanDerWaalsContact O-N 3.17Å
339	G	46	Very low	52.7	Low	40 Å²	40	69.2 Å²	69.2	41%	0.412	39%	0.387	S	S	.	.	H	α-helix	trans	-108.9	-19.6	-173.5	0	0	0	0	0	118.7	F335 A336 I337 N341	F335-G339 PolarHBondContact O-N 2.87Å; A336-G339 PolarHBondContact O-N 2.95Å; I337-G339 VanDerWaalsContact C-N 3.26Å; I337-G339 PolarHBondContact O-N 2.8Å; G339-N341 PolarHBondContact O-N 2.87Å; G339-N341 VanDerWaalsContact O-N 3.15Å
340	S	39.4	Very low	53.6	Low	62 Å²	62	67 Å²	67	43%	0.434	38%	0.375	S	S	.	.			trans	-91.8	68.8	-164.2	57.7	0	0	0	0	116.5	A336 G342	A336-S340 WeakPolarHBondContact O-CB 3.38Å; A336-S340 PolarHBondContact O-N 2.94Å; A336-S340 PolarHBondContact O-OG 3.05Å; S340-G342 PolarHBondContact O-N 3.01Å; S340-G342 VanDerWaalsContact O-N 3.16Å
341	N	42.3	Very low	54.7	Low	53 Å²	53	68.2 Å²	68.2	28%	0.283	38%	0.381	S	S	.	.			trans	-78.9	86.4	155.3	-87.4	3.8	0	0	0	110.1	K153 G339 T343 E346	K153-N341 PolarHBondContact NZ-ND2 2.77Å; G339-N341 PolarHBondContact O-N 2.87Å; G339-N341 VanDerWaalsContact O-N 3.15Å; N341-T343 PolarHBondContact O-N 2.96Å; N341-E346 PolarHBondContact ND2-OE1 3.41Å; N341-E346 VanDerWaalsContact ND2-OE1 3.1Å
342	G	40.7	Very low	55.9	Low	61 Å²	61	68.7 Å²	68.7	63%	0.629	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	134.7	168.3	0	0	0	0	0	111.1	S340 R344	S340-G342 PolarHBondContact O-N 3.01Å; S340-G342 VanDerWaalsContact O-N 3.16Å; G342-R344 PolarHBondContact O-N 3.4Å
343	T	32	Very low	57.4	Low	155 Å²	155	62.8 Å²	62.8	95%	0.951	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	33.5	177.8	53.9	0	0	0	0	116.8	N341	N341-T343 PolarHBondContact O-N 2.96Å
344	R	38.7	Very low	59.1	Low	181 Å²	181	62.5 Å²	62.5	68%	0.683	36%	0.357	S	S	*	.			trans	-119.1	111.7	147.5	-82.7	-171.8	169.4	169.9	1.1	111.8	G342 E346	G342-R344 PolarHBondContact O-N 3.4Å; R344-E346 HydrophobicContact CB-CG 3.83Å; R344-E346 PolarHBondContact O-N 2.66Å
345	S	37.8	Very low	60.8	Low	122 Å²	122	62.4 Å²	62.4	85%	0.853	36%	0.356	S	S	*	.			trans	-67.2	84.6	145.1	51	0	0	0	0	107.8	E347	S345-E347 PolarHBondContact O-N 3.01Å
346	E	48	Very low	62.6	Low	95 Å²	95	58.2 Å²	58.2	44%	0.444	34%	0.338	S	S	.	.			trans	-63.8	117.4	165.1	-60.4	-173.4	171.4	0	0	106.1	K153 N341 R344 L348	K153-E346 IonicContact NZ-OE1 2.66Å; K153-E346 PolarHBondContact NZ-OE1 3.41Å; K153-E346 IonicContact NZ-OE2 2.65Å; K153-E346 PolarHBondContact NZ-OE2 3.47Å; N341-E346 PolarHBondContact ND2-OE1 3.41Å; N341-E346 VanDerWaalsContact ND2-OE1 3.1Å; R344-E346 HydrophobicContact CB-CG 3.83Å; R344-E346 PolarHBondContact O-N 2.66Å; E346-L348 PolarHBondContact O-N 3.31Å
347	E	57.1	Low	64.8	Low	163 Å²	163	59.6 Å²	59.6	76%	0.762	34%	0.339	S	S	*	.			trans	-51.7	120.8	-174.1	-70.2	174.9	-170.4	0	0	110.4	S345 S349	S345-E347 PolarHBondContact O-N 3.01Å; E347-S349 PolarHBondContact O-N 2.95Å
348	L	64.8	Low	66.9	Low	53 Å²	53	59.9 Å²	59.9	28%	0.277	34%	0.342	S	S	.	.			trans	-66.2	101.7	-174.7	-74.6	169.7	0	0	0	109.4	E346 E351 M352 K374 T375 W376	E346-L348 PolarHBondContact O-N 3.31Å; L348-E351 HydrophobicContact CD2-CB 4.08Å; L348-E351 HydrophobicContact CD2-CG 4.45Å; L348-M352 HydrophobicContact CD1-CG 4.37Å; L348-K374 CarbonylContact O-C 3.56Å; L348-K374 WeakPolarHBondContact O-CA 3.43Å; L348-K374 PolarHBondContact O-N 2.95Å; L348-T375 PolarHBondContact O-N 3.47Å; L348-W376 HydrophobicContact CD1-CH2 3.53Å; L348-W376 HydrophobicContact CD1-CZ2 4.47Å; L348-W376 HydrophobicContact CD1-CZ3 3.55Å
349	S	78.7	Confident	69.1	Low	54 Å²	54	60.4 Å²	60.4	38%	0.378	35%	0.347	S	S	.	.	S	Bend	trans	-76.7	-62.9	-171.1	-169.3	0	0	0	0	111	E347 E351 S373 K374	E347-S349 PolarHBondContact O-N 2.95Å; S349-E351 WeakPolarHBondContact CA-OE2 3.46Å; S349-E351 PolarHBondContact N-OE2 3.37Å; S349-S373 VanDerWaalsContact O-CA 3.31Å; S349-S373 WeakPolarHBondContact O-CA 3.11Å; S349-K374 PolarHBondContact O-N 2.91Å
350	N	84.2	Confident	71.4	Confident	37 Å²	37	59.2 Å²	59.2	20%	0.198	33%	0.332	C	S	.	.	S	Bend	trans	-146.6	4.6	-176.2	-74.8	-45.7	0	0	0	113.4	N127 Q148 M352 A353 S373	N127-N350 PolarHBondContact ND2-O 3.46Å; Q148-N350 HydrophobicContact CB-CB 4.27Å; N350-M352 PolarHBondContact O-N 3.28Å; N350-A353 HydrophobicContact CB-CB 4.15Å; N350-A353 WeakPolarHBondContact O-CB 3.41Å; N350-A353 PolarHBondContact O-N 3.46Å; N350-A353 VanDerWaalsContact O-N 3.12Å; N350-S373 PolarHBondContact OD1-OG 2.95Å
351	E	85.9	Confident	73.8	Confident	27 Å²	27	57 Å²	57	13%	0.126	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32	175.1	-66.9	64.2	-143.1	0	0	111.1	Y125 L126 Q148 L348 S349	Y125-E351 CarbonylContact C-O 3.44Å; Y125-E351 VanDerWaalsContact CA-O 3.27Å; Y125-E351 WeakPolarHBondContact CA-O 3.43Å; Y125-E351 WeakPolarHBondContact CB-O 3.28Å; Y125-E351 HydrophobicContact CD1-CB 3.84Å; Y125-E351 HydrophobicContact CD1-CG 4.03Å; Y125-E351 HydrophobicContact CD2-CB 4.4Å; Y125-E351 HydrophobicContact CD2-CG 4.3Å; Y125-E351 HydrophobicContact CE1-CB 3.97Å; Y125-E351 HydrophobicContact CE1-CG 3.63Å; Y125-E351 HydrophobicContact CE2-CG 3.93Å; Y125-E351 HydrophobicContact CG-CB 4.09Å; Y125-E351 HydrophobicContact CG-CG 4.36Å; L126-E351 PolarHBondContact N-O 2.8Å; Q148-E351 HydrophobicContact CG-CG 4.11Å; Q148-E351 WeakPolarHBondContact CG-OE1 3.46Å; Q148-E351 PolarHBondContact NE2-OE1 2.93Å; L348-E351 HydrophobicContact CD2-CB 4.08Å; L348-E351 HydrophobicContact CD2-CG 4.45Å; S349-E351 WeakPolarHBondContact CA-OE2 3.46Å; S349-E351 PolarHBondContact N-OE2 3.37Å
352	M	90	Very high	76	Confident	49 Å²	49	55.7 Å²	55.7	24%	0.241	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	25	176.9	-61	-64.3	-177	0	0	112.3	V124 L126 L348 N350 Q354 G372 W376	V124-M352 WeakPolarHBondContact O-CE 3.47Å; L126-M352 HydrophobicContact CB-SD 3.66Å; L126-M352 CarbonylContact O-C 3.46Å; L348-M352 HydrophobicContact CD1-CG 4.37Å; N350-M352 PolarHBondContact O-N 3.28Å; M352-Q354 VanDerWaalsContact C-N 3.29Å; M352-Q354 PolarHBondContact O-N 2.88Å; M352-Q354 VanDerWaalsContact O-N 3.09Å; M352-G372 CarbonylContact O-C 3.45Å; M352-G372 WeakPolarHBondContact O-CA 3.36Å; M352-W376 HydrophobicContact CB-CZ2 4.25Å; M352-W376 HydrophobicContact CG-CZ2 4.08Å
353	A	91.3	Very high	78.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.			trans	-52.2	-40.4	-166.1	0	0	0	0	0	114.9	L126 L146 N350 S355 S370 V371 G372 S373	L126-A353 PolarHBondContact O-N 2.94Å; L146-A353 HydrophobicContact CB-CB 4.29Å; N350-A353 HydrophobicContact CB-CB 4.15Å; N350-A353 WeakPolarHBondContact O-CB 3.41Å; N350-A353 PolarHBondContact O-N 3.46Å; N350-A353 VanDerWaalsContact O-N 3.12Å; A353-S355 VanDerWaalsContact C-N 3.27Å; A353-S355 PolarHBondContact O-N 2.89Å; A353-S370 CarbonylContact O-C 3.57Å; A353-S370 WeakPolarHBondContact O-CA 3.4Å; A353-S370 VanDerWaalsContact O-CB 3.25Å; A353-S370 WeakPolarHBondContact O-CB 3.46Å; A353-V371 PolarHBondContact O-N 2.97Å; A353-G372 PolarHBondContact O-N 2.65Å; A353-S373 WeakPolarHBondContact CB-OG 3.48Å
354	Q	95.1	Very high	80.2	Confident	32 Å²	32	55.2 Å²	55.2	15%	0.15	28%	0.281	C	S	.	.			trans	49.9	44	-173.3	-60.5	-170.1	-96	0	0	113.5	P114 L126 S128 M352 G356 F357 V371	P114-Q354 HydrophobicContact CB-CB 4.41Å; P114-Q354 PolarHBondContact O-NE2 2.04Å; L126-Q354 HydrophobicContact CD2-CG 3.93Å; L126-Q354 HydrophobicContact CG-CG 4.06Å; L126-Q354 PolarHBondContact O-N 2.87Å; S128-Q354 VanDerWaalsContact OG-CA 3.29Å; S128-Q354 WeakPolarHBondContact OG-CA 3.48Å; M352-Q354 VanDerWaalsContact C-N 3.29Å; M352-Q354 PolarHBondContact O-N 2.88Å; M352-Q354 VanDerWaalsContact O-N 3.09Å; Q354-G356 PolarHBondContact O-N 3.4Å; Q354-F357 WeakPolarHBondContact O-CB 3.38Å; Q354-F357 PolarHBondContact O-N 3.41Å; Q354-F357 VanDerWaalsContact O-N 3.11Å; Q354-V371 HydrophobicContact CB-CG2 4.15Å
355	S	94.9	Very high	82.6	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	121.9	-175.1	-164	0	0	0	0	113.1	S128 P145 A353 A369 S370	S128-S355 WeakPolarHBondContact CB-O 3.41Å; S128-S355 PolarHBondContact OG-N 2.83Å; S128-S355 PolarHBondContact OG-O 2.89Å; P145-S355 WeakPolarHBondContact CG-O 3.45Å; A353-S355 VanDerWaalsContact C-N 3.27Å; A353-S355 PolarHBondContact O-N 2.89Å; S355-A369 CarbonylContact C-O 3.53Å; S355-A369 WeakPolarHBondContact CA-O 3.38Å; S355-S370 VanDerWaalsContact CA-OG 3.3Å; S355-S370 WeakPolarHBondContact CA-OG 3.28Å; S355-S370 WeakPolarHBondContact CB-OG 3.03Å; S355-S370 PolarHBondContact OG-OG 2.98Å
356	G	94.5	Very high	85.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.2	29.4	-164.5	0	0	0	0	0	113.1	S100 Q354 A369	S100-G356 PolarHBondContact OG-O 2.84Å; Q354-G356 PolarHBondContact O-N 3.4Å; G356-A369 PolarHBondContact N-O 2.64Å
357	F	96.9	Very high	87.3	Confident	55 Å²	55	36.8 Å²	36.8	24%	0.241	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-43	167	-174.8	-84.1	0	0	0	111	P114 Q354 A369 V371 Y403	P114-F357 HydrophobicContact CB-CB 4.41Å; P114-F357 HydrophobicContact CB-CD2 4.46Å; Q354-F357 WeakPolarHBondContact O-CB 3.38Å; Q354-F357 PolarHBondContact O-N 3.41Å; Q354-F357 VanDerWaalsContact O-N 3.11Å; F357-A369 PolarHBondContact N-O 2.9Å; F357-A369 VanDerWaalsContact N-O 3.12Å; F357-V371 HydrophobicContact CB-CG1 4.01Å; F357-V371 HydrophobicContact CB-CG2 3.84Å; F357-V371 HydrophobicContact CD1-CG1 3.76Å; F357-V371 HydrophobicContact CD1-CG2 4.27Å; F357-V371 HydrophobicContact CD2-CG2 3.66Å; F357-V371 HydrophobicContact CE1-CG1 4.44Å; F357-V371 HydrophobicContact CE2-CG2 4.29Å; F357-V371 HydrophobicContact CG-CB 4.44Å; F357-V371 HydrophobicContact CG-CG1 3.88Å; F357-V371 HydrophobicContact CG-CG2 3.65Å; F357-Y403 HydrophobicContact CD1-CD2 4.39Å; F357-Y403 HydrophobicContact CE1-CD1 4.45Å; F357-Y403 AromaticContact CE1-CD2 3.45Å; F357-Y403 HydrophobicContact CE1-CD2 3.45Å; F357-Y403 VanDerWaalsContact CE1-CD2 3.45Å; F357-Y403 AromaticContact CE1-CE2 3.54Å; F357-Y403 HydrophobicContact CE1-CE2 3.54Å; F357-Y403 AromaticContact CE1-CG 3.94Å; F357-Y403 HydrophobicContact CE1-CG 3.94Å; F357-Y403 AromaticContact CZ-CD2 3.81Å; F357-Y403 HydrophobicContact CZ-CD2 3.81Å; F357-Y403 AromaticContact CZ-CE2 3.51Å; F357-Y403 HydrophobicContact CZ-CE2 3.51Å
358	S	96.9	Very high	89.2	Confident	15 Å²	15	29 Å²	29	11%	0.105	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	158.4	158.6	71.2	0	0	0	0	109.1	A369 G402 L405	S358-A369 WeakPolarHBondContact O-CB 3.4Å; S358-A369 PolarHBondContact O-N 3.16Å; S358-A369 VanDerWaalsContact OG-CB 3.24Å; S358-A369 WeakPolarHBondContact OG-CB 3.47Å; S358-G402 PolarHBondContact OG-O 2.77Å; S358-L405 WeakPolarHBondContact OG-CG 3.49Å
359	A	95.1	Very high	90.7	Very high	15 Å²	15	26.5 Å²	26.5	12%	0.124	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	143.6	-174.7	0	0	0	0	0	110.8	T102 I367 L368	T102-A359 WeakPolarHBondContact CB-O 3.43Å; T102-A359 HydrophobicContact CG2-CB 3.85Å; T102-A359 PolarHBondContact OG1-O 2.98Å; A359-I367 WeakPolarHBondContact CA-O 3.42Å; A359-L368 HydrophobicContact CB-CD2 3.58Å
360	V	94.1	Very high	91.5	Very high	15 Å²	15	23.9 Å²	23.9	9%	0.091	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	138.8	173	67.4	0	0	0	0	110.4	I367 L405 V407 Y416	V360-I367 HydrophobicContact CG1-CB 4.06Å; V360-I367 PolarHBondContact N-O 2.88Å; V360-I367 VanDerWaalsContact N-O 3.09Å; V360-I367 PolarHBondContact O-N 3.42Å; V360-L405 HydrophobicContact CB-CB 4.48Å; V360-L405 HydrophobicContact CG1-CB 4.28Å; V360-L405 HydrophobicContact CG1-CD1 4.32Å; V360-V407 HydrophobicContact CG2-CB 3.84Å; V360-V407 HydrophobicContact CG2-CG1 3.46Å; V360-V407 VanDerWaalsContact CG2-CG1 3.46Å; V360-Y416 HydrophobicContact CG1-CD1 4.23Å; V360-Y416 HydrophobicContact CG1-CE1 4.38Å
361	S	90.7	Very high	92.1	Very high	14 Å²	14	22.3 Å²	22.3	10%	0.098	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.3	172.3	-156.6	0	0	0	0	110.7	D104 T365	D104-S361 WeakPolarHBondContact OD1-CB 3.34Å; D104-S361 PolarHBondContact OD1-OG 2.76Å; S361-T365 WeakPolarHBondContact CA-O 3.18Å
362	H	89.5	Confident	92.5	Very high	27 Å²	27	21 Å²	21	13%	0.125	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	129.8	176.8	172.4	95.8	0	0	0	109.7	T365 V407 E409 S414	H362-T365 PolarHBondContact N-O 3.16Å; H362-T365 WeakPolarHBondContact O-CB 3.37Å; H362-T365 PolarHBondContact O-N 3Å; H362-T365 VanDerWaalsContact O-N 3.12Å; H362-V407 HydrophobicContact CB-CB 4.46Å; H362-V407 HydrophobicContact CB-CG1 3.97Å; H362-V407 HydrophobicContact CB-CG2 3.86Å; H362-E409 IonicContact CE1-OE2 2.99Å; H362-E409 PolarHBondContact CE1-OE2 2.77Å; H362-E409 VanDerWaalsContact CE1-OE2 3.28Å; H362-E409 IonicContact NE2-OE2 3.24Å; H362-E409 PolarHBondContact NE2-OE2 2.97Å; H362-S414 PolarHBondContact CD2-OG 2.82Å; H362-S414 PolarHBondContact NE2-OG 2.92Å
363	K	83.4	Confident	92.5	Very high	97 Å²	97	18.7 Å²	18.7	42%	0.422	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	67.4	179.6	-64.3	179	-176.2	170.5	0	111.9	T365 E409	K363-T365 PolarHBondContact O-N 3.06Å; K363-T365 PolarHBondContact O-OG1 2.82Å; K363-E409 WeakPolarHBondContact CE-OE2 3.35Å; K363-E409 IonicContact NZ-OE1 2.68Å; K363-E409 PolarHBondContact NZ-OE1 3.43Å; K363-E409 IonicContact NZ-OE2 3.98Å; K363-E409 PolarHBondContact NZ-OE2 3.26Å
364	D	77.4	Confident	92.2	Very high	108 Å²	108	22.5 Å²	22.5	58%	0.578	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	12	-179	-57.2	-50.2	0	0	0	115.9	Q384	D364-Q384 VanDerWaalsContact O-CD 3.24Å; D364-Q384 WeakPolarHBondContact O-CG 3.2Å; D364-Q384 PolarHBondContact O-NE2 3.23Å
365	T	87.2	Confident	91.8	Very high	9 Å²	9	22.4 Å²	22.4	6%	0.055	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.2	-173.1	-54.3	0	0	0	0	111.6	S361 H362 K363 I367 R434	S361-T365 WeakPolarHBondContact CA-O 3.18Å; H362-T365 PolarHBondContact N-O 3.16Å; H362-T365 WeakPolarHBondContact O-CB 3.37Å; H362-T365 PolarHBondContact O-N 3Å; H362-T365 VanDerWaalsContact O-N 3.12Å; K363-T365 PolarHBondContact O-N 3.06Å; K363-T365 PolarHBondContact O-OG1 2.82Å; T365-I367 HydrophobicContact CG2-CD1 3.82Å; T365-I367 HydrophobicContact CG2-CG1 4.41Å; T365-R434 VanDerWaalsContact OG1-CZ 3.31Å; T365-R434 PolarHBondContact OG1-NH1 3Å; T365-R434 PolarHBondContact OG1-NH2 2.99Å
366	L	91.8	Very high	91.6	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.9	177.4	177.7	69.9	0	0	0	109.4	T102 I110 F143 L368 Y383 Q384	T102-L366 HydrophobicContact CG2-CD1 4.12Å; I110-L366 HydrophobicContact CD1-CD1 3.95Å; I110-L366 HydrophobicContact CD1-CD2 3.57Å; I110-L366 HydrophobicContact CD1-CG 4.31Å; F143-L366 HydrophobicContact CZ-CD2 4.03Å; L366-L368 HydrophobicContact CD1-CD2 3.93Å; L366-L368 HydrophobicContact CD2-CD1 4.06Å; L366-L368 HydrophobicContact CD2-CD2 3.98Å; L366-L368 HydrophobicContact CD2-CG 4.09Å; L366-L368 HydrophobicContact CG-CD1 4.48Å; L366-L368 HydrophobicContact CG-CD2 3.83Å; L366-L368 HydrophobicContact CG-CG 3.97Å; L366-Y383 HydrophobicContact CD2-CD1 4.12Å; L366-Y383 HydrophobicContact CD2-CG 4.27Å; L366-Y383 PolarHBondContact O-N 2.89Å; L366-Y383 VanDerWaalsContact O-N 3.13Å; L366-Q384 PolarHBondContact O-OE1 3.18Å
367	I	94.6	Very high	91.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.4	172.6	-56.5	-53.2	0	0	0	109.2	A359 V360 T365 L380 N381 D382 I390 L405 Y416 W439	A359-I367 WeakPolarHBondContact CA-O 3.42Å; V360-I367 HydrophobicContact CG1-CB 4.06Å; V360-I367 PolarHBondContact N-O 2.88Å; V360-I367 VanDerWaalsContact N-O 3.09Å; V360-I367 PolarHBondContact O-N 3.42Å; T365-I367 HydrophobicContact CG2-CD1 3.82Å; T365-I367 HydrophobicContact CG2-CG1 4.41Å; I367-L380 HydrophobicContact CG2-CB 3.79Å; I367-L380 HydrophobicContact CG2-CD1 4.36Å; I367-N381 WeakPolarHBondContact CA-O 3.36Å; I367-D382 HydrophobicContact CD1-CB 3.95Å; I367-I390 HydrophobicContact CD1-CD1 4.11Å; I367-L405 HydrophobicContact CG2-CD1 4.16Å; I367-Y416 HydrophobicContact CB-CD1 4.5Å; I367-Y416 HydrophobicContact CB-CE1 4.47Å; I367-Y416 HydrophobicContact CG1-CD1 3.8Å; I367-Y416 HydrophobicContact CG1-CE1 3.5Å; I367-Y416 VanDerWaalsContact CG1-CE1 3.5Å; I367-W439 HydrophobicContact CD1-CH2 3.77Å; I367-W439 HydrophobicContact CD1-CZ2 4.1Å; I367-W439 HydrophobicContact CG1-CH2 4.28Å
368	L	95.9	Very high	91.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.6	179.8	-60.6	178.1	0	0	0	111	F143 P145 A359 L366 N381 Y383	F143-L368 HydrophobicContact CE2-CD1 3.84Å; F143-L368 HydrophobicContact CZ-CD1 4.39Å; P145-L368 HydrophobicContact CB-CD1 3.66Å; P145-L368 HydrophobicContact CG-CD1 3.88Å; A359-L368 HydrophobicContact CB-CD2 3.58Å; L366-L368 HydrophobicContact CD1-CD2 3.93Å; L366-L368 HydrophobicContact CD2-CD1 4.06Å; L366-L368 HydrophobicContact CD2-CD2 3.98Å; L366-L368 HydrophobicContact CD2-CG 4.09Å; L366-L368 HydrophobicContact CG-CD1 4.48Å; L366-L368 HydrophobicContact CG-CD2 3.83Å; L366-L368 HydrophobicContact CG-CG 3.97Å; L368-N381 PolarHBondContact N-O 2.91Å; L368-N381 PolarHBondContact O-N 2.75Å; L368-N381 PolarHBondContact O-ND2 2.89Å; L368-Y383 HydrophobicContact CD1-CD2 4.44Å
369	A	96.9	Very high	91.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.8	176.5	0	0	0	0	0	112.2	S355 G356 F357 S358 L380 G402 L405	S355-A369 CarbonylContact C-O 3.53Å; S355-A369 WeakPolarHBondContact CA-O 3.38Å; G356-A369 PolarHBondContact N-O 2.64Å; F357-A369 PolarHBondContact N-O 2.9Å; F357-A369 VanDerWaalsContact N-O 3.12Å; S358-A369 WeakPolarHBondContact O-CB 3.4Å; S358-A369 PolarHBondContact O-N 3.16Å; S358-A369 VanDerWaalsContact OG-CB 3.24Å; S358-A369 WeakPolarHBondContact OG-CB 3.47Å; A369-L380 HydrophobicContact CB-CD2 3.96Å; A369-G402 WeakPolarHBondContact CB-O 3.47Å; A369-L405 HydrophobicContact CB-CD1 3.78Å; A369-L405 HydrophobicContact CB-CG 4.32Å
370	S	96.1	Very high	91.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	80.3	-179.1	-47	0	0	0	0	109	A353 S355 G372 S373 G378 T379 N381	A353-S370 CarbonylContact O-C 3.57Å; A353-S370 WeakPolarHBondContact O-CA 3.4Å; A353-S370 VanDerWaalsContact O-CB 3.25Å; A353-S370 WeakPolarHBondContact O-CB 3.46Å; S355-S370 VanDerWaalsContact CA-OG 3.3Å; S355-S370 WeakPolarHBondContact CA-OG 3.28Å; S355-S370 WeakPolarHBondContact CB-OG 3.03Å; S355-S370 PolarHBondContact OG-OG 2.98Å; S370-G372 PolarHBondContact O-N 2.83Å; S370-S373 WeakPolarHBondContact CB-OG 3.36Å; S370-S373 PolarHBondContact O-N 2.98Å; S370-G378 WeakPolarHBondContact O-CA 3.34Å; S370-T379 PolarHBondContact N-O 2.98Å; S370-T379 PolarHBondContact O-N 2.61Å; S370-T379 VanDerWaalsContact O-N 3.12Å; S370-N381 PolarHBondContact OG-ND2 2.86Å
371	V	96.9	Very high	91.4	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.024	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.7	-170.2	-68.5	0	0	0	0	114.1	A353 Q354 F357 W376 G402	A353-V371 PolarHBondContact O-N 2.97Å; Q354-V371 HydrophobicContact CB-CG2 4.15Å; F357-V371 HydrophobicContact CB-CG1 4.01Å; F357-V371 HydrophobicContact CB-CG2 3.84Å; F357-V371 HydrophobicContact CD1-CG1 3.76Å; F357-V371 HydrophobicContact CD1-CG2 4.27Å; F357-V371 HydrophobicContact CD2-CG2 3.66Å; F357-V371 HydrophobicContact CE1-CG1 4.44Å; F357-V371 HydrophobicContact CE2-CG2 4.29Å; F357-V371 HydrophobicContact CG-CB 4.44Å; F357-V371 HydrophobicContact CG-CG1 3.88Å; F357-V371 HydrophobicContact CG-CG2 3.65Å; V371-W376 CarbonylContact O-C 3.58Å; V371-W376 WeakPolarHBondContact O-CA 3.25Å; V371-G402 VanDerWaalsContact CG1-C 3.49Å
372	G	92.2	Very high	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-6	-178.4	0	0	0	0	0	114.9	M352 A353 S370 W376	M352-G372 CarbonylContact O-C 3.45Å; M352-G372 WeakPolarHBondContact O-CA 3.36Å; A353-G372 PolarHBondContact O-N 2.65Å; S370-G372 PolarHBondContact O-N 2.83Å; G372-W376 VanDerWaalsContact CA-CD1 3.48Å; G372-W376 PolarHBondContact O-N 3.07Å
373	S	90.9	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	142.8	174.4	-68.1	0	0	0	0	111.6	S349 N350 A353 S370 R377 G378	S349-S373 VanDerWaalsContact O-CA 3.31Å; S349-S373 WeakPolarHBondContact O-CA 3.11Å; N350-S373 PolarHBondContact OD1-OG 2.95Å; A353-S373 WeakPolarHBondContact CB-OG 3.48Å; S370-S373 WeakPolarHBondContact CB-OG 3.36Å; S370-S373 PolarHBondContact O-N 2.98Å; S373-R377 PolarHBondContact O-N 3Å; S373-G378 PolarHBondContact O-N 3.23Å
374	K	85.6	Confident	91.2	Very high	80 Å²	80	26 Å²	26	35%	0.348	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	65.3	179.9	-59.5	-175.3	177	-170.1	0	112.4	L348 S349 W376 R377 T379	L348-K374 CarbonylContact O-C 3.56Å; L348-K374 WeakPolarHBondContact O-CA 3.43Å; L348-K374 PolarHBondContact O-N 2.95Å; S349-K374 PolarHBondContact O-N 2.91Å; K374-W376 VanDerWaalsContact C-N 3.29Å; K374-W376 PolarHBondContact O-N 3.43Å; K374-R377 HydrophobicContact CB-CB 4.08Å; K374-R377 WeakPolarHBondContact O-CB 3.4Å; K374-R377 PolarHBondContact O-N 2.88Å; K374-T379 HydrophobicContact CD-CG2 4.37Å
375	T	85.1	Confident	91.3	Very high	29 Å²	29	23.5 Å²	23.5	18%	0.178	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	47.5	-179.8	-36.1	0	0	0	0	112	L348 R377 E397 A398	L348-T375 PolarHBondContact O-N 3.47Å; T375-R377 PolarHBondContact O-N 3.33Å; T375-R377 VanDerWaalsContact O-N 3.08Å; T375-E397 VanDerWaalsContact CB-CD 3.46Å; T375-E397 WeakPolarHBondContact CB-OE1 3.32Å; T375-E397 HydrophobicContact CG2-CB 4.45Å; T375-E397 HydrophobicContact CG2-CG 4.49Å; T375-E397 PolarHBondContact OG1-OE1 2.99Å; T375-A398 PolarHBondContact O-N 3.16Å
376	W	92.1	Very high	90.8	Very high	81 Å²	81	32 Å²	32	31%	0.307	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	19.5	-176.7	-59.7	-91.1	0	0	0	116.2	L348 M352 V371 G372 K374 A398 S399 Y400	L348-W376 HydrophobicContact CD1-CH2 3.53Å; L348-W376 HydrophobicContact CD1-CZ2 4.47Å; L348-W376 HydrophobicContact CD1-CZ3 3.55Å; M352-W376 HydrophobicContact CB-CZ2 4.25Å; M352-W376 HydrophobicContact CG-CZ2 4.08Å; V371-W376 CarbonylContact O-C 3.58Å; V371-W376 WeakPolarHBondContact O-CA 3.25Å; G372-W376 VanDerWaalsContact CA-CD1 3.48Å; G372-W376 PolarHBondContact O-N 3.07Å; K374-W376 VanDerWaalsContact C-N 3.29Å; K374-W376 PolarHBondContact O-N 3.43Å; W376-A398 CarbonylContact O-C 3.59Å; W376-A398 WeakPolarHBondContact O-CA 3.46Å; W376-A398 PolarHBondContact O-N 2.84Å; W376-S399 PolarHBondContact O-N 3.41Å; W376-Y400 HydrophobicContact CB-CD1 3.88Å; W376-Y400 HydrophobicContact CB-CE1 3.73Å; W376-Y400 AromaticContact CD1-CE1 3.75Å; W376-Y400 HydrophobicContact CG-CD1 4.49Å; W376-Y400 AromaticContact CG-CE1 3.96Å; W376-Y400 HydrophobicContact CG-CE1 3.96Å; W376-Y400 PolarHBondContact O-N 2.76Å
377	R	93.5	Very high	90	Very high	51 Å²	51	34.2 Å²	34.2	19%	0.192	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-42.7	163.8	-180	-171	-171.3	114.4	3	110.7	S373 K374 T375 D392 P393 M395 Q396 M401	S373-R377 PolarHBondContact O-N 3Å; K374-R377 HydrophobicContact CB-CB 4.08Å; K374-R377 WeakPolarHBondContact O-CB 3.4Å; K374-R377 PolarHBondContact O-N 2.88Å; T375-R377 PolarHBondContact O-N 3.33Å; T375-R377 VanDerWaalsContact O-N 3.08Å; R377-D392 PolarHBondContact NE-O 3.39Å; R377-D392 PolarHBondContact NH2-O 3.14Å; R377-P393 PolarHBondContact NH2-O 2.75Å; R377-M395 HydrophobicContact CG-CB 4.1Å; R377-M395 HydrophobicContact CG-CG 3.78Å; R377-M395 PolarHBondContact NE-O 2.84Å; R377-M395 VanDerWaalsContact NE-O 3.15Å; R377-M395 PolarHBondContact NH1-O 2.82Å; R377-M395 VanDerWaalsContact NH1-O 3.15Å; R377-M395 PolarHBondContact NH2-O 2.92Å; R377-M395 VanDerWaalsContact NH2-O 3.09Å; R377-Q396 WeakPolarHBondContact CA-O 3.25Å; R377-M401 VanDerWaalsContact O-CB 3.28Å; R377-M401 WeakPolarHBondContact O-CB 3.27Å; R377-M401 PolarHBondContact O-N 3.3Å
378	G	95.2	Very high	89.5	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.01	17%	0.169	C	C	.	.			trans	92.2	152.9	-175.5	0	0	0	0	0	113.2	S370 S373 M401	S370-G378 WeakPolarHBondContact O-CA 3.34Å; S373-G378 PolarHBondContact O-N 3.23Å; G378-M401 VanDerWaalsContact CA-O 3.27Å; G378-M401 WeakPolarHBondContact CA-O 3.37Å
379	T	94.9	Very high	89.1	Confident	3 Å²	3	40 Å²	40	2%	0.018	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.6	172.3	63	0	0	0	0	110.5	S370 K374 N381 I391	S370-T379 PolarHBondContact N-O 2.98Å; S370-T379 PolarHBondContact O-N 2.61Å; S370-T379 VanDerWaalsContact O-N 3.12Å; K374-T379 HydrophobicContact CD-CG2 4.37Å; T379-N381 PolarHBondContact OG1-ND2 2.87Å; T379-I391 HydrophobicContact CG2-CG1 3.92Å
380	L	96	Very high	88.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	153.2	165.9	-42.2	179.3	0	0	0	109.2	I367 A369 I390 M401 L405 T418 F432	I367-L380 HydrophobicContact CG2-CB 3.79Å; I367-L380 HydrophobicContact CG2-CD1 4.36Å; A369-L380 HydrophobicContact CB-CD2 3.96Å; L380-I390 HydrophobicContact CB-CB 4.1Å; L380-I390 HydrophobicContact CB-CD1 4.2Å; L380-I390 PolarHBondContact N-O 2.77Å; L380-I390 VanDerWaalsContact N-O 3.09Å; L380-I390 WeakPolarHBondContact O-CB 3.29Å; L380-I390 PolarHBondContact O-N 2.88Å; L380-M401 HydrophobicContact CG-CE 4.47Å; L380-L405 HydrophobicContact CD1-CD2 3.82Å; L380-L405 HydrophobicContact CD2-CD1 4.35Å; L380-L405 HydrophobicContact CD2-CD2 3.85Å; L380-L405 HydrophobicContact CD2-CG 4.32Å; L380-L405 HydrophobicContact CG-CD2 4.44Å; L380-T418 HydrophobicContact CD1-CG2 3.96Å; L380-T418 HydrophobicContact CD2-CG2 4.46Å; L380-T418 HydrophobicContact CG-CG2 4.48Å; L380-F432 HydrophobicContact CD1-CD2 4.19Å; L380-F432 HydrophobicContact CD1-CE2 4.19Å
381	N	92.8	Very high	88.6	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	122.9	-174.3	-62.9	-89	0	0	0	111.6	L146 I367 L368 S370 T379 Y383 K388 A389	L146-N381 WeakPolarHBondContact CD1-OD1 3.35Å; I367-N381 WeakPolarHBondContact CA-O 3.36Å; L368-N381 PolarHBondContact N-O 2.91Å; L368-N381 PolarHBondContact O-N 2.75Å; L368-N381 PolarHBondContact O-ND2 2.89Å; S370-N381 PolarHBondContact OG-ND2 2.86Å; T379-N381 PolarHBondContact OG1-ND2 2.87Å; N381-Y383 PolarHBondContact O-N 3.46Å; N381-K388 WeakPolarHBondContact CA-O 3.27Å; N381-A389 WeakPolarHBondContact OD1-CA 2.84Å
382	D	90.5	Very high	88.5	Confident	3 Å²	3	43 Å²	43	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	104.3	169.8	-178.2	-29.3	0	0	0	108.4	I367 Q384 N385 N387 K388 R434	I367-D382 HydrophobicContact CD1-CB 3.95Å; D382-Q384 PolarHBondContact OD1-N 3.49Å; D382-N385 HydrophobicContact CB-CB 4.01Å; D382-N385 CarbonylContact O-C 3.59Å; D382-N385 PolarHBondContact O-N 3.35Å; D382-N385 VanDerWaalsContact OD1-CB 3.28Å; D382-N385 WeakPolarHBondContact OD1-CB 3.3Å; D382-N385 PolarHBondContact OD1-N 2.58Å; D382-N387 CarbonylContact O-C 3.52Å; D382-N387 WeakPolarHBondContact O-CA 3.34Å; D382-N387 PolarHBondContact O-N 2.91Å; D382-K388 HydrophobicContact CB-CB 4.38Å; D382-K388 PolarHBondContact N-O 2.89Å; D382-K388 VanDerWaalsContact N-O 3.09Å; D382-K388 PolarHBondContact O-N 2.92Å; D382-R434 IonicContact OD2-NH2 2.59Å; D382-R434 PolarHBondContact OD2-NH2 2.83Å
383	Y	85.9	Confident	88.3	Confident	78 Å²	78	47.9 Å²	47.9	31%	0.306	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-45.7	-173.6	176.5	-108.3	0	0	0	111.7	F143 L366 L368 N381 N385 K386 N387	F143-Y383 WeakPolarHBondContact CB-OH 3.48Å; F143-Y383 HydrophobicContact CD2-CD2 4.06Å; F143-Y383 HydrophobicContact CD2-CE1 4.37Å; F143-Y383 AromaticContact CD2-CE2 3.31Å; F143-Y383 HydrophobicContact CD2-CE2 3.31Å; F143-Y383 AromaticContact CD2-CZ 3.5Å; F143-Y383 VanDerWaalsContact CD2-CZ 3.5Å; F143-Y383 AromaticContact CE2-CD2 3.89Å; F143-Y383 HydrophobicContact CE2-CD2 3.89Å; F143-Y383 HydrophobicContact CE2-CE1 4.27Å; F143-Y383 AromaticContact CE2-CE2 3.59Å; F143-Y383 HydrophobicContact CE2-CE2 3.59Å; F143-Y383 HydrophobicContact CE2-CG 4.37Å; F143-Y383 AromaticContact CE2-CZ 3.8Å; F143-Y383 HydrophobicContact CG-CE2 4.03Å; F143-Y383 AromaticContact CG-CZ 3.76Å; F143-Y383 WeakPolarHBondContact CG-OH 3.26Å; F143-Y383 HydrophobicContact CZ-CE1 4.41Å; F143-Y383 HydrophobicContact CZ-CE2 4.49Å; L366-Y383 HydrophobicContact CD2-CD1 4.12Å; L366-Y383 HydrophobicContact CD2-CG 4.27Å; L366-Y383 PolarHBondContact O-N 2.89Å; L366-Y383 VanDerWaalsContact O-N 3.13Å; L368-Y383 HydrophobicContact CD1-CD2 4.44Å; N381-Y383 PolarHBondContact O-N 3.46Å; Y383-N385 VanDerWaalsContact C-N 3.31Å; Y383-N385 PolarHBondContact O-N 2.84Å; Y383-K386 PolarHBondContact O-N 2.97Å; Y383-K386 VanDerWaalsContact O-N 3.17Å; Y383-N387 PolarHBondContact O-N 3.28Å
384	Q	82.6	Confident	88.3	Confident	96 Å²	96	54.2 Å²	54.2	45%	0.449	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-43.5	177.5	-76.2	76.5	-8.9	0	0	110.8	D364 L366 D382 K386	D364-Q384 VanDerWaalsContact O-CD 3.24Å; D364-Q384 WeakPolarHBondContact O-CG 3.2Å; D364-Q384 PolarHBondContact O-NE2 3.23Å; L366-Q384 PolarHBondContact O-OE1 3.18Å; D382-Q384 PolarHBondContact OD1-N 3.49Å; Q384-K386 PolarHBondContact O-N 2.78Å
385	N	80.1	Confident	88.6	Confident	56 Å²	56	50.5 Å²	50.5	30%	0.299	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	43.7	175.2	-156.2	-11.3	0	0	0	112.4	D382 Y383 N387 K388 D437	D382-N385 HydrophobicContact CB-CB 4.01Å; D382-N385 CarbonylContact O-C 3.59Å; D382-N385 PolarHBondContact O-N 3.35Å; D382-N385 VanDerWaalsContact OD1-CB 3.28Å; D382-N385 WeakPolarHBondContact OD1-CB 3.3Å; D382-N385 PolarHBondContact OD1-N 2.58Å; Y383-N385 VanDerWaalsContact C-N 3.31Å; Y383-N385 PolarHBondContact O-N 2.84Å; N385-N387 VanDerWaalsContact C-N 3.34Å; N385-N387 PolarHBondContact O-N 2.99Å; N385-K388 HydrophobicContact CB-CB 4.11Å; N385-K388 WeakPolarHBondContact O-CB 3.29Å; N385-K388 PolarHBondContact O-N 2.88Å; N385-K388 VanDerWaalsContact O-N 3.15Å; N385-D437 PolarHBondContact ND2-OD1 2.97Å
386	K	76.3	Confident	88.8	Confident	188 Å²	188	53.6 Å²	53.6	82%	0.817	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	29.1	175.2	-53.3	173	-176.9	168.1	0	115.1	Y383 Q384	Y383-K386 PolarHBondContact O-N 2.97Å; Y383-K386 VanDerWaalsContact O-N 3.17Å; Q384-K386 PolarHBondContact O-N 2.78Å
387	N	75.4	Confident	88.5	Confident	47 Å²	47	54.5 Å²	54.5	25%	0.251	27%	0.268	S	S	.	.	S	Bend	trans	64.8	50.1	-169.5	-47.7	-102.5	0	0	0	111.9	L146 D382 Y383 N385 A389	L146-N387 HydrophobicContact CD2-CB 3.82Å; D382-N387 CarbonylContact O-C 3.52Å; D382-N387 WeakPolarHBondContact O-CA 3.34Å; D382-N387 PolarHBondContact O-N 2.91Å; Y383-N387 PolarHBondContact O-N 3.28Å; N385-N387 VanDerWaalsContact C-N 3.34Å; N385-N387 PolarHBondContact O-N 2.99Å; N387-A389 PolarHBondContact O-N 2.88Å
388	K	85	Confident	88.3	Confident	73 Å²	73	54.3 Å²	54.3	32%	0.317	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	114.7	176.2	-171.2	178.1	-167.6	-178.3	0	109.6	N381 D382 N385 I390 D437	N381-K388 WeakPolarHBondContact CA-O 3.27Å; D382-K388 HydrophobicContact CB-CB 4.38Å; D382-K388 PolarHBondContact N-O 2.89Å; D382-K388 VanDerWaalsContact N-O 3.09Å; D382-K388 PolarHBondContact O-N 2.92Å; N385-K388 HydrophobicContact CB-CB 4.11Å; N385-K388 WeakPolarHBondContact O-CB 3.29Å; N385-K388 PolarHBondContact O-N 2.88Å; N385-K388 VanDerWaalsContact O-N 3.15Å; K388-I390 PolarHBondContact O-N 2.85Å; K388-D437 PolarHBondContact NZ-O 2.95Å; K388-D437 IonicContact NZ-OD1 2.69Å; K388-D437 PolarHBondContact NZ-OD1 2.95Å; K388-D437 IonicContact NZ-OD2 3.75Å
389	A	87.5	Confident	88.2	Confident	48 Å²	48	54.4 Å²	54.4	40%	0.397	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	119.8	-179.2	0	0	0	0	0	111.8	N381 N387 I391	N381-A389 WeakPolarHBondContact OD1-CA 2.84Å; N387-A389 PolarHBondContact O-N 2.88Å; A389-I391 HydrophobicContact CB-CD1 3.87Å; A389-I391 HydrophobicContact CB-CG1 4.14Å
390	I	93	Very high	88.4	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.8	170.6	-55.1	158.4	0	0	0	106.3	I367 L380 K388 F432 W439	I367-I390 HydrophobicContact CD1-CD1 4.11Å; L380-I390 HydrophobicContact CB-CB 4.1Å; L380-I390 HydrophobicContact CB-CD1 4.2Å; L380-I390 PolarHBondContact N-O 2.77Å; L380-I390 VanDerWaalsContact N-O 3.09Å; L380-I390 WeakPolarHBondContact O-CB 3.29Å; L380-I390 PolarHBondContact O-N 2.88Å; K388-I390 PolarHBondContact O-N 2.85Å; I390-F432 HydrophobicContact CG2-CD1 3.9Å; I390-F432 HydrophobicContact CG2-CE1 3.75Å; I390-F432 HydrophobicContact CG2-CE2 4.42Å; I390-F432 HydrophobicContact CG2-CG 4.29Å; I390-F432 HydrophobicContact CG2-CZ 4.02Å; I390-W439 HydrophobicContact CB-CG 4.48Å; I390-W439 HydrophobicContact CD1-CD2 3.56Å; I390-W439 HydrophobicContact CD1-CE3 3.76Å; I390-W439 HydrophobicContact CD1-CG 4.14Å; I390-W439 HydrophobicContact CD1-CH2 3.9Å; I390-W439 HydrophobicContact CD1-CZ2 3.71Å; I390-W439 HydrophobicContact CD1-CZ3 3.91Å; I390-W439 HydrophobicContact CG1-CB 4.48Å; I390-W439 HydrophobicContact CG1-CD2 3.78Å; I390-W439 HydrophobicContact CG1-CE3 4.35Å; I390-W439 HydrophobicContact CG1-CG 3.79Å; I390-W439 HydrophobicContact CG2-CB 3.76Å; I390-W439 HydrophobicContact CG2-CD2 4.2Å; I390-W439 HydrophobicContact CG2-CE3 4.33Å; I390-W439 HydrophobicContact CG2-CG 3.95Å
391	I	89.8	Confident	88.5	Confident	62 Å²	62	57.5 Å²	57.5	32%	0.318	29%	0.29	S	S	.	.			trans	-132.6	125.8	-168.8	-60.9	147.4	0	0	0	108.1	T379 A389	T379-I391 HydrophobicContact CG2-CG1 3.92Å; A389-I391 HydrophobicContact CB-CD1 3.87Å; A389-I391 HydrophobicContact CB-CG1 4.14Å
392	D	93.3	Very high	88.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.29	C	S	.	.			trans	-76.8	123.9	164	174.8	2.3	0	0	0	109.9	R377 E394 M395 M401 F432 I441 R444	R377-D392 PolarHBondContact NE-O 3.39Å; R377-D392 PolarHBondContact NH2-O 3.14Å; D392-E394 VanDerWaalsContact C-N 3.35Å; D392-E394 PolarHBondContact OD1-N 2.86Å; D392-M395 HydrophobicContact CB-CB 3.85Å; D392-M395 PolarHBondContact OD1-N 3.28Å; D392-M401 HydrophobicContact CB-CE 4.47Å; D392-M401 HydrophobicContact CB-SD 3.82Å; D392-F432 HydrophobicContact CB-CZ 4.09Å; D392-I441 HydrophobicContact CB-CD1 3.88Å; D392-I441 WeakPolarHBondContact OD1-CD1 3.44Å; D392-R444 VanDerWaalsContact CG-NH2 3.28Å; D392-R444 IonicContact OD1-CZ 3.75Å; D392-R444 IonicContact OD1-NH1 2.61Å; D392-R444 IonicContact OD1-NH2 3.03Å; D392-R444 PolarHBondContact OD1-NH2 2.91Å; D392-R444 IonicContact OD2-CZ 3.76Å; D392-R444 IonicContact OD2-NH1 2.66Å; D392-R444 PolarHBondContact OD2-NH1 3.36Å; D392-R444 IonicContact OD2-NH2 2.74Å; D392-R444 PolarHBondContact OD2-NH2 2.87Å; D392-R444 VanDerWaalsContact OD2-NH2 3.15Å
393	P	88.3	Confident	89.1	Confident	103 Å²	103	60.6 Å²	60.6	67%	0.669	30%	0.302	S	S	*	.	S	Bend	trans	-71.3	-21.9	178.7	29.5	-35.1	0	0	0	114.5	R377	R377-P393 PolarHBondContact NH2-O 2.75Å
394	E	90.6	Very high	89.6	Confident	133 Å²	133	57.1 Å²	57.1	62%	0.621	29%	0.289	S	S	*	.	S	Bend	trans	-94.6	-20.8	-176.9	-57.1	177.2	146.2	0	0	112.8	D392 Q396 R444	D392-E394 VanDerWaalsContact C-N 3.35Å; D392-E394 PolarHBondContact OD1-N 2.86Å; E394-Q396 PolarHBondContact O-N 3.41Å; E394-R444 IonicContact OE2-CZ 3.46Å; E394-R444 IonicContact OE2-NE 2.74Å; E394-R444 PolarHBondContact OE2-NE 3.46Å; E394-R444 IonicContact OE2-NH2 3.63Å; E394-R444 PolarHBondContact OE2-NH2 2.96Å
395	M	93.8	Very high	90.3	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-54.1	131.1	176.3	-171.1	57.2	53.6	0	0	112.3	R377 D392 S399 M401 A420 F423 V430	R377-M395 HydrophobicContact CG-CB 4.1Å; R377-M395 HydrophobicContact CG-CG 3.78Å; R377-M395 PolarHBondContact NE-O 2.84Å; R377-M395 VanDerWaalsContact NE-O 3.15Å; R377-M395 PolarHBondContact NH1-O 2.82Å; R377-M395 VanDerWaalsContact NH1-O 3.15Å; R377-M395 PolarHBondContact NH2-O 2.92Å; R377-M395 VanDerWaalsContact NH2-O 3.09Å; D392-M395 HydrophobicContact CB-CB 3.85Å; D392-M395 PolarHBondContact OD1-N 3.28Å; M395-S399 WeakPolarHBondContact SD-CB 3.39Å; M395-M401 HydrophobicContact CE-CB 4.38Å; M395-M401 HydrophobicContact CE-CG 4.3Å; M395-M401 HydrophobicContact CE-SD 4.17Å; M395-M401 HydrophobicContact CG-CB 4.02Å; M395-M401 HydrophobicContact CG-SD 4.3Å; M395-M401 HydrophobicContact SD-CB 4.21Å; M395-A420 HydrophobicContact CE-CB 3.75Å; M395-A420 HydrophobicContact SD-CB 3.72Å; M395-F423 HydrophobicContact CE-CD2 4.29Å; M395-F423 HydrophobicContact SD-CB 4.39Å; M395-F423 HydrophobicContact SD-CD2 3.58Å; M395-F423 VanDerWaalsContact SD-CD2 3.58Å; M395-F423 HydrophobicContact SD-CE2 4.22Å; M395-F423 HydrophobicContact SD-CG 4.3Å; M395-V430 HydrophobicContact CE-CG2 3.58Å
396	Q	87.9	Confident	91.1	Very high	94 Å²	94	51.2 Å²	51.2	44%	0.439	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-87.5	163.2	-178.3	-68.2	176.7	56.7	0	0	112.3	R377 E394 S399 F423 N424	R377-Q396 WeakPolarHBondContact CA-O 3.25Å; E394-Q396 PolarHBondContact O-N 3.41Å; Q396-S399 VanDerWaalsContact O-CB 3.29Å; Q396-S399 WeakPolarHBondContact O-CB 3.49Å; Q396-S399 PolarHBondContact O-OG 2.86Å; Q396-F423 HydrophobicContact CB-CD2 4.47Å; Q396-F423 HydrophobicContact CB-CE2 4.35Å; Q396-F423 HydrophobicContact CG-CE2 4.1Å; Q396-N424 PolarHBondContact NE2-OD1 3.04Å
397	E	85.9	Confident	92	Very high	100 Å²	100	43.4 Å²	43.4	47%	0.467	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	159.5	168.9	-60.8	-166.8	132.9	0	0	111.8	T375 S399	T375-E397 VanDerWaalsContact CB-CD 3.46Å; T375-E397 WeakPolarHBondContact CB-OE1 3.32Å; T375-E397 HydrophobicContact CG2-CB 4.45Å; T375-E397 HydrophobicContact CG2-CG 4.49Å; T375-E397 PolarHBondContact OG1-OE1 2.99Å; E397-S399 PolarHBondContact O-N 2.92Å; E397-S399 PolarHBondContact O-OG 2.97Å
398	A	88.5	Confident	92.9	Very high	48 Å²	48	41.3 Å²	41.3	40%	0.397	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	13.7	-178.7	0	0	0	0	0	117.3	T375 W376 R422	T375-A398 PolarHBondContact O-N 3.16Å; W376-A398 CarbonylContact O-C 3.59Å; W376-A398 WeakPolarHBondContact O-CA 3.46Å; W376-A398 PolarHBondContact O-N 2.84Å; A398-R422 WeakPolarHBondContact O-CB 3.36Å
399	S	95.1	Very high	93.3	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.014	21%	0.211	C	C	.	.			trans	-82.5	-17.4	-176.2	-60.2	0	0	0	0	115.1	W376 M395 Q396 E397 A420 R422	W376-S399 PolarHBondContact O-N 3.41Å; M395-S399 WeakPolarHBondContact SD-CB 3.39Å; Q396-S399 VanDerWaalsContact O-CB 3.29Å; Q396-S399 WeakPolarHBondContact O-CB 3.49Å; Q396-S399 PolarHBondContact O-OG 2.86Å; E397-S399 PolarHBondContact O-N 2.92Å; E397-S399 PolarHBondContact O-OG 2.97Å; S399-A420 CarbonylContact O-C 3.59Å; S399-A420 WeakPolarHBondContact O-CA 3.36Å; S399-R422 PolarHBondContact O-N 3.29Å
400	Y	97.4	Very high	93.6	Very high	69 Å²	69	38.7 Å²	38.7	27%	0.271	20%	0.197	S	C	.	.			trans	58.8	42	-179.1	-65.5	10.4	0	0	0	113.9	W376 G402 Y403 R422	W376-Y400 HydrophobicContact CB-CD1 3.88Å; W376-Y400 HydrophobicContact CB-CE1 3.73Å; W376-Y400 AromaticContact CD1-CE1 3.75Å; W376-Y400 HydrophobicContact CG-CD1 4.49Å; W376-Y400 AromaticContact CG-CE1 3.96Å; W376-Y400 HydrophobicContact CG-CE1 3.96Å; W376-Y400 PolarHBondContact O-N 2.76Å; Y400-G402 PolarHBondContact O-N 3.11Å; Y400-Y403 HydrophobicContact CD2-CD2 4.06Å; Y400-Y403 WeakPolarHBondContact O-CB 3.11Å; Y400-Y403 PolarHBondContact O-N 2.73Å; Y400-R422 VanDerWaalsContact CD2-CD 3.46Å; Y400-R422 HydrophobicContact CD2-CG 3.99Å; Y400-R422 HydrophobicContact CE2-CG 4.36Å; Y400-R422 HydrophobicContact CG-CB 4.48Å; Y400-R422 HydrophobicContact CG-CG 4.13Å
401	M	97.9	Very high	93.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	127.1	173.9	-169.1	-173.2	73.6	0	0	110.5	R377 G378 L380 D392 M395 T418 A420 F432	R377-M401 VanDerWaalsContact O-CB 3.28Å; R377-M401 WeakPolarHBondContact O-CB 3.27Å; R377-M401 PolarHBondContact O-N 3.3Å; G378-M401 VanDerWaalsContact CA-O 3.27Å; G378-M401 WeakPolarHBondContact CA-O 3.37Å; L380-M401 HydrophobicContact CG-CE 4.47Å; D392-M401 HydrophobicContact CB-CE 4.47Å; D392-M401 HydrophobicContact CB-SD 3.82Å; M395-M401 HydrophobicContact CE-CB 4.38Å; M395-M401 HydrophobicContact CE-CG 4.3Å; M395-M401 HydrophobicContact CE-SD 4.17Å; M395-M401 HydrophobicContact CG-CB 4.02Å; M395-M401 HydrophobicContact CG-SD 4.3Å; M395-M401 HydrophobicContact SD-CB 4.21Å; M401-T418 HydrophobicContact CG-CG2 3.74Å; M401-T418 HydrophobicContact SD-CG2 4.18Å; M401-A420 HydrophobicContact CB-CB 4.03Å; M401-A420 HydrophobicContact CG-CB 4.4Å; M401-F432 HydrophobicContact SD-CE2 4.33Å; M401-F432 HydrophobicContact SD-CZ 4.37Å
402	G	97.4	Very high	93.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	8	-171	0	0	0	0	0	114.5	S358 A369 V371 Y400 S404 T418 G419	S358-G402 PolarHBondContact OG-O 2.77Å; A369-G402 WeakPolarHBondContact CB-O 3.47Å; V371-G402 VanDerWaalsContact CG1-C 3.49Å; Y400-G402 PolarHBondContact O-N 3.11Å; G402-S404 PolarHBondContact O-N 3.48Å; G402-T418 WeakPolarHBondContact CA-OG1 3.41Å; G402-T418 PolarHBondContact N-OG1 2.7Å; G402-T418 VanDerWaalsContact N-OG1 3.08Å; G402-G419 PolarHBondContact N-O 3.15Å
403	Y	98.5	Very high	93.3	Very high	69 Å²	69	45.1 Å²	45.1	27%	0.271	25%	0.247	S	C	.	.	S	Bend	trans	-57.1	-39.2	171.7	-170.3	-87.8	0	0	0	111.1	F357 Y400 G419 P421 Y453 A456	F357-Y403 HydrophobicContact CD1-CD2 4.39Å; F357-Y403 HydrophobicContact CE1-CD1 4.45Å; F357-Y403 AromaticContact CE1-CD2 3.45Å; F357-Y403 HydrophobicContact CE1-CD2 3.45Å; F357-Y403 VanDerWaalsContact CE1-CD2 3.45Å; F357-Y403 AromaticContact CE1-CE2 3.54Å; F357-Y403 HydrophobicContact CE1-CE2 3.54Å; F357-Y403 AromaticContact CE1-CG 3.94Å; F357-Y403 HydrophobicContact CE1-CG 3.94Å; F357-Y403 AromaticContact CZ-CD2 3.81Å; F357-Y403 HydrophobicContact CZ-CD2 3.81Å; F357-Y403 AromaticContact CZ-CE2 3.51Å; F357-Y403 HydrophobicContact CZ-CE2 3.51Å; Y400-Y403 HydrophobicContact CD2-CD2 4.06Å; Y400-Y403 WeakPolarHBondContact O-CB 3.11Å; Y400-Y403 PolarHBondContact O-N 2.73Å; Y403-G419 PolarHBondContact N-O 2.67Å; Y403-P421 VanDerWaalsContact CB-CD 3.48Å; Y403-P421 HydrophobicContact CD1-CG 3.85Å; Y403-P421 HydrophobicContact CD2-CG 4.29Å; Y403-P421 HydrophobicContact CG-CG 3.64Å; Y403-Y453 HydrophobicContact CD1-CE1 4.42Å; Y403-Y453 AromaticContact CE1-CE1 3.83Å; Y403-Y453 HydrophobicContact CE1-CE1 3.83Å; Y403-Y453 HydrophobicContact CE2-CE1 4.29Å; Y403-Y453 WeakPolarHBondContact CE2-OH 3.47Å; Y403-Y453 AromaticContact CZ-CE1 3.77Å; Y403-A456 HydrophobicContact CE1-CB 4.33Å
404	S	98.4	Very high	93.5	Very high	5 Å²	5	41 Å²	41	4%	0.035	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.5	170.6	62.9	0	0	0	0	110.9	G402 T418 G419 G455 L458	G402-S404 PolarHBondContact O-N 3.48Å; S404-T418 WeakPolarHBondContact O-CA 3.33Å; S404-T418 PolarHBondContact O-OG1 2.95Å; S404-G419 PolarHBondContact O-N 3.15Å; S404-G419 WeakPolarHBondContact OG-CA 3.39Å; S404-G419 PolarHBondContact OG-N 2.79Å; S404-G455 WeakPolarHBondContact CB-O 3.44Å; S404-G455 PolarHBondContact OG-O 2.82Å; S404-L458 WeakPolarHBondContact OG-CD1 3.45Å; S404-L458 WeakPolarHBondContact OG-CG 3.36Å
405	L	97.1	Very high	93.8	Very high	22 Å²	22	34.6 Å²	34.6	12%	0.115	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.2	174.7	-86.2	175.1	0	0	0	110.2	S358 V360 I367 A369 L380 F417	S358-L405 WeakPolarHBondContact OG-CG 3.49Å; V360-L405 HydrophobicContact CB-CB 4.48Å; V360-L405 HydrophobicContact CG1-CB 4.28Å; V360-L405 HydrophobicContact CG1-CD1 4.32Å; I367-L405 HydrophobicContact CG2-CD1 4.16Å; A369-L405 HydrophobicContact CB-CD1 3.78Å; A369-L405 HydrophobicContact CB-CG 4.32Å; L380-L405 HydrophobicContact CD1-CD2 3.82Å; L380-L405 HydrophobicContact CD2-CD1 4.35Å; L380-L405 HydrophobicContact CD2-CD2 3.85Å; L380-L405 HydrophobicContact CD2-CG 4.32Å; L380-L405 HydrophobicContact CG-CD2 4.44Å; L405-F417 WeakPolarHBondContact CA-O 3.49Å
406	S	96.7	Very high	93.9	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.6	169.1	164.2	0	0	0	0	108.7	F417 S460	S406-F417 PolarHBondContact N-O 2.85Å; S406-F417 PolarHBondContact O-N 2.89Å; S406-S460 VanDerWaalsContact OG-CB 3.27Å; S406-S460 WeakPolarHBondContact OG-CB 3.4Å; S406-S460 PolarHBondContact OG-N 2.86Å; S406-S460 PolarHBondContact OG-OG 2.82Å; S406-S460 VanDerWaalsContact OG-OG 3.1Å
407	V	95.4	Very high	94.4	Very high	23 Å²	23	30.1 Å²	30.1	14%	0.139	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.2	179.3	68.1	0	0	0	0	109.1	V360 H362 L415 Y416 S460	V360-V407 HydrophobicContact CG2-CB 3.84Å; V360-V407 HydrophobicContact CG2-CG1 3.46Å; V360-V407 VanDerWaalsContact CG2-CG1 3.46Å; H362-V407 HydrophobicContact CB-CB 4.46Å; H362-V407 HydrophobicContact CB-CG1 3.97Å; H362-V407 HydrophobicContact CB-CG2 3.86Å; V407-L415 CarbonylContact C-O 3.59Å; V407-L415 WeakPolarHBondContact CA-O 3.4Å; V407-L415 WeakPolarHBondContact CG2-O 2.96Å; V407-Y416 HydrophobicContact CB-CD1 4.24Å; V407-Y416 HydrophobicContact CB-CE1 4.29Å; V407-Y416 HydrophobicContact CG2-CD1 3.84Å; V407-Y416 HydrophobicContact CG2-CD2 4.44Å; V407-Y416 HydrophobicContact CG2-CE1 3.62Å; V407-Y416 HydrophobicContact CG2-CE2 4.25Å; V407-Y416 HydrophobicContact CG2-CG 4.27Å; V407-S460 WeakPolarHBondContact O-CB 3.36Å; V407-S460 PolarHBondContact O-OG 2.83Å
408	G	94.3	Very high	95	Very high	3 Å²	3	25.3 Å²	25.3	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	177.4	175.5	0	0	0	0	0	111.8	S414 L415 T469	G408-S414 WeakPolarHBondContact O-CA 3.33Å; G408-L415 PolarHBondContact N-O 2.79Å; G408-L415 PolarHBondContact O-N 3.01Å; G408-T469 WeakPolarHBondContact CA-OG1 3.44Å
409	E	93.7	Very high	95.4	Very high	35 Å²	35	23 Å²	23	16%	0.164	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	142.8	-179	-170.5	152	164.2	0	0	110.6	H362 K363 G412 T413 N468 T469	H362-E409 IonicContact CE1-OE2 2.99Å; H362-E409 PolarHBondContact CE1-OE2 2.77Å; H362-E409 VanDerWaalsContact CE1-OE2 3.28Å; H362-E409 IonicContact NE2-OE2 3.24Å; H362-E409 PolarHBondContact NE2-OE2 2.97Å; K363-E409 WeakPolarHBondContact CE-OE2 3.35Å; K363-E409 IonicContact NZ-OE1 2.68Å; K363-E409 PolarHBondContact NZ-OE1 3.43Å; K363-E409 IonicContact NZ-OE2 3.98Å; K363-E409 PolarHBondContact NZ-OE2 3.26Å; E409-G412 WeakPolarHBondContact OE1-CA 3.46Å; E409-T413 WeakPolarHBondContact CA-O 3.32Å; E409-N468 CarbonylContact O-C 3.57Å; E409-N468 WeakPolarHBondContact O-CA 3.46Å; E409-T469 PolarHBondContact N-OG1 2.61Å; E409-T469 PolarHBondContact O-N 3.24Å
410	R	93.1	Very high	95.6	Very high	31 Å²	31	23 Å²	23	12%	0.117	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	122.1	169.6	-161.5	77.5	-168.7	172.6	5.8	109.5	G412 T413 L415 N468 T469 D470 L495 D497	R410-G412 VanDerWaalsContact C-N 3.29Å; R410-G412 PolarHBondContact O-N 3.04Å; R410-T413 PolarHBondContact N-O 2.7Å; R410-T413 WeakPolarHBondContact O-CB 3.49Å; R410-T413 PolarHBondContact O-N 2.77Å; R410-T413 PolarHBondContact O-OG1 2.79Å; R410-L415 HydrophobicContact CB-CD1 4.33Å; R410-N468 WeakPolarHBondContact CA-OD1 3.28Å; R410-T469 WeakPolarHBondContact CD-O 3.46Å; R410-T469 PolarHBondContact NH1-O 2.89Å; R410-D470 IonicContact CZ-OD1 3.76Å; R410-D470 IonicContact NH1-OD1 2.64Å; R410-D470 PolarHBondContact NH1-OD1 3.3Å; R410-D470 IonicContact NH2-OD1 2.8Å; R410-L495 HydrophobicContact CB-CD2 4.15Å; R410-L495 HydrophobicContact CG-CD2 4.43Å; R410-L495 HydrophobicContact CG-CG 4.5Å; R410-D497 IonicContact CZ-OD1 3.72Å; R410-D497 IonicContact NE-OD1 3.65Å; R410-D497 PolarHBondContact NE-OD1 2.75Å; R410-D497 IonicContact NH2-OD1 2.7Å; R410-D497 PolarHBondContact NH2-OD1 2.99Å
411	N	90.1	Very high	95.6	Very high	108 Å²	108	19.8 Å²	19.8	58%	0.578	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	47.2	-178.3	-64.1	-58	0	0	0	112.5	T413 N468	N411-T413 PolarHBondContact O-N 2.87Å; N411-N468 PolarHBondContact N-OD1 2.78Å
412	G	88	Confident	95.5	Very high	52 Å²	52	24.2 Å²	24.2	54%	0.536	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	-2.1	-178	0	0	0	0	0	115.8	E409 R410	E409-G412 WeakPolarHBondContact OE1-CA 3.46Å; R410-G412 VanDerWaalsContact C-N 3.29Å; R410-G412 PolarHBondContact O-N 3.04Å
413	T	91.1	Very high	95.5	Very high	43 Å²	43	25.3 Å²	25.3	26%	0.264	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.8	-177.1	-58.9	0	0	0	0	110.9	E409 R410 N411 L415 R433 I499	E409-T413 WeakPolarHBondContact CA-O 3.32Å; R410-T413 PolarHBondContact N-O 2.7Å; R410-T413 WeakPolarHBondContact O-CB 3.49Å; R410-T413 PolarHBondContact O-N 2.77Å; R410-T413 PolarHBondContact O-OG1 2.79Å; N411-T413 PolarHBondContact O-N 2.87Å; T413-L415 HydrophobicContact CG2-CD2 4.19Å; T413-R433 VanDerWaalsContact CG2-CD 3.45Å; T413-R433 HydrophobicContact CG2-CG 3.53Å; T413-I499 HydrophobicContact CG2-CD1 4.02Å
414	S	93.5	Very high	95	Very high	15 Å²	15	25.6 Å²	25.6	11%	0.105	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.1	175.3	-51.3	0	0	0	0	112.3	H362 G408 R434	H362-S414 PolarHBondContact CD2-OG 2.82Å; H362-S414 PolarHBondContact NE2-OG 2.92Å; G408-S414 WeakPolarHBondContact O-CA 3.33Å; S414-R434 PolarHBondContact O-N 2.9Å; S414-R434 VanDerWaalsContact O-N 3.16Å
415	L	95.4	Very high	94.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.2	-178.4	-54.6	174	0	0	0	109.4	V407 G408 R410 T413 F417 F432 R433 L495 I499	V407-L415 CarbonylContact C-O 3.59Å; V407-L415 WeakPolarHBondContact CA-O 3.4Å; V407-L415 WeakPolarHBondContact CG2-O 2.96Å; G408-L415 PolarHBondContact N-O 2.79Å; G408-L415 PolarHBondContact O-N 3.01Å; R410-L415 HydrophobicContact CB-CD1 4.33Å; T413-L415 HydrophobicContact CG2-CD2 4.19Å; L415-F417 HydrophobicContact CB-CE1 4.18Å; L415-F417 HydrophobicContact CB-CE2 4.37Å; L415-F417 HydrophobicContact CB-CZ 3.84Å; L415-F417 HydrophobicContact CD1-CZ 4.16Å; L415-F432 WeakPolarHBondContact CA-O 3.3Å; L415-R433 HydrophobicContact CD2-CB 4.01Å; L415-R433 HydrophobicContact CD2-CG 4.21Å; L415-L495 HydrophobicContact CD1-CD1 4.32Å; L415-L495 HydrophobicContact CD1-CD2 3.58Å; L415-I499 HydrophobicContact CD1-CG2 3.67Å; L415-I499 HydrophobicContact CD2-CD1 4.35Å; L415-I499 HydrophobicContact CD2-CG2 3.56Å; L415-I499 HydrophobicContact CG-CG2 4.27Å
416	Y	96.5	Very high	94.1	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	112.9	-177.9	-66.1	-101.8	0	0	0	108.7	V360 I367 V407 F432 R434 W439	V360-Y416 HydrophobicContact CG1-CD1 4.23Å; V360-Y416 HydrophobicContact CG1-CE1 4.38Å; I367-Y416 HydrophobicContact CB-CD1 4.5Å; I367-Y416 HydrophobicContact CB-CE1 4.47Å; I367-Y416 HydrophobicContact CG1-CD1 3.8Å; I367-Y416 HydrophobicContact CG1-CE1 3.5Å; I367-Y416 VanDerWaalsContact CG1-CE1 3.5Å; V407-Y416 HydrophobicContact CB-CD1 4.24Å; V407-Y416 HydrophobicContact CB-CE1 4.29Å; V407-Y416 HydrophobicContact CG2-CD1 3.84Å; V407-Y416 HydrophobicContact CG2-CD2 4.44Å; V407-Y416 HydrophobicContact CG2-CE1 3.62Å; V407-Y416 HydrophobicContact CG2-CE2 4.25Å; V407-Y416 HydrophobicContact CG2-CG 4.27Å; Y416-F432 PolarHBondContact N-O 3.42Å; Y416-F432 PolarHBondContact O-N 2.92Å; Y416-R434 HydrophobicContact CD2-CB 4.45Å; Y416-R434 HydrophobicContact CE2-CB 4.04Å; Y416-W439 HydrophobicContact CD1-CZ3 4.4Å; Y416-W439 HydrophobicContact CD2-CE3 4.49Å; Y416-W439 AromaticContact CD2-CH2 3.93Å; Y416-W439 HydrophobicContact CD2-CH2 3.93Å; Y416-W439 AromaticContact CD2-CZ3 3.41Å; Y416-W439 HydrophobicContact CD2-CZ3 3.41Å; Y416-W439 VanDerWaalsContact CD2-CZ3 3.41Å; Y416-W439 HydrophobicContact CE1-CH2 4.48Å; Y416-W439 AromaticContact CE2-CH2 3.76Å; Y416-W439 HydrophobicContact CE2-CH2 3.76Å; Y416-W439 AromaticContact CE2-CZ3 3.73Å; Y416-W439 HydrophobicContact CE2-CZ3 3.73Å; Y416-W439 HydrophobicContact CG-CH2 4.36Å; Y416-W439 AromaticContact CG-CZ3 3.77Å; Y416-W439 HydrophobicContact CG-CZ3 3.77Å
417	F	97.8	Very high	94.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.2	-178.4	-46.3	-72.6	0	0	0	108.6	L405 S406 L415 V431 L458 L472 L501	L405-F417 WeakPolarHBondContact CA-O 3.49Å; S406-F417 PolarHBondContact N-O 2.85Å; S406-F417 PolarHBondContact O-N 2.89Å; L415-F417 HydrophobicContact CB-CE1 4.18Å; L415-F417 HydrophobicContact CB-CE2 4.37Å; L415-F417 HydrophobicContact CB-CZ 3.84Å; L415-F417 HydrophobicContact CD1-CZ 4.16Å; F417-V431 HydrophobicContact CD1-CB 4.39Å; F417-V431 HydrophobicContact CD1-CG1 3.82Å; F417-V431 HydrophobicContact CD1-CG2 4.05Å; F417-V431 HydrophobicContact CE1-CG1 3.76Å; F417-V431 HydrophobicContact CE1-CG2 4.46Å; F417-L458 HydrophobicContact CB-CD1 4.02Å; F417-L458 WeakPolarHBondContact O-CD1 3.45Å; F417-L472 HydrophobicContact CB-CD1 4.09Å; F417-L472 HydrophobicContact CB-CD2 4.17Å; F417-L472 HydrophobicContact CD1-CD1 4.32Å; F417-L472 HydrophobicContact CD1-CD2 3.7Å; F417-L472 HydrophobicContact CD2-CD1 3.75Å; F417-L472 HydrophobicContact CE1-CD2 4.22Å; F417-L472 HydrophobicContact CE2-CD1 4.23Å; F417-L472 HydrophobicContact CG-CD1 3.79Å; F417-L472 HydrophobicContact CG-CD2 3.91Å; F417-L472 HydrophobicContact CG-CG 4.47Å; F417-L501 HydrophobicContact CD1-CD1 4.47Å; F417-L501 HydrophobicContact CE1-CD1 4.11Å
418	T	98.3	Very high	94.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.9	177.3	-169.7	0	0	0	0	112.9	L380 M401 G402 S404 V429 V430 F432	L380-T418 HydrophobicContact CD1-CG2 3.96Å; L380-T418 HydrophobicContact CD2-CG2 4.46Å; L380-T418 HydrophobicContact CG-CG2 4.48Å; M401-T418 HydrophobicContact CG-CG2 3.74Å; M401-T418 HydrophobicContact SD-CG2 4.18Å; G402-T418 WeakPolarHBondContact CA-OG1 3.41Å; G402-T418 PolarHBondContact N-OG1 2.7Å; G402-T418 VanDerWaalsContact N-OG1 3.08Å; S404-T418 WeakPolarHBondContact O-CA 3.33Å; S404-T418 PolarHBondContact O-OG1 2.95Å; T418-V429 CarbonylContact O-C 3.59Å; T418-V429 WeakPolarHBondContact O-CA 3.47Å; T418-V430 HydrophobicContact CG2-CB 4.09Å; T418-V430 PolarHBondContact N-O 2.81Å; T418-V430 PolarHBondContact O-N 2.94Å; T418-F432 HydrophobicContact CG2-CD2 4.24Å; T418-F432 HydrophobicContact CG2-CE2 3.85Å
419	G	98.4	Very high	94.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.9	176	0	0	0	0	0	112.6	G402 Y403 S404 P421 G455	G402-G419 PolarHBondContact N-O 3.15Å; Y403-G419 PolarHBondContact N-O 2.67Å; S404-G419 PolarHBondContact O-N 3.15Å; S404-G419 WeakPolarHBondContact OG-CA 3.39Å; S404-G419 PolarHBondContact OG-N 2.79Å; G419-P421 VanDerWaalsContact C-CD 3.48Å; G419-G455 WeakPolarHBondContact CA-O 3.14Å
420	A	98.4	Very high	94.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	69.7	168.8	0	0	0	0	0	108.7	M395 S399 M401 R422 F423 G427 E428	M395-A420 HydrophobicContact CE-CB 3.75Å; M395-A420 HydrophobicContact SD-CB 3.72Å; S399-A420 CarbonylContact O-C 3.59Å; S399-A420 WeakPolarHBondContact O-CA 3.36Å; M401-A420 HydrophobicContact CB-CB 4.03Å; M401-A420 HydrophobicContact CG-CB 4.4Å; A420-R422 PolarHBondContact O-N 2.79Å; A420-F423 HydrophobicContact CB-CB 4.12Å; A420-F423 VanDerWaalsContact O-CB 3.31Å; A420-F423 WeakPolarHBondContact O-CB 3.42Å; A420-F423 PolarHBondContact O-N 2.98Å; A420-G427 WeakPolarHBondContact O-CA 3.42Å; A420-E428 PolarHBondContact N-O 2.89Å; A420-E428 PolarHBondContact O-N 3.43Å; A420-E428 VanDerWaalsContact O-N 3.16Å
421	P	98.3	Very high	94.8	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.013	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	0.8	-166.7	30.4	-37.7	0	0	0	114.9	Y403 G419 Y453 F454 A456	Y403-P421 VanDerWaalsContact CB-CD 3.48Å; Y403-P421 HydrophobicContact CD1-CG 3.85Å; Y403-P421 HydrophobicContact CD2-CG 4.29Å; Y403-P421 HydrophobicContact CG-CG 3.64Å; G419-P421 VanDerWaalsContact C-CD 3.48Å; P421-Y453 HydrophobicContact CB-CD1 4.11Å; P421-Y453 HydrophobicContact CB-CD2 3.8Å; P421-Y453 HydrophobicContact CB-CE1 4.17Å; P421-Y453 HydrophobicContact CB-CE2 3.9Å; P421-Y453 HydrophobicContact CB-CG 3.87Å; P421-Y453 HydrophobicContact CG-CD1 4.49Å; P421-Y453 HydrophobicContact CG-CD2 4.41Å; P421-Y453 HydrophobicContact CG-CE1 4.07Å; P421-Y453 HydrophobicContact CG-CE2 4.02Å; P421-Y453 VanDerWaalsContact O-CD2 3.31Å; P421-Y453 WeakPolarHBondContact O-CD2 3.36Å; P421-F454 VanDerWaalsContact CA-O 3.32Å; P421-F454 WeakPolarHBondContact CA-O 3.31Å; P421-A456 HydrophobicContact CB-CB 4.39Å
422	R	96.1	Very high	95.1	Very high	93 Å²	93	23.4 Å²	23.4	35%	0.351	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-4.4	169.8	-66.8	-169.9	62.9	84.9	7.6	114.2	A398 S399 Y400 A420 N424 H425 Y453	A398-R422 WeakPolarHBondContact O-CB 3.36Å; S399-R422 PolarHBondContact O-N 3.29Å; Y400-R422 VanDerWaalsContact CD2-CD 3.46Å; Y400-R422 HydrophobicContact CD2-CG 3.99Å; Y400-R422 HydrophobicContact CE2-CG 4.36Å; Y400-R422 HydrophobicContact CG-CB 4.48Å; Y400-R422 HydrophobicContact CG-CG 4.13Å; A420-R422 PolarHBondContact O-N 2.79Å; R422-N424 PolarHBondContact O-N 3.35Å; R422-H425 WeakPolarHBondContact O-CA 3.48Å; R422-H425 PolarHBondContact O-N 3.5Å; R422-Y453 HydrophobicContact CG-CE2 3.85Å
423	F	95.5	Very high	95.3	Very high	24 Å²	24	25.2 Å²	25.2	11%	0.105	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-55	125.4	179.2	-179.7	-102.3	0	0	0	111.2	M395 Q396 A420 H425 M426 G427 E428	M395-F423 HydrophobicContact CE-CD2 4.29Å; M395-F423 HydrophobicContact SD-CB 4.39Å; M395-F423 HydrophobicContact SD-CD2 3.58Å; M395-F423 VanDerWaalsContact SD-CD2 3.58Å; M395-F423 HydrophobicContact SD-CE2 4.22Å; M395-F423 HydrophobicContact SD-CG 4.3Å; Q396-F423 HydrophobicContact CB-CD2 4.47Å; Q396-F423 HydrophobicContact CB-CE2 4.35Å; Q396-F423 HydrophobicContact CG-CE2 4.1Å; A420-F423 HydrophobicContact CB-CB 4.12Å; A420-F423 VanDerWaalsContact O-CB 3.31Å; A420-F423 WeakPolarHBondContact O-CB 3.42Å; A420-F423 PolarHBondContact O-N 2.98Å; F423-H425 PolarHBondContact O-N 2.85Å; F423-M426 PolarHBondContact O-N 2.93Å; F423-G427 PolarHBondContact O-N 2.81Å; F423-E428 HydrophobicContact CB-CB 3.98Å; F423-E428 HydrophobicContact CD1-CB 3.57Å; F423-E428 HydrophobicContact CD1-CG 4.43Å; F423-E428 HydrophobicContact CE1-CB 4.25Å; F423-E428 WeakPolarHBondContact CE1-OE1 3.35Å; F423-E428 HydrophobicContact CG-CB 3.95Å
424	N	89	Confident	95.2	Very high	74 Å²	74	26.3 Å²	26.3	40%	0.396	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	48.3	23.9	-172.2	-71.6	-32.6	0	0	0	114.8	Q396 R422 M426	Q396-N424 PolarHBondContact NE2-OD1 3.04Å; R422-N424 PolarHBondContact O-N 3.35Å; N424-M426 HydrophobicContact CB-CE 3.96Å; N424-M426 PolarHBondContact O-N 2.74Å; N424-M426 VanDerWaalsContact O-N 3.14Å
425	H	87.8	Confident	94.8	Very high	115 Å²	115	28.6 Å²	28.6	53%	0.532	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	59.9	6	-169.8	-55.6	86.7	0	0	0	115.9	R422 F423 I450 G451	R422-H425 WeakPolarHBondContact O-CA 3.48Å; R422-H425 PolarHBondContact O-N 3.5Å; F423-H425 PolarHBondContact O-N 2.85Å; H425-I450 HydrophobicContact CB-CD1 3.99Å; H425-I450 HydrophobicContact CB-CG1 3.75Å; H425-I450 WeakPolarHBondContact O-CG1 3.4Å; H425-G451 PolarHBondContact O-N 2.8Å
426	M	89.3	Confident	94.1	Very high	59 Å²	59	36.8 Å²	36.8	29%	0.291	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-43.3	178.4	-60.4	-176.9	-67.6	0	0	111.8	F423 N424 I450 S452 F454	F423-M426 PolarHBondContact O-N 2.93Å; N424-M426 HydrophobicContact CB-CE 3.96Å; N424-M426 PolarHBondContact O-N 2.74Å; N424-M426 VanDerWaalsContact O-N 3.14Å; M426-I450 HydrophobicContact CG-CB 4.25Å; M426-S452 PolarHBondContact O-OG 3.14Å; M426-F454 PolarHBondContact O-N 3.09Å
427	G	96.2	Very high	93.2	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	19%	0.188	C	C	.	.			trans	109.1	143	-173.8	0	0	0	0	0	112.8	A420 F423 F454	A420-G427 WeakPolarHBondContact O-CA 3.42Å; F423-G427 PolarHBondContact O-N 2.81Å; G427-F454 WeakPolarHBondContact CA-O 3.28Å
428	E	97.5	Very high	92.7	Very high	7 Å²	7	47 Å²	47	3%	0.033	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	154.1	174.1	174.9	169.3	-82.6	0	0	109.7	A420 F423 V430 R444 L445 T446	A420-E428 PolarHBondContact N-O 2.89Å; A420-E428 PolarHBondContact O-N 3.43Å; A420-E428 VanDerWaalsContact O-N 3.16Å; F423-E428 HydrophobicContact CB-CB 3.98Å; F423-E428 HydrophobicContact CD1-CB 3.57Å; F423-E428 HydrophobicContact CD1-CG 4.43Å; F423-E428 HydrophobicContact CE1-CB 4.25Å; F423-E428 WeakPolarHBondContact CE1-OE1 3.35Å; F423-E428 HydrophobicContact CG-CB 3.95Å; E428-V430 HydrophobicContact CG-CG2 4.22Å; E428-V430 WeakPolarHBondContact OE2-CG2 3.36Å; E428-R444 IonicContact OE2-CZ 3.21Å; E428-R444 IonicContact OE2-NH1 3.42Å; E428-R444 PolarHBondContact OE2-NH1 3.49Å; E428-L445 CarbonylContact C-O 3.47Å; E428-L445 WeakPolarHBondContact CA-O 3.43Å; E428-T446 HydrophobicContact CB-CG2 4.39Å; E428-T446 HydrophobicContact CG-CG2 4.15Å; E428-T446 WeakPolarHBondContact OE1-CG2 3.35Å
429	V	98.4	Very high	92.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.7	163.5	178.9	0	0	0	0	109.3	T418 R444 L445 F454 L458 L472 V474	T418-V429 CarbonylContact O-C 3.59Å; T418-V429 WeakPolarHBondContact O-CA 3.47Å; V429-R444 WeakPolarHBondContact O-CA 3.41Å; V429-L445 HydrophobicContact CB-CB 4.22Å; V429-L445 HydrophobicContact CB-CD1 4.33Å; V429-L445 HydrophobicContact CG1-CD1 4.44Å; V429-L445 PolarHBondContact N-O 2.87Å; V429-L445 PolarHBondContact O-N 3.43Å; V429-F454 HydrophobicContact CB-CE1 4.37Å; V429-F454 HydrophobicContact CG2-CD1 4.29Å; V429-F454 HydrophobicContact CG2-CE1 3.74Å; V429-F454 HydrophobicContact CG2-CZ 4.29Å; V429-L458 HydrophobicContact CG1-CD1 4.21Å; V429-L458 HydrophobicContact CG1-CD2 4Å; V429-L458 HydrophobicContact CG2-CD2 3.81Å; V429-L472 HydrophobicContact CG1-CD2 4.37Å; V429-V474 HydrophobicContact CG2-CG1 3.68Å; V429-V474 HydrophobicContact CG2-CG2 4.3Å
430	V	97.9	Very high	92.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.3	178	-173	0	0	0	0	109.4	M395 T418 E428 F432 I441	M395-V430 HydrophobicContact CE-CG2 3.58Å; T418-V430 HydrophobicContact CG2-CB 4.09Å; T418-V430 PolarHBondContact N-O 2.81Å; T418-V430 PolarHBondContact O-N 2.94Å; E428-V430 HydrophobicContact CG-CG2 4.22Å; E428-V430 WeakPolarHBondContact OE2-CG2 3.36Å; V430-F432 HydrophobicContact CB-CE2 4.21Å; V430-F432 HydrophobicContact CG1-CD2 4.19Å; V430-F432 HydrophobicContact CG1-CE2 3.71Å; V430-F432 HydrophobicContact CG1-CZ 3.96Å; V430-I441 HydrophobicContact CG1-CD1 4.02Å; V430-I441 HydrophobicContact CG1-CG1 4.05Å; V430-I441 HydrophobicContact CG1-CG2 3.93Å
431	V	97.1	Very high	92	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114	178.6	-171.4	0	0	0	0	109.7	F417 I441 V442 Q443 L501	F417-V431 HydrophobicContact CD1-CB 4.39Å; F417-V431 HydrophobicContact CD1-CG1 3.82Å; F417-V431 HydrophobicContact CD1-CG2 4.05Å; F417-V431 HydrophobicContact CE1-CG1 3.76Å; F417-V431 HydrophobicContact CE1-CG2 4.46Å; V431-I441 CarbonylContact O-C 3.55Å; V431-I441 WeakPolarHBondContact O-CA 3.29Å; V431-V442 HydrophobicContact CB-CB 4.38Å; V431-V442 HydrophobicContact CG1-CB 4.19Å; V431-V442 HydrophobicContact CG1-CG2 4.46Å; V431-V442 PolarHBondContact O-N 3.16Å; V431-Q443 HydrophobicContact CB-CB 4.34Å; V431-Q443 HydrophobicContact CG2-CB 4.13Å; V431-Q443 PolarHBondContact N-O 2.93Å; V431-L501 HydrophobicContact CG2-CD1 3.87Å
432	F	95.9	Very high	91.8	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.009	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135	170.7	-65.8	-87.4	0	0	0	110.6	L380 I390 D392 M401 L415 Y416 T418 V430 W439 I441	L380-F432 HydrophobicContact CD1-CD2 4.19Å; L380-F432 HydrophobicContact CD1-CE2 4.19Å; I390-F432 HydrophobicContact CG2-CD1 3.9Å; I390-F432 HydrophobicContact CG2-CE1 3.75Å; I390-F432 HydrophobicContact CG2-CE2 4.42Å; I390-F432 HydrophobicContact CG2-CG 4.29Å; I390-F432 HydrophobicContact CG2-CZ 4.02Å; D392-F432 HydrophobicContact CB-CZ 4.09Å; M401-F432 HydrophobicContact SD-CE2 4.33Å; M401-F432 HydrophobicContact SD-CZ 4.37Å; L415-F432 WeakPolarHBondContact CA-O 3.3Å; Y416-F432 PolarHBondContact N-O 3.42Å; Y416-F432 PolarHBondContact O-N 2.92Å; T418-F432 HydrophobicContact CG2-CD2 4.24Å; T418-F432 HydrophobicContact CG2-CE2 3.85Å; V430-F432 HydrophobicContact CB-CE2 4.21Å; V430-F432 HydrophobicContact CG1-CD2 4.19Å; V430-F432 HydrophobicContact CG1-CE2 3.71Å; V430-F432 HydrophobicContact CG1-CZ 3.96Å; F432-W439 HydrophobicContact CB-CE3 4.13Å; F432-W439 HydrophobicContact CD1-CB 4.19Å; F432-W439 WeakPolarHBondContact CD1-O 3.42Å; F432-I441 HydrophobicContact CD1-CG1 3.81Å; F432-I441 HydrophobicContact CE1-CD1 4.08Å; F432-I441 HydrophobicContact CE1-CG1 3.5Å; F432-I441 HydrophobicContact CZ-CD1 4.39Å; F432-I441 HydrophobicContact CZ-CG1 4.15Å
433	R	93.8	Very high	91.7	Very high	90 Å²	90	53 Å²	53	34%	0.34	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	140	162.4	174.8	176.5	74.7	-152.4	6.6	108.8	T413 L415 W439 P440 V442	T413-R433 VanDerWaalsContact CG2-CD 3.45Å; T413-R433 HydrophobicContact CG2-CG 3.53Å; L415-R433 HydrophobicContact CD2-CB 4.01Å; L415-R433 HydrophobicContact CD2-CG 4.21Å; R433-W439 WeakPolarHBondContact O-CA 3.43Å; R433-P440 HydrophobicContact CB-CG 4.38Å; R433-P440 PolarHBondContact N-O 2.81Å; R433-P440 VanDerWaalsContact O-CD 3.26Å; R433-P440 WeakPolarHBondContact O-CD 3.5Å; R433-V442 HydrophobicContact CB-CG2 3.53Å
434	R	88.6	Confident	91.7	Very high	66 Å²	66	54.9 Å²	54.9	25%	0.249	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-84.8	128.8	168.9	-166.3	178.8	-170.2	-176.2	10	110.5	T365 D382 S414 Y416 W439	T365-R434 VanDerWaalsContact OG1-CZ 3.31Å; T365-R434 PolarHBondContact OG1-NH1 3Å; T365-R434 PolarHBondContact OG1-NH2 2.99Å; D382-R434 IonicContact OD2-NH2 2.59Å; D382-R434 PolarHBondContact OD2-NH2 2.83Å; S414-R434 PolarHBondContact O-N 2.9Å; S414-R434 VanDerWaalsContact O-N 3.16Å; Y416-R434 HydrophobicContact CD2-CB 4.45Å; Y416-R434 HydrophobicContact CE2-CB 4.04Å; R434-W439 HydrophobicContact CB-CE3 4.45Å; R434-W439 HydrophobicContact CB-CH2 4.16Å; R434-W439 HydrophobicContact CB-CZ3 4.13Å; R434-W439 HydrophobicContact CG-CH2 3.87Å; R434-W439 HydrophobicContact CG-CZ2 3.81Å; R434-W439 HydrophobicContact CG-CZ3 4.3Å
435	D	85.3	Confident	92.1	Very high	63 Å²	63	51.7 Å²	51.7	34%	0.337	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-137.2	81.2	-177	177.4	32.4	0	0	0	108.5	D437 K438 P440	D435-D437 PolarHBondContact O-N 2.81Å; D435-K438 HydrophobicContact CB-CB 4.23Å; D435-K438 PolarHBondContact N-O 2.95Å; D435-K438 WeakPolarHBondContact O-CA 3.48Å; D435-K438 WeakPolarHBondContact O-CB 3.48Å; D435-K438 PolarHBondContact O-N 3.25Å; D435-P440 HydrophobicContact CB-CG 4.26Å
436	E	80.4	Confident	92.3	Very high	171 Å²	171	50.2 Å²	50.2	80%	0.799	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	-103.1	-164.9	-59.8	179.1	154.8	0	0	112.1
437	D	77.8	Confident	92.4	Very high	84 Å²	84	48 Å²	48	45%	0.449	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-4.3	-177.3	-133.7	-11.5	0	0	0	111.9	N385 K388 D435	N385-D437 PolarHBondContact ND2-OD1 2.97Å; K388-D437 PolarHBondContact NZ-O 2.95Å; K388-D437 IonicContact NZ-OD1 2.69Å; K388-D437 PolarHBondContact NZ-OD1 2.95Å; K388-D437 IonicContact NZ-OD2 3.75Å; D435-D437 PolarHBondContact O-N 2.81Å
438	K	86.5	Confident	91.9	Very high	131 Å²	131	55.6 Å²	55.6	57%	0.57	27%	0.272	S	S	*	.	B	Isolated β-bridge	trans	-105.9	153.7	-177.1	-57.6	170.2	-165.8	145.1	0	111.4	D435	D435-K438 HydrophobicContact CB-CB 4.23Å; D435-K438 PolarHBondContact N-O 2.95Å; D435-K438 WeakPolarHBondContact O-CA 3.48Å; D435-K438 WeakPolarHBondContact O-CB 3.48Å; D435-K438 PolarHBondContact O-N 3.25Å
439	W	91.9	Very high	91.4	Very high	33 Å²	33	57.8 Å²	57.8	13%	0.125	28%	0.283	C	S	.	.			trans	-133.4	66.9	-177.8	-64.7	83.5	0	0	0	109.9	I367 I390 Y416 F432 R433 R434	I367-W439 HydrophobicContact CD1-CH2 3.77Å; I367-W439 HydrophobicContact CD1-CZ2 4.1Å; I367-W439 HydrophobicContact CG1-CH2 4.28Å; I390-W439 HydrophobicContact CB-CG 4.48Å; I390-W439 HydrophobicContact CD1-CD2 3.56Å; I390-W439 HydrophobicContact CD1-CE3 3.76Å; I390-W439 HydrophobicContact CD1-CG 4.14Å; I390-W439 HydrophobicContact CD1-CH2 3.9Å; I390-W439 HydrophobicContact CD1-CZ2 3.71Å; I390-W439 HydrophobicContact CD1-CZ3 3.91Å; I390-W439 HydrophobicContact CG1-CB 4.48Å; I390-W439 HydrophobicContact CG1-CD2 3.78Å; I390-W439 HydrophobicContact CG1-CE3 4.35Å; I390-W439 HydrophobicContact CG1-CG 3.79Å; I390-W439 HydrophobicContact CG2-CB 3.76Å; I390-W439 HydrophobicContact CG2-CD2 4.2Å; I390-W439 HydrophobicContact CG2-CE3 4.33Å; I390-W439 HydrophobicContact CG2-CG 3.95Å; Y416-W439 HydrophobicContact CD1-CZ3 4.4Å; Y416-W439 HydrophobicContact CD2-CE3 4.49Å; Y416-W439 AromaticContact CD2-CH2 3.93Å; Y416-W439 HydrophobicContact CD2-CH2 3.93Å; Y416-W439 AromaticContact CD2-CZ3 3.41Å; Y416-W439 HydrophobicContact CD2-CZ3 3.41Å; Y416-W439 VanDerWaalsContact CD2-CZ3 3.41Å; Y416-W439 HydrophobicContact CE1-CH2 4.48Å; Y416-W439 AromaticContact CE2-CH2 3.76Å; Y416-W439 HydrophobicContact CE2-CH2 3.76Å; Y416-W439 AromaticContact CE2-CZ3 3.73Å; Y416-W439 HydrophobicContact CE2-CZ3 3.73Å; Y416-W439 HydrophobicContact CG-CH2 4.36Å; Y416-W439 AromaticContact CG-CZ3 3.77Å; Y416-W439 HydrophobicContact CG-CZ3 3.77Å; F432-W439 HydrophobicContact CB-CE3 4.13Å; F432-W439 HydrophobicContact CD1-CB 4.19Å; F432-W439 WeakPolarHBondContact CD1-O 3.42Å; R433-W439 WeakPolarHBondContact O-CA 3.43Å; R434-W439 HydrophobicContact CB-CE3 4.45Å; R434-W439 HydrophobicContact CB-CH2 4.16Å; R434-W439 HydrophobicContact CB-CZ3 4.13Å; R434-W439 HydrophobicContact CG-CH2 3.87Å; R434-W439 HydrophobicContact CG-CZ2 3.81Å; R434-W439 HydrophobicContact CG-CZ3 4.3Å
440	P	93.8	Very high	90.9	Very high	44 Å²	44	63.6 Å²	63.6	29%	0.286	31%	0.312	S	S	.	.			trans	-61.2	136.1	172.7	25.9	-35.2	0	0	0	111.4	R433 D435	R433-P440 HydrophobicContact CB-CG 4.38Å; R433-P440 PolarHBondContact N-O 2.81Å; R433-P440 VanDerWaalsContact O-CD 3.26Å; R433-P440 WeakPolarHBondContact O-CD 3.5Å; D435-P440 HydrophobicContact CB-CG 4.26Å
441	I	95.1	Very high	90.4	Very high	56 Å²	56	65.7 Å²	65.7	29%	0.287	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.8	166.9	-61.7	174.1	0	0	0	107.8	D392 V430 V431 F432	D392-I441 HydrophobicContact CB-CD1 3.88Å; D392-I441 WeakPolarHBondContact OD1-CD1 3.44Å; V430-I441 HydrophobicContact CG1-CD1 4.02Å; V430-I441 HydrophobicContact CG1-CG1 4.05Å; V430-I441 HydrophobicContact CG1-CG2 3.93Å; V431-I441 CarbonylContact O-C 3.55Å; V431-I441 WeakPolarHBondContact O-CA 3.29Å; F432-I441 HydrophobicContact CD1-CG1 3.81Å; F432-I441 HydrophobicContact CE1-CD1 4.08Å; F432-I441 HydrophobicContact CE1-CG1 3.5Å; F432-I441 HydrophobicContact CZ-CD1 4.39Å; F432-I441 HydrophobicContact CZ-CG1 4.15Å
442	V	93.3	Very high	90.4	Very high	51 Å²	51	65.5 Å²	65.5	31%	0.309	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-45.5	177.8	-172.1	0	0	0	0	110.3	V431 R433 I499	V431-V442 HydrophobicContact CB-CB 4.38Å; V431-V442 HydrophobicContact CG1-CB 4.19Å; V431-V442 HydrophobicContact CG1-CG2 4.46Å; V431-V442 PolarHBondContact O-N 3.16Å; R433-V442 HydrophobicContact CB-CG2 3.53Å; V442-I499 HydrophobicContact CG1-CB 4.32Å; V442-I499 HydrophobicContact CG1-CG2 3.96Å; V442-I499 WeakPolarHBondContact CG1-O 3.29Å
443	Q	94.5	Very high	90.4	Very high	39 Å²	39	67 Å²	67	18%	0.182	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	159.1	-170.9	-166.8	172.6	0.4	0	0	111.7	V431 L445 D500 L501	V431-Q443 HydrophobicContact CB-CB 4.34Å; V431-Q443 HydrophobicContact CG2-CB 4.13Å; V431-Q443 PolarHBondContact N-O 2.93Å; Q443-L445 HydrophobicContact CG-CD2 4.2Å; Q443-D500 PolarHBondContact NE2-OD1 3.1Å; Q443-L501 PolarHBondContact NE2-O 3.29Å
444	R	95.3	Very high	90.7	Very high	63 Å²	63	62.7 Å²	62.7	24%	0.238	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.9	169.1	-57.1	-175.1	178	-66.9	-8.2	109.3	D392 E394 E428 V429	D392-R444 VanDerWaalsContact CG-NH2 3.28Å; D392-R444 IonicContact OD1-CZ 3.75Å; D392-R444 IonicContact OD1-NH1 2.61Å; D392-R444 IonicContact OD1-NH2 3.03Å; D392-R444 PolarHBondContact OD1-NH2 2.91Å; D392-R444 IonicContact OD2-CZ 3.76Å; D392-R444 IonicContact OD2-NH1 2.66Å; D392-R444 PolarHBondContact OD2-NH1 3.36Å; D392-R444 IonicContact OD2-NH2 2.74Å; D392-R444 PolarHBondContact OD2-NH2 2.87Å; D392-R444 VanDerWaalsContact OD2-NH2 3.15Å; E394-R444 IonicContact OE2-CZ 3.46Å; E394-R444 IonicContact OE2-NE 2.74Å; E394-R444 PolarHBondContact OE2-NE 3.46Å; E394-R444 IonicContact OE2-NH2 3.63Å; E394-R444 PolarHBondContact OE2-NH2 2.96Å; E428-R444 IonicContact OE2-CZ 3.21Å; E428-R444 IonicContact OE2-NH1 3.42Å; E428-R444 PolarHBondContact OE2-NH1 3.49Å; V429-R444 WeakPolarHBondContact O-CA 3.41Å
445	L	96.9	Very high	91.1	Very high	7 Å²	7	59.6 Å²	59.6	4%	0.037	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.7	172.9	-47	175	0	0	0	108.7	E428 V429 Q443 F454 L472 V474 Y493 L501	E428-L445 CarbonylContact C-O 3.47Å; E428-L445 WeakPolarHBondContact CA-O 3.43Å; V429-L445 HydrophobicContact CB-CB 4.22Å; V429-L445 HydrophobicContact CB-CD1 4.33Å; V429-L445 HydrophobicContact CG1-CD1 4.44Å; V429-L445 PolarHBondContact N-O 2.87Å; V429-L445 PolarHBondContact O-N 3.43Å; Q443-L445 HydrophobicContact CG-CD2 4.2Å; L445-F454 HydrophobicContact CB-CE1 4.2Å; L445-F454 HydrophobicContact CB-CZ 4.15Å; L445-F454 WeakPolarHBondContact O-CE1 3.49Å; L445-L472 HydrophobicContact CD1-CD2 4.07Å; L445-V474 HydrophobicContact CD1-CG2 4.46Å; L445-Y493 HydrophobicContact CB-CE1 4.43Å; L445-Y493 HydrophobicContact CD1-CD1 4.09Å; L445-Y493 HydrophobicContact CD1-CD2 3.96Å; L445-Y493 HydrophobicContact CD1-CE1 4.08Å; L445-Y493 HydrophobicContact CD1-CE2 3.93Å; L445-Y493 HydrophobicContact CD1-CG 4.04Å; L445-Y493 HydrophobicContact CD2-CD1 3.98Å; L445-Y493 HydrophobicContact CD2-CE1 3.83Å; L445-Y493 HydrophobicContact CG-CE1 4.34Å; L445-L501 HydrophobicContact CD1-CD1 3.99Å; L445-L501 HydrophobicContact CD2-CB 4.24Å
446	T	93.4	Very high	91.7	Very high	84 Å²	84	57.1 Å²	57.1	52%	0.515	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.8	-173.4	55.1	0	0	0	0	110.8	E428	E428-T446 HydrophobicContact CB-CG2 4.39Å; E428-T446 HydrophobicContact CG-CG2 4.15Å; E428-T446 WeakPolarHBondContact OE1-CG2 3.35Å
447	V	90.9	Very high	92.6	Very high	12 Å²	12	50.7 Å²	50.7	7%	0.073	27%	0.269	C	S	.	.			trans	-135.1	156	174.9	-60	0	0	0	0	111.7	Q449 F454 Y491	V447-Q449 PolarHBondContact O-N 3.21Å; V447-F454 HydrophobicContact CB-CD2 4.36Å; V447-F454 HydrophobicContact CB-CG 4.4Å; V447-F454 HydrophobicContact CG1-CD1 4.34Å; V447-F454 HydrophobicContact CG1-CD2 3.52Å; V447-F454 HydrophobicContact CG1-CE1 4.36Å; V447-F454 HydrophobicContact CG1-CE2 3.55Å; V447-F454 HydrophobicContact CG1-CG 3.94Å; V447-F454 HydrophobicContact CG1-CZ 3.99Å; V447-F454 HydrophobicContact CG2-CB 3.45Å; V447-F454 VanDerWaalsContact CG2-CB 3.45Å; V447-F454 HydrophobicContact CG2-CD1 4.17Å; V447-F454 HydrophobicContact CG2-CD2 3.87Å; V447-F454 HydrophobicContact CG2-CG 3.57Å; V447-Y491 HydrophobicContact CG1-CD1 4.29Å; V447-Y491 HydrophobicContact CG1-CE1 3.84Å; V447-Y491 HydrophobicContact CG1-CE2 4.31Å
448	D	85.3	Confident	93.6	Very high	162 Å²	162	47.2 Å²	47.2	87%	0.866	25%	0.25	S	S	*	.	S	Bend	trans	-85.6	-2.4	-169.6	-52.1	-51.2	0	0	0	115.1
449	Q	88.1	Confident	94.1	Very high	53 Å²	53	41.6 Å²	41.6	25%	0.248	23%	0.227	C	C	.	.			trans	-98	108.5	-176.2	-169	178.2	90.2	0	0	112.7	V447 S452 F479 F480	V447-Q449 PolarHBondContact O-N 3.21Å; Q449-S452 VanDerWaalsContact O-CB 3.27Å; Q449-S452 WeakPolarHBondContact O-CB 3.06Å; Q449-S452 PolarHBondContact O-N 2.86Å; Q449-S452 PolarHBondContact O-OG 3.14Å; Q449-F479 HydrophobicContact CB-CD2 4.34Å; Q449-F479 HydrophobicContact CB-CE2 4.48Å; Q449-F479 VanDerWaalsContact OE1-CA 3.23Å; Q449-F480 PolarHBondContact NE2-O 2.97Å
450	I	87.6	Confident	94.3	Very high	122 Å²	122	41.7 Å²	41.7	63%	0.626	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	138.7	168.6	-165.5	172.6	0	0	0	111.6	H425 M426 S452	H425-I450 HydrophobicContact CB-CD1 3.99Å; H425-I450 HydrophobicContact CB-CG1 3.75Å; H425-I450 WeakPolarHBondContact O-CG1 3.4Å; M426-I450 HydrophobicContact CG-CB 4.25Å; I450-S452 PolarHBondContact O-N 3.38Å
451	G	87.9	Confident	94.5	Very high	43 Å²	43	39.6 Å²	39.6	44%	0.443	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-6.7	-179	0	0	0	0	0	115.2	H425 Y453 M478	H425-G451 PolarHBondContact O-N 2.8Å; G451-Y453 PolarHBondContact O-N 2.88Å; G451-Y453 VanDerWaalsContact O-N 3.14Å; G451-M478 WeakPolarHBondContact O-CB 3.22Å
452	S	95.5	Very high	94.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-65.2	-18.2	-177.2	66.6	0	0	0	0	114.5	M426 Q449 I450 F454 A476 M478 F479	M426-S452 PolarHBondContact O-OG 3.14Å; Q449-S452 VanDerWaalsContact O-CB 3.27Å; Q449-S452 WeakPolarHBondContact O-CB 3.06Å; Q449-S452 PolarHBondContact O-N 2.86Å; Q449-S452 PolarHBondContact O-OG 3.14Å; I450-S452 PolarHBondContact O-N 3.38Å; S452-F454 VanDerWaalsContact C-N 3.32Å; S452-A476 CarbonylContact O-C 3.57Å; S452-A476 VanDerWaalsContact O-C 3.29Å; S452-A476 WeakPolarHBondContact O-CA 3.09Å; S452-M478 CarbonylContact O-C 3.57Å; S452-M478 PolarHBondContact O-N 3.06Å; S452-M478 VanDerWaalsContact O-N 3.12Å; S452-F479 PolarHBondContact O-N 3.39Å
453	Y	97.6	Very high	94.7	Very high	33 Å²	33	36 Å²	36	13%	0.129	20%	0.199	C	C	.	.			trans	61.9	40.3	178.3	-142.3	-124	0	0	0	111.5	Y403 P421 R422 G451 G455 A456 M478	Y403-Y453 HydrophobicContact CD1-CE1 4.42Å; Y403-Y453 AromaticContact CE1-CE1 3.83Å; Y403-Y453 HydrophobicContact CE1-CE1 3.83Å; Y403-Y453 HydrophobicContact CE2-CE1 4.29Å; Y403-Y453 WeakPolarHBondContact CE2-OH 3.47Å; Y403-Y453 AromaticContact CZ-CE1 3.77Å; P421-Y453 HydrophobicContact CB-CD1 4.11Å; P421-Y453 HydrophobicContact CB-CD2 3.8Å; P421-Y453 HydrophobicContact CB-CE1 4.17Å; P421-Y453 HydrophobicContact CB-CE2 3.9Å; P421-Y453 HydrophobicContact CB-CG 3.87Å; P421-Y453 HydrophobicContact CG-CD1 4.49Å; P421-Y453 HydrophobicContact CG-CD2 4.41Å; P421-Y453 HydrophobicContact CG-CE1 4.07Å; P421-Y453 HydrophobicContact CG-CE2 4.02Å; P421-Y453 VanDerWaalsContact O-CD2 3.31Å; P421-Y453 WeakPolarHBondContact O-CD2 3.36Å; R422-Y453 HydrophobicContact CG-CE2 3.85Å; G451-Y453 PolarHBondContact O-N 2.88Å; G451-Y453 VanDerWaalsContact O-N 3.14Å; Y453-G455 PolarHBondContact O-N 3.42Å; Y453-A456 HydrophobicContact CD1-CB 3.43Å; Y453-A456 VanDerWaalsContact CD1-CB 3.43Å; Y453-A456 HydrophobicContact CE1-CB 3.91Å; Y453-A456 HydrophobicContact CG-CB 4.29Å; Y453-A456 WeakPolarHBondContact O-CB 3.34Å; Y453-A456 PolarHBondContact O-N 3.25Å; Y453-A456 VanDerWaalsContact O-N 3.15Å; Y453-M478 HydrophobicContact CD1-CE 4.12Å; Y453-M478 HydrophobicContact CG-CE 4.38Å; Y453-M478 HydrophobicContact CG-SD 4.28Å
454	F	98.5	Very high	94.7	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	130.8	-179.1	173.9	-92.3	0	0	0	111.9	P421 M426 G427 V429 L445 V447 S452 V474 A476 Y491 Y493	P421-F454 VanDerWaalsContact CA-O 3.32Å; P421-F454 WeakPolarHBondContact CA-O 3.31Å; M426-F454 PolarHBondContact O-N 3.09Å; G427-F454 WeakPolarHBondContact CA-O 3.28Å; V429-F454 HydrophobicContact CB-CE1 4.37Å; V429-F454 HydrophobicContact CG2-CD1 4.29Å; V429-F454 HydrophobicContact CG2-CE1 3.74Å; V429-F454 HydrophobicContact CG2-CZ 4.29Å; L445-F454 HydrophobicContact CB-CE1 4.2Å; L445-F454 HydrophobicContact CB-CZ 4.15Å; L445-F454 WeakPolarHBondContact O-CE1 3.49Å; V447-F454 HydrophobicContact CB-CD2 4.36Å; V447-F454 HydrophobicContact CB-CG 4.4Å; V447-F454 HydrophobicContact CG1-CD1 4.34Å; V447-F454 HydrophobicContact CG1-CD2 3.52Å; V447-F454 HydrophobicContact CG1-CE1 4.36Å; V447-F454 HydrophobicContact CG1-CE2 3.55Å; V447-F454 HydrophobicContact CG1-CG 3.94Å; V447-F454 HydrophobicContact CG1-CZ 3.99Å; V447-F454 HydrophobicContact CG2-CB 3.45Å; V447-F454 VanDerWaalsContact CG2-CB 3.45Å; V447-F454 HydrophobicContact CG2-CD1 4.17Å; V447-F454 HydrophobicContact CG2-CD2 3.87Å; V447-F454 HydrophobicContact CG2-CG 3.57Å; S452-F454 VanDerWaalsContact C-N 3.32Å; F454-V474 HydrophobicContact CD1-CG1 4.39Å; F454-V474 HydrophobicContact CD2-CG1 3.84Å; F454-V474 HydrophobicContact CE1-CG1 4.05Å; F454-V474 HydrophobicContact CE2-CB 3.91Å; F454-V474 HydrophobicContact CE2-CG1 3.46Å; F454-V474 VanDerWaalsContact CE2-CG1 3.46Å; F454-V474 HydrophobicContact CG-CG1 4.29Å; F454-V474 HydrophobicContact CZ-CB 4.11Å; F454-V474 HydrophobicContact CZ-CG1 3.58Å; F454-V474 HydrophobicContact CZ-CG2 4.39Å; F454-A476 HydrophobicContact CB-CB 4.02Å; F454-A476 HydrophobicContact CD2-CB 4.2Å; F454-Y491 AromaticContact CD2-CD2 3.77Å; F454-Y491 HydrophobicContact CD2-CD2 3.77Å; F454-Y491 AromaticContact CD2-CE2 3.96Å; F454-Y491 HydrophobicContact CD2-CE2 3.96Å; F454-Y491 HydrophobicContact CD2-CG 4.4Å; F454-Y491 AromaticContact CE2-CD2 3.66Å; F454-Y491 HydrophobicContact CE2-CD2 3.66Å; F454-Y491 HydrophobicContact CE2-CE2 4.24Å; F454-Y491 AromaticContact CE2-CG 3.85Å; F454-Y491 HydrophobicContact CE2-CG 3.85Å; F454-Y493 HydrophobicContact CE2-CE2 4.45Å; F454-Y493 HydrophobicContact CZ-CE2 4.22Å; F454-Y493 WeakPolarHBondContact CZ-OH 3.5Å
455	G	98.1	Very high	94.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	11.4	-171.3	0	0	0	0	0	113.7	S404 G419 Y453 E457 G475	S404-G455 WeakPolarHBondContact CB-O 3.44Å; S404-G455 PolarHBondContact OG-O 2.82Å; G419-G455 WeakPolarHBondContact CA-O 3.14Å; Y453-G455 PolarHBondContact O-N 3.42Å; G455-E457 PolarHBondContact O-N 3.14Å; G455-G475 PolarHBondContact N-O 3.09Å
456	A	98.1	Very high	94.5	Very high	12 Å²	12	42.1 Å²	42.1	10%	0.099	24%	0.244	C	C	.	.	S	Bend	trans	-66.6	-26.9	175.7	0	0	0	0	0	113.8	Y403 P421 Y453 G475 P477	Y403-A456 HydrophobicContact CE1-CB 4.33Å; P421-A456 HydrophobicContact CB-CB 4.39Å; Y453-A456 HydrophobicContact CD1-CB 3.43Å; Y453-A456 VanDerWaalsContact CD1-CB 3.43Å; Y453-A456 HydrophobicContact CE1-CB 3.91Å; Y453-A456 HydrophobicContact CG-CB 4.29Å; Y453-A456 WeakPolarHBondContact O-CB 3.34Å; Y453-A456 PolarHBondContact O-N 3.25Å; Y453-A456 VanDerWaalsContact O-N 3.15Å; A456-G475 PolarHBondContact N-O 3.47Å; A456-P477 HydrophobicContact CB-CG 3.76Å
457	E	98.3	Very high	94.4	Very high	35 Å²	35	40.2 Å²	40.2	16%	0.164	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	143.4	176.2	-176.9	75.1	141.4	0	0	108.6	G455 G475 T518 I519	G455-E457 PolarHBondContact O-N 3.14Å; E457-G475 PolarHBondContact O-N 3.16Å; E457-T518 VanDerWaalsContact OE1-CA 3.3Å; E457-T518 WeakPolarHBondContact OE1-CA 3.4Å; E457-I519 HydrophobicContact CG-CB 4.14Å; E457-I519 HydrophobicContact CG-CD1 4.34Å; E457-I519 HydrophobicContact CG-CG1 3.96Å; E457-I519 PolarHBondContact OE1-N 2.81Å
458	L	98.4	Very high	94.6	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.063	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.2	-179.4	-67.2	175.5	0	0	0	110.3	S404 F417 V429 L472 L473 V474	S404-L458 WeakPolarHBondContact OG-CD1 3.45Å; S404-L458 WeakPolarHBondContact OG-CG 3.36Å; F417-L458 HydrophobicContact CB-CD1 4.02Å; F417-L458 WeakPolarHBondContact O-CD1 3.45Å; V429-L458 HydrophobicContact CG1-CD1 4.21Å; V429-L458 HydrophobicContact CG1-CD2 4Å; V429-L458 HydrophobicContact CG2-CD2 3.81Å; L458-L472 HydrophobicContact CD2-CD1 4.4Å; L458-L473 WeakPolarHBondContact CA-O 3.12Å; L458-V474 HydrophobicContact CD2-CB 4.19Å; L458-V474 HydrophobicContact CD2-CG1 3.9Å; L458-V474 HydrophobicContact CD2-CG2 3.77Å
459	C	97.7	Very high	95.1	Very high	12 Å²	12	33.6 Å²	33.6	8%	0.081	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.2	175.6	-173.8	0	0	0	0	111.1	L473 I519 S521	C459-L473 HydrophobicContact CB-CB 4.3Å; C459-L473 PolarHBondContact N-O 3.26Å; C459-L473 PolarHBondContact O-N 2.66Å; C459-I519 HydrophobicContact CB-CB 3.87Å; C459-I519 HydrophobicContact CB-CG2 3.6Å; C459-S521 PolarHBondContact SG-N 3.12Å
460	S	97	Very high	95.5	Very high	35 Å²	35	32.4 Å²	32.4	25%	0.245	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	125.6	172	45.6	0	0	0	0	109.8	S406 V407	S406-S460 VanDerWaalsContact OG-CB 3.27Å; S406-S460 WeakPolarHBondContact OG-CB 3.4Å; S406-S460 PolarHBondContact OG-N 2.86Å; S406-S460 PolarHBondContact OG-OG 2.82Å; S406-S460 VanDerWaalsContact OG-OG 3.1Å; V407-S460 WeakPolarHBondContact O-CB 3.36Å; V407-S460 PolarHBondContact O-OG 2.83Å
461	V	97.1	Very high	96	Very high	1 Å²	1	27 Å²	27	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.4	177.9	-179.1	0	0	0	0	109.6	I463 D470 F471 L473 V533	V461-I463 HydrophobicContact CG1-CB 4.46Å; V461-I463 HydrophobicContact CG1-CD1 3.86Å; V461-D470 PolarHBondContact O-N 2.81Å; V461-F471 HydrophobicContact CB-CB 4.41Å; V461-F471 PolarHBondContact N-O 3.05Å; V461-F471 PolarHBondContact O-N 2.96Å; V461-L473 HydrophobicContact CB-CD1 4.35Å; V461-L473 HydrophobicContact CG2-CD1 3.78Å; V461-V533 HydrophobicContact CG2-CG2 4.4Å
462	D	96.4	Very high	96.6	Very high	27 Å²	27	24.9 Å²	24.9	14%	0.144	15%	0.151	C	C	.	.			trans	-81.5	112.3	157.7	171	-13.2	0	0	0	105.8	S465 D466 G467 N468 R531	D462-S465 WeakPolarHBondContact OD1-CA 3.27Å; D462-S465 PolarHBondContact OD1-N 2.92Å; D462-D466 PolarHBondContact OD1-N 3.27Å; D462-D466 VanDerWaalsContact OD1-N 3.12Å; D462-G467 VanDerWaalsContact OD2-CA 3.29Å; D462-G467 WeakPolarHBondContact OD2-CA 3.37Å; D462-G467 PolarHBondContact OD2-N 3.41Å; D462-N468 VanDerWaalsContact CA-O 3.23Å; D462-N468 WeakPolarHBondContact CA-O 3.24Å; D462-N468 WeakPolarHBondContact CB-O 3.46Å; D462-R531 WeakPolarHBondContact O-CD 3.23Å
463	I	96.3	Very high	96.7	Very high	4 Å²	4	25 Å²	25	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	-84.4	-34.2	-162.9	-162.8	54.3	0	0	0	113.4	V461 D470 F471 L530 R531 G557	V461-I463 HydrophobicContact CG1-CB 4.46Å; V461-I463 HydrophobicContact CG1-CD1 3.86Å; I463-D470 HydrophobicContact CB-CB 4.5Å; I463-D470 HydrophobicContact CG2-CB 4.2Å; I463-D470 WeakPolarHBondContact CG2-OD2 3.05Å; I463-D470 PolarHBondContact N-OD2 3.11Å; I463-F471 HydrophobicContact CB-CD2 4.16Å; I463-F471 HydrophobicContact CB-CE2 4.03Å; I463-F471 HydrophobicContact CG1-CE2 4.42Å; I463-F471 HydrophobicContact CG2-CE2 4.01Å; I463-L530 HydrophobicContact CD1-CB 4.49Å; I463-L530 HydrophobicContact CG1-CB 4.48Å; I463-L530 HydrophobicContact CG1-CD2 4.41Å; I463-L530 CarbonylContact O-C 3.5Å; I463-L530 VanDerWaalsContact O-CA 3.25Å; I463-L530 WeakPolarHBondContact O-CA 3.28Å; I463-R531 WeakPolarHBondContact CD1-O 3.43Å; I463-R531 PolarHBondContact O-N 3.11Å; I463-G557 WeakPolarHBondContact CD1-O 3.31Å
464	D	94.4	Very high	96.8	Very high	59 Å²	59	23.4 Å²	23.4	32%	0.316	15%	0.146	S	C	.	.	S	Bend	trans	-115	15.8	179.8	57.6	15.5	0	0	0	113.9	L530 K554	D464-L530 HydrophobicContact CB-CD2 4.1Å; D464-K554 WeakPolarHBondContact OD2-CE 3Å; D464-K554 IonicContact OD2-NZ 2.69Å; D464-K554 PolarHBondContact OD2-NZ 3.16Å
465	S	94.3	Very high	96.7	Very high	77 Å²	77	23.4 Å²	23.4	54%	0.538	15%	0.146	S	C	.	.	S	Bend	trans	62.5	36	172.8	-53.6	0	0	0	0	114	D462 G467	D462-S465 WeakPolarHBondContact OD1-CA 3.27Å; D462-S465 PolarHBondContact OD1-N 2.92Å; S465-G467 VanDerWaalsContact C-N 3.34Å
466	D	93.7	Very high	96.7	Very high	101 Å²	101	23.4 Å²	23.4	54%	0.54	15%	0.146	S	C	.	.	S	Bend	trans	-83.2	-10.3	179.7	104.9	-33.6	0	0	0	113.5	D462 N468	D462-D466 PolarHBondContact OD1-N 3.27Å; D462-D466 VanDerWaalsContact OD1-N 3.12Å; D466-N468 VanDerWaalsContact CG-ND2 3.26Å; D466-N468 WeakPolarHBondContact OD1-CA 3.41Å; D466-N468 WeakPolarHBondContact OD1-CB 3.2Å; D466-N468 PolarHBondContact OD1-N 2.99Å; D466-N468 PolarHBondContact OD1-ND2 2.87Å; D466-N468 PolarHBondContact OD2-ND2 2.88Å
467	G	91.9	Very high	96.7	Very high	44 Å²	44	23.2 Å²	23.2	45%	0.454	14%	0.143	S	C	.	.	S	Bend	trans	100	-5.1	-176.9	0	0	0	0	0	114.2	D462 S465	D462-G467 VanDerWaalsContact OD2-CA 3.29Å; D462-G467 WeakPolarHBondContact OD2-CA 3.37Å; D462-G467 PolarHBondContact OD2-N 3.41Å; S465-G467 VanDerWaalsContact C-N 3.34Å
468	N	95	Very high	96.6	Very high	25 Å²	25	25 Å²	25	13%	0.134	15%	0.153	C	C	.	.	S	Bend	trans	-101.6	142.8	171.3	-59.3	-82.5	0	0	0	110.9	E409 R410 N411 D462 D466	E409-N468 CarbonylContact O-C 3.57Å; E409-N468 WeakPolarHBondContact O-CA 3.46Å; R410-N468 WeakPolarHBondContact CA-OD1 3.28Å; N411-N468 PolarHBondContact N-OD1 2.78Å; D462-N468 VanDerWaalsContact CA-O 3.23Å; D462-N468 WeakPolarHBondContact CA-O 3.24Å; D462-N468 WeakPolarHBondContact CB-O 3.46Å; D466-N468 VanDerWaalsContact CG-ND2 3.26Å; D466-N468 WeakPolarHBondContact OD1-CA 3.41Å; D466-N468 WeakPolarHBondContact OD1-CB 3.2Å; D466-N468 PolarHBondContact OD1-N 2.99Å; D466-N468 PolarHBondContact OD1-ND2 2.87Å; D466-N468 PolarHBondContact OD2-ND2 2.88Å
469	T	96.5	Very high	96.4	Very high	11 Å²	11	25.1 Å²	25.1	7%	0.067	15%	0.153	C	C	.	.			trans	-73.6	130.4	164.8	-53	0	0	0	0	109.6	G408 E409 R410 F471	G408-T469 WeakPolarHBondContact CA-OG1 3.44Å; E409-T469 PolarHBondContact N-OG1 2.61Å; E409-T469 PolarHBondContact O-N 3.24Å; R410-T469 WeakPolarHBondContact CD-O 3.46Å; R410-T469 PolarHBondContact NH1-O 2.89Å; T469-F471 WeakPolarHBondContact CG2-O 3.48Å
470	D	96.4	Very high	96.1	Very high	27 Å²	27	28.9 Å²	28.9	14%	0.144	17%	0.168	C	C	.	.			trans	-105.1	-27.2	174.5	-60.4	-68.2	0	0	0	112.3	R410 V461 I463 A494 L495	R410-D470 IonicContact CZ-OD1 3.76Å; R410-D470 IonicContact NH1-OD1 2.64Å; R410-D470 PolarHBondContact NH1-OD1 3.3Å; R410-D470 IonicContact NH2-OD1 2.8Å; V461-D470 PolarHBondContact O-N 2.81Å; I463-D470 HydrophobicContact CB-CB 4.5Å; I463-D470 HydrophobicContact CG2-CB 4.2Å; I463-D470 WeakPolarHBondContact CG2-OD2 3.05Å; I463-D470 PolarHBondContact N-OD2 3.11Å; D470-A494 CarbonylContact O-C 3.49Å; D470-A494 WeakPolarHBondContact O-CA 3.37Å; D470-L495 PolarHBondContact O-N 2.82Å
471	F	98.1	Very high	95.7	Very high	8 Å²	8	29 Å²	29	4%	0.035	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144	-177.3	-57.2	-86.3	0	0	0	113	V461 I463 T469 L473 V492 Y493 A494 V504 K554 G557	V461-F471 HydrophobicContact CB-CB 4.41Å; V461-F471 PolarHBondContact N-O 3.05Å; V461-F471 PolarHBondContact O-N 2.96Å; I463-F471 HydrophobicContact CB-CD2 4.16Å; I463-F471 HydrophobicContact CB-CE2 4.03Å; I463-F471 HydrophobicContact CG1-CE2 4.42Å; I463-F471 HydrophobicContact CG2-CE2 4.01Å; T469-F471 WeakPolarHBondContact CG2-O 3.48Å; F471-L473 HydrophobicContact CB-CD1 3.98Å; F471-V492 HydrophobicContact CB-CG1 4.21Å; F471-V492 HydrophobicContact CD1-CG1 3.96Å; F471-V492 HydrophobicContact CG-CG1 4.37Å; F471-Y493 CarbonylContact C-O 3.58Å; F471-Y493 WeakPolarHBondContact CA-O 3.46Å; F471-A494 HydrophobicContact CD1-CB 3.92Å; F471-A494 HydrophobicContact CE1-CB 3.62Å; F471-V504 HydrophobicContact CD1-CG2 4.26Å; F471-V504 HydrophobicContact CE1-CG2 4.11Å; F471-K554 WeakPolarHBondContact CZ-O 3.49Å; F471-G557 VanDerWaalsContact CD2-CA 3.4Å; F471-G557 VanDerWaalsContact CE2-CA 3.48Å
472	L	98.5	Very high	95	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.1	163.1	-179.5	68.2	0	0	0	108.8	F417 V429 L445 L458 V474 Y493 L501	F417-L472 HydrophobicContact CB-CD1 4.09Å; F417-L472 HydrophobicContact CB-CD2 4.17Å; F417-L472 HydrophobicContact CD1-CD1 4.32Å; F417-L472 HydrophobicContact CD1-CD2 3.7Å; F417-L472 HydrophobicContact CD2-CD1 3.75Å; F417-L472 HydrophobicContact CE1-CD2 4.22Å; F417-L472 HydrophobicContact CE2-CD1 4.23Å; F417-L472 HydrophobicContact CG-CD1 3.79Å; F417-L472 HydrophobicContact CG-CD2 3.91Å; F417-L472 HydrophobicContact CG-CG 4.47Å; V429-L472 HydrophobicContact CG1-CD2 4.37Å; L445-L472 HydrophobicContact CD1-CD2 4.07Å; L458-L472 HydrophobicContact CD2-CD1 4.4Å; L472-V474 HydrophobicContact CD2-CG2 4.07Å; L472-V474 HydrophobicContact CG-CG2 4.03Å; L472-Y493 PolarHBondContact N-O 3.22Å; L472-Y493 PolarHBondContact O-N 3.05Å; L472-L501 HydrophobicContact CB-CD1 4.41Å; L472-L501 HydrophobicContact CB-CD2 4.11Å; L472-L501 HydrophobicContact CD2-CD1 3.85Å
473	L	98.5	Very high	94.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.2	172.2	-75.6	68.1	0	0	0	108.7	L458 C459 V461 F471 I490 Y491 V492 I519 V533 M558	L458-L473 WeakPolarHBondContact CA-O 3.12Å; C459-L473 HydrophobicContact CB-CB 4.3Å; C459-L473 PolarHBondContact N-O 3.26Å; C459-L473 PolarHBondContact O-N 2.66Å; V461-L473 HydrophobicContact CB-CD1 4.35Å; V461-L473 HydrophobicContact CG2-CD1 3.78Å; F471-L473 HydrophobicContact CB-CD1 3.98Å; L473-I490 HydrophobicContact CB-CG2 4.21Å; L473-I490 HydrophobicContact CD2-CG2 4.49Å; L473-I490 HydrophobicContact CG-CG2 4.37Å; L473-Y491 WeakPolarHBondContact CA-O 3.39Å; L473-V492 HydrophobicContact CD1-CG1 3.88Å; L473-V492 HydrophobicContact CG-CG1 4.16Å; L473-V492 HydrophobicContact CG-CG2 4.26Å; L473-I519 HydrophobicContact CB-CD1 4.26Å; L473-I519 HydrophobicContact CB-CG2 4.1Å; L473-I519 HydrophobicContact CD2-CG2 3.8Å; L473-V533 HydrophobicContact CD2-CG1 3.68Å; L473-V533 HydrophobicContact CD2-CG2 4.08Å; L473-M558 HydrophobicContact CD2-SD 3.89Å
474	V	98.7	Very high	93.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.6	-177.5	-174	0	0	0	0	110.2	V429 L445 F454 L458 L472 I490 Y491 Y493	V429-V474 HydrophobicContact CG2-CG1 3.68Å; V429-V474 HydrophobicContact CG2-CG2 4.3Å; L445-V474 HydrophobicContact CD1-CG2 4.46Å; F454-V474 HydrophobicContact CD1-CG1 4.39Å; F454-V474 HydrophobicContact CD2-CG1 3.84Å; F454-V474 HydrophobicContact CE1-CG1 4.05Å; F454-V474 HydrophobicContact CE2-CB 3.91Å; F454-V474 HydrophobicContact CE2-CG1 3.46Å; F454-V474 VanDerWaalsContact CE2-CG1 3.46Å; F454-V474 HydrophobicContact CG-CG1 4.29Å; F454-V474 HydrophobicContact CZ-CB 4.11Å; F454-V474 HydrophobicContact CZ-CG1 3.58Å; F454-V474 HydrophobicContact CZ-CG2 4.39Å; L458-V474 HydrophobicContact CD2-CB 4.19Å; L458-V474 HydrophobicContact CD2-CG1 3.9Å; L458-V474 HydrophobicContact CD2-CG2 3.77Å; L472-V474 HydrophobicContact CD2-CG2 4.07Å; L472-V474 HydrophobicContact CG-CG2 4.03Å; V474-I490 WeakPolarHBondContact O-CA 3.35Å; V474-Y491 PolarHBondContact N-O 2.81Å; V474-Y491 PolarHBondContact O-N 2.87Å; V474-Y493 HydrophobicContact CB-CE2 4.28Å; V474-Y493 HydrophobicContact CG2-CD2 3.91Å; V474-Y493 HydrophobicContact CG2-CE2 3.79Å
475	G	98.3	Very high	93.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	135.6	175.4	0	0	0	0	0	112.7	G455 A456 E457	G455-G475 PolarHBondContact N-O 3.09Å; A456-G475 PolarHBondContact N-O 3.47Å; E457-G475 PolarHBondContact O-N 3.16Å
476	A	97.8	Very high	93	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	75.5	164.2	0	0	0	0	0	108.5	S452 F454 M478 F479 S489 Y491	S452-A476 CarbonylContact O-C 3.57Å; S452-A476 VanDerWaalsContact O-C 3.29Å; S452-A476 WeakPolarHBondContact O-CA 3.09Å; F454-A476 HydrophobicContact CB-CB 4.02Å; F454-A476 HydrophobicContact CD2-CB 4.2Å; A476-M478 VanDerWaalsContact C-N 3.26Å; A476-M478 PolarHBondContact O-N 2.59Å; A476-F479 HydrophobicContact CB-CB 4.16Å; A476-F479 WeakPolarHBondContact O-CB 3.14Å; A476-F479 PolarHBondContact O-N 2.66Å; A476-F479 VanDerWaalsContact O-N 3.11Å; A476-S489 PolarHBondContact N-O 2.97Å; A476-S489 PolarHBondContact O-N 2.93Å; A476-S489 VanDerWaalsContact O-N 3.11Å; A476-Y491 HydrophobicContact CB-CE2 4.01Å
477	P	97.2	Very high	93	Very high	8 Å²	8	47 Å²	47	5%	0.052	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	-17.9	-167.9	26	-34.7	0	0	0	114.4	A456 G488 R514 T517	A456-P477 HydrophobicContact CB-CG 3.76Å; P477-G488 WeakPolarHBondContact O-CA 3.25Å; P477-R514 HydrophobicContact CB-CB 4.19Å; P477-R514 WeakPolarHBondContact O-CA 3.39Å; P477-R514 WeakPolarHBondContact O-CB 3.47Å; P477-R514 WeakPolarHBondContact O-CG 3.44Å; P477-T517 WeakPolarHBondContact CB-OG1 3.34Å
478	M	95.7	Very high	93.1	Very high	73 Å²	73	44.9 Å²	44.9	36%	0.36	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	7.5	175.7	-59.1	-171.1	-167.7	0	0	112.4	G451 S452 Y453 A476 F480	G451-M478 WeakPolarHBondContact O-CB 3.22Å; S452-M478 CarbonylContact O-C 3.57Å; S452-M478 PolarHBondContact O-N 3.06Å; S452-M478 VanDerWaalsContact O-N 3.12Å; Y453-M478 HydrophobicContact CD1-CE 4.12Å; Y453-M478 HydrophobicContact CG-CE 4.38Å; Y453-M478 HydrophobicContact CG-SD 4.28Å; A476-M478 VanDerWaalsContact C-N 3.26Å; A476-M478 PolarHBondContact O-N 2.59Å; M478-F480 PolarHBondContact O-N 2.92Å
479	F	95.2	Very high	93.2	Very high	14 Å²	14	43.7 Å²	43.7	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	133	171.8	174.8	-95	0	0	0	110.4	Q449 S452 A476 L481 E487 G488 S489 K508	Q449-F479 HydrophobicContact CB-CD2 4.34Å; Q449-F479 HydrophobicContact CB-CE2 4.48Å; Q449-F479 VanDerWaalsContact OE1-CA 3.23Å; S452-F479 PolarHBondContact O-N 3.39Å; A476-F479 HydrophobicContact CB-CB 4.16Å; A476-F479 WeakPolarHBondContact O-CB 3.14Å; A476-F479 PolarHBondContact O-N 2.66Å; A476-F479 VanDerWaalsContact O-N 3.11Å; F479-L481 HydrophobicContact CE1-CD1 3.63Å; F479-L481 HydrophobicContact CE1-CD2 4.3Å; F479-L481 HydrophobicContact CE1-CG 3.61Å; F479-L481 HydrophobicContact CZ-CD1 3.96Å; F479-L481 HydrophobicContact CZ-CD2 4Å; F479-L481 HydrophobicContact CZ-CG 3.84Å; F479-E487 CarbonylContact O-C 3.57Å; F479-E487 WeakPolarHBondContact O-CA 3.3Å; F479-G488 PolarHBondContact O-N 2.75Å; F479-S489 WeakPolarHBondContact CB-OG 3.32Å; F479-S489 WeakPolarHBondContact CD1-OG 3.4Å; F479-S489 WeakPolarHBondContact CG-OG 3.31Å; F479-K508 HydrophobicContact CE1-CD 4.16Å; F479-K508 HydrophobicContact CE1-CG 4.47Å
480	F	91.3	Very high	93.2	Very high	91 Å²	91	43.2 Å²	43.2	40%	0.399	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.3	-171.4	-176.4	-125.7	0	0	0	112.8	Q449 M478 P482 K486 M512	Q449-F480 PolarHBondContact NE2-O 2.97Å; M478-F480 PolarHBondContact O-N 2.92Å; F480-P482 HydrophobicContact CE1-CB 3.68Å; F480-P482 HydrophobicContact CE1-CG 4.19Å; F480-P482 HydrophobicContact CZ-CB 3.79Å; F480-K486 WeakPolarHBondContact CD2-O 3.47Å; F480-M512 HydrophobicContact CE2-CE 3.81Å; F480-M512 HydrophobicContact CE2-SD 4.49Å
481	L	88.3	Confident	93.2	Very high	39 Å²	39	43 Å²	43	20%	0.204	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	102.4	169.8	-67.8	172.1	0	0	0	109.5	F479 E483 E484 R485 K486 K508	F479-L481 HydrophobicContact CE1-CD1 3.63Å; F479-L481 HydrophobicContact CE1-CD2 4.3Å; F479-L481 HydrophobicContact CE1-CG 3.61Å; F479-L481 HydrophobicContact CZ-CD1 3.96Å; F479-L481 HydrophobicContact CZ-CD2 4Å; F479-L481 HydrophobicContact CZ-CG 3.84Å; L481-E483 PolarHBondContact O-N 3.28Å; L481-E484 HydrophobicContact CB-CB 4.4Å; L481-R485 PolarHBondContact O-N 2.73Å; L481-K486 HydrophobicContact CB-CB 4.37Å; L481-K486 PolarHBondContact N-O 3.16Å; L481-K486 PolarHBondContact O-N 3.46Å; L481-K486 VanDerWaalsContact O-N 3.16Å; L481-K508 HydrophobicContact CD1-CD 3.89Å
482	P	82.6	Confident	93.2	Very high	88 Å²	88	42.7 Å²	42.7	57%	0.571	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-36.5	-173.4	23.2	-32.2	0	0	0	113.5	F480 R485	F480-P482 HydrophobicContact CE1-CB 3.68Å; F480-P482 HydrophobicContact CE1-CG 4.19Å; F480-P482 HydrophobicContact CZ-CB 3.79Å; P482-R485 PolarHBondContact O-N 3.29Å
483	E	84.5	Confident	93.2	Very high	191 Å²	191	43.5 Å²	43.5	89%	0.893	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-39.4	-177.6	-59.8	-172	168.5	0	0	112.3	L481	L481-E483 PolarHBondContact O-N 3.28Å
484	E	81.9	Confident	93.1	Very high	103 Å²	103	44.6 Å²	44.6	48%	0.481	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.9	178.8	-63	-172.5	-110.9	0	0	113.4	L481 K486	L481-E484 HydrophobicContact CB-CB 4.4Å; E484-K486 HydrophobicContact CB-CD 3.85Å; E484-K486 HydrophobicContact CB-CG 3.88Å; E484-K486 VanDerWaalsContact OE2-CE 3.3Å; E484-K486 WeakPolarHBondContact OE2-CE 3.5Å; E484-K486 IonicContact OE2-NZ 2.72Å; E484-K486 PolarHBondContact OE2-NZ 2.95Å
485	R	84.4	Confident	92.9	Very high	189 Å²	189	45 Å²	45	71%	0.713	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	53.8	-168.9	-62	-177.2	176.3	-175.8	-2.5	112.9	L481 P482 S511 M512	L481-R485 PolarHBondContact O-N 2.73Å; P482-R485 PolarHBondContact O-N 3.29Å; R485-S511 CarbonylContact O-C 3.59Å; R485-M512 HydrophobicContact CB-CG 4.27Å; R485-M512 HydrophobicContact CB-SD 4.21Å; R485-M512 WeakPolarHBondContact O-CG 3.45Å
486	K	88.1	Confident	92.6	Very high	42 Å²	42	47.1 Å²	47.1	18%	0.183	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.7	177.4	-62.5	177.8	172.3	170.5	0	111	F480 L481 E484 K508 A509 S511	F480-K486 WeakPolarHBondContact CD2-O 3.47Å; L481-K486 HydrophobicContact CB-CB 4.37Å; L481-K486 PolarHBondContact N-O 3.16Å; L481-K486 PolarHBondContact O-N 3.46Å; L481-K486 VanDerWaalsContact O-N 3.16Å; E484-K486 HydrophobicContact CB-CD 3.85Å; E484-K486 HydrophobicContact CB-CG 3.88Å; E484-K486 VanDerWaalsContact OE2-CE 3.3Å; E484-K486 WeakPolarHBondContact OE2-CE 3.5Å; E484-K486 IonicContact OE2-NZ 2.72Å; E484-K486 PolarHBondContact OE2-NZ 2.95Å; K486-K508 HydrophobicContact CD-CB 4.39Å; K486-A509 WeakPolarHBondContact CD-O 3.11Å; K486-A509 WeakPolarHBondContact CE-O 3.23Å; K486-A509 VanDerWaalsContact CG-O 3.24Å; K486-A509 WeakPolarHBondContact CG-O 3.49Å; K486-S511 WeakPolarHBondContact CA-O 3.3Å
487	E	93.3	Very high	92	Very high	33 Å²	33	52.1 Å²	52.1	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.3	174.1	-169.7	-166.9	-171.8	0	0	110.2	F479 S511 M512 R514 F515	F479-E487 CarbonylContact O-C 3.57Å; F479-E487 WeakPolarHBondContact O-CA 3.3Å; E487-S511 PolarHBondContact N-O 3.16Å; E487-M512 HydrophobicContact CB-CB 4.18Å; E487-M512 HydrophobicContact CB-CG 4.37Å; E487-R514 HydrophobicContact CG-CG 4.02Å; E487-R514 WeakPolarHBondContact O-CA 3.27Å; E487-R514 PolarHBondContact O-N 2.73Å; E487-R514 WeakPolarHBondContact OE1-CG 3.21Å; E487-R514 IonicContact OE1-CZ 2.65Å; E487-R514 IonicContact OE1-NE 2.9Å; E487-R514 PolarHBondContact OE1-NE 2.98Å; E487-R514 IonicContact OE1-NH2 2.65Å; E487-F515 PolarHBondContact O-N 3.09Å
488	G	95.4	Very high	91.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.4	148.3	-176.5	0	0	0	0	0	114	P477 F479 F515	P477-G488 WeakPolarHBondContact O-CA 3.25Å; F479-G488 PolarHBondContact O-N 2.75Å; G488-F515 CarbonylContact C-O 3.07Å; G488-F515 VanDerWaalsContact C-O 3.3Å; G488-F515 WeakPolarHBondContact CA-O 3.18Å
489	S	95.8	Very high	91	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	159.2	177.3	59.5	0	0	0	0	111.7	A476 F479 Y491 V507 F515	A476-S489 PolarHBondContact N-O 2.97Å; A476-S489 PolarHBondContact O-N 2.93Å; A476-S489 VanDerWaalsContact O-N 3.11Å; F479-S489 WeakPolarHBondContact CB-OG 3.32Å; F479-S489 WeakPolarHBondContact CD1-OG 3.4Å; F479-S489 WeakPolarHBondContact CG-OG 3.31Å; S489-Y491 WeakPolarHBondContact OG-CE2 3.49Å; S489-V507 WeakPolarHBondContact CA-O 3.21Å; S489-F515 PolarHBondContact N-O 3.12Å; S489-F515 VanDerWaalsContact N-O 3.15Å
490	I	97.1	Very high	90.8	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.9	171.9	-65.9	176.5	0	0	0	109.4	L473 V474 V492 H506 V507 F515 I519 V535	L473-I490 HydrophobicContact CB-CG2 4.21Å; L473-I490 HydrophobicContact CD2-CG2 4.49Å; L473-I490 HydrophobicContact CG-CG2 4.37Å; V474-I490 WeakPolarHBondContact O-CA 3.35Å; I490-V492 HydrophobicContact CG2-CG2 4.31Å; I490-H506 CarbonylContact O-C 3.32Å; I490-H506 WeakPolarHBondContact O-CA 3.46Å; I490-V507 PolarHBondContact N-O 2.92Å; I490-V507 PolarHBondContact O-N 2.84Å; I490-F515 HydrophobicContact CB-CE1 4.42Å; I490-F515 HydrophobicContact CD1-CE1 3.95Å; I490-F515 HydrophobicContact CD1-CZ 4.14Å; I490-F515 HydrophobicContact CG1-CD1 4.45Å; I490-F515 HydrophobicContact CG1-CE1 3.97Å; I490-I519 HydrophobicContact CD1-CD1 3.64Å; I490-I519 HydrophobicContact CD1-CG1 3.72Å; I490-I519 HydrophobicContact CG1-CD1 3.79Å; I490-I519 HydrophobicContact CG1-CG1 4.33Å; I490-I519 HydrophobicContact CG2-CD1 4.18Å; I490-V535 HydrophobicContact CD1-CB 4.1Å; I490-V535 HydrophobicContact CD1-CG1 3.48Å; I490-V535 VanDerWaalsContact CD1-CG1 3.48Å; I490-V535 HydrophobicContact CD1-CG2 3.43Å; I490-V535 VanDerWaalsContact CD1-CG2 3.43Å
491	Y	97.6	Very high	90.9	Very high	24 Å²	24	56.9 Å²	56.9	9%	0.094	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.5	171.9	-61.6	-104.7	0	0	0	108.3	V447 F454 L473 V474 A476 S489 H506	V447-Y491 HydrophobicContact CG1-CD1 4.29Å; V447-Y491 HydrophobicContact CG1-CE1 3.84Å; V447-Y491 HydrophobicContact CG1-CE2 4.31Å; F454-Y491 AromaticContact CD2-CD2 3.77Å; F454-Y491 HydrophobicContact CD2-CD2 3.77Å; F454-Y491 AromaticContact CD2-CE2 3.96Å; F454-Y491 HydrophobicContact CD2-CE2 3.96Å; F454-Y491 HydrophobicContact CD2-CG 4.4Å; F454-Y491 AromaticContact CE2-CD2 3.66Å; F454-Y491 HydrophobicContact CE2-CD2 3.66Å; F454-Y491 HydrophobicContact CE2-CE2 4.24Å; F454-Y491 AromaticContact CE2-CG 3.85Å; F454-Y491 HydrophobicContact CE2-CG 3.85Å; L473-Y491 WeakPolarHBondContact CA-O 3.39Å; V474-Y491 PolarHBondContact N-O 2.81Å; V474-Y491 PolarHBondContact O-N 2.87Å; A476-Y491 HydrophobicContact CB-CE2 4.01Å; S489-Y491 WeakPolarHBondContact OG-CE2 3.49Å; Y491-H506 AromaticContact CD1-ND1 3.99Å; Y491-H506 AromaticContact CE1-CE1 3.48Å; Y491-H506 VanDerWaalsContact CE1-CE1 3.48Å; Y491-H506 WeakPolarHBondContact CE1-CE1 3.49Å; Y491-H506 AromaticContact CE1-ND1 3.4Å; Y491-H506 WeakPolarHBondContact CE1-ND1 3.4Å; Y491-H506 AromaticContact CZ-CE1 3.35Å; Y491-H506 AromaticContact CZ-ND1 3.79Å; Y491-H506 AromaticContact CZ-NE2 3.79Å; Y491-H506 PolarHBondContact OH-CE1 3.43Å
492	V	98.1	Very high	91.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.7	179.2	-165.1	0	0	0	0	108.9	F471 L473 I490 V504 L505 T556 M558	F471-V492 HydrophobicContact CB-CG1 4.21Å; F471-V492 HydrophobicContact CD1-CG1 3.96Å; F471-V492 HydrophobicContact CG-CG1 4.37Å; L473-V492 HydrophobicContact CD1-CG1 3.88Å; L473-V492 HydrophobicContact CG-CG1 4.16Å; L473-V492 HydrophobicContact CG-CG2 4.26Å; I490-V492 HydrophobicContact CG2-CG2 4.31Å; V492-V504 HydrophobicContact CB-CG2 4.28Å; V492-V504 HydrophobicContact CG1-CG2 4.21Å; V492-V504 WeakPolarHBondContact O-CG2 3.48Å; V492-V504 PolarHBondContact O-N 3.21Å; V492-L505 HydrophobicContact CB-CB 4.01Å; V492-L505 HydrophobicContact CG2-CB 3.95Å; V492-L505 HydrophobicContact CG2-CD2 4.34Å; V492-L505 HydrophobicContact CG2-CG 4.39Å; V492-L505 PolarHBondContact N-O 2.79Å; V492-L505 PolarHBondContact O-N 3.36Å; V492-T556 WeakPolarHBondContact CG1-O 3.46Å; V492-M558 HydrophobicContact CG2-CG 4.22Å; V492-M558 HydrophobicContact CG2-SD 3.75Å
493	Y	97.6	Very high	91.6	Very high	17 Å²	17	59.1 Å²	59.1	7%	0.067	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.3	179.2	-62.8	-96.9	0	0	0	110	L445 F454 F471 L472 V474 M502	L445-Y493 HydrophobicContact CB-CE1 4.43Å; L445-Y493 HydrophobicContact CD1-CD1 4.09Å; L445-Y493 HydrophobicContact CD1-CD2 3.96Å; L445-Y493 HydrophobicContact CD1-CE1 4.08Å; L445-Y493 HydrophobicContact CD1-CE2 3.93Å; L445-Y493 HydrophobicContact CD1-CG 4.04Å; L445-Y493 HydrophobicContact CD2-CD1 3.98Å; L445-Y493 HydrophobicContact CD2-CE1 3.83Å; L445-Y493 HydrophobicContact CG-CE1 4.34Å; F454-Y493 HydrophobicContact CE2-CE2 4.45Å; F454-Y493 HydrophobicContact CZ-CE2 4.22Å; F454-Y493 WeakPolarHBondContact CZ-OH 3.5Å; F471-Y493 CarbonylContact C-O 3.58Å; F471-Y493 WeakPolarHBondContact CA-O 3.46Å; L472-Y493 PolarHBondContact N-O 3.22Å; L472-Y493 PolarHBondContact O-N 3.05Å; V474-Y493 HydrophobicContact CB-CE2 4.28Å; V474-Y493 HydrophobicContact CG2-CD2 3.91Å; V474-Y493 HydrophobicContact CG2-CE2 3.79Å; Y493-M502 CarbonylContact C-O 3.58Å; Y493-M502 VanDerWaalsContact CA-O 3.29Å; Y493-M502 WeakPolarHBondContact CA-O 3.47Å
494	A	96.1	Very high	92	Very high	24 Å²	24	52.9 Å²	52.9	20%	0.198	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	130.8	173.4	0	0	0	0	0	110.7	D470 F471 L501 M502 V504	D470-A494 CarbonylContact O-C 3.49Å; D470-A494 WeakPolarHBondContact O-CA 3.37Å; F471-A494 HydrophobicContact CD1-CB 3.92Å; F471-A494 HydrophobicContact CE1-CB 3.62Å; A494-L501 WeakPolarHBondContact O-CA 3.45Å; A494-M502 PolarHBondContact N-O 2.79Å; A494-M502 PolarHBondContact O-N 2.85Å; A494-V504 HydrophobicContact CB-CG1 3.7Å; A494-V504 HydrophobicContact CB-CG2 4.19Å
495	L	95.1	Very high	92.5	Very high	9 Å²	9	49.5 Å²	49.5	5%	0.047	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	109.9	179.7	-177.2	58.5	0	0	0	110.5	R410 L415 D470 I499 L501	R410-L495 HydrophobicContact CB-CD2 4.15Å; R410-L495 HydrophobicContact CG-CD2 4.43Å; R410-L495 HydrophobicContact CG-CG 4.5Å; L415-L495 HydrophobicContact CD1-CD1 4.32Å; L415-L495 HydrophobicContact CD1-CD2 3.58Å; D470-L495 PolarHBondContact O-N 2.82Å; L495-I499 HydrophobicContact CD1-CG2 4.22Å; L495-L501 HydrophobicContact CB-CD2 3.69Å; L495-L501 HydrophobicContact CD1-CD2 3.8Å; L495-L501 HydrophobicContact CD1-CG 3.98Å; L495-L501 HydrophobicContact CG-CD2 4.28Å
496	S	91	Very high	93	Very high	45 Å²	45	43.9 Å²	43.9	32%	0.315	23%	0.229	S	C	.	.			trans	-78.2	161.5	175.8	66.1	0	0	0	0	112.8	K498 I499 D500	S496-K498 PolarHBondContact O-N 3.01Å; S496-I499 WeakPolarHBondContact O-CA 3.3Å; S496-I499 PolarHBondContact O-N 2.87Å; S496-D500 PolarHBondContact N-O 3.02Å; S496-D500 WeakPolarHBondContact OG-CB 3.14Å; S496-D500 PolarHBondContact OG-N 3.47Å; S496-D500 PolarHBondContact OG-O 3.41Å
497	D	85	Confident	93.2	Very high	105 Å²	105	42.1 Å²	42.1	56%	0.561	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	177.4	-52.9	-43.2	0	0	0	114.4	R410 I499	R410-D497 IonicContact CZ-OD1 3.72Å; R410-D497 IonicContact NE-OD1 3.65Å; R410-D497 PolarHBondContact NE-OD1 2.75Å; R410-D497 IonicContact NH2-OD1 2.7Å; R410-D497 PolarHBondContact NH2-OD1 2.99Å; D497-I499 VanDerWaalsContact C-N 3.25Å
498	K	86.1	Confident	93	Very high	191 Å²	191	44 Å²	44	83%	0.83	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	0.3	174.2	-64.7	-177.8	-177.7	174.1	0	113.2	S496	S496-K498 PolarHBondContact O-N 3.01Å
499	I	87.6	Confident	92.2	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.108	23%	0.23	C	C	.	.	S	Bend	trans	62.8	47	-173.8	-40.2	176.6	0	0	0	110.7	T413 L415 V442 L495 S496 D497	T413-I499 HydrophobicContact CG2-CD1 4.02Å; L415-I499 HydrophobicContact CD1-CG2 3.67Å; L415-I499 HydrophobicContact CD2-CD1 4.35Å; L415-I499 HydrophobicContact CD2-CG2 3.56Å; L415-I499 HydrophobicContact CG-CG2 4.27Å; V442-I499 HydrophobicContact CG1-CB 4.32Å; V442-I499 HydrophobicContact CG1-CG2 3.96Å; V442-I499 WeakPolarHBondContact CG1-O 3.29Å; L495-I499 HydrophobicContact CD1-CG2 4.22Å; S496-I499 WeakPolarHBondContact O-CA 3.3Å; S496-I499 PolarHBondContact O-N 2.87Å; D497-I499 VanDerWaalsContact C-N 3.25Å
500	D	90	Very high	91.3	Very high	68 Å²	68	49 Å²	49	36%	0.364	26%	0.262	S	S	.	.			trans	-122.1	124.1	175.2	-178.3	18.2	0	0	0	108.5	Q443 S496	Q443-D500 PolarHBondContact NE2-OD1 3.1Å; S496-D500 PolarHBondContact N-O 3.02Å; S496-D500 WeakPolarHBondContact OG-CB 3.14Å; S496-D500 PolarHBondContact OG-N 3.47Å; S496-D500 PolarHBondContact OG-O 3.41Å
501	L	93.3	Very high	90.6	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.4	-177.3	-75.7	171.4	0	0	0	111	F417 V431 Q443 L445 L472 A494 L495	F417-L501 HydrophobicContact CD1-CD1 4.47Å; F417-L501 HydrophobicContact CE1-CD1 4.11Å; V431-L501 HydrophobicContact CG2-CD1 3.87Å; Q443-L501 PolarHBondContact NE2-O 3.29Å; L445-L501 HydrophobicContact CD1-CD1 3.99Å; L445-L501 HydrophobicContact CD2-CB 4.24Å; L472-L501 HydrophobicContact CB-CD1 4.41Å; L472-L501 HydrophobicContact CB-CD2 4.11Å; L472-L501 HydrophobicContact CD2-CD1 3.85Å; A494-L501 WeakPolarHBondContact O-CA 3.45Å; L495-L501 HydrophobicContact CB-CD2 3.69Å; L495-L501 HydrophobicContact CD1-CD2 3.8Å; L495-L501 HydrophobicContact CD1-CG 3.98Å; L495-L501 HydrophobicContact CG-CD2 4.28Å
502	M	92.8	Very high	90.1	Very high	102 Å²	102	53.1 Å²	53.1	50%	0.502	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.3	-179.5	-69.6	-66.2	-63.9	0	0	110.7	Y493 A494 V504	Y493-M502 CarbonylContact C-O 3.58Å; Y493-M502 VanDerWaalsContact CA-O 3.29Å; Y493-M502 WeakPolarHBondContact CA-O 3.47Å; A494-M502 PolarHBondContact N-O 2.79Å; A494-M502 PolarHBondContact O-N 2.85Å; M502-V504 PolarHBondContact O-N 2.99Å
503	S	93.6	Very high	89.8	Confident	71 Å²	71	53.1 Å²	53.1	50%	0.497	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	121.7	176.7	-173.8	0	0	0	0	110.8
504	V	93.1	Very high	89.7	Confident	60 Å²	60	56.3 Å²	56.3	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	-26.6	-177.2	-70.4	0	0	0	0	113.6	F471 V492 A494 M502	F471-V504 HydrophobicContact CD1-CG2 4.26Å; F471-V504 HydrophobicContact CE1-CG2 4.11Å; V492-V504 HydrophobicContact CB-CG2 4.28Å; V492-V504 HydrophobicContact CG1-CG2 4.21Å; V492-V504 WeakPolarHBondContact O-CG2 3.48Å; V492-V504 PolarHBondContact O-N 3.21Å; A494-V504 HydrophobicContact CB-CG1 3.7Å; A494-V504 HydrophobicContact CB-CG2 4.19Å; M502-V504 PolarHBondContact O-N 2.99Å
505	L	92.1	Very high	89.7	Confident	33 Å²	33	55.2 Å²	55.2	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	147.7	-178.5	-174.1	64	0	0	0	111.4	V492 V507 M558 N560	V492-L505 HydrophobicContact CB-CB 4.01Å; V492-L505 HydrophobicContact CG2-CB 3.95Å; V492-L505 HydrophobicContact CG2-CD2 4.34Å; V492-L505 HydrophobicContact CG2-CG 4.39Å; V492-L505 PolarHBondContact N-O 2.79Å; V492-L505 PolarHBondContact O-N 3.36Å; L505-V507 HydrophobicContact CD2-CG2 3.65Å; L505-V507 HydrophobicContact CG-CG2 3.77Å; L505-M558 HydrophobicContact CD2-CG 3.83Å; L505-N560 HydrophobicContact CD1-CB 4.03Å; L505-N560 HydrophobicContact CD2-CB 4.39Å
506	H	93.6	Very high	89.8	Confident	70 Å²	70	54.8 Å²	54.8	32%	0.324	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	110.6	172.7	179.7	165.1	0	0	0	107.9	I490 Y491 K508	I490-H506 CarbonylContact O-C 3.32Å; I490-H506 WeakPolarHBondContact O-CA 3.46Å; Y491-H506 AromaticContact CD1-ND1 3.99Å; Y491-H506 AromaticContact CE1-CE1 3.48Å; Y491-H506 VanDerWaalsContact CE1-CE1 3.48Å; Y491-H506 WeakPolarHBondContact CE1-CE1 3.49Å; Y491-H506 AromaticContact CE1-ND1 3.4Å; Y491-H506 WeakPolarHBondContact CE1-ND1 3.4Å; Y491-H506 AromaticContact CZ-CE1 3.35Å; Y491-H506 AromaticContact CZ-ND1 3.79Å; Y491-H506 AromaticContact CZ-NE2 3.79Å; Y491-H506 PolarHBondContact OH-CE1 3.43Å; H506-K508 WeakPolarHBondContact NE2-CE 3.31Å
507	V	92.6	Very high	90.1	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.3	-176.2	-171.8	0	0	0	0	110.3	S489 I490 L505 F515 Y550 M558	S489-V507 WeakPolarHBondContact CA-O 3.21Å; I490-V507 PolarHBondContact N-O 2.92Å; I490-V507 PolarHBondContact O-N 2.84Å; L505-V507 HydrophobicContact CD2-CG2 3.65Å; L505-V507 HydrophobicContact CG-CG2 3.77Å; V507-F515 HydrophobicContact CB-CE1 4.36Å; V507-F515 HydrophobicContact CG1-CE1 3.99Å; V507-F515 HydrophobicContact CG1-CZ 3.89Å; V507-Y550 HydrophobicContact CG1-CE1 3.87Å; V507-M558 HydrophobicContact CG2-CE 4.24Å; V507-M558 HydrophobicContact CG2-SD 3.99Å
508	K	89.7	Confident	90.8	Very high	73 Å²	73	50 Å²	50	32%	0.317	26%	0.258	S	S	.	.			trans	-139.6	129.5	179.9	-59.2	170.6	-176.3	171.4	0	109.1	F479 L481 K486 H506	F479-K508 HydrophobicContact CE1-CD 4.16Å; F479-K508 HydrophobicContact CE1-CG 4.47Å; L481-K508 HydrophobicContact CD1-CD 3.89Å; K486-K508 HydrophobicContact CD-CB 4.39Å; H506-K508 WeakPolarHBondContact NE2-CE 3.31Å
509	A	79.7	Confident	91.3	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.008	22%	0.221	C	C	.	.			trans	-66.5	159.4	173.3	0	0	0	0	0	112.4	K486 S511 F515 Y548	K486-A509 WeakPolarHBondContact CD-O 3.11Å; K486-A509 WeakPolarHBondContact CE-O 3.23Å; K486-A509 VanDerWaalsContact CG-O 3.24Å; K486-A509 WeakPolarHBondContact CG-O 3.49Å; A509-S511 WeakPolarHBondContact CB-OG 3.25Å; A509-S511 PolarHBondContact O-N 3.23Å; A509-F515 HydrophobicContact CB-CB 3.6Å; A509-F515 HydrophobicContact CB-CD1 4.17Å; A509-F515 HydrophobicContact CB-CD2 3.58Å; A509-F515 HydrophobicContact CB-CE2 4.24Å; A509-F515 HydrophobicContact CB-CG 3.52Å; A509-Y548 HydrophobicContact CB-CE2 4.34Å
510	P	76	Confident	91.8	Very high	104 Å²	104	40.9 Å²	40.9	68%	0.675	22%	0.22	S	C	*	.	S	Bend	trans	-80.5	21.1	171.2	35.7	-37.6	0	0	0	113.8
511	S	81.2	Confident	92.1	Very high	14 Å²	14	38.3 Å²	38.3	10%	0.098	21%	0.207	C	C	.	.	S	Bend	trans	-137	162	-164.7	62.4	0	0	0	0	113.6	R485 K486 E487 A509 E540	R485-S511 CarbonylContact O-C 3.59Å; K486-S511 WeakPolarHBondContact CA-O 3.3Å; E487-S511 PolarHBondContact N-O 3.16Å; A509-S511 WeakPolarHBondContact CB-OG 3.25Å; A509-S511 PolarHBondContact O-N 3.23Å; S511-E540 VanDerWaalsContact CB-OE2 3.25Å; S511-E540 WeakPolarHBondContact CB-OE2 3.21Å; S511-E540 PolarHBondContact OG-OE2 2.97Å
512	M	87.3	Confident	92.2	Very high	95 Å²	95	38 Å²	38	47%	0.468	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	110.5	158.3	-62.5	-172.4	63	0	0	108.2	F480 R485 E487	F480-M512 HydrophobicContact CE2-CE 3.81Å; F480-M512 HydrophobicContact CE2-SD 4.49Å; R485-M512 HydrophobicContact CB-CG 4.27Å; R485-M512 HydrophobicContact CB-SD 4.21Å; R485-M512 WeakPolarHBondContact O-CG 3.45Å; E487-M512 HydrophobicContact CB-CB 4.18Å; E487-M512 HydrophobicContact CB-CG 4.37Å
513	G	92.1	Very high	92.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	10.8	-175.9	0	0	0	0	0	115.9	A537 L539	G513-A537 CarbonylContact O-C 3.5Å; G513-A537 VanDerWaalsContact O-CA 3.29Å; G513-A537 WeakPolarHBondContact O-CA 3.03Å; G513-L539 PolarHBondContact O-N 2.96Å
514	R	95.6	Very high	92.4	Very high	85 Å²	85	33.3 Å²	33.3	32%	0.321	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.3	54.8	-169.7	-60.2	-170.6	179	168.1	1.6	113.8	P477 E487 G516 T517 L539	P477-R514 HydrophobicContact CB-CB 4.19Å; P477-R514 WeakPolarHBondContact O-CA 3.39Å; P477-R514 WeakPolarHBondContact O-CB 3.47Å; P477-R514 WeakPolarHBondContact O-CG 3.44Å; E487-R514 HydrophobicContact CG-CG 4.02Å; E487-R514 WeakPolarHBondContact O-CA 3.27Å; E487-R514 PolarHBondContact O-N 2.73Å; E487-R514 WeakPolarHBondContact OE1-CG 3.21Å; E487-R514 IonicContact OE1-CZ 2.65Å; E487-R514 IonicContact OE1-NE 2.9Å; E487-R514 PolarHBondContact OE1-NE 2.98Å; E487-R514 IonicContact OE1-NH2 2.65Å; R514-G516 PolarHBondContact O-N 3.15Å; R514-T517 VanDerWaalsContact CB-OG1 3.24Å; R514-T517 WeakPolarHBondContact CB-OG1 3.16Å; R514-T517 WeakPolarHBondContact O-CB 3.39Å; R514-T517 PolarHBondContact O-N 3.2Å; R514-T517 VanDerWaalsContact O-N 3.12Å; R514-T517 PolarHBondContact O-OG1 3.15Å; R514-L539 HydrophobicContact CB-CG 4.49Å; R514-L539 HydrophobicContact CG-CD1 3.91Å; R514-L539 HydrophobicContact CG-CG 4.17Å
515	F	97.5	Very high	92.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	130.9	173.1	176	-98.5	0	0	0	111.6	E487 G488 S489 I490 V507 A509 V535 A537 Y548 Y550	E487-F515 PolarHBondContact O-N 3.09Å; G488-F515 CarbonylContact C-O 3.07Å; G488-F515 VanDerWaalsContact C-O 3.3Å; G488-F515 WeakPolarHBondContact CA-O 3.18Å; S489-F515 PolarHBondContact N-O 3.12Å; S489-F515 VanDerWaalsContact N-O 3.15Å; I490-F515 HydrophobicContact CB-CE1 4.42Å; I490-F515 HydrophobicContact CD1-CE1 3.95Å; I490-F515 HydrophobicContact CD1-CZ 4.14Å; I490-F515 HydrophobicContact CG1-CD1 4.45Å; I490-F515 HydrophobicContact CG1-CE1 3.97Å; V507-F515 HydrophobicContact CB-CE1 4.36Å; V507-F515 HydrophobicContact CG1-CE1 3.99Å; V507-F515 HydrophobicContact CG1-CZ 3.89Å; A509-F515 HydrophobicContact CB-CB 3.6Å; A509-F515 HydrophobicContact CB-CD1 4.17Å; A509-F515 HydrophobicContact CB-CD2 3.58Å; A509-F515 HydrophobicContact CB-CE2 4.24Å; A509-F515 HydrophobicContact CB-CG 3.52Å; F515-V535 HydrophobicContact CD1-CG1 4.41Å; F515-V535 HydrophobicContact CD2-CB 4.36Å; F515-V535 HydrophobicContact CD2-CG1 3.56Å; F515-V535 HydrophobicContact CE1-CG1 4.17Å; F515-V535 HydrophobicContact CE2-CB 3.7Å; F515-V535 HydrophobicContact CE2-CG1 3.29Å; F515-V535 HydrophobicContact CE2-CG2 4.31Å; F515-V535 HydrophobicContact CG-CG1 4.14Å; F515-V535 HydrophobicContact CZ-CB 4.06Å; F515-V535 HydrophobicContact CZ-CG1 3.62Å; F515-V535 HydrophobicContact CZ-CG2 4.18Å; F515-A537 HydrophobicContact CB-CB 4.28Å; F515-Y548 AromaticContact CD2-CD2 3.85Å; F515-Y548 HydrophobicContact CD2-CD2 3.85Å; F515-Y548 HydrophobicContact CD2-CE2 4.04Å; F515-Y548 HydrophobicContact CD2-CG 4.44Å; F515-Y548 AromaticContact CE2-CD2 3.87Å; F515-Y548 HydrophobicContact CE2-CD2 3.87Å; F515-Y548 HydrophobicContact CE2-CE2 4.4Å; F515-Y548 HydrophobicContact CE2-CG 4.01Å; F515-Y550 AromaticContact CE2-CE2 3.98Å; F515-Y550 HydrophobicContact CE2-CE2 3.98Å; F515-Y550 WeakPolarHBondContact CE2-OH 3.34Å; F515-Y550 AromaticContact CZ-CE2 3.87Å; F515-Y550 HydrophobicContact CZ-CE2 3.87Å; F515-Y550 AromaticContact CZ-CZ 3.87Å; F515-Y550 VanDerWaalsContact CZ-OH 3.24Å; F515-Y550 WeakPolarHBondContact CZ-OH 3.49Å
516	G	96.8	Very high	92.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	21.3	-173.1	0	0	0	0	0	113.9	R514 G536	R514-G516 PolarHBondContact O-N 3.15Å; G516-G536 PolarHBondContact N-O 3.26Å
517	T	97.5	Very high	92.2	Very high	44 Å²	44	26.8 Å²	26.8	27%	0.27	15%	0.152	S	C	.	.	S	Bend	trans	-68.8	-27.4	165.4	-63.8	0	0	0	0	111.4	P477 R514 G536 P538	P477-T517 WeakPolarHBondContact CB-OG1 3.34Å; R514-T517 VanDerWaalsContact CB-OG1 3.24Å; R514-T517 WeakPolarHBondContact CB-OG1 3.16Å; R514-T517 WeakPolarHBondContact O-CB 3.39Å; R514-T517 PolarHBondContact O-N 3.2Å; R514-T517 VanDerWaalsContact O-N 3.12Å; R514-T517 PolarHBondContact O-OG1 3.15Å; T517-G536 PolarHBondContact N-O 3.12Å; T517-P538 HydrophobicContact CG2-CG 3.8Å
518	T	97.9	Very high	92.1	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.6	174.3	-60.1	0	0	0	0	109.4	E457 V535 G536 Q580 I582	E457-T518 VanDerWaalsContact OE1-CA 3.3Å; E457-T518 WeakPolarHBondContact OE1-CA 3.4Å; T518-V535 WeakPolarHBondContact O-CA 3.24Å; T518-G536 PolarHBondContact O-N 3.23Å; T518-Q580 PolarHBondContact OG1-O 3.03Å; T518-Q580 VanDerWaalsContact OG1-O 3.09Å; T518-I582 HydrophobicContact CG2-CB 4.18Å; T518-I582 HydrophobicContact CG2-CD1 4.3Å; T518-I582 HydrophobicContact CG2-CG1 4.02Å
519	I	98.3	Very high	92.3	Very high	9 Å²	9	28.5 Å²	28.5	5%	0.046	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	118.5	177.7	-50.2	173.5	0	0	0	107.6	E457 C459 L473 I490 V533	E457-I519 HydrophobicContact CG-CB 4.14Å; E457-I519 HydrophobicContact CG-CD1 4.34Å; E457-I519 HydrophobicContact CG-CG1 3.96Å; E457-I519 PolarHBondContact OE1-N 2.81Å; C459-I519 HydrophobicContact CB-CB 3.87Å; C459-I519 HydrophobicContact CB-CG2 3.6Å; L473-I519 HydrophobicContact CB-CD1 4.26Å; L473-I519 HydrophobicContact CB-CG2 4.1Å; L473-I519 HydrophobicContact CD2-CG2 3.8Å; I490-I519 HydrophobicContact CD1-CD1 3.64Å; I490-I519 HydrophobicContact CD1-CG1 3.72Å; I490-I519 HydrophobicContact CG1-CD1 3.79Å; I490-I519 HydrophobicContact CG1-CG1 4.33Å; I490-I519 HydrophobicContact CG2-CD1 4.18Å; I519-V533 HydrophobicContact CG2-CG1 4.03Å
520	S	97.4	Very high	93	Very high	13 Å²	13	29.1 Å²	29.1	9%	0.091	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.8	173.3	-164.4	0	0	0	0	109	V533 A534	S520-V533 WeakPolarHBondContact O-CA 3.33Å; S520-A534 PolarHBondContact N-O 3.4Å; S520-A534 PolarHBondContact O-N 2.9Å
521	S	96.2	Very high	94	Very high	13 Å²	13	27.1 Å²	27.1	9%	0.091	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	147.4	149.3	-163.9	0	0	0	0	107.4	C459	C459-S521 PolarHBondContact SG-N 3.12Å
522	L	96.5	Very high	94.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-115	-179.1	170.7	-56.2	179.2	0	0	0	109.1	L525 R531 D532 A534 I549 G584 I596	L522-L525 HydrophobicContact CD1-CD1 3.78Å; L522-L525 HydrophobicContact CD1-CD2 4.28Å; L522-L525 HydrophobicContact CD1-CG 4.2Å; L522-R531 PolarHBondContact O-NE 2.94Å; L522-R531 PolarHBondContact O-NH2 2.66Å; L522-D532 HydrophobicContact CB-CB 4.34Å; L522-D532 HydrophobicContact CD1-CB 4.25Å; L522-D532 PolarHBondContact N-O 3.37Å; L522-A534 HydrophobicContact CD1-CB 4.04Å; L522-A534 HydrophobicContact CD2-CB 3.94Å; L522-A534 HydrophobicContact CG-CB 4.15Å; L522-I549 HydrophobicContact CD1-CD1 4.42Å; L522-G584 CarbonylContact C-O 3.56Å; L522-G584 VanDerWaalsContact CA-O 3.27Å; L522-G584 WeakPolarHBondContact CA-O 3.46Å; L522-G584 WeakPolarHBondContact CB-O 3.49Å; L522-I596 HydrophobicContact CD1-CD1 3.78Å; L522-I596 HydrophobicContact CD1-CG1 4.4Å; L522-I596 HydrophobicContact CD2-CG1 4.43Å
523	S	94.8	Very high	95.2	Very high	38 Å²	38	22 Å²	22	27%	0.266	13%	0.13	S	C	.	.			trans	-65.5	167.9	150.8	-176.7	0	0	0	0	110.9	L525 D532 G584	S523-L525 PolarHBondContact O-N 2.91Å; S523-D532 PolarHBondContact O-N 2.84Å; S523-G584 PolarHBondContact N-O 3.37Å
524	D	94.9	Very high	95.5	Very high	36 Å²	36	22 Å²	22	19%	0.193	13%	0.13	C	C	.	.			trans	-55.1	122.8	158.4	178.6	-8.3	0	0	0	109.7	N526 G527 D528 G529 L530 P594	D524-N526 PolarHBondContact OD1-N 2.9Å; D524-N526 PolarHBondContact OD1-OD1 3.18Å; D524-G527 PolarHBondContact OD1-N 3.33Å; D524-G527 WeakPolarHBondContact OD2-CA 3.33Å; D524-G527 PolarHBondContact OD2-N 2.98Å; D524-D528 PolarHBondContact OD2-N 3.05Å; D524-G529 WeakPolarHBondContact OD2-CA 3.22Å; D524-G529 PolarHBondContact OD2-N 2.9Å; D524-L530 WeakPolarHBondContact CA-O 3.34Å; D524-L530 WeakPolarHBondContact CB-O 3.46Å; D524-P594 WeakPolarHBondContact O-CG 3.35Å
525	L	93.6	Very high	95.7	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	11%	0.114	C	C	.	.	S	Bend	trans	-98.4	-18.7	173.5	-50	178.9	0	0	0	113	F26 N27 V28 L522 S523 D532 I549 P594 I596	F26-L525 HydrophobicContact CE1-CB 4.26Å; N27-L525 PolarHBondContact ND2-O 2.79Å; V28-L525 HydrophobicContact CG2-CD1 4.12Å; L522-L525 HydrophobicContact CD1-CD1 3.78Å; L522-L525 HydrophobicContact CD1-CD2 4.28Å; L522-L525 HydrophobicContact CD1-CG 4.2Å; S523-L525 PolarHBondContact O-N 2.91Å; L525-D532 WeakPolarHBondContact CA-OD2 3.17Å; L525-D532 WeakPolarHBondContact CB-OD2 3.47Å; L525-D532 HydrophobicContact CD1-CB 4.31Å; L525-D532 HydrophobicContact CG-CB 4.1Å; L525-D532 VanDerWaalsContact CG-OD2 3.25Å; L525-D532 WeakPolarHBondContact CG-OD2 3.39Å; L525-D532 PolarHBondContact N-OD2 3.24Å; L525-I549 HydrophobicContact CD1-CG2 3.71Å; L525-P594 HydrophobicContact CD2-CB 4.43Å; L525-P594 HydrophobicContact CD2-CG 3.78Å; L525-I596 HydrophobicContact CD1-CD1 4.15Å
526	N	91.1	Very high	95.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	-107.6	-11.4	-168.2	79.6	-8.8	0	0	0	115.1	F26 D524 D528 L551 V656	F26-N526 HydrophobicContact CE1-CB 3.95Å; F26-N526 HydrophobicContact CE2-CB 4.29Å; F26-N526 HydrophobicContact CZ-CB 3.35Å; D524-N526 PolarHBondContact OD1-N 2.9Å; D524-N526 PolarHBondContact OD1-OD1 3.18Å; N526-D528 PolarHBondContact ND2-OD2 2.63Å; N526-D528 VanDerWaalsContact OD1-CB 3.3Å; N526-D528 WeakPolarHBondContact OD1-CB 3.48Å; N526-D528 PolarHBondContact OD1-N 2.97Å; N526-D528 PolarHBondContact OD1-OD1 3.26Å; N526-D528 PolarHBondContact OD1-OD2 3.4Å; N526-L551 HydrophobicContact CB-CD2 3.83Å; N526-V656 WeakPolarHBondContact O-CG2 3.29Å
527	G	89.6	Confident	95.7	Very high	26 Å²	26	17.9 Å²	17.9	27%	0.268	11%	0.114	S	C	.	.	S	Bend	trans	76.8	17.7	-176.9	0	0	0	0	0	114.9	D524	D524-G527 PolarHBondContact OD1-N 3.33Å; D524-G527 WeakPolarHBondContact OD2-CA 3.33Å; D524-G527 PolarHBondContact OD2-N 2.98Å
528	D	91.1	Very high	95.7	Very high	70 Å²	70	16.1 Å²	16.1	37%	0.374	10%	0.103	S	C	.	.	S	Bend	trans	-87.4	-4.3	176.6	84.4	19	0	0	0	114	D524 N526 L530 R559	D524-D528 PolarHBondContact OD2-N 3.05Å; N526-D528 PolarHBondContact ND2-OD2 2.63Å; N526-D528 VanDerWaalsContact OD1-CB 3.3Å; N526-D528 WeakPolarHBondContact OD1-CB 3.48Å; N526-D528 PolarHBondContact OD1-N 2.97Å; N526-D528 PolarHBondContact OD1-OD1 3.26Å; N526-D528 PolarHBondContact OD1-OD2 3.4Å; D528-L530 VanDerWaalsContact OD1-CB 3.23Å; D528-L530 WeakPolarHBondContact OD1-CB 3.41Å; D528-L530 WeakPolarHBondContact OD1-CG 3.18Å; D528-L530 PolarHBondContact OD1-N 3.15Å; D528-R559 IonicContact OD2-NH2 2.74Å; D528-R559 PolarHBondContact OD2-NH2 3.3Å
529	G	92.4	Very high	95.6	Very high	44 Å²	44	17.8 Å²	17.8	45%	0.454	11%	0.112	S	C	.	.	S	Bend	trans	86.8	13.8	177.8	0	0	0	0	0	114.1	D524	D524-G529 WeakPolarHBondContact OD2-CA 3.22Å; D524-G529 PolarHBondContact OD2-N 2.9Å
530	L	95.4	Very high	95.4	Very high	15 Å²	15	17.7 Å²	17.7	8%	0.079	11%	0.111	C	C	.	.			trans	-113.8	146.9	175.9	-52.8	-179.7	0	0	0	111.6	I463 D464 D524 D528 K554	I463-L530 HydrophobicContact CD1-CB 4.49Å; I463-L530 HydrophobicContact CG1-CB 4.48Å; I463-L530 HydrophobicContact CG1-CD2 4.41Å; I463-L530 CarbonylContact O-C 3.5Å; I463-L530 VanDerWaalsContact O-CA 3.25Å; I463-L530 WeakPolarHBondContact O-CA 3.28Å; D464-L530 HydrophobicContact CB-CD2 4.1Å; D524-L530 WeakPolarHBondContact CA-O 3.34Å; D524-L530 WeakPolarHBondContact CB-O 3.46Å; D528-L530 VanDerWaalsContact OD1-CB 3.23Å; D528-L530 WeakPolarHBondContact OD1-CB 3.41Å; D528-L530 WeakPolarHBondContact OD1-CG 3.18Å; D528-L530 PolarHBondContact OD1-N 3.15Å; L530-K554 HydrophobicContact CD1-CG 4.06Å; L530-K554 HydrophobicContact CD2-CD 4.06Å; L530-K554 HydrophobicContact CD2-CG 3.47Å; L530-K554 VanDerWaalsContact CD2-CG 3.47Å; L530-K554 HydrophobicContact CG-CG 4.45Å
531	R	96.7	Very high	95	Very high	61 Å²	61	21.2 Å²	21.2	23%	0.23	13%	0.126	C	C	.	.			trans	-76.6	136.4	173.2	-60.8	-168.4	75.7	166.4	-2.7	111.4	D462 I463 L522 G552 D585	D462-R531 WeakPolarHBondContact O-CD 3.23Å; I463-R531 WeakPolarHBondContact CD1-O 3.43Å; I463-R531 PolarHBondContact O-N 3.11Å; L522-R531 PolarHBondContact O-NE 2.94Å; L522-R531 PolarHBondContact O-NH2 2.66Å; R531-G552 WeakPolarHBondContact O-CA 3.25Å; R531-D585 IonicContact NH2-OD1 2.63Å; R531-D585 PolarHBondContact NH2-OD1 3.09Å
532	D	97.1	Very high	94.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.			trans	-92.3	169.4	179.2	-67.2	-32.7	0	0	0	112.5	L522 S523 L525 L551 G552	L522-D532 HydrophobicContact CB-CB 4.34Å; L522-D532 HydrophobicContact CD1-CB 4.25Å; L522-D532 PolarHBondContact N-O 3.37Å; S523-D532 PolarHBondContact O-N 2.84Å; L525-D532 WeakPolarHBondContact CA-OD2 3.17Å; L525-D532 WeakPolarHBondContact CB-OD2 3.47Å; L525-D532 HydrophobicContact CD1-CB 4.31Å; L525-D532 HydrophobicContact CG-CB 4.1Å; L525-D532 VanDerWaalsContact CG-OD2 3.25Å; L525-D532 WeakPolarHBondContact CG-OD2 3.39Å; L525-D532 PolarHBondContact N-OD2 3.24Å; D532-L551 WeakPolarHBondContact OD1-CA 3.49Å; D532-L551 WeakPolarHBondContact OD1-CD2 3.48Å; D532-L551 VanDerWaalsContact OD2-CD2 3.28Å; D532-L551 WeakPolarHBondContact OD2-CD2 3.28Å; D532-G552 PolarHBondContact OD1-N 3.25Å
533	V	97.8	Very high	94.6	Very high	1 Å²	1	31 Å²	31	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.7	-177	179.4	0	0	0	0	111.3	V461 L473 I519 S520 V535 Y550 M558	V461-V533 HydrophobicContact CG2-CG2 4.4Å; L473-V533 HydrophobicContact CD2-CG1 3.68Å; L473-V533 HydrophobicContact CD2-CG2 4.08Å; I519-V533 HydrophobicContact CG2-CG1 4.03Å; S520-V533 WeakPolarHBondContact O-CA 3.33Å; V533-V535 HydrophobicContact CG1-CG2 4.11Å; V533-Y550 PolarHBondContact N-O 3.39Å; V533-Y550 PolarHBondContact O-N 3.33Å; V533-M558 HydrophobicContact CG1-CE 4.3Å; V533-M558 HydrophobicContact CG2-CB 4.37Å
534	A	98.1	Very high	94.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.4	167.7	0	0	0	0	0	111.7	S520 L522 V547 Y548 I549 I582	S520-A534 PolarHBondContact N-O 3.4Å; S520-A534 PolarHBondContact O-N 2.9Å; L522-A534 HydrophobicContact CD1-CB 4.04Å; L522-A534 HydrophobicContact CD2-CB 3.94Å; L522-A534 HydrophobicContact CG-CB 4.15Å; A534-V547 HydrophobicContact CB-CG1 4.28Å; A534-Y548 CarbonylContact C-O 3.54Å; A534-Y548 WeakPolarHBondContact CA-O 3.39Å; A534-I549 HydrophobicContact CB-CD1 3.97Å; A534-I582 HydrophobicContact CB-CD1 4.08Å; A534-I582 HydrophobicContact CB-CG2 3.81Å
535	V	98.3	Very high	94.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.9	178.5	-177.5	0	0	0	0	111.5	I490 F515 T518 V533 V547 Y548 Y550	I490-V535 HydrophobicContact CD1-CB 4.1Å; I490-V535 HydrophobicContact CD1-CG1 3.48Å; I490-V535 VanDerWaalsContact CD1-CG1 3.48Å; I490-V535 HydrophobicContact CD1-CG2 3.43Å; I490-V535 VanDerWaalsContact CD1-CG2 3.43Å; F515-V535 HydrophobicContact CD1-CG1 4.41Å; F515-V535 HydrophobicContact CD2-CB 4.36Å; F515-V535 HydrophobicContact CD2-CG1 3.56Å; F515-V535 HydrophobicContact CE1-CG1 4.17Å; F515-V535 HydrophobicContact CE2-CB 3.7Å; F515-V535 HydrophobicContact CE2-CG1 3.29Å; F515-V535 HydrophobicContact CE2-CG2 4.31Å; F515-V535 HydrophobicContact CG-CG1 4.14Å; F515-V535 HydrophobicContact CZ-CB 4.06Å; F515-V535 HydrophobicContact CZ-CG1 3.62Å; F515-V535 HydrophobicContact CZ-CG2 4.18Å; T518-V535 WeakPolarHBondContact O-CA 3.24Å; V533-V535 HydrophobicContact CG1-CG2 4.11Å; V535-V547 CarbonylContact O-C 3.53Å; V535-V547 WeakPolarHBondContact O-CA 3.08Å; V535-Y548 PolarHBondContact N-O 2.87Å; V535-Y548 PolarHBondContact O-N 3.13Å; V535-Y550 HydrophobicContact CB-CE2 4.29Å; V535-Y550 HydrophobicContact CG2-CD2 4.02Å; V535-Y550 HydrophobicContact CG2-CE2 3.92Å
536	G	97.9	Very high	94.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	137	175.3	0	0	0	0	0	114	G516 T517 T518 G579	G516-G536 PolarHBondContact N-O 3.26Å; T517-G536 PolarHBondContact N-O 3.12Å; T518-G536 PolarHBondContact O-N 3.23Å; G536-G579 WeakPolarHBondContact CA-O 3.23Å
537	A	97.6	Very high	95.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	71.4	167.7	0	0	0	0	0	109.5	G513 F515 L539 E540 G545 A546 Y548	G513-A537 CarbonylContact O-C 3.5Å; G513-A537 VanDerWaalsContact O-CA 3.29Å; G513-A537 WeakPolarHBondContact O-CA 3.03Å; F515-A537 HydrophobicContact CB-CB 4.28Å; A537-L539 VanDerWaalsContact C-N 3.3Å; A537-L539 PolarHBondContact O-N 2.83Å; A537-E540 HydrophobicContact CB-CB 4.31Å; A537-E540 WeakPolarHBondContact CB-OE2 3.16Å; A537-E540 VanDerWaalsContact O-CB 3.31Å; A537-E540 WeakPolarHBondContact O-CB 3.15Å; A537-E540 PolarHBondContact O-N 3.45Å; A537-G545 WeakPolarHBondContact O-CA 3.25Å; A537-A546 PolarHBondContact N-O 3.24Å; A537-A546 PolarHBondContact O-N 3.22Å; A537-Y548 HydrophobicContact CB-CD2 4.47Å; A537-Y548 HydrophobicContact CB-CE2 4.02Å
538	P	97.4	Very high	95.4	Very high	6 Å²	6	26.5 Å²	26.5	4%	0.039	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.7	-167.1	25.8	-34.1	0	0	0	115.1	T517 G545 F577 Q580	T517-P538 HydrophobicContact CG2-CG 3.8Å; P538-G545 VanDerWaalsContact O-CA 3.3Å; P538-G545 WeakPolarHBondContact O-CA 3.33Å; P538-F577 HydrophobicContact CB-CB 4.05Å; P538-F577 WeakPolarHBondContact O-CA 3.44Å; P538-Q580 HydrophobicContact CB-CB 4.18Å
539	L	95.9	Very high	95.7	Very high	40 Å²	40	23.1 Å²	23.1	21%	0.209	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-3.4	178.1	-54.6	-162.3	0	0	0	113.4	G513 R514 A537 N543 F577	G513-L539 PolarHBondContact O-N 2.96Å; R514-L539 HydrophobicContact CB-CG 4.49Å; R514-L539 HydrophobicContact CG-CD1 3.91Å; R514-L539 HydrophobicContact CG-CG 4.17Å; A537-L539 VanDerWaalsContact C-N 3.3Å; A537-L539 PolarHBondContact O-N 2.83Å; L539-N543 WeakPolarHBondContact O-CA 3.21Å; L539-N543 PolarHBondContact O-N 2.95Å; L539-F577 HydrophobicContact CD2-CD1 3.63Å; L539-F577 HydrophobicContact CD2-CE1 3.54Å
540	E	94	Very high	95.9	Very high	7 Å²	7	21.4 Å²	21.4	3%	0.033	11%	0.107	C	C	.	.	H	α-helix	trans	-64.5	157.1	-177.1	-153.2	168.4	131.2	0	0	112.6	S511 A537 N542 N543 A544 G545 A546 Y548 R565	S511-E540 VanDerWaalsContact CB-OE2 3.25Å; S511-E540 WeakPolarHBondContact CB-OE2 3.21Å; S511-E540 PolarHBondContact OG-OE2 2.97Å; A537-E540 HydrophobicContact CB-CB 4.31Å; A537-E540 WeakPolarHBondContact CB-OE2 3.16Å; A537-E540 VanDerWaalsContact O-CB 3.31Å; A537-E540 WeakPolarHBondContact O-CB 3.15Å; A537-E540 PolarHBondContact O-N 3.45Å; E540-N542 PolarHBondContact O-N 2.65Å; E540-N543 PolarHBondContact O-N 2.81Å; E540-A544 PolarHBondContact O-N 2.98Å; E540-G545 PolarHBondContact O-N 3.03Å; E540-A546 HydrophobicContact CB-CB 4.21Å; E540-Y548 PolarHBondContact OE1-OH 3.01Å; E540-Y548 VanDerWaalsContact OE1-OH 3.09Å; E540-Y548 PolarHBondContact OE2-OH 2.87Å; E540-R565 IonicContact OE1-CZ 2.84Å; E540-R565 IonicContact OE1-NE 3.83Å; E540-R565 PolarHBondContact OE1-NE 2.84Å; E540-R565 IonicContact OE1-NH2 2.84Å; E540-R565 PolarHBondContact OE1-NH2 3.42Å
541	E	89.5	Confident	95.9	Very high	87 Å²	87	20.7 Å²	20.7	41%	0.407	10%	0.103	S	C	.	.	H	α-helix	trans	51.2	52	179.4	-54.7	-66.4	-172.4	0	0	113.5	A544 R565 M567	E541-A544 HydrophobicContact CB-CB 4.2Å; E541-A544 WeakPolarHBondContact O-CB 3.06Å; E541-A544 PolarHBondContact O-N 3.22Å; E541-R565 IonicContact OE1-CZ 1.76Å; E541-R565 IonicContact OE1-NH1 3.81Å; E541-R565 IonicContact OE1-NH2 3.43Å; E541-R565 PolarHBondContact OE1-NH2 3.49Å; E541-M567 HydrophobicContact CG-CE 4.21Å
542	N	89.1	Confident	95.8	Very high	147 Å²	147	17.8 Å²	17.8	79%	0.786	9%	0.092	S	C	*	.	H	α-helix	trans	59.8	47.2	-177.1	-51.3	-81.6	0	0	0	113.3	E540 A544	E540-N542 PolarHBondContact O-N 2.65Å; N542-A544 VanDerWaalsContact C-N 3.26Å; N542-A544 PolarHBondContact O-N 2.85Å
543	N	93.7	Very high	95.6	Very high	71 Å²	71	21.8 Å²	21.8	38%	0.38	11%	0.111	S	C	.	.	H	α-helix	trans	66.3	14	-175.8	-48.8	-57.6	0	0	0	115.7	L539 E540 G545 R576 F577	L539-N543 WeakPolarHBondContact O-CA 3.21Å; L539-N543 PolarHBondContact O-N 2.95Å; E540-N543 PolarHBondContact O-N 2.81Å; N543-G545 VanDerWaalsContact C-N 3.33Å; N543-R576 CarbonylContact O-C 3.55Å; N543-R576 WeakPolarHBondContact O-CA 3.43Å; N543-R576 WeakPolarHBondContact O-CB 3.21Å; N543-R576 WeakPolarHBondContact O-CD 3.36Å; N543-F577 HydrophobicContact CB-CD1 4.15Å; N543-F577 HydrophobicContact CB-CE1 3.79Å; N543-F577 PolarHBondContact O-N 3.41Å
544	A	95.3	Very high	95.1	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.025	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-39.4	169	0	0	0	0	0	111.1	E540 E541 N542 A569 L575 F577 F578	E540-A544 PolarHBondContact O-N 2.98Å; E541-A544 HydrophobicContact CB-CB 4.2Å; E541-A544 WeakPolarHBondContact O-CB 3.06Å; E541-A544 PolarHBondContact O-N 3.22Å; N542-A544 VanDerWaalsContact C-N 3.26Å; N542-A544 PolarHBondContact O-N 2.85Å; A544-A569 HydrophobicContact CB-CB 3.88Å; A544-L575 WeakPolarHBondContact CA-O 3.43Å; A544-F577 PolarHBondContact O-N 3.27Å; A544-F578 WeakPolarHBondContact O-CB 3.38Å; A544-F578 PolarHBondContact O-N 3.28Å
545	G	96.4	Very high	94.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.			trans	90.5	154.7	176.5	0	0	0	0	0	114.2	A537 P538 E540 N543 G568 F578	A537-G545 WeakPolarHBondContact O-CA 3.25Å; P538-G545 VanDerWaalsContact O-CA 3.3Å; P538-G545 WeakPolarHBondContact O-CA 3.33Å; E540-G545 PolarHBondContact O-N 3.03Å; N543-G545 VanDerWaalsContact C-N 3.33Å; G545-G568 PolarHBondContact O-N 2.9Å; G545-F578 CarbonylContact C-O 3.57Å; G545-F578 WeakPolarHBondContact CA-O 3.39Å
546	A	96.4	Very high	94	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.9	177.8	0	0	0	0	0	111.9	A537 E540 Y548 I566 F578	A537-A546 PolarHBondContact N-O 3.24Å; A537-A546 PolarHBondContact O-N 3.22Å; E540-A546 HydrophobicContact CB-CB 4.21Å; A546-Y548 HydrophobicContact CB-CE2 4.35Å; A546-I566 CarbonylContact C-O 3.58Å; A546-I566 VanDerWaalsContact CA-O 3.28Å; A546-I566 WeakPolarHBondContact CA-O 3.24Å; A546-F578 PolarHBondContact N-O 3Å
547	V	97.3	Very high	93.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.2	168.6	173.7	0	0	0	0	109.5	A534 V535 I549 R565 I566 F578 I582 V598	A534-V547 HydrophobicContact CB-CG1 4.28Å; V535-V547 CarbonylContact O-C 3.53Å; V535-V547 WeakPolarHBondContact O-CA 3.08Å; V547-I549 HydrophobicContact CG1-CD1 4.03Å; V547-R565 WeakPolarHBondContact O-CA 3.46Å; V547-I566 HydrophobicContact CB-CB 4.5Å; V547-I566 PolarHBondContact N-O 3.12Å; V547-I566 PolarHBondContact O-N 3.27Å; V547-F578 HydrophobicContact CB-CE1 4.13Å; V547-F578 HydrophobicContact CG2-CD1 4.08Å; V547-F578 HydrophobicContact CG2-CE1 3.73Å; V547-F578 HydrophobicContact CG2-CZ 4.47Å; V547-I582 HydrophobicContact CG1-CD1 3.89Å; V547-I582 HydrophobicContact CG2-CD1 3.83Å; V547-I582 HydrophobicContact CG2-CG1 4.32Å; V547-V598 HydrophobicContact CG2-CG1 3.71Å; V547-V598 HydrophobicContact CG2-CG2 4.12Å
548	Y	96.8	Very high	93.5	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.012	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.3	176	-68.1	-101.6	0	0	0	109.5	A509 F515 A534 V535 A537 E540 A546 Y550 R565	A509-Y548 HydrophobicContact CB-CE2 4.34Å; F515-Y548 AromaticContact CD2-CD2 3.85Å; F515-Y548 HydrophobicContact CD2-CD2 3.85Å; F515-Y548 HydrophobicContact CD2-CE2 4.04Å; F515-Y548 HydrophobicContact CD2-CG 4.44Å; F515-Y548 AromaticContact CE2-CD2 3.87Å; F515-Y548 HydrophobicContact CE2-CD2 3.87Å; F515-Y548 HydrophobicContact CE2-CE2 4.4Å; F515-Y548 HydrophobicContact CE2-CG 4.01Å; A534-Y548 CarbonylContact C-O 3.54Å; A534-Y548 WeakPolarHBondContact CA-O 3.39Å; V535-Y548 PolarHBondContact N-O 2.87Å; V535-Y548 PolarHBondContact O-N 3.13Å; A537-Y548 HydrophobicContact CB-CD2 4.47Å; A537-Y548 HydrophobicContact CB-CE2 4.02Å; E540-Y548 PolarHBondContact OE1-OH 3.01Å; E540-Y548 VanDerWaalsContact OE1-OH 3.09Å; E540-Y548 PolarHBondContact OE2-OH 2.87Å; A546-Y548 HydrophobicContact CB-CE2 4.35Å; Y548-Y550 HydrophobicContact CG-CE2 4.4Å; Y548-R565 HydrophobicContact CD1-CB 4.17Å; Y548-R565 HydrophobicContact CD1-CG 4.2Å; Y548-R565 HydrophobicContact CE1-CB 4.21Å; Y548-R565 HydrophobicContact CE1-CG 3.93Å; Y548-R565 PolarHBondContact OH-NE 3.04Å
549	I	96.9	Very high	93.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.3	173.9	-51.6	-57.8	0	0	0	108.5	V28 L522 L525 A534 V547 S562 S563 Q564 I566 I596	V28-I549 HydrophobicContact CG2-CG1 4.33Å; L522-I549 HydrophobicContact CD1-CD1 4.42Å; L525-I549 HydrophobicContact CD1-CG2 3.71Å; A534-I549 HydrophobicContact CB-CD1 3.97Å; V547-I549 HydrophobicContact CG1-CD1 4.03Å; I549-S562 CarbonylContact O-C 3.58Å; I549-S562 VanDerWaalsContact O-CA 3.25Å; I549-S562 WeakPolarHBondContact O-CA 3.39Å; I549-S562 WeakPolarHBondContact O-CB 3.49Å; I549-S563 PolarHBondContact O-N 2.72Å; I549-Q564 HydrophobicContact CB-CB 4.29Å; I549-Q564 HydrophobicContact CG1-CB 4.45Å; I549-Q564 PolarHBondContact N-O 3.15Å; I549-Q564 PolarHBondContact O-N 3.38Å; I549-I566 HydrophobicContact CD1-CD1 4.43Å; I549-I566 HydrophobicContact CG1-CD1 4.04Å; I549-I596 HydrophobicContact CD1-CD1 3.77Å
550	Y	96.3	Very high	92.9	Very high	7 Å²	7	37.2 Å²	37.2	3%	0.027	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.4	175.3	-65.5	-96.4	0	0	0	108.8	V507 F515 V533 V535 Y548 M558 R559	V507-Y550 HydrophobicContact CG1-CE1 3.87Å; F515-Y550 AromaticContact CE2-CE2 3.98Å; F515-Y550 HydrophobicContact CE2-CE2 3.98Å; F515-Y550 WeakPolarHBondContact CE2-OH 3.34Å; F515-Y550 AromaticContact CZ-CE2 3.87Å; F515-Y550 HydrophobicContact CZ-CE2 3.87Å; F515-Y550 AromaticContact CZ-CZ 3.87Å; F515-Y550 VanDerWaalsContact CZ-OH 3.24Å; F515-Y550 WeakPolarHBondContact CZ-OH 3.49Å; V533-Y550 PolarHBondContact N-O 3.39Å; V533-Y550 PolarHBondContact O-N 3.33Å; V535-Y550 HydrophobicContact CB-CE2 4.29Å; V535-Y550 HydrophobicContact CG2-CD2 4.02Å; V535-Y550 HydrophobicContact CG2-CE2 3.92Å; Y548-Y550 HydrophobicContact CG-CE2 4.4Å; Y550-M558 HydrophobicContact CD1-CE 3.64Å; Y550-M558 HydrophobicContact CD2-CE 3.48Å; Y550-M558 VanDerWaalsContact CD2-CE 3.48Å; Y550-M558 HydrophobicContact CE1-CE 4.14Å; Y550-M558 HydrophobicContact CE2-CE 4.01Å; Y550-M558 HydrophobicContact CG-CE 3.28Å; Y550-R559 VanDerWaalsContact CD1-O 3.31Å; Y550-R559 WeakPolarHBondContact CD1-O 3.32Å
551	L	95.6	Very high	92.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.			trans	-72	153.2	175.6	-68.2	172.6	0	0	0	111.5	F26 N526 D532 M558 R559 S563 I744	F26-L551 HydrophobicContact CD1-CD2 4.14Å; F26-L551 HydrophobicContact CD2-CD1 4.29Å; F26-L551 HydrophobicContact CE1-CD2 3.71Å; F26-L551 HydrophobicContact CE2-CD1 4.03Å; F26-L551 HydrophobicContact CZ-CD1 4.26Å; F26-L551 HydrophobicContact CZ-CD2 3.99Å; N526-L551 HydrophobicContact CB-CD2 3.83Å; D532-L551 WeakPolarHBondContact OD1-CA 3.49Å; D532-L551 WeakPolarHBondContact OD1-CD2 3.48Å; D532-L551 VanDerWaalsContact OD2-CD2 3.28Å; D532-L551 WeakPolarHBondContact OD2-CD2 3.28Å; L551-M558 WeakPolarHBondContact O-CA 3.4Å; L551-R559 HydrophobicContact CB-CG 4.31Å; L551-R559 WeakPolarHBondContact O-CG 3.38Å; L551-R559 PolarHBondContact O-N 3.28Å; L551-S563 VanDerWaalsContact CD1-OG 3.3Å; L551-S563 WeakPolarHBondContact CD1-OG 3.38Å; L551-S563 VanDerWaalsContact CG-OG 3.29Å; L551-S563 WeakPolarHBondContact CG-OG 3.45Å; L551-I744 HydrophobicContact CD1-CG2 3.86Å
552	G	95.2	Very high	92.8	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	155.2	174.4	0	0	0	0	0	113.6	R531 D532 G557	R531-G552 WeakPolarHBondContact O-CA 3.25Å; D532-G552 PolarHBondContact OD1-N 3.25Å; G552-G557 WeakPolarHBondContact CA-O 3.43Å
553	Q	92.8	Very high	93	Very high	83 Å²	83	33.1 Å²	33.1	39%	0.388	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	109.2	173.4	-175.8	171.7	-10.7	0	0	111.4	G555 T556 G557 R559	Q553-G555 PolarHBondContact O-N 2.99Å; Q553-T556 VanDerWaalsContact CD-OG1 3.24Å; Q553-T556 WeakPolarHBondContact CG-OG1 3.13Å; Q553-T556 PolarHBondContact O-N 2.84Å; Q553-T556 PolarHBondContact OE1-OG1 2.88Å; Q553-G557 PolarHBondContact N-O 3.46Å; Q553-G557 CarbonylContact O-C 3.55Å; Q553-G557 WeakPolarHBondContact O-CA 3.11Å; Q553-G557 PolarHBondContact O-N 2.66Å; Q553-R559 HydrophobicContact CB-CG 4.16Å
554	K	86.1	Confident	93	Very high	126 Å²	126	30 Å²	30	55%	0.548	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-28	-175	-66.4	-154.9	176.3	-156.3	0	116.6	D464 F471 L530	D464-K554 WeakPolarHBondContact OD2-CE 3Å; D464-K554 IonicContact OD2-NZ 2.69Å; D464-K554 PolarHBondContact OD2-NZ 3.16Å; F471-K554 WeakPolarHBondContact CZ-O 3.49Å; L530-K554 HydrophobicContact CD1-CG 4.06Å; L530-K554 HydrophobicContact CD2-CD 4.06Å; L530-K554 HydrophobicContact CD2-CG 3.47Å; L530-K554 VanDerWaalsContact CD2-CG 3.47Å; L530-K554 HydrophobicContact CG-CG 4.45Å
555	G	83.9	Confident	92.9	Very high	57 Å²	57	32.9 Å²	32.9	59%	0.588	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-14.8	-179.7	0	0	0	0	0	115.8	Q553	Q553-G555 PolarHBondContact O-N 2.99Å
556	T	88.9	Confident	92.8	Very high	29 Å²	29	33 Å²	33	18%	0.178	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.8	7.5	-170.3	50.9	0	0	0	0	113.7	V492 Q553 M558	V492-T556 WeakPolarHBondContact CG1-O 3.46Å; Q553-T556 VanDerWaalsContact CD-OG1 3.24Å; Q553-T556 WeakPolarHBondContact CG-OG1 3.13Å; Q553-T556 PolarHBondContact O-N 2.84Å; Q553-T556 PolarHBondContact OE1-OG1 2.88Å; T556-M558 PolarHBondContact O-N 2.91Å; T556-M558 PolarHBondContact OG1-O 3.44Å
557	G	90.6	Very high	92.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	73.5	-59.7	-169.9	0	0	0	0	0	111.5	I463 F471 G552 Q553	I463-G557 WeakPolarHBondContact CD1-O 3.31Å; F471-G557 VanDerWaalsContact CD2-CA 3.4Å; F471-G557 VanDerWaalsContact CE2-CA 3.48Å; G552-G557 WeakPolarHBondContact CA-O 3.43Å; Q553-G557 PolarHBondContact N-O 3.46Å; Q553-G557 CarbonylContact O-C 3.55Å; Q553-G557 WeakPolarHBondContact O-CA 3.11Å; Q553-G557 PolarHBondContact O-N 2.66Å
558	M	94.6	Very high	92.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	156.9	-176.5	64.1	-166.8	-61	0	0	111.5	L473 V492 L505 V507 V533 Y550 L551 T556	L473-M558 HydrophobicContact CD2-SD 3.89Å; V492-M558 HydrophobicContact CG2-CG 4.22Å; V492-M558 HydrophobicContact CG2-SD 3.75Å; L505-M558 HydrophobicContact CD2-CG 3.83Å; V507-M558 HydrophobicContact CG2-CE 4.24Å; V507-M558 HydrophobicContact CG2-SD 3.99Å; V533-M558 HydrophobicContact CG1-CE 4.3Å; V533-M558 HydrophobicContact CG2-CB 4.37Å; Y550-M558 HydrophobicContact CD1-CE 3.64Å; Y550-M558 HydrophobicContact CD2-CE 3.48Å; Y550-M558 VanDerWaalsContact CD2-CE 3.48Å; Y550-M558 HydrophobicContact CE1-CE 4.14Å; Y550-M558 HydrophobicContact CE2-CE 4.01Å; Y550-M558 HydrophobicContact CG-CE 3.28Å; L551-M558 WeakPolarHBondContact O-CA 3.4Å; T556-M558 PolarHBondContact O-N 2.91Å; T556-M558 PolarHBondContact OG1-O 3.44Å
559	R	92.3	Very high	92.3	Very high	49 Å²	49	36.7 Å²	36.7	19%	0.185	20%	0.199	C	C	.	.			trans	-65.8	150.5	166.6	-61.4	-175.2	-162.5	-162.9	4.9	110.1	D528 Y550 L551 Q553 I561 D745	D528-R559 IonicContact OD2-NH2 2.74Å; D528-R559 PolarHBondContact OD2-NH2 3.3Å; Y550-R559 VanDerWaalsContact CD1-O 3.31Å; Y550-R559 WeakPolarHBondContact CD1-O 3.32Å; L551-R559 HydrophobicContact CB-CG 4.31Å; L551-R559 WeakPolarHBondContact O-CG 3.38Å; L551-R559 PolarHBondContact O-N 3.28Å; Q553-R559 HydrophobicContact CB-CG 4.16Å; R559-I561 VanDerWaalsContact C-N 3.3Å; R559-I561 PolarHBondContact O-N 2.69Å; R559-D745 IonicContact CZ-OD2 3.6Å; R559-D745 VanDerWaalsContact CZ-OD2 3.24Å; R559-D745 VanDerWaalsContact NH1-CG 3.29Å; R559-D745 IonicContact NH1-OD1 3.39Å; R559-D745 PolarHBondContact NH1-OD1 2.93Å; R559-D745 IonicContact NH1-OD2 3.86Å; R559-D745 PolarHBondContact NH1-OD2 2.83Å; R559-D745 IonicContact NH2-OD2 2.63Å; R559-D745 PolarHBondContact NH2-OD2 2.91Å
560	N	88.7	Confident	92.1	Very high	109 Å²	109	40.4 Å²	40.4	58%	0.583	22%	0.216	S	C	*	.	S	Bend	trans	-80.6	-6.7	-176.7	69.9	-20.2	0	0	0	114.9	L505	L505-N560 HydrophobicContact CD1-CB 4.03Å; L505-N560 HydrophobicContact CD2-CB 4.39Å
561	I	90.2	Very high	91.9	Very high	121 Å²	121	41.8 Å²	41.8	62%	0.621	22%	0.222	S	C	*	.	S	Bend	trans	-126.6	134.7	178.5	-65.6	166.2	0	0	0	106.9	R559	R559-I561 VanDerWaalsContact C-N 3.3Å; R559-I561 PolarHBondContact O-N 2.69Å
562	S	92.7	Very high	91.6	Very high	27 Å²	27	44.5 Å²	44.5	19%	0.189	24%	0.237	C	C	.	.			trans	-69.6	129.5	176.2	55.8	0	0	0	0	110.6	I549 Q564	I549-S562 CarbonylContact O-C 3.58Å; I549-S562 VanDerWaalsContact O-CA 3.25Å; I549-S562 WeakPolarHBondContact O-CA 3.39Å; I549-S562 WeakPolarHBondContact O-CB 3.49Å; S562-Q564 VanDerWaalsContact C-N 3.29Å; S562-Q564 PolarHBondContact O-N 3.09Å
563	S	92.8	Very high	91.3	Very high	7 Å²	7	49.3 Å²	49.3	5%	0.049	27%	0.268	C	S	.	.	S	Bend	trans	-68	-30.7	174.6	-58.9	0	0	0	0	112	S24 I549 L551	S24-S563 WeakPolarHBondContact CB-O 3.15Å; S24-S563 VanDerWaalsContact O-O 3.04Å; S24-S563 PolarHBondContact OG-O 2.91Å; I549-S563 PolarHBondContact O-N 2.72Å; L551-S563 VanDerWaalsContact CD1-OG 3.3Å; L551-S563 WeakPolarHBondContact CD1-OG 3.38Å; L551-S563 VanDerWaalsContact CG-OG 3.29Å; L551-S563 WeakPolarHBondContact CG-OG 3.45Å
564	Q	92.5	Very high	91.2	Very high	5 Å²	5	46.9 Å²	46.9	2%	0.023	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	144.7	179.1	-171.6	168.4	-8	0	0	111.4	S24 F26 V28 I549 S562 I566	S24-Q564 WeakPolarHBondContact O-CB 3.43Å; S24-Q564 WeakPolarHBondContact O-CG 3.44Å; F26-Q564 HydrophobicContact CB-CB 3.97Å; V28-Q564 PolarHBondContact O-NE2 3.08Å; I549-Q564 HydrophobicContact CB-CB 4.29Å; I549-Q564 HydrophobicContact CG1-CB 4.45Å; I549-Q564 PolarHBondContact N-O 3.15Å; I549-Q564 PolarHBondContact O-N 3.38Å; S562-Q564 VanDerWaalsContact C-N 3.29Å; S562-Q564 PolarHBondContact O-N 3.09Å; Q564-I566 HydrophobicContact CG-CD1 4.48Å; Q564-I566 HydrophobicContact CG-CG1 4.02Å
565	R	94.1	Very high	91.4	Very high	65 Å²	65	41.2 Å²	41.2	25%	0.245	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.5	169.6	175.7	-178.5	169.8	-96.4	7.5	108.5	E540 E541 V547 Y548 M567	E540-R565 IonicContact OE1-CZ 2.84Å; E540-R565 IonicContact OE1-NE 3.83Å; E540-R565 PolarHBondContact OE1-NE 2.84Å; E540-R565 IonicContact OE1-NH2 2.84Å; E540-R565 PolarHBondContact OE1-NH2 3.42Å; E541-R565 IonicContact OE1-CZ 1.76Å; E541-R565 IonicContact OE1-NH1 3.81Å; E541-R565 IonicContact OE1-NH2 3.43Å; E541-R565 PolarHBondContact OE1-NH2 3.49Å; V547-R565 WeakPolarHBondContact O-CA 3.46Å; Y548-R565 HydrophobicContact CD1-CB 4.17Å; Y548-R565 HydrophobicContact CD1-CG 4.2Å; Y548-R565 HydrophobicContact CE1-CB 4.21Å; Y548-R565 HydrophobicContact CE1-CG 3.93Å; Y548-R565 PolarHBondContact OH-NE 3.04Å; R565-M567 VanDerWaalsContact NH1-CG 3.34Å; R565-M567 PolarHBondContact NH1-SD 3.27Å
566	I	94.8	Very high	92	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.3	-170.6	-58.6	175.8	0	0	0	107.5	V28 T30 A546 V547 I549 Q564 F571 F578 L607	V28-I566 HydrophobicContact CB-CD1 4.11Å; V28-I566 HydrophobicContact CG1-CD1 3.82Å; T30-I566 HydrophobicContact CG2-CG1 4.25Å; T30-I566 HydrophobicContact CG2-CG2 4.16Å; A546-I566 CarbonylContact C-O 3.58Å; A546-I566 VanDerWaalsContact CA-O 3.28Å; A546-I566 WeakPolarHBondContact CA-O 3.24Å; V547-I566 HydrophobicContact CB-CB 4.5Å; V547-I566 PolarHBondContact N-O 3.12Å; V547-I566 PolarHBondContact O-N 3.27Å; I549-I566 HydrophobicContact CD1-CD1 4.43Å; I549-I566 HydrophobicContact CG1-CD1 4.04Å; Q564-I566 HydrophobicContact CG-CD1 4.48Å; Q564-I566 HydrophobicContact CG-CG1 4.02Å; I566-F571 HydrophobicContact CG2-CE2 3.71Å; I566-F571 HydrophobicContact CG2-CZ 3.73Å; I566-F578 HydrophobicContact CG2-CE1 3.91Å; I566-F578 HydrophobicContact CG2-CZ 4Å; I566-L607 HydrophobicContact CD1-CD1 3.97Å; I566-L607 HydrophobicContact CG2-CD1 3.97Å
567	M	94.2	Very high	92.4	Very high	48 Å²	48	43.6 Å²	43.6	24%	0.236	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.8	-176.7	-71.3	165.5	54	0	0	111.3	E541 R565 A569 Q570	E541-M567 HydrophobicContact CG-CE 4.21Å; R565-M567 VanDerWaalsContact NH1-CG 3.34Å; R565-M567 PolarHBondContact NH1-SD 3.27Å; M567-A569 PolarHBondContact O-N 3.08Å; M567-Q570 HydrophobicContact CB-CB 4.34Å; M567-Q570 VanDerWaalsContact O-CD 3.25Å; M567-Q570 WeakPolarHBondContact O-CG 3.21Å; M567-Q570 PolarHBondContact O-N 3.02Å; M567-Q570 VanDerWaalsContact O-N 3.13Å
568	G	93.3	Very high	92.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-57.5	-39.1	173.2	0	0	0	0	0	112.6	G545 Q570 F571 D572 L575	G545-G568 PolarHBondContact O-N 2.9Å; G568-Q570 PolarHBondContact O-N 2.77Å; G568-Q570 VanDerWaalsContact O-N 3.16Å; G568-F571 PolarHBondContact O-N 2.96Å; G568-F571 VanDerWaalsContact O-N 3.15Å; G568-D572 PolarHBondContact O-N 2.73Å; G568-L575 WeakPolarHBondContact O-CD1 3.47Å
569	A	92.9	Very high	92.9	Very high	35 Å²	35	43.6 Å²	43.6	29%	0.289	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-64.5	-15.7	179.3	0	0	0	0	0	115.2	A544 M567 F571	A544-A569 HydrophobicContact CB-CB 3.88Å; M567-A569 PolarHBondContact O-N 3.08Å; A569-F571 VanDerWaalsContact C-N 3.3Å
570	Q	92.4	Very high	93.1	Very high	78 Å²	78	42.3 Å²	42.3	36%	0.364	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-76.3	-22.4	176.7	87.5	-155.7	-4.7	0	0	112.2	M567 G568	M567-Q570 HydrophobicContact CB-CB 4.34Å; M567-Q570 VanDerWaalsContact O-CD 3.25Å; M567-Q570 WeakPolarHBondContact O-CG 3.21Å; M567-Q570 PolarHBondContact O-N 3.02Å; M567-Q570 VanDerWaalsContact O-N 3.13Å; G568-Q570 PolarHBondContact O-N 2.77Å; G568-Q570 VanDerWaalsContact O-N 3.16Å
571	F	91.2	Very high	93.6	Very high	35 Å²	35	37.3 Å²	37.3	15%	0.154	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-48.9	-176.2	-59.8	-51.3	0	0	0	111.9	T30 P33 F35 I566 G568 A569 L575 F578 L607	T30-F571 HydrophobicContact CG2-CE1 4.35Å; T30-F571 HydrophobicContact CG2-CZ 4.13Å; T30-F571 WeakPolarHBondContact O-CE1 3.48Å; P33-F571 HydrophobicContact CB-CD1 4.29Å; P33-F571 HydrophobicContact CB-CE1 4.14Å; P33-F571 HydrophobicContact CG-CD1 3.68Å; P33-F571 HydrophobicContact CG-CE1 3.88Å; P33-F571 HydrophobicContact CG-CG 4.45Å; F35-F571 HydrophobicContact CE1-CB 4.24Å; F35-F571 HydrophobicContact CZ-CB 4.04Å; I566-F571 HydrophobicContact CG2-CE2 3.71Å; I566-F571 HydrophobicContact CG2-CZ 3.73Å; G568-F571 PolarHBondContact O-N 2.96Å; G568-F571 VanDerWaalsContact O-N 3.15Å; A569-F571 VanDerWaalsContact C-N 3.3Å; F571-L575 HydrophobicContact CB-CD1 3.98Å; F571-F578 HydrophobicContact CD2-CE2 4.14Å; F571-F578 HydrophobicContact CD2-CZ 4.24Å; F571-F578 HydrophobicContact CE2-CE1 4.37Å; F571-F578 AromaticContact CE2-CE2 3.96Å; F571-F578 HydrophobicContact CE2-CE2 3.96Å; F571-F578 AromaticContact CE2-CZ 3.65Å; F571-F578 HydrophobicContact CE2-CZ 3.65Å; F571-L607 HydrophobicContact CE1-CD2 4.2Å; F571-L607 HydrophobicContact CE2-CD2 4.07Å; F571-L607 HydrophobicContact CZ-CD1 4.44Å; F571-L607 HydrophobicContact CZ-CD2 3.52Å
572	D	89.4	Confident	93.9	Very high	58 Å²	58	32.1 Å²	32.1	31%	0.31	17%	0.173	S	C	.	.			trans	-155	115.7	177.3	177.2	-18	0	0	0	107.8	K37 G568 G574 L575	K37-D572 IonicContact NZ-OD2 2.67Å; G568-D572 PolarHBondContact O-N 2.73Å; D572-G574 PolarHBondContact O-N 2.83Å; D572-G574 WeakPolarHBondContact OD1-CA 3.07Å; D572-G574 PolarHBondContact OD1-N 3.48Å; D572-L575 HydrophobicContact CB-CD1 3.87Å; D572-L575 HydrophobicContact CB-CG 3.92Å; D572-L575 WeakPolarHBondContact O-CB 3.47Å; D572-L575 PolarHBondContact O-N 3.1Å
573	P	88.4	Confident	94.1	Very high	101 Å²	101	31.8 Å²	31.8	66%	0.656	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-9.8	179	-26.5	35.9	0	0	0	115.3	R576	P573-R576 PolarHBondContact O-NH1 3.08Å; P573-R576 PolarHBondContact O-NH2 2.94Å
574	G	90.4	Very high	94.1	Very high	32 Å²	32	31.5 Å²	31.5	33%	0.33	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-13.8	171.5	0	0	0	0	0	115.1	Q40 D572	Q40-G574 PolarHBondContact NE2-O 2.69Å; Q40-G574 VanDerWaalsContact NE2-O 3.09Å; D572-G574 PolarHBondContact O-N 2.83Å; D572-G574 WeakPolarHBondContact OD1-CA 3.07Å; D572-G574 PolarHBondContact OD1-N 3.48Å
575	L	91.9	Very high	93.9	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.037	18%	0.182	C	C	.	.			trans	-65.3	138.4	177.6	-73.1	166.4	0	0	0	111.6	F35 A544 G568 F571 D572 S600 A603	F35-L575 HydrophobicContact CE1-CD1 4.43Å; A544-L575 WeakPolarHBondContact CA-O 3.43Å; G568-L575 WeakPolarHBondContact O-CD1 3.47Å; F571-L575 HydrophobicContact CB-CD1 3.98Å; D572-L575 HydrophobicContact CB-CD1 3.87Å; D572-L575 HydrophobicContact CB-CG 3.92Å; D572-L575 WeakPolarHBondContact O-CB 3.47Å; D572-L575 PolarHBondContact O-N 3.1Å; L575-S600 WeakPolarHBondContact CD2-OG 3.27Å; L575-A603 HydrophobicContact CD2-CB 3.88Å
576	R	95.6	Very high	93.8	Very high	88 Å²	88	32.6 Å²	32.6	33%	0.332	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.1	175.3	-62.9	-65.6	176.3	-91.8	-1	110.6	N543 P573 F578 S600 Q601	N543-R576 CarbonylContact O-C 3.55Å; N543-R576 WeakPolarHBondContact O-CA 3.43Å; N543-R576 WeakPolarHBondContact O-CB 3.21Å; N543-R576 WeakPolarHBondContact O-CD 3.36Å; P573-R576 PolarHBondContact O-NH1 3.08Å; P573-R576 PolarHBondContact O-NH2 2.94Å; R576-F578 PolarHBondContact O-N 2.94Å; R576-S600 CarbonylContact O-C 3.57Å; R576-S600 WeakPolarHBondContact O-CB 3.37Å; R576-Q601 HydrophobicContact CB-CB 4.29Å; R576-Q601 PolarHBondContact O-N 2.63Å
577	F	97.3	Very high	93.6	Very high	49 Å²	49	33.8 Å²	33.8	22%	0.215	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.1	31.9	179.7	-47.7	-37.1	0	0	0	114.4	F43 P538 L539 N543 A544 G579 Q580 Q601	F43-F577 HydrophobicContact CE1-CD2 4.49Å; F43-F577 HydrophobicContact CE1-CE2 4.19Å; P538-F577 HydrophobicContact CB-CB 4.05Å; P538-F577 WeakPolarHBondContact O-CA 3.44Å; L539-F577 HydrophobicContact CD2-CD1 3.63Å; L539-F577 HydrophobicContact CD2-CE1 3.54Å; N543-F577 HydrophobicContact CB-CD1 4.15Å; N543-F577 HydrophobicContact CB-CE1 3.79Å; N543-F577 PolarHBondContact O-N 3.41Å; A544-F577 PolarHBondContact O-N 3.27Å; F577-G579 PolarHBondContact O-N 2.94Å; F577-Q580 HydrophobicContact CB-CB 4.24Å; F577-Q580 HydrophobicContact CB-CG 4.43Å; F577-Q580 WeakPolarHBondContact O-CB 3.33Å; F577-Q580 WeakPolarHBondContact O-CG 3.49Å; F577-Q580 PolarHBondContact O-N 3.01Å; F577-Q601 HydrophobicContact CD2-CB 3.95Å; F577-Q601 VanDerWaalsContact CE2-OE1 3.27Å
578	F	98	Very high	93.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	121.7	174.6	-178.9	-94.6	0	0	0	110.3	A544 G545 A546 V547 I566 F571 R576 V598 V605 L607	A544-F578 WeakPolarHBondContact O-CB 3.38Å; A544-F578 PolarHBondContact O-N 3.28Å; G545-F578 CarbonylContact C-O 3.57Å; G545-F578 WeakPolarHBondContact CA-O 3.39Å; A546-F578 PolarHBondContact N-O 3Å; V547-F578 HydrophobicContact CB-CE1 4.13Å; V547-F578 HydrophobicContact CG2-CD1 4.08Å; V547-F578 HydrophobicContact CG2-CE1 3.73Å; V547-F578 HydrophobicContact CG2-CZ 4.47Å; I566-F578 HydrophobicContact CG2-CE1 3.91Å; I566-F578 HydrophobicContact CG2-CZ 4Å; F571-F578 HydrophobicContact CD2-CE2 4.14Å; F571-F578 HydrophobicContact CD2-CZ 4.24Å; F571-F578 HydrophobicContact CE2-CE1 4.37Å; F571-F578 AromaticContact CE2-CE2 3.96Å; F571-F578 HydrophobicContact CE2-CE2 3.96Å; F571-F578 AromaticContact CE2-CZ 3.65Å; F571-F578 HydrophobicContact CE2-CZ 3.65Å; R576-F578 PolarHBondContact O-N 2.94Å; F578-V598 HydrophobicContact CD1-CG1 4.12Å; F578-V598 HydrophobicContact CD2-CB 4.39Å; F578-V598 HydrophobicContact CD2-CG1 3.75Å; F578-V598 HydrophobicContact CE1-CG1 3.89Å; F578-V598 HydrophobicContact CE2-CB 3.71Å; F578-V598 HydrophobicContact CE2-CG1 3.5Å; F578-V598 VanDerWaalsContact CE2-CG1 3.5Å; F578-V598 HydrophobicContact CE2-CG2 4.4Å; F578-V598 HydrophobicContact CG-CG1 4.05Å; F578-V598 HydrophobicContact CZ-CB 3.79Å; F578-V598 HydrophobicContact CZ-CG1 3.56Å; F578-V598 HydrophobicContact CZ-CG2 3.99Å; F578-V605 HydrophobicContact CD2-CG2 4.24Å; F578-V605 HydrophobicContact CE2-CB 4.05Å; F578-V605 HydrophobicContact CE2-CG2 3.88Å; F578-L607 HydrophobicContact CZ-CD1 4.45Å
579	G	97.3	Very high	92.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.7	12	-171.4	0	0	0	0	0	114.8	G536 F577 S581 V598 G599	G536-G579 WeakPolarHBondContact CA-O 3.23Å; F577-G579 PolarHBondContact O-N 2.94Å; G579-S581 PolarHBondContact O-N 3.04Å; G579-V598 VanDerWaalsContact N-CG1 3.34Å; G579-G599 PolarHBondContact N-O 3.15Å
580	Q	97.3	Very high	92.4	Very high	23 Å²	23	38.9 Å²	38.9	11%	0.107	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-15.4	172.5	69.2	-179.1	-0.4	0	0	113.9	G45 T518 P538 F577 G599 S600	G45-Q580 VanDerWaalsContact C-NE2 3.3Å; G45-Q580 PolarHBondContact O-NE2 3.35Å; T518-Q580 PolarHBondContact OG1-O 3.03Å; T518-Q580 VanDerWaalsContact OG1-O 3.09Å; P538-Q580 HydrophobicContact CB-CB 4.18Å; F577-Q580 HydrophobicContact CB-CB 4.24Å; F577-Q580 HydrophobicContact CB-CG 4.43Å; F577-Q580 WeakPolarHBondContact O-CB 3.33Å; F577-Q580 WeakPolarHBondContact O-CG 3.49Å; F577-Q580 PolarHBondContact O-N 3.01Å; Q580-G599 PolarHBondContact N-O 3.36Å; Q580-S600 PolarHBondContact NE2-O 3.31Å
581	S	98.1	Very high	92.1	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	149.6	164.7	50.5	0	0	0	0	109.6	G45 Y46 K47 V48 G579 G599	G45-S581 PolarHBondContact O-OG 2.85Å; Y46-S581 VanDerWaalsContact O-CB 3.24Å; Y46-S581 WeakPolarHBondContact O-CB 3.35Å; Y46-S581 PolarHBondContact O-OG 2.94Å; K47-S581 WeakPolarHBondContact CA-OG 3.25Å; V48-S581 PolarHBondContact N-OG 2.91Å; G579-S581 PolarHBondContact O-N 3.04Å; S581-G599 PolarHBondContact O-N 2.83Å
582	I	98.2	Very high	91.9	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	141.1	-176.6	-51	172.3	0	0	0	107.7	T518 A534 V547 I596 V597	T518-I582 HydrophobicContact CG2-CB 4.18Å; T518-I582 HydrophobicContact CG2-CD1 4.3Å; T518-I582 HydrophobicContact CG2-CG1 4.02Å; A534-I582 HydrophobicContact CB-CD1 4.08Å; A534-I582 HydrophobicContact CB-CG2 3.81Å; V547-I582 HydrophobicContact CG1-CD1 3.89Å; V547-I582 HydrophobicContact CG2-CD1 3.83Å; V547-I582 HydrophobicContact CG2-CG1 4.32Å; I582-I596 HydrophobicContact CG2-CG2 3.86Å; I582-V597 WeakPolarHBondContact CA-O 3.34Å
583	N	95.9	Very high	92	Very high	20 Å²	20	39.2 Å²	39.2	11%	0.107	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	143.2	164.8	179.7	-128.9	0	0	0	109.7	Q50 D585 V597	Q50-N583 WeakPolarHBondContact CB-OD1 3.26Å; Q50-N583 WeakPolarHBondContact CG-OD1 3.48Å; Q50-N583 PolarHBondContact N-OD1 3.47Å; N583-D585 PolarHBondContact ND2-OD2 3.45Å; N583-V597 PolarHBondContact N-O 2.75Å; N583-V597 PolarHBondContact O-N 2.99Å
584	G	93.7	Very high	92.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	63	-172.1	0	0	0	0	0	114	L522 S523 D595	L522-G584 CarbonylContact C-O 3.56Å; L522-G584 VanDerWaalsContact CA-O 3.27Å; L522-G584 WeakPolarHBondContact CA-O 3.46Å; L522-G584 WeakPolarHBondContact CB-O 3.49Å; S523-G584 PolarHBondContact N-O 3.37Å; G584-D595 WeakPolarHBondContact CA-O 3.36Å
585	D	88.5	Confident	92.4	Very high	64 Å²	64	33.6 Å²	33.6	34%	0.342	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-6.4	179.7	-58.6	-66.3	0	0	0	112.7	R531 N583	R531-D585 IonicContact NH2-OD1 2.63Å; R531-D585 PolarHBondContact NH2-OD1 3.09Å; N583-D585 PolarHBondContact ND2-OD2 3.45Å
586	I	90.1	Very high	92.6	Very high	29 Å²	29	33.3 Å²	33.3	15%	0.149	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	131.2	-163.7	-54.7	-173.4	0	0	0	111.5	Q50 K52 L588 D595	Q50-I586 HydrophobicContact CB-CB 4.22Å; Q50-I586 HydrophobicContact CB-CD1 3.92Å; Q50-I586 HydrophobicContact CB-CG1 4.2Å; Q50-I586 PolarHBondContact NE2-O 2.85Å; K52-I586 HydrophobicContact CB-CD1 4.05Å; K52-I586 HydrophobicContact CB-CG2 4.16Å; K52-I586 HydrophobicContact CD-CG2 3.84Å; I586-L588 HydrophobicContact CG2-CD2 4.15Å; I586-L588 PolarHBondContact O-N 2.8Å; I586-D595 PolarHBondContact O-N 2.97Å; I586-D595 VanDerWaalsContact O-N 3.1Å
587	D	91.1	Very high	92.7	Very high	26 Å²	26	29.1 Å²	29.1	14%	0.139	15%	0.147	C	C	.	.			trans	-59.4	112.1	158.3	139.6	52.8	0	0	0	109.7	K52 K57 G589 L593	K52-D587 IonicContact NZ-OD2 2.78Å; K57-D587 VanDerWaalsContact CD-O 3.31Å; K57-D587 WeakPolarHBondContact CD-O 3.25Å; K57-D587 WeakPolarHBondContact CE-O 3.36Å; K57-D587 PolarHBondContact NZ-O 2.86Å; K57-D587 IonicContact NZ-OD1 2.76Å; K57-D587 PolarHBondContact NZ-OD1 2.76Å; K57-D587 IonicContact NZ-OD2 2.78Å; K57-D587 PolarHBondContact NZ-OD2 3.04Å; D587-G589 VanDerWaalsContact OD1-C 3.28Å; D587-G589 WeakPolarHBondContact OD1-CA 3.43Å; D587-G589 PolarHBondContact OD1-N 2.94Å; D587-L593 VanDerWaalsContact CA-O 3.26Å; D587-L593 WeakPolarHBondContact CA-O 3.49Å; D587-L593 VanDerWaalsContact CB-O 3.31Å; D587-L593 WeakPolarHBondContact CB-O 3.47Å
588	L	89.1	Confident	92.7	Very high	17 Å²	17	26.8 Å²	26.8	9%	0.089	14%	0.136	C	C	.	.			trans	-100.4	5.3	170.4	-55.1	175.5	0	0	0	111.4	Q50 V59 I586 D595 V597 V606 R608	Q50-L588 HydrophobicContact CG-CD1 4.22Å; Q50-L588 HydrophobicContact CG-CD2 4.49Å; V59-L588 HydrophobicContact CG2-CD1 3.79Å; I586-L588 HydrophobicContact CG2-CD2 4.15Å; I586-L588 PolarHBondContact O-N 2.8Å; L588-D595 VanDerWaalsContact CA-OD2 3.25Å; L588-D595 WeakPolarHBondContact CA-OD2 3.08Å; L588-D595 HydrophobicContact CB-CB 4.31Å; L588-D595 VanDerWaalsContact CB-OD2 3.26Å; L588-D595 WeakPolarHBondContact CB-OD2 3.36Å; L588-D595 HydrophobicContact CD1-CB 4.35Å; L588-D595 HydrophobicContact CG-CB 4.25Å; L588-D595 PolarHBondContact N-OD2 3.04Å; L588-V597 HydrophobicContact CD1-CG2 3.9Å; L588-V606 HydrophobicContact CD1-CG1 4.08Å; L588-R608 PolarHBondContact O-NH1 2.83Å
589	G	84	Confident	92.7	Very high	12 Å²	12	26.8 Å²	26.8	12%	0.124	14%	0.136	C	C	.	.	S	Bend	trans	-99.9	-143.2	-177.4	0	0	0	0	0	112	K57 D587 D595 R608	K57-G589 WeakPolarHBondContact CE-O 3.29Å; K57-G589 PolarHBondContact NZ-O 2.93Å; D587-G589 VanDerWaalsContact OD1-C 3.28Å; D587-G589 WeakPolarHBondContact OD1-CA 3.43Å; D587-G589 PolarHBondContact OD1-N 2.94Å; G589-D595 PolarHBondContact N-OD2 3.46Å; G589-R608 VanDerWaalsContact CA-NH1 3.25Å
590	E	82.7	Confident	92.7	Very high	161 Å²	161	26.8 Å²	26.8	75%	0.752	14%	0.136	S	C	*	.	S	Bend	trans	-138.6	21.5	163.5	-64.4	-165.9	164.5	0	0	111.4	T660	E590-T660 PolarHBondContact O-OG1 2.96Å
591	D	86.4	Confident	92.7	Very high	42 Å²	42	27.2 Å²	27.2	23%	0.225	14%	0.138	C	C	.	.	S	Bend	trans	-98	-9.8	-177.6	46.8	35.7	0	0	0	113.7	L593 S659 T660	D591-L593 VanDerWaalsContact C-N 3.29Å; D591-L593 HydrophobicContact CB-CG 4.4Å; D591-L593 PolarHBondContact OD1-N 2.96Å; D591-S659 WeakPolarHBondContact O-CA 3.42Å; D591-S659 WeakPolarHBondContact O-CB 3.31Å; D591-T660 WeakPolarHBondContact CA-OG1 3.12Å; D591-T660 PolarHBondContact O-N 2.92Å; D591-T660 VanDerWaalsContact O-N 3.15Å
592	Q	87.4	Confident	92.5	Very high	132 Å²	132	27.4 Å²	27.4	62%	0.617	14%	0.141	S	C	*	.	S	Bend	trans	70.4	11.5	-171.5	-59.6	-179.9	89.1	0	0	115.2	T660	Q592-T660 HydrophobicContact CG-CG2 3.96Å
593	L	91	Very high	92.4	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-93.4	140.8	178.5	-58.3	178.5	0	0	0	111.2	D587 D591 D595 S609 P611 T657	D587-L593 VanDerWaalsContact CA-O 3.26Å; D587-L593 WeakPolarHBondContact CA-O 3.49Å; D587-L593 VanDerWaalsContact CB-O 3.31Å; D587-L593 WeakPolarHBondContact CB-O 3.47Å; D591-L593 VanDerWaalsContact C-N 3.29Å; D591-L593 HydrophobicContact CB-CG 4.4Å; D591-L593 PolarHBondContact OD1-N 2.96Å; L593-D595 PolarHBondContact O-N 3.23Å; L593-S609 VanDerWaalsContact CD1-O 3.24Å; L593-S609 WeakPolarHBondContact CD1-O 3.47Å; L593-P611 HydrophobicContact CD1-CG 3.9Å; L593-T657 HydrophobicContact CD2-CG2 4.33Å
594	P	92.5	Very high	92.4	Very high	15 Å²	15	26 Å²	26	10%	0.097	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-70.2	131.5	179	28.7	-35.1	0	0	0	111.6	D524 L525 S609	D524-P594 WeakPolarHBondContact O-CG 3.35Å; L525-P594 HydrophobicContact CD2-CB 4.43Å; L525-P594 HydrophobicContact CD2-CG 3.78Å; P594-S609 VanDerWaalsContact O-CB 3.29Å; P594-S609 WeakPolarHBondContact O-CB 3.42Å; P594-S609 PolarHBondContact O-OG 3.12Å
595	D	93.7	Very high	92.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	153.5	178.4	-66.6	-46.4	0	0	0	111.4	Q50 G584 I586 L588 G589 L593 V606 R608	Q50-D595 PolarHBondContact NE2-O 3.17Å; G584-D595 WeakPolarHBondContact CA-O 3.36Å; I586-D595 PolarHBondContact O-N 2.97Å; I586-D595 VanDerWaalsContact O-N 3.1Å; L588-D595 VanDerWaalsContact CA-OD2 3.25Å; L588-D595 WeakPolarHBondContact CA-OD2 3.08Å; L588-D595 HydrophobicContact CB-CB 4.31Å; L588-D595 VanDerWaalsContact CB-OD2 3.26Å; L588-D595 WeakPolarHBondContact CB-OD2 3.36Å; L588-D595 HydrophobicContact CD1-CB 4.35Å; L588-D595 HydrophobicContact CG-CB 4.25Å; L588-D595 PolarHBondContact N-OD2 3.04Å; G589-D595 PolarHBondContact N-OD2 3.46Å; L593-D595 PolarHBondContact O-N 3.23Å; D595-V606 HydrophobicContact CB-CG1 4.42Å; D595-R608 VanDerWaalsContact OD1-CA 3.27Å; D595-R608 WeakPolarHBondContact OD1-CA 3.37Å; D595-R608 WeakPolarHBondContact OD1-CD 3.32Å; D595-R608 IonicContact OD1-NH1 3.81Å; D595-R608 IonicContact OD2-CZ 2.6Å; D595-R608 IonicContact OD2-NH1 3.93Å; D595-R608 PolarHBondContact OD2-NH1 2.88Å
596	I	96.7	Very high	92.8	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122	178.2	-51.7	178.5	0	0	0	109.8	V28 L522 L525 I549 I582 V598 L607	V28-I596 HydrophobicContact CG1-CD1 4.36Å; V28-I596 HydrophobicContact CG2-CD1 3.73Å; L522-I596 HydrophobicContact CD1-CD1 3.78Å; L522-I596 HydrophobicContact CD1-CG1 4.4Å; L522-I596 HydrophobicContact CD2-CG1 4.43Å; L525-I596 HydrophobicContact CD1-CD1 4.15Å; I549-I596 HydrophobicContact CD1-CD1 3.77Å; I582-I596 HydrophobicContact CG2-CG2 3.86Å; I596-V598 HydrophobicContact CG2-CG2 4.06Å; I596-L607 PolarHBondContact N-O 3.09Å; I596-L607 PolarHBondContact O-N 2.95Å
597	V	96.9	Very high	93	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.3	170.9	-170.6	0	0	0	0	109.5	V48 Q50 V59 I582 N583 L588 A604 V605 V606	V48-V597 HydrophobicContact CB-CG1 3.79Å; V48-V597 HydrophobicContact CG1-CG1 4.04Å; V48-V597 HydrophobicContact CG2-CB 4.26Å; V48-V597 HydrophobicContact CG2-CG1 3.92Å; Q50-V597 HydrophobicContact CG-CG2 3.6Å; V59-V597 HydrophobicContact CG1-CG1 3.84Å; V59-V597 HydrophobicContact CG1-CG2 4.45Å; V59-V597 HydrophobicContact CG2-CG1 4.35Å; V59-V597 HydrophobicContact CG2-CG2 3.71Å; I582-V597 WeakPolarHBondContact CA-O 3.34Å; N583-V597 PolarHBondContact N-O 2.75Å; N583-V597 PolarHBondContact O-N 2.99Å; L588-V597 HydrophobicContact CD1-CG2 3.9Å; V597-A604 HydrophobicContact CG1-CB 4.34Å; V597-V605 CarbonylContact C-O 3.34Å; V597-V605 WeakPolarHBondContact CA-O 3.47Å; V597-V606 HydrophobicContact CG2-CG2 4.36Å
598	V	98.4	Very high	93.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.7	177.3	-175.7	0	0	0	0	110.6	V547 F578 G579 I596 V605 L607	V547-V598 HydrophobicContact CG2-CG1 3.71Å; V547-V598 HydrophobicContact CG2-CG2 4.12Å; F578-V598 HydrophobicContact CD1-CG1 4.12Å; F578-V598 HydrophobicContact CD2-CB 4.39Å; F578-V598 HydrophobicContact CD2-CG1 3.75Å; F578-V598 HydrophobicContact CE1-CG1 3.89Å; F578-V598 HydrophobicContact CE2-CB 3.71Å; F578-V598 HydrophobicContact CE2-CG1 3.5Å; F578-V598 VanDerWaalsContact CE2-CG1 3.5Å; F578-V598 HydrophobicContact CE2-CG2 4.4Å; F578-V598 HydrophobicContact CG-CG1 4.05Å; F578-V598 HydrophobicContact CZ-CB 3.79Å; F578-V598 HydrophobicContact CZ-CG1 3.56Å; F578-V598 HydrophobicContact CZ-CG2 3.99Å; G579-V598 VanDerWaalsContact N-CG1 3.34Å; I596-V598 HydrophobicContact CG2-CG2 4.06Å; V598-V605 PolarHBondContact N-O 3.44Å; V598-V605 PolarHBondContact O-N 2.94Å; V598-L607 HydrophobicContact CG2-CD1 4.18Å
599	G	98	Very high	93.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	145.3	171.4	0	0	0	0	0	112.7	G45 G579 Q580 S581	G45-G599 WeakPolarHBondContact O-CA 3.48Å; G579-G599 PolarHBondContact N-O 3.15Å; Q580-G599 PolarHBondContact N-O 3.36Å; S581-G599 PolarHBondContact O-N 2.83Å
600	S	97.3	Very high	93.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	164.9	176.9	68.3	0	0	0	0	109.3	G45 L575 R576 Q580 G602 A603	G45-S600 WeakPolarHBondContact CA-O 3.4Å; G45-S600 PolarHBondContact O-N 3.03Å; L575-S600 WeakPolarHBondContact CD2-OG 3.27Å; R576-S600 CarbonylContact O-C 3.57Å; R576-S600 WeakPolarHBondContact O-CB 3.37Å; Q580-S600 PolarHBondContact NE2-O 3.31Å; S600-G602 PolarHBondContact O-N 3.38Å; S600-A603 CarbonylContact C-O 3.52Å; S600-A603 PolarHBondContact N-O 2.96Å; S600-A603 PolarHBondContact O-N 2.76Å; S600-A603 PolarHBondContact OG-O 3.39Å
601	Q	96.3	Very high	93.8	Very high	32 Å²	32	16.6 Å²	16.6	15%	0.15	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	106.5	178.3	-169.3	-179.3	6.7	0	0	111.1	Q40 F43 R576 F577	Q40-Q601 HydrophobicContact CB-CG 4.27Å; Q40-Q601 WeakPolarHBondContact O-CG 3.37Å; Q40-Q601 PolarHBondContact O-NE2 2.78Å; F43-Q601 HydrophobicContact CD1-CG 4.49Å; R576-Q601 HydrophobicContact CB-CB 4.29Å; R576-Q601 PolarHBondContact O-N 2.63Å; F577-Q601 HydrophobicContact CD2-CB 3.95Å; F577-Q601 VanDerWaalsContact CE2-OE1 3.27Å
602	G	94.4	Very high	94.1	Very high	8 Å²	8	14.7 Å²	14.7	8%	0.082	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	0.9	-179.5	0	0	0	0	0	115	G38 F44 S600	G38-G602 PolarHBondContact N-O 2.72Å; F44-G602 PolarHBondContact O-N 2.82Å; S600-G602 PolarHBondContact O-N 3.38Å
603	A	95.6	Very high	94.2	Very high	2 Å²	2	8.5 Å²	8.5	2%	0.017	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	150.3	173.4	0	0	0	0	0	113.7	Y36 L575 S600	Y36-A603 CarbonylContact O-C 3.6Å; Y36-A603 VanDerWaalsContact O-CA 3.23Å; Y36-A603 WeakPolarHBondContact O-CA 3.41Å; L575-A603 HydrophobicContact CD2-CB 3.88Å; S600-A603 CarbonylContact C-O 3.52Å; S600-A603 PolarHBondContact N-O 2.96Å; S600-A603 PolarHBondContact O-N 2.76Å; S600-A603 PolarHBondContact OG-O 3.39Å
604	A	96.1	Very high	94.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.6	156.8	0	0	0	0	0	107.9	Y36 V48 V61 V597	Y36-A604 HydrophobicContact CD2-CB 4.45Å; Y36-A604 PolarHBondContact N-O 3.03Å; Y36-A604 PolarHBondContact O-N 2.78Å; V48-A604 HydrophobicContact CG1-CB 3.78Å; V61-A604 HydrophobicContact CG1-CB 4.17Å; V61-A604 HydrophobicContact CG2-CB 3.73Å; V597-A604 HydrophobicContact CG1-CB 4.34Å
605	V	96.2	Very high	94.2	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.8	-177.8	-169.2	0	0	0	0	108.4	P33 S34 F35 F578 V597 V598 L607	P33-V605 HydrophobicContact CB-CG1 3.83Å; S34-V605 CarbonylContact O-C 3.19Å; S34-V605 WeakPolarHBondContact O-CA 3.28Å; F35-V605 HydrophobicContact CD1-CG1 4.19Å; F35-V605 HydrophobicContact CD1-CG2 3.89Å; F35-V605 HydrophobicContact CE1-CG1 3.99Å; F35-V605 HydrophobicContact CE1-CG2 3.96Å; F578-V605 HydrophobicContact CD2-CG2 4.24Å; F578-V605 HydrophobicContact CE2-CB 4.05Å; F578-V605 HydrophobicContact CE2-CG2 3.88Å; V597-V605 CarbonylContact C-O 3.34Å; V597-V605 WeakPolarHBondContact CA-O 3.47Å; V598-V605 PolarHBondContact N-O 3.44Å; V598-V605 PolarHBondContact O-N 2.94Å; V605-L607 HydrophobicContact CG1-CD2 3.78Å; V605-L607 HydrophobicContact CG1-CG 4.48Å
606	V	95.1	Very high	94.2	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.006	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	122.2	174.4	-173.6	0	0	0	0	108.3	S34 Y36 V59 L588 D595 V597	S34-V606 PolarHBondContact N-O 3.37Å; S34-V606 PolarHBondContact O-N 3.21Å; Y36-V606 HydrophobicContact CD2-CG2 4.21Å; Y36-V606 HydrophobicContact CE2-CG2 3.65Å; V59-V606 HydrophobicContact CG2-CG2 4.37Å; L588-V606 HydrophobicContact CD1-CG1 4.08Å; D595-V606 HydrophobicContact CB-CG1 4.42Å; V597-V606 HydrophobicContact CG2-CG2 4.36Å
607	L	94.9	Very high	94	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.1	178.8	-53.2	179.3	0	0	0	108.5	V28 P33 I566 F571 F578 I596 V598 V605	V28-L607 HydrophobicContact CG1-CB 3.66Å; V28-L607 HydrophobicContact CG1-CD1 4.05Å; V28-L607 HydrophobicContact CG1-CG 4.49Å; P33-L607 HydrophobicContact CB-CD2 3.84Å; I566-L607 HydrophobicContact CD1-CD1 3.97Å; I566-L607 HydrophobicContact CG2-CD1 3.97Å; F571-L607 HydrophobicContact CE1-CD2 4.2Å; F571-L607 HydrophobicContact CE2-CD2 4.07Å; F571-L607 HydrophobicContact CZ-CD1 4.44Å; F571-L607 HydrophobicContact CZ-CD2 3.52Å; F578-L607 HydrophobicContact CZ-CD1 4.45Å; I596-L607 PolarHBondContact N-O 3.09Å; I596-L607 PolarHBondContact O-N 2.95Å; V598-L607 HydrophobicContact CG2-CD1 4.18Å; V605-L607 HydrophobicContact CG1-CD2 3.78Å; V605-L607 HydrophobicContact CG1-CG 4.48Å
608	R	91.8	Very high	93.8	Very high	71 Å²	71	18.4 Å²	18.4	27%	0.268	9%	0.087	S	C	.	.	P	Polyproline II helix	trans	-88.6	147.8	-179.7	-54.7	-57.4	-178.2	151.9	4.7	111.1	D29 L588 G589 D595	D29-R608 PolarHBondContact N-O 3Å; L588-R608 PolarHBondContact O-NH1 2.83Å; G589-R608 VanDerWaalsContact CA-NH1 3.25Å; D595-R608 VanDerWaalsContact OD1-CA 3.27Å; D595-R608 WeakPolarHBondContact OD1-CA 3.37Å; D595-R608 WeakPolarHBondContact OD1-CD 3.32Å; D595-R608 IonicContact OD1-NH1 3.81Å; D595-R608 IonicContact OD2-CZ 2.6Å; D595-R608 IonicContact OD2-NH1 3.93Å; D595-R608 PolarHBondContact OD2-NH1 2.88Å
609	S	91.6	Very high	93.6	Very high	6 Å²	6	19.6 Å²	19.6	4%	0.042	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-86.8	143.1	169	-71.7	0	0	0	0	110.7	L593 P594	L593-S609 VanDerWaalsContact CD1-O 3.24Å; L593-S609 WeakPolarHBondContact CD1-O 3.47Å; P594-S609 VanDerWaalsContact O-CB 3.29Å; P594-S609 WeakPolarHBondContact O-CB 3.42Å; P594-S609 PolarHBondContact O-OG 3.12Å
610	K	89.5	Confident	93.3	Very high	24 Å²	24	22.5 Å²	22.5	10%	0.104	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-93.4	148.1	169	-62.5	-172.1	178.1	-166.8	0	110.3	N27 D29 H735 E736 S738 I741	N27-K610 PolarHBondContact ND2-O 3.24Å; N27-K610 WeakPolarHBondContact O-CB 3.31Å; N27-K610 WeakPolarHBondContact O-CG 3.17Å; N27-K610 PolarHBondContact O-N 2.75Å; D29-K610 HydrophobicContact CB-CG 4.17Å; D29-K610 VanDerWaalsContact OD1-CE 3.29Å; D29-K610 WeakPolarHBondContact OD1-CE 3.41Å; D29-K610 IonicContact OD1-NZ 2.66Å; K610-H735 PolarHBondContact NZ-O 3.32Å; K610-E736 PolarHBondContact NZ-O 2.77Å; K610-S738 PolarHBondContact NZ-O 2.94Å; K610-I741 HydrophobicContact CB-CG1 4.15Å; K610-I741 HydrophobicContact CD-CD1 4.07Å; K610-I741 HydrophobicContact CD-CG1 4Å
611	P	91.1	Very high	92.8	Very high	10 Å²	10	25.1 Å²	25.1	7%	0.065	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-54.2	145	170.6	-21.6	28.4	0	0	0	112.4	L593 T657 P663 T739 A740 I741	L593-P611 HydrophobicContact CD1-CG 3.9Å; P611-T657 WeakPolarHBondContact CA-OG1 3.28Å; P611-P663 HydrophobicContact CB-CG 4Å; P611-P663 HydrophobicContact CG-CG 4.36Å; P611-T739 WeakPolarHBondContact CD-O 3.41Å; P611-A740 HydrophobicContact CB-CB 4.01Å; P611-A740 HydrophobicContact CG-CB 4.5Å; P611-A740 CarbonylContact O-C 3.55Å; P611-A740 WeakPolarHBondContact O-CA 3.35Å; P611-A740 WeakPolarHBondContact O-CB 3.34Å; P611-I741 PolarHBondContact O-N 2.98Å
612	V	91.8	Very high	92.3	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.2	179.2	-178.5	0	0	0	0	110	F26 N27 V656 T657 I741 N743	F26-V612 HydrophobicContact CZ-CG2 4.19Å; N27-V612 HydrophobicContact CB-CG2 3.68Å; V612-V656 HydrophobicContact CB-CG2 3.97Å; V612-V656 HydrophobicContact CG1-CG2 3.85Å; V612-V656 VanDerWaalsContact O-CG2 3.24Å; V612-V656 WeakPolarHBondContact O-CG2 3.33Å; V612-V656 PolarHBondContact O-N 3.03Å; V612-V656 VanDerWaalsContact O-N 3.09Å; V612-T657 HydrophobicContact CB-CG2 3.84Å; V612-T657 HydrophobicContact CG2-CG2 3.99Å; V612-T657 PolarHBondContact N-OG1 3.3Å; V612-I741 WeakPolarHBondContact CA-O 3.44Å; V612-N743 HydrophobicContact CG1-CB 3.6Å
613	L	90.6	Very high	91.8	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.8	-179.8	-69.4	162.9	0	0	0	109.5	M653 E655 P663 I665 A740 I741 N743	L613-M653 HydrophobicContact CD1-SD 4.11Å; L613-M653 HydrophobicContact CD2-CG 3.98Å; L613-M653 HydrophobicContact CD2-SD 4.11Å; L613-E655 HydrophobicContact CD2-CB 3.77Å; L613-E655 HydrophobicContact CD2-CG 4.15Å; L613-P663 HydrophobicContact CD1-CG 4.11Å; L613-P663 HydrophobicContact CD2-CG 4.29Å; L613-P663 HydrophobicContact CG-CG 4.37Å; L613-I665 HydrophobicContact CD1-CB 3.64Å; L613-I665 HydrophobicContact CD1-CD1 4.19Å; L613-I665 HydrophobicContact CD1-CG1 4.48Å; L613-I665 HydrophobicContact CD1-CG2 3.77Å; L613-A740 HydrophobicContact CD1-CB 3.63Å; L613-A740 HydrophobicContact CG-CB 4.21Å; L613-I741 PolarHBondContact N-O 2.88Å; L613-N743 PolarHBondContact O-N 2.78Å
614	D	90.8	Very high	90.9	Very high	54 Å²	54	38.4 Å²	38.4	29%	0.289	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	131.1	164.2	-172.8	36.2	0	0	0	109.9	V654 V656 N743 S746	D614-V654 PolarHBondContact N-O 3.35Å; D614-V654 PolarHBondContact O-N 3.36Å; D614-V656 HydrophobicContact CB-CG1 4.4Å; D614-N743 HydrophobicContact CB-CB 4.38Å; D614-S746 WeakPolarHBondContact OD1-CA 3.48Å; D614-S746 VanDerWaalsContact OD1-CB 3.25Å; D614-S746 WeakPolarHBondContact OD1-CB 3.48Å; D614-S746 PolarHBondContact OD1-OG 2.97Å
615	V	91.6	Very high	90.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.1	178.8	-176.7	0	0	0	0	109.9	F651 E652 M653 I665 L700 F730 L742 S746	V615-F651 HydrophobicContact CG1-CB 4.12Å; V615-F651 HydrophobicContact CG1-CD1 4.16Å; V615-E652 CarbonylContact C-O 3.54Å; V615-E652 VanDerWaalsContact CA-O 3.32Å; V615-E652 WeakPolarHBondContact CA-O 3.24Å; V615-M653 HydrophobicContact CG2-CB 4.41Å; V615-M653 HydrophobicContact CG2-CG 4.1Å; V615-I665 HydrophobicContact CG2-CG2 4.49Å; V615-L700 HydrophobicContact CG1-CD1 4.06Å; V615-F730 HydrophobicContact CB-CE2 3.95Å; V615-F730 HydrophobicContact CB-CZ 3.71Å; V615-F730 HydrophobicContact CG1-CE1 4.36Å; V615-F730 HydrophobicContact CG1-CE2 3.87Å; V615-F730 HydrophobicContact CG1-CZ 3.56Å; V615-F730 WeakPolarHBondContact O-CZ 3.35Å; V615-L742 HydrophobicContact CB-CD1 3.66Å; V615-L742 HydrophobicContact CG2-CD1 3.67Å; V615-S746 PolarHBondContact N-OG 3.25Å
616	K	93.3	Very high	89.5	Confident	78 Å²	78	41.4 Å²	41.4	34%	0.339	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.3	-179.3	-179.1	170.9	-176.4	127.6	0	110.7	F651 E652 Q747	K616-F651 WeakPolarHBondContact O-CA 3.27Å; K616-E652 HydrophobicContact CB-CB 4.42Å; K616-E652 PolarHBondContact N-O 2.93Å; K616-E652 PolarHBondContact O-N 3.09Å; K616-Q747 HydrophobicContact CG-CB 4.36Å
617	A	92.9	Very high	88.8	Confident	9 Å²	9	43 Å²	43	7%	0.074	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	137.7	173.4	0	0	0	0	0	111.9	F651 L728 F730 A750	A617-F651 HydrophobicContact CB-CD1 4.12Å; A617-F651 HydrophobicContact CB-CE1 4.01Å; A617-L728 HydrophobicContact CB-CD2 3.65Å; A617-F730 HydrophobicContact CB-CD1 3.87Å; A617-F730 HydrophobicContact CB-CE1 3.66Å; A617-A750 HydrophobicContact CB-CB 4.14Å
618	K	93.6	Very high	87.9	Confident	86 Å²	86	45 Å²	45	37%	0.374	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142	170.4	-67.9	179.6	178.6	171.7	0	109.8	A649 C650 E652	K618-A649 WeakPolarHBondContact O-CA 3.29Å; K618-C650 HydrophobicContact CB-CB 4.4Å; K618-C650 PolarHBondContact N-O 2.89Å; K618-C650 PolarHBondContact O-N 3.31Å; K618-E652 VanDerWaalsContact CE-CD 3.46Å; K618-E652 WeakPolarHBondContact CE-OE2 3.34Å; K618-E652 IonicContact NZ-OE1 3.71Å; K618-E652 PolarHBondContact NZ-OE1 2.82Å; K618-E652 IonicContact NZ-OE2 3.32Å; K618-E652 PolarHBondContact NZ-OE2 3.29Å
619	L	93.1	Very high	86.9	Confident	26 Å²	26	48 Å²	48	14%	0.136	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.9	167.3	-78.9	173.8	0	0	0	108.9	A649 I726 L728 A750 V752	L619-A649 HydrophobicContact CD2-CB 3.98Å; L619-I726 HydrophobicContact CD1-CG2 4.31Å; L619-L728 HydrophobicContact CD1-CB 3.76Å; L619-L728 HydrophobicContact CD2-CB 4.18Å; L619-L728 HydrophobicContact CD2-CD1 3.92Å; L619-L728 HydrophobicContact CG-CB 4.02Å; L619-L728 HydrophobicContact CG-CD1 4.26Å; L619-A750 HydrophobicContact CB-CB 4.29Å; L619-A750 HydrophobicContact CD1-CB 4.05Å; L619-A750 HydrophobicContact CG-CB 3.88Å; L619-V752 HydrophobicContact CB-CB 4.33Å; L619-V752 HydrophobicContact CB-CG1 4.03Å; L619-V752 HydrophobicContact CD1-CG1 4.26Å
620	S	91.3	Very high	85.7	Confident	61 Å²	61	53 Å²	53	43%	0.427	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	164.3	165.5	66	0	0	0	0	110.1	I647 T648	S620-I647 WeakPolarHBondContact O-CA 3.36Å; S620-T648 PolarHBondContact N-O 2.96Å; S620-T648 PolarHBondContact O-N 3.24Å
621	F	87.9	Confident	85	Confident	54 Å²	54	53.2 Å²	53.2	24%	0.237	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	150.9	-177.2	68.9	-78.2	0	0	0	110.9	P623 S624 N646 I647 V752 V754	F621-P623 VanDerWaalsContact CD2-O 3.28Å; F621-P623 WeakPolarHBondContact CD2-O 3.35Å; F621-S624 WeakPolarHBondContact CE2-O 3.29Å; F621-N646 WeakPolarHBondContact CA-O 3.45Å; F621-I647 HydrophobicContact CB-CG2 4.03Å; F621-V752 HydrophobicContact CD1-CG1 4.39Å; F621-V752 HydrophobicContact CD1-CG2 3.53Å; F621-V752 HydrophobicContact CE1-CG2 3.48Å; F621-V752 VanDerWaalsContact CE1-CG2 3.48Å; F621-V754 HydrophobicContact CB-CG2 4.19Å; F621-V754 HydrophobicContact CD1-CG2 4.21Å; F621-V754 HydrophobicContact CD2-CB 4.21Å; F621-V754 HydrophobicContact CD2-CG1 3.67Å; F621-V754 HydrophobicContact CD2-CG2 3.72Å; F621-V754 HydrophobicContact CE2-CB 4.19Å; F621-V754 HydrophobicContact CE2-CG1 3.71Å; F621-V754 HydrophobicContact CE2-CG2 4.06Å; F621-V754 HydrophobicContact CG-CG2 3.79Å; F621-V754 HydrophobicContact CZ-CG2 4.45Å
622	Y	84.6	Confident	83.9	Confident	180 Å²	180	55.3 Å²	55.3	71%	0.706	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.9	133.6	178.9	-178	-91.6	0	0	0	110.5	T645 N646	Y622-T645 PolarHBondContact O-OG1 2.75Å; Y622-N646 PolarHBondContact N-O 2.79Å; Y622-N646 PolarHBondContact O-N 2.79Å
623	P	85.2	Confident	82.8	Confident	53 Å²	53	58.3 Å²	58.3	34%	0.344	31%	0.306	S	S	.	.	S	Bend	cis	-68.8	166.8	-1	29.6	-36.4	0	0	0	113.8	F621 V625	F621-P623 VanDerWaalsContact CD2-O 3.28Å; F621-P623 WeakPolarHBondContact CD2-O 3.35Å; P623-V625 WeakPolarHBondContact CG-O 3.36Å; P623-V625 PolarHBondContact O-N 3.25Å
624	S	75.6	Confident	81.5	Confident	88 Å²	88	65.5 Å²	65.5	62%	0.615	34%	0.343	S	S	*	.	S	Bend	trans	-73	-5.2	-176	54.6	0	0	0	0	115.3	F621	F621-S624 WeakPolarHBondContact CE2-O 3.29Å
625	V	80	Confident	80	Confident	64 Å²	64	66.9 Å²	66.9	39%	0.388	35%	0.351	S	S	.	.	S	Bend	trans	-142.6	145.4	169.1	-65	0	0	0	0	109.2	P623 S627 P755	P623-V625 WeakPolarHBondContact CG-O 3.36Å; P623-V625 PolarHBondContact O-N 3.25Å; V625-S627 PolarHBondContact O-N 3.24Å; V625-P755 CarbonylContact C-O 3.59Å; V625-P755 WeakPolarHBondContact CA-O 3.39Å; V625-P755 HydrophobicContact CG1-CG 4.22Å
626	I	84	Confident	78.3	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-77.5	119.5	168.1	-63.3	152.1	0	0	0	108.5	I628 M644 M713 V724 V754 P755 F756 E757	I626-I628 PolarHBondContact O-N 2.79Å; I626-M644 HydrophobicContact CG2-CB 4.17Å; I626-M644 HydrophobicContact CG2-CE 3.79Å; I626-M713 HydrophobicContact CD1-CE 3.71Å; I626-M713 HydrophobicContact CD1-SD 4.45Å; I626-M713 HydrophobicContact CG1-CE 4.37Å; I626-V724 HydrophobicContact CD1-CB 4.3Å; I626-V724 HydrophobicContact CD1-CG2 3.89Å; I626-V754 HydrophobicContact CD1-CB 4.23Å; I626-V754 HydrophobicContact CD1-CG1 3.52Å; I626-V754 HydrophobicContact CG1-CG1 3.65Å; I626-P755 PolarHBondContact N-O 3.28Å; I626-F756 HydrophobicContact CB-CD1 3.72Å; I626-F756 HydrophobicContact CB-CE1 4.03Å; I626-F756 HydrophobicContact CB-CG 4.34Å; I626-F756 HydrophobicContact CD1-CD1 4.28Å; I626-F756 HydrophobicContact CD1-CE1 4.02Å; I626-F756 HydrophobicContact CD1-CE2 4.41Å; I626-F756 HydrophobicContact CD1-CZ 4.09Å; I626-F756 HydrophobicContact CG2-CD1 3.57Å; I626-F756 HydrophobicContact CG2-CE1 3.58Å; I626-F756 WeakPolarHBondContact O-CA 3.24Å; I626-E757 WeakPolarHBondContact O-CB 3.42Å; I626-E757 PolarHBondContact O-N 2.94Å
627	S	79.1	Confident	76.5	Confident	35 Å²	35	78.1 Å²	78.1	25%	0.245	41%	0.408	C	S	.	.			trans	-57.7	131.5	171.8	174.6	0	0	0	0	110.7	V625 Q629 M644	V625-S627 PolarHBondContact O-N 3.24Å; S627-Q629 VanDerWaalsContact C-N 3.34Å; S627-Q629 WeakPolarHBondContact OG-CB 3.47Å; S627-Q629 PolarHBondContact OG-N 2.88Å; S627-M644 VanDerWaalsContact O-CE 3.27Å; S627-M644 WeakPolarHBondContact O-CE 3.48Å
628	I	76	Confident	74.9	Confident	41 Å²	41	84.5 Å²	84.5	21%	0.21	44%	0.437	C	S	.	.	S	Bend	trans	-90.9	-2.6	172.5	62.6	165.5	0	0	0	112.4	I626 E630 I631 T720 F756 E757 R759	I626-I628 PolarHBondContact O-N 2.79Å; I628-E630 VanDerWaalsContact C-N 3.33Å; I628-E630 PolarHBondContact O-N 3.12Å; I628-I631 PolarHBondContact O-N 3Å; I628-T720 HydrophobicContact CG2-CG2 4.48Å; I628-F756 HydrophobicContact CG2-CB 3.97Å; I628-F756 HydrophobicContact CG2-CD1 4.05Å; I628-F756 HydrophobicContact CG2-CG 4.44Å; I628-E757 HydrophobicContact CG1-CB 4.15Å; I628-E757 HydrophobicContact CG1-CG 4.27Å; I628-E757 WeakPolarHBondContact CG1-OE2 3.45Å; I628-E757 HydrophobicContact CG2-CB 4.29Å; I628-E757 PolarHBondContact N-OE2 3.27Å; I628-R759 HydrophobicContact CD1-CG 4.35Å
629	Q	71.2	Confident	73.5	Confident	135 Å²	135	85.9 Å²	85.9	63%	0.631	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-26.9	-171.1	-51.5	-177	21	0	0	112.8	S627 E757	S627-Q629 VanDerWaalsContact C-N 3.34Å; S627-Q629 WeakPolarHBondContact OG-CB 3.47Å; S627-Q629 PolarHBondContact OG-N 2.88Å; Q629-E757 WeakPolarHBondContact CG-OE2 3.41Å; Q629-E757 PolarHBondContact NE2-OE1 3.45Å
630	E	66.8	Low	72.4	Confident	111 Å²	111	91.1 Å²	91.1	52%	0.519	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-9.4	179.3	-60.7	-175.8	-162.6	0	0	113.1	I628 N632 L642	I628-E630 VanDerWaalsContact C-N 3.33Å; I628-E630 PolarHBondContact O-N 3.12Å; E630-N632 PolarHBondContact O-N 3.29Å; E630-L642 HydrophobicContact CB-CD1 4.26Å
631	I	74	Confident	71.8	Confident	28 Å²	28	90 Å²	90	14%	0.144	46%	0.461	C	S	.	.			trans	-85.4	102	179.8	-56.5	174.3	0	0	0	108.8	I628 M644 K715 I717 T720 F756	I628-I631 PolarHBondContact O-N 3Å; I631-M644 HydrophobicContact CD1-CE 4.43Å; I631-M644 HydrophobicContact CG1-CE 4.19Å; I631-K715 CarbonylContact C-O 3.58Å; I631-K715 WeakPolarHBondContact CA-O 3.43Å; I631-I717 HydrophobicContact CD1-CD1 3.89Å; I631-I717 HydrophobicContact CD1-CG1 4.42Å; I631-I717 HydrophobicContact CG1-CD1 4.44Å; I631-I717 HydrophobicContact CG2-CB 4.03Å; I631-I717 HydrophobicContact CG2-CG1 4.13Å; I631-T720 HydrophobicContact CD1-CG2 3.75Å; I631-T720 HydrophobicContact CG2-CG2 4.25Å; I631-F756 HydrophobicContact CD1-CD1 4.16Å; I631-F756 HydrophobicContact CD1-CE1 3.84Å
632	N	68.4	Low	71.5	Confident	54 Å²	54	90.1 Å²	90.1	29%	0.289	46%	0.464	S	S	.	.			trans	-131.1	103.2	-177.3	-179.5	19.4	0	0	0	112.4	E630 L634 D635 K715	E630-N632 PolarHBondContact O-N 3.29Å; N632-L634 PolarHBondContact O-N 3.22Å; N632-L634 VanDerWaalsContact OD1-CB 3.31Å; N632-L634 WeakPolarHBondContact OD1-CB 3.17Å; N632-L634 PolarHBondContact OD1-N 3.27Å; N632-D635 PolarHBondContact ND2-OD2 2.7Å; N632-K715 PolarHBondContact N-O 2.79Å
633	C	68.7	Low	71.6	Confident	65 Å²	65	85.6 Å²	85.6	44%	0.439	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	3.7	175.4	-66.7	0	0	0	0	115.3	C716	C633-C716 HydrophobicContact CB-CB 3.87Å; C633-C716 WeakPolarHBondContact CB-SG 3.42Å; C633-C716 WeakPolarHBondContact SG-CA 3.33Å; C633-C716 WeakPolarHBondContact SG-CB 3.42Å; C633-C716 CovalentContact SG-SG 2.04Å; C633-C716 PolarHBondContact SG-SG 3.12Å
634	L	63.7	Low	71.6	Confident	154 Å²	154	84.1 Å²	84.1	81%	0.806	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-24.4	-179.8	-58.2	174.7	0	0	0	113.3	N632	N632-L634 PolarHBondContact O-N 3.22Å; N632-L634 VanDerWaalsContact OD1-CB 3.31Å; N632-L634 WeakPolarHBondContact OD1-CB 3.17Å; N632-L634 PolarHBondContact OD1-N 3.27Å
635	D	59.3	Low	72.2	Confident	82 Å²	82	80.1 Å²	80.1	44%	0.439	42%	0.417	S	S	.	.			trans	-75.9	138.2	173.3	-76.8	-35.2	0	0	0	110.9	N632 K715	N632-D635 PolarHBondContact ND2-OD2 2.7Å; D635-K715 WeakPolarHBondContact OD2-CE 3.31Å; D635-K715 IonicContact OD2-NZ 3.92Å; D635-K715 PolarHBondContact OD2-NZ 2.89Å
636	K	55.6	Low	72.7	Confident	207 Å²	207	80.9 Å²	80.9	90%	0.9	42%	0.42	S	S	*	.			trans	-116.4	14.7	178.4	-64	-171.4	177.4	-177.4	0	113.9
637	T	56.3	Low	73.2	Confident	107 Å²	107	81 Å²	81	66%	0.656	42%	0.42	S	S	*	.	S	Bend	trans	-90.1	134.3	174.2	43.1	0	0	0	0	109.8
638	E	58.8	Low	73.9	Confident	144 Å²	144	80.9 Å²	80.9	67%	0.673	42%	0.418	S	S	*	.			trans	4.4	111.1	-176.2	-65.5	-172.1	150.4	0	0	117.2	K640	E638-K640 PolarHBondContact O-N 3.26Å; E638-K640 VanDerWaalsContact OE2-CE 3.28Å; E638-K640 WeakPolarHBondContact OE2-CE 3.46Å; E638-K640 IonicContact OE2-NZ 2.69Å; E638-K640 PolarHBondContact OE2-NZ 2.92Å
639	D	63.1	Low	74.8	Confident	115 Å²	115	78.9 Å²	78.9	62%	0.615	41%	0.408	S	S	*	.			trans	-65.3	65.6	167.8	-87.6	-60	0	0	0	111.9
640	K	71.7	Confident	75.9	Confident	135 Å²	135	73.1 Å²	73.1	59%	0.587	38%	0.382	S	S	*	.			trans	-78.9	126.7	167	-84.3	169.5	174	155.4	0	108.7	E638	E638-K640 PolarHBondContact O-N 3.26Å; E638-K640 VanDerWaalsContact OE2-CE 3.28Å; E638-K640 WeakPolarHBondContact OE2-CE 3.46Å; E638-K640 IonicContact OE2-NZ 2.69Å; E638-K640 PolarHBondContact OE2-NZ 2.92Å
641	P	77.8	Confident	77.2	Confident	37 Å²	37	67.8 Å²	67.8	24%	0.24	36%	0.357	C	S	.	.			trans	-59.2	144.3	176.1	-26.4	35.7	0	0	0	112.9	F683 I685 M713	P641-F683 HydrophobicContact CB-CE2 3.49Å; P641-F683 VanDerWaalsContact CB-CE2 3.49Å; P641-F683 HydrophobicContact CB-CZ 3.59Å; P641-F683 HydrophobicContact CG-CE2 3.5Å; P641-F683 HydrophobicContact CG-CZ 3.58Å; P641-I685 HydrophobicContact CB-CD1 4.19Å; P641-M713 WeakPolarHBondContact CA-O 3.36Å
642	L	82.6	Confident	78.1	Confident	57 Å²	57	69.4 Å²	69.4	30%	0.298	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.5	172.5	-64.4	175.1	0	0	0	109.8	E630 M644 S712 M713	E630-L642 HydrophobicContact CB-CD1 4.26Å; L642-M644 HydrophobicContact CB-SD 3.97Å; L642-M644 PolarHBondContact O-N 2.78Å; L642-S712 CarbonylContact O-C 3.53Å; L642-S712 WeakPolarHBondContact O-CA 3.43Å; L642-M713 PolarHBondContact N-O 3.24Å; L642-M713 PolarHBondContact O-N 2.84Å
643	P	86.3	Confident	79.2	Confident	86 Å²	86	67.7 Å²	67.7	56%	0.558	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	103.7	175	29.6	-32.8	0	0	0	110.2
644	M	84.1	Confident	80.2	Confident	21 Å²	21	68.9 Å²	68.9	10%	0.103	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-27.5	-170.5	-62.5	-55.6	-64	0	0	113.9	I626 S627 I631 L642 I711 M713	I626-M644 HydrophobicContact CG2-CB 4.17Å; I626-M644 HydrophobicContact CG2-CE 3.79Å; S627-M644 VanDerWaalsContact O-CE 3.27Å; S627-M644 WeakPolarHBondContact O-CE 3.48Å; I631-M644 HydrophobicContact CD1-CE 4.43Å; I631-M644 HydrophobicContact CG1-CE 4.19Å; L642-M644 HydrophobicContact CB-SD 3.97Å; L642-M644 PolarHBondContact O-N 2.78Å; M644-I711 PolarHBondContact N-O 3.17Å; M644-M713 HydrophobicContact CB-CE 4.22Å; M644-M713 HydrophobicContact CB-CG 3.99Å; M644-M713 HydrophobicContact CB-SD 4.09Å; M644-M713 HydrophobicContact CG-CB 3.66Å; M644-M713 HydrophobicContact CG-CG 3.55Å; M644-M713 HydrophobicContact CG-SD 3.94Å
645	T	88.1	Confident	81.4	Confident	4 Å²	4	63.6 Å²	63.6	3%	0.025	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	147.9	178.6	-173.1	0	0	0	0	110.3	Y622 I711	Y622-T645 PolarHBondContact O-OG1 2.75Å; T645-I711 HydrophobicContact CG2-CB 4Å; T645-I711 HydrophobicContact CG2-CD1 4.48Å; T645-I711 PolarHBondContact N-O 2.88Å; T645-I711 PolarHBondContact O-N 2.94Å
646	N	91.2	Very high	82.9	Confident	81 Å²	81	61.4 Å²	61.4	43%	0.433	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	152.3	164.4	-66.7	-20.8	0	0	0	109.7	F621 Y622 Y709 S710	F621-N646 WeakPolarHBondContact CA-O 3.45Å; Y622-N646 PolarHBondContact N-O 2.79Å; Y622-N646 PolarHBondContact O-N 2.79Å; N646-Y709 CarbonylContact C-O 3.54Å; N646-Y709 WeakPolarHBondContact CA-O 3.16Å; N646-S710 WeakPolarHBondContact OD1-CA 3.47Å; N646-S710 VanDerWaalsContact OD1-CB 3.25Å; N646-S710 WeakPolarHBondContact OD1-CB 3.38Å; N646-S710 PolarHBondContact OD1-OG 2.99Å
647	I	93.4	Very high	84.4	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.3	168.3	59.9	167.2	0	0	0	110.1	S620 F621 I671 F684 N708 Y709 I711 I726	S620-I647 WeakPolarHBondContact O-CA 3.36Å; F621-I647 HydrophobicContact CB-CG2 4.03Å; I647-I671 HydrophobicContact CD1-CD1 4.12Å; I647-I671 HydrophobicContact CD1-CG2 3.87Å; I647-F684 HydrophobicContact CD1-CE1 4.08Å; I647-F684 HydrophobicContact CD1-CZ 4.18Å; I647-N708 WeakPolarHBondContact O-CA 3.45Å; I647-Y709 HydrophobicContact CD1-CD2 4.39Å; I647-Y709 HydrophobicContact CG1-CD2 4.37Å; I647-Y709 PolarHBondContact N-O 3.08Å; I647-Y709 PolarHBondContact O-N 2.94Å; I647-I711 HydrophobicContact CD1-CD1 4.17Å; I647-I711 HydrophobicContact CG1-CD1 4.4Å; I647-I711 HydrophobicContact CG2-CD1 3.9Å; I647-I726 HydrophobicContact CD1-CG2 4.18Å; I647-I726 HydrophobicContact CG2-CD1 3.69Å
648	T	94.8	Very high	85.5	Confident	33 Å²	33	53.5 Å²	53.5	20%	0.202	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.1	171.5	-51.9	0	0	0	0	108.3	S620 C706 F707 N708	S620-T648 PolarHBondContact N-O 2.96Å; S620-T648 PolarHBondContact O-N 3.24Å; T648-C706 HydrophobicContact CG2-CB 3.92Å; T648-F707 WeakPolarHBondContact CA-O 3.39Å; T648-N708 WeakPolarHBondContact CB-OD1 3.37Å; T648-N708 WeakPolarHBondContact CG2-OD1 3.4Å; T648-N708 PolarHBondContact OG1-OD1 2.82Å
649	A	94.8	Very high	86.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.2	172.2	0	0	0	0	0	108.3	K618 L619 F651 I671 C706 F707 Y709 L728	K618-A649 WeakPolarHBondContact O-CA 3.29Å; L619-A649 HydrophobicContact CD2-CB 3.98Å; A649-F651 HydrophobicContact CB-CE2 4.49Å; A649-I671 HydrophobicContact CB-CD1 3.82Å; A649-C706 CarbonylContact O-C 3.43Å; A649-C706 WeakPolarHBondContact O-CA 3.35Å; A649-F707 PolarHBondContact N-O 3.33Å; A649-F707 PolarHBondContact O-N 2.88Å; A649-Y709 HydrophobicContact CB-CE2 4.45Å; A649-L728 HydrophobicContact CB-CD1 3.62Å
650	C	94.1	Very high	87	Confident	13 Å²	13	45.9 Å²	45.9	9%	0.088	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.8	177.5	-64.1	0	0	0	0	110.5	K618 E704 T705 C706	K618-C650 HydrophobicContact CB-CB 4.4Å; K618-C650 PolarHBondContact N-O 2.89Å; K618-C650 PolarHBondContact O-N 3.31Å; C650-E704 HydrophobicContact CB-CG 4.42Å; C650-T705 CarbonylContact C-O 3.56Å; C650-T705 WeakPolarHBondContact CA-O 3.2Å; C650-C706 HydrophobicContact CB-CB 4.15Å; C650-C706 WeakPolarHBondContact CB-SG 3.37Å; C650-C706 WeakPolarHBondContact SG-CB 3.45Å; C650-C706 CovalentContact SG-SG 2.04Å; C650-C706 PolarHBondContact SG-SG 2.92Å
651	F	94.9	Very high	86.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.2	173.7	-60.5	-92.9	0	0	0	107.9	V615 K616 A617 A649 I667 F669 L700 E704 T705 F707 L728 F730	V615-F651 HydrophobicContact CG1-CB 4.12Å; V615-F651 HydrophobicContact CG1-CD1 4.16Å; K616-F651 WeakPolarHBondContact O-CA 3.27Å; A617-F651 HydrophobicContact CB-CD1 4.12Å; A617-F651 HydrophobicContact CB-CE1 4.01Å; A649-F651 HydrophobicContact CB-CE2 4.49Å; F651-I667 HydrophobicContact CD1-CD1 3.48Å; F651-I667 VanDerWaalsContact CD1-CD1 3.48Å; F651-I667 HydrophobicContact CD2-CD1 4.33Å; F651-I667 HydrophobicContact CE1-CD1 3.48Å; F651-I667 VanDerWaalsContact CE1-CD1 3.48Å; F651-I667 HydrophobicContact CE2-CD1 4.33Å; F651-I667 HydrophobicContact CG-CD1 3.92Å; F651-I667 HydrophobicContact CZ-CD1 3.93Å; F651-F669 HydrophobicContact CE1-CB 4.29Å; F651-F669 HydrophobicContact CE1-CD1 4.49Å; F651-F669 HydrophobicContact CE1-CG 4.46Å; F651-F669 AromaticContact CE2-CD1 3.77Å; F651-F669 HydrophobicContact CE2-CD1 3.77Å; F651-F669 HydrophobicContact CE2-CD2 4.31Å; F651-F669 AromaticContact CE2-CE1 3.71Å; F651-F669 HydrophobicContact CE2-CE1 3.71Å; F651-F669 HydrophobicContact CE2-CE2 4.27Å; F651-F669 HydrophobicContact CE2-CG 4.06Å; F651-F669 AromaticContact CE2-CZ 3.97Å; F651-F669 HydrophobicContact CE2-CZ 3.97Å; F651-F669 HydrophobicContact CZ-CB 3.74Å; F651-F669 AromaticContact CZ-CD1 3.55Å; F651-F669 HydrophobicContact CZ-CD1 3.55Å; F651-F669 AromaticContact CZ-CD2 3.93Å; F651-F669 HydrophobicContact CZ-CD2 3.93Å; F651-F669 AromaticContact CZ-CE1 4Å; F651-F669 HydrophobicContact CZ-CE1 4Å; F651-F669 HydrophobicContact CZ-CE2 4.35Å; F651-F669 AromaticContact CZ-CG 3.5Å; F651-F669 HydrophobicContact CZ-CG 3.5Å; F651-F669 VanDerWaalsContact CZ-CG 3.5Å; F651-F669 HydrophobicContact CZ-CZ 4.37Å; F651-L700 HydrophobicContact CB-CD1 3.83Å; F651-L700 HydrophobicContact CB-CD2 4.47Å; F651-L700 HydrophobicContact CG-CD1 4.37Å; F651-E704 VanDerWaalsContact O-CA 3.31Å; F651-E704 WeakPolarHBondContact O-CA 3.32Å; F651-T705 PolarHBondContact N-O 3.35Å; F651-T705 PolarHBondContact O-N 3.11Å; F651-F707 HydrophobicContact CD2-CD2 4.02Å; F651-F707 AromaticContact CD2-CE2 3.77Å; F651-F707 HydrophobicContact CD2-CE2 3.77Å; F651-F707 AromaticContact CE2-CD2 3.85Å; F651-F707 HydrophobicContact CE2-CD2 3.85Å; F651-F707 AromaticContact CE2-CE2 3.89Å; F651-F707 HydrophobicContact CE2-CE2 3.89Å; F651-L728 HydrophobicContact CE1-CD1 4.5Å; F651-L728 HydrophobicContact CE1-CD2 4.11Å; F651-L728 HydrophobicContact CZ-CD1 3.91Å; F651-L728 HydrophobicContact CZ-CD2 4.2Å; F651-F730 HydrophobicContact CD1-CD1 4.15Å; F651-F730 HydrophobicContact CD1-CE1 4.18Å; F651-F730 HydrophobicContact CE1-CB 4.12Å; F651-F730 AromaticContact CE1-CD1 3.65Å; F651-F730 HydrophobicContact CE1-CD1 3.65Å; F651-F730 HydrophobicContact CE1-CE1 4.14Å; F651-F730 AromaticContact CE1-CG 3.92Å; F651-F730 HydrophobicContact CE1-CG 3.92Å
652	E	93.1	Very high	85.8	Confident	61 Å²	61	45.4 Å²	45.4	29%	0.285	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133	169.7	-66.6	176.5	148.9	0	0	108.6	V615 K616 K618 K703 E704	V615-E652 CarbonylContact C-O 3.54Å; V615-E652 VanDerWaalsContact CA-O 3.32Å; V615-E652 WeakPolarHBondContact CA-O 3.24Å; K616-E652 HydrophobicContact CB-CB 4.42Å; K616-E652 PolarHBondContact N-O 2.93Å; K616-E652 PolarHBondContact O-N 3.09Å; K618-E652 VanDerWaalsContact CE-CD 3.46Å; K618-E652 WeakPolarHBondContact CE-OE2 3.34Å; K618-E652 IonicContact NZ-OE1 3.71Å; K618-E652 PolarHBondContact NZ-OE1 2.82Å; K618-E652 IonicContact NZ-OE2 3.32Å; K618-E652 PolarHBondContact NZ-OE2 3.29Å; E652-K703 CarbonylContact C-O 3.48Å; E652-K703 WeakPolarHBondContact CA-O 3.29Å; E652-E704 HydrophobicContact CG-CG 4.31Å
653	M	90.9	Very high	85.2	Confident	18 Å²	18	43.3 Å²	43.3	9%	0.089	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.3	-175.9	-177.2	172.6	79.6	0	0	111.1	L613 V615 I665 L700 K703	L613-M653 HydrophobicContact CD1-SD 4.11Å; L613-M653 HydrophobicContact CD2-CG 3.98Å; L613-M653 HydrophobicContact CD2-SD 4.11Å; V615-M653 HydrophobicContact CG2-CB 4.41Å; V615-M653 HydrophobicContact CG2-CG 4.1Å; M653-I665 HydrophobicContact SD-CG2 3.63Å; M653-L700 HydrophobicContact CE-CB 4.47Å; M653-L700 HydrophobicContact SD-CB 3.93Å; M653-K703 PolarHBondContact N-O 2.96Å
654	V	89.9	Confident	85	Confident	90 Å²	90	39.7 Å²	39.7	55%	0.545	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.4	176.8	-179	0	0	0	0	109.2	D614	D614-V654 PolarHBondContact N-O 3.35Å; D614-V654 PolarHBondContact O-N 3.36Å
655	E	89.3	Confident	85.2	Confident	43 Å²	43	38.7 Å²	38.7	20%	0.201	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.6	167.1	-165.8	-175.3	161.7	0	0	109.8	L613 T657 N658 S659	L613-E655 HydrophobicContact CD2-CB 3.77Å; L613-E655 HydrophobicContact CD2-CG 4.15Å; E655-T657 PolarHBondContact OE1-OG1 3.02Å; E655-N658 PolarHBondContact OE1-N 3.29Å; E655-S659 VanDerWaalsContact OE1-CB 3.28Å; E655-S659 WeakPolarHBondContact OE1-CB 3.1Å; E655-S659 PolarHBondContact OE1-N 3.49Å; E655-S659 PolarHBondContact OE1-OG 3.37Å
656	V	89.6	Confident	85.3	Confident	37 Å²	37	43.1 Å²	43.1	22%	0.224	26%	0.26	C	S	.	.	S	Bend	trans	-101	-24.6	-179.6	-73.3	0	0	0	0	112.3	N526 V612 D614 N658	N526-V656 WeakPolarHBondContact O-CG2 3.29Å; V612-V656 HydrophobicContact CB-CG2 3.97Å; V612-V656 HydrophobicContact CG1-CG2 3.85Å; V612-V656 VanDerWaalsContact O-CG2 3.24Å; V612-V656 WeakPolarHBondContact O-CG2 3.33Å; V612-V656 PolarHBondContact O-N 3.03Å; V612-V656 VanDerWaalsContact O-N 3.09Å; D614-V656 HydrophobicContact CB-CG1 4.4Å; V656-N658 PolarHBondContact O-ND2 3.19Å
657	T	87.3	Confident	85.3	Confident	24 Å²	24	39.2 Å²	39.2	15%	0.147	24%	0.239	C	C	.	.	S	Bend	trans	-85.4	-9.8	-178.7	45.5	0	0	0	0	115.8	L593 P611 V612 E655 S659	L593-T657 HydrophobicContact CD2-CG2 4.33Å; P611-T657 WeakPolarHBondContact CA-OG1 3.28Å; V612-T657 HydrophobicContact CB-CG2 3.84Å; V612-T657 HydrophobicContact CG2-CG2 3.99Å; V612-T657 PolarHBondContact N-OG1 3.3Å; E655-T657 PolarHBondContact OE1-OG1 3.02Å; T657-S659 PolarHBondContact O-N 2.91Å
658	N	80.7	Confident	85.3	Confident	123 Å²	123	39.5 Å²	39.5	66%	0.658	24%	0.241	S	C	*	.			trans	52	45.2	176.4	-58.8	-74.8	0	0	0	115.7	E655 V656	E655-N658 PolarHBondContact OE1-N 3.29Å; V656-N658 PolarHBondContact O-ND2 3.19Å
659	S	81.9	Confident	85.2	Confident	16 Å²	16	38.1 Å²	38.1	11%	0.112	23%	0.232	C	C	.	.			trans	-70.3	168.6	178.9	70.4	0	0	0	0	113.6	D591 E655 T657 T661	D591-S659 WeakPolarHBondContact O-CA 3.42Å; D591-S659 WeakPolarHBondContact O-CB 3.31Å; E655-S659 VanDerWaalsContact OE1-CB 3.28Å; E655-S659 WeakPolarHBondContact OE1-CB 3.1Å; E655-S659 PolarHBondContact OE1-N 3.49Å; E655-S659 PolarHBondContact OE1-OG 3.37Å; T657-S659 PolarHBondContact O-N 2.91Å; S659-T661 VanDerWaalsContact C-N 3.33Å; S659-T661 PolarHBondContact O-N 2.85Å; S659-T661 PolarHBondContact OG-O 2.86Å; S659-T661 VanDerWaalsContact OG-O 3.08Å
660	T	70.1	Confident	85.2	Confident	83 Å²	83	40.5 Å²	40.5	51%	0.509	24%	0.244	S	C	.	.	S	Bend	trans	-75	-17.9	-179.6	55	0	0	0	0	114.5	E590 D591 Q592	E590-T660 PolarHBondContact O-OG1 2.96Å; D591-T660 WeakPolarHBondContact CA-OG1 3.12Å; D591-T660 PolarHBondContact O-N 2.92Å; D591-T660 VanDerWaalsContact O-N 3.15Å; Q592-T660 HydrophobicContact CG-CG2 3.96Å
661	T	63.7	Low	85.2	Confident	84 Å²	84	39.9 Å²	39.9	52%	0.515	24%	0.24	S	C	.	.	S	Bend	trans	-98.8	148.3	172.3	58	0	0	0	0	109.8	S659 P663	S659-T661 VanDerWaalsContact C-N 3.33Å; S659-T661 PolarHBondContact O-N 2.85Å; S659-T661 PolarHBondContact OG-O 2.86Å; S659-T661 VanDerWaalsContact OG-O 3.08Å; T661-P663 WeakPolarHBondContact O-CD 3.47Å
662	G	61.8	Low	85.1	Confident	78 Å²	78	41.4 Å²	41.4	80%	0.804	25%	0.248	S	C	*	.			trans	-95.7	94.8	167.4	0	0	0	0	0	109.8
663	P	69.4	Low	85.1	Confident	13 Å²	13	38.5 Å²	38.5	8%	0.084	23%	0.234	C	C	.	.			trans	-75.4	139.2	-173.7	30.1	-36.3	0	0	0	112.3	P611 L613 T661 A740	P611-P663 HydrophobicContact CB-CG 4Å; P611-P663 HydrophobicContact CG-CG 4.36Å; L613-P663 HydrophobicContact CD1-CG 4.11Å; L613-P663 HydrophobicContact CD2-CG 4.29Å; L613-P663 HydrophobicContact CG-CG 4.37Å; T661-P663 WeakPolarHBondContact O-CD 3.47Å; P663-A740 HydrophobicContact CB-CB 3.56Å; P663-A740 HydrophobicContact CG-CB 3.71Å
664	G	82.3	Confident	85	Confident	10 Å²	10	37.9 Å²	37.9	10%	0.103	23%	0.231	C	C	.	.			trans	-79.8	159.8	157.6	0	0	0	0	0	111.4	L700	G664-L700 CarbonylContact C-O 3.5Å; G664-L700 WeakPolarHBondContact CA-O 3.35Å
665	I	87.9	Confident	84.8	Confident	1 Å²	1	35 Å²	35	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	126.8	174.6	-170.6	167.8	0	0	0	112.3	L613 V615 M653 I667 E699 L700 L742	L613-I665 HydrophobicContact CD1-CB 3.64Å; L613-I665 HydrophobicContact CD1-CD1 4.19Å; L613-I665 HydrophobicContact CD1-CG1 4.48Å; L613-I665 HydrophobicContact CD1-CG2 3.77Å; V615-I665 HydrophobicContact CG2-CG2 4.49Å; M653-I665 HydrophobicContact SD-CG2 3.63Å; I665-I667 HydrophobicContact CG1-CG2 4.46Å; I665-I667 HydrophobicContact CG2-CG2 4.42Å; I665-I667 PolarHBondContact O-N 2.84Å; I665-E699 CarbonylContact O-C 3.54Å; I665-E699 WeakPolarHBondContact O-CA 3.3Å; I665-L700 HydrophobicContact CG2-CB 4.18Å; I665-L700 HydrophobicContact CG2-CD1 4.49Å; I665-L700 PolarHBondContact N-O 3.17Å; I665-L700 PolarHBondContact O-N 3.42Å; I665-L742 HydrophobicContact CD1-CB 3.78Å
666	E	90.2	Very high	84.4	Confident	96 Å²	96	40.5 Å²	40.5	45%	0.449	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116.9	170.8	-173	-179.8	-127.7	0	0	110.2	T697	E666-T697 HydrophobicContact CG-CG2 3.65Å
667	I	90.9	Very high	83.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.5	169.4	64.6	160.8	0	0	0	111.2	F651 I665 F669 T697 Q698 L700 F730 S731	F651-I667 HydrophobicContact CD1-CD1 3.48Å; F651-I667 VanDerWaalsContact CD1-CD1 3.48Å; F651-I667 HydrophobicContact CD2-CD1 4.33Å; F651-I667 HydrophobicContact CE1-CD1 3.48Å; F651-I667 VanDerWaalsContact CE1-CD1 3.48Å; F651-I667 HydrophobicContact CE2-CD1 4.33Å; F651-I667 HydrophobicContact CG-CD1 3.92Å; F651-I667 HydrophobicContact CZ-CD1 3.93Å; I665-I667 HydrophobicContact CG1-CG2 4.46Å; I665-I667 HydrophobicContact CG2-CG2 4.42Å; I665-I667 PolarHBondContact O-N 2.84Å; I667-F669 HydrophobicContact CD1-CD1 4.19Å; I667-F669 HydrophobicContact CG1-CD1 4.47Å; I667-T697 VanDerWaalsContact O-CA 3.3Å; I667-T697 WeakPolarHBondContact O-CA 3.36Å; I667-Q698 PolarHBondContact N-O 2.82Å; I667-Q698 PolarHBondContact O-N 2.74Å; I667-L700 HydrophobicContact CD1-CD1 3.75Å; I667-L700 HydrophobicContact CD1-CD2 4.48Å; I667-L700 HydrophobicContact CD1-CG 4.24Å; I667-L700 HydrophobicContact CG1-CD1 4.03Å; I667-L700 HydrophobicContact CG1-CD2 4.48Å; I667-L700 HydrophobicContact CG1-CG 4.06Å; I667-F730 HydrophobicContact CB-CD2 4.2Å; I667-F730 HydrophobicContact CD1-CB 4.4Å; I667-F730 HydrophobicContact CD1-CD2 4Å; I667-F730 HydrophobicContact CD1-CG 4.28Å; I667-F730 HydrophobicContact CG2-CD2 4.07Å; I667-F730 HydrophobicContact CG2-CE2 4.31Å; I667-S731 WeakPolarHBondContact CA-O 3.42Å
668	S	93.2	Very high	83.3	Confident	7 Å²	7	51.1 Å²	51.1	5%	0.049	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124	161.7	-82.6	0	0	0	0	109.1	H696 T697 F730 S731 D733	S668-H696 CarbonylContact C-O 3.59Å; S668-H696 WeakPolarHBondContact CA-O 3.49Å; S668-T697 PolarHBondContact OG-OG1 2.74Å; S668-F730 CarbonylContact O-C 3.56Å; S668-F730 VanDerWaalsContact O-CA 3.23Å; S668-F730 WeakPolarHBondContact O-CA 3.43Å; S668-F730 WeakPolarHBondContact O-CB 3.46Å; S668-S731 PolarHBondContact N-O 3.25Å; S668-S731 PolarHBondContact O-N 3.1Å; S668-D733 WeakPolarHBondContact CB-OD2 3.19Å; S668-D733 PolarHBondContact OG-OD2 3.46Å
669	F	93.4	Very high	83.2	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	150.3	171.8	66.9	-93.6	0	0	0	112.3	F651 I667 I671 R695 H696 F707 Y709 N729 F730	F651-F669 HydrophobicContact CE1-CB 4.29Å; F651-F669 HydrophobicContact CE1-CD1 4.49Å; F651-F669 HydrophobicContact CE1-CG 4.46Å; F651-F669 AromaticContact CE2-CD1 3.77Å; F651-F669 HydrophobicContact CE2-CD1 3.77Å; F651-F669 HydrophobicContact CE2-CD2 4.31Å; F651-F669 AromaticContact CE2-CE1 3.71Å; F651-F669 HydrophobicContact CE2-CE1 3.71Å; F651-F669 HydrophobicContact CE2-CE2 4.27Å; F651-F669 HydrophobicContact CE2-CG 4.06Å; F651-F669 AromaticContact CE2-CZ 3.97Å; F651-F669 HydrophobicContact CE2-CZ 3.97Å; F651-F669 HydrophobicContact CZ-CB 3.74Å; F651-F669 AromaticContact CZ-CD1 3.55Å; F651-F669 HydrophobicContact CZ-CD1 3.55Å; F651-F669 AromaticContact CZ-CD2 3.93Å; F651-F669 HydrophobicContact CZ-CD2 3.93Å; F651-F669 AromaticContact CZ-CE1 4Å; F651-F669 HydrophobicContact CZ-CE1 4Å; F651-F669 HydrophobicContact CZ-CE2 4.35Å; F651-F669 AromaticContact CZ-CG 3.5Å; F651-F669 HydrophobicContact CZ-CG 3.5Å; F651-F669 VanDerWaalsContact CZ-CG 3.5Å; F651-F669 HydrophobicContact CZ-CZ 4.37Å; I667-F669 HydrophobicContact CD1-CD1 4.19Å; I667-F669 HydrophobicContact CG1-CD1 4.47Å; F669-I671 HydrophobicContact CD2-CD1 4.45Å; F669-I671 HydrophobicContact CD2-CG1 4.17Å; F669-I671 HydrophobicContact CE2-CD1 4.21Å; F669-I671 HydrophobicContact CE2-CG1 4.4Å; F669-R695 WeakPolarHBondContact O-CA 3.11Å; F669-H696 HydrophobicContact CD1-CB 4.32Å; F669-H696 HydrophobicContact CD2-CB 4.33Å; F669-H696 HydrophobicContact CE1-CB 3.87Å; F669-H696 AromaticContact CE1-CD2 3.88Å; F669-H696 HydrophobicContact CE2-CB 3.86Å; F669-H696 HydrophobicContact CZ-CB 3.62Å; F669-H696 AromaticContact CZ-CD2 3.79Å; F669-H696 PolarHBondContact N-O 3.43Å; F669-H696 PolarHBondContact O-N 3.31Å; F669-F707 AromaticContact CE1-CD2 3.95Å; F669-F707 HydrophobicContact CE1-CD2 3.95Å; F669-F707 AromaticContact CE1-CE2 3.89Å; F669-F707 HydrophobicContact CE1-CE2 3.89Å; F669-F707 HydrophobicContact CE1-CG 4.44Å; F669-F707 HydrophobicContact CE1-CZ 4.31Å; F669-F707 HydrophobicContact CZ-CB 4.26Å; F669-F707 HydrophobicContact CZ-CD1 4.33Å; F669-F707 AromaticContact CZ-CD2 3.58Å; F669-F707 HydrophobicContact CZ-CD2 3.58Å; F669-F707 HydrophobicContact CZ-CE2 4.01Å; F669-F707 AromaticContact CZ-CG 3.78Å; F669-F707 HydrophobicContact CZ-CG 3.78Å; F669-Y709 HydrophobicContact CE2-CE2 4.17Å; F669-Y709 VanDerWaalsContact CE2-OH 3.28Å; F669-Y709 WeakPolarHBondContact CE2-OH 3.47Å; F669-Y709 VanDerWaalsContact CZ-OH 3.27Å; F669-Y709 WeakPolarHBondContact CZ-OH 3.19Å; F669-N729 WeakPolarHBondContact CA-O 3.5Å; F669-F730 HydrophobicContact CB-CB 3.57Å
670	M	94.2	Very high	83.4	Confident	50 Å²	50	50.2 Å²	50.2	25%	0.246	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.5	175	-171.9	-175.6	-63.6	0	0	109.6	I672 N693 I694 L728 N729	M670-I672 HydrophobicContact CG-CD1 4.49Å; M670-I672 HydrophobicContact CG-CG1 4Å; M670-I672 HydrophobicContact SD-CD1 3.93Å; M670-I672 HydrophobicContact SD-CG1 3.96Å; M670-N693 HydrophobicContact CG-CB 4.33Å; M670-N693 HydrophobicContact SD-CB 4.4Å; M670-N693 PolarHBondContact SD-ND2 2.72Å; M670-N693 VanDerWaalsContact SD-ND2 3.4Å; M670-I694 VanDerWaalsContact CA-O 3.28Å; M670-I694 WeakPolarHBondContact CA-O 3.5Å; M670-I694 WeakPolarHBondContact CG-O 3.49Å; M670-L728 WeakPolarHBondContact O-CA 2.98Å; M670-N729 PolarHBondContact N-O 2.97Å; M670-N729 PolarHBondContact O-N 3.39Å
671	I	94.1	Very high	84.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.4	171.8	-48	-179.9	0	0	0	108.4	I647 A649 F669 F684 N693 I694 Y709 I726 K727 L728	I647-I671 HydrophobicContact CD1-CD1 4.12Å; I647-I671 HydrophobicContact CD1-CG2 3.87Å; A649-I671 HydrophobicContact CB-CD1 3.82Å; F669-I671 HydrophobicContact CD2-CD1 4.45Å; F669-I671 HydrophobicContact CD2-CG1 4.17Å; F669-I671 HydrophobicContact CE2-CD1 4.21Å; F669-I671 HydrophobicContact CE2-CG1 4.4Å; I671-F684 HydrophobicContact CB-CZ 4.23Å; I671-F684 HydrophobicContact CG2-CZ 3.97Å; I671-N693 CarbonylContact O-C 3.37Å; I671-N693 WeakPolarHBondContact O-CA 3.3Å; I671-N693 VanDerWaalsContact O-CB 3.27Å; I671-N693 WeakPolarHBondContact O-CB 3.33Å; I671-I694 HydrophobicContact CB-CG2 4.03Å; I671-I694 HydrophobicContact CG1-CG2 4.43Å; I671-I694 PolarHBondContact N-O 2.9Å; I671-I694 PolarHBondContact O-N 2.8Å; I671-Y709 HydrophobicContact CD1-CD2 3.68Å; I671-Y709 HydrophobicContact CD1-CE2 3.53Å; I671-I726 HydrophobicContact CG2-CG2 3.73Å; I671-K727 CarbonylContact C-O 3.54Å; I671-K727 WeakPolarHBondContact CA-O 3.43Å; I671-L728 HydrophobicContact CD1-CD1 4.31Å; I671-L728 HydrophobicContact CG1-CB 4.35Å; I671-L728 HydrophobicContact CG1-CD1 4.16Å; I671-L728 HydrophobicContact CG1-CG 4.23Å
672	I	93.1	Very high	85.6	Confident	33 Å²	33	43.3 Å²	43.3	17%	0.169	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.9	-175	-49.2	172	0	0	0	109.6	M670 P675 N693 K727	M670-I672 HydrophobicContact CG-CD1 4.49Å; M670-I672 HydrophobicContact CG-CG1 4Å; M670-I672 HydrophobicContact SD-CD1 3.93Å; M670-I672 HydrophobicContact SD-CG1 3.96Å; I672-P675 HydrophobicContact CB-CB 4.41Å; I672-P675 HydrophobicContact CG2-CB 3.88Å; I672-N693 HydrophobicContact CB-CB 4.35Å; I672-N693 HydrophobicContact CG1-CB 3.94Å; I672-N693 HydrophobicContact CG2-CB 4.38Å; I672-K727 PolarHBondContact N-O 3.48Å; I672-K727 PolarHBondContact O-N 2.77Å
673	V	92.7	Very high	87	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.4	175.9	-170.3	0	0	0	0	111.5	P675 S680 G682 F684 R692 I711 V724	V673-P675 VanDerWaalsContact C-N 3.34Å; V673-S680 PolarHBondContact O-OG 2.83Å; V673-G682 WeakPolarHBondContact CG1-O 3.34Å; V673-F684 HydrophobicContact CG2-CE2 3.73Å; V673-F684 HydrophobicContact CG2-CZ 3.75Å; V673-R692 PolarHBondContact N-O 3.37Å; V673-R692 WeakPolarHBondContact O-CG 3.44Å; V673-R692 PolarHBondContact O-NE 3.3Å; V673-I711 HydrophobicContact CG2-CD1 3.87Å; V673-I711 HydrophobicContact CG2-CG1 4.34Å; V673-V724 HydrophobicContact CG1-CG1 3.66Å
674	D	90.4	Very high	88	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	44.1	47.4	-178.5	-96	-28.4	0	0	0	113.2	M676 R677 R681 R692 N725	D674-M676 PolarHBondContact O-N 3.06Å; D674-R677 HydrophobicContact CB-CB 4.31Å; D674-R677 HydrophobicContact CB-CG 4.07Å; D674-R677 PolarHBondContact O-N 2.89Å; D674-R677 IonicContact OD1-NE 3.58Å; D674-R677 WeakPolarHBondContact OD2-CD 3.28Å; D674-R677 IonicContact OD2-NE 2.69Å; D674-R681 IonicContact OD1-CZ 3.2Å; D674-R681 IonicContact OD1-NE 3.65Å; D674-R681 IonicContact OD1-NH2 2.74Å; D674-R681 PolarHBondContact OD1-NH2 3.02Å; D674-R681 WeakPolarHBondContact OD2-CB 3.4Å; D674-R681 IonicContact OD2-CZ 2.73Å; D674-R681 PolarHBondContact OD2-N 3.29Å; D674-R681 VanDerWaalsContact OD2-N 3.08Å; D674-R681 IonicContact OD2-NE 3.96Å; D674-R681 PolarHBondContact OD2-NE 3.15Å; D674-R681 IonicContact OD2-NH2 2.76Å; D674-R681 PolarHBondContact OD2-NH2 3.33Å; D674-R692 PolarHBondContact O-NH2 3.13Å; D674-N725 WeakPolarHBondContact CA-O 3.09Å; D674-N725 PolarHBondContact N-O 3.14Å; D674-N725 PolarHBondContact OD1-N 3.33Å
675	P	85.6	Confident	88.2	Confident	30 Å²	30	43.7 Å²	43.7	20%	0.195	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.3	-163.5	22.5	-34.4	0	0	0	115.3	I672 V673 R692 N725 K727	I672-P675 HydrophobicContact CB-CB 4.41Å; I672-P675 HydrophobicContact CG2-CB 3.88Å; V673-P675 VanDerWaalsContact C-N 3.34Å; P675-R692 VanDerWaalsContact C-NH2 3.26Å; P675-R692 PolarHBondContact O-NH2 3.49Å; P675-N725 WeakPolarHBondContact CD-O 3.3Å; P675-K727 HydrophobicContact CG-CB 4.04Å
676	M	80	Confident	87.7	Confident	159 Å²	159	47.5 Å²	47.5	78%	0.783	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-4.4	179.3	-55.8	-56.6	156.4	0	0	114.5	D674	D674-M676 PolarHBondContact O-N 3.06Å
677	R	77.6	Confident	87	Confident	79 Å²	79	51.4 Å²	51.4	30%	0.298	26%	0.263	S	S	.	.			trans	-93.7	160.7	179.1	-58.8	-168.8	175.7	-111.8	-13.6	112.8	D674 S679 R681 R692 D719 S722	D674-R677 HydrophobicContact CB-CB 4.31Å; D674-R677 HydrophobicContact CB-CG 4.07Å; D674-R677 PolarHBondContact O-N 2.89Å; D674-R677 IonicContact OD1-NE 3.58Å; D674-R677 WeakPolarHBondContact OD2-CD 3.28Å; D674-R677 IonicContact OD2-NE 2.69Å; R677-S679 WeakPolarHBondContact CB-O 3.36Å; R677-S679 WeakPolarHBondContact CD-O 3.27Å; R677-R681 VanDerWaalsContact NE-NH2 3.2Å; R677-R681 VanDerWaalsContact NH2-CZ 3.34Å; R677-R692 PolarHBondContact O-NH1 3.09Å; R677-R692 PolarHBondContact O-NH2 2.62Å; R677-D719 IonicContact CZ-OD2 2.79Å; R677-D719 IonicContact NH1-OD2 3.2Å; R677-D719 PolarHBondContact NH1-OD2 3.48Å; R677-D719 IonicContact NH2-OD2 3.83Å; R677-D719 PolarHBondContact NH2-OD2 3.01Å; R677-S722 PolarHBondContact NH2-OG 2.91Å
678	Q	75.8	Confident	86.2	Confident	204 Å²	204	54.8 Å²	54.8	95%	0.953	30%	0.298	S	S	*	.	S	Bend	trans	-82.2	-39	165.2	-72	-167.4	-13	0	0	112.3
679	S	79.8	Confident	85.7	Confident	97 Å²	97	57.3 Å²	57.3	68%	0.678	32%	0.32	S	S	*	.	S	Bend	trans	-109.3	127.2	170.4	-173.6	0	0	0	0	109.5	R677	R677-S679 WeakPolarHBondContact CB-O 3.36Å; R677-S679 WeakPolarHBondContact CD-O 3.27Å
680	S	86.1	Confident	85.3	Confident	24 Å²	24	61.2 Å²	61.2	17%	0.168	34%	0.34	C	S	.	.			trans	-84.4	136.6	177.4	-166.5	0	0	0	0	110	V673 G682	V673-S680 PolarHBondContact O-OG 2.83Å; S680-G682 WeakPolarHBondContact CB-O 3.19Å; S680-G682 PolarHBondContact OG-O 2.77Å
681	R	89.5	Confident	85	Confident	22 Å²	22	60.2 Å²	60.2	8%	0.083	34%	0.339	C	S	.	.	S	Bend	trans	-80.2	-29	177.3	-66.3	169.4	-70.9	176.6	1	112.6	D674 R677 M713 I717 D719 S722 P723	D674-R681 IonicContact OD1-CZ 3.2Å; D674-R681 IonicContact OD1-NE 3.65Å; D674-R681 IonicContact OD1-NH2 2.74Å; D674-R681 PolarHBondContact OD1-NH2 3.02Å; D674-R681 WeakPolarHBondContact OD2-CB 3.4Å; D674-R681 IonicContact OD2-CZ 2.73Å; D674-R681 PolarHBondContact OD2-N 3.29Å; D674-R681 VanDerWaalsContact OD2-N 3.08Å; D674-R681 IonicContact OD2-NE 3.96Å; D674-R681 PolarHBondContact OD2-NE 3.15Å; D674-R681 IonicContact OD2-NH2 2.76Å; D674-R681 PolarHBondContact OD2-NH2 3.33Å; R677-R681 VanDerWaalsContact NE-NH2 3.2Å; R677-R681 VanDerWaalsContact NH2-CZ 3.34Å; R681-M713 WeakPolarHBondContact O-CB 3.35Å; R681-M713 WeakPolarHBondContact O-CG 3.37Å; R681-I717 HydrophobicContact CB-CG2 4.15Å; R681-I717 HydrophobicContact CG-CG2 3.79Å; R681-D719 VanDerWaalsContact CD-O 3.28Å; R681-D719 WeakPolarHBondContact CD-O 3.46Å; R681-D719 PolarHBondContact NH1-O 3.09Å; R681-D719 IonicContact NH1-OD1 2.92Å; R681-D719 IonicContact NH1-OD2 2.66Å; R681-S722 PolarHBondContact NH1-O 2.84Å; R681-S722 PolarHBondContact NH1-OG 2.78Å; R681-S722 VanDerWaalsContact NH1-OG 3.12Å; R681-P723 PolarHBondContact NH2-O 3.27Å
682	G	89.4	Confident	84.7	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	160	172.5	0	0	0	0	0	113.3	V673 S680 S712	V673-G682 WeakPolarHBondContact CG1-O 3.34Å; S680-G682 WeakPolarHBondContact CB-O 3.19Å; S680-G682 PolarHBondContact OG-O 2.77Å; G682-S712 CarbonylContact C-O 3.57Å; G682-S712 WeakPolarHBondContact CA-O 3.24Å
683	F	90.6	Very high	84.6	Confident	14 Å²	14	65.5 Å²	65.5	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.3	-176.6	44	-95.4	0	0	0	110.6	P641 I685 N690 S691 S712 N714	P641-F683 HydrophobicContact CB-CE2 3.49Å; P641-F683 VanDerWaalsContact CB-CE2 3.49Å; P641-F683 HydrophobicContact CB-CZ 3.59Å; P641-F683 HydrophobicContact CG-CE2 3.5Å; P641-F683 HydrophobicContact CG-CZ 3.58Å; F683-I685 HydrophobicContact CD2-CG1 4.34Å; F683-I685 HydrophobicContact CE2-CG1 4.38Å; F683-N690 HydrophobicContact CB-CB 4.25Å; F683-N690 HydrophobicContact CD1-CB 4.4Å; F683-N690 HydrophobicContact CD2-CB 3.58Å; F683-N690 VanDerWaalsContact CD2-CG 3.41Å; F683-N690 HydrophobicContact CE2-CB 4Å; F683-N690 VanDerWaalsContact CE2-ND2 3.29Å; F683-N690 WeakPolarHBondContact CE2-ND2 3Å; F683-N690 WeakPolarHBondContact CE2-OD1 3.01Å; F683-N690 HydrophobicContact CG-CB 3.8Å; F683-N690 VanDerWaalsContact CZ-ND2 3.34Å; F683-N690 WeakPolarHBondContact CZ-ND2 3.36Å; F683-S691 CarbonylContact C-O 3.6Å; F683-S691 WeakPolarHBondContact CA-O 3.15Å; F683-S691 WeakPolarHBondContact CB-O 3.24Å; F683-S712 PolarHBondContact N-O 3.1Å; F683-S712 PolarHBondContact O-N 2.84Å; F683-N714 VanDerWaalsContact CE1-OD1 3.31Å; F683-N714 WeakPolarHBondContact CE1-OD1 3.26Å; F683-N714 VanDerWaalsContact CZ-OD1 3.24Å; F683-N714 WeakPolarHBondContact CZ-OD1 3.39Å
684	F	91.3	Very high	84.5	Confident	7 Å²	7	66.5 Å²	66.5	3%	0.031	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	154.2	167	-51.1	-70.8	0	0	0	109.3	I647 I671 V673 S691 I694 Y709 I711	I647-F684 HydrophobicContact CD1-CE1 4.08Å; I647-F684 HydrophobicContact CD1-CZ 4.18Å; I671-F684 HydrophobicContact CB-CZ 4.23Å; I671-F684 HydrophobicContact CG2-CZ 3.97Å; V673-F684 HydrophobicContact CG2-CE2 3.73Å; V673-F684 HydrophobicContact CG2-CZ 3.75Å; F684-S691 PolarHBondContact N-O 3.4Å; F684-S691 PolarHBondContact O-N 3.29Å; F684-I694 HydrophobicContact CD2-CB 3.96Å; F684-I694 HydrophobicContact CD2-CG2 3.91Å; F684-I694 HydrophobicContact CE1-CG2 4.38Å; F684-I694 HydrophobicContact CE2-CB 4.26Å; F684-I694 HydrophobicContact CE2-CG2 3.74Å; F684-I694 HydrophobicContact CG-CB 4.35Å; F684-I694 HydrophobicContact CG-CG2 4.3Å; F684-I694 HydrophobicContact CZ-CG2 3.99Å; F684-Y709 HydrophobicContact CE1-CG 4.49Å; F684-I711 HydrophobicContact CD1-CG1 4.23Å; F684-I711 HydrophobicContact CE1-CD1 4.28Å; F684-I711 HydrophobicContact CE1-CG1 3.68Å; F684-I711 HydrophobicContact CZ-CD1 4.48Å; F684-I711 HydrophobicContact CZ-CG1 4.3Å
685	I	85.6	Confident	84.6	Confident	88 Å²	88	73.4 Å²	73.4	45%	0.451	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	103.7	175.5	-59.5	176.1	0	0	0	108	P641 F683 A689 S712	P641-I685 HydrophobicContact CB-CD1 4.19Å; F683-I685 HydrophobicContact CD2-CG1 4.34Å; F683-I685 HydrophobicContact CE2-CG1 4.38Å; I685-A689 WeakPolarHBondContact CA-O 3.35Å; I685-S712 WeakPolarHBondContact CD1-OG 3.46Å
686	E	78.3	Confident	84.8	Confident	81 Å²	81	75.1 Å²	75.1	38%	0.379	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.3	177	-68.8	-171.6	124	0	0	109.4	G688 A689 I694	E686-G688 PolarHBondContact O-N 3.17Å; E686-A689 PolarHBondContact N-O 2.96Å; E686-A689 PolarHBondContact O-N 2.85Å; E686-I694 HydrophobicContact CG-CD1 4.46Å; E686-I694 WeakPolarHBondContact OE1-CD1 2.99Å; E686-I694 WeakPolarHBondContact OE1-CG1 3.27Å
687	N	76.6	Confident	85.4	Confident	178 Å²	178	70.4 Å²	70.4	95%	0.952	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	27.4	178	-59.4	-42.2	0	0	0	114.9
688	G	72.9	Confident	86	Confident	71 Å²	71	70.4 Å²	70.4	73%	0.732	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	5	-177	0	0	0	0	0	115.3	E686	E686-G688 PolarHBondContact O-N 3.17Å
689	A	82.4	Confident	86.6	Confident	60 Å²	60	66 Å²	66	50%	0.496	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146.4	174.4	0	0	0	0	0	111.9	I685 E686 S691	I685-A689 WeakPolarHBondContact CA-O 3.35Å; E686-A689 PolarHBondContact N-O 2.96Å; E686-A689 PolarHBondContact O-N 2.85Å; A689-S691 PolarHBondContact O-N 3.5Å
690	N	84.8	Confident	87.1	Confident	84 Å²	84	61.3 Å²	61.3	45%	0.449	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	108.1	177	-65.6	-2.2	0	0	0	109.7	F683	F683-N690 HydrophobicContact CB-CB 4.25Å; F683-N690 HydrophobicContact CD1-CB 4.4Å; F683-N690 HydrophobicContact CD2-CB 3.58Å; F683-N690 VanDerWaalsContact CD2-CG 3.41Å; F683-N690 HydrophobicContact CE2-CB 4Å; F683-N690 VanDerWaalsContact CE2-ND2 3.29Å; F683-N690 WeakPolarHBondContact CE2-ND2 3Å; F683-N690 WeakPolarHBondContact CE2-OD1 3.01Å; F683-N690 HydrophobicContact CG-CB 3.8Å; F683-N690 VanDerWaalsContact CZ-ND2 3.34Å; F683-N690 WeakPolarHBondContact CZ-ND2 3.36Å
691	S	88.8	Confident	87.2	Confident	30 Å²	30	64.6 Å²	64.6	21%	0.21	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	136	174.8	-169.3	0	0	0	0	112.2	F683 F684 A689 N693	F683-S691 CarbonylContact C-O 3.6Å; F683-S691 WeakPolarHBondContact CA-O 3.15Å; F683-S691 WeakPolarHBondContact CB-O 3.24Å; F684-S691 PolarHBondContact N-O 3.4Å; F684-S691 PolarHBondContact O-N 3.29Å; A689-S691 PolarHBondContact O-N 3.5Å; S691-N693 VanDerWaalsContact C-N 3.33Å; S691-N693 PolarHBondContact OG-N 3.09Å; S691-N693 PolarHBondContact OG-O 2.94Å
692	R	87.9	Confident	87	Confident	80 Å²	80	68.3 Å²	68.3	30%	0.302	37%	0.368	S	S	.	.	S	Bend	trans	-75.6	-24.3	177.2	-179.1	177.8	179.3	-171.6	3.5	112.9	V673 D674 P675 R677	V673-R692 PolarHBondContact N-O 3.37Å; V673-R692 WeakPolarHBondContact O-CG 3.44Å; V673-R692 PolarHBondContact O-NE 3.3Å; D674-R692 PolarHBondContact O-NH2 3.13Å; P675-R692 VanDerWaalsContact C-NH2 3.26Å; P675-R692 PolarHBondContact O-NH2 3.49Å; R677-R692 PolarHBondContact O-NH1 3.09Å; R677-R692 PolarHBondContact O-NH2 2.62Å
693	N	91.1	Very high	87	Confident	64 Å²	64	77 Å²	77	34%	0.342	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	153.2	-179.4	60.6	-29.1	0	0	0	111	M670 I671 I672 S691	M670-N693 HydrophobicContact CG-CB 4.33Å; M670-N693 HydrophobicContact SD-CB 4.4Å; M670-N693 PolarHBondContact SD-ND2 2.72Å; M670-N693 VanDerWaalsContact SD-ND2 3.4Å; I671-N693 CarbonylContact O-C 3.37Å; I671-N693 WeakPolarHBondContact O-CA 3.3Å; I671-N693 VanDerWaalsContact O-CB 3.27Å; I671-N693 WeakPolarHBondContact O-CB 3.33Å; I672-N693 HydrophobicContact CB-CB 4.35Å; I672-N693 HydrophobicContact CG1-CB 3.94Å; I672-N693 HydrophobicContact CG2-CB 4.38Å; S691-N693 VanDerWaalsContact C-N 3.33Å; S691-N693 PolarHBondContact OG-N 3.09Å; S691-N693 PolarHBondContact OG-O 2.94Å
694	I	91.1	Very high	87.1	Confident	20 Å²	20	81.2 Å²	81.2	10%	0.103	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.8	170.8	-173.2	157.8	0	0	0	107.8	M670 I671 F684 E686 Y709	M670-I694 VanDerWaalsContact CA-O 3.28Å; M670-I694 WeakPolarHBondContact CA-O 3.5Å; M670-I694 WeakPolarHBondContact CG-O 3.49Å; I671-I694 HydrophobicContact CB-CG2 4.03Å; I671-I694 HydrophobicContact CG1-CG2 4.43Å; I671-I694 PolarHBondContact N-O 2.9Å; I671-I694 PolarHBondContact O-N 2.8Å; F684-I694 HydrophobicContact CD2-CB 3.96Å; F684-I694 HydrophobicContact CD2-CG2 3.91Å; F684-I694 HydrophobicContact CE1-CG2 4.38Å; F684-I694 HydrophobicContact CE2-CB 4.26Å; F684-I694 HydrophobicContact CE2-CG2 3.74Å; F684-I694 HydrophobicContact CG-CB 4.35Å; F684-I694 HydrophobicContact CG-CG2 4.3Å; F684-I694 HydrophobicContact CZ-CG2 3.99Å; E686-I694 HydrophobicContact CG-CD1 4.46Å; E686-I694 WeakPolarHBondContact OE1-CD1 2.99Å; E686-I694 WeakPolarHBondContact OE1-CG1 3.27Å; I694-Y709 HydrophobicContact CD1-CD1 3.93Å; I694-Y709 HydrophobicContact CD1-CE1 3.73Å; I694-Y709 HydrophobicContact CG1-CE1 4.49Å; I694-Y709 HydrophobicContact CG2-CD1 4.42Å; I694-Y709 HydrophobicContact CG2-CE1 4.37Å
695	R	91.8	Very high	87.2	Confident	149 Å²	149	82.2 Å²	82.2	56%	0.562	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.6	169.8	-175	-176.7	-176.6	170.7	3	107.9	F669 D733	F669-R695 WeakPolarHBondContact O-CA 3.11Å; R695-D733 IonicContact CZ-OD2 2.76Å; R695-D733 IonicContact NH2-OD2 2.8Å; R695-D733 PolarHBondContact NH2-OD2 2.69Å
696	H	90.4	Very high	87.6	Confident	67 Å²	67	80.7 Å²	80.7	31%	0.31	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145	177.2	-154.4	66.9	0	0	0	108.5	S668 F669	S668-H696 CarbonylContact C-O 3.59Å; S668-H696 WeakPolarHBondContact CA-O 3.49Å; F669-H696 HydrophobicContact CD1-CB 4.32Å; F669-H696 HydrophobicContact CD2-CB 4.33Å; F669-H696 HydrophobicContact CE1-CB 3.87Å; F669-H696 AromaticContact CE1-CD2 3.88Å; F669-H696 HydrophobicContact CE2-CB 3.86Å; F669-H696 HydrophobicContact CZ-CB 3.62Å; F669-H696 AromaticContact CZ-CD2 3.79Å; F669-H696 PolarHBondContact N-O 3.43Å; F669-H696 PolarHBondContact O-N 3.31Å
697	T	92	Very high	88.4	Confident	60 Å²	60	78.3 Å²	78.3	37%	0.368	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126.8	176	-56.9	0	0	0	0	106.7	E666 I667 S668	E666-T697 HydrophobicContact CG-CG2 3.65Å; I667-T697 VanDerWaalsContact O-CA 3.3Å; I667-T697 WeakPolarHBondContact O-CA 3.36Å; S668-T697 PolarHBondContact OG-OG1 2.74Å
698	Q	89.4	Confident	89.2	Confident	78 Å²	78	75.4 Å²	75.4	36%	0.364	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	140	-171.6	178.3	57.1	59	0	0	110.2	I667 F707	I667-Q698 PolarHBondContact N-O 2.82Å; I667-Q698 PolarHBondContact O-N 2.74Å; Q698-F707 HydrophobicContact CB-CE1 4.45Å; Q698-F707 HydrophobicContact CB-CZ 4.2Å; Q698-F707 HydrophobicContact CG-CE1 3.97Å; Q698-F707 HydrophobicContact CG-CZ 3.71Å
699	E	90	Very high	90.1	Very high	111 Å²	111	73.5 Å²	73.5	52%	0.519	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.4	167.6	-171.4	177.1	-168.2	0	0	109.8	I665 T701	I665-E699 CarbonylContact O-C 3.54Å; I665-E699 WeakPolarHBondContact O-CA 3.3Å; E699-T701 HydrophobicContact CG-CG2 4.23Å
700	L	89.5	Confident	90.6	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.5	171.8	-55.6	-177	0	0	0	109	V615 F651 M653 G664 I665 I667 T705	V615-L700 HydrophobicContact CG1-CD1 4.06Å; F651-L700 HydrophobicContact CB-CD1 3.83Å; F651-L700 HydrophobicContact CB-CD2 4.47Å; F651-L700 HydrophobicContact CG-CD1 4.37Å; M653-L700 HydrophobicContact CE-CB 4.47Å; M653-L700 HydrophobicContact SD-CB 3.93Å; G664-L700 CarbonylContact C-O 3.5Å; G664-L700 WeakPolarHBondContact CA-O 3.35Å; I665-L700 HydrophobicContact CG2-CB 4.18Å; I665-L700 HydrophobicContact CG2-CD1 4.49Å; I665-L700 PolarHBondContact N-O 3.17Å; I665-L700 PolarHBondContact O-N 3.42Å; I667-L700 HydrophobicContact CD1-CD1 3.75Å; I667-L700 HydrophobicContact CD1-CD2 4.48Å; I667-L700 HydrophobicContact CD1-CG 4.24Å; I667-L700 HydrophobicContact CG1-CD1 4.03Å; I667-L700 HydrophobicContact CG1-CD2 4.48Å; I667-L700 HydrophobicContact CG1-CG 4.06Å; L700-T705 HydrophobicContact CD2-CG2 4.23Å
701	T	87.3	Confident	90.9	Very high	92 Å²	92	68.8 Å²	68.8	56%	0.564	34%	0.343	S	S	*	.			trans	-119.3	-20.2	174.4	55.2	0	0	0	0	113.1	E699	E699-T701 HydrophobicContact CG-CG2 4.23Å
702	D	86.9	Confident	90.9	Very high	101 Å²	101	67.7 Å²	67.7	54%	0.54	34%	0.336	S	S	.	.	S	Bend	trans	-96.8	157.4	-178.4	-68.7	-54.1	0	0	0	111.8	E704	D702-E704 PolarHBondContact O-N 2.05Å
703	K	87.6	Confident	90.9	Very high	182 Å²	182	64 Å²	64	79%	0.791	32%	0.322	S	S	*	.	S	Bend	trans	-62.9	-27.6	177.9	-67.5	-168	174.7	-167.2	0	114	E652 M653	E652-K703 CarbonylContact C-O 3.48Å; E652-K703 WeakPolarHBondContact CA-O 3.29Å; M653-K703 PolarHBondContact N-O 2.96Å
704	E	92.6	Very high	90.6	Very high	102 Å²	102	64.1 Å²	64.1	48%	0.477	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	129.8	170.5	-174.3	175.6	-155.5	0	0	108.7	C650 F651 E652 D702	C650-E704 HydrophobicContact CB-CG 4.42Å; F651-E704 VanDerWaalsContact O-CA 3.31Å; F651-E704 WeakPolarHBondContact O-CA 3.32Å; E652-E704 HydrophobicContact CG-CG 4.31Å; D702-E704 PolarHBondContact O-N 2.05Å
705	T	94.4	Very high	90	Very high	28 Å²	28	65.7 Å²	65.7	17%	0.172	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.6	174.8	-46.3	0	0	0	0	109.7	C650 F651 L700 F707	C650-T705 CarbonylContact C-O 3.56Å; C650-T705 WeakPolarHBondContact CA-O 3.2Å; F651-T705 PolarHBondContact N-O 3.35Å; F651-T705 PolarHBondContact O-N 3.11Å; L700-T705 HydrophobicContact CD2-CG2 4.23Å; T705-F707 HydrophobicContact CG2-CE1 4.34Å; T705-F707 HydrophobicContact CG2-CE2 3.89Å; T705-F707 HydrophobicContact CG2-CZ 3.55Å
706	C	94.4	Very high	89.3	Confident	57 Å²	57	61.1 Å²	61.1	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.7	-172.3	-63.3	0	0	0	0	113	T648 A649 C650	T648-C706 HydrophobicContact CG2-CB 3.92Å; A649-C706 CarbonylContact O-C 3.43Å; A649-C706 WeakPolarHBondContact O-CA 3.35Å; C650-C706 HydrophobicContact CB-CB 4.15Å; C650-C706 WeakPolarHBondContact CB-SG 3.37Å; C650-C706 WeakPolarHBondContact SG-CB 3.45Å; C650-C706 CovalentContact SG-SG 2.04Å; C650-C706 PolarHBondContact SG-SG 2.92Å
707	F	94.4	Very high	88.7	Confident	30 Å²	30	58.7 Å²	58.7	13%	0.132	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130	-179.2	-52.3	-88.4	0	0	0	110.3	T648 A649 F651 F669 Q698 T705 Y709	T648-F707 WeakPolarHBondContact CA-O 3.39Å; A649-F707 PolarHBondContact N-O 3.33Å; A649-F707 PolarHBondContact O-N 2.88Å; F651-F707 HydrophobicContact CD2-CD2 4.02Å; F651-F707 AromaticContact CD2-CE2 3.77Å; F651-F707 HydrophobicContact CD2-CE2 3.77Å; F651-F707 AromaticContact CE2-CD2 3.85Å; F651-F707 HydrophobicContact CE2-CD2 3.85Å; F651-F707 AromaticContact CE2-CE2 3.89Å; F651-F707 HydrophobicContact CE2-CE2 3.89Å; F669-F707 AromaticContact CE1-CD2 3.95Å; F669-F707 HydrophobicContact CE1-CD2 3.95Å; F669-F707 AromaticContact CE1-CE2 3.89Å; F669-F707 HydrophobicContact CE1-CE2 3.89Å; F669-F707 HydrophobicContact CE1-CG 4.44Å; F669-F707 HydrophobicContact CE1-CZ 4.31Å; F669-F707 HydrophobicContact CZ-CB 4.26Å; F669-F707 HydrophobicContact CZ-CD1 4.33Å; F669-F707 AromaticContact CZ-CD2 3.58Å; F669-F707 HydrophobicContact CZ-CD2 3.58Å; F669-F707 HydrophobicContact CZ-CE2 4.01Å; F669-F707 AromaticContact CZ-CG 3.78Å; F669-F707 HydrophobicContact CZ-CG 3.78Å; Q698-F707 HydrophobicContact CB-CE1 4.45Å; Q698-F707 HydrophobicContact CB-CZ 4.2Å; Q698-F707 HydrophobicContact CG-CE1 3.97Å; Q698-F707 HydrophobicContact CG-CZ 3.71Å; T705-F707 HydrophobicContact CG2-CE1 4.34Å; T705-F707 HydrophobicContact CG2-CE2 3.89Å; T705-F707 HydrophobicContact CG2-CZ 3.55Å; F707-Y709 HydrophobicContact CB-CE2 3.6Å
708	N	93.8	Very high	87.8	Confident	118 Å²	118	65 Å²	65	63%	0.631	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.2	-178.8	-70.3	-48.7	0	0	0	111.1	I647 T648	I647-N708 WeakPolarHBondContact O-CA 3.45Å; T648-N708 WeakPolarHBondContact CB-OD1 3.37Å; T648-N708 WeakPolarHBondContact CG2-OD1 3.4Å; T648-N708 PolarHBondContact OG1-OD1 2.82Å
709	Y	92.3	Very high	87.2	Confident	31 Å²	31	63.5 Å²	63.5	12%	0.122	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144	175.7	-52.9	-84.4	0	0	0	110.3	N646 I647 A649 F669 I671 F684 I694 F707	N646-Y709 CarbonylContact C-O 3.54Å; N646-Y709 WeakPolarHBondContact CA-O 3.16Å; I647-Y709 HydrophobicContact CD1-CD2 4.39Å; I647-Y709 HydrophobicContact CG1-CD2 4.37Å; I647-Y709 PolarHBondContact N-O 3.08Å; I647-Y709 PolarHBondContact O-N 2.94Å; A649-Y709 HydrophobicContact CB-CE2 4.45Å; F669-Y709 HydrophobicContact CE2-CE2 4.17Å; F669-Y709 VanDerWaalsContact CE2-OH 3.28Å; F669-Y709 WeakPolarHBondContact CE2-OH 3.47Å; F669-Y709 VanDerWaalsContact CZ-OH 3.27Å; F669-Y709 WeakPolarHBondContact CZ-OH 3.19Å; I671-Y709 HydrophobicContact CD1-CD2 3.68Å; I671-Y709 HydrophobicContact CD1-CE2 3.53Å; F684-Y709 HydrophobicContact CE1-CG 4.49Å; I694-Y709 HydrophobicContact CD1-CD1 3.93Å; I694-Y709 HydrophobicContact CD1-CE1 3.73Å; I694-Y709 HydrophobicContact CG1-CE1 4.49Å; I694-Y709 HydrophobicContact CG2-CD1 4.42Å; I694-Y709 HydrophobicContact CG2-CE1 4.37Å; F707-Y709 HydrophobicContact CB-CE2 3.6Å
710	S	91.6	Very high	86.5	Confident	45 Å²	45	60.1 Å²	60.1	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.9	172.8	-158.2	0	0	0	0	110.2	N646	N646-S710 WeakPolarHBondContact OD1-CA 3.47Å; N646-S710 VanDerWaalsContact OD1-CB 3.25Å; N646-S710 WeakPolarHBondContact OD1-CB 3.38Å; N646-S710 PolarHBondContact OD1-OG 2.99Å
711	I	91.4	Very high	85.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	115.2	175.8	-65.1	177	0	0	0	108.1	M644 T645 I647 V673 F684 M713 I726	M644-I711 PolarHBondContact N-O 3.17Å; T645-I711 HydrophobicContact CG2-CB 4Å; T645-I711 HydrophobicContact CG2-CD1 4.48Å; T645-I711 PolarHBondContact N-O 2.88Å; T645-I711 PolarHBondContact O-N 2.94Å; I647-I711 HydrophobicContact CD1-CD1 4.17Å; I647-I711 HydrophobicContact CG1-CD1 4.4Å; I647-I711 HydrophobicContact CG2-CD1 3.9Å; V673-I711 HydrophobicContact CG2-CD1 3.87Å; V673-I711 HydrophobicContact CG2-CG1 4.34Å; F684-I711 HydrophobicContact CD1-CG1 4.23Å; F684-I711 HydrophobicContact CE1-CD1 4.28Å; F684-I711 HydrophobicContact CE1-CG1 3.68Å; F684-I711 HydrophobicContact CZ-CD1 4.48Å; F684-I711 HydrophobicContact CZ-CG1 4.3Å; I711-M713 HydrophobicContact CG2-CE 3.97Å; I711-I726 HydrophobicContact CD1-CD1 3.43Å; I711-I726 VanDerWaalsContact CD1-CD1 3.43Å; I711-I726 HydrophobicContact CD1-CG1 4.2Å
712	S	89.8	Confident	85.2	Confident	7 Å²	7	62.2 Å²	62.2	5%	0.049	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	152.3	173.4	-59.5	0	0	0	0	111.1	L642 G682 F683 I685	L642-S712 CarbonylContact O-C 3.53Å; L642-S712 WeakPolarHBondContact O-CA 3.43Å; G682-S712 CarbonylContact C-O 3.57Å; G682-S712 WeakPolarHBondContact CA-O 3.24Å; F683-S712 PolarHBondContact N-O 3.1Å; F683-S712 PolarHBondContact O-N 2.84Å; I685-S712 WeakPolarHBondContact CD1-OG 3.46Å
713	M	88.3	Confident	85	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	158.2	176.7	-50.9	-167.9	-179.7	0	0	110.4	I626 P641 L642 M644 R681 I711 I717 V724 F756	I626-M713 HydrophobicContact CD1-CE 3.71Å; I626-M713 HydrophobicContact CD1-SD 4.45Å; I626-M713 HydrophobicContact CG1-CE 4.37Å; P641-M713 WeakPolarHBondContact CA-O 3.36Å; L642-M713 PolarHBondContact N-O 3.24Å; L642-M713 PolarHBondContact O-N 2.84Å; M644-M713 HydrophobicContact CB-CE 4.22Å; M644-M713 HydrophobicContact CB-CG 3.99Å; M644-M713 HydrophobicContact CB-SD 4.09Å; M644-M713 HydrophobicContact CG-CB 3.66Å; M644-M713 HydrophobicContact CG-CG 3.55Å; M644-M713 HydrophobicContact CG-SD 3.94Å; R681-M713 WeakPolarHBondContact O-CB 3.35Å; R681-M713 WeakPolarHBondContact O-CG 3.37Å; I711-M713 HydrophobicContact CG2-CE 3.97Å; M713-I717 HydrophobicContact CB-CD1 3.71Å; M713-I717 HydrophobicContact CG-CD1 4.28Å; M713-I717 HydrophobicContact SD-CD1 3.71Å; M713-V724 HydrophobicContact CE-CG1 4.47Å; M713-V724 HydrophobicContact CE-CG2 4.06Å; M713-F756 HydrophobicContact SD-CE1 4.49Å; M713-F756 HydrophobicContact SD-CZ 4.46Å
714	N	83.9	Confident	85	Confident	66 Å²	66	50.2 Å²	50.2	35%	0.353	27%	0.269	S	S	.	.			trans	-72	148.6	173.8	-68.9	-7.8	0	0	0	110.5	F683 C716 I717	F683-N714 VanDerWaalsContact CE1-OD1 3.31Å; F683-N714 WeakPolarHBondContact CE1-OD1 3.26Å; F683-N714 VanDerWaalsContact CZ-OD1 3.24Å; F683-N714 WeakPolarHBondContact CZ-OD1 3.39Å; N714-C716 PolarHBondContact O-N 2.86Å; N714-C716 VanDerWaalsContact O-N 3.16Å; N714-I717 WeakPolarHBondContact O-CG1 3.31Å
715	K	77.5	Confident	84.9	Confident	53 Å²	53	46.9 Å²	46.9	23%	0.23	26%	0.255	C	S	.	.	S	Bend	trans	-61.8	-24.4	-179.5	-170.8	175.2	172.7	-176.5	0	113.4	I631 N632 D635	I631-K715 CarbonylContact C-O 3.58Å; I631-K715 WeakPolarHBondContact CA-O 3.43Å; N632-K715 PolarHBondContact N-O 2.79Å; D635-K715 WeakPolarHBondContact OD2-CE 3.31Å; D635-K715 IonicContact OD2-NZ 3.92Å; D635-K715 PolarHBondContact OD2-NZ 2.89Å
716	C	78.1	Confident	84.7	Confident	53 Å²	53	45.5 Å²	45.5	36%	0.358	25%	0.247	S	C	.	.			trans	-108.6	118.5	168.7	-179.9	0	0	0	0	112	C633 N714	C633-C716 HydrophobicContact CB-CB 3.87Å; C633-C716 WeakPolarHBondContact CB-SG 3.42Å; C633-C716 WeakPolarHBondContact SG-CA 3.33Å; C633-C716 WeakPolarHBondContact SG-CB 3.42Å; C633-C716 CovalentContact SG-SG 2.04Å; C633-C716 PolarHBondContact SG-SG 3.12Å; N714-C716 PolarHBondContact O-N 2.86Å; N714-C716 VanDerWaalsContact O-N 3.16Å
717	I	78.2	Confident	84.7	Confident	16 Å²	16	46 Å²	46	8%	0.082	24%	0.242	C	C	.	.			trans	-126.2	125.4	172.7	-47.6	-176.8	0	0	0	108.5	I631 R681 M713 N714 T720 F756	I631-I717 HydrophobicContact CD1-CD1 3.89Å; I631-I717 HydrophobicContact CD1-CG1 4.42Å; I631-I717 HydrophobicContact CG1-CD1 4.44Å; I631-I717 HydrophobicContact CG2-CB 4.03Å; I631-I717 HydrophobicContact CG2-CG1 4.13Å; R681-I717 HydrophobicContact CB-CG2 4.15Å; R681-I717 HydrophobicContact CG-CG2 3.79Å; M713-I717 HydrophobicContact CB-CD1 3.71Å; M713-I717 HydrophobicContact CG-CD1 4.28Å; M713-I717 HydrophobicContact SD-CD1 3.71Å; N714-I717 WeakPolarHBondContact O-CG1 3.31Å; I717-T720 HydrophobicContact CB-CG2 4.17Å; I717-T720 HydrophobicContact CG2-CG2 4.36Å; I717-F756 HydrophobicContact CD1-CE1 4.38Å; I717-F756 HydrophobicContact CD1-CZ 4.49Å
718	Q	72.8	Confident	84.6	Confident	192 Å²	192	44.6 Å²	44.6	90%	0.897	24%	0.236	S	C	*	.	S	Bend	trans	-82	-22.6	-178.9	-67	-173.6	-8	0	0	114.3
719	D	76.1	Confident	84.6	Confident	48 Å²	48	41.3 Å²	41.3	26%	0.257	22%	0.219	S	C	.	.			trans	-120.5	84.2	-178.2	-179	-4.7	0	0	0	110.1	R677 R681 L721 S722	R677-D719 IonicContact CZ-OD2 2.79Å; R677-D719 IonicContact NH1-OD2 3.2Å; R677-D719 PolarHBondContact NH1-OD2 3.48Å; R677-D719 IonicContact NH2-OD2 3.83Å; R677-D719 PolarHBondContact NH2-OD2 3.01Å; R681-D719 VanDerWaalsContact CD-O 3.28Å; R681-D719 WeakPolarHBondContact CD-O 3.46Å; R681-D719 PolarHBondContact NH1-O 3.09Å; R681-D719 IonicContact NH1-OD1 2.92Å; R681-D719 IonicContact NH1-OD2 2.66Å; D719-L721 PolarHBondContact OD1-N 3Å; D719-S722 PolarHBondContact OD1-N 3.15Å; D719-S722 PolarHBondContact OD1-OG 3.33Å; D719-S722 PolarHBondContact OD2-OG 3.03Å
720	T	76.2	Confident	84.7	Confident	40 Å²	40	40.3 Å²	40.3	25%	0.245	22%	0.215	C	C	.	.			trans	-98.6	16.3	171.9	53	0	0	0	0	112.1	I628 I631 I717 F756	I628-T720 HydrophobicContact CG2-CG2 4.48Å; I631-T720 HydrophobicContact CD1-CG2 3.75Å; I631-T720 HydrophobicContact CG2-CG2 4.25Å; I717-T720 HydrophobicContact CB-CG2 4.17Å; I717-T720 HydrophobicContact CG2-CG2 4.36Å; T720-F756 HydrophobicContact CG2-CD1 4.17Å; T720-F756 HydrophobicContact CG2-CE1 4.12Å; T720-F756 WeakPolarHBondContact O-CB 3.31Å; T720-F756 WeakPolarHBondContact O-CG 3.34Å
721	L	71.6	Confident	84.6	Confident	114 Å²	114	40.1 Å²	40.1	60%	0.597	21%	0.214	S	C	*	.	S	Bend	trans	-102.9	-34.9	-177.4	-68.7	176.6	0	0	0	112.7	D719 P847	D719-L721 PolarHBondContact OD1-N 3Å; L721-P847 HydrophobicContact CB-CG 3.79Å; L721-P847 WeakPolarHBondContact O-CB 3.08Å; L721-P847 WeakPolarHBondContact O-CG 3.49Å
722	S	77.1	Confident	84.5	Confident	21 Å²	21	40.6 Å²	40.6	15%	0.147	22%	0.216	C	C	.	.	S	Bend	trans	-96.9	145.8	178.2	59.2	0	0	0	0	111.3	R677 R681 D719 F756	R677-S722 PolarHBondContact NH2-OG 2.91Å; R681-S722 PolarHBondContact NH1-O 2.84Å; R681-S722 PolarHBondContact NH1-OG 2.78Å; R681-S722 VanDerWaalsContact NH1-OG 3.12Å; D719-S722 PolarHBondContact OD1-N 3.15Å; D719-S722 PolarHBondContact OD1-OG 3.33Å; D719-S722 PolarHBondContact OD2-OG 3.03Å; S722-F756 WeakPolarHBondContact O-CD2 3.37Å; S722-F756 WeakPolarHBondContact O-CE2 3.35Å
723	P	84	Confident	83.8	Confident	30 Å²	30	44.1 Å²	44.1	20%	0.195	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-64.5	155.1	-178.9	28.9	-36	0	0	0	112.2	R681 N725 E753 V754	R681-P723 PolarHBondContact NH2-O 3.27Å; P723-N725 PolarHBondContact O-OD1 2.82Å; P723-E753 HydrophobicContact CB-CB 3.95Å; P723-E753 HydrophobicContact CG-CB 4.09Å; P723-V754 CarbonylContact C-O 3.59Å; P723-V754 VanDerWaalsContact CA-O 3.25Å; P723-V754 WeakPolarHBondContact CA-O 3.42Å; P723-V754 WeakPolarHBondContact CB-O 3.11Å
724	V	87.3	Confident	82.8	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.8	170.9	177.7	0	0	0	0	108.6	I626 V673 M713 I726 V754 F756	I626-V724 HydrophobicContact CD1-CB 4.3Å; I626-V724 HydrophobicContact CD1-CG2 3.89Å; V673-V724 HydrophobicContact CG1-CG1 3.66Å; M713-V724 HydrophobicContact CE-CG1 4.47Å; M713-V724 HydrophobicContact CE-CG2 4.06Å; V724-I726 HydrophobicContact CG1-CG1 4.44Å; V724-V754 HydrophobicContact CB-CB 4.44Å; V724-V754 PolarHBondContact N-O 2.92Å; V724-V754 PolarHBondContact O-N 3.18Å; V724-F756 HydrophobicContact CG2-CE2 3.67Å; V724-F756 HydrophobicContact CG2-CZ 3.72Å
725	N	89.3	Confident	82	Confident	32 Å²	32	45.9 Å²	45.9	17%	0.171	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.4	-173.9	-72.6	17.7	0	0	0	110	D674 P675 P723 M751 E753	D674-N725 WeakPolarHBondContact CA-O 3.09Å; D674-N725 PolarHBondContact N-O 3.14Å; D674-N725 PolarHBondContact OD1-N 3.33Å; P675-N725 WeakPolarHBondContact CD-O 3.3Å; P723-N725 PolarHBondContact O-OD1 2.82Å; N725-M751 HydrophobicContact CB-CE 4.13Å; N725-M751 WeakPolarHBondContact ND2-CE 3.25Å; N725-E753 PolarHBondContact ND2-OE1 3.11Å; N725-E753 WeakPolarHBondContact OD1-CG 3.41Å; N725-E753 PolarHBondContact OD1-OE1 3.11Å
726	I	91.1	Very high	81.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.4	-175.6	-54.4	175.1	0	0	0	107.6	L619 I647 I671 I711 V724 M751 V752 V754	L619-I726 HydrophobicContact CD1-CG2 4.31Å; I647-I726 HydrophobicContact CD1-CG2 4.18Å; I647-I726 HydrophobicContact CG2-CD1 3.69Å; I671-I726 HydrophobicContact CG2-CG2 3.73Å; I711-I726 HydrophobicContact CD1-CD1 3.43Å; I711-I726 VanDerWaalsContact CD1-CD1 3.43Å; I711-I726 HydrophobicContact CD1-CG1 4.2Å; V724-I726 HydrophobicContact CG1-CG1 4.44Å; I726-M751 CarbonylContact O-C 3.55Å; I726-M751 VanDerWaalsContact O-CA 3.29Å; I726-M751 WeakPolarHBondContact O-CA 3.11Å; I726-V752 HydrophobicContact CB-CG1 4.02Å; I726-V752 PolarHBondContact N-O 3.07Å; I726-V752 PolarHBondContact O-N 2.66Å; I726-V754 HydrophobicContact CD1-CG2 3.55Å; I726-V754 HydrophobicContact CG1-CG2 4.33Å
727	K	93.3	Very high	80.8	Confident	68 Å²	68	54.7 Å²	54.7	30%	0.296	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.9	-177.3	-179.2	-173.4	174.4	-169.3	0	110.2	I671 I672 P675	I671-K727 CarbonylContact C-O 3.54Å; I671-K727 WeakPolarHBondContact CA-O 3.43Å; I672-K727 PolarHBondContact N-O 3.48Å; I672-K727 PolarHBondContact O-N 2.77Å; P675-K727 HydrophobicContact CG-CB 4.04Å
728	L	94.1	Very high	80.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.7	168.2	179.7	162.4	0	0	0	109.3	A617 L619 A649 F651 M670 I671 F730 R749 A750	A617-L728 HydrophobicContact CB-CD2 3.65Å; L619-L728 HydrophobicContact CD1-CB 3.76Å; L619-L728 HydrophobicContact CD2-CB 4.18Å; L619-L728 HydrophobicContact CD2-CD1 3.92Å; L619-L728 HydrophobicContact CG-CB 4.02Å; L619-L728 HydrophobicContact CG-CD1 4.26Å; A649-L728 HydrophobicContact CB-CD1 3.62Å; F651-L728 HydrophobicContact CE1-CD1 4.5Å; F651-L728 HydrophobicContact CE1-CD2 4.11Å; F651-L728 HydrophobicContact CZ-CD1 3.91Å; F651-L728 HydrophobicContact CZ-CD2 4.2Å; M670-L728 WeakPolarHBondContact O-CA 2.98Å; I671-L728 HydrophobicContact CD1-CD1 4.31Å; I671-L728 HydrophobicContact CG1-CB 4.35Å; I671-L728 HydrophobicContact CG1-CD1 4.16Å; I671-L728 HydrophobicContact CG1-CG 4.23Å; L728-F730 HydrophobicContact CD2-CD1 4.13Å; L728-R749 WeakPolarHBondContact O-CA 3.43Å; L728-A750 HydrophobicContact CB-CB 4.37Å; L728-A750 PolarHBondContact N-O 2.65Å; L728-A750 PolarHBondContact O-N 2.93Å; L728-A750 VanDerWaalsContact O-O 3.11Å
729	N	93.3	Very high	80.8	Confident	49 Å²	49	50.3 Å²	50.3	26%	0.262	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.3	165.1	55.4	-102.3	0	0	0	110.1	F669 M670 R748	F669-N729 WeakPolarHBondContact CA-O 3.5Å; M670-N729 PolarHBondContact N-O 2.97Å; M670-N729 PolarHBondContact O-N 3.39Å; N729-R748 WeakPolarHBondContact CA-O 3.21Å
730	F	93.3	Very high	81.4	Confident	9 Å²	9	48 Å²	48	4%	0.039	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.4	177	78.4	-92.2	0	0	0	113.2	V615 A617 F651 I667 S668 F669 L728 L742 R748	V615-F730 HydrophobicContact CB-CE2 3.95Å; V615-F730 HydrophobicContact CB-CZ 3.71Å; V615-F730 HydrophobicContact CG1-CE1 4.36Å; V615-F730 HydrophobicContact CG1-CE2 3.87Å; V615-F730 HydrophobicContact CG1-CZ 3.56Å; V615-F730 WeakPolarHBondContact O-CZ 3.35Å; A617-F730 HydrophobicContact CB-CD1 3.87Å; A617-F730 HydrophobicContact CB-CE1 3.66Å; F651-F730 HydrophobicContact CD1-CD1 4.15Å; F651-F730 HydrophobicContact CD1-CE1 4.18Å; F651-F730 HydrophobicContact CE1-CB 4.12Å; F651-F730 AromaticContact CE1-CD1 3.65Å; F651-F730 HydrophobicContact CE1-CD1 3.65Å; F651-F730 HydrophobicContact CE1-CE1 4.14Å; F651-F730 AromaticContact CE1-CG 3.92Å; F651-F730 HydrophobicContact CE1-CG 3.92Å; I667-F730 HydrophobicContact CB-CD2 4.2Å; I667-F730 HydrophobicContact CD1-CB 4.4Å; I667-F730 HydrophobicContact CD1-CD2 4Å; I667-F730 HydrophobicContact CD1-CG 4.28Å; I667-F730 HydrophobicContact CG2-CD2 4.07Å; I667-F730 HydrophobicContact CG2-CE2 4.31Å; S668-F730 CarbonylContact O-C 3.56Å; S668-F730 VanDerWaalsContact O-CA 3.23Å; S668-F730 WeakPolarHBondContact O-CA 3.43Å; S668-F730 WeakPolarHBondContact O-CB 3.46Å; F669-F730 HydrophobicContact CB-CB 3.57Å; L728-F730 HydrophobicContact CD2-CD1 4.13Å; F730-L742 HydrophobicContact CD2-CD2 4.06Å; F730-L742 HydrophobicContact CE2-CD1 3.81Å; F730-L742 HydrophobicContact CE2-CD2 3.59Å; F730-L742 HydrophobicContact CE2-CG 4.37Å; F730-L742 HydrophobicContact CZ-CD1 4.34Å; F730-R748 VanDerWaalsContact CE1-CA 3.41Å; F730-R748 HydrophobicContact CE1-CB 4.39Å; F730-R748 HydrophobicContact CE2-CG 4.34Å; F730-R748 HydrophobicContact CZ-CG 4.22Å; F730-R748 PolarHBondContact N-O 3.02Å
731	S	91.1	Very high	82.1	Confident	42 Å²	42	46.3 Å²	46.3	29%	0.294	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.3	178.6	44.2	0	0	0	0	109.7	I667 S668 D733	I667-S731 WeakPolarHBondContact CA-O 3.42Å; S668-S731 PolarHBondContact N-O 3.25Å; S668-S731 PolarHBondContact O-N 3.1Å; S731-D733 WeakPolarHBondContact CB-OD1 3.26Å; S731-D733 PolarHBondContact OG-OD1 3.33Å
732	Q	88.6	Confident	82.9	Confident	9 Å²	9	41 Å²	41	4%	0.042	22%	0.224	C	C	.	.			trans	-85.4	121.4	154.5	-178.2	177.5	26.1	0	0	105.9	S734 H735 S738 A740 L742	Q732-S734 WeakPolarHBondContact CG-O 3.44Å; Q732-S734 PolarHBondContact NE2-O 2.78Å; Q732-H735 PolarHBondContact OE1-CE1 3.01Å; Q732-H735 PolarHBondContact OE1-ND1 2.91Å; Q732-H735 VanDerWaalsContact OE1-ND1 3.14Å; Q732-S738 PolarHBondContact NE2-OG 2.98Å; Q732-A740 PolarHBondContact NE2-O 2.88Å; Q732-L742 HydrophobicContact CB-CB 4.12Å; Q732-L742 HydrophobicContact CB-CD2 4.39Å
733	D	75.5	Confident	83.5	Confident	81 Å²	81	40.7 Å²	40.7	43%	0.433	22%	0.221	S	C	.	.			trans	-93.6	-11.7	-175.3	-68	-9.3	0	0	0	112.7	S668 R695 S731	S668-D733 WeakPolarHBondContact CB-OD2 3.19Å; S668-D733 PolarHBondContact OG-OD2 3.46Å; R695-D733 IonicContact CZ-OD2 2.76Å; R695-D733 IonicContact NH2-OD2 2.8Å; R695-D733 PolarHBondContact NH2-OD2 2.69Å; S731-D733 WeakPolarHBondContact CB-OD1 3.26Å; S731-D733 PolarHBondContact OG-OD1 3.33Å
734	S	67.1	Low	83.7	Confident	46 Å²	46	42.5 Å²	42.5	32%	0.322	23%	0.228	S	C	.	.			trans	-133.8	116	-177.6	179.3	0	0	0	0	110.1	Q732 S738	Q732-S734 WeakPolarHBondContact CG-O 3.44Å; Q732-S734 PolarHBondContact NE2-O 2.78Å; S734-S738 WeakPolarHBondContact O-CB 3.25Å
735	H	67.6	Low	83.6	Confident	60 Å²	60	46.7 Å²	46.7	28%	0.278	25%	0.25	S	S	.	.			trans	-106.1	-28.7	178.9	-64.2	-63.7	0	0	0	113.3	A25 K610 Q732 I741	A25-H735 HydrophobicContact CB-CB 4.04Å; K610-H735 PolarHBondContact NZ-O 3.32Å; Q732-H735 PolarHBondContact OE1-CE1 3.01Å; Q732-H735 PolarHBondContact OE1-ND1 2.91Å; Q732-H735 VanDerWaalsContact OE1-ND1 3.14Å; H735-I741 HydrophobicContact CB-CD1 4.04Å
736	E	63.5	Low	83.6	Confident	142 Å²	142	45.7 Å²	45.7	66%	0.664	25%	0.246	S	C	*	.	S	Bend	trans	-66	-59.7	-173.3	-65.5	176.6	172.4	0	0	111	T31 K610 S738	T31-E736 HydrophobicContact CG2-CB 3.9Å; T31-E736 HydrophobicContact CG2-CG 4.25Å; K610-E736 PolarHBondContact NZ-O 2.77Å; E736-S738 VanDerWaalsContact C-N 3.32Å; E736-S738 PolarHBondContact O-N 2.87Å
737	N	65.6	Low	83.4	Confident	149 Å²	149	50.3 Å²	50.3	80%	0.797	27%	0.267	S	S	*	.	S	Bend	trans	-83.6	0.2	-178.5	-66.9	-19.7	0	0	0	114.3
738	S	72.8	Confident	83.2	Confident	19 Å²	19	50.6 Å²	50.6	13%	0.133	27%	0.267	C	S	.	.			trans	-83.5	141.3	-177.3	-158.1	0	0	0	0	111.6	K610 Q732 S734 E736 A740	K610-S738 PolarHBondContact NZ-O 2.94Å; Q732-S738 PolarHBondContact NE2-OG 2.98Å; S734-S738 WeakPolarHBondContact O-CB 3.25Å; E736-S738 VanDerWaalsContact C-N 3.32Å; E736-S738 PolarHBondContact O-N 2.87Å; S738-A740 PolarHBondContact OG-O 3.33Å
739	T	79.6	Confident	83	Confident	96 Å²	96	59.8 Å²	59.8	59%	0.589	30%	0.301	S	S	*	.	S	Bend	trans	-77.9	-19.1	-178.9	41.8	0	0	0	0	113.6	P611	P611-T739 WeakPolarHBondContact CD-O 3.41Å
740	A	88	Confident	83	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-145.3	161.2	175.3	0	0	0	0	0	110.6	P611 L613 P663 Q732 S738	P611-A740 HydrophobicContact CB-CB 4.01Å; P611-A740 HydrophobicContact CG-CB 4.5Å; P611-A740 CarbonylContact O-C 3.55Å; P611-A740 WeakPolarHBondContact O-CA 3.35Å; P611-A740 WeakPolarHBondContact O-CB 3.34Å; L613-A740 HydrophobicContact CD1-CB 3.63Å; L613-A740 HydrophobicContact CG-CB 4.21Å; P663-A740 HydrophobicContact CB-CB 3.56Å; P663-A740 HydrophobicContact CG-CB 3.71Å; Q732-A740 PolarHBondContact NE2-O 2.88Å; S738-A740 PolarHBondContact OG-O 3.33Å
741	I	89.8	Confident	82.8	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.2	-178	-52.5	-65.4	0	0	0	111.2	F26 K610 P611 V612 L613 H735 N743	F26-I741 WeakPolarHBondContact O-CG2 3.37Å; K610-I741 HydrophobicContact CB-CG1 4.15Å; K610-I741 HydrophobicContact CD-CD1 4.07Å; K610-I741 HydrophobicContact CD-CG1 4Å; P611-I741 PolarHBondContact O-N 2.98Å; V612-I741 WeakPolarHBondContact CA-O 3.44Å; L613-I741 PolarHBondContact N-O 2.88Å; H735-I741 HydrophobicContact CB-CD1 4.04Å; I741-N743 PolarHBondContact O-N 3.33Å
742	L	89.7	Confident	82.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	121.6	174	176.7	63.6	0	0	0	110.4	V615 I665 F730 Q732 I744 R748	V615-L742 HydrophobicContact CB-CD1 3.66Å; V615-L742 HydrophobicContact CG2-CD1 3.67Å; I665-L742 HydrophobicContact CD1-CB 3.78Å; F730-L742 HydrophobicContact CD2-CD2 4.06Å; F730-L742 HydrophobicContact CE2-CD1 3.81Å; F730-L742 HydrophobicContact CE2-CD2 3.59Å; F730-L742 HydrophobicContact CE2-CG 4.37Å; F730-L742 HydrophobicContact CZ-CD1 4.34Å; Q732-L742 HydrophobicContact CB-CB 4.12Å; Q732-L742 HydrophobicContact CB-CD2 4.39Å; L742-I744 PolarHBondContact O-N 3.3Å; L742-R748 HydrophobicContact CD2-CG 4.14Å; L742-R748 PolarHBondContact O-NH2 2.65Å
743	N	89.8	Confident	82.6	Confident	14 Å²	14	66.2 Å²	66.2	8%	0.075	33%	0.331	C	S	.	.			trans	-50.8	133.9	-178.8	-170	-30.9	0	0	0	111.3	V612 L613 D614 I741 D745 S746 R748	V612-N743 HydrophobicContact CG1-CB 3.6Å; L613-N743 PolarHBondContact O-N 2.78Å; D614-N743 HydrophobicContact CB-CB 4.38Å; I741-N743 PolarHBondContact O-N 3.33Å; N743-D745 PolarHBondContact O-N 3.37Å; N743-D745 PolarHBondContact OD1-N 3.26Å; N743-S746 WeakPolarHBondContact CB-OG 3.04Å; N743-S746 VanDerWaalsContact O-CB 3.31Å; N743-S746 WeakPolarHBondContact O-CB 3.45Å; N743-S746 PolarHBondContact O-N 2.86Å; N743-S746 VanDerWaalsContact O-N 3.16Å; N743-S746 PolarHBondContact O-OG 3.34Å; N743-S746 VanDerWaalsContact O-OG 3.14Å; N743-R748 PolarHBondContact O-NH2 3.16Å
744	I	86.9	Confident	83.1	Confident	69 Å²	69	62.4 Å²	62.4	35%	0.354	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.6	-178.2	-168.5	163.4	0	0	0	112.4	F26 L551 L742	F26-I744 HydrophobicContact CD2-CB 4.16Å; F26-I744 HydrophobicContact CD2-CG2 4.1Å; F26-I744 HydrophobicContact CE2-CB 4.27Å; F26-I744 HydrophobicContact CE2-CG2 3.91Å; L551-I744 HydrophobicContact CD1-CG2 3.86Å; L742-I744 PolarHBondContact O-N 3.3Å
745	D	86.5	Confident	83.9	Confident	89 Å²	89	62.1 Å²	62.1	48%	0.476	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.4	-177.3	-60.5	-48	0	0	0	114	R559 N743	R559-D745 IonicContact CZ-OD2 3.6Å; R559-D745 VanDerWaalsContact CZ-OD2 3.24Å; R559-D745 VanDerWaalsContact NH1-CG 3.29Å; R559-D745 IonicContact NH1-OD1 3.39Å; R559-D745 PolarHBondContact NH1-OD1 2.93Å; R559-D745 IonicContact NH1-OD2 3.86Å; R559-D745 PolarHBondContact NH1-OD2 2.83Å; R559-D745 IonicContact NH2-OD2 2.63Å; R559-D745 PolarHBondContact NH2-OD2 2.91Å; N743-D745 PolarHBondContact O-N 3.37Å; N743-D745 PolarHBondContact OD1-N 3.26Å
746	S	88.6	Confident	84.5	Confident	11 Å²	11	59.6 Å²	59.6	8%	0.077	30%	0.296	C	S	.	.	S	Bend	trans	-54.6	149.2	-178.7	-72.7	0	0	0	0	114.5	D614 V615 N743 R748	D614-S746 WeakPolarHBondContact OD1-CA 3.48Å; D614-S746 VanDerWaalsContact OD1-CB 3.25Å; D614-S746 WeakPolarHBondContact OD1-CB 3.48Å; D614-S746 PolarHBondContact OD1-OG 2.97Å; V615-S746 PolarHBondContact N-OG 3.25Å; N743-S746 WeakPolarHBondContact CB-OG 3.04Å; N743-S746 VanDerWaalsContact O-CB 3.31Å; N743-S746 WeakPolarHBondContact O-CB 3.45Å; N743-S746 PolarHBondContact O-N 2.86Å; N743-S746 VanDerWaalsContact O-N 3.16Å; N743-S746 PolarHBondContact O-OG 3.34Å; N743-S746 VanDerWaalsContact O-OG 3.14Å; S746-R748 WeakPolarHBondContact O-CG 3.48Å; S746-R748 PolarHBondContact O-N 3.45Å
747	Q	86.3	Confident	84.9	Confident	96 Å²	96	55.3 Å²	55.3	45%	0.449	28%	0.276	S	S	.	.			trans	-77.7	66.9	178.1	-62.9	-164.1	-28.3	0	0	111.7	K616 R749	K616-Q747 HydrophobicContact CG-CB 4.36Å; Q747-R749 PolarHBondContact O-N 3.03Å
748	R	89.3	Confident	85.1	Confident	74 Å²	74	52.3 Å²	52.3	28%	0.279	26%	0.255	S	S	.	.			trans	-64.4	9.2	-173.3	-66.2	178	-167.4	-151.9	-2.6	116.1	N729 F730 L742 N743 S746	N729-R748 WeakPolarHBondContact CA-O 3.21Å; F730-R748 VanDerWaalsContact CE1-CA 3.41Å; F730-R748 HydrophobicContact CE1-CB 4.39Å; F730-R748 HydrophobicContact CE2-CG 4.34Å; F730-R748 HydrophobicContact CZ-CG 4.22Å; F730-R748 PolarHBondContact N-O 3.02Å; L742-R748 HydrophobicContact CD2-CG 4.14Å; L742-R748 PolarHBondContact O-NH2 2.65Å; N743-R748 PolarHBondContact O-NH2 3.16Å; S746-R748 WeakPolarHBondContact O-CG 3.48Å; S746-R748 PolarHBondContact O-N 3.45Å
749	R	91.2	Very high	84.5	Confident	194 Å²	194	59.9 Å²	59.9	73%	0.732	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	138	-173.2	-52.7	177.4	-163.3	152.1	8.3	110.9	L728 Q747	L728-R749 WeakPolarHBondContact O-CA 3.43Å; Q747-R749 PolarHBondContact O-N 3.03Å
750	A	92.1	Very high	83.5	Confident	15 Å²	15	57.9 Å²	57.9	12%	0.124	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151	166	0	0	0	0	0	109.7	A617 L619 L728	A617-A750 HydrophobicContact CB-CB 4.14Å; L619-A750 HydrophobicContact CB-CB 4.29Å; L619-A750 HydrophobicContact CD1-CB 4.05Å; L619-A750 HydrophobicContact CG-CB 3.88Å; L728-A750 HydrophobicContact CB-CB 4.37Å; L728-A750 PolarHBondContact N-O 2.65Å; L728-A750 PolarHBondContact O-N 2.93Å; L728-A750 VanDerWaalsContact O-O 3.11Å
751	M	89.6	Confident	81.8	Confident	103 Å²	103	67.7 Å²	67.7	51%	0.507	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	141.9	173	176.4	168.3	152.7	0	0	109.7	N725 I726 E753	N725-M751 HydrophobicContact CB-CE 4.13Å; N725-M751 WeakPolarHBondContact ND2-CE 3.25Å; I726-M751 CarbonylContact O-C 3.55Å; I726-M751 VanDerWaalsContact O-CA 3.29Å; I726-M751 WeakPolarHBondContact O-CA 3.11Å; M751-E753 HydrophobicContact CE-CG 3.93Å; M751-E753 WeakPolarHBondContact CE-OE1 3.42Å
752	V	88.9	Confident	80.2	Confident	25 Å²	25	74.9 Å²	74.9	15%	0.152	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.1	173.7	70.2	0	0	0	0	110.3	L619 F621 I726	L619-V752 HydrophobicContact CB-CB 4.33Å; L619-V752 HydrophobicContact CB-CG1 4.03Å; L619-V752 HydrophobicContact CD1-CG1 4.26Å; F621-V752 HydrophobicContact CD1-CG1 4.39Å; F621-V752 HydrophobicContact CD1-CG2 3.53Å; F621-V752 HydrophobicContact CE1-CG2 3.48Å; F621-V752 VanDerWaalsContact CE1-CG2 3.48Å; I726-V752 HydrophobicContact CB-CG1 4.02Å; I726-V752 PolarHBondContact N-O 3.07Å; I726-V752 PolarHBondContact O-N 2.66Å
753	E	86.7	Confident	78.5	Confident	101 Å²	101	84.5 Å²	84.5	47%	0.472	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.1	177.1	-58.6	-158.4	148.2	0	0	108.7	P723 N725 M751 P755	P723-E753 HydrophobicContact CB-CB 3.95Å; P723-E753 HydrophobicContact CG-CB 4.09Å; N725-E753 PolarHBondContact ND2-OE1 3.11Å; N725-E753 WeakPolarHBondContact OD1-CG 3.41Å; N725-E753 PolarHBondContact OD1-OE1 3.11Å; M751-E753 HydrophobicContact CE-CG 3.93Å; M751-E753 WeakPolarHBondContact CE-OE1 3.42Å; E753-P755 WeakPolarHBondContact O-CD 3.44Å
754	V	85.6	Confident	77.1	Confident	0 Å²	0	88.3 Å²	88.3	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	105.9	-175.8	-177.3	0	0	0	0	109.5	F621 I626 P723 V724 I726	F621-V754 HydrophobicContact CB-CG2 4.19Å; F621-V754 HydrophobicContact CD1-CG2 4.21Å; F621-V754 HydrophobicContact CD2-CB 4.21Å; F621-V754 HydrophobicContact CD2-CG1 3.67Å; F621-V754 HydrophobicContact CD2-CG2 3.72Å; F621-V754 HydrophobicContact CE2-CB 4.19Å; F621-V754 HydrophobicContact CE2-CG1 3.71Å; F621-V754 HydrophobicContact CE2-CG2 4.06Å; F621-V754 HydrophobicContact CG-CG2 3.79Å; F621-V754 HydrophobicContact CZ-CG2 4.45Å; I626-V754 HydrophobicContact CD1-CB 4.23Å; I626-V754 HydrophobicContact CD1-CG1 3.52Å; I626-V754 HydrophobicContact CG1-CG1 3.65Å; P723-V754 CarbonylContact C-O 3.59Å; P723-V754 VanDerWaalsContact CA-O 3.25Å; P723-V754 WeakPolarHBondContact CA-O 3.42Å; P723-V754 WeakPolarHBondContact CB-O 3.11Å; V724-V754 HydrophobicContact CB-CB 4.44Å; V724-V754 PolarHBondContact N-O 2.92Å; V724-V754 PolarHBondContact O-N 3.18Å; I726-V754 HydrophobicContact CD1-CG2 3.55Å; I726-V754 HydrophobicContact CG1-CG2 4.33Å
755	P	83.2	Confident	76.1	Confident	41 Å²	41	85.9 Å²	85.9	27%	0.266	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-75	154.5	-177.8	30.8	-35.6	0	0	0	112.7	V625 I626 E753	V625-P755 CarbonylContact C-O 3.59Å; V625-P755 WeakPolarHBondContact CA-O 3.39Å; V625-P755 HydrophobicContact CG1-CG 4.22Å; I626-P755 PolarHBondContact N-O 3.28Å; E753-P755 WeakPolarHBondContact O-CD 3.44Å
756	F	81.1	Confident	75.4	Confident	7 Å²	7	85.3 Å²	85.3	3%	0.031	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-86.7	153.8	166	-68.8	-89.2	0	0	0	111.3	I626 I628 I631 M713 I717 T720 S722 V724	I626-F756 HydrophobicContact CB-CD1 3.72Å; I626-F756 HydrophobicContact CB-CE1 4.03Å; I626-F756 HydrophobicContact CB-CG 4.34Å; I626-F756 HydrophobicContact CD1-CD1 4.28Å; I626-F756 HydrophobicContact CD1-CE1 4.02Å; I626-F756 HydrophobicContact CD1-CE2 4.41Å; I626-F756 HydrophobicContact CD1-CZ 4.09Å; I626-F756 HydrophobicContact CG2-CD1 3.57Å; I626-F756 HydrophobicContact CG2-CE1 3.58Å; I626-F756 WeakPolarHBondContact O-CA 3.24Å; I628-F756 HydrophobicContact CG2-CB 3.97Å; I628-F756 HydrophobicContact CG2-CD1 4.05Å; I628-F756 HydrophobicContact CG2-CG 4.44Å; I631-F756 HydrophobicContact CD1-CD1 4.16Å; I631-F756 HydrophobicContact CD1-CE1 3.84Å; M713-F756 HydrophobicContact SD-CE1 4.49Å; M713-F756 HydrophobicContact SD-CZ 4.46Å; I717-F756 HydrophobicContact CD1-CE1 4.38Å; I717-F756 HydrophobicContact CD1-CZ 4.49Å; T720-F756 HydrophobicContact CG2-CD1 4.17Å; T720-F756 HydrophobicContact CG2-CE1 4.12Å; T720-F756 WeakPolarHBondContact O-CB 3.31Å; T720-F756 WeakPolarHBondContact O-CG 3.34Å; S722-F756 WeakPolarHBondContact O-CD2 3.37Å; S722-F756 WeakPolarHBondContact O-CE2 3.35Å; V724-F756 HydrophobicContact CG2-CE2 3.67Å; V724-F756 HydrophobicContact CG2-CZ 3.72Å
757	E	72.8	Confident	74.8	Confident	52 Å²	52	85.1 Å²	85.1	24%	0.243	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-57.4	128.2	169.9	178.1	-171.3	-161	0	0	111.4	I626 I628 Q629	I626-E757 WeakPolarHBondContact O-CB 3.42Å; I626-E757 PolarHBondContact O-N 2.94Å; I628-E757 HydrophobicContact CG1-CB 4.15Å; I628-E757 HydrophobicContact CG1-CG 4.27Å; I628-E757 WeakPolarHBondContact CG1-OE2 3.45Å; I628-E757 HydrophobicContact CG2-CB 4.29Å; I628-E757 PolarHBondContact N-OE2 3.27Å; Q629-E757 WeakPolarHBondContact CG-OE2 3.41Å; Q629-E757 PolarHBondContact NE2-OE1 3.45Å
758	K	69	Low	74.7	Confident	85 Å²	85	82.6 Å²	82.6	37%	0.37	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-100.6	144.1	-174.8	-59.1	178.5	-176.9	-179.5	0	111.3	Y802 E881	K758-Y802 HydrophobicContact CD-CD1 3.99Å; K758-Y802 HydrophobicContact CD-CG 4.38Å; K758-E881 IonicContact NZ-OE2 2.97Å; K758-E881 PolarHBondContact NZ-OE2 3.25Å
759	R	59.3	Low	74.6	Confident	179 Å²	179	79.5 Å²	79.5	68%	0.675	37%	0.374	S	S	*	.			trans	-123.6	145.6	171.9	-76.4	-174.2	174.9	-174.7	-0.7	111.9	I628	I628-R759 HydrophobicContact CD1-CG 4.35Å
760	C	59	Low	74.5	Confident	53 Å²	53	72.9 Å²	72.9	36%	0.358	35%	0.351	S	S	.	.			trans	-122.9	160.4	179	-74.3	0	0	0	0	110.4	K762 C765	C760-K762 WeakPolarHBondContact CB-O 3.45Å; C760-K762 PolarHBondContact O-N 2.95Å; C760-C765 HydrophobicContact CB-CB 4.27Å; C760-C765 WeakPolarHBondContact CB-SG 3.37Å; C760-C765 WeakPolarHBondContact SG-CB 3.44Å; C760-C765 CovalentContact SG-SG 2.04Å; C760-C765 PolarHBondContact SG-SG 3.14Å
761	E	53	Low	74.4	Confident	207 Å²	207	72.8 Å²	72.8	97%	0.967	35%	0.348	S	S	*	.	S	Bend	trans	-69.9	-14.9	174.9	-68.9	-168.8	153.2	0	0	113.6
762	K	55.5	Low	74.5	Confident	155 Å²	155	71 Å²	71	67%	0.674	34%	0.341	S	S	*	.	S	Bend	trans	-133.3	160.2	171.5	-63.9	174	-173.7	164.4	0	108.2	C760 I764	C760-K762 WeakPolarHBondContact CB-O 3.45Å; C760-K762 PolarHBondContact O-N 2.95Å; K762-I764 PolarHBondContact O-N 3.3Å
763	E	54.6	Low	74.8	Confident	205 Å²	205	69.8 Å²	69.8	96%	0.958	33%	0.334	S	S	*	.	S	Bend	trans	-61.9	-15.4	-178	-61.1	179.7	142.7	0	0	114.3
764	I	59.7	Low	75.1	Confident	94 Å²	94	67.7 Å²	67.7	48%	0.482	33%	0.326	S	S	.	.	S	Bend	trans	-134	125.3	176.1	-54.1	176.1	0	0	0	108.8	K762 I766	K762-I764 PolarHBondContact O-N 3.3Å; I764-I766 HydrophobicContact CG2-CG1 4.24Å
765	C	65.7	Low	75.4	Confident	17 Å²	17	68.6 Å²	68.6	12%	0.115	33%	0.33	C	S	.	.			trans	-94.1	132.8	170.8	-91.6	0	0	0	0	110.6	C760	C760-C765 HydrophobicContact CB-CB 4.27Å; C760-C765 WeakPolarHBondContact CB-SG 3.37Å; C760-C765 WeakPolarHBondContact SG-CB 3.44Å; C760-C765 CovalentContact SG-SG 2.04Å; C760-C765 PolarHBondContact SG-SG 3.14Å
766	I	72.1	Confident	75.7	Confident	78 Å²	78	71.8 Å²	71.8	40%	0.4	34%	0.344	S	S	.	.			trans	-120.1	126.3	-178	-57.1	178.6	0	0	0	111.1	I764 A798 D799	I764-I766 HydrophobicContact CG2-CG1 4.24Å; I766-A798 WeakPolarHBondContact O-CB 3.46Å; I766-D799 PolarHBondContact N-OD2 3.19Å; I766-D799 VanDerWaalsContact O-CB 3.29Å; I766-D799 WeakPolarHBondContact O-CB 3.45Å; I766-D799 PolarHBondContact O-N 2.82Å
767	A	76.4	Confident	75.9	Confident	7 Å²	7	73.8 Å²	73.8	6%	0.058	36%	0.359	C	S	.	.			trans	-110.3	127	176.2	0	0	0	0	0	111.5	L769 S801 N882	A767-L769 HydrophobicContact CB-CG 4.45Å; A767-S801 WeakPolarHBondContact CB-OG 3.28Å; A767-N882 HydrophobicContact CB-CB 3.96Å
768	D	84.3	Confident	76.5	Confident	42 Å²	42	81 Å²	81	23%	0.225	39%	0.389	C	S	.	.			trans	-108	99	170.9	171.4	10.8	0	0	0	107.6	K770 N796 R797 A798	D768-K770 WeakPolarHBondContact OD1-CE 3.43Å; D768-K770 WeakPolarHBondContact OD1-CG 3.49Å; D768-K770 IonicContact OD1-NZ 2.56Å; D768-N796 CarbonylContact O-C 3.56Å; D768-N796 VanDerWaalsContact O-CA 3.31Å; D768-N796 WeakPolarHBondContact O-CA 3.38Å; D768-N796 PolarHBondContact O-OD1 2.77Å; D768-R797 HydrophobicContact CB-CB 4.04Å; D768-R797 PolarHBondContact O-N 3.21Å; D768-R797 WeakPolarHBondContact OD2-CB 3.16Å; D768-R797 WeakPolarHBondContact OD2-CD 3.27Å; D768-A798 HydrophobicContact CB-CB 3.86Å
769	L	87.4	Confident	77.4	Confident	9 Å²	9	80.7 Å²	80.7	5%	0.047	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.4	-176.3	-64.5	-177.3	0	0	0	110.7	A767 H795 N796 T804 Y849 A878 S889	A767-L769 HydrophobicContact CB-CG 4.45Å; L769-H795 WeakPolarHBondContact CA-O 3.09Å; L769-N796 HydrophobicContact CD2-CB 3.76Å; L769-T804 HydrophobicContact CD1-CG2 3.87Å; L769-T804 HydrophobicContact CD2-CG2 4.31Å; L769-Y849 HydrophobicContact CD2-CD1 4.12Å; L769-Y849 HydrophobicContact CD2-CE1 4.42Å; L769-A878 HydrophobicContact CB-CB 4.1Å; L769-A878 HydrophobicContact CD1-CB 4.04Å; L769-S889 PolarHBondContact O-OG 2.99Å
770	K	88.6	Confident	78.7	Confident	55 Å²	55	72.4 Å²	72.4	24%	0.239	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.2	-179.2	-56	-104.9	165	-174.2	0	110.4	D768 L794 H795 E887 S889	D768-K770 WeakPolarHBondContact OD1-CE 3.43Å; D768-K770 WeakPolarHBondContact OD1-CG 3.49Å; D768-K770 IonicContact OD1-NZ 2.56Å; K770-L794 CarbonylContact O-C 3.48Å; K770-H795 PolarHBondContact N-O 3.02Å; K770-H795 PolarHBondContact O-N 3.08Å; K770-E887 IonicContact NZ-OE2 3.15Å; K770-E887 PolarHBondContact NZ-OE2 3.34Å; K770-S889 WeakPolarHBondContact CA-OG 3.4Å
771	V	90.8	Very high	80	Confident	13 Å²	13	72.5 Å²	72.5	8%	0.079	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.9	-176.7	179.6	0	0	0	0	109.8	I792 K793 L794 L806 V876 A878 S889 V891	V771-I792 HydrophobicContact CG1-CG2 4.22Å; V771-K793 WeakPolarHBondContact CA-O 3.4Å; V771-L794 HydrophobicContact CG2-CD1 3.78Å; V771-L806 HydrophobicContact CG1-CD1 4.39Å; V771-L806 HydrophobicContact CG2-CD1 4.24Å; V771-V876 HydrophobicContact CG1-CB 4.34Å; V771-V876 HydrophobicContact CG1-CG1 3.97Å; V771-A878 HydrophobicContact CG2-CB 3.6Å; V771-S889 PolarHBondContact N-OG 3.33Å; V771-V891 WeakPolarHBondContact O-CG2 3.41Å
772	D	92.1	Very high	81.5	Confident	66 Å²	66	62.7 Å²	62.7	35%	0.353	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	152.7	163.4	-176.2	17.5	0	0	0	108.1	W791 I792 K793 K893	D772-W791 HydrophobicContact CB-CZ3 4.42Å; D772-W791 WeakPolarHBondContact OD2-CH2 3.31Å; D772-I792 CarbonylContact O-C 3.56Å; D772-I792 WeakPolarHBondContact O-CA 3.47Å; D772-K793 PolarHBondContact N-O 3.32Å; D772-K793 PolarHBondContact O-N 3.09Å; D772-K893 IonicContact OD1-NZ 3.96Å
773	F	93.9	Very high	82.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157.3	178.6	91.1	-85.9	0	0	0	111.4	F775 T790 W791 I792 M874 V876 V891 K893	F773-F775 HydrophobicContact CE2-CE1 4.45Å; F773-F775 HydrophobicContact CE2-CE2 4.27Å; F773-F775 HydrophobicContact CE2-CZ 4.13Å; F773-T790 HydrophobicContact CD2-CG2 4.17Å; F773-T790 HydrophobicContact CE2-CG2 4.27Å; F773-W791 CarbonylContact C-O 3.32Å; F773-W791 WeakPolarHBondContact CA-O 3.29Å; F773-W791 VanDerWaalsContact CB-O 3.27Å; F773-W791 WeakPolarHBondContact CB-O 3.45Å; F773-I792 HydrophobicContact CB-CB 4.25Å; F773-I792 HydrophobicContact CB-CG1 3.9Å; F773-I792 HydrophobicContact CB-CG2 4.24Å; F773-M874 HydrophobicContact CE2-CB 4.33Å; F773-M874 HydrophobicContact CE2-CG 4.34Å; F773-M874 HydrophobicContact CE2-SD 3.96Å; F773-M874 HydrophobicContact CZ-CB 4.07Å; F773-M874 HydrophobicContact CZ-CG 4.26Å; F773-M874 WeakPolarHBondContact CZ-O 3.47Å; F773-M874 HydrophobicContact CZ-SD 4.46Å; F773-V876 HydrophobicContact CB-CG2 4.42Å; F773-V876 HydrophobicContact CD1-CB 3.97Å; F773-V876 HydrophobicContact CD1-CG2 3.71Å; F773-V876 HydrophobicContact CD2-CG2 4.23Å; F773-V876 HydrophobicContact CE1-CB 4.39Å; F773-V876 HydrophobicContact CE1-CG2 3.94Å; F773-V876 HydrophobicContact CE2-CG2 4.43Å; F773-V876 HydrophobicContact CG-CB 4.41Å; F773-V876 HydrophobicContact CG-CG2 3.87Å; F773-V876 HydrophobicContact CZ-CG2 4.29Å; F773-V891 HydrophobicContact CD1-CB 4.06Å; F773-V891 HydrophobicContact CD1-CG1 3.78Å; F773-V891 HydrophobicContact CE1-CB 4.32Å; F773-V891 HydrophobicContact CE1-CG1 3.93Å; F773-V891 WeakPolarHBondContact CE1-O 3.38Å; F773-K893 HydrophobicContact CE1-CB 4.16Å; F773-K893 HydrophobicContact CE1-CG 4.15Å; F773-K893 HydrophobicContact CE2-CB 4.3Å; F773-K893 HydrophobicContact CZ-CB 3.7Å; F773-K893 HydrophobicContact CZ-CG 4.17Å; F773-K893 VanDerWaalsContact O-CD 3.25Å; F773-K893 WeakPolarHBondContact O-CD 3.28Å; F773-K893 WeakPolarHBondContact O-CE 3.12Å; F773-K893 PolarHBondContact O-NZ 2.04Å
774	D	93.3	Very high	83.2	Confident	57 Å²	57	54.6 Å²	54.6	31%	0.305	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	164.7	165.4	-136.5	-39.9	0	0	0	113	T790 W791 K893	D774-T790 CarbonylContact O-C 3.57Å; D774-T790 WeakPolarHBondContact O-CA 2.96Å; D774-T790 WeakPolarHBondContact O-CB 3.09Å; D774-W791 HydrophobicContact CB-CD2 4.5Å; D774-W791 HydrophobicContact CB-CZ2 3.58Å; D774-W791 PolarHBondContact N-O 3.45Å; D774-W791 PolarHBondContact O-N 3.31Å; D774-K893 HydrophobicContact CB-CD 4.4Å; D774-K893 VanDerWaalsContact CG-NZ 3.32Å; D774-K893 IonicContact OD2-NZ 2.79Å; D774-K893 PolarHBondContact OD2-NZ 3.1Å
775	F	92.1	Very high	83.5	Confident	19 Å²	19	58.7 Å²	58.7	8%	0.083	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	141.6	175.9	-56.9	-80	0	0	0	111.3	F773 I788 T790 M872 M874 K893 I895	F773-F775 HydrophobicContact CE2-CE1 4.45Å; F773-F775 HydrophobicContact CE2-CE2 4.27Å; F773-F775 HydrophobicContact CE2-CZ 4.13Å; F775-I788 HydrophobicContact CD1-CD1 3.5Å; F775-I788 HydrophobicContact CD1-CG1 4.28Å; F775-I788 HydrophobicContact CE1-CD1 3.89Å; F775-I788 HydrophobicContact CG-CD1 4.47Å; F775-T790 HydrophobicContact CD1-CG2 3.43Å; F775-T790 VanDerWaalsContact CD1-CG2 3.43Å; F775-T790 HydrophobicContact CE1-CG2 3.78Å; F775-T790 HydrophobicContact CG-CG2 4.21Å; F775-M872 HydrophobicContact CE1-CE 3.7Å; F775-M872 HydrophobicContact CZ-CE 3.98Å; F775-M874 HydrophobicContact CE1-CB 4.35Å; F775-M874 HydrophobicContact CE1-SD 4.27Å; F775-M874 HydrophobicContact CZ-CB 3.92Å; F775-K893 HydrophobicContact CE2-CB 3.91Å; F775-I895 HydrophobicContact CB-CD1 3.97Å; F775-I895 HydrophobicContact CD1-CB 4.47Å; F775-I895 HydrophobicContact CD1-CD1 4.29Å; F775-I895 HydrophobicContact CD1-CG2 4.34Å; F775-I895 HydrophobicContact CD2-CB 3.9Å; F775-I895 HydrophobicContact CD2-CD1 4.5Å; F775-I895 HydrophobicContact CD2-CG2 4.49Å; F775-I895 HydrophobicContact CE1-CB 4.5Å; F775-I895 HydrophobicContact CE1-CG2 4.07Å; F775-I895 HydrophobicContact CE2-CB 3.92Å; F775-I895 HydrophobicContact CE2-CG2 4.21Å; F775-I895 HydrophobicContact CG-CB 4.18Å; F775-I895 HydrophobicContact CG-CD1 4.01Å; F775-I895 HydrophobicContact CZ-CB 4.22Å; F775-I895 HydrophobicContact CZ-CG2 3.98Å
776	L	88.8	Confident	83.8	Confident	107 Å²	107	59.7 Å²	59.7	56%	0.56	30%	0.297	S	S	*	.	S	Bend	trans	-83.7	-13.1	176.4	-74.3	161.5	0	0	0	113.1	K789 T858	L776-K789 HydrophobicContact CB-CB 4.46Å; L776-K789 WeakPolarHBondContact CB-O 3.35Å; L776-K789 HydrophobicContact CD1-CB 3.69Å; L776-K789 PolarHBondContact N-O 2.68Å; L776-T858 HydrophobicContact CD1-CG2 4.03Å
777	S	86.1	Confident	84.3	Confident	50 Å²	50	59.7 Å²	59.7	35%	0.35	30%	0.301	S	S	.	.	S	Bend	trans	-109.3	151.3	169.5	65.2	0	0	0	0	111.1	E779 I895	S777-E779 WeakPolarHBondContact CB-O 3.5Å; S777-E779 PolarHBondContact OG-O 3.04Å; S777-I895 WeakPolarHBondContact O-CD1 3.32Å
778	K	85.8	Confident	84.9	Confident	202 Å²	202	59.6 Å²	59.6	88%	0.878	30%	0.299	S	S	*	.	S	Bend	trans	-80.6	-18.3	177.6	-64.2	-173.5	178.1	-175.8	0	113.7
779	E	87.4	Confident	85.2	Confident	80 Å²	80	62.2 Å²	62.2	37%	0.374	31%	0.309	S	S	.	.	S	Bend	trans	-148.9	158.1	177.1	53.9	-174.9	-124.4	0	0	108.9	S777 P896 K898	S777-E779 WeakPolarHBondContact CB-O 3.5Å; S777-E779 PolarHBondContact OG-O 3.04Å; E779-P896 WeakPolarHBondContact CA-O 3.45Å; E779-K898 WeakPolarHBondContact OE1-CE 3.18Å; E779-K898 IonicContact OE1-NZ 2.71Å; E779-K898 PolarHBondContact OE1-NZ 3.1Å; E779-K898 WeakPolarHBondContact OE2-CE 3.47Å; E779-K898 IonicContact OE2-NZ 2.67Å; E779-K898 PolarHBondContact OE2-NZ 2.88Å
780	L	86.9	Confident	85.4	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	101.8	178.1	178.3	54.4	0	0	0	108.9	V782 I788 I863 W868 M872 I895 P896 V897 K898	L780-V782 HydrophobicContact CG-CG2 4.37Å; L780-I788 HydrophobicContact CD1-CB 4.05Å; L780-I788 HydrophobicContact CD1-CD1 4.02Å; L780-I788 HydrophobicContact CD1-CG1 4.39Å; L780-I863 HydrophobicContact CD1-CD1 3.42Å; L780-I863 VanDerWaalsContact CD1-CD1 3.42Å; L780-I863 HydrophobicContact CD1-CG1 4.45Å; L780-I863 HydrophobicContact CG-CD1 4.35Å; L780-W868 HydrophobicContact CD2-CE3 4.15Å; L780-W868 HydrophobicContact CD2-CH2 4.4Å; L780-W868 HydrophobicContact CD2-CZ3 3.96Å; L780-M872 HydrophobicContact CD2-CB 4.4Å; L780-M872 HydrophobicContact CD2-SD 3.7Å; L780-I895 HydrophobicContact CB-CD1 4.21Å; L780-I895 HydrophobicContact CB-CG1 4.4Å; L780-I895 HydrophobicContact CB-CG2 4.25Å; L780-P896 PolarHBondContact N-O 2.94Å; L780-V897 HydrophobicContact CB-CG2 4.49Å; L780-V897 HydrophobicContact CD2-CG1 4.42Å; L780-V897 HydrophobicContact CD2-CG2 4.28Å; L780-V897 HydrophobicContact CG-CG1 4.43Å; L780-K898 PolarHBondContact O-N 3.46Å; L780-K898 VanDerWaalsContact O-O 3.12Å
781	L	85.2	Confident	85.6	Confident	55 Å²	55	62.7 Å²	62.7	29%	0.288	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	106.7	172.8	-178.2	64.4	0	0	0	109.7	T783 K898 V1055	L781-T783 HydrophobicContact CG-CG2 4.27Å; L781-K898 CarbonylContact C-O 3.53Å; L781-K898 WeakPolarHBondContact CA-O 3.37Å; L781-K898 HydrophobicContact CD1-CB 4.12Å; L781-V1055 HydrophobicContact CD1-CB 4.11Å; L781-V1055 HydrophobicContact CD1-CG2 4Å
782	V	84.8	Confident	85.7	Confident	1 Å²	1	62 Å²	62	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.2	177.9	-178.9	0	0	0	0	110.2	L780 I863 W868 V897 K898 Y899 S900 F938	L780-V782 HydrophobicContact CG-CG2 4.37Å; V782-I863 HydrophobicContact CG1-CG2 4.04Å; V782-W868 HydrophobicContact CG2-CE3 3.95Å; V782-W868 HydrophobicContact CG2-CZ3 3.76Å; V782-V897 HydrophobicContact CG2-CG1 3.93Å; V782-K898 PolarHBondContact N-O 3.06Å; V782-Y899 HydrophobicContact CB-CD1 3.71Å; V782-Y899 HydrophobicContact CB-CE1 3.88Å; V782-Y899 HydrophobicContact CB-CG 4.37Å; V782-Y899 HydrophobicContact CG1-CD1 3.81Å; V782-Y899 HydrophobicContact CG1-CE1 3.78Å; V782-Y899 HydrophobicContact CG2-CD1 4.22Å; V782-Y899 HydrophobicContact CG2-CE1 3.98Å; V782-S900 PolarHBondContact O-N 3.27Å; V782-F938 HydrophobicContact CG1-CE2 4.46Å; V782-F938 HydrophobicContact CG1-CZ 4.29Å
783	T	78.4	Confident	85.7	Confident	37 Å²	37	63.6 Å²	63.6	23%	0.227	31%	0.308	C	S	.	.			trans	-137.7	166.1	172.4	86.1	0	0	0	0	110.2	L781 E785 T786	L781-T783 HydrophobicContact CG-CG2 4.27Å; T783-E785 PolarHBondContact O-N 2.65Å; T783-E785 PolarHBondContact OG1-N 2.93Å; T783-E785 PolarHBondContact OG1-O 3.02Å; T783-T786 HydrophobicContact CG2-CG2 3.93Å; T783-T786 PolarHBondContact N-OG1 2.89Å; T783-T786 PolarHBondContact O-OG1 3.3Å; T783-T786 WeakPolarHBondContact OG1-CG2 3.36Å; T783-T786 PolarHBondContact OG1-OG1 3.24Å
784	K	67.1	Low	85.5	Confident	152 Å²	152	63.6 Å²	63.6	66%	0.661	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-29.6	179.5	-165.5	169.5	-175.3	170.1	0	114.9	F938	K784-F938 HydrophobicContact CB-CD1 4.29Å; K784-F938 HydrophobicContact CB-CG 4.49Å
785	E	65.8	Low	85.3	Confident	180 Å²	180	63.5 Å²	63.5	84%	0.841	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.6	93	171	-69.3	-173.6	-169.5	0	0	110	T783	T783-E785 PolarHBondContact O-N 2.65Å; T783-E785 PolarHBondContact OG1-N 2.93Å; T783-E785 PolarHBondContact OG1-O 3.02Å
786	T	71.8	Confident	85.1	Confident	38 Å²	38	62.6 Å²	62.6	23%	0.233	30%	0.302	C	S	.	.			trans	-130.8	149.6	175.8	17.1	0	0	0	0	113.1	T783 I863	T783-T786 HydrophobicContact CG2-CG2 3.93Å; T783-T786 PolarHBondContact N-OG1 2.89Å; T783-T786 PolarHBondContact O-OG1 3.3Å; T783-T786 WeakPolarHBondContact OG1-CG2 3.36Å; T783-T786 PolarHBondContact OG1-OG1 3.24Å; T786-I863 PolarHBondContact O-N 2.69Å
787	T	83.8	Confident	84.8	Confident	79 Å²	79	63.6 Å²	63.6	49%	0.485	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.7	170	53.2	0	0	0	0	110.1	F861 R862	T787-F861 CarbonylContact C-O 3.49Å; T787-F861 WeakPolarHBondContact CA-O 3.5Å; T787-F861 WeakPolarHBondContact CB-O 3.23Å; T787-R862 HydrophobicContact CG2-CG 3.96Å
788	I	88.8	Confident	84.5	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.7	165.8	-171.6	176.1	0	0	0	108.3	F775 L780 L814 F861 M872 I895	F775-I788 HydrophobicContact CD1-CD1 3.5Å; F775-I788 HydrophobicContact CD1-CG1 4.28Å; F775-I788 HydrophobicContact CE1-CD1 3.89Å; F775-I788 HydrophobicContact CG-CD1 4.47Å; L780-I788 HydrophobicContact CD1-CB 4.05Å; L780-I788 HydrophobicContact CD1-CD1 4.02Å; L780-I788 HydrophobicContact CD1-CG1 4.39Å; I788-L814 HydrophobicContact CG2-CD1 4.18Å; I788-L814 HydrophobicContact CG2-CD2 3.77Å; I788-F861 HydrophobicContact CG2-CB 3.87Å; I788-F861 HydrophobicContact CG2-CD2 4.44Å; I788-F861 PolarHBondContact N-O 3.31Å; I788-F861 PolarHBondContact O-N 2.99Å; I788-M872 HydrophobicContact CD1-CE 4.36Å; I788-I895 HydrophobicContact CD1-CD1 3.94Å; I788-I895 HydrophobicContact CD1-CG2 4.28Å
789	K	90.6	Very high	84.3	Confident	98 Å²	98	56 Å²	56	43%	0.426	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137	177.1	-58.9	-168.9	176.7	-172	0	110.4	L776 T858 A859 S860	L776-K789 HydrophobicContact CB-CB 4.46Å; L776-K789 WeakPolarHBondContact CB-O 3.35Å; L776-K789 HydrophobicContact CD1-CB 3.69Å; L776-K789 PolarHBondContact N-O 2.68Å; K789-T858 HydrophobicContact CB-CG2 4.31Å; K789-T858 HydrophobicContact CD-CG2 4.37Å; K789-A859 VanDerWaalsContact CA-O 3.28Å; K789-A859 WeakPolarHBondContact CA-O 3.34Å; K789-S860 WeakPolarHBondContact CE-OG 3.15Å
790	T	91.9	Very high	84	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.3	170.5	57.6	0	0	0	0	109.5	F773 D774 F775 T858 A859 M874	F773-T790 HydrophobicContact CD2-CG2 4.17Å; F773-T790 HydrophobicContact CE2-CG2 4.27Å; D774-T790 CarbonylContact O-C 3.57Å; D774-T790 WeakPolarHBondContact O-CA 2.96Å; D774-T790 WeakPolarHBondContact O-CB 3.09Å; F775-T790 HydrophobicContact CD1-CG2 3.43Å; F775-T790 VanDerWaalsContact CD1-CG2 3.43Å; F775-T790 HydrophobicContact CE1-CG2 3.78Å; F775-T790 HydrophobicContact CG-CG2 4.21Å; T790-T858 CarbonylContact O-C 3.57Å; T790-T858 VanDerWaalsContact O-CA 3.25Å; T790-T858 WeakPolarHBondContact O-CA 3.39Å; T790-A859 PolarHBondContact N-O 3.22Å; T790-A859 PolarHBondContact O-N 3.36Å; T790-M874 HydrophobicContact CG2-SD 4.01Å
791	W	93.1	Very high	83.7	Confident	73 Å²	73	54.3 Å²	54.3	28%	0.277	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	142.2	160.8	65.2	-95.2	0	0	0	108.7	D772 F773 D774 K793 F857	D772-W791 HydrophobicContact CB-CZ3 4.42Å; D772-W791 WeakPolarHBondContact OD2-CH2 3.31Å; F773-W791 CarbonylContact C-O 3.32Å; F773-W791 WeakPolarHBondContact CA-O 3.29Å; F773-W791 VanDerWaalsContact CB-O 3.27Å; F773-W791 WeakPolarHBondContact CB-O 3.45Å; D774-W791 HydrophobicContact CB-CD2 4.5Å; D774-W791 HydrophobicContact CB-CZ2 3.58Å; D774-W791 PolarHBondContact N-O 3.45Å; D774-W791 PolarHBondContact O-N 3.31Å; W791-K793 HydrophobicContact CE3-CB 4.34Å; W791-K793 HydrophobicContact CZ3-CB 3.97Å; W791-F857 CarbonylContact C-O 3.54Å; W791-F857 VanDerWaalsContact CA-O 3.27Å; W791-F857 WeakPolarHBondContact CA-O 3.33Å
792	I	93	Very high	83.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.6	179.4	-52.9	166.8	0	0	0	108.1	V771 D772 F773 L806 M808 L819 V856 F857 A859 V876	V771-I792 HydrophobicContact CG1-CG2 4.22Å; D772-I792 CarbonylContact O-C 3.56Å; D772-I792 WeakPolarHBondContact O-CA 3.47Å; F773-I792 HydrophobicContact CB-CB 4.25Å; F773-I792 HydrophobicContact CB-CG1 3.9Å; F773-I792 HydrophobicContact CB-CG2 4.24Å; I792-L806 HydrophobicContact CD1-CD2 4.26Å; I792-L806 HydrophobicContact CG2-CD1 4.07Å; I792-L806 HydrophobicContact CG2-CD2 4.02Å; I792-M808 HydrophobicContact CD1-CG 4.13Å; I792-M808 HydrophobicContact CD1-SD 3.52Å; I792-M808 VanDerWaalsContact CD1-SD 3.52Å; I792-L819 HydrophobicContact CD1-CD1 4.38Å; I792-V856 CarbonylContact O-C 3.56Å; I792-V856 WeakPolarHBondContact O-CA 3.35Å; I792-F857 PolarHBondContact N-O 2.63Å; I792-F857 PolarHBondContact O-N 2.96Å; I792-A859 HydrophobicContact CD1-CB 3.8Å; I792-V876 HydrophobicContact CD1-CG1 4.37Å; I792-V876 HydrophobicContact CG2-CG1 4.03Å
793	K	91.3	Very high	83.1	Confident	98 Å²	98	55.4 Å²	55.4	43%	0.426	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.3	177.5	-177	176.2	-174.9	-177.6	0	110	V771 D772 W791 A855 V856	V771-K793 WeakPolarHBondContact CA-O 3.4Å; D772-K793 PolarHBondContact N-O 3.32Å; D772-K793 PolarHBondContact O-N 3.09Å; W791-K793 HydrophobicContact CE3-CB 4.34Å; W791-K793 HydrophobicContact CZ3-CB 3.97Å; K793-A855 WeakPolarHBondContact CA-O 3.43Å; K793-V856 HydrophobicContact CB-CG2 4.23Å; K793-V856 HydrophobicContact CD-CG2 4.4Å; K793-V856 HydrophobicContact CG-CG2 4.03Å
794	L	90.6	Very high	83.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	146.2	172.6	-177.2	64.2	0	0	0	110	K770 V771 T804 I844 Y849 S854 A855 F857 A878	K770-L794 CarbonylContact O-C 3.48Å; V771-L794 HydrophobicContact CG2-CD1 3.78Å; L794-T804 HydrophobicContact CD2-CG2 4.17Å; L794-I844 HydrophobicContact CD2-CB 4.28Å; L794-I844 HydrophobicContact CD2-CG1 4.05Å; L794-I844 HydrophobicContact CD2-CG2 4.11Å; L794-Y849 HydrophobicContact CD2-CD1 4.28Å; L794-Y849 HydrophobicContact CD2-CE1 3.77Å; L794-Y849 HydrophobicContact CG-CE1 3.89Å; L794-S854 CarbonylContact O-C 3.54Å; L794-S854 VanDerWaalsContact O-CA 3.24Å; L794-S854 WeakPolarHBondContact O-CA 3.43Å; L794-S854 WeakPolarHBondContact O-CB 3.37Å; L794-S854 PolarHBondContact O-OG 3.12Å; L794-A855 PolarHBondContact N-O 2.83Å; L794-A855 PolarHBondContact O-N 3.49Å; L794-F857 HydrophobicContact CB-CE2 3.95Å; L794-F857 HydrophobicContact CD2-CE2 4.44Å; L794-A878 HydrophobicContact CD1-CB 3.77Å
795	H	88.6	Confident	84.4	Confident	56 Å²	56	47.5 Å²	47.5	26%	0.259	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	123	175.9	-178.2	20	0	0	0	110.7	L769 K770 R797 S853	L769-H795 WeakPolarHBondContact CA-O 3.09Å; K770-H795 PolarHBondContact N-O 3.02Å; K770-H795 PolarHBondContact O-N 3.08Å; H795-R797 WeakPolarHBondContact NE2-CG 3.33Å; H795-S853 CarbonylContact C-O 3.57Å; H795-S853 WeakPolarHBondContact CA-O 3.33Å; H795-S853 PolarHBondContact ND1-O 3.03Å
796	N	87.2	Confident	85.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.3	165.2	-177.6	4.5	0	0	0	109.1	D768 L769 A798 D799 Y849 K852 S853	D768-N796 CarbonylContact O-C 3.56Å; D768-N796 VanDerWaalsContact O-CA 3.31Å; D768-N796 WeakPolarHBondContact O-CA 3.38Å; D768-N796 PolarHBondContact O-OD1 2.77Å; L769-N796 HydrophobicContact CD2-CB 3.76Å; N796-A798 PolarHBondContact OD1-N 2.94Å; N796-A798 VanDerWaalsContact OD1-N 3.15Å; N796-D799 PolarHBondContact ND2-O 3.01Å; N796-D799 PolarHBondContact OD1-O 2.86Å; N796-Y849 HydrophobicContact CB-CD1 3.71Å; N796-Y849 HydrophobicContact CB-CE1 3.62Å; N796-Y849 PolarHBondContact ND2-O 2.89Å; N796-Y849 VanDerWaalsContact ND2-O 3.08Å; N796-K852 CarbonylContact O-C 3.57Å; N796-K852 WeakPolarHBondContact O-CA 3.19Å; N796-K852 PolarHBondContact O-N 3.38Å; N796-S853 PolarHBondContact N-O 2.92Å; N796-S853 PolarHBondContact O-N 2.81Å
797	R	82.6	Confident	86.4	Confident	128 Å²	128	37.2 Å²	37.2	48%	0.483	18%	0.179	S	C	.	.			trans	-108.6	-23	-179.1	-69.2	172.8	168.6	-171	0.9	114.7	D768 H795	D768-R797 HydrophobicContact CB-CB 4.04Å; D768-R797 PolarHBondContact O-N 3.21Å; D768-R797 WeakPolarHBondContact OD2-CB 3.16Å; D768-R797 WeakPolarHBondContact OD2-CD 3.27Å; H795-R797 WeakPolarHBondContact NE2-CG 3.33Å
798	A	79.6	Confident	86.7	Confident	27 Å²	27	33.4 Å²	33.4	22%	0.223	16%	0.156	C	C	.	.	S	Bend	trans	-103.2	-136.4	-172.5	0	0	0	0	0	111.2	I766 D768 N796 S851	I766-A798 WeakPolarHBondContact O-CB 3.46Å; D768-A798 HydrophobicContact CB-CB 3.86Å; N796-A798 PolarHBondContact OD1-N 2.94Å; N796-A798 VanDerWaalsContact OD1-N 3.15Å; A798-S851 WeakPolarHBondContact O-CA 3.4Å; A798-S851 WeakPolarHBondContact O-CB 3.35Å; A798-S851 PolarHBondContact O-OG 3.06Å
799	D	81.7	Confident	86.8	Confident	64 Å²	64	36.1 Å²	36.1	34%	0.342	17%	0.17	S	C	.	.	S	Bend	trans	-74.2	-179.5	-179.1	-52.2	-41.9	0	0	0	111.8	I766 N796 S801	I766-D799 PolarHBondContact N-OD2 3.19Å; I766-D799 VanDerWaalsContact O-CB 3.29Å; I766-D799 WeakPolarHBondContact O-CB 3.45Å; I766-D799 PolarHBondContact O-N 2.82Å; N796-D799 PolarHBondContact ND2-O 3.01Å; N796-D799 PolarHBondContact OD1-O 2.86Å; D799-S801 PolarHBondContact O-N 3.14Å
800	D	80.9	Confident	86.7	Confident	50 Å²	50	32.3 Å²	32.3	27%	0.267	15%	0.153	S	C	.	.			trans	-61.1	130.2	173.8	-86.8	21.6	0	0	0	111.2	Y802 V848 R850 S851 N882	D800-Y802 HydrophobicContact CB-CE2 4.38Å; D800-V848 HydrophobicContact CB-CG1 3.75Å; D800-V848 WeakPolarHBondContact OD2-CG1 3.19Å; D800-R850 VanDerWaalsContact OD1-CA 3.26Å; D800-R850 WeakPolarHBondContact OD1-CA 3.31Å; D800-S851 WeakPolarHBondContact OD1-CB 2.98Å; D800-S851 PolarHBondContact OD1-N 3.24Å; D800-N882 PolarHBondContact O-ND2 2.93Å
801	S	80.4	Confident	86.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109.8	-173.4	180	0	0	0	0	111	A767 D799 T804 Y849 S880	A767-S801 WeakPolarHBondContact CB-OG 3.28Å; D799-S801 PolarHBondContact O-N 3.14Å; S801-T804 WeakPolarHBondContact CB-OG1 3.26Å; S801-T804 PolarHBondContact O-OG1 3.14Å; S801-T804 PolarHBondContact OG-OG1 3.42Å; S801-Y849 PolarHBondContact N-O 3.22Å; S801-Y849 PolarHBondContact O-N 2.96Å; S801-S880 WeakPolarHBondContact OG-CB 3.4Å; S801-S880 PolarHBondContact OG-OG 3.21Å
802	Y	79.6	Confident	85.9	Confident	38 Å²	38	35.4 Å²	35.4	15%	0.149	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	138.2	-173.4	-66.3	-95.9	0	0	0	111.6	K758 D800 T804 P847 V848 E881 N882	K758-Y802 HydrophobicContact CD-CD1 3.99Å; K758-Y802 HydrophobicContact CD-CG 4.38Å; D800-Y802 HydrophobicContact CB-CE2 4.38Å; Y802-T804 PolarHBondContact O-N 3.03Å; Y802-P847 WeakPolarHBondContact CA-O 3.48Å; Y802-V848 HydrophobicContact CD1-CG2 3.7Å; Y802-V848 HydrophobicContact CE1-CG2 3.62Å; Y802-E881 PolarHBondContact O-N 3.46Å; Y802-E881 VanDerWaalsContact O-N 3.08Å; Y802-N882 WeakPolarHBondContact CD2-OD1 3.3Å; Y802-N882 PolarHBondContact N-OD1 3.44Å
803	N	77.8	Confident	85.3	Confident	41 Å²	41	35.8 Å²	35.8	22%	0.219	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	46	43.7	-176.7	-71.2	-10.1	0	0	0	113.4	S805 L846 P847 E881	N803-S805 PolarHBondContact O-N 2.82Å; N803-L846 HydrophobicContact CB-CD2 4.36Å; N803-P847 PolarHBondContact N-O 2.97Å; N803-E881 HydrophobicContact CB-CG 4.01Å; N803-E881 VanDerWaalsContact CB-OE1 3.31Å; N803-E881 WeakPolarHBondContact CB-OE1 3.29Å; N803-E881 VanDerWaalsContact ND2-CD 3.28Å; N803-E881 PolarHBondContact ND2-OE1 2.87Å; N803-E881 PolarHBondContact ND2-OE2 3.14Å
804	T	85.8	Confident	85	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.			trans	-57.7	124.4	179	-64.2	0	0	0	0	110.6	L769 L794 S801 Y802 G843 I844 Y849 K879	L769-T804 HydrophobicContact CD1-CG2 3.87Å; L769-T804 HydrophobicContact CD2-CG2 4.31Å; L794-T804 HydrophobicContact CD2-CG2 4.17Å; S801-T804 WeakPolarHBondContact CB-OG1 3.26Å; S801-T804 PolarHBondContact O-OG1 3.14Å; S801-T804 PolarHBondContact OG-OG1 3.42Å; Y802-T804 PolarHBondContact O-N 3.03Å; T804-G843 WeakPolarHBondContact O-CA 3.43Å; T804-I844 HydrophobicContact CG2-CB 4.33Å; T804-I844 PolarHBondContact O-N 3.15Å; T804-Y849 HydrophobicContact CG2-CD1 3.99Å; T804-Y849 HydrophobicContact CG2-CG 4.26Å; T804-Y849 WeakPolarHBondContact OG1-CB 3.28Å; T804-K879 WeakPolarHBondContact CA-O 3.34Å
805	S	87.8	Confident	84.8	Confident	23 Å²	23	32.8 Å²	32.8	16%	0.161	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.5	178.8	42.4	0	0	0	0	110.9	N803 C842 A878 K879	N803-S805 PolarHBondContact O-N 2.82Å; S805-C842 CarbonylContact C-O 3.6Å; S805-C842 WeakPolarHBondContact CA-O 3.44Å; S805-A878 CarbonylContact O-C 3.58Å; S805-A878 WeakPolarHBondContact O-CA 3.38Å; S805-K879 PolarHBondContact N-O 2.9Å; S805-K879 PolarHBondContact O-N 3.38Å
806	L	89.6	Confident	84.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	112.4	173.2	-179.3	72.8	0	0	0	107.1	V771 I792 L819 C842 I844 F857 V876	V771-L806 HydrophobicContact CG1-CD1 4.39Å; V771-L806 HydrophobicContact CG2-CD1 4.24Å; I792-L806 HydrophobicContact CD1-CD2 4.26Å; I792-L806 HydrophobicContact CG2-CD1 4.07Å; I792-L806 HydrophobicContact CG2-CD2 4.02Å; L806-L819 HydrophobicContact CD2-CD2 4.38Å; L806-C842 HydrophobicContact CB-CB 4.49Å; L806-C842 PolarHBondContact N-O 2.85Å; L806-C842 PolarHBondContact O-N 3Å; L806-I844 HydrophobicContact CB-CD1 4.24Å; L806-I844 HydrophobicContact CB-CG1 4.01Å; L806-F857 HydrophobicContact CD2-CD2 4.25Å; L806-V876 HydrophobicContact CD1-CG1 3.78Å; L806-V876 HydrophobicContact CG-CG1 4.28Å
807	T	89.1	Confident	84.6	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.5	179.7	-57.1	0	0	0	0	109.8	L809 E839 T840 V841 V876 F877	T807-L809 HydrophobicContact CG2-CD2 4.2Å; T807-L809 HydrophobicContact CG2-CG 4.42Å; T807-E839 HydrophobicContact CG2-CG 3.9Å; T807-T840 WeakPolarHBondContact CA-O 3.32Å; T807-V841 HydrophobicContact CG2-CG2 4.22Å; T807-V876 WeakPolarHBondContact O-CA 3.35Å; T807-F877 VanDerWaalsContact CB-CZ 3.42Å; T807-F877 HydrophobicContact CG2-CE1 4Å; T807-F877 HydrophobicContact CG2-CE2 3.89Å; T807-F877 HydrophobicContact CG2-CZ 3.44Å; T807-F877 VanDerWaalsContact CG2-CZ 3.44Å; T807-F877 PolarHBondContact N-O 3.02Å; T807-F877 PolarHBondContact O-N 3.41Å; T807-F877 VanDerWaalsContact O-N 3.14Å; T807-F877 WeakPolarHBondContact OG1-CE2 3.11Å
808	M	90.9	Very high	84.7	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.3	176.3	-65.2	169.9	-66	0	0	108.1	I792 Y810 F816 T840 C842 A859 F861 M874 V876	I792-M808 HydrophobicContact CD1-CG 4.13Å; I792-M808 HydrophobicContact CD1-SD 3.52Å; I792-M808 VanDerWaalsContact CD1-SD 3.52Å; M808-Y810 HydrophobicContact CB-CD1 4.48Å; M808-F816 HydrophobicContact CE-CD2 3.83Å; M808-F816 HydrophobicContact CE-CE2 3.66Å; M808-F816 HydrophobicContact CE-CZ 4.39Å; M808-T840 HydrophobicContact CE-CG2 3.88Å; M808-T840 PolarHBondContact N-O 3.31Å; M808-T840 PolarHBondContact O-N 3.01Å; M808-T840 VanDerWaalsContact O-N 3.14Å; M808-C842 VanDerWaalsContact CE-SG 3.52Å; M808-A859 HydrophobicContact SD-CB 3.85Å; M808-F861 HydrophobicContact CB-CZ 4.5Å; M808-F861 HydrophobicContact SD-CZ 3.8Å; M808-M874 HydrophobicContact CB-CE 3.94Å; M808-M874 HydrophobicContact CG-CE 4.15Å; M808-M874 HydrophobicContact SD-CE 4.5Å; M808-V876 HydrophobicContact CG-CG1 4.11Å; M808-V876 HydrophobicContact CG-CG2 4.25Å
809	L	89.9	Confident	85	Confident	61 Å²	61	31.4 Å²	31.4	32%	0.319	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.1	170.8	-61.6	-178.4	0	0	0	108.7	T807 E839 M874 T875 F877	T807-L809 HydrophobicContact CG2-CD2 4.2Å; T807-L809 HydrophobicContact CG2-CG 4.42Å; L809-E839 HydrophobicContact CD2-CB 3.66Å; L809-E839 HydrophobicContact CD2-CG 3.6Å; L809-M874 WeakPolarHBondContact O-CG 3.49Å; L809-T875 PolarHBondContact N-O 3.06Å; L809-T875 PolarHBondContact O-N 3.32Å; L809-F877 HydrophobicContact CD1-CE1 3.85Å; L809-F877 HydrophobicContact CG-CE1 4.07Å
810	Y	89.8	Confident	85.1	Confident	17 Å²	17	32.2 Å²	32.2	7%	0.067	17%	0.174	C	C	.	.			trans	-138	156.8	-179.1	53.4	-105.1	0	0	0	109.5	M808 L814 F816 L837 N838 T840 F861	M808-Y810 HydrophobicContact CB-CD1 4.48Å; Y810-L814 HydrophobicContact CD2-CB 3.7Å; Y810-L814 HydrophobicContact CE2-CB 4.29Å; Y810-L814 WeakPolarHBondContact CE2-O 3.4Å; Y810-L814 HydrophobicContact CG-CB 4.17Å; Y810-F816 HydrophobicContact CE1-CB 4.21Å; Y810-L837 WeakPolarHBondContact CE2-O 3.23Å; Y810-L837 PolarHBondContact OH-O 2.86Å; Y810-N838 PolarHBondContact N-O 2.93Å; Y810-N838 WeakPolarHBondContact O-CB 3.45Å; Y810-T840 PolarHBondContact OH-OG1 3.04Å; Y810-F861 HydrophobicContact CD1-CD1 4.04Å; Y810-F861 AromaticContact CD1-CE1 3.54Å; Y810-F861 HydrophobicContact CD1-CE1 3.54Å; Y810-F861 HydrophobicContact CD1-CZ 4.47Å; Y810-F861 HydrophobicContact CE1-CD1 4.14Å; Y810-F861 AromaticContact CE1-CE1 3.71Å; Y810-F861 HydrophobicContact CE1-CE1 3.71Å; Y810-F861 HydrophobicContact CG-CE1 4.38Å
811	P	86.6	Confident	85.2	Confident	38 Å²	38	31.2 Å²	31.2	25%	0.247	17%	0.168	C	C	.	.			trans	-79.2	164.7	-178.3	32.9	-31.2	0	0	0	110.4	L814 M872 L873	P811-L814 PolarHBondContact O-N 2.58Å; P811-M872 HydrophobicContact CG-CG 3.51Å; P811-M872 HydrophobicContact CG-SD 4.24Å; P811-L873 VanDerWaalsContact CD-O 3.28Å; P811-L873 WeakPolarHBondContact CD-O 3.4Å
812	E	81.3	Confident	84.9	Confident	100 Å²	100	35.3 Å²	35.3	47%	0.467	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	151.6	169.7	-69.3	170.9	-161	0	0	111.1	L814 N838 F866 W868	E812-L814 VanDerWaalsContact C-N 3.31Å; E812-N838 WeakPolarHBondContact CG-ND2 3.41Å; E812-N838 WeakPolarHBondContact CG-OD1 3.34Å; E812-N838 PolarHBondContact OE1-ND2 2.79Å; E812-F866 HydrophobicContact CB-CD2 3.98Å; E812-F866 HydrophobicContact CB-CE1 4.34Å; E812-F866 HydrophobicContact CB-CE2 3.37Å; E812-F866 HydrophobicContact CB-CZ 3.59Å; E812-F866 VanDerWaalsContact O-CD1 3.3Å; E812-F866 WeakPolarHBondContact O-CD1 3.49Å; E812-F866 WeakPolarHBondContact O-CE1 3.4Å; E812-W868 WeakPolarHBondContact O-CZ2 3.38Å; E812-W868 PolarHBondContact O-NE1 3.27Å
813	G	79.9	Confident	84.3	Confident	9 Å²	9	35.5 Å²	35.5	9%	0.093	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-20.9	-168.6	0	0	0	0	0	114.7	K864	G813-K864 PolarHBondContact O-N 2.78Å
814	L	86.2	Confident	83.1	Confident	5 Å²	5	42 Å²	42	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	147.2	165.4	-73	-168	0	0	0	111.4	I788 Y810 P811 E812 F861 I863 W868 M872	I788-L814 HydrophobicContact CG2-CD1 4.18Å; I788-L814 HydrophobicContact CG2-CD2 3.77Å; Y810-L814 HydrophobicContact CD2-CB 3.7Å; Y810-L814 HydrophobicContact CE2-CB 4.29Å; Y810-L814 WeakPolarHBondContact CE2-O 3.4Å; Y810-L814 HydrophobicContact CG-CB 4.17Å; P811-L814 PolarHBondContact O-N 2.58Å; E812-L814 VanDerWaalsContact C-N 3.31Å; L814-F861 HydrophobicContact CD1-CB 4.25Å; L814-F861 HydrophobicContact CD1-CG 4.32Å; L814-F861 HydrophobicContact CD2-CB 4.12Å; L814-I863 HydrophobicContact CD2-CG1 3.96Å; L814-W868 HydrophobicContact CD2-CH2 3.88Å; L814-W868 HydrophobicContact CD2-CZ2 4.1Å; L814-W868 HydrophobicContact CG-CH2 4.25Å; L814-W868 HydrophobicContact CG-CZ2 3.94Å; L814-M872 HydrophobicContact CD1-CE 3.75Å; L814-M872 HydrophobicContact CD1-SD 3.58Å; L814-M872 VanDerWaalsContact CD1-SD 3.58Å; L814-M872 HydrophobicContact CD2-SD 4.41Å; L814-M872 HydrophobicContact CG-SD 3.93Å
815	S	84.9	Confident	82	Confident	30 Å²	30	50.7 Å²	50.7	21%	0.21	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	119	172.4	-160.1	0	0	0	0	107.5	F861 R862 K864	S815-F861 CarbonylContact O-C 3.59Å; S815-F861 VanDerWaalsContact O-CA 3.26Å; S815-F861 WeakPolarHBondContact O-CA 3.35Å; S815-R862 PolarHBondContact N-O 3Å; S815-R862 PolarHBondContact O-N 3.48Å; S815-K864 WeakPolarHBondContact OG-CE 3.38Å; S815-K864 PolarHBondContact OG-NZ 2.9Å
816	F	87.9	Confident	80.9	Confident	23 Å²	23	57.9 Å²	57.9	10%	0.101	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	146.4	171.3	176.9	-103.4	0	0	0	110.7	M808 Y810 M818 L819 C831 T840 F861	M808-F816 HydrophobicContact CE-CD2 3.83Å; M808-F816 HydrophobicContact CE-CE2 3.66Å; M808-F816 HydrophobicContact CE-CZ 4.39Å; Y810-F816 HydrophobicContact CE1-CB 4.21Å; F816-M818 VanDerWaalsContact CE2-C 3.43Å; F816-M818 WeakPolarHBondContact CE2-O 3.42Å; F816-L819 HydrophobicContact CE2-CB 4.13Å; F816-L819 HydrophobicContact CZ-CB 3.87Å; F816-C831 HydrophobicContact CE1-CB 3.67Å; F816-C831 HydrophobicContact CZ-CB 4Å; F816-C831 VanDerWaalsContact CZ-SG 3.57Å; F816-T840 HydrophobicContact CB-CG2 4.28Å; F816-T840 WeakPolarHBondContact CB-OG1 3.35Å; F816-T840 HydrophobicContact CD1-CG2 3.68Å; F816-T840 HydrophobicContact CD2-CG2 4.26Å; F816-T840 HydrophobicContact CE1-CG2 4.01Å; F816-T840 HydrophobicContact CG-CG2 3.81Å; F816-T840 HydrophobicContact CZ-CG2 4.42Å; F816-F861 HydrophobicContact CB-CD1 4.07Å; F816-F861 HydrophobicContact CB-CE1 4.03Å; F816-F861 HydrophobicContact CD2-CD1 4.32Å; F816-F861 AromaticContact CD2-CE1 3.81Å; F816-F861 HydrophobicContact CD2-CE1 3.81Å; F816-F861 HydrophobicContact CD2-CZ 4.18Å; F816-F861 HydrophobicContact CG-CE1 4.42Å
817	S	84.4	Confident	80.2	Confident	46 Å²	46	60.2 Å²	60.2	32%	0.322	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	-30.8	-179.5	-176.1	0	0	0	0	114.4	S860 R862	S817-S860 WeakPolarHBondContact CB-O 3.43Å; S817-S860 PolarHBondContact N-O 3.1Å; S817-R862 PolarHBondContact OG-NE 3.13Å; S817-R862 PolarHBondContact OG-NH2 3.35Å
818	M	84.4	Confident	79.1	Confident	97 Å²	97	64.6 Å²	64.6	48%	0.478	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	148.1	176.1	-165.3	165.2	176.7	0	0	111.6	F816 D820 A859 S860	F816-M818 VanDerWaalsContact CE2-C 3.43Å; F816-M818 WeakPolarHBondContact CE2-O 3.42Å; M818-D820 WeakPolarHBondContact CE-OD2 3.17Å; M818-A859 WeakPolarHBondContact O-CA 3.48Å; M818-S860 PolarHBondContact N-O 3.17Å; M818-S860 PolarHBondContact O-N 2.94Å
819	L	86	Confident	78.5	Confident	16 Å²	16	67.1 Å²	67.1	8%	0.084	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.3	163.8	-171.1	73.2	0	0	0	107.8	I792 L806 F816 Q829 C842 I844 F857 A859	I792-L819 HydrophobicContact CD1-CD1 4.38Å; L806-L819 HydrophobicContact CD2-CD2 4.38Å; F816-L819 HydrophobicContact CE2-CB 4.13Å; F816-L819 HydrophobicContact CZ-CB 3.87Å; L819-Q829 HydrophobicContact CD2-CG 4.49Å; L819-C842 HydrophobicContact CD2-CB 3.93Å; L819-I844 HydrophobicContact CD2-CD1 4.1Å; L819-F857 HydrophobicContact CD1-CB 3.6Å; L819-F857 HydrophobicContact CD1-CG 4.3Å; L819-F857 HydrophobicContact CD2-CB 4.43Å; L819-F857 HydrophobicContact CD2-CD1 4.31Å; L819-F857 HydrophobicContact CD2-CG 4.27Å; L819-F857 HydrophobicContact CG-CB 3.98Å; L819-F857 HydrophobicContact CG-CD1 4.38Å; L819-F857 HydrophobicContact CG-CG 4.3Å; L819-A859 HydrophobicContact CD1-CB 3.76Å
820	D	84.2	Confident	77.9	Confident	80 Å²	80	69.6 Å²	69.6	43%	0.428	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.5	178.2	-116.7	-39.2	0	0	0	110.1	M818 F857 T858	M818-D820 WeakPolarHBondContact CE-OD2 3.17Å; D820-F857 CarbonylContact O-C 3.58Å; D820-F857 WeakPolarHBondContact O-CA 3.24Å; D820-T858 PolarHBondContact N-O 3.02Å; D820-T858 PolarHBondContact O-N 2.64Å
821	Q	82.7	Confident	77.5	Confident	30 Å²	30	70.9 Å²	70.9	14%	0.14	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.2	176	-166.6	-166.3	-20.9	0	0	112.3	K825 V856 F857	Q821-K825 PolarHBondContact NE2-O 2.96Å; Q821-K825 PolarHBondContact OE1-O 3.02Å; Q821-V856 VanDerWaalsContact CG-O 3.29Å; Q821-V856 WeakPolarHBondContact CG-O 3.39Å; Q821-F857 HydrophobicContact CB-CD1 3.88Å; Q821-F857 HydrophobicContact CB-CE1 4.12Å; Q821-F857 HydrophobicContact CG-CD1 3.86Å; Q821-F857 HydrophobicContact CG-CE1 3.86Å
822	T	74.4	Confident	76.6	Confident	86 Å²	86	71.6 Å²	71.6	53%	0.528	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	105	173.9	-47.8	0	0	0	0	110.5	V856 T858	T822-V856 PolarHBondContact N-O 2.84Å; T822-T858 PolarHBondContact OG1-OG1 2.86Å
823	G	67.4	Low	75.3	Confident	42 Å²	42	72 Å²	72	43%	0.433	40%	0.396	S	S	.	.	S	Bend	trans	144.5	173.1	169.5	0	0	0	0	0	116	K825	G823-K825 PolarHBondContact O-N 2.85Å
824	N	51.5	Low	74.2	Confident	177 Å²	177	76.7 Å²	76.7	95%	0.947	42%	0.416	S	S	*	.	S	Bend	trans	-76.8	-15.2	-169.3	-66.8	2.1	0	0	0	115.4
825	K	63.2	Low	72.5	Confident	182 Å²	182	85.8 Å²	85.8	79%	0.791	46%	0.458	S	S	*	.	S	Bend	trans	-110.1	98.8	173.8	-80.1	-172.7	174.6	-177.9	0	109.5	Q821 G823	Q821-K825 PolarHBondContact NE2-O 2.96Å; Q821-K825 PolarHBondContact OE1-O 3.02Å; G823-K825 PolarHBondContact O-N 2.85Å
826	K	65.1	Low	71.1	Confident	174 Å²	174	90.1 Å²	90.1	76%	0.757	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-70.7	129.4	174.3	-67.8	-165.8	174.6	-163.5	0	111
827	L	74.1	Confident	69.8	Low	49 Å²	49	95.2 Å²	95.2	26%	0.257	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-95.5	147.6	169.9	-60	178.2	0	0	0	109.6	Q829 I844 Y849 A855 F857	L827-Q829 PolarHBondContact O-NE2 2.94Å; L827-I844 HydrophobicContact CD1-CG2 4.34Å; L827-Y849 HydrophobicContact CD1-CD2 4.44Å; L827-Y849 HydrophobicContact CD1-CE2 3.78Å; L827-A855 HydrophobicContact CD1-CB 3.66Å; L827-F857 HydrophobicContact CD1-CZ 4.4Å
828	T	67.2	Low	69.6	Low	95 Å²	95	95.5 Å²	95.5	58%	0.583	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-65.4	136.2	167.6	41.6	0	0	0	0	109.9	S845	T828-S845 WeakPolarHBondContact O-CA 3.49Å; T828-S845 PolarHBondContact O-N 2.82Å
829	Q	78.1	Confident	69.7	Low	52 Å²	52	92.1 Å²	92.1	24%	0.243	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	134.6	-179.6	-74.3	149.5	89	0	0	107.8	L819 L827 G843 I844 F857	L819-Q829 HydrophobicContact CD2-CG 4.49Å; L827-Q829 PolarHBondContact O-NE2 2.94Å; Q829-G843 WeakPolarHBondContact CA-O 3.48Å; Q829-I844 HydrophobicContact CG-CD1 4.03Å; Q829-F857 HydrophobicContact CG-CE1 4.06Å
830	I	77.6	Confident	69.7	Low	113 Å²	113	91.3 Å²	91.3	58%	0.579	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	116.2	175.1	-57.7	178.3	0	0	0	106.8	C842 G843	I830-C842 CarbonylContact O-C 3.47Å; I830-C842 WeakPolarHBondContact O-CA 3.37Å; I830-G843 PolarHBondContact N-O 3.37Å; I830-G843 PolarHBondContact O-N 3.04Å
831	C	80	Confident	69.9	Low	44 Å²	44	88.9 Å²	88.9	30%	0.297	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133	174.9	-58.2	0	0	0	0	109.9	F816 T840 V841 C842	F816-C831 HydrophobicContact CE1-CB 3.67Å; F816-C831 HydrophobicContact CZ-CB 4Å; F816-C831 VanDerWaalsContact CZ-SG 3.57Å; C831-T840 HydrophobicContact CB-CG2 4.22Å; C831-V841 WeakPolarHBondContact CA-O 3.32Å; C831-C842 HydrophobicContact CB-CB 4.12Å; C831-C842 WeakPolarHBondContact CB-SG 3.5Å; C831-C842 WeakPolarHBondContact SG-CB 3.48Å; C831-C842 CovalentContact SG-SG 2.04Å; C831-C842 PolarHBondContact SG-SG 2.72Å
832	A	67.7	Low	70	Confident	54 Å²	54	87.4 Å²	87.4	45%	0.446	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126	171.9	0	0	0	0	0	108.5	V841	A832-V841 PolarHBondContact N-O 3Å; A832-V841 PolarHBondContact O-N 3.27Å; A832-V841 VanDerWaalsContact O-N 3.14Å
833	D	54.9	Low	70.5	Confident	107 Å²	107	83.7 Å²	83.7	57%	0.572	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.6	163.1	-62.8	-38.8	0	0	0	107.6	T840	D833-T840 PolarHBondContact OD1-OG1 3.3Å
834	Q	57	Low	71.4	Confident	109 Å²	109	81.7 Å²	81.7	51%	0.509	42%	0.417	S	S	.	.			trans	-94.3	176.1	174.6	-65.7	-166.5	-16.6	0	0	110.3	K836	Q834-K836 PolarHBondContact O-N 3.24Å
835	E	48.8	Very low	72.6	Confident	195 Å²	195	74 Å²	74	91%	0.911	38%	0.376	S	S	*	.	S	Bend	trans	-58.7	-14.1	176.4	-61.5	177.5	149.9	0	0	113.4
836	K	56.4	Low	73	Confident	122 Å²	122	68.7 Å²	68.7	53%	0.53	36%	0.356	S	S	.	.			trans	-86	111.1	171.1	-63.8	169.4	179.8	166	0	111.1	Q834 N838 E839	Q834-K836 PolarHBondContact O-N 3.24Å; K836-N838 PolarHBondContact O-N 2.99Å; K836-E839 HydrophobicContact CB-CB 4.28Å; K836-E839 HydrophobicContact CD-CB 4.45Å; K836-E839 WeakPolarHBondContact CD-OE2 3.34Å; K836-E839 IonicContact NZ-OE2 3.96Å; K836-E839 PolarHBondContact NZ-OE2 3.28Å; K836-E839 PolarHBondContact O-N 3.39Å
837	L	61.6	Low	72.9	Confident	129 Å²	129	61.7 Å²	61.7	68%	0.675	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-21.6	178.6	-68.4	162.2	0	0	0	115.5	Y810	Y810-L837 WeakPolarHBondContact CE2-O 3.23Å; Y810-L837 PolarHBondContact OH-O 2.86Å
838	N	79.7	Confident	73.1	Confident	53 Å²	53	60.7 Å²	60.7	28%	0.283	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	7.1	-168.4	-60.7	-22	0	0	0	113.8	Y810 E812 K836	Y810-N838 PolarHBondContact N-O 2.93Å; Y810-N838 WeakPolarHBondContact O-CB 3.45Å; E812-N838 WeakPolarHBondContact CG-ND2 3.41Å; E812-N838 WeakPolarHBondContact CG-OD1 3.34Å; E812-N838 PolarHBondContact OE1-ND2 2.79Å; K836-N838 PolarHBondContact O-N 2.99Å
839	E	85.9	Confident	73.8	Confident	25 Å²	25	56.2 Å²	56.2	12%	0.117	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	109.9	-174.6	178.6	166.4	-156	0	0	111.5	T807 L809 K836 V841	T807-E839 HydrophobicContact CG2-CG 3.9Å; L809-E839 HydrophobicContact CD2-CB 3.66Å; L809-E839 HydrophobicContact CD2-CG 3.6Å; K836-E839 HydrophobicContact CB-CB 4.28Å; K836-E839 HydrophobicContact CD-CB 4.45Å; K836-E839 WeakPolarHBondContact CD-OE2 3.34Å; K836-E839 IonicContact NZ-OE2 3.96Å; K836-E839 PolarHBondContact NZ-OE2 3.28Å; K836-E839 PolarHBondContact O-N 3.39Å; E839-V841 HydrophobicContact CG-CG2 4.29Å
840	T	87.1	Confident	73.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.6	168.3	-62.2	0	0	0	0	110.1	T807 M808 Y810 F816 C831 D833	T807-T840 WeakPolarHBondContact CA-O 3.32Å; M808-T840 HydrophobicContact CE-CG2 3.88Å; M808-T840 PolarHBondContact N-O 3.31Å; M808-T840 PolarHBondContact O-N 3.01Å; M808-T840 VanDerWaalsContact O-N 3.14Å; Y810-T840 PolarHBondContact OH-OG1 3.04Å; F816-T840 HydrophobicContact CB-CG2 4.28Å; F816-T840 WeakPolarHBondContact CB-OG1 3.35Å; F816-T840 HydrophobicContact CD1-CG2 3.68Å; F816-T840 HydrophobicContact CD2-CG2 4.26Å; F816-T840 HydrophobicContact CE1-CG2 4.01Å; F816-T840 HydrophobicContact CG-CG2 3.81Å; F816-T840 HydrophobicContact CZ-CG2 4.42Å; C831-T840 HydrophobicContact CB-CG2 4.22Å; D833-T840 PolarHBondContact OD1-OG1 3.3Å
841	V	87	Confident	74.1	Confident	28 Å²	28	58.9 Å²	58.9	17%	0.17	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.6	176.6	-173.1	0	0	0	0	110.3	T807 C831 A832 E839	T807-V841 HydrophobicContact CG2-CG2 4.22Å; C831-V841 WeakPolarHBondContact CA-O 3.32Å; A832-V841 PolarHBondContact N-O 3Å; A832-V841 PolarHBondContact O-N 3.27Å; A832-V841 VanDerWaalsContact O-N 3.14Å; E839-V841 HydrophobicContact CG-CG2 4.29Å
842	C	86.1	Confident	74.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	110.5	178.7	-65	0	0	0	0	111.6	S805 L806 M808 L819 I830 C831 I844	S805-C842 CarbonylContact C-O 3.6Å; S805-C842 WeakPolarHBondContact CA-O 3.44Å; L806-C842 HydrophobicContact CB-CB 4.49Å; L806-C842 PolarHBondContact N-O 2.85Å; L806-C842 PolarHBondContact O-N 3Å; M808-C842 VanDerWaalsContact CE-SG 3.52Å; L819-C842 HydrophobicContact CD2-CB 3.93Å; I830-C842 CarbonylContact O-C 3.47Å; I830-C842 WeakPolarHBondContact O-CA 3.37Å; C831-C842 HydrophobicContact CB-CB 4.12Å; C831-C842 WeakPolarHBondContact CB-SG 3.5Å; C831-C842 WeakPolarHBondContact SG-CB 3.48Å; C831-C842 CovalentContact SG-SG 2.04Å; C831-C842 PolarHBondContact SG-SG 2.72Å; C842-I844 HydrophobicContact CB-CD1 4.33Å
843	G	83.8	Confident	74.9	Confident	8 Å²	8	63.5 Å²	63.5	8%	0.082	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	127.1	169.3	0	0	0	0	0	111.4	T804 Q829 I830	T804-G843 WeakPolarHBondContact O-CA 3.43Å; Q829-G843 WeakPolarHBondContact CA-O 3.48Å; I830-G843 PolarHBondContact N-O 3.37Å; I830-G843 PolarHBondContact O-N 3.04Å
844	I	86	Confident	76.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120	-175.6	-51.8	-57.7	0	0	0	109.6	L794 T804 L806 L819 L827 Q829 C842 L846 Y849 F857	L794-I844 HydrophobicContact CD2-CB 4.28Å; L794-I844 HydrophobicContact CD2-CG1 4.05Å; L794-I844 HydrophobicContact CD2-CG2 4.11Å; T804-I844 HydrophobicContact CG2-CB 4.33Å; T804-I844 PolarHBondContact O-N 3.15Å; L806-I844 HydrophobicContact CB-CD1 4.24Å; L806-I844 HydrophobicContact CB-CG1 4.01Å; L819-I844 HydrophobicContact CD2-CD1 4.1Å; L827-I844 HydrophobicContact CD1-CG2 4.34Å; Q829-I844 HydrophobicContact CG-CD1 4.03Å; C842-I844 HydrophobicContact CB-CD1 4.33Å; I844-L846 PolarHBondContact O-N 2.63Å; I844-Y849 HydrophobicContact CG2-CD2 4.01Å; I844-Y849 HydrophobicContact CG2-CE2 4.12Å; I844-F857 HydrophobicContact CD1-CE1 4.44Å; I844-F857 HydrophobicContact CD1-CE2 4.25Å; I844-F857 HydrophobicContact CD1-CZ 3.97Å; I844-F857 HydrophobicContact CG1-CZ 4.49Å; I844-F857 HydrophobicContact CG2-CZ 3.84Å
845	S	76.7	Confident	78	Confident	14 Å²	14	56.4 Å²	56.4	10%	0.098	28%	0.284	C	S	.	.	S	Bend	trans	54.4	34.5	-179.7	-50.3	0	0	0	0	114.2	T828 V848	T828-S845 WeakPolarHBondContact O-CA 3.49Å; T828-S845 PolarHBondContact O-N 2.82Å; S845-V848 CarbonylContact O-C 3.53Å; S845-V848 PolarHBondContact O-N 3.47Å; S845-V848 VanDerWaalsContact O-O 3.05Å
846	L	72.1	Confident	79.9	Confident	71 Å²	71	49.4 Å²	49.4	37%	0.372	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	135.2	179.7	-60	-177.4	0	0	0	110.8	N803 I844	N803-L846 HydrophobicContact CB-CD2 4.36Å; I844-L846 PolarHBondContact O-N 2.63Å
847	P	63.9	Low	81.6	Confident	27 Å²	27	43.6 Å²	43.6	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.1	-3	4.2	32.9	-32.1	0	0	0	115.3	L721 Y802 N803	L721-P847 HydrophobicContact CB-CG 3.79Å; L721-P847 WeakPolarHBondContact O-CB 3.08Å; L721-P847 WeakPolarHBondContact O-CG 3.49Å; Y802-P847 WeakPolarHBondContact CA-O 3.48Å; N803-P847 PolarHBondContact N-O 2.97Å
848	V	77	Confident	83	Confident	28 Å²	28	38.9 Å²	38.9	17%	0.17	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	111.5	-171.2	-178	0	0	0	0	113.1	D800 Y802 S845 R850	D800-V848 HydrophobicContact CB-CG1 3.75Å; D800-V848 WeakPolarHBondContact OD2-CG1 3.19Å; Y802-V848 HydrophobicContact CD1-CG2 3.7Å; Y802-V848 HydrophobicContact CE1-CG2 3.62Å; S845-V848 CarbonylContact O-C 3.53Å; S845-V848 PolarHBondContact O-N 3.47Å; S845-V848 VanDerWaalsContact O-O 3.05Å; V848-R850 HydrophobicContact CG1-CG 4.37Å; V848-R850 PolarHBondContact O-N 3.21Å
849	Y	82.3	Confident	83.6	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	102.3	167.6	-173.3	-125	0	0	0	110.2	L769 L794 N796 S801 T804 L827 I844 S854	L769-Y849 HydrophobicContact CD2-CD1 4.12Å; L769-Y849 HydrophobicContact CD2-CE1 4.42Å; L794-Y849 HydrophobicContact CD2-CD1 4.28Å; L794-Y849 HydrophobicContact CD2-CE1 3.77Å; L794-Y849 HydrophobicContact CG-CE1 3.89Å; N796-Y849 HydrophobicContact CB-CD1 3.71Å; N796-Y849 HydrophobicContact CB-CE1 3.62Å; N796-Y849 PolarHBondContact ND2-O 2.89Å; N796-Y849 VanDerWaalsContact ND2-O 3.08Å; S801-Y849 PolarHBondContact N-O 3.22Å; S801-Y849 PolarHBondContact O-N 2.96Å; T804-Y849 HydrophobicContact CG2-CD1 3.99Å; T804-Y849 HydrophobicContact CG2-CG 4.26Å; T804-Y849 WeakPolarHBondContact OG1-CB 3.28Å; L827-Y849 HydrophobicContact CD1-CD2 4.44Å; L827-Y849 HydrophobicContact CD1-CE2 3.78Å; I844-Y849 HydrophobicContact CG2-CD2 4.01Å; I844-Y849 HydrophobicContact CG2-CE2 4.12Å; Y849-S854 WeakPolarHBondContact OH-CA 3.35Å
850	R	80.8	Confident	83.8	Confident	181 Å²	181	36 Å²	36	68%	0.683	19%	0.192	S	C	*	.			trans	-60.7	149.8	-167	-65.1	-172.8	-177.8	-169	-1	114.6	D800 V848 S853	D800-R850 VanDerWaalsContact OD1-CA 3.26Å; D800-R850 WeakPolarHBondContact OD1-CA 3.31Å; V848-R850 HydrophobicContact CG1-CG 4.37Å; V848-R850 PolarHBondContact O-N 3.21Å; R850-S853 WeakPolarHBondContact O-CB 3.18Å; R850-S853 PolarHBondContact O-N 2.84Å; R850-S853 PolarHBondContact O-OG 2.94Å
851	S	81.1	Confident	83.9	Confident	39 Å²	39	36 Å²	36	27%	0.273	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.4	138.1	168.9	179.7	0	0	0	0	112.2	A798 D800 S853	A798-S851 WeakPolarHBondContact O-CA 3.4Å; A798-S851 WeakPolarHBondContact O-CB 3.35Å; A798-S851 PolarHBondContact O-OG 3.06Å; D800-S851 WeakPolarHBondContact OD1-CB 2.98Å; D800-S851 PolarHBondContact OD1-N 3.24Å; S851-S853 PolarHBondContact O-N 2.94Å
852	K	80.9	Confident	83.8	Confident	162 Å²	162	42 Å²	42	70%	0.704	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	9.9	175.5	-62.8	156.8	-169.1	167.2	0	115.3	N796	N796-K852 CarbonylContact O-C 3.57Å; N796-K852 WeakPolarHBondContact O-CA 3.19Å; N796-K852 PolarHBondContact O-N 3.38Å
853	S	84.1	Confident	83.7	Confident	34 Å²	34	42.9 Å²	42.9	24%	0.238	22%	0.217	C	C	.	.			trans	-69	149	174.4	-61	0	0	0	0	112	H795 N796 R850 S851	H795-S853 CarbonylContact C-O 3.57Å; H795-S853 WeakPolarHBondContact CA-O 3.33Å; H795-S853 PolarHBondContact ND1-O 3.03Å; N796-S853 PolarHBondContact N-O 2.92Å; N796-S853 PolarHBondContact O-N 2.81Å; R850-S853 WeakPolarHBondContact O-CB 3.18Å; R850-S853 PolarHBondContact O-N 2.84Å; R850-S853 PolarHBondContact O-OG 2.94Å; S851-S853 PolarHBondContact O-N 2.94Å
854	S	87.9	Confident	83.1	Confident	61 Å²	61	47.7 Å²	47.7	43%	0.427	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	146	163.6	-174.2	0	0	0	0	110.1	L794 Y849	L794-S854 CarbonylContact O-C 3.54Å; L794-S854 VanDerWaalsContact O-CA 3.24Å; L794-S854 WeakPolarHBondContact O-CA 3.43Å; L794-S854 WeakPolarHBondContact O-CB 3.37Å; L794-S854 PolarHBondContact O-OG 3.12Å; Y849-S854 WeakPolarHBondContact OH-CA 3.35Å
855	A	87.8	Confident	82.2	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152.5	178	0	0	0	0	0	110.5	K793 L794 L827 F857	K793-A855 WeakPolarHBondContact CA-O 3.43Å; L794-A855 PolarHBondContact N-O 2.83Å; L794-A855 PolarHBondContact O-N 3.49Å; L827-A855 HydrophobicContact CD1-CB 3.66Å; A855-F857 HydrophobicContact CB-CE1 4.06Å; A855-F857 HydrophobicContact CB-CE2 3.92Å; A855-F857 HydrophobicContact CB-CZ 3.54Å
856	V	90.6	Very high	82.1	Confident	48 Å²	48	55.4 Å²	55.4	29%	0.291	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.2	168.4	-178.8	0	0	0	0	107.8	I792 K793 Q821 T822	I792-V856 CarbonylContact O-C 3.56Å; I792-V856 WeakPolarHBondContact O-CA 3.35Å; K793-V856 HydrophobicContact CB-CG2 4.23Å; K793-V856 HydrophobicContact CD-CG2 4.4Å; K793-V856 HydrophobicContact CG-CG2 4.03Å; Q821-V856 VanDerWaalsContact CG-O 3.29Å; Q821-V856 WeakPolarHBondContact CG-O 3.39Å; T822-V856 PolarHBondContact N-O 2.84Å
857	F	90.7	Very high	82.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	159.4	177.3	-50.1	-75	0	0	0	110.2	W791 I792 L794 L806 L819 D820 Q821 L827 Q829 I844 A855	W791-F857 CarbonylContact C-O 3.54Å; W791-F857 VanDerWaalsContact CA-O 3.27Å; W791-F857 WeakPolarHBondContact CA-O 3.33Å; I792-F857 PolarHBondContact N-O 2.63Å; I792-F857 PolarHBondContact O-N 2.96Å; L794-F857 HydrophobicContact CB-CE2 3.95Å; L794-F857 HydrophobicContact CD2-CE2 4.44Å; L806-F857 HydrophobicContact CD2-CD2 4.25Å; L819-F857 HydrophobicContact CD1-CB 3.6Å; L819-F857 HydrophobicContact CD1-CG 4.3Å; L819-F857 HydrophobicContact CD2-CB 4.43Å; L819-F857 HydrophobicContact CD2-CD1 4.31Å; L819-F857 HydrophobicContact CD2-CG 4.27Å; L819-F857 HydrophobicContact CG-CB 3.98Å; L819-F857 HydrophobicContact CG-CD1 4.38Å; L819-F857 HydrophobicContact CG-CG 4.3Å; D820-F857 CarbonylContact O-C 3.58Å; D820-F857 WeakPolarHBondContact O-CA 3.24Å; Q821-F857 HydrophobicContact CB-CD1 3.88Å; Q821-F857 HydrophobicContact CB-CE1 4.12Å; Q821-F857 HydrophobicContact CG-CD1 3.86Å; Q821-F857 HydrophobicContact CG-CE1 3.86Å; L827-F857 HydrophobicContact CD1-CZ 4.4Å; Q829-F857 HydrophobicContact CG-CE1 4.06Å; I844-F857 HydrophobicContact CD1-CE1 4.44Å; I844-F857 HydrophobicContact CD1-CE2 4.25Å; I844-F857 HydrophobicContact CD1-CZ 3.97Å; I844-F857 HydrophobicContact CG1-CZ 4.49Å; I844-F857 HydrophobicContact CG2-CZ 3.84Å; A855-F857 HydrophobicContact CB-CE1 4.06Å; A855-F857 HydrophobicContact CB-CE2 3.92Å; A855-F857 HydrophobicContact CB-CZ 3.54Å
858	T	92.1	Very high	83.2	Confident	30 Å²	30	57 Å²	57	18%	0.184	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	108.7	168.1	-56.3	0	0	0	0	107.1	L776 K789 T790 D820 T822	L776-T858 HydrophobicContact CD1-CG2 4.03Å; K789-T858 HydrophobicContact CB-CG2 4.31Å; K789-T858 HydrophobicContact CD-CG2 4.37Å; T790-T858 CarbonylContact O-C 3.57Å; T790-T858 VanDerWaalsContact O-CA 3.25Å; T790-T858 WeakPolarHBondContact O-CA 3.39Å; D820-T858 PolarHBondContact N-O 3.02Å; D820-T858 PolarHBondContact O-N 2.64Å; T822-T858 PolarHBondContact OG1-OG1 2.86Å
859	A	90.7	Very high	83.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	136.1	172.5	0	0	0	0	0	109.2	K789 T790 I792 M808 M818 L819 F861	K789-A859 VanDerWaalsContact CA-O 3.28Å; K789-A859 WeakPolarHBondContact CA-O 3.34Å; T790-A859 PolarHBondContact N-O 3.22Å; T790-A859 PolarHBondContact O-N 3.36Å; I792-A859 HydrophobicContact CD1-CB 3.8Å; M808-A859 HydrophobicContact SD-CB 3.85Å; M818-A859 WeakPolarHBondContact O-CA 3.48Å; L819-A859 HydrophobicContact CD1-CB 3.76Å; A859-F861 HydrophobicContact CB-CD2 4.5Å; A859-F861 HydrophobicContact CB-CE2 3.53Å; A859-F861 HydrophobicContact CB-CZ 3.83Å
860	S	90.3	Very high	83.4	Confident	18 Å²	18	67 Å²	67	13%	0.126	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.1	176.6	-60.4	0	0	0	0	109.6	K789 S817 M818	K789-S860 WeakPolarHBondContact CE-OG 3.15Å; S817-S860 WeakPolarHBondContact CB-O 3.43Å; S817-S860 PolarHBondContact N-O 3.1Å; M818-S860 PolarHBondContact N-O 3.17Å; M818-S860 PolarHBondContact O-N 2.94Å
861	F	89.4	Confident	83.7	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.6	178	-55.1	-95	0	0	0	109.2	T787 I788 M808 Y810 L814 S815 F816 A859 M874	T787-F861 CarbonylContact C-O 3.49Å; T787-F861 WeakPolarHBondContact CA-O 3.5Å; T787-F861 WeakPolarHBondContact CB-O 3.23Å; I788-F861 HydrophobicContact CG2-CB 3.87Å; I788-F861 HydrophobicContact CG2-CD2 4.44Å; I788-F861 PolarHBondContact N-O 3.31Å; I788-F861 PolarHBondContact O-N 2.99Å; M808-F861 HydrophobicContact CB-CZ 4.5Å; M808-F861 HydrophobicContact SD-CZ 3.8Å; Y810-F861 HydrophobicContact CD1-CD1 4.04Å; Y810-F861 AromaticContact CD1-CE1 3.54Å; Y810-F861 HydrophobicContact CD1-CE1 3.54Å; Y810-F861 HydrophobicContact CD1-CZ 4.47Å; Y810-F861 HydrophobicContact CE1-CD1 4.14Å; Y810-F861 AromaticContact CE1-CE1 3.71Å; Y810-F861 HydrophobicContact CE1-CE1 3.71Å; Y810-F861 HydrophobicContact CG-CE1 4.38Å; L814-F861 HydrophobicContact CD1-CB 4.25Å; L814-F861 HydrophobicContact CD1-CG 4.32Å; L814-F861 HydrophobicContact CD2-CB 4.12Å; S815-F861 CarbonylContact O-C 3.59Å; S815-F861 VanDerWaalsContact O-CA 3.26Å; S815-F861 WeakPolarHBondContact O-CA 3.35Å; F816-F861 HydrophobicContact CB-CD1 4.07Å; F816-F861 HydrophobicContact CB-CE1 4.03Å; F816-F861 HydrophobicContact CD2-CD1 4.32Å; F816-F861 AromaticContact CD2-CE1 3.81Å; F816-F861 HydrophobicContact CD2-CE1 3.81Å; F816-F861 HydrophobicContact CD2-CZ 4.18Å; F816-F861 HydrophobicContact CG-CE1 4.42Å; A859-F861 HydrophobicContact CB-CD2 4.5Å; A859-F861 HydrophobicContact CB-CE2 3.53Å; A859-F861 HydrophobicContact CB-CZ 3.83Å; F861-M874 HydrophobicContact CE1-CE 4.13Å; F861-M874 HydrophobicContact CE2-CE 3.68Å; F861-M874 HydrophobicContact CE2-SD 4.36Å; F861-M874 HydrophobicContact CZ-CE 3.33Å; F861-M874 HydrophobicContact CZ-SD 4.48Å
862	R	86.5	Confident	84	Confident	153 Å²	153	60.2 Å²	60.2	58%	0.577	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	143	168	-65.1	172.1	-165.2	-152.7	2.2	108.8	T787 S815 S817	T787-R862 HydrophobicContact CG2-CG 3.96Å; S815-R862 PolarHBondContact N-O 3Å; S815-R862 PolarHBondContact O-N 3.48Å; S817-R862 PolarHBondContact OG-NE 3.13Å; S817-R862 PolarHBondContact OG-NH2 3.35Å
863	I	83.1	Confident	84.5	Confident	20 Å²	20	57.6 Å²	57.6	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.3	171.6	-61.6	173	0	0	0	108	L780 V782 T786 L814 W868	L780-I863 HydrophobicContact CD1-CD1 3.42Å; L780-I863 VanDerWaalsContact CD1-CD1 3.42Å; L780-I863 HydrophobicContact CD1-CG1 4.45Å; L780-I863 HydrophobicContact CG-CD1 4.35Å; V782-I863 HydrophobicContact CG1-CG2 4.04Å; T786-I863 PolarHBondContact O-N 2.69Å; L814-I863 HydrophobicContact CD2-CG1 3.96Å; I863-W868 HydrophobicContact CG1-CH2 4.35Å; I863-W868 HydrophobicContact CG2-CH2 3.83Å; I863-W868 HydrophobicContact CG2-CZ3 3.83Å
864	K	71.5	Confident	84.8	Confident	109 Å²	109	56 Å²	56	47%	0.474	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-91.7	159.4	163.7	-69.7	170	173	165.3	0	108	G813 S815 F866	G813-K864 PolarHBondContact O-N 2.78Å; S815-K864 WeakPolarHBondContact OG-CE 3.38Å; S815-K864 PolarHBondContact OG-NZ 2.9Å; K864-F866 PolarHBondContact O-N 3.36Å
865	D	66.8	Low	85	Confident	109 Å²	109	54.6 Å²	54.6	58%	0.583	28%	0.276	S	S	*	.	S	Bend	trans	-67.5	118.3	178.7	-162.4	-4.1	0	0	0	110.3	K939	D865-K939 IonicContact OD1-NZ 3.68Å; D865-K939 PolarHBondContact OD1-NZ 2.87Å
866	F	74.9	Confident	85.2	Confident	66 Å²	66	54.4 Å²	54.4	29%	0.289	27%	0.274	S	S	.	.			trans	-158.2	152.4	-172.6	-167.5	-94.3	0	0	0	112.1	E812 K864 W868 Y899	E812-F866 HydrophobicContact CB-CD2 3.98Å; E812-F866 HydrophobicContact CB-CE1 4.34Å; E812-F866 HydrophobicContact CB-CE2 3.37Å; E812-F866 HydrophobicContact CB-CZ 3.59Å; E812-F866 VanDerWaalsContact O-CD1 3.3Å; E812-F866 WeakPolarHBondContact O-CD1 3.49Å; E812-F866 WeakPolarHBondContact O-CE1 3.4Å; K864-F866 PolarHBondContact O-N 3.36Å; F866-W868 AromaticContact CD1-CD1 3.58Å; F866-W868 HydrophobicContact CD1-CD2 4.08Å; F866-W868 AromaticContact CD1-CE2 3.81Å; F866-W868 AromaticContact CD1-CG 3.98Å; F866-W868 HydrophobicContact CD1-CG 3.98Å; F866-W868 HydrophobicContact CD1-CZ2 4.49Å; F866-W868 AromaticContact CD1-NE1 3.43Å; F866-W868 AromaticContact CE1-CD1 3.65Å; F866-W868 HydrophobicContact CE1-CG 4.38Å; F866-W868 AromaticContact CE1-NE1 3.71Å; F866-Y899 PolarHBondContact O-OH 3.38Å
867	E	77.6	Confident	85.2	Confident	122 Å²	122	53.5 Å²	53.5	57%	0.57	27%	0.266	S	S	*	.			trans	-98.1	93.3	-179.3	-68.9	-87.9	116.7	0	0	110.6	K939	E867-K939 WeakPolarHBondContact OE1-CE 3.43Å; E867-K939 IonicContact OE1-NZ 3.55Å; E867-K939 PolarHBondContact OE1-NZ 3.17Å
868	W	82	Confident	85.1	Confident	11 Å²	11	53.6 Å²	53.6	4%	0.042	27%	0.267	C	S	.	.			trans	-88.2	148.3	168.1	-66.4	-57.8	0	0	0	111.5	L780 V782 E812 L814 I863 F866 M872 V897 Y899 R1053	L780-W868 HydrophobicContact CD2-CE3 4.15Å; L780-W868 HydrophobicContact CD2-CH2 4.4Å; L780-W868 HydrophobicContact CD2-CZ3 3.96Å; V782-W868 HydrophobicContact CG2-CE3 3.95Å; V782-W868 HydrophobicContact CG2-CZ3 3.76Å; E812-W868 WeakPolarHBondContact O-CZ2 3.38Å; E812-W868 PolarHBondContact O-NE1 3.27Å; L814-W868 HydrophobicContact CD2-CH2 3.88Å; L814-W868 HydrophobicContact CD2-CZ2 4.1Å; L814-W868 HydrophobicContact CG-CH2 4.25Å; L814-W868 HydrophobicContact CG-CZ2 3.94Å; I863-W868 HydrophobicContact CG1-CH2 4.35Å; I863-W868 HydrophobicContact CG2-CH2 3.83Å; I863-W868 HydrophobicContact CG2-CZ3 3.83Å; F866-W868 AromaticContact CD1-CD1 3.58Å; F866-W868 HydrophobicContact CD1-CD2 4.08Å; F866-W868 AromaticContact CD1-CE2 3.81Å; F866-W868 AromaticContact CD1-CG 3.98Å; F866-W868 HydrophobicContact CD1-CG 3.98Å; F866-W868 HydrophobicContact CD1-CZ2 4.49Å; F866-W868 AromaticContact CD1-NE1 3.43Å; F866-W868 AromaticContact CE1-CD1 3.65Å; F866-W868 HydrophobicContact CE1-CG 4.38Å; F866-W868 AromaticContact CE1-NE1 3.71Å; W868-M872 HydrophobicContact CZ2-SD 4.29Å; W868-V897 HydrophobicContact CB-CG1 4.23Å; W868-V897 HydrophobicContact CB-CG2 4.13Å; W868-V897 HydrophobicContact CE3-CG1 4.08Å; W868-Y899 PolarHBondContact N-OH 2.85Å; W868-R1053 PolarHBondContact O-NH2 2.76Å
869	N	80.6	Confident	84.8	Confident	127 Å²	127	57.1 Å²	57.1	68%	0.679	28%	0.279	S	S	*	.			trans	-67.9	-176.6	163.7	-67.3	-23.7	0	0	0	110.7	T871	N869-T871 PolarHBondContact O-N 2.96Å
870	D	82.3	Confident	84.5	Confident	113 Å²	113	58 Å²	58	60%	0.604	29%	0.286	S	S	*	.	S	Bend	trans	-57.9	-19.6	-173.4	-54.8	-44.9	0	0	0	114.8	P896 V897	D870-P896 CarbonylContact O-C 3.53Å; D870-P896 WeakPolarHBondContact O-CA 3.42Å; D870-V897 PolarHBondContact O-N 2.83Å
871	T	86	Confident	83.8	Confident	75 Å²	75	62.5 Å²	62.5	46%	0.46	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.8	175.2	59.2	0	0	0	0	112.6	N869 I895	N869-T871 PolarHBondContact O-N 2.96Å; T871-I895 CarbonylContact C-O 3.5Å; T871-I895 WeakPolarHBondContact CA-O 3.23Å
872	M	88.9	Confident	83.2	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.8	168.9	-171.8	-159.6	83.6	0	0	109.7	F775 L780 I788 P811 L814 W868 M874 S894 I895 V897	F775-M872 HydrophobicContact CE1-CE 3.7Å; F775-M872 HydrophobicContact CZ-CE 3.98Å; L780-M872 HydrophobicContact CD2-CB 4.4Å; L780-M872 HydrophobicContact CD2-SD 3.7Å; I788-M872 HydrophobicContact CD1-CE 4.36Å; P811-M872 HydrophobicContact CG-CG 3.51Å; P811-M872 HydrophobicContact CG-SD 4.24Å; L814-M872 HydrophobicContact CD1-CE 3.75Å; L814-M872 HydrophobicContact CD1-SD 3.58Å; L814-M872 VanDerWaalsContact CD1-SD 3.58Å; L814-M872 HydrophobicContact CD2-SD 4.41Å; L814-M872 HydrophobicContact CG-SD 3.93Å; W868-M872 HydrophobicContact CZ2-SD 4.29Å; M872-M874 HydrophobicContact CE-CB 4.45Å; M872-S894 CarbonylContact O-C 3.49Å; M872-S894 WeakPolarHBondContact O-CA 3.47Å; M872-I895 HydrophobicContact CB-CG2 4.02Å; M872-I895 HydrophobicContact CE-CG2 3.85Å; M872-I895 PolarHBondContact N-O 3.44Å; M872-I895 PolarHBondContact O-N 2.6Å; M872-V897 HydrophobicContact CB-CG2 3.85Å
873	L	90.8	Very high	81.7	Confident	106 Å²	106	60.3 Å²	60.3	56%	0.555	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.2	176.5	-79.2	161.2	0	0	0	110.7	P811 T892	P811-L873 VanDerWaalsContact CD-O 3.28Å; P811-L873 WeakPolarHBondContact CD-O 3.4Å; L873-T892 HydrophobicContact CD2-CG2 4Å
874	M	90.8	Very high	80.7	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.4	173.1	-174.2	-175.2	179.8	0	0	110.1	F773 F775 T790 M808 L809 F861 M872 V876 T892 K893	F773-M874 HydrophobicContact CE2-CB 4.33Å; F773-M874 HydrophobicContact CE2-CG 4.34Å; F773-M874 HydrophobicContact CE2-SD 3.96Å; F773-M874 HydrophobicContact CZ-CB 4.07Å; F773-M874 HydrophobicContact CZ-CG 4.26Å; F773-M874 WeakPolarHBondContact CZ-O 3.47Å; F773-M874 HydrophobicContact CZ-SD 4.46Å; F775-M874 HydrophobicContact CE1-CB 4.35Å; F775-M874 HydrophobicContact CE1-SD 4.27Å; F775-M874 HydrophobicContact CZ-CB 3.92Å; T790-M874 HydrophobicContact CG2-SD 4.01Å; M808-M874 HydrophobicContact CB-CE 3.94Å; M808-M874 HydrophobicContact CG-CE 4.15Å; M808-M874 HydrophobicContact SD-CE 4.5Å; L809-M874 WeakPolarHBondContact O-CG 3.49Å; F861-M874 HydrophobicContact CE1-CE 4.13Å; F861-M874 HydrophobicContact CE2-CE 3.68Å; F861-M874 HydrophobicContact CE2-SD 4.36Å; F861-M874 HydrophobicContact CZ-CE 3.33Å; F861-M874 HydrophobicContact CZ-SD 4.48Å; M872-M874 HydrophobicContact CE-CB 4.45Å; M874-V876 HydrophobicContact CE-CG2 3.91Å; M874-T892 VanDerWaalsContact O-CA 3.29Å; M874-T892 WeakPolarHBondContact O-CA 3.39Å; M874-K893 PolarHBondContact N-O 3.45Å; M874-K893 PolarHBondContact O-N 2.97Å
875	T	92	Very high	80	Confident	31 Å²	31	60.7 Å²	60.7	19%	0.19	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135	179.2	-61.3	0	0	0	0	110.8	L809 F877 S890 V891 T892	L809-T875 PolarHBondContact N-O 3.06Å; L809-T875 PolarHBondContact O-N 3.32Å; T875-F877 HydrophobicContact CG2-CD1 4.47Å; T875-S890 VanDerWaalsContact CG2-OG 3.27Å; T875-S890 WeakPolarHBondContact CG2-OG 3.4Å; T875-V891 CarbonylContact C-O 3.51Å; T875-V891 VanDerWaalsContact CA-O 3.31Å; T875-V891 WeakPolarHBondContact CA-O 3.39Å; T875-T892 WeakPolarHBondContact CG2-OG1 3.48Å; T875-T892 WeakPolarHBondContact OG1-CG2 3.13Å; T875-T892 PolarHBondContact OG1-OG1 3Å
876	V	92.4	Very high	79.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.2	178.2	-169.2	0	0	0	0	109.9	V771 F773 I792 L806 T807 M808 M874 V891	V771-V876 HydrophobicContact CG1-CB 4.34Å; V771-V876 HydrophobicContact CG1-CG1 3.97Å; F773-V876 HydrophobicContact CB-CG2 4.42Å; F773-V876 HydrophobicContact CD1-CB 3.97Å; F773-V876 HydrophobicContact CD1-CG2 3.71Å; F773-V876 HydrophobicContact CD2-CG2 4.23Å; F773-V876 HydrophobicContact CE1-CB 4.39Å; F773-V876 HydrophobicContact CE1-CG2 3.94Å; F773-V876 HydrophobicContact CE2-CG2 4.43Å; F773-V876 HydrophobicContact CG-CB 4.41Å; F773-V876 HydrophobicContact CG-CG2 3.87Å; F773-V876 HydrophobicContact CZ-CG2 4.29Å; I792-V876 HydrophobicContact CD1-CG1 4.37Å; I792-V876 HydrophobicContact CG2-CG1 4.03Å; L806-V876 HydrophobicContact CD1-CG1 3.78Å; L806-V876 HydrophobicContact CG-CG1 4.28Å; T807-V876 WeakPolarHBondContact O-CA 3.35Å; M808-V876 HydrophobicContact CG-CG1 4.11Å; M808-V876 HydrophobicContact CG-CG2 4.25Å; M874-V876 HydrophobicContact CE-CG2 3.91Å; V876-V891 PolarHBondContact N-O 2.93Å; V876-V891 PolarHBondContact O-N 3.03Å
877	F	89.9	Confident	78.1	Confident	29 Å²	29	63.1 Å²	63.1	13%	0.127	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	168.5	175.5	61.2	-100.8	0	0	0	111	T807 L809 T875 K879	T807-F877 VanDerWaalsContact CB-CZ 3.42Å; T807-F877 HydrophobicContact CG2-CE1 4Å; T807-F877 HydrophobicContact CG2-CE2 3.89Å; T807-F877 HydrophobicContact CG2-CZ 3.44Å; T807-F877 VanDerWaalsContact CG2-CZ 3.44Å; T807-F877 PolarHBondContact N-O 3.02Å; T807-F877 PolarHBondContact O-N 3.41Å; T807-F877 VanDerWaalsContact O-N 3.14Å; T807-F877 WeakPolarHBondContact OG1-CE2 3.11Å; L809-F877 HydrophobicContact CD1-CE1 3.85Å; L809-F877 HydrophobicContact CG-CE1 4.07Å; T875-F877 HydrophobicContact CG2-CD1 4.47Å; F877-K879 HydrophobicContact CD2-CD 4.44Å; F877-K879 HydrophobicContact CD2-CG 4.17Å; F877-K879 HydrophobicContact CE2-CD 3.8Å; F877-K879 HydrophobicContact CE2-CG 4.03Å
878	A	89.2	Confident	77.1	Confident	2 Å²	2	61 Å²	61	2%	0.017	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	152.3	173.8	0	0	0	0	0	112.1	L769 V771 L794 S805	L769-A878 HydrophobicContact CB-CB 4.1Å; L769-A878 HydrophobicContact CD1-CB 4.04Å; V771-A878 HydrophobicContact CG2-CB 3.6Å; L794-A878 HydrophobicContact CD1-CB 3.77Å; S805-A878 CarbonylContact O-C 3.58Å; S805-A878 WeakPolarHBondContact O-CA 3.38Å
879	K	85.1	Confident	76.5	Confident	104 Å²	104	61.9 Å²	61.9	45%	0.452	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	158	178.6	-77.6	173.5	177.7	163.6	0	110.6	T804 S805 F877	T804-K879 WeakPolarHBondContact CA-O 3.34Å; S805-K879 PolarHBondContact N-O 2.9Å; S805-K879 PolarHBondContact O-N 3.38Å; F877-K879 HydrophobicContact CD2-CD 4.44Å; F877-K879 HydrophobicContact CD2-CG 4.17Å; F877-K879 HydrophobicContact CE2-CD 3.8Å; F877-K879 HydrophobicContact CE2-CG 4.03Å
880	S	83.6	Confident	76.7	Confident	20 Å²	20	59.1 Å²	59.1	14%	0.14	34%	0.341	C	S	.	.			trans	-145.8	149.5	-178.6	-175.1	0	0	0	0	109	S801 N882	S801-S880 WeakPolarHBondContact OG-CB 3.4Å; S801-S880 PolarHBondContact OG-OG 3.21Å; S880-N882 PolarHBondContact O-N 3.32Å; S880-N882 WeakPolarHBondContact OG-CB 3.27Å; S880-N882 PolarHBondContact OG-N 2.77Å; S880-N882 PolarHBondContact OG-OD1 3.32Å; S880-N882 VanDerWaalsContact OG-OD1 3.08Å
881	E	75.9	Confident	77.1	Confident	112 Å²	112	55.3 Å²	55.3	52%	0.523	32%	0.321	S	S	.	.			trans	-77.8	-7.1	170.7	-75.2	176.5	-166.9	0	0	113	K758 Y802 N803 S883	K758-E881 IonicContact NZ-OE2 2.97Å; K758-E881 PolarHBondContact NZ-OE2 3.25Å; Y802-E881 PolarHBondContact O-N 3.46Å; Y802-E881 VanDerWaalsContact O-N 3.08Å; N803-E881 HydrophobicContact CB-CG 4.01Å; N803-E881 VanDerWaalsContact CB-OE1 3.31Å; N803-E881 WeakPolarHBondContact CB-OE1 3.29Å; N803-E881 VanDerWaalsContact ND2-CD 3.28Å; N803-E881 PolarHBondContact ND2-OE1 2.87Å; N803-E881 PolarHBondContact ND2-OE2 3.14Å; E881-S883 PolarHBondContact O-N 2.9Å
882	N	77	Confident	77.4	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.043	32%	0.322	C	S	.	.	S	Bend	trans	-59.4	126.6	178.8	-70.4	39.6	0	0	0	110.6	A767 D800 Y802 S880 N884 S885	A767-N882 HydrophobicContact CB-CB 3.96Å; D800-N882 PolarHBondContact O-ND2 2.93Å; Y802-N882 WeakPolarHBondContact CD2-OD1 3.3Å; Y802-N882 PolarHBondContact N-OD1 3.44Å; S880-N882 PolarHBondContact O-N 3.32Å; S880-N882 WeakPolarHBondContact OG-CB 3.27Å; S880-N882 PolarHBondContact OG-N 2.77Å; S880-N882 PolarHBondContact OG-OD1 3.32Å; S880-N882 VanDerWaalsContact OG-OD1 3.08Å; N882-N884 PolarHBondContact O-N 3.15Å; N882-S885 PolarHBondContact O-N 2.83Å; N882-S885 PolarHBondContact O-OG 3.47Å
883	S	56.1	Low	77.6	Confident	99 Å²	99	57.9 Å²	57.9	69%	0.692	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	12.8	-163	50	0	0	0	0	116.6	E881	E881-S883 PolarHBondContact O-N 2.9Å
884	N	61.6	Low	77.6	Confident	90 Å²	90	56.1 Å²	56.1	48%	0.481	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.9	39.1	173.4	-146.4	-13.2	0	0	0	113.3	N882 S886	N882-N884 PolarHBondContact O-N 3.15Å; N884-S886 PolarHBondContact O-N 3.41Å; N884-S886 PolarHBondContact O-OG 2.75Å
885	S	56.9	Low	77.6	Confident	47 Å²	47	56.1 Å²	56.1	33%	0.329	33%	0.329	S	S	.	.			trans	-74.4	63.4	-178	43	0	0	0	0	113.3	N882 E887	N882-S885 PolarHBondContact O-N 2.83Å; N882-S885 PolarHBondContact O-OG 3.47Å; S885-E887 PolarHBondContact O-N 2.93Å
886	S	48	Very low	77.5	Confident	101 Å²	101	57.8 Å²	57.8	71%	0.706	34%	0.34	S	S	*	.			trans	-82.6	-2.9	-163.6	41	0	0	0	0	117.1	N884	N884-S886 PolarHBondContact O-N 3.41Å; N884-S886 PolarHBondContact O-OG 2.75Å
887	E	54.2	Low	77.3	Confident	125 Å²	125	58.1 Å²	58.1	58%	0.584	34%	0.343	S	S	*	.			trans	-123.7	76.3	166.6	-75.1	-165.1	173.2	0	0	111.3	K770 S885 S889	K770-E887 IonicContact NZ-OE2 3.15Å; K770-E887 PolarHBondContact NZ-OE2 3.34Å; S885-E887 PolarHBondContact O-N 2.93Å; E887-S889 PolarHBondContact O-N 3.28Å
888	S	56.3	Low	77.3	Confident	76 Å²	76	58.9 Å²	58.9	53%	0.531	35%	0.346	S	S	.	.			trans	-72.5	92.7	166	48.9	0	0	0	0	109.7	S890	S888-S890 PolarHBondContact O-N 3.02Å
889	S	68.8	Low	77.1	Confident	30 Å²	30	58.9 Å²	58.9	21%	0.21	35%	0.345	C	S	.	.			trans	-64.8	108	-179.4	69	0	0	0	0	110.4	L769 K770 V771 E887	L769-S889 PolarHBondContact O-OG 2.99Å; K770-S889 WeakPolarHBondContact CA-OG 3.4Å; V771-S889 PolarHBondContact N-OG 3.33Å; E887-S889 PolarHBondContact O-N 3.28Å
890	S	84.8	Confident	77.2	Confident	70 Å²	70	54.3 Å²	54.3	49%	0.49	33%	0.326	S	S	.	.			trans	-95.4	131.6	171.8	-170.7	0	0	0	0	109.7	T875 S888	T875-S890 VanDerWaalsContact CG2-OG 3.27Å; T875-S890 WeakPolarHBondContact CG2-OG 3.4Å; S888-S890 PolarHBondContact O-N 3.02Å
891	V	91.1	Very high	77.4	Confident	32 Å²	32	53.4 Å²	53.4	19%	0.194	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.4	175.9	179.6	0	0	0	0	108.2	V771 F773 T875 V876 K893	V771-V891 WeakPolarHBondContact O-CG2 3.41Å; F773-V891 HydrophobicContact CD1-CB 4.06Å; F773-V891 HydrophobicContact CD1-CG1 3.78Å; F773-V891 HydrophobicContact CE1-CB 4.32Å; F773-V891 HydrophobicContact CE1-CG1 3.93Å; F773-V891 WeakPolarHBondContact CE1-O 3.38Å; T875-V891 CarbonylContact C-O 3.51Å; T875-V891 VanDerWaalsContact CA-O 3.31Å; T875-V891 WeakPolarHBondContact CA-O 3.39Å; V876-V891 PolarHBondContact N-O 2.93Å; V876-V891 PolarHBondContact O-N 3.03Å; V891-K893 HydrophobicContact CG1-CG 4.4Å
892	T	92.5	Very high	77.9	Confident	77 Å²	77	52.1 Å²	52.1	47%	0.472	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.5	175.5	-57.5	0	0	0	0	109.2	L873 M874 T875	L873-T892 HydrophobicContact CD2-CG2 4Å; M874-T892 VanDerWaalsContact O-CA 3.29Å; M874-T892 WeakPolarHBondContact O-CA 3.39Å; T875-T892 WeakPolarHBondContact CG2-OG1 3.48Å; T875-T892 WeakPolarHBondContact OG1-CG2 3.13Å; T875-T892 PolarHBondContact OG1-OG1 3Å
893	K	92.5	Very high	78.4	Confident	54 Å²	54	52.3 Å²	52.3	24%	0.235	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	159.7	174.3	-67.8	-171.7	178.9	172.1	0	111.1	D772 F773 D774 F775 M874 V891	D772-K893 IonicContact OD1-NZ 3.96Å; F773-K893 HydrophobicContact CE1-CB 4.16Å; F773-K893 HydrophobicContact CE1-CG 4.15Å; F773-K893 HydrophobicContact CE2-CB 4.3Å; F773-K893 HydrophobicContact CZ-CB 3.7Å; F773-K893 HydrophobicContact CZ-CG 4.17Å; F773-K893 VanDerWaalsContact O-CD 3.25Å; F773-K893 WeakPolarHBondContact O-CD 3.28Å; F773-K893 WeakPolarHBondContact O-CE 3.12Å; F773-K893 PolarHBondContact O-NZ 2.04Å; D774-K893 HydrophobicContact CB-CD 4.4Å; D774-K893 VanDerWaalsContact CG-NZ 3.32Å; D774-K893 IonicContact OD2-NZ 2.79Å; D774-K893 PolarHBondContact OD2-NZ 3.1Å; F775-K893 HydrophobicContact CE2-CB 3.91Å; M874-K893 PolarHBondContact N-O 3.45Å; M874-K893 PolarHBondContact O-N 2.97Å; V891-K893 HydrophobicContact CG1-CG 4.4Å
894	S	91.1	Very high	79.9	Confident	69 Å²	69	51.3 Å²	51.3	48%	0.483	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	152.7	177.9	56.9	0	0	0	0	111.7	M872	M872-S894 CarbonylContact O-C 3.49Å; M872-S894 WeakPolarHBondContact O-CA 3.47Å
895	I	90.7	Very high	81.2	Confident	3 Å²	3	48 Å²	48	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.4	172.1	-170.9	171.5	0	0	0	110.2	F775 S777 L780 I788 T871 M872	F775-I895 HydrophobicContact CB-CD1 3.97Å; F775-I895 HydrophobicContact CD1-CB 4.47Å; F775-I895 HydrophobicContact CD1-CD1 4.29Å; F775-I895 HydrophobicContact CD1-CG2 4.34Å; F775-I895 HydrophobicContact CD2-CB 3.9Å; F775-I895 HydrophobicContact CD2-CD1 4.5Å; F775-I895 HydrophobicContact CD2-CG2 4.49Å; F775-I895 HydrophobicContact CE1-CB 4.5Å; F775-I895 HydrophobicContact CE1-CG2 4.07Å; F775-I895 HydrophobicContact CE2-CB 3.92Å; F775-I895 HydrophobicContact CE2-CG2 4.21Å; F775-I895 HydrophobicContact CG-CB 4.18Å; F775-I895 HydrophobicContact CG-CD1 4.01Å; F775-I895 HydrophobicContact CZ-CB 4.22Å; F775-I895 HydrophobicContact CZ-CG2 3.98Å; S777-I895 WeakPolarHBondContact O-CD1 3.32Å; L780-I895 HydrophobicContact CB-CD1 4.21Å; L780-I895 HydrophobicContact CB-CG1 4.4Å; L780-I895 HydrophobicContact CB-CG2 4.25Å; I788-I895 HydrophobicContact CD1-CD1 3.94Å; I788-I895 HydrophobicContact CD1-CG2 4.28Å; T871-I895 CarbonylContact C-O 3.5Å; T871-I895 WeakPolarHBondContact CA-O 3.23Å; M872-I895 HydrophobicContact CB-CG2 4.02Å; M872-I895 HydrophobicContact CE-CG2 3.85Å; M872-I895 PolarHBondContact N-O 3.44Å; M872-I895 PolarHBondContact O-N 2.6Å
896	P	89.9	Confident	82.7	Confident	65 Å²	65	48.3 Å²	48.3	42%	0.422	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	143.1	175.1	-20.9	33.3	0	0	0	112.4	E779 L780 D870	E779-P896 WeakPolarHBondContact CA-O 3.45Å; L780-P896 PolarHBondContact N-O 2.94Å; D870-P896 CarbonylContact O-C 3.53Å; D870-P896 WeakPolarHBondContact O-CA 3.42Å
897	V	88.9	Confident	84.6	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.5	-175.8	-168	0	0	0	0	112.1	L780 V782 W868 D870 M872 Y899	L780-V897 HydrophobicContact CB-CG2 4.49Å; L780-V897 HydrophobicContact CD2-CG1 4.42Å; L780-V897 HydrophobicContact CD2-CG2 4.28Å; L780-V897 HydrophobicContact CG-CG1 4.43Å; V782-V897 HydrophobicContact CG2-CG1 3.93Å; W868-V897 HydrophobicContact CB-CG1 4.23Å; W868-V897 HydrophobicContact CB-CG2 4.13Å; W868-V897 HydrophobicContact CE3-CG1 4.08Å; D870-V897 PolarHBondContact O-N 2.83Å; M872-V897 HydrophobicContact CB-CG2 3.85Å; V897-Y899 HydrophobicContact CG1-CE2 4.16Å
898	K	88.1	Confident	86.1	Confident	44 Å²	44	41.7 Å²	41.7	19%	0.191	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.3	172.3	-62.5	-176.3	-168.8	159.9	0	111.2	E779 L780 L781 V782 T1052 R1053 V1055	E779-K898 WeakPolarHBondContact OE1-CE 3.18Å; E779-K898 IonicContact OE1-NZ 2.71Å; E779-K898 PolarHBondContact OE1-NZ 3.1Å; E779-K898 WeakPolarHBondContact OE2-CE 3.47Å; E779-K898 IonicContact OE2-NZ 2.67Å; E779-K898 PolarHBondContact OE2-NZ 2.88Å; L780-K898 PolarHBondContact O-N 3.46Å; L780-K898 VanDerWaalsContact O-O 3.12Å; L781-K898 CarbonylContact C-O 3.53Å; L781-K898 WeakPolarHBondContact CA-O 3.37Å; L781-K898 HydrophobicContact CD1-CB 4.12Å; V782-K898 PolarHBondContact N-O 3.06Å; K898-T1052 WeakPolarHBondContact CE-O 3.34Å; K898-R1053 CarbonylContact C-O 3.55Å; K898-R1053 VanDerWaalsContact CA-O 3.28Å; K898-R1053 WeakPolarHBondContact CA-O 3.29Å; K898-V1055 HydrophobicContact CB-CG2 4.38Å; K898-V1055 HydrophobicContact CD-CG2 3.99Å
899	Y	86.3	Confident	87.1	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.1	179.2	-68.9	-91.9	0	0	0	111.3	V782 F866 W868 V897 K939 R1053 Y1054 V1055	V782-Y899 HydrophobicContact CB-CD1 3.71Å; V782-Y899 HydrophobicContact CB-CE1 3.88Å; V782-Y899 HydrophobicContact CB-CG 4.37Å; V782-Y899 HydrophobicContact CG1-CD1 3.81Å; V782-Y899 HydrophobicContact CG1-CE1 3.78Å; V782-Y899 HydrophobicContact CG2-CD1 4.22Å; V782-Y899 HydrophobicContact CG2-CE1 3.98Å; F866-Y899 PolarHBondContact O-OH 3.38Å; W868-Y899 PolarHBondContact N-OH 2.85Å; V897-Y899 HydrophobicContact CG1-CE2 4.16Å; Y899-K939 HydrophobicContact CD1-CD 4.2Å; Y899-K939 HydrophobicContact CD1-CG 4.03Å; Y899-K939 HydrophobicContact CE1-CD 4.47Å; Y899-K939 HydrophobicContact CG-CG 4.48Å; Y899-R1053 PolarHBondContact N-O 2.75Å; Y899-Y1054 CarbonylContact O-C 3.3Å; Y899-Y1054 WeakPolarHBondContact O-CA 3.46Å; Y899-V1055 PolarHBondContact O-N 3.08Å
900	S	86.2	Confident	87.6	Confident	8 Å²	8	48.6 Å²	48.6	6%	0.056	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.3	169	-169	0	0	0	0	109.2	V782 F938 V1055	V782-S900 PolarHBondContact O-N 3.27Å; S900-F938 VanDerWaalsContact O-CE1 3.26Å; S900-F938 WeakPolarHBondContact O-CE1 3.41Å; S900-V1055 WeakPolarHBondContact CA-O 3.43Å
901	V	88.2	Confident	87.6	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	162.2	-179.9	-63.2	0	0	0	0	110.8	K939 F941 Y1054 V1055 L1056 S1057	V901-K939 HydrophobicContact CG1-CB 4.42Å; V901-F941 HydrophobicContact CB-CD1 3.82Å; V901-F941 HydrophobicContact CB-CE1 3.71Å; V901-F941 HydrophobicContact CB-CG 4.36Å; V901-F941 HydrophobicContact CB-CZ 4.16Å; V901-F941 HydrophobicContact CG1-CB 4.27Å; V901-F941 HydrophobicContact CG1-CD1 3.65Å; V901-F941 HydrophobicContact CG1-CE1 4.1Å; V901-F941 HydrophobicContact CG1-CG 4Å; V901-F941 HydrophobicContact CG2-CD1 4.34Å; V901-F941 HydrophobicContact CG2-CD2 4.46Å; V901-F941 HydrophobicContact CG2-CE1 4.13Å; V901-F941 HydrophobicContact CG2-CE2 4.24Å; V901-F941 HydrophobicContact CG2-CZ 4.07Å; V901-Y1054 HydrophobicContact CG1-CD1 3.62Å; V901-Y1054 HydrophobicContact CG1-CE1 4.42Å; V901-Y1054 HydrophobicContact CG1-CG 4.36Å; V901-V1055 PolarHBondContact N-O 3.29Å; V901-L1056 HydrophobicContact CG2-CD1 3.78Å; V901-L1056 CarbonylContact O-C 3.53Å; V901-L1056 WeakPolarHBondContact O-CA 3.21Å; V901-S1057 PolarHBondContact O-N 2.78Å
902	E	86.6	Confident	87.2	Confident	86 Å²	86	46.6 Å²	46.6	40%	0.402	27%	0.27	S	S	.	.			trans	-147.5	115.1	-175.7	-168.8	164.7	144.8	0	0	110.5	N935 A936 G937 S1057	E902-N935 CarbonylContact O-C 3.16Å; E902-N935 WeakPolarHBondContact O-CA 3.21Å; E902-N935 PolarHBondContact O-OD1 3.11Å; E902-A936 HydrophobicContact CB-CB 4.44Å; E902-A936 HydrophobicContact CG-CB 4.08Å; E902-A936 PolarHBondContact O-N 3.49Å; E902-G937 PolarHBondContact O-N 3.37Å; E902-S1057 WeakPolarHBondContact OE2-CB 3.49Å; E902-S1057 PolarHBondContact OE2-OG 3.11Å
903	M	87.9	Confident	86.8	Confident	11 Å²	11	49.6 Å²	49.6	5%	0.054	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147	176.6	58.9	173.1	170.5	0	0	111.4	Y934 F941 L1000 V1047 Y1049 L1056 V1069	M903-Y934 CarbonylContact C-O 3.54Å; M903-Y934 WeakPolarHBondContact CA-O 3.4Å; M903-F941 HydrophobicContact CB-CZ 4.09Å; M903-F941 HydrophobicContact CE-CE2 4.41Å; M903-F941 HydrophobicContact CG-CZ 4.04Å; M903-F941 HydrophobicContact SD-CE2 4.1Å; M903-F941 HydrophobicContact SD-CZ 3.87Å; M903-L1000 HydrophobicContact CB-CD2 4.27Å; M903-V1047 HydrophobicContact CE-CG1 4.21Å; M903-V1047 HydrophobicContact SD-CB 4.44Å; M903-V1047 HydrophobicContact SD-CG1 3.82Å; M903-Y1049 HydrophobicContact CE-CD1 3.49Å; M903-Y1049 VanDerWaalsContact CE-CD1 3.49Å; M903-Y1049 HydrophobicContact CE-CE1 4.05Å; M903-Y1049 HydrophobicContact CE-CG 4.16Å; M903-L1056 HydrophobicContact CE-CD1 3.69Å; M903-L1056 HydrophobicContact CE-CD2 4.14Å; M903-L1056 HydrophobicContact CG-CD1 4.17Å; M903-L1056 HydrophobicContact CG-CD2 4.22Å; M903-V1069 HydrophobicContact CE-CB 4.1Å; M903-V1069 HydrophobicContact CE-CG2 3.74Å
904	T	86.7	Confident	86.3	Confident	78 Å²	78	51.6 Å²	51.6	48%	0.479	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	152.3	171.2	58	0	0	0	0	110.1	Y934	T904-Y934 PolarHBondContact N-O 2.82Å; T904-Y934 PolarHBondContact O-N 2.99Å
905	T	88.7	Confident	86	Confident	22 Å²	22	48.9 Å²	48.9	14%	0.135	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.4	179.4	52.4	0	0	0	0	109.4	K932 I933 V1047 V1069	T905-K932 CarbonylContact C-O 3.47Å; T905-K932 WeakPolarHBondContact CA-O 3.29Å; T905-I933 HydrophobicContact CG2-CG1 4.38Å; T905-V1047 HydrophobicContact CG2-CG2 4Å; T905-V1069 HydrophobicContact CG2-CG1 3.82Å; T905-V1069 WeakPolarHBondContact OG1-CG1 3.17Å
906	S	88.7	Confident	85.7	Confident	52 Å²	52	54.2 Å²	54.2	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	166.9	173.2	79.7	0	0	0	0	111.2	Y931 K932	S906-Y931 WeakPolarHBondContact O-CA 3.24Å; S906-K932 PolarHBondContact N-O 3.25Å; S906-K932 PolarHBondContact O-N 3.03Å
907	V	88	Confident	85.3	Confident	49 Å²	49	51.1 Å²	51.1	30%	0.297	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	152.5	157.3	-171.7	0	0	0	0	107.3	S911 Y931 Q1071 A1073	V907-S911 WeakPolarHBondContact CG1-OG 3.5Å; V907-Y931 HydrophobicContact CG2-CD1 4.48Å; V907-Y931 HydrophobicContact CG2-CE1 4.3Å; V907-Q1071 HydrophobicContact CG2-CG 4.18Å; V907-A1073 HydrophobicContact CG1-CB 4.25Å; V907-A1073 HydrophobicContact CG2-CB 3.78Å
908	N	86.4	Confident	84.8	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.203	28%	0.284	C	S	.	.			trans	-106.7	144.5	176.9	-169.8	6.4	0	0	0	110	T910 S911 V930	N908-T910 PolarHBondContact ND2-OG1 3.24Å; N908-T910 PolarHBondContact O-N 2.86Å; N908-S911 VanDerWaalsContact O-CB 3.27Å; N908-S911 WeakPolarHBondContact O-CB 3.23Å; N908-S911 PolarHBondContact O-N 3.17Å; N908-S911 PolarHBondContact O-OG 3.02Å; N908-V930 HydrophobicContact CB-CB 4.03Å; N908-V930 HydrophobicContact CB-CG1 3.95Å; N908-V930 WeakPolarHBondContact CB-O 3.39Å; N908-V930 PolarHBondContact N-O 3.04Å
909	D	77.8	Confident	83.9	Confident	162 Å²	162	53 Å²	53	87%	0.866	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.5	-173.8	-48.7	-34.7	0	0	0	113.4	S911	D909-S911 PolarHBondContact O-N 2.95Å
910	T	78.8	Confident	82.9	Confident	90 Å²	90	61.9 Å²	61.9	55%	0.552	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-0.1	170.7	54.8	0	0	0	0	114.1	N908	N908-T910 PolarHBondContact ND2-OG1 3.24Å; N908-T910 PolarHBondContact O-N 2.86Å
911	S	84.8	Confident	81.9	Confident	18 Å²	18	64.8 Å²	64.8	13%	0.126	35%	0.349	C	S	.	.	S	Bend	trans	-77.3	139.3	175.2	-56	0	0	0	0	111.2	V907 N908 D909 E913 V930	V907-S911 WeakPolarHBondContact CG1-OG 3.5Å; N908-S911 VanDerWaalsContact O-CB 3.27Å; N908-S911 WeakPolarHBondContact O-CB 3.23Å; N908-S911 PolarHBondContact O-N 3.17Å; N908-S911 PolarHBondContact O-OG 3.02Å; D909-S911 PolarHBondContact O-N 2.95Å; S911-E913 PolarHBondContact O-N 3.38Å; S911-V930 PolarHBondContact OG-N 3.15Å; S911-V930 PolarHBondContact OG-O 3.18Å
912	V	83.3	Confident	81.2	Confident	42 Å²	42	67.2 Å²	67.2	26%	0.255	36%	0.359	S	S	.	.			trans	-77.5	111.2	174.5	177.3	0	0	0	0	108.8	N914 L915 I928 V1075	V912-N914 VanDerWaalsContact CG1-O 3.29Å; V912-N914 WeakPolarHBondContact CG1-O 3.39Å; V912-L915 HydrophobicContact CG1-CD2 3.72Å; V912-L915 HydrophobicContact CG1-CG 4.05Å; V912-I928 HydrophobicContact CG2-CB 4.19Å; V912-I928 PolarHBondContact N-O 3.42Å; V912-V1075 VanDerWaalsContact O-CG1 3.28Å; V912-V1075 WeakPolarHBondContact O-CG1 3.46Å; V912-V1075 WeakPolarHBondContact O-CG2 3.48Å
913	E	82.3	Confident	80.7	Confident	140 Å²	140	70.5 Å²	70.5	65%	0.654	37%	0.372	S	S	*	.			trans	-77.4	-35.2	177.8	-61.7	-167.7	145.3	0	0	113.3	S911 V1075 T1076	S911-E913 PolarHBondContact O-N 3.38Å; E913-V1075 CarbonylContact O-C 3.55Å; E913-V1075 WeakPolarHBondContact O-CA 3.43Å; E913-T1076 PolarHBondContact O-N 2.89Å
914	N	83.9	Confident	80.5	Confident	95 Å²	95	72.8 Å²	72.8	51%	0.508	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.5	-172.2	-55.4	-62.8	0	0	0	112.2	V912 T1076	V912-N914 VanDerWaalsContact CG1-O 3.29Å; V912-N914 WeakPolarHBondContact CG1-O 3.39Å; N914-T1076 CarbonylContact C-O 3.6Å; N914-T1076 VanDerWaalsContact CA-O 3.3Å; N914-T1076 WeakPolarHBondContact CA-O 3.23Å; N914-T1076 VanDerWaalsContact OD1-CB 3.24Å; N914-T1076 WeakPolarHBondContact OD1-CB 3.29Å; N914-T1076 PolarHBondContact OD1-OG1 2.77Å
915	L	84.5	Confident	80.5	Confident	13 Å²	13	70.7 Å²	70.7	7%	0.068	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.8	175.6	-66.9	171.8	0	0	0	109.7	V912 F917 Q925 M927 V1014 V1075 T1076 V1077 E1078	V912-L915 HydrophobicContact CG1-CD2 3.72Å; V912-L915 HydrophobicContact CG1-CG 4.05Å; L915-F917 HydrophobicContact CB-CE2 4.14Å; L915-Q925 HydrophobicContact CD2-CB 4.22Å; L915-M927 HydrophobicContact CD1-CB 4.15Å; L915-M927 HydrophobicContact CD1-CG 4.37Å; L915-V1014 HydrophobicContact CD1-CB 4.29Å; L915-V1014 HydrophobicContact CD1-CG2 4.27Å; L915-V1075 HydrophobicContact CD1-CG1 4.22Å; L915-V1075 HydrophobicContact CG-CG1 4.32Å; L915-T1076 PolarHBondContact N-O 3.02Å; L915-V1077 HydrophobicContact CB-CG2 4.45Å; L915-V1077 HydrophobicContact CD1-CG2 4.33Å; L915-V1077 CarbonylContact O-C 3.57Å; L915-V1077 WeakPolarHBondContact O-CA 3.16Å; L915-E1078 PolarHBondContact O-N 3.23Å
916	E	83.8	Confident	80.4	Confident	115 Å²	115	77.6 Å²	77.6	54%	0.537	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	118.6	-176.3	-167.6	-164.9	171.3	0	0	112.2	T918 Q925	E916-T918 HydrophobicContact CG-CG2 3.83Å; E916-T918 WeakPolarHBondContact OE1-CG2 3.49Å; E916-Q925 PolarHBondContact O-NE2 3.33Å
917	F	82.3	Confident	80.4	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	97.9	178.5	-74.7	-97.9	0	0	0	111.6	L915 Y922 K923 Q925 F957 V1014 V1077 E1078 F1079 K1080	L915-F917 HydrophobicContact CB-CE2 4.14Å; F917-Y922 HydrophobicContact CB-CD1 4.29Å; F917-K923 WeakPolarHBondContact CE1-O 3.01Å; F917-Q925 HydrophobicContact CE1-CG 3.83Å; F917-Q925 HydrophobicContact CE2-CB 4.4Å; F917-Q925 HydrophobicContact CE2-CG 4.14Å; F917-Q925 HydrophobicContact CZ-CB 3.85Å; F917-Q925 HydrophobicContact CZ-CG 3.57Å; F917-F957 HydrophobicContact CB-CZ 4.35Å; F917-F957 HydrophobicContact CD1-CE1 4.09Å; F917-F957 AromaticContact CD2-CE1 3.83Å; F917-F957 HydrophobicContact CD2-CE1 3.83Å; F917-F957 HydrophobicContact CD2-CZ 4.19Å; F917-F957 HydrophobicContact CE1-CE1 4.19Å; F917-F957 AromaticContact CE2-CE1 3.93Å; F917-F957 HydrophobicContact CE2-CE1 3.93Å; F917-F957 AromaticContact CG-CE1 3.91Å; F917-F957 HydrophobicContact CG-CE1 3.91Å; F917-F957 HydrophobicContact CG-CZ 4.14Å; F917-F957 HydrophobicContact CZ-CE1 4.1Å; F917-V1014 HydrophobicContact CE2-CG1 4.28Å; F917-V1014 HydrophobicContact CZ-CG1 4.14Å; F917-V1014 WeakPolarHBondContact CZ-O 3.09Å; F917-V1077 HydrophobicContact CD2-CG1 3.57Å; F917-V1077 HydrophobicContact CE2-CG1 3.64Å; F917-E1078 PolarHBondContact N-O 3.23Å; F917-F1079 HydrophobicContact CB-CB 3.99Å; F917-F1079 WeakPolarHBondContact O-CA 3.35Å; F917-K1080 PolarHBondContact O-N 3.44Å
918	T	77.9	Confident	80.5	Confident	33 Å²	33	75.5 Å²	75.5	20%	0.202	39%	0.388	C	S	.	.			trans	-96.6	161.8	-175.7	69.2	0	0	0	0	113.1	E916 E920 N921 Y922	E916-T918 HydrophobicContact CG-CG2 3.83Å; E916-T918 WeakPolarHBondContact OE1-CG2 3.49Å; T918-E920 PolarHBondContact O-N 3.5Å; T918-N921 CarbonylContact O-C 3.49Å; T918-N921 PolarHBondContact O-N 3.09Å; T918-N921 PolarHBondContact OG1-N 3.44Å; T918-Y922 WeakPolarHBondContact O-CD1 3.18Å; T918-Y922 WeakPolarHBondContact O-CE1 3.21Å; T918-Y922 PolarHBondContact O-N 3.32Å
919	P	69.2	Low	80.7	Confident	59 Å²	59	73.8 Å²	73.8	38%	0.383	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19	175.9	-25.7	35.1	0	0	0	115.8	Y922 K1080 P1082	P919-Y922 WeakPolarHBondContact CA-OH 3.47Å; P919-K1080 WeakPolarHBondContact CD-O 3.4Å; P919-K1080 WeakPolarHBondContact CG-O 3.49Å; P919-P1082 HydrophobicContact CB-CB 4.27Å; P919-P1082 HydrophobicContact CB-CG 4.17Å; P919-P1082 HydrophobicContact CG-CB 4.21Å; P919-P1082 HydrophobicContact CG-CG 4.41Å
920	E	64.4	Low	81.3	Confident	188 Å²	188	66.5 Å²	66.5	88%	0.879	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-14.2	-179.8	-65.4	171.4	-166.2	0	0	111.9	T918	T918-E920 PolarHBondContact O-N 3.5Å
921	N	65.7	Low	82	Confident	68 Å²	68	62.3 Å²	62.3	36%	0.364	31%	0.314	S	S	.	.			trans	-148.9	62.7	-173.9	-167.3	31.7	0	0	0	114.5	T918 K923	T918-N921 CarbonylContact O-C 3.49Å; T918-N921 PolarHBondContact O-N 3.09Å; T918-N921 PolarHBondContact OG1-N 3.44Å; N921-K923 PolarHBondContact O-N 3.14Å; N921-K923 VanDerWaalsContact O-N 3.09Å; N921-K923 WeakPolarHBondContact OD1-CB 3.32Å; N921-K923 WeakPolarHBondContact OD1-CG 2.95Å
922	Y	73.4	Confident	82.2	Confident	52 Å²	52	64.6 Å²	64.6	20%	0.204	32%	0.322	C	S	.	.			trans	-73.2	16.2	166.2	-61.2	-57.5	0	0	0	114.6	F917 T918 P919 L1019 K1080 V1081 P1082	F917-Y922 HydrophobicContact CB-CD1 4.29Å; T918-Y922 WeakPolarHBondContact O-CD1 3.18Å; T918-Y922 WeakPolarHBondContact O-CE1 3.21Å; T918-Y922 PolarHBondContact O-N 3.32Å; P919-Y922 WeakPolarHBondContact CA-OH 3.47Å; Y922-L1019 HydrophobicContact CD1-CD2 4.47Å; Y922-L1019 HydrophobicContact CD2-CD2 3.34Å; Y922-L1019 HydrophobicContact CE2-CD2 3.61Å; Y922-L1019 HydrophobicContact CG-CD2 3.83Å; Y922-K1080 PolarHBondContact OH-O 3.25Å; Y922-V1081 WeakPolarHBondContact OH-CA 3.42Å; Y922-P1082 WeakPolarHBondContact OH-CD 3.33Å
923	K	76.9	Confident	82.7	Confident	155 Å²	155	62.6 Å²	62.6	67%	0.674	31%	0.31	S	S	*	.	S	Bend	trans	-70.9	149.3	-178.5	-62.3	178.8	-176.2	170.2	0	110.1	F917 N921 Q925	F917-K923 WeakPolarHBondContact CE1-O 3.01Å; N921-K923 PolarHBondContact O-N 3.14Å; N921-K923 VanDerWaalsContact O-N 3.09Å; N921-K923 WeakPolarHBondContact OD1-CB 3.32Å; N921-K923 WeakPolarHBondContact OD1-CG 2.95Å; K923-Q925 VanDerWaalsContact O-CG 3.32Å; K923-Q925 WeakPolarHBondContact O-CG 3.35Å; K923-Q925 PolarHBondContact O-N 3.48Å
924	A	83.8	Confident	83	Confident	59 Å²	59	59.5 Å²	59.5	49%	0.488	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-58.3	123	-178.9	0	0	0	0	0	111.7	V1013 V1014 H1015	A924-V1013 HydrophobicContact CB-CG1 3.56Å; A924-V1014 WeakPolarHBondContact CA-O 3.2Å; A924-H1015 HydrophobicContact CB-CB 3.64Å
925	Q	85.3	Confident	83.2	Confident	35 Å²	35	55 Å²	55	16%	0.164	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	145.5	-173.8	-58.3	-168.8	15.7	0	0	111.2	L915 E916 F917 K923 V1013 V1014	L915-Q925 HydrophobicContact CD2-CB 4.22Å; E916-Q925 PolarHBondContact O-NE2 3.33Å; F917-Q925 HydrophobicContact CE1-CG 3.83Å; F917-Q925 HydrophobicContact CE2-CB 4.4Å; F917-Q925 HydrophobicContact CE2-CG 4.14Å; F917-Q925 HydrophobicContact CZ-CB 3.85Å; F917-Q925 HydrophobicContact CZ-CG 3.57Å; K923-Q925 VanDerWaalsContact O-CG 3.32Å; K923-Q925 WeakPolarHBondContact O-CG 3.35Å; K923-Q925 PolarHBondContact O-N 3.48Å; Q925-V1013 CarbonylContact O-C 3.19Å; Q925-V1013 WeakPolarHBondContact O-CA 3.33Å; Q925-V1014 PolarHBondContact N-O 3.14Å; Q925-V1014 PolarHBondContact O-N 3.06Å
926	K	87.6	Confident	83.2	Confident	166 Å²	166	56 Å²	56	72%	0.722	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.4	176.8	-69.3	178.6	-178.7	176	0	109.7
927	M	88.5	Confident	83	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.1	-179.7	176.5	-87.9	164.3	0	0	108.6	L915 T929 I959 L1010 G1012 V1014 F1041 V1075	L915-M927 HydrophobicContact CD1-CB 4.15Å; L915-M927 HydrophobicContact CD1-CG 4.37Å; M927-T929 WeakPolarHBondContact CE-OG1 3.3Å; M927-I959 HydrophobicContact SD-CD1 3.95Å; M927-L1010 HydrophobicContact CE-CD2 4.3Å; M927-L1010 HydrophobicContact SD-CD2 4.44Å; M927-G1012 PolarHBondContact N-O 3.05Å; M927-G1012 PolarHBondContact O-N 2.93Å; M927-V1014 HydrophobicContact CB-CG2 3.77Å; M927-V1014 HydrophobicContact CG-CG2 4.1Å; M927-F1041 HydrophobicContact CE-CD1 3.55Å; M927-F1041 HydrophobicContact CE-CE1 3.33Å; M927-F1041 HydrophobicContact CE-CZ 4.18Å; M927-F1041 HydrophobicContact SD-CE1 4.15Å; M927-F1041 HydrophobicContact SD-CZ 4.47Å; M927-V1075 HydrophobicContact CE-CB 4.36Å; M927-V1075 HydrophobicContact CE-CG2 3.6Å
928	I	89.7	Confident	82.9	Confident	57 Å²	57	52.1 Å²	52.1	29%	0.292	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.3	-175.3	-54.1	-171	0	0	0	108.7	V912 V930 L1010 L1011	V912-I928 HydrophobicContact CG2-CB 4.19Å; V912-I928 PolarHBondContact N-O 3.42Å; I928-V930 HydrophobicContact CG2-CG2 3.89Å; I928-L1010 WeakPolarHBondContact CA-O 3.3Å; I928-L1011 HydrophobicContact CB-CD2 4.08Å; I928-L1011 HydrophobicContact CD1-CD2 3.82Å; I928-L1011 HydrophobicContact CG1-CD2 3.6Å; I928-L1011 HydrophobicContact CG2-CD2 3.74Å
929	T	89.9	Confident	83.1	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	124.3	166.8	-62.5	0	0	0	0	108.8	M927 Y931 L1010 A1073	M927-T929 WeakPolarHBondContact CE-OG1 3.3Å; T929-Y931 HydrophobicContact CG2-CD2 4.06Å; T929-Y931 HydrophobicContact CG2-CE2 3.51Å; T929-L1010 PolarHBondContact N-O 2.68Å; T929-L1010 PolarHBondContact O-N 2.93Å; T929-A1073 HydrophobicContact CG2-CB 3.54Å
930	V	91.1	Very high	84	Confident	10 Å²	10	51 Å²	51	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.2	-178.8	-177.7	0	0	0	0	108.8	N908 S911 I928 Y1007	N908-V930 HydrophobicContact CB-CB 4.03Å; N908-V930 HydrophobicContact CB-CG1 3.95Å; N908-V930 WeakPolarHBondContact CB-O 3.39Å; N908-V930 PolarHBondContact N-O 3.04Å; S911-V930 PolarHBondContact OG-N 3.15Å; S911-V930 PolarHBondContact OG-O 3.18Å; I928-V930 HydrophobicContact CG2-CG2 3.89Å; V930-Y1007 HydrophobicContact CG1-CD1 4.06Å
931	Y	92.8	Very high	85.2	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.4	171.5	-67	-87.4	0	0	0	109.8	S906 V907 T929 L947 Y1007 V1008 S1043 I1045 Q1071 A1073	S906-Y931 WeakPolarHBondContact O-CA 3.24Å; V907-Y931 HydrophobicContact CG2-CD1 4.48Å; V907-Y931 HydrophobicContact CG2-CE1 4.3Å; T929-Y931 HydrophobicContact CG2-CD2 4.06Å; T929-Y931 HydrophobicContact CG2-CE2 3.51Å; Y931-L947 HydrophobicContact CD2-CD1 3.99Å; Y931-L947 HydrophobicContact CE2-CD1 3.76Å; Y931-Y1007 CarbonylContact O-C 3.6Å; Y931-Y1007 WeakPolarHBondContact O-CA 3.43Å; Y931-V1008 PolarHBondContact N-O 3.26Å; Y931-V1008 PolarHBondContact O-N 3.16Å; Y931-S1043 PolarHBondContact OH-O 2.89Å; Y931-S1043 PolarHBondContact OH-OG 2.66Å; Y931-I1045 HydrophobicContact CD1-CB 3.92Å; Y931-I1045 HydrophobicContact CD1-CG2 3.33Å; Y931-I1045 HydrophobicContact CD2-CB 4.21Å; Y931-I1045 HydrophobicContact CD2-CD1 4.29Å; Y931-I1045 HydrophobicContact CD2-CG2 4.49Å; Y931-I1045 HydrophobicContact CE1-CB 4.06Å; Y931-I1045 HydrophobicContact CE1-CG2 3.65Å; Y931-I1045 HydrophobicContact CE2-CB 4.38Å; Y931-I1045 HydrophobicContact CG-CB 3.97Å; Y931-I1045 HydrophobicContact CG-CD1 3.94Å; Y931-I1045 HydrophobicContact CG-CG2 3.79Å; Y931-Q1071 HydrophobicContact CD1-CB 4.41Å; Y931-Q1071 HydrophobicContact CD1-CG 4.13Å; Y931-Q1071 HydrophobicContact CE1-CB 4.44Å; Y931-Q1071 HydrophobicContact CE1-CG 4.13Å; Y931-A1073 HydrophobicContact CE1-CB 4.16Å; Y931-A1073 WeakPolarHBondContact OH-CB 3.47Å; Y931-A1073 PolarHBondContact OH-N 2.83Å
932	K	90.9	Very high	86.4	Confident	66 Å²	66	40.7 Å²	40.7	29%	0.287	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.3	175.3	-178	178.7	-175.7	176.6	0	109.1	T905 S906 N1005 Y1007	T905-K932 CarbonylContact C-O 3.47Å; T905-K932 WeakPolarHBondContact CA-O 3.29Å; S906-K932 PolarHBondContact N-O 3.25Å; S906-K932 PolarHBondContact O-N 3.03Å; K932-N1005 WeakPolarHBondContact CE-OD1 3.32Å; K932-Y1007 HydrophobicContact CB-CD1 4.16Å; K932-Y1007 HydrophobicContact CB-CE1 4.03Å; K932-Y1007 HydrophobicContact CD-CE1 3.97Å; K932-Y1007 HydrophobicContact CG-CD1 4.23Å; K932-Y1007 HydrophobicContact CG-CE1 3.71Å
933	I	92.4	Very high	87.2	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.7	172.4	-52	170.7	0	0	0	106.8	T905 I943 V945 L1000 N1005 V1006 V1008 I1045 V1047	T905-I933 HydrophobicContact CG2-CG1 4.38Å; I933-I943 HydrophobicContact CD1-CD1 4.28Å; I933-I943 HydrophobicContact CG2-CD1 4.26Å; I933-V945 HydrophobicContact CD1-CG2 3.93Å; I933-L1000 HydrophobicContact CG2-CD1 4.06Å; I933-L1000 HydrophobicContact CG2-CD2 4.02Å; I933-N1005 CarbonylContact O-C 3.05Å; I933-N1005 WeakPolarHBondContact O-CA 3.29Å; I933-V1006 PolarHBondContact N-O 3.31Å; I933-V1006 PolarHBondContact O-N 3.17Å; I933-V1008 HydrophobicContact CD1-CG2 3.9Å; I933-I1045 HydrophobicContact CD1-CD1 4.2Å; I933-V1047 HydrophobicContact CD1-CG2 3.66Å; I933-V1047 HydrophobicContact CG1-CG2 4.12Å
934	Y	88.9	Confident	87.8	Confident	74 Å²	74	32.1 Å²	32.1	29%	0.29	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.7	-179	175.2	-111.7	0	0	0	111	M903 T904 A936 Y1003 S1004 N1005	M903-Y934 CarbonylContact C-O 3.54Å; M903-Y934 WeakPolarHBondContact CA-O 3.4Å; T904-Y934 PolarHBondContact N-O 2.82Å; T904-Y934 PolarHBondContact O-N 2.99Å; Y934-A936 HydrophobicContact CD1-CB 4.11Å; Y934-A936 HydrophobicContact CE1-CB 3.68Å; Y934-Y1003 WeakPolarHBondContact CE2-O 3.49Å; Y934-S1004 WeakPolarHBondContact CA-O 3.45Å; Y934-S1004 VanDerWaalsContact CD2-O 3.25Å; Y934-S1004 WeakPolarHBondContact CD2-O 3.38Å; Y934-N1005 VanDerWaalsContact CD2-OD1 3.29Å; Y934-N1005 WeakPolarHBondContact CD2-OD1 3.22Å
935	N	89.1	Confident	88.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	100.2	172.2	-169.1	-3.3	0	0	0	109.7	E902 G937 K939 L1000 K1001 Y1003 S1004	E902-N935 CarbonylContact O-C 3.16Å; E902-N935 WeakPolarHBondContact O-CA 3.21Å; E902-N935 PolarHBondContact O-OD1 3.11Å; N935-G937 VanDerWaalsContact OD1-CA 3.31Å; N935-G937 WeakPolarHBondContact OD1-CA 3.31Å; N935-G937 PolarHBondContact OD1-N 2.78Å; N935-G937 PolarHBondContact OD1-O 2.67Å; N935-K939 PolarHBondContact ND2-O 3.48Å; N935-L1000 HydrophobicContact CB-CD2 3.79Å; N935-L1000 HydrophobicContact CB-CG 3.89Å; N935-L1000 PolarHBondContact ND2-O 2.87Å; N935-L1000 VanDerWaalsContact ND2-O 3.13Å; N935-K1001 VanDerWaalsContact CB-O 3.26Å; N935-K1001 WeakPolarHBondContact CB-O 3.04Å; N935-K1001 PolarHBondContact ND2-O 3.29Å; N935-Y1003 WeakPolarHBondContact O-CA 3.37Å; N935-Y1003 PolarHBondContact O-N 3.17Å; N935-S1004 PolarHBondContact N-O 3.24Å; N935-S1004 VanDerWaalsContact N-O 3.12Å
936	A	83.3	Confident	88.4	Confident	34 Å²	34	28 Å²	28	28%	0.281	14%	0.14	S	C	.	.			trans	-76.4	-13.9	171.3	0	0	0	0	0	111.9	E902 Y934	E902-A936 HydrophobicContact CB-CB 4.44Å; E902-A936 HydrophobicContact CG-CB 4.08Å; E902-A936 PolarHBondContact O-N 3.49Å; Y934-A936 HydrophobicContact CD1-CB 4.11Å; Y934-A936 HydrophobicContact CE1-CB 3.68Å
937	G	80.2	Confident	88.5	Confident	5 Å²	5	20.2 Å²	20.2	5%	0.052	11%	0.106	C	C	.	.	S	Bend	trans	-73.3	153.3	-179.4	0	0	0	0	0	113	E902 N935 K939 N1002	E902-G937 PolarHBondContact O-N 3.37Å; N935-G937 VanDerWaalsContact OD1-CA 3.31Å; N935-G937 WeakPolarHBondContact OD1-CA 3.31Å; N935-G937 PolarHBondContact OD1-N 2.78Å; N935-G937 PolarHBondContact OD1-O 2.67Å; G937-K939 PolarHBondContact O-N 3.3Å; G937-N1002 WeakPolarHBondContact O-CB 3.15Å
938	F	79.4	Confident	88.5	Confident	30 Å²	30	20.6 Å²	20.6	13%	0.132	11%	0.108	C	C	.	.	S	Bend	trans	-69.3	-10.6	176.2	70.5	-80.2	0	0	0	113.9	V782 K784 S900 N1002	V782-F938 HydrophobicContact CG1-CE2 4.46Å; V782-F938 HydrophobicContact CG1-CZ 4.29Å; K784-F938 HydrophobicContact CB-CD1 4.29Å; K784-F938 HydrophobicContact CB-CG 4.49Å; S900-F938 VanDerWaalsContact O-CE1 3.26Å; S900-F938 WeakPolarHBondContact O-CE1 3.41Å; F938-N1002 WeakPolarHBondContact O-CB 3.36Å; F938-N1002 PolarHBondContact O-ND2 3.23Å
939	K	83.5	Confident	88.4	Confident	18 Å²	18	17.9 Å²	17.9	8%	0.078	9%	0.094	C	C	.	.	S	Bend	trans	-123.8	134.3	-165.1	-162.7	63.8	175.4	177.4	0	113	D865 E867 Y899 V901 N935 G937	D865-K939 IonicContact OD1-NZ 3.68Å; D865-K939 PolarHBondContact OD1-NZ 2.87Å; E867-K939 WeakPolarHBondContact OE1-CE 3.43Å; E867-K939 IonicContact OE1-NZ 3.55Å; E867-K939 PolarHBondContact OE1-NZ 3.17Å; Y899-K939 HydrophobicContact CD1-CD 4.2Å; Y899-K939 HydrophobicContact CD1-CG 4.03Å; Y899-K939 HydrophobicContact CE1-CD 4.47Å; Y899-K939 HydrophobicContact CG-CG 4.48Å; V901-K939 HydrophobicContact CG1-CB 4.42Å; N935-K939 PolarHBondContact ND2-O 3.48Å; G937-K939 PolarHBondContact O-N 3.3Å
940	D	88.3	Confident	88	Confident	51 Å²	51	19.5 Å²	19.5	27%	0.273	10%	0.101	S	C	.	.			trans	-68.4	137.4	170.1	-73.8	34.4	0	0	0	111.1	M999 K1001 N1002	D940-M999 HydrophobicContact CB-CE 3.91Å; D940-K1001 WeakPolarHBondContact OD2-CA 3.46Å; D940-N1002 PolarHBondContact OD1-N 3.19Å
941	F	88.8	Confident	87.5	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	149.8	174.6	65.8	-78.2	0	0	0	113.3	V901 M903 I943 L1000 Y1054	V901-F941 HydrophobicContact CB-CD1 3.82Å; V901-F941 HydrophobicContact CB-CE1 3.71Å; V901-F941 HydrophobicContact CB-CG 4.36Å; V901-F941 HydrophobicContact CB-CZ 4.16Å; V901-F941 HydrophobicContact CG1-CB 4.27Å; V901-F941 HydrophobicContact CG1-CD1 3.65Å; V901-F941 HydrophobicContact CG1-CE1 4.1Å; V901-F941 HydrophobicContact CG1-CG 4Å; V901-F941 HydrophobicContact CG2-CD1 4.34Å; V901-F941 HydrophobicContact CG2-CD2 4.46Å; V901-F941 HydrophobicContact CG2-CE1 4.13Å; V901-F941 HydrophobicContact CG2-CE2 4.24Å; V901-F941 HydrophobicContact CG2-CZ 4.07Å; M903-F941 HydrophobicContact CB-CZ 4.09Å; M903-F941 HydrophobicContact CE-CE2 4.41Å; M903-F941 HydrophobicContact CG-CZ 4.04Å; M903-F941 HydrophobicContact SD-CE2 4.1Å; M903-F941 HydrophobicContact SD-CZ 3.87Å; F941-I943 HydrophobicContact CD2-CG2 3.68Å; F941-I943 HydrophobicContact CE2-CG2 3.38Å; F941-I943 HydrophobicContact CZ-CG2 4.23Å; F941-L1000 HydrophobicContact CE1-CD2 4.04Å; F941-L1000 HydrophobicContact CZ-CD2 3.95Å; F941-L1000 PolarHBondContact N-O 2.65Å; F941-L1000 PolarHBondContact O-N 2.83Å; F941-Y1054 HydrophobicContact CB-CD1 3.69Å; F941-Y1054 HydrophobicContact CB-CD2 4.28Å; F941-Y1054 HydrophobicContact CB-CE1 3.46Å; F941-Y1054 VanDerWaalsContact CB-CE1 3.46Å; F941-Y1054 HydrophobicContact CB-CE2 4.1Å; F941-Y1054 HydrophobicContact CB-CG 4.09Å; F941-Y1054 HydrophobicContact CG-CD1 4.47Å
942	P	90.2	Very high	87	Confident	38 Å²	38	25.2 Å²	25.2	25%	0.247	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.3	176.4	28.5	-33	0	0	0	111.4	T997 F998 M999 Y1054	P942-T997 HydrophobicContact CB-CG2 3.72Å; P942-F998 WeakPolarHBondContact CA-O 3.47Å; P942-M999 HydrophobicContact CB-SD 3.8Å; P942-M999 HydrophobicContact CG-SD 4.29Å; P942-Y1054 WeakPolarHBondContact CD-OH 3.45Å; P942-Y1054 HydrophobicContact CG-CE2 4.12Å
943	I	90.8	Very high	86.3	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.7	170.4	61.4	168	0	0	0	110.5	I933 F941 V945 T997 F998 L1000 V1047 H1048	I933-I943 HydrophobicContact CD1-CD1 4.28Å; I933-I943 HydrophobicContact CG2-CD1 4.26Å; F941-I943 HydrophobicContact CD2-CG2 3.68Å; F941-I943 HydrophobicContact CE2-CG2 3.38Å; F941-I943 HydrophobicContact CZ-CG2 4.23Å; I943-V945 HydrophobicContact CD1-CG2 4.47Å; I943-T997 CarbonylContact O-C 3.29Å; I943-T997 VanDerWaalsContact O-CA 3.28Å; I943-T997 WeakPolarHBondContact O-CA 3.39Å; I943-T997 WeakPolarHBondContact O-CG2 3.25Å; I943-F998 HydrophobicContact CD1-CD2 4.46Å; I943-F998 HydrophobicContact CD1-CE2 3.58Å; I943-F998 HydrophobicContact CD1-CZ 3.73Å; I943-F998 HydrophobicContact CG1-CD2 4.07Å; I943-F998 HydrophobicContact CG1-CE2 3.65Å; I943-F998 HydrophobicContact CG1-CZ 3.92Å; I943-F998 PolarHBondContact N-O 2.86Å; I943-F998 PolarHBondContact O-N 3.5Å; I943-L1000 HydrophobicContact CD1-CB 4Å; I943-L1000 HydrophobicContact CD1-CD1 4.2Å; I943-L1000 HydrophobicContact CD1-CD2 4.2Å; I943-L1000 HydrophobicContact CD1-CG 4.35Å; I943-L1000 HydrophobicContact CG1-CB 4.08Å; I943-L1000 HydrophobicContact CG2-CB 4.5Å; I943-V1047 HydrophobicContact CB-CG1 3.86Å; I943-V1047 HydrophobicContact CD1-CG1 3.66Å; I943-V1047 HydrophobicContact CG1-CG1 4.34Å; I943-V1047 HydrophobicContact CG2-CG1 3.96Å; I943-H1048 VanDerWaalsContact CA-O 3.28Å; I943-H1048 WeakPolarHBondContact CA-O 3.44Å
944	N	90.3	Very high	85.5	Confident	27 Å²	27	29.6 Å²	29.6	14%	0.144	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	153	160.3	63.2	92.2	0	0	0	110.2	K994 H1048	N944-K994 WeakPolarHBondContact OD1-CE 3.33Å; N944-H1048 PolarHBondContact N-O 2.84Å; N944-H1048 PolarHBondContact O-N 3.32Å
945	V	90.8	Very high	84.8	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.8	-170.1	176.3	0	0	0	0	109.9	I933 I943 C995 F998 V1008 I1045	I933-V945 HydrophobicContact CD1-CG2 3.93Å; I943-V945 HydrophobicContact CD1-CG2 4.47Å; V945-C995 HydrophobicContact CB-CB 4.4Å; V945-C995 PolarHBondContact O-N 3.2Å; V945-F998 HydrophobicContact CG2-CE1 3.85Å; V945-F998 HydrophobicContact CG2-CZ 3.79Å; V945-V1008 HydrophobicContact CG1-CG1 4.27Å; V945-V1008 HydrophobicContact CG1-CG2 4.41Å; V945-I1045 HydrophobicContact CG1-CD1 3.65Å; V945-I1045 HydrophobicContact CG1-CG1 3.6Å
946	S	89.3	Confident	84.3	Confident	6 Å²	6	32.6 Å²	32.6	4%	0.042	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.2	172.2	-56.5	0	0	0	0	109.1	I993 K1046 H1048	S946-I993 CarbonylContact C-O 3.59Å; S946-I993 WeakPolarHBondContact CA-O 3.24Å; S946-K1046 PolarHBondContact N-O 3.06Å; S946-K1046 PolarHBondContact O-N 3.46Å; S946-H1048 WeakPolarHBondContact CB-NE2 3.28Å; S946-H1048 PolarHBondContact OG-CD2 2.98Å; S946-H1048 PolarHBondContact OG-NE2 3.16Å
947	L	89.9	Confident	84.3	Confident	2 Å²	2	31 Å²	31	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.8	-179.8	-164.6	92.8	0	0	0	110.2	Y931 F949 V964 A992 I993 L1010 I1045	Y931-L947 HydrophobicContact CD2-CD1 3.99Å; Y931-L947 HydrophobicContact CE2-CD1 3.76Å; L947-F949 HydrophobicContact CD2-CD1 4.04Å; L947-F949 HydrophobicContact CD2-CE1 4.2Å; L947-V964 HydrophobicContact CD2-CG2 3.69Å; L947-A992 CarbonylContact O-C 3.58Å; L947-A992 WeakPolarHBondContact O-CA 3.29Å; L947-I993 PolarHBondContact N-O 3.18Å; L947-I993 PolarHBondContact O-N 3.1Å; L947-L1010 HydrophobicContact CD2-CB 3.91Å; L947-L1010 HydrophobicContact CD2-CD1 3.86Å; L947-L1010 HydrophobicContact CD2-CD2 4.08Å; L947-L1010 HydrophobicContact CD2-CG 4.15Å; L947-I1045 HydrophobicContact CD1-CB 3.91Å; L947-I1045 HydrophobicContact CD1-CD1 4.43Å; L947-I1045 HydrophobicContact CD1-CG1 4.08Å
948	F	88.1	Confident	84.6	Confident	10 Å²	10	31.5 Å²	31.5	4%	0.044	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.4	-176.4	-56.1	-92.5	0	0	0	110.4	A981 C984 V991 A992 S1043 T1044 K1046	F948-A981 HydrophobicContact CE1-CB 4.23Å; F948-C984 HydrophobicContact CD1-CB 4.16Å; F948-V991 VanDerWaalsContact CA-O 3.32Å; F948-V991 WeakPolarHBondContact CA-O 3.49Å; F948-A992 HydrophobicContact CD1-CB 3.73Å; F948-A992 HydrophobicContact CE1-CB 3.67Å; F948-S1043 CarbonylContact O-C 3.4Å; F948-S1043 WeakPolarHBondContact O-CA 3.33Å; F948-T1044 PolarHBondContact N-O 3.48Å; F948-T1044 PolarHBondContact O-N 2.72Å; F948-K1046 HydrophobicContact CD2-CD 4.43Å; F948-K1046 HydrophobicContact CD2-CG 4.24Å; F948-K1046 HydrophobicContact CE2-CB 4.2Å; F948-K1046 HydrophobicContact CE2-CD 3.8Å; F948-K1046 HydrophobicContact CE2-CG 3.85Å
949	F	87.6	Confident	84.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	175.7	175.3	60.7	-85.5	0	0	0	111.5	L947 I959 Y962 C990 V991 I993 L1010 F1041 N1042	L947-F949 HydrophobicContact CD2-CD1 4.04Å; L947-F949 HydrophobicContact CD2-CE1 4.2Å; F949-I959 HydrophobicContact CD2-CG2 4.27Å; F949-I959 HydrophobicContact CE2-CG2 4.09Å; F949-Y962 AromaticContact CE2-CD1 3.96Å; F949-Y962 HydrophobicContact CE2-CD1 3.96Å; F949-Y962 HydrophobicContact CE2-CD2 4.42Å; F949-Y962 HydrophobicContact CE2-CE1 4.13Å; F949-Y962 HydrophobicContact CE2-CG 4.12Å; F949-Y962 HydrophobicContact CZ-CD1 4.04Å; F949-Y962 AromaticContact CZ-CD2 3.68Å; F949-Y962 HydrophobicContact CZ-CD2 3.68Å; F949-Y962 HydrophobicContact CZ-CE1 4.15Å; F949-Y962 AromaticContact CZ-CE2 3.82Å; F949-Y962 HydrophobicContact CZ-CE2 3.82Å; F949-Y962 AromaticContact CZ-CG 3.82Å; F949-Y962 HydrophobicContact CZ-CG 3.82Å; F949-C990 CarbonylContact O-C 3.54Å; F949-C990 WeakPolarHBondContact O-CA 3.31Å; F949-V991 HydrophobicContact CD2-CB 4.35Å; F949-V991 HydrophobicContact CE1-CB 4.18Å; F949-V991 HydrophobicContact CE1-CG1 3.75Å; F949-V991 HydrophobicContact CE2-CB 3.99Å; F949-V991 HydrophobicContact CE2-CG1 4.11Å; F949-V991 HydrophobicContact CE2-CG2 4.4Å; F949-V991 HydrophobicContact CZ-CB 3.9Å; F949-V991 HydrophobicContact CZ-CG1 3.52Å; F949-V991 PolarHBondContact N-O 3Å; F949-V991 PolarHBondContact O-N 2.83Å; F949-I993 HydrophobicContact CE1-CD1 3.72Å; F949-I993 HydrophobicContact CE1-CG1 4.2Å; F949-I993 HydrophobicContact CZ-CD1 4.03Å; F949-L1010 HydrophobicContact CD1-CD1 4.44Å; F949-L1010 HydrophobicContact CD1-CD2 4.22Å; F949-L1010 HydrophobicContact CE1-CD1 4.03Å; F949-L1010 HydrophobicContact CG-CD2 4.34Å; F949-L1010 HydrophobicContact CZ-CD1 4.28Å; F949-F1041 HydrophobicContact CB-CE1 4.3Å; F949-F1041 HydrophobicContact CB-CE2 4.1Å; F949-F1041 HydrophobicContact CB-CZ 3.56Å; F949-F1041 AromaticContact CD2-CE2 3.9Å; F949-F1041 HydrophobicContact CD2-CE2 3.9Å; F949-F1041 AromaticContact CD2-CZ 3.78Å; F949-F1041 HydrophobicContact CD2-CZ 3.78Å; F949-F1041 HydrophobicContact CG-CE2 4.38Å; F949-F1041 AromaticContact CG-CZ 3.89Å; F949-F1041 HydrophobicContact CG-CZ 3.89Å; F949-N1042 WeakPolarHBondContact CA-O 3.25Å
950	Q	83.3	Confident	84.9	Confident	34 Å²	34	33.7 Å²	33.7	16%	0.159	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.5	-179	-60.4	176.1	-93	0	0	111.4	L953 I959 W986 F1041	Q950-L953 HydrophobicContact CB-CD2 3.98Å; Q950-I959 WeakPolarHBondContact O-CG2 3.42Å; Q950-W986 HydrophobicContact CG-CB 4.31Å; Q950-W986 HydrophobicContact CG-CD2 3.87Å; Q950-W986 HydrophobicContact CG-CE3 3.8Å; Q950-W986 HydrophobicContact CG-CG 4.06Å; Q950-F1041 WeakPolarHBondContact O-CE2 3.45Å
951	E	80.6	Confident	84.8	Confident	64 Å²	64	38 Å²	38	30%	0.299	19%	0.188	S	C	.	.	S	Bend	trans	-81.3	-30.8	179.9	-161.5	157.2	-161.7	0	0	112.5	E958 I959 Y962 K975 N989 V991	E951-E958 WeakPolarHBondContact O-CA 3.48Å; E951-I959 PolarHBondContact O-N 2.75Å; E951-Y962 HydrophobicContact CG-CE1 4.38Å; E951-K975 VanDerWaalsContact CD-NZ 3.26Å; E951-K975 IonicContact OE1-NZ 2.66Å; E951-K975 PolarHBondContact OE1-NZ 2.97Å; E951-K975 IonicContact OE2-NZ 3.73Å; E951-K975 PolarHBondContact OE2-NZ 2.71Å; E951-N989 PolarHBondContact N-O 3.14Å; E951-V991 HydrophobicContact CB-CG2 3.72Å; E951-V991 HydrophobicContact CG-CG2 4.16Å; E951-V991 WeakPolarHBondContact OE2-CG2 3.44Å
952	Q	80.5	Confident	84.7	Confident	68 Å²	68	40.4 Å²	40.4	32%	0.318	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-123	138.8	174	-66.5	171.5	32	0	0	108.6	E958 N989	Q952-E958 HydrophobicContact CG-CB 4.43Å; Q952-N989 HydrophobicContact CB-CB 4.24Å; Q952-N989 PolarHBondContact OE1-ND2 2.72Å
953	L	76.3	Confident	84.6	Confident	22 Å²	22	45.8 Å²	45.8	12%	0.115	21%	0.213	C	C	.	.			trans	-114.9	178.7	-178	-59	173.7	0	0	0	110.4	Q950 F957 V1039 F1041	Q950-L953 HydrophobicContact CB-CD2 3.98Å; L953-F957 HydrophobicContact CB-CB 4.05Å; L953-F957 HydrophobicContact CD1-CB 4.2Å; L953-F957 PolarHBondContact N-O 2.93Å; L953-V1039 HydrophobicContact CB-CG1 3.73Å; L953-V1039 HydrophobicContact CD1-CG1 4.17Å; L953-V1039 HydrophobicContact CG-CG1 4.47Å; L953-F1041 HydrophobicContact CD1-CB 4.04Å; L953-F1041 HydrophobicContact CD1-CD2 4.14Å; L953-F1041 HydrophobicContact CD2-CB 4.35Å; L953-F1041 HydrophobicContact CD2-CD2 4.06Å
954	E	76.7	Confident	84.5	Confident	136 Å²	136	46.8 Å²	46.8	64%	0.636	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-64.5	160.9	170.3	-59.7	-174.3	-179.8	0	0	111.7	D956 F957 V1039	E954-D956 VanDerWaalsContact C-N 3.33Å; E954-D956 PolarHBondContact O-N 3.3Å; E954-F957 PolarHBondContact O-N 3.11Å; E954-V1039 HydrophobicContact CB-CG1 4.26Å; E954-V1039 HydrophobicContact CB-CG2 4.45Å
955	H	74.1	Confident	84.3	Confident	73 Å²	73	47 Å²	47	34%	0.338	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	57.9	36.4	177.2	-52.4	92.1	0	0	0	114.9	F957 F1016 Y1022 V1039 F1079	H955-F957 HydrophobicContact CB-CD2 4.34Å; H955-F957 PolarHBondContact O-N 2.91Å; H955-F1016 WeakPolarHBondContact O-CE1 3.37Å; H955-F1016 WeakPolarHBondContact O-CZ 3.41Å; H955-Y1022 HydrophobicContact CB-CE2 4.25Å; H955-V1039 HydrophobicContact CB-CG2 4.15Å; H955-V1039 WeakPolarHBondContact ND1-CG2 3.49Å; H955-F1079 HydrophobicContact CB-CE1 3.99Å; H955-F1079 HydrophobicContact CB-CZ 3.83Å; H955-F1079 AromaticContact CD2-CZ 3.75Å; H955-F1079 AromaticContact CG-CE1 3.86Å; H955-F1079 AromaticContact CG-CZ 3.69Å
956	D	77.8	Confident	84	Confident	64 Å²	64	47 Å²	47	34%	0.342	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	59.1	21.7	177.9	-76.5	-34.4	0	0	0	115.3	E954 F1016 R1017	E954-D956 VanDerWaalsContact C-N 3.33Å; E954-D956 PolarHBondContact O-N 3.3Å; D956-F1016 HydrophobicContact CB-CD1 4.34Å; D956-F1016 HydrophobicContact CB-CE1 3.9Å; D956-R1017 WeakPolarHBondContact O-CB 3.36Å; D956-R1017 PolarHBondContact O-N 3.41Å
957	F	83	Confident	83.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143	166.6	-78.4	-87.2	0	0	0	111.7	F917 L953 E954 H955 V1014 F1016 V1039 V1077 F1079	F917-F957 HydrophobicContact CB-CZ 4.35Å; F917-F957 HydrophobicContact CD1-CE1 4.09Å; F917-F957 AromaticContact CD2-CE1 3.83Å; F917-F957 HydrophobicContact CD2-CE1 3.83Å; F917-F957 HydrophobicContact CD2-CZ 4.19Å; F917-F957 HydrophobicContact CE1-CE1 4.19Å; F917-F957 AromaticContact CE2-CE1 3.93Å; F917-F957 HydrophobicContact CE2-CE1 3.93Å; F917-F957 AromaticContact CG-CE1 3.91Å; F917-F957 HydrophobicContact CG-CE1 3.91Å; F917-F957 HydrophobicContact CG-CZ 4.14Å; F917-F957 HydrophobicContact CZ-CE1 4.1Å; L953-F957 HydrophobicContact CB-CB 4.05Å; L953-F957 HydrophobicContact CD1-CB 4.2Å; L953-F957 PolarHBondContact N-O 2.93Å; E954-F957 PolarHBondContact O-N 3.11Å; H955-F957 HydrophobicContact CB-CD2 4.34Å; H955-F957 PolarHBondContact O-N 2.91Å; F957-V1014 HydrophobicContact CD1-CG1 3.96Å; F957-F1016 HydrophobicContact CD1-CD2 4.4Å; F957-F1016 HydrophobicContact CD2-CD2 4.27Å; F957-F1016 HydrophobicContact CD2-CE2 4.13Å; F957-F1016 AromaticContact CE1-CD2 3.83Å; F957-F1016 HydrophobicContact CE1-CD2 3.83Å; F957-F1016 HydrophobicContact CE1-CE2 4.46Å; F957-F1016 AromaticContact CE2-CD2 3.67Å; F957-F1016 HydrophobicContact CE2-CD2 3.67Å; F957-F1016 AromaticContact CE2-CE2 3.45Å; F957-F1016 HydrophobicContact CE2-CE2 3.45Å; F957-F1016 VanDerWaalsContact CE2-CE2 3.45Å; F957-F1016 HydrophobicContact CE2-CZ 4.35Å; F957-F1016 AromaticContact CZ-CD2 3.43Å; F957-F1016 HydrophobicContact CZ-CD2 3.43Å; F957-F1016 VanDerWaalsContact CZ-CD2 3.43Å; F957-F1016 AromaticContact CZ-CE2 3.66Å; F957-F1016 HydrophobicContact CZ-CE2 3.66Å; F957-F1016 HydrophobicContact CZ-CG 4.49Å; F957-V1039 HydrophobicContact CD2-CG2 4.31Å; F957-V1077 HydrophobicContact CD1-CG1 4.18Å; F957-V1077 HydrophobicContact CE1-CG1 3.79Å; F957-V1077 HydrophobicContact CE2-CG1 4.4Å; F957-V1077 HydrophobicContact CZ-CG1 3.9Å; F957-F1079 HydrophobicContact CE2-CB 4.03Å; F957-F1079 AromaticContact CE2-CD1 3.75Å; F957-F1079 HydrophobicContact CE2-CD1 3.75Å; F957-F1079 HydrophobicContact CE2-CD2 4.46Å; F957-F1079 HydrophobicContact CE2-CE1 4.31Å; F957-F1079 AromaticContact CE2-CG 3.83Å; F957-F1079 HydrophobicContact CE2-CG 3.83Å; F957-F1079 HydrophobicContact CZ-CB 3.77Å; F957-F1079 HydrophobicContact CZ-CD1 4.35Å; F957-F1079 HydrophobicContact CZ-CG 4.1Å
958	E	86.4	Confident	82.1	Confident	14 Å²	14	55.8 Å²	55.8	7%	0.065	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	155	173.7	68.5	-175.3	164.9	0	0	110.9	E951 Q952 K960 H1015 R1017	E951-E958 WeakPolarHBondContact O-CA 3.48Å; Q952-E958 HydrophobicContact CG-CB 4.43Å; E958-K960 VanDerWaalsContact OE1-CE 3.28Å; E958-K960 WeakPolarHBondContact OE1-CE 3.31Å; E958-K960 IonicContact OE1-NZ 3.51Å; E958-K960 PolarHBondContact OE1-NZ 2.88Å; E958-K960 WeakPolarHBondContact OE2-CE 3.34Å; E958-K960 IonicContact OE2-NZ 2.73Å; E958-K960 PolarHBondContact OE2-NZ 2.95Å; E958-H1015 WeakPolarHBondContact CG-CE1 3.46Å; E958-H1015 WeakPolarHBondContact CG-NE2 3.36Å; E958-H1015 PolarHBondContact N-O 2.82Å; E958-H1015 VanDerWaalsContact N-O 3.08Å; E958-H1015 PolarHBondContact O-N 3.09Å; E958-H1015 VanDerWaalsContact O-N 3.16Å; E958-H1015 IonicContact OE1-CD2 2.69Å; E958-H1015 IonicContact OE1-CE1 3.28Å; E958-H1015 PolarHBondContact OE1-CE1 3.43Å; E958-H1015 CovalentContact OE1-NE2 1.76Å; E958-H1015 IonicContact OE1-NE2 3.46Å; E958-H1015 PolarHBondContact OE1-NE2 3.27Å; E958-H1015 IonicContact OE2-NE2 3.96Å; E958-R1017 HydrophobicContact CG-CB 4.1Å; E958-R1017 HydrophobicContact CG-CG 4.48Å; E958-R1017 WeakPolarHBondContact OE1-CG 3.36Å; E958-R1017 IonicContact OE2-NE 2.6Å
959	I	86.6	Confident	80.9	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.4	173.3	-170.8	171.1	0	0	0	110.1	M927 F949 Q950 E951 Y962 V1013 V1014 F1041	M927-I959 HydrophobicContact SD-CD1 3.95Å; F949-I959 HydrophobicContact CD2-CG2 4.27Å; F949-I959 HydrophobicContact CE2-CG2 4.09Å; Q950-I959 WeakPolarHBondContact O-CG2 3.42Å; E951-I959 PolarHBondContact O-N 2.75Å; I959-Y962 HydrophobicContact CG2-CD1 4.47Å; I959-V1013 CarbonylContact C-O 3.5Å; I959-V1013 WeakPolarHBondContact CA-O 3.42Å; I959-V1014 HydrophobicContact CB-CG2 4.41Å; I959-V1014 HydrophobicContact CD1-CG2 4.39Å; I959-V1014 HydrophobicContact CG1-CG2 4.27Å; I959-F1041 HydrophobicContact CB-CE2 4.48Å; I959-F1041 HydrophobicContact CD1-CE2 3.82Å; I959-F1041 HydrophobicContact CD1-CZ 4Å; I959-F1041 HydrophobicContact CG2-CE2 4.06Å
960	K	84.4	Confident	80	Confident	93 Å²	93	64.8 Å²	64.8	40%	0.404	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	167.7	178	-78.8	-174.8	-174.3	150.7	0	112.2	E958 Y962 V1013 H1015	E958-K960 VanDerWaalsContact OE1-CE 3.28Å; E958-K960 WeakPolarHBondContact OE1-CE 3.31Å; E958-K960 IonicContact OE1-NZ 3.51Å; E958-K960 PolarHBondContact OE1-NZ 2.88Å; E958-K960 WeakPolarHBondContact OE2-CE 3.34Å; E958-K960 IonicContact OE2-NZ 2.73Å; E958-K960 PolarHBondContact OE2-NZ 2.95Å; K960-Y962 PolarHBondContact O-N 2.97Å; K960-Y962 VanDerWaalsContact O-N 3.08Å; K960-V1013 PolarHBondContact N-O 3.2Å; K960-V1013 PolarHBondContact O-N 2.9Å; K960-H1015 WeakPolarHBondContact CB-CE1 3.43Å; K960-H1015 WeakPolarHBondContact CD-CE1 3.42Å; K960-H1015 VanDerWaalsContact CE-CE1 3.46Å; K960-H1015 WeakPolarHBondContact CE-CE1 3.35Å; K960-H1015 WeakPolarHBondContact CG-CE1 3.42Å; K960-H1015 PolarHBondContact NZ-NE2 3.45Å
961	N	84.9	Confident	79.7	Confident	142 Å²	142	64.6 Å²	64.6	76%	0.759	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.1	32.5	177.6	-57.3	-17	0	0	0	112.9
962	Y	87.8	Confident	79.8	Confident	50 Å²	50	69 Å²	69	20%	0.196	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	146.9	-177.8	61.9	-106.6	0	0	0	111.1	F949 E951 I959 K960 K975 V991 I993 L1011	F949-Y962 AromaticContact CE2-CD1 3.96Å; F949-Y962 HydrophobicContact CE2-CD1 3.96Å; F949-Y962 HydrophobicContact CE2-CD2 4.42Å; F949-Y962 HydrophobicContact CE2-CE1 4.13Å; F949-Y962 HydrophobicContact CE2-CG 4.12Å; F949-Y962 HydrophobicContact CZ-CD1 4.04Å; F949-Y962 AromaticContact CZ-CD2 3.68Å; F949-Y962 HydrophobicContact CZ-CD2 3.68Å; F949-Y962 HydrophobicContact CZ-CE1 4.15Å; F949-Y962 AromaticContact CZ-CE2 3.82Å; F949-Y962 HydrophobicContact CZ-CE2 3.82Å; F949-Y962 AromaticContact CZ-CG 3.82Å; F949-Y962 HydrophobicContact CZ-CG 3.82Å; E951-Y962 HydrophobicContact CG-CE1 4.38Å; I959-Y962 HydrophobicContact CG2-CD1 4.47Å; K960-Y962 PolarHBondContact O-N 2.97Å; K960-Y962 VanDerWaalsContact O-N 3.08Å; Y962-K975 WeakPolarHBondContact OH-CD 3.04Å; Y962-K975 VanDerWaalsContact OH-CE 3.27Å; Y962-K975 WeakPolarHBondContact OH-CE 3.36Å; Y962-K975 PolarHBondContact OH-NZ 2.96Å; Y962-V991 HydrophobicContact CE2-CG1 4.34Å; Y962-I993 HydrophobicContact CD2-CD1 3.89Å; Y962-I993 HydrophobicContact CE2-CD1 3.76Å; Y962-L1011 CarbonylContact C-O 3.51Å; Y962-L1011 WeakPolarHBondContact CA-O 3.35Å; Y962-L1011 WeakPolarHBondContact CB-O 3.48Å
963	R	87.1	Confident	80	Confident	152 Å²	152	67.8 Å²	67.8	57%	0.574	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.8	175	63.8	-177.2	-171.4	166.1	11.2	109.3	L1011	R963-L1011 HydrophobicContact CG-CB 3.87Å; R963-L1011 HydrophobicContact CG-CD1 4.2Å; R963-L1011 PolarHBondContact N-O 3.06Å; R963-L1011 VanDerWaalsContact NE-CD1 3.3Å; R963-L1011 PolarHBondContact O-N 2.66Å
964	V	88.4	Confident	80.4	Confident	21 Å²	21	70.2 Å²	70.2	13%	0.127	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.1	169.8	176.5	0	0	0	0	107.5	L947 C973 I993 V1008 S1009 L1010	L947-V964 HydrophobicContact CD2-CG2 3.69Å; V964-C973 HydrophobicContact CB-CB 4.46Å; V964-I993 HydrophobicContact CB-CG2 4.38Å; V964-I993 HydrophobicContact CG2-CB 4.45Å; V964-I993 HydrophobicContact CG2-CD1 3.64Å; V964-I993 HydrophobicContact CG2-CG2 4.1Å; V964-V1008 HydrophobicContact CG1-CG1 3.77Å; V964-S1009 WeakPolarHBondContact CA-O 3.36Å; V964-L1010 HydrophobicContact CG2-CD1 4Å
965	I	86	Confident	80.7	Confident	33 Å²	33	68.6 Å²	68.6	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.9	173.8	-53.4	-176.8	0	0	0	107.7	E967 V1008 S1009 L1011	I965-E967 HydrophobicContact CG2-CG 4Å; I965-V1008 WeakPolarHBondContact O-CA 3.49Å; I965-S1009 PolarHBondContact N-O 2.56Å; I965-S1009 PolarHBondContact O-N 3.29Å; I965-L1011 HydrophobicContact CD1-CD1 3.72Å; I965-L1011 HydrophobicContact CG1-CD1 4.31Å
966	V	85.4	Confident	80.6	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.5	176	-177.5	0	0	0	0	108.4	N970 T971 F998 V1006 Y1007 V1008	V966-N970 VanDerWaalsContact O-CA 3.28Å; V966-N970 WeakPolarHBondContact O-CA 3.49Å; V966-N970 PolarHBondContact O-N 3.01Å; V966-T971 WeakPolarHBondContact CB-OG1 3.35Å; V966-F998 HydrophobicContact CG1-CE1 3.93Å; V966-F998 HydrophobicContact CG1-CZ 3.92Å; V966-V1006 HydrophobicContact CG1-CG1 3.63Å; V966-Y1007 CarbonylContact C-O 3.58Å; V966-Y1007 WeakPolarHBondContact CA-O 3.44Å; V966-V1008 HydrophobicContact CG1-CG2 4.38Å; V966-V1008 HydrophobicContact CG2-CG1 4.44Å; V966-V1008 HydrophobicContact CG2-CG2 4.32Å
967	E	78.8	Confident	79.5	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.439	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	135.6	-177.7	-74.8	162.6	-176.4	0	0	109.8	I965 V1006 Y1007	I965-E967 HydrophobicContact CG2-CG 4Å; E967-V1006 WeakPolarHBondContact O-CA 3.44Å; E967-Y1007 PolarHBondContact N-O 3.13Å; E967-Y1007 PolarHBondContact O-N 3.4Å
968	P	60.7	Low	78.2	Confident	99 Å²	99	75.1 Å²	75.1	64%	0.643	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.5	-9.4	5.1	34.5	-36.8	0	0	0	115.2	N970	P968-N970 VanDerWaalsContact C-N 3.32Å; P968-N970 PolarHBondContact O-N 3.11Å
969	N	63.7	Low	76.4	Confident	70 Å²	70	80.6 Å²	80.6	37%	0.374	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10.6	-162.7	-74	-17.7	0	0	0	116.4	T971 F998 M999	N969-T971 PolarHBondContact O-N 3.4Å; N969-T971 VanDerWaalsContact O-N 3.09Å; N969-F998 VanDerWaalsContact ND2-CD2 3.28Å; N969-F998 WeakPolarHBondContact ND2-CD2 3.41Å; N969-M999 PolarHBondContact ND2-O 3.13Å
970	N	67.3	Low	74.8	Confident	129 Å²	129	89.7 Å²	89.7	69%	0.69	47%	0.472	S	S	*	.			trans	49.8	35.4	176.6	-118.9	-12.4	0	0	0	114.5	V966 P968	V966-N970 VanDerWaalsContact O-CA 3.28Å; V966-N970 WeakPolarHBondContact O-CA 3.49Å; V966-N970 PolarHBondContact O-N 3.01Å; P968-N970 VanDerWaalsContact C-N 3.32Å; P968-N970 PolarHBondContact O-N 3.11Å
971	T	78	Confident	73.2	Confident	30 Å²	30	86.4 Å²	86.4	18%	0.184	46%	0.462	C	S	.	.			trans	-65.9	147.1	-175.3	12.9	0	0	0	0	112.8	V966 N969 D996 F998	V966-T971 WeakPolarHBondContact CB-OG1 3.35Å; N969-T971 PolarHBondContact O-N 3.4Å; N969-T971 VanDerWaalsContact O-N 3.09Å; T971-D996 HydrophobicContact CG2-CB 4.32Å; T971-F998 HydrophobicContact CG2-CB 3.92Å; T971-F998 HydrophobicContact CG2-CD1 3.96Å; T971-F998 HydrophobicContact CG2-CG 4.35Å
972	Q	81.6	Confident	71.5	Confident	156 Å²	156	88.8 Å²	88.8	73%	0.729	47%	0.469	S	S	*	.			trans	-70.5	140.2	174.8	-59	-170.3	16.5	0	0	110.4	C995 D996	Q972-C995 WeakPolarHBondContact O-CA 3.34Å; Q972-D996 PolarHBondContact O-N 3.44Å
973	C	85.7	Confident	69.8	Low	42 Å²	42	88.7 Å²	88.7	28%	0.284	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.9	180	-55.4	0	0	0	0	110.1	V964 I993 K994 C995	V964-C973 HydrophobicContact CB-CB 4.46Å; C973-I993 HydrophobicContact CB-CG2 3.78Å; C973-K994 CarbonylContact C-O 3.55Å; C973-K994 WeakPolarHBondContact CA-O 3.47Å; C973-C995 HydrophobicContact CB-CB 4.05Å; C973-C995 WeakPolarHBondContact CB-SG 3.33Å; C973-C995 WeakPolarHBondContact SG-CB 3.22Å; C973-C995 CovalentContact SG-SG 2.04Å; C973-C995 PolarHBondContact SG-SG 3.33Å
974	S	84.7	Confident	68.5	Low	73 Å²	73	82.5 Å²	82.5	51%	0.51	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147.5	-172.3	61.7	0	0	0	0	112.6	I993 K994	S974-I993 CarbonylContact O-C 3.49Å; S974-I993 VanDerWaalsContact O-CA 3.31Å; S974-I993 WeakPolarHBondContact O-CA 3.47Å; S974-K994 PolarHBondContact N-O 3.31Å; S974-K994 PolarHBondContact O-N 2.94Å
975	K	81.8	Confident	66.9	Low	103 Å²	103	85.4 Å²	85.4	45%	0.448	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.2	174.3	-169.1	174	-170.3	163	0	108.7	E951 Y962 V991	E951-K975 VanDerWaalsContact CD-NZ 3.26Å; E951-K975 IonicContact OE1-NZ 2.66Å; E951-K975 PolarHBondContact OE1-NZ 2.97Å; E951-K975 IonicContact OE2-NZ 3.73Å; E951-K975 PolarHBondContact OE2-NZ 2.71Å; Y962-K975 WeakPolarHBondContact OH-CD 3.04Å; Y962-K975 VanDerWaalsContact OH-CE 3.27Å; Y962-K975 WeakPolarHBondContact OH-CE 3.36Å; Y962-K975 PolarHBondContact OH-NZ 2.96Å; K975-V991 HydrophobicContact CD-CG1 4.45Å; K975-V991 HydrophobicContact CG-CG1 4.31Å
976	M	73.1	Confident	65.7	Low	74 Å²	74	87 Å²	87	37%	0.365	49%	0.486	S	S	.	.			trans	-65.9	140.3	177	-71.2	-179.3	60.7	0	0	110.8	A992 K994	M976-A992 HydrophobicContact CB-CB 4.14Å; M976-A992 HydrophobicContact CG-CB 4.28Å; M976-A992 PolarHBondContact N-O 2.89Å; M976-A992 HydrophobicContact SD-CB 3.91Å; M976-K994 HydrophobicContact CG-CB 4.12Å; M976-K994 HydrophobicContact SD-CB 4.22Å
977	S	54.5	Low	64.3	Low	121 Å²	121	96.6 Å²	96.6	85%	0.846	53%	0.527	S	S	*	.	S	Bend	trans	-88.7	-1	-169.8	49.5	0	0	0	0	115.3
978	T	55.7	Low	63.4	Low	81 Å²	81	99.7 Å²	99.7	50%	0.497	54%	0.542	S	S	.	.			trans	-104.9	119.8	-178.5	44.6	0	0	0	0	112	K980	T978-K980 PolarHBondContact O-N 2.81Å
979	P	48	Very low	63.7	Low	129 Å²	129	98.9 Å²	98.9	84%	0.838	53%	0.532	S	S	*	.	S	Bend	trans	-75.8	14.8	-175.7	32	-37.1	0	0	0	114.5
980	K	52.8	Low	64.3	Low	192 Å²	192	97.5 Å²	97.5	84%	0.835	53%	0.527	S	S	*	.	S	Bend	trans	-140.6	67.3	173.5	-70.3	-173.9	179.2	177.7	0	108.8	T978 E982	T978-K980 PolarHBondContact O-N 2.81Å; K980-E982 PolarHBondContact O-N 2.95Å
981	A	51.4	Low	65.1	Low	23 Å²	23	91.4 Å²	91.4	19%	0.19	50%	0.495	C	S	.	.			trans	-67.3	119.4	171.8	0	0	0	0	0	109.5	F948 G983 C984 A992	F948-A981 HydrophobicContact CE1-CB 4.23Å; A981-G983 PolarHBondContact O-N 2.86Å; A981-C984 PolarHBondContact O-N 2.91Å; A981-A992 HydrophobicContact CB-CB 4.13Å
982	E	48.2	Very low	65.5	Low	193 Å²	193	90.4 Å²	90.4	90%	0.902	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	132.6	177.1	-68.2	-174.5	121.8	0	0	110.3	K980	K980-E982 PolarHBondContact O-N 2.95Å
983	G	53.2	Low	65.7	Low	47 Å²	47	83.4 Å²	83.4	49%	0.485	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	11	-179.7	0	0	0	0	0	116.5	A981 K1046	A981-G983 PolarHBondContact O-N 2.86Å; G983-K1046 PolarHBondContact O-NZ 3.49Å
984	C	59.2	Low	65.9	Low	23 Å²	23	85.5 Å²	85.5	16%	0.155	46%	0.461	C	S	.	.			trans	-76.4	133.7	158.6	-172.3	0	0	0	0	110.3	F948 A981 W986 C990	F948-C984 HydrophobicContact CD1-CB 4.16Å; A981-C984 PolarHBondContact O-N 2.91Å; C984-W986 VanDerWaalsContact C-N 3.32Å; C984-W986 PolarHBondContact O-N 2.85Å; C984-C990 HydrophobicContact CB-CB 4.14Å; C984-C990 WeakPolarHBondContact CB-SG 3.35Å; C984-C990 WeakPolarHBondContact SG-CB 3.48Å; C984-C990 CovalentContact SG-SG 2.04Å; C984-C990 PolarHBondContact SG-SG 2.77Å
985	P	55.8	Low	66.1	Low	82 Å²	82	82.1 Å²	82.1	53%	0.532	44%	0.438	S	S	.	.	S	Bend	trans	-66.4	-30.5	179.3	-21.3	32.9	0	0	0	114.1
986	W	60.5	Low	66.3	Low	66 Å²	66	81.6 Å²	81.6	25%	0.25	44%	0.44	C	S	.	.			trans	-105.5	127.5	-173.2	-46.7	-76.8	0	0	0	110.5	Q950 C984 C990 N1042	Q950-W986 HydrophobicContact CG-CB 4.31Å; Q950-W986 HydrophobicContact CG-CD2 3.87Å; Q950-W986 HydrophobicContact CG-CE3 3.8Å; Q950-W986 HydrophobicContact CG-CG 4.06Å; C984-W986 VanDerWaalsContact C-N 3.32Å; C984-W986 PolarHBondContact O-N 2.85Å; W986-C990 WeakPolarHBondContact O-CB 3.41Å; W986-N1042 HydrophobicContact CH2-CB 3.45Å; W986-N1042 VanDerWaalsContact CH2-CB 3.45Å; W986-N1042 HydrophobicContact CZ2-CB 3.33Å; W986-N1042 HydrophobicContact CZ3-CB 4.41Å
987	K	55.4	Low	67	Low	202 Å²	202	82.3 Å²	82.3	88%	0.878	45%	0.448	S	S	*	.	S	Bend	trans	-84.2	-9.5	-170.3	-71	178.9	178.8	173.5	0	115
988	E	59.3	Low	68.6	Low	159 Å²	159	77.2 Å²	77.2	74%	0.743	41%	0.411	S	S	*	.	S	Bend	trans	-131.6	144.2	-178.2	-63.7	-177.9	178	0	0	109.4	C990	E988-C990 PolarHBondContact O-N 3.23Å
989	N	68.1	Low	70.2	Confident	82 Å²	82	77.7 Å²	77.7	44%	0.439	41%	0.408	S	S	.	.	S	Bend	trans	53.3	23	178.3	-58.6	-30.2	0	0	0	116.5	E951 Q952	E951-N989 PolarHBondContact N-O 3.14Å; Q952-N989 HydrophobicContact CB-CB 4.24Å; Q952-N989 PolarHBondContact OE1-ND2 2.72Å
990	C	76.9	Confident	72.1	Confident	40 Å²	40	71.5 Å²	71.5	27%	0.27	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130.1	174.2	-178.6	0	0	0	0	111.8	F949 C984 W986 E988	F949-C990 CarbonylContact O-C 3.54Å; F949-C990 WeakPolarHBondContact O-CA 3.31Å; C984-C990 HydrophobicContact CB-CB 4.14Å; C984-C990 WeakPolarHBondContact CB-SG 3.35Å; C984-C990 WeakPolarHBondContact SG-CB 3.48Å; C984-C990 CovalentContact SG-SG 2.04Å; C984-C990 PolarHBondContact SG-SG 2.77Å; W986-C990 WeakPolarHBondContact O-CB 3.41Å; E988-C990 PolarHBondContact O-N 3.23Å
991	V	83.4	Confident	73.6	Confident	2 Å²	2	68 Å²	68	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.3	171.2	171.8	0	0	0	0	109	F948 F949 E951 Y962 K975 I993	F948-V991 VanDerWaalsContact CA-O 3.32Å; F948-V991 WeakPolarHBondContact CA-O 3.49Å; F949-V991 HydrophobicContact CD2-CB 4.35Å; F949-V991 HydrophobicContact CE1-CB 4.18Å; F949-V991 HydrophobicContact CE1-CG1 3.75Å; F949-V991 HydrophobicContact CE2-CB 3.99Å; F949-V991 HydrophobicContact CE2-CG1 4.11Å; F949-V991 HydrophobicContact CE2-CG2 4.4Å; F949-V991 HydrophobicContact CZ-CB 3.9Å; F949-V991 HydrophobicContact CZ-CG1 3.52Å; F949-V991 PolarHBondContact N-O 3Å; F949-V991 PolarHBondContact O-N 2.83Å; E951-V991 HydrophobicContact CB-CG2 3.72Å; E951-V991 HydrophobicContact CG-CG2 4.16Å; E951-V991 WeakPolarHBondContact OE2-CG2 3.44Å; Y962-V991 HydrophobicContact CE2-CG1 4.34Å; K975-V991 HydrophobicContact CD-CG1 4.45Å; K975-V991 HydrophobicContact CG-CG1 4.31Å; V991-I993 HydrophobicContact CG1-CD1 4.5Å; V991-I993 HydrophobicContact CG1-CG1 4.01Å
992	A	85.3	Confident	75.2	Confident	8 Å²	8	70 Å²	70	7%	0.066	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.4	167.1	0	0	0	0	0	109.4	L947 F948 M976 A981	L947-A992 CarbonylContact O-C 3.58Å; L947-A992 WeakPolarHBondContact O-CA 3.29Å; F948-A992 HydrophobicContact CD1-CB 3.73Å; F948-A992 HydrophobicContact CE1-CB 3.67Å; M976-A992 HydrophobicContact CB-CB 4.14Å; M976-A992 HydrophobicContact CG-CB 4.28Å; M976-A992 PolarHBondContact N-O 2.89Å; M976-A992 HydrophobicContact SD-CB 3.91Å; A981-A992 HydrophobicContact CB-CB 4.13Å
993	I	87.8	Confident	76.7	Confident	9 Å²	9	66.1 Å²	66.1	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.9	170.4	-63.9	176.2	0	0	0	107.5	S946 L947 F949 Y962 V964 C973 S974 V991	S946-I993 CarbonylContact C-O 3.59Å; S946-I993 WeakPolarHBondContact CA-O 3.24Å; L947-I993 PolarHBondContact N-O 3.18Å; L947-I993 PolarHBondContact O-N 3.1Å; F949-I993 HydrophobicContact CE1-CD1 3.72Å; F949-I993 HydrophobicContact CE1-CG1 4.2Å; F949-I993 HydrophobicContact CZ-CD1 4.03Å; Y962-I993 HydrophobicContact CD2-CD1 3.89Å; Y962-I993 HydrophobicContact CE2-CD1 3.76Å; V964-I993 HydrophobicContact CB-CG2 4.38Å; V964-I993 HydrophobicContact CG2-CB 4.45Å; V964-I993 HydrophobicContact CG2-CD1 3.64Å; V964-I993 HydrophobicContact CG2-CG2 4.1Å; C973-I993 HydrophobicContact CB-CG2 3.78Å; S974-I993 CarbonylContact O-C 3.49Å; S974-I993 VanDerWaalsContact O-CA 3.31Å; S974-I993 WeakPolarHBondContact O-CA 3.47Å; V991-I993 HydrophobicContact CG1-CD1 4.5Å; V991-I993 HydrophobicContact CG1-CG1 4.01Å
994	K	88.6	Confident	78	Confident	87 Å²	87	65.3 Å²	65.3	38%	0.378	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.6	174.2	-173.7	174.5	-178.8	179.4	0	110.2	N944 C973 S974 M976	N944-K994 WeakPolarHBondContact OD1-CE 3.33Å; C973-K994 CarbonylContact C-O 3.55Å; C973-K994 WeakPolarHBondContact CA-O 3.47Å; S974-K994 PolarHBondContact N-O 3.31Å; S974-K994 PolarHBondContact O-N 2.94Å; M976-K994 HydrophobicContact CG-CB 4.12Å; M976-K994 HydrophobicContact SD-CB 4.22Å
995	C	89.1	Confident	79.2	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.014	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	150.4	171.9	-56.9	0	0	0	0	111	V945 Q972 C973	V945-C995 HydrophobicContact CB-CB 4.4Å; V945-C995 PolarHBondContact O-N 3.2Å; Q972-C995 WeakPolarHBondContact O-CA 3.34Å; C973-C995 HydrophobicContact CB-CB 4.05Å; C973-C995 WeakPolarHBondContact CB-SG 3.33Å; C973-C995 WeakPolarHBondContact SG-CB 3.22Å; C973-C995 CovalentContact SG-SG 2.04Å; C973-C995 PolarHBondContact SG-SG 3.33Å
996	D	87.1	Confident	80.7	Confident	92 Å²	92	63 Å²	63	49%	0.492	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-62.4	160.4	175.8	-73.6	-32.1	0	0	0	112.5	T971 Q972 F998	T971-D996 HydrophobicContact CG2-CB 4.32Å; Q972-D996 PolarHBondContact O-N 3.44Å; D996-F998 WeakPolarHBondContact O-CD1 3.25Å; D996-F998 PolarHBondContact O-N 3.45Å
997	T	87.4	Confident	82.2	Confident	88 Å²	88	63 Å²	63	54%	0.54	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-69.8	128.7	179.5	-51.9	0	0	0	0	110.9	P942 I943	P942-T997 HydrophobicContact CB-CG2 3.72Å; I943-T997 CarbonylContact O-C 3.29Å; I943-T997 VanDerWaalsContact O-CA 3.28Å; I943-T997 WeakPolarHBondContact O-CA 3.39Å; I943-T997 WeakPolarHBondContact O-CG2 3.25Å
998	F	88.2	Confident	83.8	Confident	15 Å²	15	53.4 Å²	53.4	7%	0.066	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	159.9	175.7	59.5	-95	0	0	0	111.7	P942 I943 V945 V966 N969 T971 D996 V1006	P942-F998 WeakPolarHBondContact CA-O 3.47Å; I943-F998 HydrophobicContact CD1-CD2 4.46Å; I943-F998 HydrophobicContact CD1-CE2 3.58Å; I943-F998 HydrophobicContact CD1-CZ 3.73Å; I943-F998 HydrophobicContact CG1-CD2 4.07Å; I943-F998 HydrophobicContact CG1-CE2 3.65Å; I943-F998 HydrophobicContact CG1-CZ 3.92Å; I943-F998 PolarHBondContact N-O 2.86Å; I943-F998 PolarHBondContact O-N 3.5Å; V945-F998 HydrophobicContact CG2-CE1 3.85Å; V945-F998 HydrophobicContact CG2-CZ 3.79Å; V966-F998 HydrophobicContact CG1-CE1 3.93Å; V966-F998 HydrophobicContact CG1-CZ 3.92Å; N969-F998 VanDerWaalsContact ND2-CD2 3.28Å; N969-F998 WeakPolarHBondContact ND2-CD2 3.41Å; T971-F998 HydrophobicContact CG2-CB 3.92Å; T971-F998 HydrophobicContact CG2-CD1 3.96Å; T971-F998 HydrophobicContact CG2-CG 4.35Å; D996-F998 WeakPolarHBondContact O-CD1 3.25Å; D996-F998 PolarHBondContact O-N 3.45Å; F998-V1006 HydrophobicContact CE2-CB 4.38Å; F998-V1006 HydrophobicContact CE2-CG1 3.83Å; F998-V1006 HydrophobicContact CE2-CG2 4.1Å; F998-V1006 HydrophobicContact CZ-CG1 3.92Å
999	M	87.5	Confident	85.3	Confident	90 Å²	90	46.4 Å²	46.4	44%	0.443	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.6	176	-65.2	-59	-65.1	0	0	110.8	D940 P942 N969	D940-M999 HydrophobicContact CB-CE 3.91Å; P942-M999 HydrophobicContact CB-SD 3.8Å; P942-M999 HydrophobicContact CG-SD 4.29Å; N969-M999 PolarHBondContact ND2-O 3.13Å
1000	L	88.4	Confident	86.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	101	168.6	-175.7	73.4	0	0	0	108.3	M903 I933 N935 F941 I943 V1006	M903-L1000 HydrophobicContact CB-CD2 4.27Å; I933-L1000 HydrophobicContact CG2-CD1 4.06Å; I933-L1000 HydrophobicContact CG2-CD2 4.02Å; N935-L1000 HydrophobicContact CB-CD2 3.79Å; N935-L1000 HydrophobicContact CB-CG 3.89Å; N935-L1000 PolarHBondContact ND2-O 2.87Å; N935-L1000 VanDerWaalsContact ND2-O 3.13Å; F941-L1000 HydrophobicContact CE1-CD2 4.04Å; F941-L1000 HydrophobicContact CZ-CD2 3.95Å; F941-L1000 PolarHBondContact N-O 2.65Å; F941-L1000 PolarHBondContact O-N 2.83Å; I943-L1000 HydrophobicContact CD1-CB 4Å; I943-L1000 HydrophobicContact CD1-CD1 4.2Å; I943-L1000 HydrophobicContact CD1-CD2 4.2Å; I943-L1000 HydrophobicContact CD1-CG 4.35Å; I943-L1000 HydrophobicContact CG1-CB 4.08Å; I943-L1000 HydrophobicContact CG2-CB 4.5Å; L1000-V1006 HydrophobicContact CD1-CB 4.07Å; L1000-V1006 HydrophobicContact CD1-CG2 3.64Å
1001	K	85.3	Confident	87.1	Confident	117 Å²	117	42.1 Å²	42.1	51%	0.509	21%	0.208	S	C	.	.			trans	-62.4	150.2	-178.4	-65	-172	174.9	-175.4	0	111.9	N935 D940 S1004	N935-K1001 VanDerWaalsContact CB-O 3.26Å; N935-K1001 WeakPolarHBondContact CB-O 3.04Å; N935-K1001 PolarHBondContact ND2-O 3.29Å; D940-K1001 WeakPolarHBondContact OD2-CA 3.46Å; K1001-S1004 WeakPolarHBondContact CB-OG 3.35Å; K1001-S1004 PolarHBondContact N-OG 3.26Å; K1001-S1004 WeakPolarHBondContact O-CB 3.36Å; K1001-S1004 PolarHBondContact O-N 3.49Å; K1001-S1004 PolarHBondContact O-OG 2.86Å
1002	N	83.8	Confident	87.3	Confident	65 Å²	65	42.3 Å²	42.3	35%	0.348	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	146.2	173	65.1	11.3	0	0	0	112	G937 F938 D940 S1004	G937-N1002 WeakPolarHBondContact O-CB 3.15Å; F938-N1002 WeakPolarHBondContact O-CB 3.36Å; F938-N1002 PolarHBondContact O-ND2 3.23Å; D940-N1002 PolarHBondContact OD1-N 3.19Å; N1002-S1004 PolarHBondContact O-N 3.29Å
1003	Y	80.9	Confident	87.5	Confident	113 Å²	113	43.6 Å²	43.6	44%	0.443	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	17.6	-177.9	-45.8	-69.6	0	0	0	115.7	Y934 N935	Y934-Y1003 WeakPolarHBondContact CE2-O 3.49Å; N935-Y1003 WeakPolarHBondContact O-CA 3.37Å; N935-Y1003 PolarHBondContact O-N 3.17Å
1004	S	79.1	Confident	87.4	Confident	29 Å²	29	43.1 Å²	43.1	20%	0.203	22%	0.215	C	C	.	.			trans	-106	158	-173.4	81.5	0	0	0	0	113	Y934 N935 K1001 N1002	Y934-S1004 WeakPolarHBondContact CA-O 3.45Å; Y934-S1004 VanDerWaalsContact CD2-O 3.25Å; Y934-S1004 WeakPolarHBondContact CD2-O 3.38Å; N935-S1004 PolarHBondContact N-O 3.24Å; N935-S1004 VanDerWaalsContact N-O 3.12Å; K1001-S1004 WeakPolarHBondContact CB-OG 3.35Å; K1001-S1004 PolarHBondContact N-OG 3.26Å; K1001-S1004 WeakPolarHBondContact O-CB 3.36Å; K1001-S1004 PolarHBondContact O-N 3.49Å; K1001-S1004 PolarHBondContact O-OG 2.86Å; N1002-S1004 PolarHBondContact O-N 3.29Å
1005	N	85.3	Confident	87.3	Confident	54 Å²	54	40.7 Å²	40.7	29%	0.289	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.2	174.5	-60.8	-81.8	0	0	0	109.6	K932 I933 Y934 Y1007	K932-N1005 WeakPolarHBondContact CE-OD1 3.32Å; I933-N1005 CarbonylContact O-C 3.05Å; I933-N1005 WeakPolarHBondContact O-CA 3.29Å; Y934-N1005 VanDerWaalsContact CD2-OD1 3.29Å; Y934-N1005 WeakPolarHBondContact CD2-OD1 3.22Å; N1005-Y1007 HydrophobicContact CB-CE2 3.99Å
1006	V	88.4	Confident	86.9	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.7	165.6	171.6	0	0	0	0	108.3	I933 V966 E967 F998 L1000 V1008	I933-V1006 PolarHBondContact N-O 3.31Å; I933-V1006 PolarHBondContact O-N 3.17Å; V966-V1006 HydrophobicContact CG1-CG1 3.63Å; E967-V1006 WeakPolarHBondContact O-CA 3.44Å; F998-V1006 HydrophobicContact CE2-CB 4.38Å; F998-V1006 HydrophobicContact CE2-CG1 3.83Å; F998-V1006 HydrophobicContact CE2-CG2 4.1Å; F998-V1006 HydrophobicContact CZ-CG1 3.92Å; L1000-V1006 HydrophobicContact CD1-CB 4.07Å; L1000-V1006 HydrophobicContact CD1-CG2 3.64Å; V1006-V1008 HydrophobicContact CG1-CG2 4.39Å
1007	Y	90.1	Very high	86.3	Confident	68 Å²	68	43.2 Å²	43.2	27%	0.267	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.4	178.4	-60.9	-75.3	0	0	0	109.8	V930 Y931 K932 V966 E967 N1005	V930-Y1007 HydrophobicContact CG1-CD1 4.06Å; Y931-Y1007 CarbonylContact O-C 3.6Å; Y931-Y1007 WeakPolarHBondContact O-CA 3.43Å; K932-Y1007 HydrophobicContact CB-CD1 4.16Å; K932-Y1007 HydrophobicContact CB-CE1 4.03Å; K932-Y1007 HydrophobicContact CD-CE1 3.97Å; K932-Y1007 HydrophobicContact CG-CD1 4.23Å; K932-Y1007 HydrophobicContact CG-CE1 3.71Å; V966-Y1007 CarbonylContact C-O 3.58Å; V966-Y1007 WeakPolarHBondContact CA-O 3.44Å; E967-Y1007 PolarHBondContact N-O 3.13Å; E967-Y1007 PolarHBondContact O-N 3.4Å; N1005-Y1007 HydrophobicContact CB-CE2 3.99Å
1008	V	90.9	Very high	85.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	103	177.4	-177.4	0	0	0	0	108.2	Y931 I933 V945 V964 I965 V966 V1006 I1045	Y931-V1008 PolarHBondContact N-O 3.26Å; Y931-V1008 PolarHBondContact O-N 3.16Å; I933-V1008 HydrophobicContact CD1-CG2 3.9Å; V945-V1008 HydrophobicContact CG1-CG1 4.27Å; V945-V1008 HydrophobicContact CG1-CG2 4.41Å; V964-V1008 HydrophobicContact CG1-CG1 3.77Å; I965-V1008 WeakPolarHBondContact O-CA 3.49Å; V966-V1008 HydrophobicContact CG1-CG2 4.38Å; V966-V1008 HydrophobicContact CG2-CG1 4.44Å; V966-V1008 HydrophobicContact CG2-CG2 4.32Å; V1006-V1008 HydrophobicContact CG1-CG2 4.39Å; V1008-I1045 HydrophobicContact CB-CD1 3.8Å; V1008-I1045 HydrophobicContact CG1-CD1 3.96Å; V1008-I1045 HydrophobicContact CG2-CD1 3.99Å
1009	S	90.4	Very high	84.8	Confident	11 Å²	11	43.7 Å²	43.7	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	105.9	-171.5	-62.5	0	0	0	0	110.3	V964 I965	V964-S1009 WeakPolarHBondContact CA-O 3.36Å; I965-S1009 PolarHBondContact N-O 2.56Å; I965-S1009 PolarHBondContact O-N 3.29Å
1010	L	91.4	Very high	83.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119	162.6	176.9	64.4	0	0	0	108.2	M927 I928 T929 L947 F949 V964 F1041	M927-L1010 HydrophobicContact CE-CD2 4.3Å; M927-L1010 HydrophobicContact SD-CD2 4.44Å; I928-L1010 WeakPolarHBondContact CA-O 3.3Å; T929-L1010 PolarHBondContact N-O 2.68Å; T929-L1010 PolarHBondContact O-N 2.93Å; L947-L1010 HydrophobicContact CD2-CB 3.91Å; L947-L1010 HydrophobicContact CD2-CD1 3.86Å; L947-L1010 HydrophobicContact CD2-CD2 4.08Å; L947-L1010 HydrophobicContact CD2-CG 4.15Å; F949-L1010 HydrophobicContact CD1-CD1 4.44Å; F949-L1010 HydrophobicContact CD1-CD2 4.22Å; F949-L1010 HydrophobicContact CE1-CD1 4.03Å; F949-L1010 HydrophobicContact CG-CD2 4.34Å; F949-L1010 HydrophobicContact CZ-CD1 4.28Å; V964-L1010 HydrophobicContact CG2-CD1 4Å; L1010-F1041 HydrophobicContact CD2-CE1 3.98Å; L1010-F1041 HydrophobicContact CD2-CZ 3.86Å
1011	L	90.3	Very high	82.8	Confident	33 Å²	33	50.2 Å²	50.2	17%	0.173	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.5	173.5	-61.1	172.2	0	0	0	108.1	I928 Y962 R963 I965	I928-L1011 HydrophobicContact CB-CD2 4.08Å; I928-L1011 HydrophobicContact CD1-CD2 3.82Å; I928-L1011 HydrophobicContact CG1-CD2 3.6Å; I928-L1011 HydrophobicContact CG2-CD2 3.74Å; Y962-L1011 CarbonylContact C-O 3.51Å; Y962-L1011 WeakPolarHBondContact CA-O 3.35Å; Y962-L1011 WeakPolarHBondContact CB-O 3.48Å; R963-L1011 HydrophobicContact CG-CB 3.87Å; R963-L1011 HydrophobicContact CG-CD1 4.2Å; R963-L1011 PolarHBondContact N-O 3.06Å; R963-L1011 VanDerWaalsContact NE-CD1 3.3Å; R963-L1011 PolarHBondContact O-N 2.66Å; I965-L1011 HydrophobicContact CD1-CD1 3.72Å; I965-L1011 HydrophobicContact CG1-CD1 4.31Å
1012	G	89.1	Confident	82.1	Confident	6 Å²	6	46.5 Å²	46.5	6%	0.062	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	-177.3	174.2	0	0	0	0	0	113.4	M927	M927-G1012 PolarHBondContact N-O 3.05Å; M927-G1012 PolarHBondContact O-N 2.93Å
1013	V	88.2	Confident	81.3	Confident	34 Å²	34	44.9 Å²	44.9	21%	0.206	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.6	178.2	-177	0	0	0	0	108.9	A924 Q925 I959 K960	A924-V1013 HydrophobicContact CB-CG1 3.56Å; Q925-V1013 CarbonylContact O-C 3.19Å; Q925-V1013 WeakPolarHBondContact O-CA 3.33Å; I959-V1013 CarbonylContact C-O 3.5Å; I959-V1013 WeakPolarHBondContact CA-O 3.42Å; K960-V1013 PolarHBondContact N-O 3.2Å; K960-V1013 PolarHBondContact O-N 2.9Å
1014	V	87.1	Confident	80.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.6	177.6	175.2	0	0	0	0	108.9	L915 F917 A924 Q925 M927 F957 I959 V1077	L915-V1014 HydrophobicContact CD1-CB 4.29Å; L915-V1014 HydrophobicContact CD1-CG2 4.27Å; F917-V1014 HydrophobicContact CE2-CG1 4.28Å; F917-V1014 HydrophobicContact CZ-CG1 4.14Å; F917-V1014 WeakPolarHBondContact CZ-O 3.09Å; A924-V1014 WeakPolarHBondContact CA-O 3.2Å; Q925-V1014 PolarHBondContact N-O 3.14Å; Q925-V1014 PolarHBondContact O-N 3.06Å; M927-V1014 HydrophobicContact CB-CG2 3.77Å; M927-V1014 HydrophobicContact CG-CG2 4.1Å; F957-V1014 HydrophobicContact CD1-CG1 3.96Å; I959-V1014 HydrophobicContact CB-CG2 4.41Å; I959-V1014 HydrophobicContact CD1-CG2 4.39Å; I959-V1014 HydrophobicContact CG1-CG2 4.27Å; V1014-V1077 HydrophobicContact CG1-CG2 4.4Å
1015	H	85.3	Confident	80.1	Confident	35 Å²	35	47.3 Å²	47.3	16%	0.162	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	164.4	175.4	65.2	-77.2	0	0	0	112.2	A924 E958 K960	A924-H1015 HydrophobicContact CB-CB 3.64Å; E958-H1015 WeakPolarHBondContact CG-CE1 3.46Å; E958-H1015 WeakPolarHBondContact CG-NE2 3.36Å; E958-H1015 PolarHBondContact N-O 2.82Å; E958-H1015 VanDerWaalsContact N-O 3.08Å; E958-H1015 PolarHBondContact O-N 3.09Å; E958-H1015 VanDerWaalsContact O-N 3.16Å; E958-H1015 IonicContact OE1-CD2 2.69Å; E958-H1015 IonicContact OE1-CE1 3.28Å; E958-H1015 PolarHBondContact OE1-CE1 3.43Å; E958-H1015 CovalentContact OE1-NE2 1.76Å; E958-H1015 IonicContact OE1-NE2 3.46Å; E958-H1015 PolarHBondContact OE1-NE2 3.27Å; E958-H1015 IonicContact OE2-NE2 3.96Å; K960-H1015 WeakPolarHBondContact CB-CE1 3.43Å; K960-H1015 WeakPolarHBondContact CD-CE1 3.42Å; K960-H1015 VanDerWaalsContact CE-CE1 3.46Å; K960-H1015 WeakPolarHBondContact CE-CE1 3.35Å; K960-H1015 WeakPolarHBondContact CG-CE1 3.42Å; K960-H1015 PolarHBondContact NZ-NE2 3.45Å
1016	F	81.1	Confident	79.4	Confident	18 Å²	18	45.2 Å²	45.2	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.8	175	-137	-70.1	0	0	0	109.7	H955 D956 F957 L1019 Y1022 F1079	H955-F1016 WeakPolarHBondContact O-CE1 3.37Å; H955-F1016 WeakPolarHBondContact O-CZ 3.41Å; D956-F1016 HydrophobicContact CB-CD1 4.34Å; D956-F1016 HydrophobicContact CB-CE1 3.9Å; F957-F1016 HydrophobicContact CD1-CD2 4.4Å; F957-F1016 HydrophobicContact CD2-CD2 4.27Å; F957-F1016 HydrophobicContact CD2-CE2 4.13Å; F957-F1016 AromaticContact CE1-CD2 3.83Å; F957-F1016 HydrophobicContact CE1-CD2 3.83Å; F957-F1016 HydrophobicContact CE1-CE2 4.46Å; F957-F1016 AromaticContact CE2-CD2 3.67Å; F957-F1016 HydrophobicContact CE2-CD2 3.67Å; F957-F1016 AromaticContact CE2-CE2 3.45Å; F957-F1016 HydrophobicContact CE2-CE2 3.45Å; F957-F1016 VanDerWaalsContact CE2-CE2 3.45Å; F957-F1016 HydrophobicContact CE2-CZ 4.35Å; F957-F1016 AromaticContact CZ-CD2 3.43Å; F957-F1016 HydrophobicContact CZ-CD2 3.43Å; F957-F1016 VanDerWaalsContact CZ-CD2 3.43Å; F957-F1016 AromaticContact CZ-CE2 3.66Å; F957-F1016 HydrophobicContact CZ-CE2 3.66Å; F957-F1016 HydrophobicContact CZ-CG 4.49Å; F1016-L1019 HydrophobicContact CD1-CB 4.2Å; F1016-L1019 HydrophobicContact CD1-CD1 4.22Å; F1016-L1019 HydrophobicContact CD2-CD1 4.21Å; F1016-L1019 HydrophobicContact CE1-CD1 4.24Å; F1016-L1019 HydrophobicContact CE2-CD1 4.23Å; F1016-L1019 HydrophobicContact CG-CB 4.43Å; F1016-L1019 HydrophobicContact CG-CD1 4.21Å; F1016-L1019 HydrophobicContact CZ-CD1 4.25Å; F1016-Y1022 HydrophobicContact CE1-CD1 4.14Å; F1016-Y1022 HydrophobicContact CE1-CD2 4.27Å; F1016-Y1022 AromaticContact CE1-CG 3.76Å; F1016-Y1022 HydrophobicContact CE1-CG 3.76Å; F1016-Y1022 AromaticContact CZ-CD1 3.73Å; F1016-Y1022 HydrophobicContact CZ-CD1 3.73Å; F1016-Y1022 HydrophobicContact CZ-CD2 4.15Å; F1016-Y1022 HydrophobicContact CZ-CE1 4.18Å; F1016-Y1022 AromaticContact CZ-CG 3.73Å; F1016-Y1022 HydrophobicContact CZ-CG 3.73Å; F1016-F1079 HydrophobicContact CE2-CD2 4.25Å
1017	R	74.3	Confident	78.8	Confident	129 Å²	129	49.1 Å²	49.1	49%	0.487	25%	0.251	S	S	.	.	S	Bend	trans	-65.7	-41.2	-172.5	-178.2	172.3	-177.8	-172.2	4.8	113.4	D956 E958	D956-R1017 WeakPolarHBondContact O-CB 3.36Å; D956-R1017 PolarHBondContact O-N 3.41Å; E958-R1017 HydrophobicContact CG-CB 4.1Å; E958-R1017 HydrophobicContact CG-CG 4.48Å; E958-R1017 WeakPolarHBondContact OE1-CG 3.36Å; E958-R1017 IonicContact OE2-NE 2.6Å
1018	N	72	Confident	77.9	Confident	76 Å²	76	52.2 Å²	52.2	41%	0.406	27%	0.266	S	S	.	.			trans	-155.9	92.4	171.4	-172.4	-23	0	0	0	110.6	E1020 N1021 Y1022	N1018-E1020 PolarHBondContact OD1-N 3.39Å; N1018-N1021 HydrophobicContact CB-CB 4.05Å; N1018-N1021 VanDerWaalsContact CG-CB 3.44Å; N1018-N1021 PolarHBondContact O-N 2.81Å; N1018-N1021 WeakPolarHBondContact OD1-CB 3.45Å; N1018-N1021 PolarHBondContact OD1-N 2.89Å; N1018-Y1022 PolarHBondContact O-N 3.06Å
1019	L	71.4	Confident	76.9	Confident	37 Å²	37	58.6 Å²	58.6	19%	0.194	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-42.1	179.2	-176.1	67.4	0	0	0	112.3	Y922 F1016 N1021 Y1022 E1023	Y922-L1019 HydrophobicContact CD1-CD2 4.47Å; Y922-L1019 HydrophobicContact CD2-CD2 3.34Å; Y922-L1019 HydrophobicContact CE2-CD2 3.61Å; Y922-L1019 HydrophobicContact CG-CD2 3.83Å; F1016-L1019 HydrophobicContact CD1-CB 4.2Å; F1016-L1019 HydrophobicContact CD1-CD1 4.22Å; F1016-L1019 HydrophobicContact CD2-CD1 4.21Å; F1016-L1019 HydrophobicContact CE1-CD1 4.24Å; F1016-L1019 HydrophobicContact CE2-CD1 4.23Å; F1016-L1019 HydrophobicContact CG-CB 4.43Å; F1016-L1019 HydrophobicContact CG-CD1 4.21Å; F1016-L1019 HydrophobicContact CZ-CD1 4.25Å; L1019-N1021 VanDerWaalsContact C-N 3.3Å; L1019-N1021 PolarHBondContact O-N 2.97Å; L1019-Y1022 PolarHBondContact O-N 3.43Å; L1019-E1023 HydrophobicContact CD1-CG 4.36Å; L1019-E1023 HydrophobicContact CG-CG 4.34Å; L1019-E1023 WeakPolarHBondContact O-CB 3.11Å; L1019-E1023 WeakPolarHBondContact O-CG 3.03Å; L1019-E1023 PolarHBondContact O-N 3.24Å
1020	E	66	Low	75.9	Confident	154 Å²	154	62.9 Å²	62.9	72%	0.72	32%	0.317	S	S	*	.	H	α-helix	trans	-60.8	-38.2	-179	-61.5	-177	167.8	0	0	112.2	N1018 S1024	N1018-E1020 PolarHBondContact OD1-N 3.39Å; E1020-S1024 WeakPolarHBondContact O-CB 3.44Å; E1020-S1024 PolarHBondContact O-N 2.83Å; E1020-S1024 PolarHBondContact O-OG 2.83Å
1021	N	67.9	Low	75	Confident	73 Å²	73	64.7 Å²	64.7	39%	0.39	33%	0.325	S	S	.	.	H	α-helix	trans	-71	-41.3	175.8	-177	62.4	0	0	0	112.1	N1018 L1019 S1024 N1025	N1018-N1021 HydrophobicContact CB-CB 4.05Å; N1018-N1021 VanDerWaalsContact CG-CB 3.44Å; N1018-N1021 PolarHBondContact O-N 2.81Å; N1018-N1021 WeakPolarHBondContact OD1-CB 3.45Å; N1018-N1021 PolarHBondContact OD1-N 2.89Å; L1019-N1021 VanDerWaalsContact C-N 3.3Å; L1019-N1021 PolarHBondContact O-N 2.97Å; N1021-S1024 PolarHBondContact O-N 2.64Å; N1021-N1025 WeakPolarHBondContact O-CB 3.43Å; N1021-N1025 PolarHBondContact O-N 2.97Å; N1021-N1025 PolarHBondContact O-ND2 2.99Å; N1021-N1025 PolarHBondContact OD1-ND2 2.98Å
1022	Y	70.9	Confident	73.8	Confident	39 Å²	39	66 Å²	66	15%	0.153	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-44.2	176.3	-179.9	-93.9	0	0	0	111.6	H955 F1016 N1018 L1019 M1026 F1079 V1081	H955-Y1022 HydrophobicContact CB-CE2 4.25Å; F1016-Y1022 HydrophobicContact CE1-CD1 4.14Å; F1016-Y1022 HydrophobicContact CE1-CD2 4.27Å; F1016-Y1022 AromaticContact CE1-CG 3.76Å; F1016-Y1022 HydrophobicContact CE1-CG 3.76Å; F1016-Y1022 AromaticContact CZ-CD1 3.73Å; F1016-Y1022 HydrophobicContact CZ-CD1 3.73Å; F1016-Y1022 HydrophobicContact CZ-CD2 4.15Å; F1016-Y1022 HydrophobicContact CZ-CE1 4.18Å; F1016-Y1022 AromaticContact CZ-CG 3.73Å; F1016-Y1022 HydrophobicContact CZ-CG 3.73Å; N1018-Y1022 PolarHBondContact O-N 3.06Å; L1019-Y1022 PolarHBondContact O-N 3.43Å; Y1022-M1026 HydrophobicContact CE1-CE 4.11Å; Y1022-M1026 PolarHBondContact O-N 2.9Å; Y1022-M1026 VanDerWaalsContact O-N 3.11Å; Y1022-F1079 HydrophobicContact CE1-CE2 4.27Å; Y1022-V1081 HydrophobicContact CE1-CG2 4.15Å
1023	E	68.3	Low	72.8	Confident	31 Å²	31	71 Å²	71	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-63.7	-43.5	173	-73.5	-167.1	-170.6	0	0	112.4	L1019 N1025 M1026 K1031 V1081 Y1084	L1019-E1023 HydrophobicContact CD1-CG 4.36Å; L1019-E1023 HydrophobicContact CG-CG 4.34Å; L1019-E1023 WeakPolarHBondContact O-CB 3.11Å; L1019-E1023 WeakPolarHBondContact O-CG 3.03Å; L1019-E1023 PolarHBondContact O-N 3.24Å; E1023-N1025 VanDerWaalsContact C-N 3.34Å; E1023-N1025 PolarHBondContact O-N 2.96Å; E1023-M1026 VanDerWaalsContact O-CB 3.29Å; E1023-M1026 WeakPolarHBondContact O-CB 3.45Å; E1023-M1026 PolarHBondContact O-N 3.42Å; E1023-K1031 WeakPolarHBondContact O-CE 3.39Å; E1023-K1031 PolarHBondContact O-NZ 3.08Å; E1023-V1081 HydrophobicContact CG-CG1 3.94Å; E1023-Y1084 HydrophobicContact CB-CE2 4.42Å; E1023-Y1084 WeakPolarHBondContact OE2-CE2 3.21Å; E1023-Y1084 PolarHBondContact OE2-OH 2.63Å
1024	S	65.8	Low	71.9	Confident	78 Å²	78	69.9 Å²	69.9	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-59	-45.6	178.8	-68.4	0	0	0	0	111.7	E1020 N1021 M1026 K1031	E1020-S1024 WeakPolarHBondContact O-CB 3.44Å; E1020-S1024 PolarHBondContact O-N 2.83Å; E1020-S1024 PolarHBondContact O-OG 2.83Å; N1021-S1024 PolarHBondContact O-N 2.64Å; S1024-M1026 VanDerWaalsContact C-N 3.31Å; S1024-M1026 PolarHBondContact O-N 2.75Å; S1024-K1031 PolarHBondContact O-NZ 3.25Å
1025	N	67.6	Low	71.3	Confident	115 Å²	115	70.5 Å²	70.5	62%	0.615	36%	0.357	S	S	*	.	H	α-helix	trans	-81.3	-3.5	179.9	-65.2	-56.2	0	0	0	114.3	N1021 E1023	N1021-N1025 WeakPolarHBondContact O-CB 3.43Å; N1021-N1025 PolarHBondContact O-N 2.97Å; N1021-N1025 PolarHBondContact O-ND2 2.99Å; N1021-N1025 PolarHBondContact OD1-ND2 2.98Å; E1023-N1025 VanDerWaalsContact C-N 3.34Å; E1023-N1025 PolarHBondContact O-N 2.96Å
1026	M	71.4	Confident	70.9	Confident	11 Å²	11	74.5 Å²	74.5	5%	0.054	38%	0.375	C	S	.	.	S	Bend	trans	-60.3	132.5	-179.5	-178.4	-176.3	-63.8	0	0	111.7	Y1022 E1023 S1024 K1030 K1031 V1035 V1081	Y1022-M1026 HydrophobicContact CE1-CE 4.11Å; Y1022-M1026 PolarHBondContact O-N 2.9Å; Y1022-M1026 VanDerWaalsContact O-N 3.11Å; E1023-M1026 VanDerWaalsContact O-CB 3.29Å; E1023-M1026 WeakPolarHBondContact O-CB 3.45Å; E1023-M1026 PolarHBondContact O-N 3.42Å; S1024-M1026 VanDerWaalsContact C-N 3.31Å; S1024-M1026 PolarHBondContact O-N 2.75Å; M1026-K1030 HydrophobicContact CG-CB 3.65Å; M1026-K1030 HydrophobicContact SD-CB 3.78Å; M1026-K1031 HydrophobicContact CB-CG 4.19Å; M1026-K1031 HydrophobicContact CG-CG 4.1Å; M1026-K1031 WeakPolarHBondContact O-CE 3.18Å; M1026-K1031 PolarHBondContact O-NZ 3.06Å; M1026-K1031 HydrophobicContact SD-CG 3.98Å; M1026-V1035 HydrophobicContact CE-CB 4.19Å; M1026-V1035 HydrophobicContact CE-CG2 3.56Å; M1026-V1035 HydrophobicContact CG-CG2 4.44Å; M1026-V1035 HydrophobicContact SD-CG2 3.7Å; M1026-V1081 HydrophobicContact CE-CB 4.06Å; M1026-V1081 HydrophobicContact CE-CG1 3.69Å
1027	P	75.4	Confident	70.8	Confident	83 Å²	83	74.3 Å²	74.3	54%	0.539	38%	0.378	S	S	.	.			trans	-54.7	141.1	178.9	-28.7	35.5	0	0	0	113.3	L1029 K1030 K1031	P1027-L1029 VanDerWaalsContact C-N 3.29Å; P1027-L1029 PolarHBondContact O-N 2.81Å; P1027-L1029 VanDerWaalsContact O-N 3.1Å; P1027-K1030 HydrophobicContact CG-CD 4.46Å; P1027-K1030 WeakPolarHBondContact O-CB 3.46Å; P1027-K1030 PolarHBondContact O-N 2.89Å; P1027-K1031 PolarHBondContact O-N 2.73Å
1028	F	71	Confident	71.3	Confident	133 Å²	133	72.7 Å²	72.7	58%	0.583	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-45.5	-172.1	-178.3	-104.1	0	0	0	113.8	K1030 K1031 Y1032 L1087	F1028-K1030 PolarHBondContact O-N 3.41Å; F1028-K1031 PolarHBondContact O-N 2.57Å; F1028-Y1032 HydrophobicContact CD1-CE2 4.17Å; F1028-Y1032 HydrophobicContact CD2-CE2 4.46Å; F1028-Y1032 AromaticContact CE1-CE2 3.67Å; F1028-Y1032 HydrophobicContact CE1-CE2 3.67Å; F1028-Y1032 AromaticContact CE2-CE2 3.99Å; F1028-Y1032 HydrophobicContact CE2-CE2 3.99Å; F1028-Y1032 AromaticContact CZ-CE2 3.57Å; F1028-Y1032 HydrophobicContact CZ-CE2 3.57Å; F1028-Y1032 AromaticContact CZ-CZ 3.96Å; F1028-Y1032 WeakPolarHBondContact CZ-OH 3.46Å; F1028-Y1032 WeakPolarHBondContact O-CD2 3.4Å; F1028-L1087 HydrophobicContact CE2-CD2 4.33Å
1029	L	69.8	Low	71.9	Confident	135 Å²	135	69.2 Å²	69.2	71%	0.707	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-38	179.7	-141.3	78.6	0	0	0	113	P1027 K1031 Y1032 T1033	P1027-L1029 VanDerWaalsContact C-N 3.29Å; P1027-L1029 PolarHBondContact O-N 2.81Å; P1027-L1029 VanDerWaalsContact O-N 3.1Å; L1029-K1031 VanDerWaalsContact C-N 3.26Å; L1029-K1031 PolarHBondContact O-N 3.44Å; L1029-Y1032 WeakPolarHBondContact O-CB 3.23Å; L1029-Y1032 PolarHBondContact O-N 2.69Å; L1029-Y1032 VanDerWaalsContact O-N 3.11Å; L1029-T1033 PolarHBondContact O-N 2.83Å
1030	K	70.3	Confident	72.5	Confident	100 Å²	100	72.3 Å²	72.3	44%	0.435	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-26.5	179.3	-77.8	-176.4	164.5	-166.3	0	112.4	M1026 P1027 F1028 Y1032 T1033 G1034 V1035	M1026-K1030 HydrophobicContact CG-CB 3.65Å; M1026-K1030 HydrophobicContact SD-CB 3.78Å; P1027-K1030 HydrophobicContact CG-CD 4.46Å; P1027-K1030 WeakPolarHBondContact O-CB 3.46Å; P1027-K1030 PolarHBondContact O-N 2.89Å; F1028-K1030 PolarHBondContact O-N 3.41Å; K1030-Y1032 PolarHBondContact O-N 3.06Å; K1030-T1033 PolarHBondContact O-N 3.43Å; K1030-T1033 PolarHBondContact O-OG1 3.17Å; K1030-G1034 CarbonylContact O-C 3.54Å; K1030-G1034 WeakPolarHBondContact O-CA 3.36Å; K1030-G1034 PolarHBondContact O-N 3.26Å; K1030-V1035 HydrophobicContact CB-CG2 3.9Å; K1030-V1035 HydrophobicContact CD-CG2 3.8Å; K1030-V1035 HydrophobicContact CG-CG2 4.12Å
1031	K	71.4	Confident	73.4	Confident	38 Å²	38	65 Å²	65	17%	0.165	34%	0.335	C	S	.	.	H	α-helix	trans	-65.8	-19	173.3	-68	-179.9	171.7	169.3	0	113.4	E1023 S1024 M1026 P1027 F1028 L1029 Y1084 L1087	E1023-K1031 WeakPolarHBondContact O-CE 3.39Å; E1023-K1031 PolarHBondContact O-NZ 3.08Å; S1024-K1031 PolarHBondContact O-NZ 3.25Å; M1026-K1031 HydrophobicContact CB-CG 4.19Å; M1026-K1031 HydrophobicContact CG-CG 4.1Å; M1026-K1031 WeakPolarHBondContact O-CE 3.18Å; M1026-K1031 PolarHBondContact O-NZ 3.06Å; M1026-K1031 HydrophobicContact SD-CG 3.98Å; P1027-K1031 PolarHBondContact O-N 2.73Å; F1028-K1031 PolarHBondContact O-N 2.57Å; L1029-K1031 VanDerWaalsContact C-N 3.26Å; L1029-K1031 PolarHBondContact O-N 3.44Å; K1031-Y1084 HydrophobicContact CB-CD2 4.45Å; K1031-Y1084 HydrophobicContact CG-CD2 4.42Å; K1031-Y1084 PolarHBondContact O-N 3.25Å; K1031-L1087 HydrophobicContact CB-CD2 4.09Å
1032	Y	65.9	Low	74.3	Confident	62 Å²	62	63.2 Å²	63.2	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-88.3	-38.2	171.9	-70.2	-95.9	0	0	0	113.1	F1028 L1029 K1030 Q1083 L1087 I1088 T1091	F1028-Y1032 HydrophobicContact CD1-CE2 4.17Å; F1028-Y1032 HydrophobicContact CD2-CE2 4.46Å; F1028-Y1032 AromaticContact CE1-CE2 3.67Å; F1028-Y1032 HydrophobicContact CE1-CE2 3.67Å; F1028-Y1032 AromaticContact CE2-CE2 3.99Å; F1028-Y1032 HydrophobicContact CE2-CE2 3.99Å; F1028-Y1032 AromaticContact CZ-CE2 3.57Å; F1028-Y1032 HydrophobicContact CZ-CE2 3.57Å; F1028-Y1032 AromaticContact CZ-CZ 3.96Å; F1028-Y1032 WeakPolarHBondContact CZ-OH 3.46Å; F1028-Y1032 WeakPolarHBondContact O-CD2 3.4Å; L1029-Y1032 WeakPolarHBondContact O-CB 3.23Å; L1029-Y1032 PolarHBondContact O-N 2.69Å; L1029-Y1032 VanDerWaalsContact O-N 3.11Å; K1030-Y1032 PolarHBondContact O-N 3.06Å; Y1032-Q1083 WeakPolarHBondContact O-CB 3.33Å; Y1032-Q1083 PolarHBondContact O-OE1 2.91Å; Y1032-L1087 HydrophobicContact CD2-CD2 4.22Å; Y1032-L1087 HydrophobicContact CE2-CD2 3.57Å; Y1032-L1087 HydrophobicContact CE2-CG 4.41Å; Y1032-I1088 HydrophobicContact CD1-CG1 3.8Å; Y1032-I1088 HydrophobicContact CE1-CG1 4.2Å; Y1032-T1091 VanDerWaalsContact OH-CG2 3.3Å; Y1032-T1091 WeakPolarHBondContact OH-CG2 3.46Å; Y1032-T1091 PolarHBondContact OH-OG1 3.3Å
1033	T	67.3	Low	75.2	Confident	109 Å²	109	61.4 Å²	61.4	67%	0.669	32%	0.319	S	S	*	.	H	α-helix	trans	-85.9	-19.9	-176.8	57.2	0	0	0	0	113.8	L1029 K1030	L1029-T1033 PolarHBondContact O-N 2.83Å; K1030-T1033 PolarHBondContact O-N 3.43Å; K1030-T1033 PolarHBondContact O-OG1 3.17Å
1034	G	68.9	Low	76.2	Confident	11 Å²	11	60.2 Å²	60.2	11%	0.113	31%	0.314	C	S	.	.			trans	72.3	-179.5	-157.3	0	0	0	0	0	111.5	K1030 V1081	K1030-G1034 CarbonylContact O-C 3.54Å; K1030-G1034 WeakPolarHBondContact O-CA 3.36Å; K1030-G1034 PolarHBondContact O-N 3.26Å; G1034-V1081 VanDerWaalsContact CA-O 3.29Å; G1034-V1081 WeakPolarHBondContact CA-O 3.35Å
1035	V	75.9	Confident	77.4	Confident	14 Å²	14	56.6 Å²	56.6	9%	0.085	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	133.3	177.3	176.3	0	0	0	0	109.7	M1026 K1030 F1079 K1080 V1081	M1026-V1035 HydrophobicContact CE-CB 4.19Å; M1026-V1035 HydrophobicContact CE-CG2 3.56Å; M1026-V1035 HydrophobicContact CG-CG2 4.44Å; M1026-V1035 HydrophobicContact SD-CG2 3.7Å; K1030-V1035 HydrophobicContact CB-CG2 3.9Å; K1030-V1035 HydrophobicContact CD-CG2 3.8Å; K1030-V1035 HydrophobicContact CG-CG2 4.12Å; V1035-F1079 HydrophobicContact CG1-CE2 4.22Å; V1035-K1080 CarbonylContact O-C 3.59Å; V1035-K1080 WeakPolarHBondContact O-CA 3.44Å; V1035-V1081 HydrophobicContact CB-CB 4.34Å; V1035-V1081 PolarHBondContact N-O 3.17Å; V1035-V1081 PolarHBondContact O-N 3.37Å
1036	H	77.4	Confident	78.4	Confident	119 Å²	119	52.1 Å²	52.1	55%	0.551	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.3	160.8	-161.2	-72.8	0	0	0	108	F1079	H1036-F1079 WeakPolarHBondContact CA-O 3.41Å
1037	G	78.6	Confident	79.3	Confident	14 Å²	14	51.6 Å²	51.6	14%	0.144	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	164.9	175.2	0	0	0	0	0	112.4	E1078 F1079	G1037-E1078 WeakPolarHBondContact O-CA 3.39Å; G1037-F1079 VanDerWaalsContact CA-CE1 3.48Å; G1037-F1079 PolarHBondContact N-O 3.16Å; G1037-F1079 WeakPolarHBondContact O-CD1 3.26Å; G1037-F1079 PolarHBondContact O-N 3.18Å
1038	E	83.4	Confident	79.9	Confident	94 Å²	94	50.1 Å²	50.1	44%	0.439	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.2	-178	-173.1	-167.5	171.6	0	0	106.9	K1040 T1076 V1077	E1038-K1040 VanDerWaalsContact CD-CE 3.5Å; E1038-K1040 WeakPolarHBondContact OE1-CE 3.37Å; E1038-K1040 IonicContact OE1-NZ 3.78Å; E1038-K1040 PolarHBondContact OE1-NZ 2.97Å; E1038-T1076 HydrophobicContact CG-CG2 3.4Å; E1038-T1076 WeakPolarHBondContact OE1-CG2 2.95Å; E1038-V1077 CarbonylContact C-O 3.51Å; E1038-V1077 WeakPolarHBondContact CA-O 3.49Å
1039	V	84.4	Confident	80.8	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.1	-179.8	179.3	0	0	0	0	109.2	L953 E954 H955 F957 V1077 F1079	L953-V1039 HydrophobicContact CB-CG1 3.73Å; L953-V1039 HydrophobicContact CD1-CG1 4.17Å; L953-V1039 HydrophobicContact CG-CG1 4.47Å; E954-V1039 HydrophobicContact CB-CG1 4.26Å; E954-V1039 HydrophobicContact CB-CG2 4.45Å; H955-V1039 HydrophobicContact CB-CG2 4.15Å; H955-V1039 WeakPolarHBondContact ND1-CG2 3.49Å; F957-V1039 HydrophobicContact CD2-CG2 4.31Å; V1039-V1077 HydrophobicContact CB-CB 4.29Å; V1039-V1077 PolarHBondContact N-O 3.48Å; V1039-V1077 PolarHBondContact O-N 2.81Å; V1039-F1079 HydrophobicContact CG2-CD1 4.24Å; V1039-F1079 HydrophobicContact CG2-CE1 3.9Å
1040	K	84	Confident	81.5	Confident	102 Å²	102	41.6 Å²	41.6	44%	0.443	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	106.3	-174.4	-65.2	-171.7	-177.9	-169.3	0	111.1	E1038 N1042 T1074	E1038-K1040 VanDerWaalsContact CD-CE 3.5Å; E1038-K1040 WeakPolarHBondContact OE1-CE 3.37Å; E1038-K1040 IonicContact OE1-NZ 3.78Å; E1038-K1040 PolarHBondContact OE1-NZ 2.97Å; K1040-N1042 PolarHBondContact O-N 3.18Å; K1040-N1042 PolarHBondContact O-ND2 2.86Å; K1040-T1074 HydrophobicContact CB-CG2 3.93Å; K1040-T1074 HydrophobicContact CD-CG2 4.18Å; K1040-T1074 HydrophobicContact CG-CG2 4.18Å
1041	F	86.8	Confident	81.8	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	119.4	164.6	176.9	-88.1	0	0	0	108.3	M927 F949 Q950 L953 I959 L1010 T1074 V1075	M927-F1041 HydrophobicContact CE-CD1 3.55Å; M927-F1041 HydrophobicContact CE-CE1 3.33Å; M927-F1041 HydrophobicContact CE-CZ 4.18Å; M927-F1041 HydrophobicContact SD-CE1 4.15Å; M927-F1041 HydrophobicContact SD-CZ 4.47Å; F949-F1041 HydrophobicContact CB-CE1 4.3Å; F949-F1041 HydrophobicContact CB-CE2 4.1Å; F949-F1041 HydrophobicContact CB-CZ 3.56Å; F949-F1041 AromaticContact CD2-CE2 3.9Å; F949-F1041 HydrophobicContact CD2-CE2 3.9Å; F949-F1041 AromaticContact CD2-CZ 3.78Å; F949-F1041 HydrophobicContact CD2-CZ 3.78Å; F949-F1041 HydrophobicContact CG-CE2 4.38Å; F949-F1041 AromaticContact CG-CZ 3.89Å; F949-F1041 HydrophobicContact CG-CZ 3.89Å; Q950-F1041 WeakPolarHBondContact O-CE2 3.45Å; L953-F1041 HydrophobicContact CD1-CB 4.04Å; L953-F1041 HydrophobicContact CD1-CD2 4.14Å; L953-F1041 HydrophobicContact CD2-CB 4.35Å; L953-F1041 HydrophobicContact CD2-CD2 4.06Å; I959-F1041 HydrophobicContact CB-CE2 4.48Å; I959-F1041 HydrophobicContact CD1-CE2 3.82Å; I959-F1041 HydrophobicContact CD1-CZ 4Å; I959-F1041 HydrophobicContact CG2-CE2 4.06Å; L1010-F1041 HydrophobicContact CD2-CE1 3.98Å; L1010-F1041 HydrophobicContact CD2-CZ 3.86Å; F1041-T1074 CarbonylContact O-C 3.58Å; F1041-T1074 WeakPolarHBondContact O-CA 3.23Å; F1041-V1075 HydrophobicContact CB-CB 4.32Å; F1041-V1075 HydrophobicContact CD1-CB 4.36Å; F1041-V1075 HydrophobicContact CD1-CG2 4.42Å; F1041-V1075 PolarHBondContact N-O 3.04Å; F1041-V1075 PolarHBondContact O-N 2.94Å
1042	N	86.4	Confident	82.3	Confident	36 Å²	36	39.9 Å²	39.9	19%	0.193	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	138.3	176.2	-63.1	-68.9	0	0	0	110	F949 W986 K1040 T1074	F949-N1042 WeakPolarHBondContact CA-O 3.25Å; W986-N1042 HydrophobicContact CH2-CB 3.45Å; W986-N1042 VanDerWaalsContact CH2-CB 3.45Å; W986-N1042 HydrophobicContact CZ2-CB 3.33Å; W986-N1042 HydrophobicContact CZ3-CB 4.41Å; K1040-N1042 PolarHBondContact O-N 3.18Å; K1040-N1042 PolarHBondContact O-ND2 2.86Å; N1042-T1074 WeakPolarHBondContact OD1-CG2 3.23Å; N1042-T1074 PolarHBondContact OD1-OG1 2.85Å
1043	S	89.4	Confident	83.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.1	167.8	62.3	0	0	0	0	111.2	Y931 F948 S1072 A1073	Y931-S1043 PolarHBondContact OH-O 2.89Å; Y931-S1043 PolarHBondContact OH-OG 2.66Å; F948-S1043 CarbonylContact O-C 3.4Å; F948-S1043 WeakPolarHBondContact O-CA 3.33Å; S1043-S1072 CarbonylContact O-C 3.59Å; S1043-S1072 VanDerWaalsContact O-CA 3.25Å; S1043-S1072 WeakPolarHBondContact O-CA 3.42Å; S1043-S1072 WeakPolarHBondContact O-CB 3.31Å; S1043-A1073 PolarHBondContact N-O 3.17Å; S1043-A1073 PolarHBondContact O-N 3.26Å
1044	T	89	Confident	84.1	Confident	7 Å²	7	35.6 Å²	35.6	4%	0.043	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	126.3	179.2	-57.5	0	0	0	0	109.3	F948 K1046 Q1071 S1072	F948-T1044 PolarHBondContact N-O 3.48Å; F948-T1044 PolarHBondContact O-N 2.72Å; T1044-K1046 HydrophobicContact CG2-CG 4.41Å; T1044-Q1071 CarbonylContact C-O 3.53Å; T1044-Q1071 WeakPolarHBondContact CA-O 3.3Å; T1044-S1072 WeakPolarHBondContact CG2-OG 3.39Å; T1044-S1072 PolarHBondContact OG1-OG 2.68Å
1045	I	90.3	Very high	84.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.6	167.3	-164.1	168.5	0	0	0	109.6	Y931 I933 V945 L947 V1008 Q1070 Q1071	Y931-I1045 HydrophobicContact CD1-CB 3.92Å; Y931-I1045 HydrophobicContact CD1-CG2 3.33Å; Y931-I1045 HydrophobicContact CD2-CB 4.21Å; Y931-I1045 HydrophobicContact CD2-CD1 4.29Å; Y931-I1045 HydrophobicContact CD2-CG2 4.49Å; Y931-I1045 HydrophobicContact CE1-CB 4.06Å; Y931-I1045 HydrophobicContact CE1-CG2 3.65Å; Y931-I1045 HydrophobicContact CE2-CB 4.38Å; Y931-I1045 HydrophobicContact CG-CB 3.97Å; Y931-I1045 HydrophobicContact CG-CD1 3.94Å; Y931-I1045 HydrophobicContact CG-CG2 3.79Å; I933-I1045 HydrophobicContact CD1-CD1 4.2Å; V945-I1045 HydrophobicContact CG1-CD1 3.65Å; V945-I1045 HydrophobicContact CG1-CG1 3.6Å; L947-I1045 HydrophobicContact CD1-CB 3.91Å; L947-I1045 HydrophobicContact CD1-CD1 4.43Å; L947-I1045 HydrophobicContact CD1-CG1 4.08Å; V1008-I1045 HydrophobicContact CB-CD1 3.8Å; V1008-I1045 HydrophobicContact CG1-CD1 3.96Å; V1008-I1045 HydrophobicContact CG2-CD1 3.99Å; I1045-Q1070 VanDerWaalsContact O-CA 3.25Å; I1045-Q1070 WeakPolarHBondContact O-CA 3.36Å; I1045-Q1071 HydrophobicContact CG2-CB 3.8Å; I1045-Q1071 PolarHBondContact N-O 3.02Å; I1045-Q1071 PolarHBondContact O-N 3.4Å
1046	K	89.6	Confident	85.2	Confident	22 Å²	22	36.1 Å²	36.1	10%	0.096	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.4	167.2	-59.8	-167.2	-175.5	178.5	0	109.6	S946 F948 G983 T1044 V1069 Q1070	S946-K1046 PolarHBondContact N-O 3.06Å; S946-K1046 PolarHBondContact O-N 3.46Å; F948-K1046 HydrophobicContact CD2-CD 4.43Å; F948-K1046 HydrophobicContact CD2-CG 4.24Å; F948-K1046 HydrophobicContact CE2-CB 4.2Å; F948-K1046 HydrophobicContact CE2-CD 3.8Å; F948-K1046 HydrophobicContact CE2-CG 3.85Å; G983-K1046 PolarHBondContact O-NZ 3.49Å; T1044-K1046 HydrophobicContact CG2-CG 4.41Å; K1046-V1069 CarbonylContact C-O 3.38Å; K1046-V1069 WeakPolarHBondContact CA-O 3.47Å; K1046-Q1070 HydrophobicContact CG-CB 3.98Å
1047	V	90.1	Very high	84.9	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	111.3	178.6	-174.5	0	0	0	0	108.1	M903 T905 I933 I943 T1068 V1069	M903-V1047 HydrophobicContact CE-CG1 4.21Å; M903-V1047 HydrophobicContact SD-CB 4.44Å; M903-V1047 HydrophobicContact SD-CG1 3.82Å; T905-V1047 HydrophobicContact CG2-CG2 4Å; I933-V1047 HydrophobicContact CD1-CG2 3.66Å; I933-V1047 HydrophobicContact CG1-CG2 4.12Å; I943-V1047 HydrophobicContact CB-CG1 3.86Å; I943-V1047 HydrophobicContact CD1-CG1 3.66Å; I943-V1047 HydrophobicContact CG1-CG1 4.34Å; I943-V1047 HydrophobicContact CG2-CG1 3.96Å; V1047-T1068 VanDerWaalsContact O-CA 3.25Å; V1047-T1068 WeakPolarHBondContact O-CA 3.46Å; V1047-V1069 PolarHBondContact N-O 3.01Å; V1047-V1069 PolarHBondContact O-N 3.45Å
1048	H	88.7	Confident	84.3	Confident	51 Å²	51	36.1 Å²	36.1	24%	0.236	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.7	179	-53.9	-100.4	0	0	0	110.3	I943 N944 S946 T1068	I943-H1048 VanDerWaalsContact CA-O 3.28Å; I943-H1048 WeakPolarHBondContact CA-O 3.44Å; N944-H1048 PolarHBondContact N-O 2.84Å; N944-H1048 PolarHBondContact O-N 3.32Å; S946-H1048 WeakPolarHBondContact CB-NE2 3.28Å; S946-H1048 PolarHBondContact OG-CD2 2.98Å; S946-H1048 PolarHBondContact OG-NE2 3.16Å; H1048-T1068 HydrophobicContact CB-CG2 4.43Å; H1048-T1068 WeakPolarHBondContact ND1-CG2 3.34Å
1049	Y	89.1	Confident	83.4	Confident	18 Å²	18	34.3 Å²	34.3	7%	0.071	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.2	177.6	69.7	-82.2	0	0	0	111.5	M903 G1051 L1056 Q1059 Y1067	M903-Y1049 HydrophobicContact CE-CD1 3.49Å; M903-Y1049 VanDerWaalsContact CE-CD1 3.49Å; M903-Y1049 HydrophobicContact CE-CE1 4.05Å; M903-Y1049 HydrophobicContact CE-CG 4.16Å; Y1049-G1051 PolarHBondContact O-N 3.31Å; Y1049-L1056 HydrophobicContact CD1-CD1 4.11Å; Y1049-L1056 HydrophobicContact CD2-CD1 4.26Å; Y1049-L1056 HydrophobicContact CE1-CD1 3.79Å; Y1049-L1056 HydrophobicContact CE2-CD1 3.95Å; Y1049-L1056 HydrophobicContact CG-CD1 4.34Å; Y1049-Q1059 PolarHBondContact OH-OE1 3.3Å; Y1049-Q1059 VanDerWaalsContact OH-OE1 3.04Å; Y1049-Y1067 VanDerWaalsContact CD1-O 3.26Å; Y1049-Y1067 WeakPolarHBondContact CD1-O 3.2Å; Y1049-Y1067 WeakPolarHBondContact CE1-O 3.2Å; Y1049-Y1067 HydrophobicContact CE2-CD1 4.41Å; Y1049-Y1067 PolarHBondContact N-O 3.37Å
1050	N	85.5	Confident	82	Confident	71 Å²	71	39.2 Å²	39.2	38%	0.38	21%	0.205	S	C	.	.			trans	-80.3	90.7	-178.9	-177.3	13.9	0	0	0	112.8	T1052 R1053 Y1054	N1050-T1052 PolarHBondContact ND2-OG1 3.13Å; N1050-T1052 PolarHBondContact O-N 3.48Å; N1050-T1052 PolarHBondContact OD1-N 2.77Å; N1050-T1052 VanDerWaalsContact OD1-N 3.12Å; N1050-T1052 PolarHBondContact OD1-OG1 2.8Å; N1050-R1053 PolarHBondContact O-N 3.08Å; N1050-Y1054 HydrophobicContact CB-CD2 4.19Å; N1050-Y1054 WeakPolarHBondContact O-CD2 3.2Å; N1050-Y1054 PolarHBondContact O-N 3.47Å
1051	G	76.5	Confident	80.4	Confident	8 Å²	8	42 Å²	42	8%	0.082	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	1.1	177.2	0	0	0	0	0	117.6	Y1049 Y1054	Y1049-G1051 PolarHBondContact O-N 3.31Å; G1051-Y1054 WeakPolarHBondContact CA-O 3.06Å
1052	T	81	Confident	78.8	Confident	95 Å²	95	48.8 Å²	48.8	58%	0.583	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-36.7	168.5	69.1	0	0	0	0	112.4	K898 N1050	K898-T1052 WeakPolarHBondContact CE-O 3.34Å; N1050-T1052 PolarHBondContact ND2-OG1 3.13Å; N1050-T1052 PolarHBondContact O-N 3.48Å; N1050-T1052 PolarHBondContact OD1-N 2.77Å; N1050-T1052 VanDerWaalsContact OD1-N 3.12Å; N1050-T1052 PolarHBondContact OD1-OG1 2.8Å
1053	R	84.3	Confident	77	Confident	60 Å²	60	57 Å²	57	23%	0.226	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-22.4	-177.2	-164.8	171.7	-174.3	-163.6	0.2	113.3	W868 K898 Y899 N1050	W868-R1053 PolarHBondContact O-NH2 2.76Å; K898-R1053 CarbonylContact C-O 3.55Å; K898-R1053 VanDerWaalsContact CA-O 3.28Å; K898-R1053 WeakPolarHBondContact CA-O 3.29Å; Y899-R1053 PolarHBondContact N-O 2.75Å; N1050-R1053 PolarHBondContact O-N 3.08Å
1054	Y	86.9	Confident	74.8	Confident	20 Å²	20	64.5 Å²	64.5	8%	0.078	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.2	-177.3	-56	-81.7	0	0	0	112.3	Y899 V901 F941 P942 N1050 G1051	Y899-Y1054 CarbonylContact O-C 3.3Å; Y899-Y1054 WeakPolarHBondContact O-CA 3.46Å; V901-Y1054 HydrophobicContact CG1-CD1 3.62Å; V901-Y1054 HydrophobicContact CG1-CE1 4.42Å; V901-Y1054 HydrophobicContact CG1-CG 4.36Å; F941-Y1054 HydrophobicContact CB-CD1 3.69Å; F941-Y1054 HydrophobicContact CB-CD2 4.28Å; F941-Y1054 HydrophobicContact CB-CE1 3.46Å; F941-Y1054 VanDerWaalsContact CB-CE1 3.46Å; F941-Y1054 HydrophobicContact CB-CE2 4.1Å; F941-Y1054 HydrophobicContact CB-CG 4.09Å; F941-Y1054 HydrophobicContact CG-CD1 4.47Å; P942-Y1054 WeakPolarHBondContact CD-OH 3.45Å; P942-Y1054 HydrophobicContact CG-CE2 4.12Å; N1050-Y1054 HydrophobicContact CB-CD2 4.19Å; N1050-Y1054 WeakPolarHBondContact O-CD2 3.2Å; N1050-Y1054 PolarHBondContact O-N 3.47Å; G1051-Y1054 WeakPolarHBondContact CA-O 3.06Å
1055	V	85.3	Confident	73.2	Confident	35 Å²	35	72 Å²	72	21%	0.212	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122	-178.5	-178.3	0	0	0	0	109.6	L781 K898 Y899 S900 V901	L781-V1055 HydrophobicContact CD1-CB 4.11Å; L781-V1055 HydrophobicContact CD1-CG2 4Å; K898-V1055 HydrophobicContact CB-CG2 4.38Å; K898-V1055 HydrophobicContact CD-CG2 3.99Å; Y899-V1055 PolarHBondContact O-N 3.08Å; S900-V1055 WeakPolarHBondContact CA-O 3.43Å; V901-V1055 PolarHBondContact N-O 3.29Å
1056	L	81.4	Confident	71.7	Confident	2 Å²	2	77 Å²	77	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.1	179.7	-121	78.2	0	0	0	111.9	V901 M903 Y1049 S1058 Q1059 V1069	V901-L1056 HydrophobicContact CG2-CD1 3.78Å; V901-L1056 CarbonylContact O-C 3.53Å; V901-L1056 WeakPolarHBondContact O-CA 3.21Å; M903-L1056 HydrophobicContact CE-CD1 3.69Å; M903-L1056 HydrophobicContact CE-CD2 4.14Å; M903-L1056 HydrophobicContact CG-CD1 4.17Å; M903-L1056 HydrophobicContact CG-CD2 4.22Å; Y1049-L1056 HydrophobicContact CD1-CD1 4.11Å; Y1049-L1056 HydrophobicContact CD2-CD1 4.26Å; Y1049-L1056 HydrophobicContact CE1-CD1 3.79Å; Y1049-L1056 HydrophobicContact CE2-CD1 3.95Å; Y1049-L1056 HydrophobicContact CG-CD1 4.34Å; L1056-S1058 PolarHBondContact O-N 3.45Å; L1056-Q1059 HydrophobicContact CB-CB 4.31Å; L1056-Q1059 PolarHBondContact O-N 2.8Å; L1056-V1069 HydrophobicContact CD2-CG2 3.55Å
1057	S	72	Confident	71.1	Confident	32 Å²	32	79.7 Å²	79.7	22%	0.224	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-53.3	-37.6	178	-86.7	0	0	0	0	114.1	V901 E902 K1060	V901-S1057 PolarHBondContact O-N 2.78Å; E902-S1057 WeakPolarHBondContact OE2-CB 3.49Å; E902-S1057 PolarHBondContact OE2-OG 3.11Å; S1057-K1060 WeakPolarHBondContact O-CD 3.26Å; S1057-K1060 WeakPolarHBondContact O-CG 3.39Å; S1057-K1060 PolarHBondContact OG-NZ 3.34Å
1058	S	66.7	Low	70.6	Confident	100 Å²	100	80.6 Å²	80.6	70%	0.699	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-78.6	-25.9	-177.7	50.9	0	0	0	0	114.6	L1056	L1056-S1058 PolarHBondContact O-N 3.45Å
1059	Q	64	Low	70.3	Confident	56 Å²	56	79.4 Å²	79.4	26%	0.262	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-97.2	11.7	-174.2	-75.7	-178.7	-22.8	0	0	114.1	Y1049 L1056 N1061 E1062	Y1049-Q1059 PolarHBondContact OH-OE1 3.3Å; Y1049-Q1059 VanDerWaalsContact OH-OE1 3.04Å; L1056-Q1059 HydrophobicContact CB-CB 4.31Å; L1056-Q1059 PolarHBondContact O-N 2.8Å; Q1059-N1061 PolarHBondContact O-N 3.42Å; Q1059-E1062 PolarHBondContact O-N 3.04Å; Q1059-E1062 VanDerWaalsContact O-N 3.12Å
1060	K	55.5	Low	70.2	Confident	107 Å²	107	84.3 Å²	84.3	47%	0.465	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-14.2	-173.1	-78.1	173.4	178.3	149.3	0	116.4	S1057	S1057-K1060 WeakPolarHBondContact O-CD 3.26Å; S1057-K1060 WeakPolarHBondContact O-CG 3.39Å; S1057-K1060 PolarHBondContact OG-NZ 3.34Å
1061	N	49.8	Very low	70.3	Confident	161 Å²	161	84 Å²	84	86%	0.861	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	-3.9	-178.7	-71.2	-39.8	0	0	0	115.2	Q1059	Q1059-N1061 PolarHBondContact O-N 3.42Å
1062	E	52.5	Low	70.9	Confident	143 Å²	143	86.5 Å²	86.5	67%	0.668	44%	0.437	S	S	*	.			trans	-88.9	135.3	-174.4	-64.5	-161.4	119.6	0	0	112.7	Q1059	Q1059-E1062 PolarHBondContact O-N 3.04Å; Q1059-E1062 VanDerWaalsContact O-N 3.12Å
1063	K	48.5	Very low	71.2	Confident	208 Å²	208	82.5 Å²	82.5	90%	0.904	41%	0.414	S	S	*	.			trans	-88.4	-7.7	-177.6	-73.1	-176.8	177.1	176.4	0	114.4
1064	N	44.8	Very low	71.4	Confident	157 Å²	157	82.8 Å²	82.8	84%	0.84	42%	0.423	S	S	*	.			trans	-94	116.4	-172.5	-129.9	11.4	0	0	0	110.4	D1066	N1064-D1066 PolarHBondContact O-N 3Å
1065	K	55.6	Low	71.5	Confident	165 Å²	165	82 Å²	82	72%	0.717	42%	0.42	S	S	*	.			trans	-88.1	79.6	-176	-68.1	-174.8	174.1	-167.6	0	111.9	Y1067	K1065-Y1067 HydrophobicContact CB-CE2 4.25Å; K1065-Y1067 HydrophobicContact CD-CE2 4.27Å; K1065-Y1067 WeakPolarHBondContact CD-OH 3.27Å; K1065-Y1067 VanDerWaalsContact CE-OH 3.31Å; K1065-Y1067 WeakPolarHBondContact CE-OH 3.43Å; K1065-Y1067 HydrophobicContact CG-CE1 4.44Å; K1065-Y1067 HydrophobicContact CG-CE2 4.41Å
1066	D	58.6	Low	71.6	Confident	107 Å²	107	81.2 Å²	81.2	57%	0.572	42%	0.415	S	S	*	.			trans	-119.6	101.4	155.2	-160.3	-6.5	0	0	0	107.3	N1064 T1068	N1064-D1066 PolarHBondContact O-N 3Å; D1066-T1068 PolarHBondContact O-N 3.22Å; D1066-T1068 WeakPolarHBondContact OD1-CG2 3.1Å
1067	Y	76	Confident	71.8	Confident	78 Å²	78	81.1 Å²	81.1	31%	0.306	42%	0.415	S	S	.	.			trans	-78.8	62	-168.9	-62.2	-62.1	0	0	0	111.1	Y1049 K1065	Y1049-Y1067 VanDerWaalsContact CD1-O 3.26Å; Y1049-Y1067 WeakPolarHBondContact CD1-O 3.2Å; Y1049-Y1067 WeakPolarHBondContact CE1-O 3.2Å; Y1049-Y1067 HydrophobicContact CE2-CD1 4.41Å; Y1049-Y1067 PolarHBondContact N-O 3.37Å; K1065-Y1067 HydrophobicContact CB-CE2 4.25Å; K1065-Y1067 HydrophobicContact CD-CE2 4.27Å; K1065-Y1067 WeakPolarHBondContact CD-OH 3.27Å; K1065-Y1067 VanDerWaalsContact CE-OH 3.31Å; K1065-Y1067 WeakPolarHBondContact CE-OH 3.43Å; K1065-Y1067 HydrophobicContact CG-CE1 4.44Å; K1065-Y1067 HydrophobicContact CG-CE2 4.41Å
1068	T	79.4	Confident	72.4	Confident	18 Å²	18	83.5 Å²	83.5	11%	0.11	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.3	-172.5	68.1	0	0	0	0	112.1	V1047 H1048 D1066	V1047-T1068 VanDerWaalsContact O-CA 3.25Å; V1047-T1068 WeakPolarHBondContact O-CA 3.46Å; H1048-T1068 HydrophobicContact CB-CG2 4.43Å; H1048-T1068 WeakPolarHBondContact ND1-CG2 3.34Å; D1066-T1068 PolarHBondContact O-N 3.22Å; D1066-T1068 WeakPolarHBondContact OD1-CG2 3.1Å
1069	V	82.8	Confident	73.3	Confident	27 Å²	27	78.8 Å²	78.8	16%	0.164	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.1	163.3	170.7	0	0	0	0	107.7	M903 T905 K1046 V1047 L1056	M903-V1069 HydrophobicContact CE-CB 4.1Å; M903-V1069 HydrophobicContact CE-CG2 3.74Å; T905-V1069 HydrophobicContact CG2-CG1 3.82Å; T905-V1069 WeakPolarHBondContact OG1-CG1 3.17Å; K1046-V1069 CarbonylContact C-O 3.38Å; K1046-V1069 WeakPolarHBondContact CA-O 3.47Å; V1047-V1069 PolarHBondContact N-O 3.01Å; V1047-V1069 PolarHBondContact O-N 3.45Å; L1056-V1069 HydrophobicContact CD2-CG2 3.55Å
1070	Q	86.7	Confident	74	Confident	120 Å²	120	81.4 Å²	81.4	56%	0.561	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.5	-176.3	66.9	-179.1	-0.6	0	0	112.1	I1045 K1046	I1045-Q1070 VanDerWaalsContact O-CA 3.25Å; I1045-Q1070 WeakPolarHBondContact O-CA 3.36Å; K1046-Q1070 HydrophobicContact CG-CB 3.98Å
1071	Q	88.6	Confident	75	Confident	66 Å²	66	76.4 Å²	76.4	31%	0.308	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146	173	177.3	59.3	46.5	0	0	108.5	V907 Y931 T1044 I1045	V907-Q1071 HydrophobicContact CG2-CG 4.18Å; Y931-Q1071 HydrophobicContact CD1-CB 4.41Å; Y931-Q1071 HydrophobicContact CD1-CG 4.13Å; Y931-Q1071 HydrophobicContact CE1-CB 4.44Å; Y931-Q1071 HydrophobicContact CE1-CG 4.13Å; T1044-Q1071 CarbonylContact C-O 3.53Å; T1044-Q1071 WeakPolarHBondContact CA-O 3.3Å; I1045-Q1071 HydrophobicContact CG2-CB 3.8Å; I1045-Q1071 PolarHBondContact N-O 3.02Å; I1045-Q1071 PolarHBondContact O-N 3.4Å
1072	S	88.8	Confident	75.9	Confident	59 Å²	59	71.4 Å²	71.4	41%	0.413	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.3	175.6	-59.8	0	0	0	0	111.7	S1043 T1044	S1043-S1072 CarbonylContact O-C 3.59Å; S1043-S1072 VanDerWaalsContact O-CA 3.25Å; S1043-S1072 WeakPolarHBondContact O-CA 3.42Å; S1043-S1072 WeakPolarHBondContact O-CB 3.31Å; T1044-S1072 WeakPolarHBondContact CG2-OG 3.39Å; T1044-S1072 PolarHBondContact OG1-OG 2.68Å
1073	A	87.9	Confident	77	Confident	11 Å²	11	69.4 Å²	69.4	9%	0.091	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144	172.5	0	0	0	0	0	109.4	V907 T929 Y931 S1043	V907-A1073 HydrophobicContact CG1-CB 4.25Å; V907-A1073 HydrophobicContact CG2-CB 3.78Å; T929-A1073 HydrophobicContact CG2-CB 3.54Å; Y931-A1073 HydrophobicContact CE1-CB 4.16Å; Y931-A1073 WeakPolarHBondContact OH-CB 3.47Å; Y931-A1073 PolarHBondContact OH-N 2.83Å; S1043-A1073 PolarHBondContact N-O 3.17Å; S1043-A1073 PolarHBondContact O-N 3.26Å
1074	T	88.1	Confident	78.2	Confident	67 Å²	67	63.3 Å²	63.3	41%	0.411	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.2	177.5	-59.5	0	0	0	0	108.3	K1040 F1041 N1042	K1040-T1074 HydrophobicContact CB-CG2 3.93Å; K1040-T1074 HydrophobicContact CD-CG2 4.18Å; K1040-T1074 HydrophobicContact CG-CG2 4.18Å; F1041-T1074 CarbonylContact O-C 3.58Å; F1041-T1074 WeakPolarHBondContact O-CA 3.23Å; N1042-T1074 WeakPolarHBondContact OD1-CG2 3.23Å; N1042-T1074 PolarHBondContact OD1-OG1 2.85Å
1075	V	88	Confident	79.4	Confident	2 Å²	2	65 Å²	65	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.4	172.2	-179.1	0	0	0	0	108	V912 E913 L915 M927 F1041	V912-V1075 VanDerWaalsContact O-CG1 3.28Å; V912-V1075 WeakPolarHBondContact O-CG1 3.46Å; V912-V1075 WeakPolarHBondContact O-CG2 3.48Å; E913-V1075 CarbonylContact O-C 3.55Å; E913-V1075 WeakPolarHBondContact O-CA 3.43Å; L915-V1075 HydrophobicContact CD1-CG1 4.22Å; L915-V1075 HydrophobicContact CG-CG1 4.32Å; M927-V1075 HydrophobicContact CE-CB 4.36Å; M927-V1075 HydrophobicContact CE-CG2 3.6Å; F1041-V1075 HydrophobicContact CB-CB 4.32Å; F1041-V1075 HydrophobicContact CD1-CB 4.36Å; F1041-V1075 HydrophobicContact CD1-CG2 4.42Å; F1041-V1075 PolarHBondContact N-O 3.04Å; F1041-V1075 PolarHBondContact O-N 2.94Å
1076	T	87.3	Confident	80.1	Confident	20 Å²	20	66.9 Å²	66.9	12%	0.123	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.3	-178.9	-44.3	0	0	0	0	109.8	E913 N914 L915 E1038 E1078	E913-T1076 PolarHBondContact O-N 2.89Å; N914-T1076 CarbonylContact C-O 3.6Å; N914-T1076 VanDerWaalsContact CA-O 3.3Å; N914-T1076 WeakPolarHBondContact CA-O 3.23Å; N914-T1076 VanDerWaalsContact OD1-CB 3.24Å; N914-T1076 WeakPolarHBondContact OD1-CB 3.29Å; N914-T1076 PolarHBondContact OD1-OG1 2.77Å; L915-T1076 PolarHBondContact N-O 3.02Å; E1038-T1076 HydrophobicContact CG-CG2 3.4Å; E1038-T1076 WeakPolarHBondContact OE1-CG2 2.95Å; T1076-E1078 HydrophobicContact CG2-CG 4.4Å
1077	V	86.7	Confident	80.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	102.8	175	-175.2	0	0	0	0	107.9	L915 F917 F957 V1014 E1038 V1039	L915-V1077 HydrophobicContact CB-CG2 4.45Å; L915-V1077 HydrophobicContact CD1-CG2 4.33Å; L915-V1077 CarbonylContact O-C 3.57Å; L915-V1077 WeakPolarHBondContact O-CA 3.16Å; F917-V1077 HydrophobicContact CD2-CG1 3.57Å; F917-V1077 HydrophobicContact CE2-CG1 3.64Å; F957-V1077 HydrophobicContact CD1-CG1 4.18Å; F957-V1077 HydrophobicContact CE1-CG1 3.79Å; F957-V1077 HydrophobicContact CE2-CG1 4.4Å; F957-V1077 HydrophobicContact CZ-CG1 3.9Å; V1014-V1077 HydrophobicContact CG1-CG2 4.4Å; E1038-V1077 CarbonylContact C-O 3.51Å; E1038-V1077 WeakPolarHBondContact CA-O 3.49Å; V1039-V1077 HydrophobicContact CB-CB 4.29Å; V1039-V1077 PolarHBondContact N-O 3.48Å; V1039-V1077 PolarHBondContact O-N 2.81Å
1078	E	84.9	Confident	80.5	Confident	81 Å²	81	63.3 Å²	63.3	38%	0.379	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137.6	172.5	-63	-164	157.2	0	0	109.6	L915 F917 G1037 T1076	L915-E1078 PolarHBondContact O-N 3.23Å; F917-E1078 PolarHBondContact N-O 3.23Å; G1037-E1078 WeakPolarHBondContact O-CA 3.39Å; T1076-E1078 HydrophobicContact CG2-CG 4.4Å
1079	F	84.8	Confident	80.3	Confident	1 Å²	1	67.5 Å²	67.5	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.6	179.2	76.7	-85.5	0	0	0	112.8	F917 H955 F957 F1016 Y1022 V1035 H1036 G1037 V1039 V1081	F917-F1079 HydrophobicContact CB-CB 3.99Å; F917-F1079 WeakPolarHBondContact O-CA 3.35Å; H955-F1079 HydrophobicContact CB-CE1 3.99Å; H955-F1079 HydrophobicContact CB-CZ 3.83Å; H955-F1079 AromaticContact CD2-CZ 3.75Å; H955-F1079 AromaticContact CG-CE1 3.86Å; H955-F1079 AromaticContact CG-CZ 3.69Å; F957-F1079 HydrophobicContact CE2-CB 4.03Å; F957-F1079 AromaticContact CE2-CD1 3.75Å; F957-F1079 HydrophobicContact CE2-CD1 3.75Å; F957-F1079 HydrophobicContact CE2-CD2 4.46Å; F957-F1079 HydrophobicContact CE2-CE1 4.31Å; F957-F1079 AromaticContact CE2-CG 3.83Å; F957-F1079 HydrophobicContact CE2-CG 3.83Å; F957-F1079 HydrophobicContact CZ-CB 3.77Å; F957-F1079 HydrophobicContact CZ-CD1 4.35Å; F957-F1079 HydrophobicContact CZ-CG 4.1Å; F1016-F1079 HydrophobicContact CE2-CD2 4.25Å; Y1022-F1079 HydrophobicContact CE1-CE2 4.27Å; V1035-F1079 HydrophobicContact CG1-CE2 4.22Å; H1036-F1079 WeakPolarHBondContact CA-O 3.41Å; G1037-F1079 VanDerWaalsContact CA-CE1 3.48Å; G1037-F1079 PolarHBondContact N-O 3.16Å; G1037-F1079 WeakPolarHBondContact O-CD1 3.26Å; G1037-F1079 PolarHBondContact O-N 3.18Å; V1039-F1079 HydrophobicContact CG2-CD1 4.24Å; V1039-F1079 HydrophobicContact CG2-CE1 3.9Å; F1079-V1081 HydrophobicContact CD2-CG2 3.99Å; F1079-V1081 HydrophobicContact CE2-CG2 4.15Å
1080	K	79.2	Confident	79.9	Confident	111 Å²	111	68.7 Å²	68.7	48%	0.483	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	112.4	-173.3	-174	173	-175.5	173.1	0	110.5	F917 P919 Y922 V1035	F917-K1080 PolarHBondContact O-N 3.44Å; P919-K1080 WeakPolarHBondContact CD-O 3.4Å; P919-K1080 WeakPolarHBondContact CG-O 3.49Å; Y922-K1080 PolarHBondContact OH-O 3.25Å; V1035-K1080 CarbonylContact O-C 3.59Å; V1035-K1080 WeakPolarHBondContact O-CA 3.44Å
1081	V	76.4	Confident	79.4	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.018	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.8	179.4	-172.2	0	0	0	0	110.2	Y922 Y1022 E1023 M1026 G1034 V1035 F1079	Y922-V1081 WeakPolarHBondContact OH-CA 3.42Å; Y1022-V1081 HydrophobicContact CE1-CG2 4.15Å; E1023-V1081 HydrophobicContact CG-CG1 3.94Å; M1026-V1081 HydrophobicContact CE-CB 4.06Å; M1026-V1081 HydrophobicContact CE-CG1 3.69Å; G1034-V1081 VanDerWaalsContact CA-O 3.29Å; G1034-V1081 WeakPolarHBondContact CA-O 3.35Å; V1035-V1081 HydrophobicContact CB-CB 4.34Å; V1035-V1081 PolarHBondContact N-O 3.17Å; V1035-V1081 PolarHBondContact O-N 3.37Å; F1079-V1081 HydrophobicContact CD2-CG2 3.99Å; F1079-V1081 HydrophobicContact CE2-CG2 4.15Å
1082	P	68.3	Low	78.9	Confident	55 Å²	55	64 Å²	64	36%	0.357	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-74	157	-172.9	32.1	-37.8	0	0	0	113.1	P919 Y922	P919-P1082 HydrophobicContact CB-CB 4.27Å; P919-P1082 HydrophobicContact CB-CG 4.17Å; P919-P1082 HydrophobicContact CG-CB 4.21Å; P919-P1082 HydrophobicContact CG-CG 4.41Å; Y922-P1082 WeakPolarHBondContact OH-CD 3.33Å
1083	Q	75.5	Confident	78.5	Confident	102 Å²	102	65.2 Å²	65.2	48%	0.477	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-68.9	142.5	170.8	60.4	-178	-29.8	0	0	112.3	Y1032 R1085 I1088	Y1032-Q1083 WeakPolarHBondContact O-CB 3.33Å; Y1032-Q1083 PolarHBondContact O-OE1 2.91Å; Q1083-R1085 PolarHBondContact O-N 3.48Å; Q1083-I1088 HydrophobicContact CB-CD1 4.02Å; Q1083-I1088 HydrophobicContact CG-CD1 4.05Å; Q1083-I1088 VanDerWaalsContact OE1-CD1 3.25Å
1084	Y	74.4	Confident	78.2	Confident	80 Å²	80	68.8 Å²	68.8	31%	0.314	35%	0.352	S	S	.	.			trans	-74.8	85.1	-178	-93.2	-118.2	0	0	0	111.5	E1023 K1031 Y1086 L1087 I1088	E1023-Y1084 HydrophobicContact CB-CE2 4.42Å; E1023-Y1084 WeakPolarHBondContact OE2-CE2 3.21Å; E1023-Y1084 PolarHBondContact OE2-OH 2.63Å; K1031-Y1084 HydrophobicContact CB-CD2 4.45Å; K1031-Y1084 HydrophobicContact CG-CD2 4.42Å; K1031-Y1084 PolarHBondContact O-N 3.25Å; Y1084-Y1086 VanDerWaalsContact C-N 3.29Å; Y1084-Y1086 PolarHBondContact O-N 3.34Å; Y1084-Y1086 VanDerWaalsContact O-N 3.16Å; Y1084-L1087 WeakPolarHBondContact O-CB 3.48Å; Y1084-L1087 PolarHBondContact O-N 3.32Å; Y1084-I1088 PolarHBondContact O-N 3.5Å; Y1084-I1088 VanDerWaalsContact O-N 3.14Å
1085	R	68.6	Low	77.9	Confident	193 Å²	193	71.1 Å²	71.1	73%	0.728	36%	0.362	S	S	*	.	H	α-helix	trans	-49.3	-44.1	-176.3	-64.4	-174.7	-177.1	-178.2	2.6	113.4	Q1083 L1087 I1088 I1089	Q1083-R1085 PolarHBondContact O-N 3.48Å; R1085-L1087 PolarHBondContact O-N 3.19Å; R1085-I1088 PolarHBondContact O-N 3.2Å; R1085-I1089 WeakPolarHBondContact O-CD1 3.45Å; R1085-I1089 VanDerWaalsContact O-CG1 3.26Å; R1085-I1089 WeakPolarHBondContact O-CG1 3.49Å; R1085-I1089 PolarHBondContact O-N 3.24Å
1086	Y	71.2	Confident	77.6	Confident	203 Å²	203	72.9 Å²	72.9	80%	0.796	38%	0.38	S	S	*	.	H	α-helix	trans	-66.7	-33.1	178.5	-66.5	-68.4	0	0	0	113.6	Y1084 A1090	Y1084-Y1086 VanDerWaalsContact C-N 3.29Å; Y1084-Y1086 PolarHBondContact O-N 3.34Å; Y1084-Y1086 VanDerWaalsContact O-N 3.16Å; Y1086-A1090 WeakPolarHBondContact O-CB 3.3Å; Y1086-A1090 PolarHBondContact O-N 3.16Å
1087	L	72.9	Confident	77.3	Confident	51 Å²	51	78.2 Å²	78.2	27%	0.267	40%	0.402	S	S	.	.	H	α-helix	trans	-68.6	-42	176.4	-168.3	79	0	0	0	110.8	F1028 K1031 Y1032 Y1084 R1085 T1091	F1028-L1087 HydrophobicContact CE2-CD2 4.33Å; K1031-L1087 HydrophobicContact CB-CD2 4.09Å; Y1032-L1087 HydrophobicContact CD2-CD2 4.22Å; Y1032-L1087 HydrophobicContact CE2-CD2 3.57Å; Y1032-L1087 HydrophobicContact CE2-CG 4.41Å; Y1084-L1087 WeakPolarHBondContact O-CB 3.48Å; Y1084-L1087 PolarHBondContact O-N 3.32Å; R1085-L1087 PolarHBondContact O-N 3.19Å; L1087-T1091 WeakPolarHBondContact O-CB 3.46Å; L1087-T1091 PolarHBondContact O-N 3.18Å; L1087-T1091 PolarHBondContact O-OG1 3.46Å
1088	I	71	Confident	77.1	Confident	59 Å²	59	82.1 Å²	82.1	30%	0.303	42%	0.422	S	S	.	.	H	α-helix	trans	-62.3	-48	175.1	-64	163.6	0	0	0	110.3	Y1032 Q1083 Y1084 R1085 G1092	Y1032-I1088 HydrophobicContact CD1-CG1 3.8Å; Y1032-I1088 HydrophobicContact CE1-CG1 4.2Å; Q1083-I1088 HydrophobicContact CB-CD1 4.02Å; Q1083-I1088 HydrophobicContact CG-CD1 4.05Å; Q1083-I1088 VanDerWaalsContact OE1-CD1 3.25Å; Y1084-I1088 PolarHBondContact O-N 3.5Å; Y1084-I1088 VanDerWaalsContact O-N 3.14Å; R1085-I1088 PolarHBondContact O-N 3.2Å; I1088-G1092 PolarHBondContact O-N 3.38Å
1089	I	74.4	Confident	76.9	Confident	106 Å²	106	83.1 Å²	83.1	54%	0.544	43%	0.429	S	S	.	.	H	α-helix	trans	-62.9	-48.8	177.7	-67.6	163.3	0	0	0	110.9	R1085 T1091 G1092 V1093	R1085-I1089 WeakPolarHBondContact O-CD1 3.45Å; R1085-I1089 VanDerWaalsContact O-CG1 3.26Å; R1085-I1089 WeakPolarHBondContact O-CG1 3.49Å; R1085-I1089 PolarHBondContact O-N 3.24Å; I1089-T1091 PolarHBondContact O-N 3.36Å; I1089-G1092 PolarHBondContact O-N 2.94Å; I1089-V1093 HydrophobicContact CG2-CG2 4.43Å; I1089-V1093 WeakPolarHBondContact O-CG2 3.48Å; I1089-V1093 PolarHBondContact O-N 3.45Å
1090	A	74.3	Confident	76.8	Confident	53 Å²	53	87.9 Å²	87.9	44%	0.438	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-44.8	-178.5	0	0	0	0	0	112.3	Y1086 V1093 V1094	Y1086-A1090 WeakPolarHBondContact O-CB 3.3Å; Y1086-A1090 PolarHBondContact O-N 3.16Å; A1090-V1093 PolarHBondContact O-N 2.61Å; A1090-V1094 WeakPolarHBondContact O-CG2 3.14Å; A1090-V1094 PolarHBondContact O-N 3.42Å
1091	T	77	Confident	76.9	Confident	45 Å²	45	87.1 Å²	87.1	28%	0.276	46%	0.455	S	S	.	.	H	α-helix	trans	-70.9	-32.6	176.8	51	0	0	0	0	112.7	Y1032 L1087 I1089 V1094 L1095	Y1032-T1091 VanDerWaalsContact OH-CG2 3.3Å; Y1032-T1091 WeakPolarHBondContact OH-CG2 3.46Å; Y1032-T1091 PolarHBondContact OH-OG1 3.3Å; L1087-T1091 WeakPolarHBondContact O-CB 3.46Å; L1087-T1091 PolarHBondContact O-N 3.18Å; L1087-T1091 PolarHBondContact O-OG1 3.46Å; I1089-T1091 PolarHBondContact O-N 3.36Å; T1091-V1094 PolarHBondContact O-N 3.32Å; T1091-L1095 VanDerWaalsContact O-CB 3.29Å; T1091-L1095 WeakPolarHBondContact O-CB 3.33Å; T1091-L1095 WeakPolarHBondContact O-CG 3.14Å; T1091-L1095 PolarHBondContact O-N 3.25Å
1092	G	76.7	Confident	77.2	Confident	43 Å²	43	91 Å²	91	44%	0.443	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-43.1	169.1	0	0	0	0	0	113.3	I1088 I1089 G1096	I1088-G1092 PolarHBondContact O-N 3.38Å; I1089-G1092 PolarHBondContact O-N 2.94Å; G1092-G1096 PolarHBondContact O-N 3.41Å
1093	V	81.8	Confident	77.7	Confident	84 Å²	84	92.9 Å²	92.9	51%	0.509	48%	0.481	S	S	.	.	H	α-helix	trans	-66	-43.7	175.6	169.5	0	0	0	0	111.4	I1089 A1090 G1096 F1097	I1089-V1093 HydrophobicContact CG2-CG2 4.43Å; I1089-V1093 WeakPolarHBondContact O-CG2 3.48Å; I1089-V1093 PolarHBondContact O-N 3.45Å; A1090-V1093 PolarHBondContact O-N 2.61Å; V1093-G1096 PolarHBondContact O-N 2.74Å; V1093-F1097 HydrophobicContact CG1-CD2 4.41Å; V1093-F1097 PolarHBondContact O-N 3.01Å
1094	V	81.8	Confident	77.7	Confident	86 Å²	86	91.4 Å²	91.4	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-65.8	-45.5	178.1	169.9	0	0	0	0	111.4	A1090 T1091 G1096 F1097 I1098	A1090-V1094 WeakPolarHBondContact O-CG2 3.14Å; A1090-V1094 PolarHBondContact O-N 3.42Å; T1091-V1094 PolarHBondContact O-N 3.32Å; V1094-G1096 VanDerWaalsContact C-N 3.33Å; V1094-G1096 PolarHBondContact O-N 3.18Å; V1094-F1097 PolarHBondContact O-N 3.04Å; V1094-I1098 HydrophobicContact CG1-CD1 3.8Å; V1094-I1098 WeakPolarHBondContact O-CB 3.11Å; V1094-I1098 VanDerWaalsContact O-CG1 3.29Å; V1094-I1098 WeakPolarHBondContact O-CG1 3.34Å; V1094-I1098 PolarHBondContact O-N 3.38Å
1095	L	81.5	Confident	77.9	Confident	116 Å²	116	91 Å²	91	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-63.9	-38.1	174.5	-76.4	165.5	0	0	0	111.9	T1091 I1098 L1099	T1091-L1095 VanDerWaalsContact O-CB 3.29Å; T1091-L1095 WeakPolarHBondContact O-CB 3.33Å; T1091-L1095 WeakPolarHBondContact O-CG 3.14Å; T1091-L1095 PolarHBondContact O-N 3.25Å; L1095-I1098 PolarHBondContact O-N 2.92Å; L1095-L1099 VanDerWaalsContact O-CB 3.3Å; L1095-L1099 WeakPolarHBondContact O-CB 3.47Å; L1095-L1099 PolarHBondContact O-N 3.19Å
1096	G	80.5	Confident	78.3	Confident	39 Å²	39	85.9 Å²	85.9	40%	0.402	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-42.4	173.3	0	0	0	0	0	112.9	G1092 V1093 V1094 L1099 L1100	G1092-G1096 PolarHBondContact O-N 3.41Å; V1093-G1096 PolarHBondContact O-N 2.74Å; V1094-G1096 VanDerWaalsContact C-N 3.33Å; V1094-G1096 PolarHBondContact O-N 3.18Å; G1096-L1099 PolarHBondContact O-N 2.88Å; G1096-L1100 WeakPolarHBondContact O-CB 3.18Å; G1096-L1100 PolarHBondContact O-N 3.37Å
1097	F	81.7	Confident	78.4	Confident	132 Å²	132	80.8 Å²	80.8	58%	0.579	46%	0.455	S	S	*	.	H	α-helix	trans	-65.9	-42.4	173.9	-111.9	-85.7	0	0	0	112.2	V1093 V1094 L1099 L1100 I1101	V1093-F1097 HydrophobicContact CG1-CD2 4.41Å; V1093-F1097 PolarHBondContact O-N 3.01Å; V1094-F1097 PolarHBondContact O-N 3.04Å; F1097-L1099 VanDerWaalsContact C-N 3.35Å; F1097-L1100 PolarHBondContact O-N 3.26Å; F1097-I1101 WeakPolarHBondContact O-CB 3.47Å; F1097-I1101 VanDerWaalsContact O-CG1 3.26Å; F1097-I1101 WeakPolarHBondContact O-CG1 3.38Å; F1097-I1101 PolarHBondContact O-N 3.05Å
1098	I	81.9	Confident	78.1	Confident	82 Å²	82	87.6 Å²	87.6	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-42.6	175.4	-70.2	166.3	0	0	0	110.4	V1094 L1095 L1100 I1101 I1102	V1094-I1098 HydrophobicContact CG1-CD1 3.8Å; V1094-I1098 WeakPolarHBondContact O-CB 3.11Å; V1094-I1098 VanDerWaalsContact O-CG1 3.29Å; V1094-I1098 WeakPolarHBondContact O-CG1 3.34Å; V1094-I1098 PolarHBondContact O-N 3.38Å; L1095-I1098 PolarHBondContact O-N 2.92Å; I1098-L1100 PolarHBondContact O-N 3.17Å; I1098-I1101 PolarHBondContact O-N 3.43Å; I1098-I1102 HydrophobicContact CG2-CD1 3.82Å; I1098-I1102 WeakPolarHBondContact O-CB 3.43Å; I1098-I1102 VanDerWaalsContact O-CG1 3.28Å; I1098-I1102 WeakPolarHBondContact O-CG1 3.42Å; I1098-I1102 PolarHBondContact O-N 3.08Å
1099	L	82.1	Confident	78.1	Confident	101 Å²	101	94 Å²	94	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-41.4	174.7	-172.7	70.6	0	0	0	111.5	L1095 G1096 F1097 I1102 L1103	L1095-L1099 VanDerWaalsContact O-CB 3.3Å; L1095-L1099 WeakPolarHBondContact O-CB 3.47Å; L1095-L1099 PolarHBondContact O-N 3.19Å; G1096-L1099 PolarHBondContact O-N 2.88Å; F1097-L1099 VanDerWaalsContact C-N 3.35Å; L1099-I1102 PolarHBondContact O-N 3.16Å; L1099-L1103 HydrophobicContact CG-CD1 4.07Å; L1099-L1103 WeakPolarHBondContact O-CB 3.44Å; L1099-L1103 VanDerWaalsContact O-CG 3.27Å; L1099-L1103 WeakPolarHBondContact O-CG 3.5Å; L1099-L1103 PolarHBondContact O-N 2.7Å
1100	L	82.6	Confident	77.7	Confident	101 Å²	101	93.5 Å²	93.5	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-37.1	176	-170.1	119.8	0	0	0	112.2	G1096 F1097 I1098 T1104	G1096-L1100 WeakPolarHBondContact O-CB 3.18Å; G1096-L1100 PolarHBondContact O-N 3.37Å; F1097-L1100 PolarHBondContact O-N 3.26Å; I1098-L1100 PolarHBondContact O-N 3.17Å; L1100-T1104 WeakPolarHBondContact O-CB 3.42Å; L1100-T1104 WeakPolarHBondContact O-CG2 3.1Å; L1100-T1104 PolarHBondContact O-N 3.4Å; L1100-T1104 PolarHBondContact O-OG1 2.95Å
1101	I	81.2	Confident	77	Confident	95 Å²	95	92.4 Å²	92.4	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-44.2	172.2	-70.1	163.4	0	0	0	110.5	F1097 I1098 T1104 V1105	F1097-I1101 WeakPolarHBondContact O-CB 3.47Å; F1097-I1101 VanDerWaalsContact O-CG1 3.26Å; F1097-I1101 WeakPolarHBondContact O-CG1 3.38Å; F1097-I1101 PolarHBondContact O-N 3.05Å; I1098-I1101 PolarHBondContact O-N 3.43Å; I1101-T1104 WeakPolarHBondContact CA-OG1 3.49Å; I1101-T1104 PolarHBondContact O-N 3.45Å; I1101-T1104 PolarHBondContact O-OG1 3.34Å; I1101-T1104 VanDerWaalsContact O-OG1 3.06Å; I1101-V1105 WeakPolarHBondContact O-CB 3.28Å; I1101-V1105 VanDerWaalsContact O-CG2 3.28Å; I1101-V1105 WeakPolarHBondContact O-CG2 3.42Å; I1101-V1105 PolarHBondContact O-N 3.46Å
1102	I	82.1	Confident	76.2	Confident	85 Å²	85	94.4 Å²	94.4	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-45.5	175.9	-70.7	165.7	0	0	0	110.6	I1098 L1099 V1105 I1106	I1098-I1102 HydrophobicContact CG2-CD1 3.82Å; I1098-I1102 WeakPolarHBondContact O-CB 3.43Å; I1098-I1102 VanDerWaalsContact O-CG1 3.28Å; I1098-I1102 WeakPolarHBondContact O-CG1 3.42Å; I1098-I1102 PolarHBondContact O-N 3.08Å; L1099-I1102 PolarHBondContact O-N 3.16Å; I1102-V1105 PolarHBondContact O-N 3.38Å; I1102-I1106 HydrophobicContact CG2-CD1 3.75Å; I1102-I1106 HydrophobicContact CG2-CG1 4.49Å; I1102-I1106 WeakPolarHBondContact O-CB 3.03Å; I1102-I1106 VanDerWaalsContact O-CG1 3.24Å; I1102-I1106 WeakPolarHBondContact O-CG1 3.35Å; I1102-I1106 PolarHBondContact O-N 3Å
1103	L	79.3	Confident	75.4	Confident	95 Å²	95	99 Å²	99	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-39.5	177.7	-74.7	168.7	0	0	0	112.5	L1099 I1106 M1107	L1099-L1103 HydrophobicContact CG-CD1 4.07Å; L1099-L1103 WeakPolarHBondContact O-CB 3.44Å; L1099-L1103 VanDerWaalsContact O-CG 3.27Å; L1099-L1103 WeakPolarHBondContact O-CG 3.5Å; L1099-L1103 PolarHBondContact O-N 2.7Å; L1103-I1106 PolarHBondContact O-N 3.35Å; L1103-M1107 WeakPolarHBondContact O-CB 3.42Å; L1103-M1107 WeakPolarHBondContact O-CG 3.28Å; L1103-M1107 PolarHBondContact O-N 2.83Å
1104	T	75.7	Confident	73.8	Confident	71 Å²	71	103.8 Å²	103.8	44%	0.436	54%	0.539	S	S	.	.	H	α-helix	trans	-70.8	-36.1	175.7	47.2	0	0	0	0	112.3	L1100 I1101 M1107 W1108	L1100-T1104 WeakPolarHBondContact O-CB 3.42Å; L1100-T1104 WeakPolarHBondContact O-CG2 3.1Å; L1100-T1104 PolarHBondContact O-N 3.4Å; L1100-T1104 PolarHBondContact O-OG1 2.95Å; I1101-T1104 WeakPolarHBondContact CA-OG1 3.49Å; I1101-T1104 PolarHBondContact O-N 3.45Å; I1101-T1104 PolarHBondContact O-OG1 3.34Å; I1101-T1104 VanDerWaalsContact O-OG1 3.06Å; T1104-M1107 PolarHBondContact O-N 3.19Å; T1104-W1108 WeakPolarHBondContact O-CB 3.29Å; T1104-W1108 PolarHBondContact O-N 2.95Å
1105	V	77.4	Confident	72	Confident	71 Å²	71	111.4 Å²	111.4	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-39.5	170.3	168.8	0	0	0	0	111.6	I1101 I1102 W1108 K1109	I1101-V1105 WeakPolarHBondContact O-CB 3.28Å; I1101-V1105 VanDerWaalsContact O-CG2 3.28Å; I1101-V1105 WeakPolarHBondContact O-CG2 3.42Å; I1101-V1105 PolarHBondContact O-N 3.46Å; I1102-V1105 PolarHBondContact O-N 3.38Å; V1105-W1108 PolarHBondContact O-N 3.16Å; V1105-K1109 WeakPolarHBondContact O-CB 3.46Å; V1105-K1109 PolarHBondContact O-N 3.12Å
1106	I	78.1	Confident	69.9	Low	86 Å²	86	115.3 Å²	115.3	44%	0.441	57%	0.57	S	S	.	*	H	α-helix	trans	-63.5	-49.6	173.2	-71.7	165.1	0	0	0	110.3	I1102 L1103 W1108 K1109 C1110	I1102-I1106 HydrophobicContact CG2-CD1 3.75Å; I1102-I1106 HydrophobicContact CG2-CG1 4.49Å; I1102-I1106 WeakPolarHBondContact O-CB 3.03Å; I1102-I1106 VanDerWaalsContact O-CG1 3.24Å; I1102-I1106 WeakPolarHBondContact O-CG1 3.35Å; I1102-I1106 PolarHBondContact O-N 3Å; L1103-I1106 PolarHBondContact O-N 3.35Å; I1106-W1108 PolarHBondContact O-N 3.05Å; I1106-K1109 PolarHBondContact O-N 2.96Å; I1106-K1109 VanDerWaalsContact O-N 3.14Å; I1106-C1110 WeakPolarHBondContact O-CB 3.45Å; I1106-C1110 PolarHBondContact O-N 3.27Å; I1106-C1110 PolarHBondContact O-SG 3Å
1107	M	71.8	Confident	68.1	Low	95 Å²	95	120.3 Å²	120.3	47%	0.468	59%	0.593	S	S	.	*	H	α-helix	trans	-57.4	-36.1	176	-71.4	-98.5	-77.6	0	0	112.6	L1103 T1104 G1111 C1112 F1113	L1103-M1107 WeakPolarHBondContact O-CB 3.42Å; L1103-M1107 WeakPolarHBondContact O-CG 3.28Å; L1103-M1107 PolarHBondContact O-N 2.83Å; T1104-M1107 PolarHBondContact O-N 3.19Å; M1107-G1111 PolarHBondContact O-N 2.61Å; M1107-C1112 PolarHBondContact O-N 3.03Å; M1107-F1113 HydrophobicContact CB-CE2 4.09Å
1108	W	67.6	Low	66	Low	195 Å²	195	121.5 Å²	121.5	74%	0.739	60%	0.604	S	S	*	*	H	α-helix	trans	-69.8	-45.2	174.9	-173.6	29	0	0	0	112.1	T1104 V1105 I1106 G1111	T1104-W1108 WeakPolarHBondContact O-CB 3.29Å; T1104-W1108 PolarHBondContact O-N 2.95Å; V1105-W1108 PolarHBondContact O-N 3.16Å; I1106-W1108 PolarHBondContact O-N 3.05Å; W1108-G1111 PolarHBondContact O-N 3.33Å; W1108-G1111 VanDerWaalsContact O-N 3.13Å
1109	K	71	Confident	63.7	Low	192 Å²	192	126.3 Å²	126.3	84%	0.835	63%	0.625	S	S	*	*	H	α-helix	trans	-65.3	-36.5	175.8	-114.5	-178.1	176.3	-178.4	0	113.1	V1105 I1106 G1111	V1105-K1109 WeakPolarHBondContact O-CB 3.46Å; V1105-K1109 PolarHBondContact O-N 3.12Å; I1106-K1109 PolarHBondContact O-N 2.96Å; I1106-K1109 VanDerWaalsContact O-N 3.14Å; K1109-G1111 PolarHBondContact O-N 3.21Å
1110	C	66.3	Low	61.3	Low	97 Å²	97	130.3 Å²	130.3	66%	0.655	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-0	174.3	-66.3	0	0	0	0	113.5	I1106	I1106-C1110 WeakPolarHBondContact O-CB 3.45Å; I1106-C1110 PolarHBondContact O-N 3.27Å; I1106-C1110 PolarHBondContact O-SG 3Å
1111	G	59.7	Low	58.9	Low	29 Å²	29	134 Å²	134	30%	0.299	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	88.7	2	165.9	0	0	0	0	0	116.3	M1107 W1108 K1109 F1113 K1114	M1107-G1111 PolarHBondContact O-N 2.61Å; W1108-G1111 PolarHBondContact O-N 3.33Å; W1108-G1111 VanDerWaalsContact O-N 3.13Å; K1109-G1111 PolarHBondContact O-N 3.21Å; G1111-F1113 PolarHBondContact O-N 2.93Å; G1111-K1114 PolarHBondContact O-N 2.84Å
1112	C	59.6	Low	56.5	Low	88 Å²	88	136 Å²	136	60%	0.595	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-13.2	-175.4	-60.5	0	0	0	0	115	M1107	M1107-C1112 PolarHBondContact O-N 3.03Å
1113	F	60.1	Low	54.3	Low	140 Å²	140	140.7 Å²	140.7	61%	0.614	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	11.1	-179.9	-65.7	-79.1	0	0	0	114.4	M1107 G1111 R1115	M1107-F1113 HydrophobicContact CB-CE2 4.09Å; G1111-F1113 PolarHBondContact O-N 2.93Å; F1113-R1115 PolarHBondContact O-N 3.46Å
1114	K	48	Very low	51.9	Low	184 Å²	184	142.9 Å²	142.9	80%	0.8	69%	0.686	S	S	*	*			trans	-89.7	95.3	174.6	-74.9	-170.7	179.4	-179.2	0	112.2	G1111 K1116	G1111-K1114 PolarHBondContact O-N 2.84Å; K1114-K1116 PolarHBondContact O-N 2.86Å
1115	R	44.5	Very low	49.6	Very low	245 Å²	245	149.3 Å²	149.3	93%	0.925	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.8	125.4	168.2	-170.8	178.6	-173.1	177.4	2.1	110.2	F1113	F1113-R1115 PolarHBondContact O-N 3.46Å
1116	K	37.7	Very low	47.4	Very low	198 Å²	198	150.1 Å²	150.1	86%	0.861	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-103.7	153.9	161	-86.2	-168.8	171.6	-171.6	0	110	K1114	K1114-K1116 PolarHBondContact O-N 2.86Å
1117	T	41.4	Very low	45.1	Very low	144 Å²	144	152.2 Å²	152.2	88%	0.883	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-78.1	162.8	178.1	22.6	0	0	0	0	112.6
1118	I	38.7	Very low	43.1	Very low	158 Å²	158	156.3 Å²	156.3	81%	0.81	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-82	136.5	176.1	-59.8	153.6	0	0	0	108.4
1119	E	33	Very low	42	Very low	183 Å²	183	152.3 Å²	152.3	86%	0.855	75%	0.748	S	S	*	*			trans	168.3	89.8	135.6	-94.8	167.8	-157.2	0	0	110.4
1120	E	30.9	Very low	40	Very low	184 Å²	184	147.5 Å²	147.5	86%	0.86	75%	0.745	S	S	*	*				-160.7	119.7	128.4	-115.3	170.5	-176.1	0	0	111.1
1121	F	32.4	Very low	38.3	Very low	178 Å²	178	151.5 Å²	151.5	78%	0.781	75%	0.754	S	S	*	*			trans	15.9	116.9	154.4	-69.1	-95.7	0	0	0	119.4
1122	E	32	Very low	36.9	Very low	137 Å²	137	156.2 Å²	156.2	64%	0.64	78%	0.777	S	S	*	*				69.9	92.5	73.9	-80.1	-135.5	119	0	0	115.3	K1124	E1122-K1124 IonicContact OE1-NZ 2.82Å; E1122-K1124 PolarHBondContact OE1-NZ 2.94Å; E1122-K1124 IonicContact OE2-NZ 3.61Å; E1122-K1124 PolarHBondContact OE2-NZ 3.48Å
1123	E	35.8	Very low	35.7	Very low	184 Å²	184	161.8 Å²	161.8	86%	0.86	79%	0.791	S	S	*	*			trans	-167.1	109.3	131.4	-103.6	-177	163.9	0	0	106.9
1124	K	28.9	Very low	34.2	Very low	141 Å²	141	161.9 Å²	161.9	61%	0.613	80%	0.803	S	S	*	*				86.5	111.6	63.8	-77.8	172	174.8	124.3	0	113.6	E1122	E1122-K1124 IonicContact OE1-NZ 2.82Å; E1122-K1124 PolarHBondContact OE1-NZ 2.94Å; E1122-K1124 IonicContact OE2-NZ 3.61Å; E1122-K1124 PolarHBondContact OE2-NZ 3.48Å
1125	K	27.8	Very low	33.4	Very low	207 Å²	207	159 Å²	159	90%	0.9	81%	0.806	S	S	*	*			trans	74.5	144.6	171.9	-53.8	168	180	175.2	0	114.3
1126	A	29.8	Very low	32.6	Very low	88 Å²	88	152.1 Å²	152.1	73%	0.727	80%	0.796	S	S	*	*			cis	-173.5	158.2	-2.8	0	0	0	0	0	109
1127	D	30.5	Very low	32.5	Very low	129 Å²	129	148.7 Å²	148.7	69%	0.69	79%	0.791	S	S	*	*			cis	-168.7	173.2	-22.6	-133.5	-57.2	0	0	0	112.1
1128	F	29.3	Very low	32.6	Very low	182 Å²	182	147.1 Å²	147.1	80%	0.798	78%	0.784	S	S	*	*			trans	67.6	163.9	158.5	-83.5	-55.4	0	0	0	120.8
1129	P	45.1	Very low	32.2	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	77%	0.774	S	S	*	*				-136.5	-166.3	-122.2	48.8	-32.6	0	0	0	118
1130	A	28.1	Very low	32.2	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	77%	0.769	S	S	*	*			trans	82	157.2	165.7	0	0	0	0	0	116.4
1131	Q	31.4	Very low	32.2	Very low	180 Å²	180	139.7 Å²	139.7	84%	0.841	76%	0.758	S	S	*	*			cis	-147.6	178.9	7.3	-146.9	166.3	20.1	0	0	112.9
1132	T	30.7	Very low	32.1	Very low	129 Å²	129	139.6 Å²	139.6	79%	0.791	76%	0.758	S	S	*	*			trans	-25.9	145.9	179.6	36.4	0	0	0	0	121.4
1133	K	33	Very low	32.1	Very low	205 Å²	205	137.1 Å²	137.1	89%	0.891	76%	0.755	S	S	*	*			trans	-86.5	141.9	165	-65.2	179	178.1	179	0	113
1134	T	28.8	Very low	32	Very low	142 Å²	142	136.1 Å²	136.1	87%	0.871	75%	0.751	S	S	*	*			trans	-147.7	148.4	136.8	-0.1	0	0	0	0	109.6
1135	S	31.5	Very low	32	Very low	123 Å²	123	137.8 Å²	137.8	86%	0.86	76%	0.761	S	S	*	*			trans	-84.3	146.4	-169.1	50.1	0	0	0	0	114.1
1136	S	28.6	Very low	32.1	Very low	101 Å²	101	133.5 Å²	133.5	71%	0.706	75%	0.751	S	S	*	*			trans	-148.6	145.6	-177	55.5	0	0	0	0	113.2
1137	V	35.3	Very low	32.2	Very low	125 Å²	125	137.6 Å²	137.6	76%	0.758	76%	0.756	S	S	*	*			trans	65.2	174	138.8	169.7	0	0	0	0	115.5
1138	P	43.9	Very low	32.3	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	76%	0.759	S	S	*	*			cis	-103	176.7	-22	17	6.5	0	0	0	112.5
1139	S	29.5	Very low	32.4	Very low	87 Å²	87	137 Å²	137	61%	0.608	75%	0.751	S	S	*	*			cis	100.5	132.1	12	99.8	0	0	0	0	118.6
1140	H	33	Very low	31.8	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.745	75%	0.752	S	S	*	*			trans	66.3	159.3	153.2	-71.9	-60.1	0	0	0	119.9
1141	N	30.8	Very low	32	Very low	120 Å²	120	144.1 Å²	144.1	64%	0.642	75%	0.754	S	S	*	*			cis	-157.8	173.5	-0.1	-125.7	-16.9	0	0	0	115.1
1142	K	31.6	Very low	32.9	Very low	177 Å²	177	141 Å²	141	77%	0.77	75%	0.749	S	S	*	*			trans	-0.2	163.2	138.7	-70.4	179.3	176.7	-169.4	0	121.3
1143	S	31	Very low	33.2	Very low	84 Å²	84	142 Å²	142	59%	0.587	75%	0.749	S	S	*	*			cis	-174.2	171.9	-15.1	51	0	0	0	0	111.9
1144	E	32.8	Very low	33.5	Very low	163 Å²	163	138.7 Å²	138.7	76%	0.762	74%	0.741	S	S	*	*			trans	77.5	113	151.9	-73.8	156	136.8	0	0	125.3
1145	Q	29.1	Very low	33.9	Very low	177 Å²	177	135 Å²	135	83%	0.827	73%	0.725	S	S	*	*				68.4	154.3	125.8	-65.6	-164.9	-19.2	0	0	127
1146	V	30.7	Very low	34.2	Very low	116 Å²	116	135 Å²	135	70%	0.703	72%	0.715	S	S	*	*			trans	104.3	108.7	152.2	-170.6	0	0	0	0	120.4
1147	E	30.6	Very low	34.6	Very low	175 Å²	175	137.1 Å²	137.1	82%	0.818	71%	0.712	S	S	*	*			trans	37.1	159.3	132.2	-56.8	-178.8	143.7	0	0	123.1
1148	E	32.8	Very low	34.5	Very low	164 Å²	164	136.3 Å²	136.3	77%	0.766	70%	0.703	S	S	*	*			cis	-159.6	-168.6	-7	-128.7	-142	128.8	0	0	112.8
1149	E	32.7	Very low	33.9	Very low	133 Å²	133	138.6 Å²	138.6	62%	0.621	70%	0.702	S	S	*	*			trans	80	143	161.7	-55.9	-149.3	160.7	0	0	119.7
1150	K	31.1	Very low	33.9	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	71%	0.711	S	S	*	*			cis	-154.3	161.9	-8.9	-123.1	175.6	-164.5	139.5	0	112.8
1151	K	33	Very low	33.5	Very low	186 Å²	186	142.3 Å²	142.3	81%	0.809	72%	0.716	S	S	*	*			trans	-94.1	164.2	171.9	-87.7	-173.6	-179.8	177	0	113.4
1152	P	50.5	Low	34	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	72%	0.718	S	S	*	*				-121.2	-154.7	116.5	33.3	-27.7	0	0	0	112.2
1153	L	37.3	Very low	33.9	Very low	149 Å²	149	138.7 Å²	138.7	78%	0.78	72%	0.719	S	S	*	*				-146	165	-93.3	-124.3	72.2	0	0	0	107.3
1154	N	38.9	Very low	33.9	Very low	137 Å²	137	141 Å²	141	73%	0.733	73%	0.729	S	S	*	*			cis	-155.2	-174.1	-5.2	-147.9	11.9	0	0	0	106.3
1155	A	36.5	Very low	33.7	Very low	65 Å²	65	140.2 Å²	140.2	54%	0.537	73%	0.731	S	S	.	*			cis	-157.1	177.2	2.2	0	0	0	0	0	110.4
1156	D	38	Very low	33.7	Very low	123 Å²	123	138.4 Å²	138.4	66%	0.658	73%	0.732	S	S	*	*			trans	41.4	135.5	144.4	-80.9	18.8	0	0	0	123.2
1157	K	37.7	Very low	33.6	Very low	145 Å²	145	141.9 Å²	141.9	63%	0.63	74%	0.74	S	S	*	*			cis	-167.3	157	-8.1	-133.1	-177.7	-161.1	77.6	0	111.7
1158	D	34.1	Very low	33.5	Very low	107 Å²	107	137.2 Å²	137.2	57%	0.572	74%	0.739	S	S	*	*			trans	58.9	145.2	152.1	-71.6	-5.6	0	0	0	120
1159	K	31.4	Very low	33.2	Very low	161 Å²	161	136.9 Å²	136.9	70%	0.7	74%	0.743	S	S	*	*			cis	-164.4	155.1	-8.4	-117.2	166.3	-170.4	143	0	112.4
1160	V	28.1	Very low	32.8	Very low	133 Å²	133	135.9 Å²	135.9	81%	0.806	75%	0.749	S	S	*	*			trans	79.4	134.7	143.2	166.5	0	0	0	0	121
1161	K	25.3	Very low	32.7	Very low	193 Å²	193	135.1 Å²	135.1	84%	0.839	75%	0.748	S	S	*	*			trans	-84.9	-170.5	172.4	-91.5	-175.6	177.3	-175.9	0	110.5
1162	P	39.9	Very low	32.6	Very low	108 Å²	108	134.3 Å²	134.3	70%	0.701	75%	0.745	S	S	*	*			cis	-139.7	-177.3	10.8	44.6	-25.9	0	0	0	117.1
1163	S	30.7	Very low	31.7	Very low	112 Å²	112	136 Å²	136	78%	0.783	75%	0.753	S	S	*	*			trans	-79.7	150.3	157.8	51.8	0	0	0	0	112.6
1164	V	30.5	Very low	31.3	Very low	133 Å²	133	132 Å²	132	81%	0.806	75%	0.747	S	S	*	*			trans	-143.4	148.3	164.5	-168.2	0	0	0	0	109.6
1165	N	29.1	Very low	31.1	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	77%	0.772	S	S	*	*			trans	-87.1	162.1	174.8	-55.5	-18.2	0	0	0	111.9
1166	T	28.8	Very low	30.8	Very low	139 Å²	139	143 Å²	143	85%	0.853	78%	0.784	S	S	*	*			trans	-164	158	136.7	18.4	0	0	0	0	111.3
1167	E	29.1	Very low	30.4	Very low	188 Å²	188	144 Å²	144	88%	0.879	79%	0.791	S	S	*	*			trans	-72.5	171	171.9	-55.5	108.2	132.2	0	0	113.6
1168	G	27.7	Very low	30	Very low	77 Å²	77	143.9 Å²	143.9	79%	0.794	80%	0.8	S	S	*	*			trans	175.5	107.3	174	0	0	0	0	0	115.2
1169	D	27.5	Very low	29.8	Very low	157 Å²	157	146.1 Å²	146.1	84%	0.84	81%	0.813	S	S	*	*			trans	-60.7	155.3	-171.7	-65.9	-54.4	0	0	0	119.8
1170	C	24.8	Very low	29.7	Very low	113 Å²	113	145.2 Å²	145.2	76%	0.764	82%	0.82	S	S	*	*			trans	56.1	141.4	135.5	-67.7	0	0	0	0	125.3
1171	E	29.1	Very low	29.8	Very low	150 Å²	150	146 Å²	146	70%	0.701	82%	0.821	S	S	*	*			trans	55.3	118.7	148	-78.7	-170	-172.9	0	0	119.6
1172	K	29.4	Very low	30.1	Very low	170 Å²	170	142.6 Å²	142.6	74%	0.739	82%	0.82	S	S	*	*				-177.6	147.2	63.2	-115.9	144	179	134.9	0	114.1
1173	V	31.5	Very low	29.3	Very low	150 Å²	150	145.3 Å²	145.3	91%	0.909	83%	0.829	S	S	*	*			trans	40.3	123.7	136.8	-177.4	0	0	0	0	121
1174	G	29.1	Very low	29.2	Very low	63 Å²	63	148.1 Å²	148.1	65%	0.649	83%	0.833	S	S	*	*			trans	155.3	134	162.9	0	0	0	0	0	109.6
1175	F	34.3	Very low	29.1	Very low	290 Å²	290	149.5 Å²	149.5	100%	1.272	84%	0.835	S	S	*	*			cis	-122.8	0	4.6	-86	-105.6	0	0	0	111.3

Retrieved 1,175 of 1,175 residues in 240.1 ms (Link to these results)

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