A0A087YMC4_POEFO Loading...

Epidermal growth factor

AlphaFold DB , UniProt , Accession A0A087YMC4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,030 aa.

						>A0A087YMC4_POEFO|A0A087YMC4
CGWGRRAIRCWDLFSALVFFLVQSTGNLALSAACWDGRLSGSGRNSSCTPSQPFLLFGHGKSIHRMSLDGKNHRRLAAGTGSSILLDFHFREERLYWADRRTGIIYKASVQGAHRQKLYSSDKHISGLTVDWVGNGVFWTSSRKGQIKKMDLNGKNERTILRHLSQPSFINVDPTHRFLFWLSGGSEIQRFDLSGQMKMTVLKLEEQLEVLSVDQEDKRLFWVQLGLQGERLIASCDYSGNSLHIIDLPLQSQSLGISVFLENVYYTDAAAGVIRKINKYTGGRPVDVNDKPMVKPPVDIKVVHPLIQPMADTSSPFPVSPHLSCNDQSGSCVNVCSRLEELGVCQCSEGFALSNHGTHCEDVNECAHWNHGCSLGCENIPGSYFCTCPKGYTLLPDGRTCQEITPCGGIMKCGHGCIATEHGAVCVCPEGSVLQEDGHTCTGCSSADRGGCSQLCSSITPSRWECGCLPGYRLHQDGKRCIATGPPAFLIVANLMDVRRMNPDGTEEQTLVKEPRGTILALDFDPVYHRVYFASISQRTIERVDLNTGSRDVLVSDGLESPEGLAIDWVHHRMYWTDRSKSAVDCSTLDGLKRKTVVKEGLEEPRGIAVHPQAKKLFWTDTGAQPVVESATLEGSSRVIIASTGLMSPTGLTIDFTDDRLFWCDQKRGLIETAALDGSDRRVLIENQVGRPFDLAVFEDRLWISEWEHQQIRSVHKRTGQKLQRIHGSLVQPASVVVVHPLAKPGANVCLHLNGGCAQKCESNQGLSHCSCLPHFTLSADGKSCMSVSSSNVTVESGDETSDLTSLKNKTLHEAGFISDGGTKPVLFTEKMIAGNDQNDCYSLHCAVNARCVLDAENPRCLCQEGFTGDGQTCLGKAEITILNRNLAKLAVINAFTFDLAGVEPAQPEKMATNDQAVNKTLESTSLKATSQPSMDVTTRHHNSNSAEKCPSSHDAYCLYHGVCVYFPEIKSYACNCVRGYIGERCQFSDLEWLELQQAEKEKERNLVIGGCMVALISIISITACITYCF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	C	30.7	Very low	30.3	Very low	184 Å²	184	164.6 Å²	164.6	100%	1.243	85%	0.847	S	S	*	*				0	142.2	0	-58.2	0	0	0	0	109.7
2	G	39.7	Very low	30.5	Very low	83 Å²	83	162.9 Å²	162.9	86%	0.856	84%	0.84	S	S	*	*			trans	73.4	64.1	163.6	0	0	0	0	0	118.3
3	W	28	Very low	31	Very low	239 Å²	239	161.8 Å²	161.8	91%	0.905	84%	0.836	S	S	*	*			trans	-125.8	149.6	163.2	-83.5	39.1	0	0	0	107.6
4	G	27.5	Very low	31.2	Very low	74 Å²	74	161 Å²	161	76%	0.763	82%	0.823	S	S	*	*			cis	-152.3	-148	-5.1	0	0	0	0	0	107.5
5	R	30.7	Very low	31.4	Very low	227 Å²	227	155.5 Å²	155.5	86%	0.857	81%	0.805	S	S	*	*			cis	-160.4	166.5	-3.3	-126.4	-179.7	-171.6	-170.6	3.8	107.4
6	R	30.4	Very low	31.6	Very low	245 Å²	245	149.4 Å²	149.4	93%	0.925	78%	0.784	S	S	*	*			trans	-46.5	145.2	175.2	-59.3	166.8	175	168.3	-4	114
7	A	27.3	Very low	31.7	Very low	79 Å²	79	147 Å²	147	65%	0.653	77%	0.772	S	S	*	*				148.8	152.2	106	0	0	0	0	0	114.7
8	I	29.4	Very low	31.9	Very low	151 Å²	151	142.9 Å²	142.9	77%	0.774	75%	0.753	S	S	*	*			trans	72.6	141	154.2	-64.9	150.7	0	0	0	117.2
9	R	29.6	Very low	31.8	Very low	204 Å²	204	144.2 Å²	144.2	77%	0.77	75%	0.752	S	S	*	*			cis	-165.6	147.1	-23.9	-102.9	-178.5	-175.5	164.1	-1.2	107.6	W11	R9-W11 VanDerWaalsContact C-N 3.31Å; R9-W11 PolarHBondContact O-N 3.2Å
10	C	30.4	Very low	31.8	Very low	113 Å²	113	146.2 Å²	146.2	76%	0.764	76%	0.755	S	S	*	*			trans	32.7	22	133.9	-51	0	0	0	0	123.5
11	W	30.1	Very low	31.7	Very low	212 Å²	212	144.8 Å²	144.8	80%	0.803	75%	0.748	S	S	*	*			trans	-101.5	-39.1	-179.8	-107.8	29.5	0	0	0	114.8	R9 L13 F14 S15	R9-W11 VanDerWaalsContact C-N 3.31Å; R9-W11 PolarHBondContact O-N 3.2Å; W11-L13 VanDerWaalsContact C-N 3.32Å; W11-L13 PolarHBondContact O-N 2.63Å; W11-F14 PolarHBondContact O-N 3.45Å; W11-S15 PolarHBondContact O-N 3.41Å
12	D	33	Very low	31.7	Very low	144 Å²	144	141 Å²	141	77%	0.77	72%	0.719	S	S	*	*	H	α-helix	trans	-69.8	-26.6	-174.4	-59.6	-50.8	0	0	0	114.1	F14 A16	D12-F14 VanDerWaalsContact C-N 3.3Å; D12-F14 PolarHBondContact O-N 3.1Å; D12-A16 PolarHBondContact O-N 2.84Å
13	L	36.1	Very low	31.2	Very low	149 Å²	149	145 Å²	145	78%	0.78	72%	0.716	S	S	*	*	H	α-helix	trans	-74.6	-16.5	173.1	-89	158.6	0	0	0	113.6	W11	W11-L13 VanDerWaalsContact C-N 3.32Å; W11-L13 PolarHBondContact O-N 2.63Å
14	F	34.3	Very low	31.3	Very low	150 Å²	150	138.1 Å²	138.1	66%	0.658	70%	0.704	S	S	*	*	H	α-helix	trans	-88.9	-38.3	175.1	-125.5	-95.4	0	0	0	111.6	W11 D12 A16 L17 V18	W11-F14 PolarHBondContact O-N 3.45Å; D12-F14 VanDerWaalsContact C-N 3.3Å; D12-F14 PolarHBondContact O-N 3.1Å; F14-A16 VanDerWaalsContact C-N 3.31Å; F14-A16 PolarHBondContact O-N 3.4Å; F14-L17 PolarHBondContact O-N 2.81Å; F14-V18 HydrophobicContact CD1-CG2 4.29Å; F14-V18 WeakPolarHBondContact O-CG2 3.4Å; F14-V18 PolarHBondContact O-N 3.12Å
15	S	34	Very low	31.5	Very low	79 Å²	79	140.6 Å²	140.6	55%	0.552	71%	0.705	S	S	*	*	H	α-helix	trans	-61.4	-37.3	173.4	-70.8	0	0	0	0	112.8	W11 L17 F19	W11-S15 PolarHBondContact O-N 3.41Å; S15-L17 PolarHBondContact O-N 2.91Å; S15-F19 PolarHBondContact O-N 3.02Å; S15-F19 VanDerWaalsContact O-N 3.15Å
16	A	34.7	Very low	31.3	Very low	58 Å²	58	132.6 Å²	132.6	48%	0.479	69%	0.692	S	S	.	*	H	α-helix	trans	-67.3	-32.1	176.4	0	0	0	0	0	113.5	D12 F14	D12-A16 PolarHBondContact O-N 2.84Å; F14-A16 VanDerWaalsContact C-N 3.31Å; F14-A16 PolarHBondContact O-N 3.4Å
17	L	32.8	Very low	31.5	Very low	108 Å²	108	128.7 Å²	128.7	57%	0.565	69%	0.69	S	S	*	*	H	α-helix	trans	-79.9	-36.6	178	-125.1	81.9	0	0	0	112.5	F14 S15 F20 L21	F14-L17 PolarHBondContact O-N 2.81Å; S15-L17 PolarHBondContact O-N 2.91Å; L17-F20 PolarHBondContact O-N 2.85Å; L17-L21 PolarHBondContact O-N 3.13Å
18	V	35	Very low	31.5	Very low	73 Å²	73	132.7 Å²	132.7	44%	0.442	70%	0.699	S	S	.	*	H	α-helix	trans	-71.4	-33.3	178.6	175.5	0	0	0	0	111.6	F14 F20 L21 V22	F14-V18 HydrophobicContact CD1-CG2 4.29Å; F14-V18 WeakPolarHBondContact O-CG2 3.4Å; F14-V18 PolarHBondContact O-N 3.12Å; V18-F20 PolarHBondContact O-N 3.43Å; V18-L21 PolarHBondContact O-N 2.05Å; V18-L21 VanDerWaalsContact O-N 3.07Å; V18-V22 HydrophobicContact CG1-CG2 4.07Å; V18-V22 PolarHBondContact O-N 3.19Å
19	F	31.2	Very low	31.5	Very low	168 Å²	168	129.6 Å²	129.6	74%	0.737	70%	0.697	S	S	*	*	H	α-helix	trans	-64.6	-24.2	171.6	-131.6	-88.6	0	0	0	112.9	S15	S15-F19 PolarHBondContact O-N 3.02Å; S15-F19 VanDerWaalsContact O-N 3.15Å
20	F	31.3	Very low	31.5	Very low	184 Å²	184	128.2 Å²	128.2	81%	0.807	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-7.9	173.2	-101.7	-85.4	0	0	0	114.4	L17 V18	L17-F20 PolarHBondContact O-N 2.85Å; V18-F20 PolarHBondContact O-N 3.43Å
21	L	28.9	Very low	31.6	Very low	117 Å²	117	126.6 Å²	126.6	61%	0.613	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	0.8	-175.1	-82	164	0	0	0	115	L17 V18	L17-L21 PolarHBondContact O-N 3.13Å; V18-L21 PolarHBondContact O-N 2.05Å; V18-L21 VanDerWaalsContact O-N 3.07Å
22	V	31.3	Very low	32	Very low	104 Å²	104	118 Å²	118	63%	0.63	67%	0.667	S	S	*	*	S	Bend	trans	-120.1	11.7	178.7	-173.3	0	0	0	0	113.1	V18	V18-V22 HydrophobicContact CG1-CG2 4.07Å; V18-V22 PolarHBondContact O-N 3.19Å
23	Q	28.9	Very low	32.6	Very low	167 Å²	167	112.9 Å²	112.9	78%	0.78	65%	0.645	S	S	*	*	S	Bend	trans	-115.1	8.5	167.2	-85.2	-166.1	-15.6	0	0	114.9
24	S	30.8	Very low	33.3	Very low	95 Å²	95	106.3 Å²	106.3	66%	0.664	61%	0.612	S	S	*	*	S	Bend	trans	-91.3	-4.4	173.6	62.5	0	0	0	0	114.8
25	T	32.2	Very low	34.3	Very low	126 Å²	126	99.7 Å²	99.7	77%	0.773	58%	0.582	S	S	*	*			trans	-116.5	39.3	178.3	52.7	0	0	0	0	113
26	G	25	Very low	35.1	Very low	58 Å²	58	98.6 Å²	98.6	60%	0.598	57%	0.57	S	S	*	*			trans	-97.3	90.9	164.5	0	0	0	0	0	111.1	L28	G26-L28 PolarHBondContact O-N 2.66Å
27	N	34.4	Very low	35.6	Very low	163 Å²	163	99 Å²	99	87%	0.872	58%	0.58	S	S	*	*			trans	-66.4	74.4	163.6	-99.3	-44.3	0	0	0	109.6	A29	N27-A29 PolarHBondContact O-N 2.7Å
28	L	28	Very low	36.1	Very low	163 Å²	163	103.5 Å²	103.5	85%	0.853	59%	0.59	S	S	*	*			trans	-88.7	97.2	163	-88.7	161.5	0	0	0	107	G26 L30	G26-L28 PolarHBondContact O-N 2.66Å; L28-L30 PolarHBondContact O-N 2.7Å
29	A	29.4	Very low	36.3	Very low	87 Å²	87	104.6 Å²	104.6	72%	0.719	59%	0.593	S	S	*	*			trans	-49.5	123.7	177.9	0	0	0	0	0	110.1	N27 S31	N27-A29 PolarHBondContact O-N 2.7Å; A29-S31 PolarHBondContact O-N 2.87Å
30	L	30.4	Very low	36.5	Very low	174 Å²	174	100.7 Å²	100.7	91%	0.911	59%	0.586	S	S	*	*			trans	-62	90.2	152.9	-87	159.1	0	0	0	106.5	L28 A32	L28-L30 PolarHBondContact O-N 2.7Å; L30-A32 PolarHBondContact O-N 3.46Å
31	S	32.8	Very low	36.7	Very low	80 Å²	80	94.5 Å²	94.5	56%	0.559	58%	0.575	S	S	*	*			trans	-53.3	121.8	157.4	51	0	0	0	0	106.5	A29 A33	A29-S31 PolarHBondContact O-N 2.87Å; S31-A33 VanDerWaalsContact C-N 3.31Å; S31-A33 PolarHBondContact O-N 2.9Å
32	A	38.5	Very low	37.1	Very low	30 Å²	30	95.6 Å²	95.6	25%	0.248	59%	0.592	C	S	.	*			trans	-66.1	100.6	173.4	0	0	0	0	0	106.9	L30 L39 S46	L30-A32 PolarHBondContact O-N 3.46Å; A32-L39 HydrophobicContact CB-CD2 4.42Å; A32-L39 WeakPolarHBondContact O-CD2 3.34Å; A32-S46 WeakPolarHBondContact CB-O 3.11Å; A32-S46 VanDerWaalsContact CB-OG 3.22Å; A32-S46 WeakPolarHBondContact CB-OG 3.06Å
33	A	44	Very low	37.5	Very low	37 Å²	37	93.2 Å²	93.2	31%	0.306	59%	0.588	S	S	.	*			trans	-102.9	116.3	-173.2	0	0	0	0	0	107.4	S31 E93 Q111	S31-A33 VanDerWaalsContact C-N 3.31Å; S31-A33 PolarHBondContact O-N 2.9Å; A33-E93 VanDerWaalsContact O-CD 3.31Å; A33-Q111 VanDerWaalsContact C-NE2 3.35Å; A33-Q111 VanDerWaalsContact CB-OE1 3.23Å; A33-Q111 PolarHBondContact O-NE2 2.64Å; A33-Q111 VanDerWaalsContact O-NE2 3.14Å
34	C	50.5	Low	38	Very low	11 Å²	11	96.6 Å²	96.6	7%	0.074	59%	0.594	C	S	.	*			trans	-96.6	154.8	-176	-44.8	0	0	0	0	110.6	D36 G37 C48 E93	C34-D36 PolarHBondContact O-N 2.94Å; C34-G37 PolarHBondContact O-N 2.77Å; C34-C48 HydrophobicContact CB-CB 3.84Å; C34-C48 WeakPolarHBondContact CB-SG 3.46Å; C34-C48 WeakPolarHBondContact SG-CA 3.47Å; C34-C48 WeakPolarHBondContact SG-CB 3.48Å; C34-C48 CovalentContact SG-SG 2.04Å; C34-C48 PolarHBondContact SG-SG 2.88Å; C34-E93 VanDerWaalsContact C-OE1 3.23Å; C34-E93 WeakPolarHBondContact CA-OE1 3.17Å
35	W	55.4	Low	38.5	Very low	11 Å²	11	99.5 Å²	99.5	4%	0.042	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-43.9	-28.1	173	-73.9	85.6	0	0	0	115.6	F54 R65 R74 F88 F90 E93 V110 V303	W35-F54 HydrophobicContact CD2-CZ 4.14Å; W35-F54 HydrophobicContact CE3-CE1 4.11Å; W35-F54 HydrophobicContact CE3-CE2 4.26Å; W35-F54 AromaticContact CE3-CZ 3.35Å; W35-F54 HydrophobicContact CE3-CZ 3.35Å; W35-F54 HydrophobicContact CZ3-CE2 4.18Å; W35-F54 AromaticContact CZ3-CZ 3.6Å; W35-F54 HydrophobicContact CZ3-CZ 3.6Å; W35-R65 PolarHBondContact O-NH1 2.87Å; W35-R74 PolarHBondContact O-NH2 2.94Å; W35-F88 HydrophobicContact CH2-CB 4.45Å; W35-F90 PolarHBondContact NE1-O 2.74Å; W35-E93 VanDerWaalsContact CD1-CD 3.47Å; W35-E93 PolarHBondContact N-OE1 2.84Å; W35-V110 HydrophobicContact CD2-CG1 4.3Å; W35-V110 HydrophobicContact CD2-CG2 4.11Å; W35-V110 HydrophobicContact CE3-CB 4.12Å; W35-V110 HydrophobicContact CE3-CG1 3.54Å; W35-V110 HydrophobicContact CE3-CG2 3.58Å; W35-V110 HydrophobicContact CH2-CG2 3.34Å; W35-V110 HydrophobicContact CZ2-CG2 3.84Å; W35-V110 HydrophobicContact CZ3-CB 4.15Å; W35-V110 HydrophobicContact CZ3-CG1 3.84Å; W35-V110 HydrophobicContact CZ3-CG2 3.18Å; W35-V303 HydrophobicContact CH2-CG1 4.05Å; W35-V303 HydrophobicContact CZ2-CG1 4.32Å; W35-V303 HydrophobicContact CZ3-CG1 4.16Å
36	D	51	Low	38.7	Very low	57 Å²	57	95.2 Å²	95.2	31%	0.305	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.2	-3.5	178.6	-80.8	-27.6	0	0	0	116.3	C34 R38 R65	C34-D36 PolarHBondContact O-N 2.94Å; D36-R38 PolarHBondContact O-N 3.08Å; D36-R38 VanDerWaalsContact O-N 3.08Å; D36-R65 IonicContact OD1-CZ 2.73Å; D36-R65 IonicContact OD1-NH1 2.81Å; D36-R65 PolarHBondContact OD1-NH1 2.83Å; D36-R65 IonicContact OD1-NH2 3.57Å; D36-R65 PolarHBondContact OD1-NH2 2.78Å
37	G	46.2	Very low	39.4	Very low	67 Å²	67	96.8 Å²	96.8	69%	0.691	58%	0.579	S	S	*	*			trans	66.1	6.9	176	0	0	0	0	0	115.8	C34	C34-G37 PolarHBondContact O-N 2.77Å
38	R	42.3	Very low	39.7	Very low	202 Å²	202	92.2 Å²	92.2	76%	0.762	56%	0.559	S	S	*	*			trans	-96.6	105.9	173	-74.9	-172	177.3	-176.3	0.5	110.9	D36	D36-R38 PolarHBondContact O-N 3.08Å; D36-R38 VanDerWaalsContact O-N 3.08Å
39	L	39.6	Very low	40.2	Very low	96 Å²	96	88.1 Å²	88.1	50%	0.503	54%	0.541	S	S	.	.			trans	-78.8	131.2	161.5	-84.1	158.8	0	0	0	109.4	A32	A32-L39 HydrophobicContact CB-CD2 4.42Å; A32-L39 WeakPolarHBondContact O-CD2 3.34Å
40	S	35.9	Very low	40.9	Very low	85 Å²	85	89.9 Å²	89.9	59%	0.594	55%	0.545	S	S	*	.			trans	-117.6	124.2	163.1	-166.8	0	0	0	0	108.6
41	G	35.9	Very low	42	Very low	55 Å²	55	82.2 Å²	82.2	57%	0.567	51%	0.506	S	S	*	.			trans	122.4	123.7	-177	0	0	0	0	0	113.4
42	S	37.6	Very low	43.5	Very low	139 Å²	139	85.4 Å²	85.4	97%	0.972	51%	0.512	S	S	*	.	S	Bend	trans	-93.2	92.9	168.6	-177.9	0	0	0	0	109.1
43	G	39.8	Very low	45.5	Very low	54 Å²	54	85.6 Å²	85.6	56%	0.557	51%	0.511	S	S	*	.	S	Bend	trans	149.7	174.1	179.4	0	0	0	0	0	113.9	N45	G43-N45 PolarHBondContact O-N 3.41Å
44	R	39.2	Very low	47.5	Very low	239 Å²	239	83.8 Å²	83.8	90%	0.902	50%	0.496	S	S	*	.	S	Bend	trans	-61.8	-8.7	-172.2	-82.5	178.3	168.2	171.9	-5.5	116.2
45	N	39.6	Very low	49.4	Very low	155 Å²	155	83.3 Å²	83.3	83%	0.829	49%	0.492	S	S	*	.			trans	-106	88.8	173.6	-76.5	2.7	0	0	0	110.3	G43	G43-N45 PolarHBondContact O-N 3.41Å
46	S	37.9	Very low	51	Low	36 Å²	36	82.8 Å²	82.8	25%	0.252	49%	0.491	S	S	.	.			trans	-104.5	100.3	174.7	32.2	0	0	0	0	110	A32	A32-S46 WeakPolarHBondContact CB-O 3.11Å; A32-S46 VanDerWaalsContact CB-OG 3.22Å; A32-S46 WeakPolarHBondContact CB-OG 3.06Å
47	S	38.8	Very low	52.9	Low	91 Å²	91	80 Å²	80	64%	0.636	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-88.2	130.7	174.8	56.8	0	0	0	0	110.9	T49	S47-T49 PolarHBondContact O-N 3.15Å
48	C	41.5	Very low	54.9	Low	68 Å²	68	76.9 Å²	76.9	46%	0.459	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-68	123.7	169.3	-66.8	0	0	0	0	110.5	C34	C34-C48 HydrophobicContact CB-CB 3.84Å; C34-C48 WeakPolarHBondContact CB-SG 3.46Å; C34-C48 WeakPolarHBondContact SG-CA 3.47Å; C34-C48 WeakPolarHBondContact SG-CB 3.48Å; C34-C48 CovalentContact SG-SG 2.04Å; C34-C48 PolarHBondContact SG-SG 2.88Å
49	T	38.6	Very low	57.1	Low	76 Å²	76	68.8 Å²	68.8	47%	0.466	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-61.2	148.9	169	49.7	0	0	0	0	110.4	S47 S51	S47-T49 PolarHBondContact O-N 3.15Å; T49-S51 PolarHBondContact O-N 2.99Å
50	P	42.9	Very low	59.3	Low	125 Å²	125	65.1 Å²	65.1	81%	0.812	40%	0.4	S	S	*	.			trans	-54.8	113.8	176.3	22.6	-33.1	0	0	0	110
51	S	54	Low	61.7	Low	13 Å²	13	67.8 Å²	67.8	9%	0.091	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-70.6	130	-174.2	56.3	0	0	0	0	110.3	T49 F90	T49-S51 PolarHBondContact O-N 2.99Å; S51-F90 WeakPolarHBondContact OG-CZ 3.48Å
52	Q	64.6	Low	64.2	Low	146 Å²	146	66.1 Å²	66.1	68%	0.682	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-59.1	137.8	173.5	-70.5	-175.1	-29.1	0	0	110
53	P	81.2	Confident	66.6	Low	34 Å²	34	59.5 Å²	59.5	22%	0.221	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61.3	146.7	179.8	27.1	-36.1	0	0	0	111	L68 F260 V302 H304	P53-L68 HydrophobicContact CB-CD1 3.76Å; P53-L68 HydrophobicContact CB-CG 4.15Å; P53-L68 HydrophobicContact CG-CD1 3.55Å; P53-L68 HydrophobicContact CG-CG 4.16Å; P53-F260 HydrophobicContact CB-CD1 4.42Å; P53-F260 HydrophobicContact CB-CE1 3.72Å; P53-F260 HydrophobicContact CB-CZ 3.95Å; P53-F260 HydrophobicContact CG-CE1 3.75Å; P53-F260 HydrophobicContact CG-CZ 4.14Å; P53-V302 HydrophobicContact CB-CG1 4.42Å; P53-H304 HydrophobicContact CB-CB 4.18Å
54	F	85.5	Confident	68.9	Low	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	158.5	179.6	64.2	-94.6	0	0	0	111.4	W35 R65 M66 V303	W35-F54 HydrophobicContact CD2-CZ 4.14Å; W35-F54 HydrophobicContact CE3-CE1 4.11Å; W35-F54 HydrophobicContact CE3-CE2 4.26Å; W35-F54 AromaticContact CE3-CZ 3.35Å; W35-F54 HydrophobicContact CE3-CZ 3.35Å; W35-F54 HydrophobicContact CZ3-CE2 4.18Å; W35-F54 AromaticContact CZ3-CZ 3.6Å; W35-F54 HydrophobicContact CZ3-CZ 3.6Å; F54-R65 HydrophobicContact CB-CG 4.47Å; F54-R65 HydrophobicContact CD2-CB 4.43Å; F54-R65 HydrophobicContact CD2-CG 3.57Å; F54-R65 VanDerWaalsContact CD2-NE 3.34Å; F54-R65 HydrophobicContact CE2-CG 4.06Å; F54-R65 HydrophobicContact CG-CG 4.14Å; F54-M66 CarbonylContact C-O 3.52Å; F54-M66 WeakPolarHBondContact CB-O 3.23Å; F54-V303 HydrophobicContact CD1-CB 4.48Å; F54-V303 HydrophobicContact CD2-CB 4.12Å; F54-V303 HydrophobicContact CD2-CG2 4.34Å; F54-V303 HydrophobicContact CE1-CB 3.97Å; F54-V303 HydrophobicContact CE1-CG1 3.91Å; F54-V303 HydrophobicContact CE2-CB 3.57Å; F54-V303 HydrophobicContact CE2-CG1 4.01Å; F54-V303 HydrophobicContact CE2-CG2 3.69Å; F54-V303 HydrophobicContact CZ-CB 3.46Å; F54-V303 VanDerWaalsContact CZ-CB 3.46Å; F54-V303 HydrophobicContact CZ-CG1 3.41Å; F54-V303 VanDerWaalsContact CZ-CG1 3.41Å; F54-V303 HydrophobicContact CZ-CG2 4.01Å; F54-V303 PolarHBondContact N-O 2.91Å; F54-V303 PolarHBondContact O-N 3.22Å
55	L	89.3	Confident	71.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	140	174.5	-61.6	179.4	0	0	0	111.2	F57 R65 M66 L68 Y265 I274 V288 I300 V302	L55-F57 HydrophobicContact CB-CD1 4.31Å; L55-R65 VanDerWaalsContact O-CA 3.29Å; L55-R65 WeakPolarHBondContact O-CA 3.47Å; L55-M66 HydrophobicContact CD1-CE 3.91Å; L55-M66 PolarHBondContact N-O 3.2Å; L55-M66 PolarHBondContact O-N 2.82Å; L55-L68 HydrophobicContact CD2-CD2 3.77Å; L55-L68 HydrophobicContact CG-CD2 3.85Å; L55-Y265 HydrophobicContact CD1-CD1 4.41Å; L55-Y265 HydrophobicContact CD2-CD1 4.05Å; L55-Y265 HydrophobicContact CD2-CG 4.2Å; L55-I274 HydrophobicContact CD1-CD1 4.06Å; L55-I274 HydrophobicContact CD1-CG2 3.92Å; L55-V288 HydrophobicContact CD1-CG1 3.92Å; L55-I300 HydrophobicContact CD1-CD1 4.24Å; L55-I300 HydrophobicContact CD2-CD1 4.08Å; L55-I300 HydrophobicContact CD2-CG1 4.32Å; L55-V302 HydrophobicContact CD2-CB 4.5Å; L55-V302 HydrophobicContact CD2-CG2 3.62Å
56	L	90.5	Very high	73.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.5	168.5	-171.5	145.1	0	0	0	108.7	I63 H64 L76 L86 L95 I300 K301 V303	L56-I63 HydrophobicContact CD1-CG2 4.5Å; L56-I63 HydrophobicContact CD2-CG2 3.7Å; L56-I63 HydrophobicContact CG-CG2 3.94Å; L56-H64 WeakPolarHBondContact CA-O 3.19Å; L56-L76 HydrophobicContact CD1-CD1 3.63Å; L56-L76 HydrophobicContact CG-CD1 4.42Å; L56-L86 HydrophobicContact CD2-CD1 3.55Å; L56-L86 HydrophobicContact CD2-CD2 3.82Å; L56-L86 HydrophobicContact CD2-CG 4.22Å; L56-L95 HydrophobicContact CD1-CD1 4.02Å; L56-L95 HydrophobicContact CD1-CD2 4.48Å; L56-L95 HydrophobicContact CD2-CD1 3.58Å; L56-L95 HydrophobicContact CG-CD1 4.47Å; L56-I300 WeakPolarHBondContact O-CA 3.18Å; L56-K301 PolarHBondContact N-O 2.97Å; L56-K301 PolarHBondContact O-N 3.42Å; L56-V303 HydrophobicContact CB-CG2 3.93Å
57	F	90.6	Very high	75.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	153.3	-171.5	60.3	-83.4	0	0	0	112.6	L55 H59 I63 H64 M66 H73 I274 M293 P297 D299 I300	L55-F57 HydrophobicContact CB-CD1 4.31Å; F57-H59 HydrophobicContact CD2-CB 4.15Å; F57-H59 HydrophobicContact CE2-CB 3.98Å; F57-I63 WeakPolarHBondContact O-CA 3.42Å; F57-H64 HydrophobicContact CE1-CB 4.19Å; F57-H64 HydrophobicContact CE2-CB 3.98Å; F57-H64 HydrophobicContact CZ-CB 3.78Å; F57-H64 PolarHBondContact N-O 3.24Å; F57-H64 VanDerWaalsContact N-O 3.09Å; F57-H64 PolarHBondContact O-N 3.37Å; F57-M66 HydrophobicContact CE1-CB 3.81Å; F57-M66 HydrophobicContact CE1-CE 4.38Å; F57-M66 HydrophobicContact CZ-CB 4.47Å; F57-H73 AromaticContact CZ-NE2 3.63Å; F57-I274 HydrophobicContact CD1-CD1 3.92Å; F57-I274 HydrophobicContact CD2-CD1 4.35Å; F57-I274 HydrophobicContact CE1-CD1 4.14Å; F57-I274 HydrophobicContact CG-CD1 4.03Å; F57-I274 HydrophobicContact CZ-CD1 4.46Å; F57-M293 HydrophobicContact CE2-CE 3.72Å; F57-M293 HydrophobicContact CE2-SD 3.65Å; F57-M293 HydrophobicContact CZ-CE 3.64Å; F57-M293 HydrophobicContact CZ-SD 4.14Å; F57-P297 HydrophobicContact CD2-CB 3.9Å; F57-D299 VanDerWaalsContact CA-O 3.23Å; F57-D299 WeakPolarHBondContact CA-O 3.38Å; F57-D299 VanDerWaalsContact CB-O 3.27Å; F57-D299 WeakPolarHBondContact CB-O 3.21Å; F57-I300 HydrophobicContact CB-CB 4.41Å; F57-I300 HydrophobicContact CB-CG1 4.41Å
58	G	88.1	Confident	77.7	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140	170.5	0	0	0	0	0	111.4	P297 V298 D299	G58-P297 CarbonylContact O-C 3.47Å; G58-P297 VanDerWaalsContact O-CA 3.22Å; G58-P297 WeakPolarHBondContact O-CA 3.28Å; G58-V298 WeakPolarHBondContact CA-O 3.37Å; G58-V298 PolarHBondContact N-O 2.81Å; G58-V298 PolarHBondContact O-N 3.14Å; G58-D299 PolarHBondContact N-O 2.85Å
59	H	87.6	Confident	79.6	Confident	32 Å²	32	36.1 Å²	36.1	15%	0.148	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	120.6	173.4	174.7	-106.5	0	0	0	110.8	F57 K61 S62 H64 K295	F57-H59 HydrophobicContact CD2-CB 4.15Å; F57-H59 HydrophobicContact CE2-CB 3.98Å; H59-K61 PolarHBondContact O-N 3.16Å; H59-K61 VanDerWaalsContact O-N 3.12Å; H59-S62 PolarHBondContact N-O 2.74Å; H59-S62 PolarHBondContact O-N 2.89Å; H59-S62 VanDerWaalsContact O-O 3.09Å; H59-S62 PolarHBondContact O-OG 2.76Å; H59-H64 AromaticContact ND1-CE1 3.61Å; H59-K295 PolarHBondContact CD2-O 3Å; H59-K295 PolarHBondContact NE2-O 2.96Å
60	G	85.8	Confident	81.6	Confident	19 Å²	19	33.2 Å²	33.2	20%	0.196	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-101.8	-177.8	0	0	0	0	0	113.8	S82	G60-S82 WeakPolarHBondContact O-CA 3.29Å
61	K	86.9	Confident	83.2	Confident	140 Å²	140	32.8 Å²	32.8	61%	0.609	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.4	33.9	175	-67.9	-174.1	-179.9	178.2	0	111.1	H59 G79 T80 G81	H59-K61 PolarHBondContact O-N 3.16Å; H59-K61 VanDerWaalsContact O-N 3.12Å; K61-G79 WeakPolarHBondContact O-CA 3.37Å; K61-G79 PolarHBondContact O-N 3.2Å; K61-T80 VanDerWaalsContact C-OG1 3.27Å; K61-T80 PolarHBondContact O-N 2.97Å; K61-T80 VanDerWaalsContact O-N 3.12Å; K61-T80 PolarHBondContact O-OG1 2.95Å; K61-G81 WeakPolarHBondContact CA-O 3.48Å
62	S	87.6	Confident	84.4	Confident	20 Å²	20	37.9 Å²	37.9	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	159.9	-165.9	23.2	0	0	0	0	110.6	H59 H64 A77 T80	H59-S62 PolarHBondContact N-O 2.74Å; H59-S62 PolarHBondContact O-N 2.89Å; H59-S62 VanDerWaalsContact O-O 3.09Å; H59-S62 PolarHBondContact O-OG 2.76Å; S62-H64 PolarHBondContact OG-CE1 2.94Å; S62-H64 VanDerWaalsContact OG-CE1 3.31Å; S62-A77 CarbonylContact C-O 3.57Å; S62-A77 WeakPolarHBondContact CA-O 3.28Å; S62-A77 WeakPolarHBondContact CB-O 3.41Å; S62-T80 WeakPolarHBondContact CA-OG1 3.2Å; S62-T80 PolarHBondContact N-OG1 2.59Å
63	I	89.3	Confident	85.4	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.9	171.1	-63.8	166.5	0	0	0	108	L56 F57 L76 A77 T80 I84 L86 L95 W97	L56-I63 HydrophobicContact CD1-CG2 4.5Å; L56-I63 HydrophobicContact CD2-CG2 3.7Å; L56-I63 HydrophobicContact CG-CG2 3.94Å; F57-I63 WeakPolarHBondContact O-CA 3.42Å; I63-L76 PolarHBondContact O-N 2.79Å; I63-A77 HydrophobicContact CB-CB 4.25Å; I63-A77 PolarHBondContact N-O 3.41Å; I63-A77 PolarHBondContact O-N 3.13Å; I63-T80 HydrophobicContact CD1-CG2 3.94Å; I63-T80 HydrophobicContact CG1-CG2 4.02Å; I63-I84 HydrophobicContact CD1-CD1 3.84Å; I63-I84 HydrophobicContact CG1-CD1 3.43Å; I63-I84 VanDerWaalsContact CG1-CD1 3.43Å; I63-L86 HydrophobicContact CG1-CD2 4.49Å; I63-L86 HydrophobicContact CG2-CD2 4.44Å; I63-L95 HydrophobicContact CB-CD2 4.42Å; I63-L95 HydrophobicContact CD1-CD2 3.85Å; I63-L95 HydrophobicContact CD1-CG 4.49Å; I63-L95 HydrophobicContact CG2-CD2 3.96Å; I63-W97 HydrophobicContact CD1-CB 3.94Å; I63-W97 HydrophobicContact CD1-CD2 3.88Å; I63-W97 HydrophobicContact CD1-CE3 4.14Å; I63-W97 HydrophobicContact CD1-CG 3.8Å
64	H	88.4	Confident	85.5	Confident	20 Å²	20	38.6 Å²	38.6	9%	0.093	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	158.4	-177.5	-65.8	84.6	0	0	0	111.6	L56 F57 H59 S62 H73 R74 R75	L56-H64 WeakPolarHBondContact CA-O 3.19Å; F57-H64 HydrophobicContact CE1-CB 4.19Å; F57-H64 HydrophobicContact CE2-CB 3.98Å; F57-H64 HydrophobicContact CZ-CB 3.78Å; F57-H64 PolarHBondContact N-O 3.24Å; F57-H64 VanDerWaalsContact N-O 3.09Å; F57-H64 PolarHBondContact O-N 3.37Å; H59-H64 AromaticContact ND1-CE1 3.61Å; S62-H64 PolarHBondContact OG-CE1 2.94Å; S62-H64 VanDerWaalsContact OG-CE1 3.31Å; H64-H73 AromaticContact CD2-CD2 3.86Å; H64-H73 AromaticContact CD2-NE2 3.33Å; H64-H73 PolarHBondContact CD2-NE2 3.47Å; H64-H73 VanDerWaalsContact CD2-NE2 3.33Å; H64-H73 AromaticContact CG-NE2 3.5Å; H64-R74 CarbonylContact C-O 3.44Å; H64-R74 VanDerWaalsContact CA-O 3.3Å; H64-R74 WeakPolarHBondContact CA-O 3.41Å; H64-R75 VanDerWaalsContact CD2-CA 3.41Å; H64-R75 WeakPolarHBondContact CD2-CA 3.38Å
65	R	87.1	Confident	85.5	Confident	14 Å²	14	46.9 Å²	46.9	5%	0.053	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.7	170.6	163.8	171.9	-173.8	-151.5	-8.6	108.9	W35 D36 F54 L55 H73 R74 L76	W35-R65 PolarHBondContact O-NH1 2.87Å; D36-R65 IonicContact OD1-CZ 2.73Å; D36-R65 IonicContact OD1-NH1 2.81Å; D36-R65 PolarHBondContact OD1-NH1 2.83Å; D36-R65 IonicContact OD1-NH2 3.57Å; D36-R65 PolarHBondContact OD1-NH2 2.78Å; F54-R65 HydrophobicContact CB-CG 4.47Å; F54-R65 HydrophobicContact CD2-CB 4.43Å; F54-R65 HydrophobicContact CD2-CG 3.57Å; F54-R65 VanDerWaalsContact CD2-NE 3.34Å; F54-R65 HydrophobicContact CE2-CG 4.06Å; F54-R65 HydrophobicContact CG-CG 4.14Å; L55-R65 VanDerWaalsContact O-CA 3.29Å; L55-R65 WeakPolarHBondContact O-CA 3.47Å; R65-H73 CarbonylContact O-C 3.56Å; R65-H73 VanDerWaalsContact O-CA 3.29Å; R65-H73 WeakPolarHBondContact O-CA 3.36Å; R65-R74 HydrophobicContact CB-CG 4.14Å; R65-R74 PolarHBondContact N-O 3.44Å; R65-R74 PolarHBondContact O-N 2.97Å; R65-L76 HydrophobicContact CB-CD1 3.81Å; R65-L76 HydrophobicContact CB-CD2 4.21Å; R65-L76 HydrophobicContact CB-CG 3.93Å
66	M	86.9	Confident	85.2	Confident	1 Å²	1	49 Å²	49	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	145	175.1	-173.1	174.1	71.9	0	0	109.4	F54 L55 F57 G70 K71 H73 I274 V288 N289 M293	F54-M66 CarbonylContact C-O 3.52Å; F54-M66 WeakPolarHBondContact CB-O 3.23Å; L55-M66 HydrophobicContact CD1-CE 3.91Å; L55-M66 PolarHBondContact N-O 3.2Å; L55-M66 PolarHBondContact O-N 2.82Å; F57-M66 HydrophobicContact CE1-CB 3.81Å; F57-M66 HydrophobicContact CE1-CE 4.38Å; F57-M66 HydrophobicContact CZ-CB 4.47Å; M66-G70 WeakPolarHBondContact CG-O 3.47Å; M66-K71 WeakPolarHBondContact CG-O 3.04Å; M66-H73 HydrophobicContact CB-CB 4.45Å; M66-H73 HydrophobicContact CG-CB 4.17Å; M66-H73 HydrophobicContact SD-CB 4.39Å; M66-I274 HydrophobicContact CE-CD1 4Å; M66-V288 HydrophobicContact CE-CG1 4.03Å; M66-N289 HydrophobicContact CE-CB 4.04Å; M66-N289 HydrophobicContact SD-CB 3.93Å; M66-M293 HydrophobicContact CE-CE 4.34Å; M66-M293 HydrophobicContact SD-CE 4.28Å
67	S	82.8	Confident	84.8	Confident	11 Å²	11	49.8 Å²	49.8	8%	0.077	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	160.1	174.3	-71.8	0	0	0	0	111.4	D69 G70 K71 N72	S67-D69 WeakPolarHBondContact CB-OD1 3.48Å; S67-D69 PolarHBondContact O-N 3.5Å; S67-D69 VanDerWaalsContact O-N 3.07Å; S67-G70 PolarHBondContact O-N 3.01Å; S67-K71 WeakPolarHBondContact CB-O 3.41Å; S67-K71 PolarHBondContact N-O 2.69Å; S67-N72 PolarHBondContact OG-ND2 3.13Å
68	L	83.2	Confident	84.4	Confident	33 Å²	33	52.6 Å²	52.6	17%	0.173	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.4	178.2	-62.6	-169.5	0	0	0	114.2	P53 L55 F260 Y265 V302	P53-L68 HydrophobicContact CB-CD1 3.76Å; P53-L68 HydrophobicContact CB-CG 4.15Å; P53-L68 HydrophobicContact CG-CD1 3.55Å; P53-L68 HydrophobicContact CG-CG 4.16Å; L55-L68 HydrophobicContact CD2-CD2 3.77Å; L55-L68 HydrophobicContact CG-CD2 3.85Å; L68-F260 HydrophobicContact CD1-CD1 4.01Å; L68-F260 HydrophobicContact CD1-CE1 4.09Å; L68-Y265 HydrophobicContact CD2-CE1 4.09Å; L68-V302 HydrophobicContact CD2-CG1 4.32Å
69	D	81	Confident	84	Confident	74 Å²	74	54.7 Å²	54.7	40%	0.396	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	15	175.2	74.7	-28.3	0	0	0	113	S67 K71 V288	S67-D69 WeakPolarHBondContact CB-OD1 3.48Å; S67-D69 PolarHBondContact O-N 3.5Å; S67-D69 VanDerWaalsContact O-N 3.07Å; D69-K71 PolarHBondContact O-N 2.04Å; D69-K71 WeakPolarHBondContact OD1-CB 3.38Å; D69-K71 PolarHBondContact OD1-N 2.89Å; D69-K71 VanDerWaalsContact OD2-CD 3.27Å; D69-K71 WeakPolarHBondContact OD2-CD 3.18Å; D69-K71 WeakPolarHBondContact OD2-CE 3.46Å; D69-K71 WeakPolarHBondContact OD2-CG 3.08Å; D69-K71 IonicContact OD2-NZ 2.73Å; D69-K71 PolarHBondContact OD2-NZ 2.95Å; D69-V288 CarbonylContact C-O 3.57Å
70	G	79.8	Confident	83.5	Confident	14 Å²	14	53.3 Å²	53.3	14%	0.144	28%	0.278	C	S	.	.	S	Bend	trans	79.2	-8.5	179.5	0	0	0	0	0	115.5	M66 S67 V288	M66-G70 WeakPolarHBondContact CG-O 3.47Å; S67-G70 PolarHBondContact O-N 3.01Å; G70-V288 WeakPolarHBondContact CA-O 3.42Å; G70-V288 PolarHBondContact N-O 3.14Å; G70-V288 VanDerWaalsContact N-O 3.12Å
71	K	78.3	Confident	83.1	Confident	116 Å²	116	53.1 Å²	53.1	50%	0.504	28%	0.276	S	S	.	.			trans	-85.1	174.8	-175.6	-55.9	-168.8	-167.4	99.3	0	111.8	M66 S67 D69 H73	M66-K71 WeakPolarHBondContact CG-O 3.04Å; S67-K71 WeakPolarHBondContact CB-O 3.41Å; S67-K71 PolarHBondContact N-O 2.69Å; D69-K71 PolarHBondContact O-N 2.04Å; D69-K71 WeakPolarHBondContact OD1-CB 3.38Å; D69-K71 PolarHBondContact OD1-N 2.89Å; D69-K71 VanDerWaalsContact OD2-CD 3.27Å; D69-K71 WeakPolarHBondContact OD2-CD 3.18Å; D69-K71 WeakPolarHBondContact OD2-CE 3.46Å; D69-K71 WeakPolarHBondContact OD2-CG 3.08Å; D69-K71 IonicContact OD2-NZ 2.73Å; D69-K71 PolarHBondContact OD2-NZ 2.95Å; K71-H73 PolarHBondContact O-N 2.9Å; K71-H73 VanDerWaalsContact O-N 3.13Å
72	N	78.5	Confident	82.5	Confident	121 Å²	121	50.2 Å²	50.2	65%	0.647	27%	0.274	S	S	*	.			trans	56.6	28.9	176.5	-55	-48	0	0	0	115.2	S67 R74	S67-N72 PolarHBondContact OG-ND2 3.13Å; N72-R74 PolarHBondContact O-N 3.09Å; N72-R74 VanDerWaalsContact O-N 3.07Å
73	H	85.1	Confident	82.2	Confident	86 Å²	86	51.4 Å²	51.4	40%	0.398	28%	0.282	S	S	.	.			trans	-60.1	111.5	177.5	-174.6	-178.7	0	0	0	110.8	F57 H64 R65 M66 K71	F57-H73 AromaticContact CZ-NE2 3.63Å; H64-H73 AromaticContact CD2-CD2 3.86Å; H64-H73 AromaticContact CD2-NE2 3.33Å; H64-H73 PolarHBondContact CD2-NE2 3.47Å; H64-H73 VanDerWaalsContact CD2-NE2 3.33Å; H64-H73 AromaticContact CG-NE2 3.5Å; R65-H73 CarbonylContact O-C 3.56Å; R65-H73 VanDerWaalsContact O-CA 3.29Å; R65-H73 WeakPolarHBondContact O-CA 3.36Å; M66-H73 HydrophobicContact CB-CB 4.45Å; M66-H73 HydrophobicContact CG-CB 4.17Å; M66-H73 HydrophobicContact SD-CB 4.39Å; K71-H73 PolarHBondContact O-N 2.9Å; K71-H73 VanDerWaalsContact O-N 3.13Å
74	R	83.9	Confident	82.1	Confident	109 Å²	109	51.7 Å²	51.7	41%	0.411	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.2	-180	73.4	-174.9	-161.7	-161.7	3.2	112.3	W35 H64 R65 N72 L76	W35-R74 PolarHBondContact O-NH2 2.94Å; H64-R74 CarbonylContact C-O 3.44Å; H64-R74 VanDerWaalsContact CA-O 3.3Å; H64-R74 WeakPolarHBondContact CA-O 3.41Å; R65-R74 HydrophobicContact CB-CG 4.14Å; R65-R74 PolarHBondContact N-O 3.44Å; R65-R74 PolarHBondContact O-N 2.97Å; N72-R74 PolarHBondContact O-N 3.09Å; N72-R74 VanDerWaalsContact O-N 3.07Å; R74-L76 HydrophobicContact CG-CD2 4.41Å
75	R	85.8	Confident	82.3	Confident	173 Å²	173	51 Å²	51	65%	0.653	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	128.8	174.6	-172.3	179.4	65.6	-155.6	-2.5	110.7	H64	H64-R75 VanDerWaalsContact CD2-CA 3.41Å; H64-R75 WeakPolarHBondContact CD2-CA 3.38Å
76	L	82.3	Confident	82.5	Confident	44 Å²	44	50.3 Å²	50.3	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-46.6	176.1	-64.2	-177.3	0	0	0	112.5	L56 I63 R65 R74	L56-L76 HydrophobicContact CD1-CD1 3.63Å; L56-L76 HydrophobicContact CG-CD1 4.42Å; I63-L76 PolarHBondContact O-N 2.79Å; R65-L76 HydrophobicContact CB-CD1 3.81Å; R65-L76 HydrophobicContact CB-CD2 4.21Å; R65-L76 HydrophobicContact CB-CG 3.93Å; R74-L76 HydrophobicContact CG-CD2 4.41Å
77	A	81.9	Confident	82.8	Confident	17 Å²	17	50.7 Å²	50.7	14%	0.14	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.2	-177.3	0	0	0	0	0	111.8	S62 I63 T80	S62-A77 CarbonylContact C-O 3.57Å; S62-A77 WeakPolarHBondContact CA-O 3.28Å; S62-A77 WeakPolarHBondContact CB-O 3.41Å; I63-A77 HydrophobicContact CB-CB 4.25Å; I63-A77 PolarHBondContact N-O 3.41Å; I63-A77 PolarHBondContact O-N 3.13Å; A77-T80 HydrophobicContact CB-CG2 3.8Å
78	A	82.6	Confident	83.2	Confident	59 Å²	59	50.2 Å²	50.2	49%	0.488	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152	-179.1	0	0	0	0	0	112
79	G	78.5	Confident	83.4	Confident	45 Å²	45	49 Å²	49	46%	0.464	27%	0.27	S	S	.	.	S	Bend	trans	70.7	31	-177.1	0	0	0	0	0	113.2	K61 R115	K61-G79 WeakPolarHBondContact O-CA 3.37Å; K61-G79 PolarHBondContact O-N 3.2Å; G79-R115 PolarHBondContact O-NH1 3.32Å
80	T	78.1	Confident	83.5	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.018	26%	0.258	C	S	.	.			trans	-81	-21.8	-171.4	52.9	0	0	0	0	114.4	K61 S62 I63 A77 I84 W97	K61-T80 VanDerWaalsContact C-OG1 3.27Å; K61-T80 PolarHBondContact O-N 2.97Å; K61-T80 VanDerWaalsContact O-N 3.12Å; K61-T80 PolarHBondContact O-OG1 2.95Å; S62-T80 WeakPolarHBondContact CA-OG1 3.2Å; S62-T80 PolarHBondContact N-OG1 2.59Å; I63-T80 HydrophobicContact CD1-CG2 3.94Å; I63-T80 HydrophobicContact CG1-CG2 4.02Å; A77-T80 HydrophobicContact CB-CG2 3.8Å; T80-I84 WeakPolarHBondContact O-CG2 3.34Å; T80-W97 HydrophobicContact CG2-CD2 4.44Å; T80-W97 HydrophobicContact CG2-CZ2 3.98Å
81	G	76.9	Confident	83.2	Confident	15 Å²	15	54.7 Å²	54.7	16%	0.155	28%	0.282	C	S	.	.			trans	118.2	163.9	-168.7	0	0	0	0	0	110.8	K61 D99	K61-G81 WeakPolarHBondContact CA-O 3.48Å; G81-D99 WeakPolarHBondContact CA-OD2 3.31Å
82	S	75.6	Confident	83.3	Confident	80 Å²	80	52.5 Å²	52.5	56%	0.559	27%	0.274	S	S	*	.	S	Bend	trans	-103	-6.3	178	58.2	0	0	0	0	114.3	G60	G60-S82 WeakPolarHBondContact O-CA 3.29Å
83	S	81.3	Confident	83.2	Confident	45 Å²	45	48.3 Å²	48.3	32%	0.315	25%	0.25	S	S	.	.	S	Bend	trans	-137.9	96	170	-174.9	0	0	0	0	106.1	D99 R100	S83-D99 WeakPolarHBondContact O-CA 3.38Å; S83-R100 PolarHBondContact O-N 2.87Å; S83-R100 VanDerWaalsContact OG-CD 3.28Å; S83-R100 WeakPolarHBondContact OG-CD 3.42Å
84	I	87.3	Confident	83.2	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	153.8	-175.2	64.8	173.2	0	0	0	110.4	I63 T80 L86 A98	I63-I84 HydrophobicContact CD1-CD1 3.84Å; I63-I84 HydrophobicContact CG1-CD1 3.43Å; I63-I84 VanDerWaalsContact CG1-CD1 3.43Å; T80-I84 WeakPolarHBondContact O-CG2 3.34Å; I84-L86 HydrophobicContact CD1-CD2 4.2Å; I84-A98 CarbonylContact C-O 3.59Å; I84-A98 VanDerWaalsContact CA-O 3.27Å; I84-A98 WeakPolarHBondContact CA-O 3.48Å
85	L	90.9	Very high	83.5	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.1	164.6	-62.4	160.2	0	0	0	106.5	W97 A98 R100 I125 L128 F169 D299	L85-W97 CarbonylContact O-C 3.59Å; L85-W97 WeakPolarHBondContact O-CA 3.33Å; L85-W97 WeakPolarHBondContact O-CB 3.48Å; L85-A98 PolarHBondContact N-O 3.06Å; L85-A98 PolarHBondContact O-N 2.69Å; L85-R100 HydrophobicContact CD1-CG 3.81Å; L85-R100 HydrophobicContact CG-CG 3.81Å; L85-I125 HydrophobicContact CD1-CG2 4.01Å; L85-L128 HydrophobicContact CB-CB 3.98Å; L85-F169 HydrophobicContact CD2-CE1 4.3Å; L85-D299 VanDerWaalsContact CA-OD2 3.3Å; L85-D299 WeakPolarHBondContact CA-OD2 3.48Å
86	L	91.5	Very high	83.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	-175.7	63.3	80.3	0	0	0	113.2	L56 I63 I84 Y96 W97 D299 K301	L56-L86 HydrophobicContact CD2-CD1 3.55Å; L56-L86 HydrophobicContact CD2-CD2 3.82Å; L56-L86 HydrophobicContact CD2-CG 4.22Å; I63-L86 HydrophobicContact CG1-CD2 4.49Å; I63-L86 HydrophobicContact CG2-CD2 4.44Å; I84-L86 HydrophobicContact CD1-CD2 4.2Å; L86-Y96 WeakPolarHBondContact CA-O 3.2Å; L86-W97 HydrophobicContact CB-CB 4.2Å; L86-D299 HydrophobicContact CG-CB 4.21Å; L86-D299 PolarHBondContact N-OD2 3.11Å; L86-K301 HydrophobicContact CD1-CB 4.11Å; L86-K301 HydrophobicContact CD1-CG 3.69Å
87	D	93.3	Very high	84.2	Confident	8 Å²	8	33 Å²	33	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	167.7	170.5	-156.1	-6.5	0	0	0	109.2	Y96 T129 V130	D87-Y96 PolarHBondContact N-O 2.92Å; D87-Y96 PolarHBondContact O-N 2.8Å; D87-T129 WeakPolarHBondContact OD2-CA 3.44Å; D87-T129 WeakPolarHBondContact OD2-CB 2.92Å; D87-T129 PolarHBondContact OD2-OG1 2.93Å; D87-V130 HydrophobicContact CB-CB 4.46Å; D87-V130 HydrophobicContact CB-CG2 4.02Å; D87-V130 PolarHBondContact OD2-N 3.01Å
88	F	91	Very high	84.6	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.009	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	165.4	-172	64.8	-81.3	0	0	0	112.6	W35 F90 R94 K301 V302 V303 I307 Q308	W35-F88 HydrophobicContact CH2-CB 4.45Å; F88-F90 HydrophobicContact CD2-CB 4.23Å; F88-F90 HydrophobicContact CE2-CB 4.07Å; F88-F90 HydrophobicContact CE2-CD2 4.47Å; F88-R94 CarbonylContact C-O 3.57Å; F88-R94 WeakPolarHBondContact CA-O 3.1Å; F88-K301 HydrophobicContact CD1-CB 4.21Å; F88-K301 HydrophobicContact CE1-CB 4.01Å; F88-V302 WeakPolarHBondContact CE1-O 3.4Å; F88-V302 WeakPolarHBondContact CZ-O 3.35Å; F88-V303 HydrophobicContact CD1-CG2 3.96Å; F88-V303 HydrophobicContact CD2-CG1 3.9Å; F88-V303 HydrophobicContact CD2-CG2 4.33Å; F88-V303 HydrophobicContact CE1-CG2 3.97Å; F88-V303 HydrophobicContact CE2-CB 4.31Å; F88-V303 HydrophobicContact CE2-CG1 3.77Å; F88-V303 HydrophobicContact CE2-CG2 4.34Å; F88-V303 HydrophobicContact CG-CG1 4.5Å; F88-V303 HydrophobicContact CG-CG2 4.15Å; F88-V303 HydrophobicContact CZ-CB 4.3Å; F88-V303 HydrophobicContact CZ-CG1 4.26Å; F88-V303 HydrophobicContact CZ-CG2 4.17Å; F88-I307 HydrophobicContact CZ-CG2 4.12Å; F88-Q308 HydrophobicContact CE2-CG 4.05Å; F88-Q308 HydrophobicContact CZ-CG 4.3Å; F88-Q308 PolarHBondContact O-NE2 2.91Å
89	H	87.1	Confident	84.8	Confident	6 Å²	6	30 Å²	30	3%	0.028	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.1	163.1	-168.6	-28.4	0	0	0	107.8	E92 E93 R94 Y96 V130	H89-E92 HydrophobicContact CB-CB 4.45Å; H89-E92 IonicContact CD2-OE2 3.7Å; H89-E93 PolarHBondContact O-N 3.07Å; H89-R94 HydrophobicContact CB-CB 4.48Å; H89-R94 PolarHBondContact N-O 3.5Å; H89-R94 PolarHBondContact O-N 2.81Å; H89-Y96 HydrophobicContact CB-CE2 4.12Å; H89-V130 HydrophobicContact CB-CG1 4.26Å
90	F	83	Confident	85.2	Confident	36 Å²	36	31.7 Å²	31.7	16%	0.158	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-58	-172.3	-173.6	-93.7	0	0	0	111.9	W35 S51 F88 E92 E93 V303 P305 Q308	W35-F90 PolarHBondContact NE1-O 2.74Å; S51-F90 WeakPolarHBondContact OG-CZ 3.48Å; F88-F90 HydrophobicContact CD2-CB 4.23Å; F88-F90 HydrophobicContact CE2-CB 4.07Å; F88-F90 HydrophobicContact CE2-CD2 4.47Å; F90-E92 PolarHBondContact O-N 3.22Å; F90-E93 PolarHBondContact O-N 2.86Å; F90-E93 VanDerWaalsContact O-N 3.14Å; F90-V303 HydrophobicContact CD2-CG1 3.8Å; F90-V303 HydrophobicContact CE2-CG1 4.16Å; F90-P305 HydrophobicContact CD1-CB 4.38Å; F90-P305 HydrophobicContact CD1-CG 4.26Å; F90-P305 HydrophobicContact CE1-CB 4.12Å; F90-P305 HydrophobicContact CE1-CG 3.56Å; F90-P305 HydrophobicContact CE2-CG 4.24Å; F90-P305 HydrophobicContact CZ-CB 4.49Å; F90-P305 HydrophobicContact CZ-CG 3.55Å; F90-Q308 HydrophobicContact CB-CB 4.31Å
91	R	75.4	Confident	85.3	Confident	173 Å²	173	40.2 Å²	40.2	65%	0.653	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.4	-176	-171.3	179.8	-76.3	-168.9	-0.2	114.2	M310	R91-M310 PolarHBondContact NE-SD 3.15Å; R91-M310 VanDerWaalsContact NE-SD 3.41Å; R91-M310 PolarHBondContact NH1-SD 3.34Å
92	E	78.9	Confident	85.6	Confident	70 Å²	70	41.6 Å²	41.6	33%	0.327	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	3.7	176.2	-61.2	-163.7	122.9	0	0	114.4	H89 F90 R94	H89-E92 HydrophobicContact CB-CB 4.45Å; H89-E92 IonicContact CD2-OE2 3.7Å; F90-E92 PolarHBondContact O-N 3.22Å; E92-R94 VanDerWaalsContact C-N 3.34Å; E92-R94 HydrophobicContact CB-CG 4.37Å; E92-R94 WeakPolarHBondContact O-CG 3.42Å; E92-R94 PolarHBondContact O-N 3.08Å; E92-R94 IonicContact OE1-CZ 2.71Å; E92-R94 IonicContact OE1-NH1 3.88Å; E92-R94 PolarHBondContact OE1-NH1 3.36Å; E92-R94 WeakPolarHBondContact OE2-CD 3.46Å; E92-R94 IonicContact OE2-CZ 3.15Å; E92-R94 IonicContact OE2-NE 3.91Å; E92-R94 IonicContact OE2-NH1 2.74Å; E92-R94 PolarHBondContact OE2-NH1 3.14Å
93	E	77.7	Confident	85.9	Confident	32 Å²	32	37.8 Å²	37.8	15%	0.15	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	46.7	-175.8	-51	-143.1	152.9	0	0	114.6	A33 C34 W35 H89 F90 V110 Q111	A33-E93 VanDerWaalsContact O-CD 3.31Å; C34-E93 VanDerWaalsContact C-OE1 3.23Å; C34-E93 WeakPolarHBondContact CA-OE1 3.17Å; W35-E93 VanDerWaalsContact CD1-CD 3.47Å; W35-E93 PolarHBondContact N-OE1 2.84Å; H89-E93 PolarHBondContact O-N 3.07Å; F90-E93 PolarHBondContact O-N 2.86Å; F90-E93 VanDerWaalsContact O-N 3.14Å; E93-V110 HydrophobicContact CB-CG2 4.48Å; E93-V110 WeakPolarHBondContact O-CG2 3.39Å; E93-V110 PolarHBondContact O-N 3.41Å; E93-Q111 PolarHBondContact OE2-NE2 2.78Å
94	R	84.5	Confident	86.2	Confident	83 Å²	83	36.9 Å²	36.9	31%	0.313	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.1	-173.9	-78.9	153.9	-177.8	-172	7.2	112.9	F88 H89 E92 Y96 A108	F88-R94 CarbonylContact C-O 3.57Å; F88-R94 WeakPolarHBondContact CA-O 3.1Å; H89-R94 HydrophobicContact CB-CB 4.48Å; H89-R94 PolarHBondContact N-O 3.5Å; H89-R94 PolarHBondContact O-N 2.81Å; E92-R94 VanDerWaalsContact C-N 3.34Å; E92-R94 HydrophobicContact CB-CG 4.37Å; E92-R94 WeakPolarHBondContact O-CG 3.42Å; E92-R94 PolarHBondContact O-N 3.08Å; E92-R94 IonicContact OE1-CZ 2.71Å; E92-R94 IonicContact OE1-NH1 3.88Å; E92-R94 PolarHBondContact OE1-NH1 3.36Å; E92-R94 WeakPolarHBondContact OE2-CD 3.46Å; E92-R94 IonicContact OE2-CZ 3.15Å; E92-R94 IonicContact OE2-NE 3.91Å; E92-R94 IonicContact OE2-NH1 2.74Å; E92-R94 PolarHBondContact OE2-NH1 3.14Å; R94-Y96 HydrophobicContact CB-CE2 3.71Å; R94-A108 WeakPolarHBondContact CA-O 3.46Å
95	L	89.4	Confident	86.3	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.026	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.6	175.3	175.2	63.7	0	0	0	109.4	L56 I63 W97 K107 A108	L56-L95 HydrophobicContact CD1-CD1 4.02Å; L56-L95 HydrophobicContact CD1-CD2 4.48Å; L56-L95 HydrophobicContact CD2-CD1 3.58Å; L56-L95 HydrophobicContact CG-CD1 4.47Å; I63-L95 HydrophobicContact CB-CD2 4.42Å; I63-L95 HydrophobicContact CD1-CD2 3.85Å; I63-L95 HydrophobicContact CD1-CG 4.49Å; I63-L95 HydrophobicContact CG2-CD2 3.96Å; L95-W97 HydrophobicContact CD2-CE3 4.32Å; L95-W97 HydrophobicContact CD2-CZ3 4.49Å; L95-W97 HydrophobicContact CG-CE3 4.09Å; L95-W97 HydrophobicContact CG-CZ3 4.47Å; L95-K107 CarbonylContact O-C 3.5Å; L95-K107 WeakPolarHBondContact O-CA 3.28Å; L95-A108 PolarHBondContact N-O 3Å; L95-A108 PolarHBondContact O-N 2.73Å
96	Y	91.8	Very high	86.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.4	176.8	-62.4	-98.9	0	0	0	108.9	L86 D87 H89 R94 Y106 K107 L118 V130 V137 L152	L86-Y96 WeakPolarHBondContact CA-O 3.2Å; D87-Y96 PolarHBondContact N-O 2.92Å; D87-Y96 PolarHBondContact O-N 2.8Å; H89-Y96 HydrophobicContact CB-CE2 4.12Å; R94-Y96 HydrophobicContact CB-CE2 3.71Å; Y96-Y106 WeakPolarHBondContact CA-O 3.44Å; Y96-K107 HydrophobicContact CD1-CB 4.11Å; Y96-K107 HydrophobicContact CD1-CG 4.19Å; Y96-K107 HydrophobicContact CE1-CB 4.07Å; Y96-K107 HydrophobicContact CE1-CD 3.7Å; Y96-K107 HydrophobicContact CE1-CG 3.76Å; Y96-K107 WeakPolarHBondContact OH-CE 3.47Å; Y96-K107 PolarHBondContact OH-NZ 2.87Å; Y96-L118 HydrophobicContact CD1-CD1 3.95Å; Y96-L118 HydrophobicContact CE1-CD1 3.81Å; Y96-V130 HydrophobicContact CD2-CG2 3.63Å; Y96-V130 HydrophobicContact CE2-CG2 4.23Å; Y96-V130 HydrophobicContact CG-CG2 3.85Å; Y96-V137 HydrophobicContact CD1-CG2 3.9Å; Y96-V137 HydrophobicContact CE1-CG2 3.88Å; Y96-L152 HydrophobicContact CE1-CD2 4.42Å
97	W	91.9	Very high	86.1	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.011	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.6	174.1	73.7	95.4	0	0	0	112.6	I63 T80 L85 L86 L95 Y106 A108 R115	I63-W97 HydrophobicContact CD1-CB 3.94Å; I63-W97 HydrophobicContact CD1-CD2 3.88Å; I63-W97 HydrophobicContact CD1-CE3 4.14Å; I63-W97 HydrophobicContact CD1-CG 3.8Å; T80-W97 HydrophobicContact CG2-CD2 4.44Å; T80-W97 HydrophobicContact CG2-CZ2 3.98Å; L85-W97 CarbonylContact O-C 3.59Å; L85-W97 WeakPolarHBondContact O-CA 3.33Å; L85-W97 WeakPolarHBondContact O-CB 3.48Å; L86-W97 HydrophobicContact CB-CB 4.2Å; L95-W97 HydrophobicContact CD2-CE3 4.32Å; L95-W97 HydrophobicContact CD2-CZ3 4.49Å; L95-W97 HydrophobicContact CG-CE3 4.09Å; L95-W97 HydrophobicContact CG-CZ3 4.47Å; W97-Y106 VanDerWaalsContact CE2-CB 3.44Å; W97-Y106 AromaticContact CE2-CD2 3.95Å; W97-Y106 AromaticContact CE2-CG 3.9Å; W97-Y106 VanDerWaalsContact CZ2-CB 3.44Å; W97-Y106 HydrophobicContact CZ2-CD2 4.31Å; W97-Y106 AromaticContact CZ2-CG 3.88Å; W97-Y106 HydrophobicContact CZ2-CG 3.88Å; W97-Y106 PolarHBondContact N-O 2.84Å; W97-Y106 VanDerWaalsContact N-O 3.08Å; W97-Y106 AromaticContact NE1-CD2 3.5Å; W97-Y106 AromaticContact NE1-CG 3.94Å; W97-Y106 PolarHBondContact O-N 3.21Å; W97-A108 HydrophobicContact CH2-CB 3.9Å; W97-A108 HydrophobicContact CZ3-CB 3.68Å; W97-R115 HydrophobicContact CH2-CB 3.81Å; W97-R115 HydrophobicContact CZ2-CB 4.11Å
98	A	90.6	Very high	85.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.5	175.7	0	0	0	0	0	110.6	I84 L85 I104 I105 I125 L128	I84-A98 CarbonylContact C-O 3.59Å; I84-A98 VanDerWaalsContact CA-O 3.27Å; I84-A98 WeakPolarHBondContact CA-O 3.48Å; L85-A98 PolarHBondContact N-O 3.06Å; L85-A98 PolarHBondContact O-N 2.69Å; A98-I104 WeakPolarHBondContact CA-O 3.35Å; A98-I105 HydrophobicContact CB-CG1 4.12Å; A98-I125 HydrophobicContact CB-CD1 4.24Å; A98-I125 HydrophobicContact CB-CG2 4.31Å; A98-L128 HydrophobicContact CB-CD2 4.09Å
99	D	86.3	Confident	85.2	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.064	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.5	168.7	167.1	-59.1	0	0	0	108.5	G81 S83 R101 T102 G103	G81-D99 WeakPolarHBondContact CA-OD2 3.31Å; S83-D99 WeakPolarHBondContact O-CA 3.38Å; D99-R101 PolarHBondContact O-N 3.48Å; D99-R101 VanDerWaalsContact O-N 3.11Å; D99-R101 WeakPolarHBondContact OD1-CA 3.25Å; D99-R101 WeakPolarHBondContact OD1-CB 3.4Å; D99-R101 PolarHBondContact OD1-N 2.89Å; D99-T102 WeakPolarHBondContact CB-OG1 3.33Å; D99-T102 PolarHBondContact O-N 2.85Å; D99-T102 PolarHBondContact OD1-N 3.29Å; D99-T102 PolarHBondContact OD1-OG1 3.11Å; D99-G103 WeakPolarHBondContact O-CA 3.5Å; D99-G103 PolarHBondContact O-N 3.35Å
100	R	86	Confident	84.4	Confident	81 Å²	81	42.3 Å²	42.3	31%	0.306	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.5	-172.6	-63.1	-176.5	101.7	-175.9	11.8	112.8	S83 L85 H124 I125 S126	S83-R100 PolarHBondContact O-N 2.87Å; S83-R100 VanDerWaalsContact OG-CD 3.28Å; S83-R100 WeakPolarHBondContact OG-CD 3.42Å; L85-R100 HydrophobicContact CD1-CG 3.81Å; L85-R100 HydrophobicContact CG-CG 3.81Å; R100-H124 VanDerWaalsContact O-CA 3.26Å; R100-H124 WeakPolarHBondContact O-CA 3.31Å; R100-I125 PolarHBondContact O-N 3.25Å; R100-S126 PolarHBondContact NH2-O 2.75Å
101	R	81.7	Confident	83.5	Confident	182 Å²	182	46 Å²	46	69%	0.687	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-43.6	-176.2	-176.8	-173.5	63	97.4	8.4	112.3	D99	D99-R101 PolarHBondContact O-N 3.48Å; D99-R101 VanDerWaalsContact O-N 3.11Å; D99-R101 WeakPolarHBondContact OD1-CA 3.25Å; D99-R101 WeakPolarHBondContact OD1-CB 3.4Å; D99-R101 PolarHBondContact OD1-N 2.89Å
102	T	83.2	Confident	82.5	Confident	45 Å²	45	39.5 Å²	39.5	28%	0.276	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-29.2	179.9	65.2	0	0	0	0	112.5	D99 I104	D99-T102 WeakPolarHBondContact CB-OG1 3.33Å; D99-T102 PolarHBondContact O-N 2.85Å; D99-T102 PolarHBondContact OD1-N 3.29Å; D99-T102 PolarHBondContact OD1-OG1 3.11Å; T102-I104 PolarHBondContact O-N 2.78Å
103	G	80.9	Confident	81.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.			trans	65.8	20.1	-177.2	0	0	0	0	0	114.4	D99 D122 I125	D99-G103 WeakPolarHBondContact O-CA 3.5Å; D99-G103 PolarHBondContact O-N 3.35Å; G103-D122 VanDerWaalsContact CA-O 3.27Å; G103-D122 WeakPolarHBondContact CA-O 3.49Å; G103-I125 VanDerWaalsContact O-CD1 3.3Å; G103-I125 WeakPolarHBondContact O-CD1 3.3Å
104	I	87.3	Confident	80.5	Confident	26 Å²	26	48.1 Å²	48.1	13%	0.133	25%	0.25	C	S	.	.			trans	-86.7	123.4	174	-61	174.2	0	0	0	108.4	A98 T102 Y106 K117 Y119	A98-I104 WeakPolarHBondContact CA-O 3.35Å; T102-I104 PolarHBondContact O-N 2.78Å; I104-Y106 HydrophobicContact CB-CD2 4.48Å; I104-Y106 HydrophobicContact CB-CE2 3.77Å; I104-Y106 HydrophobicContact CG2-CD1 4.25Å; I104-Y106 HydrophobicContact CG2-CD2 3.95Å; I104-Y106 HydrophobicContact CG2-CE1 3.75Å; I104-Y106 HydrophobicContact CG2-CE2 3.42Å; I104-Y106 VanDerWaalsContact CG2-CE2 3.42Å; I104-Y106 HydrophobicContact CG2-CG 4.34Å; I104-K117 HydrophobicContact CG2-CD 3.93Å; I104-K117 HydrophobicContact CG2-CG 3.78Å; I104-Y119 WeakPolarHBondContact CA-O 3.4Å; I104-Y119 WeakPolarHBondContact CG2-O 3.35Å
105	I	90	Very high	80.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.8	172.1	-48.9	175.3	0	0	0	108.4	A98 L118 Y119 I125 L128 W139 M150	A98-I105 HydrophobicContact CB-CG1 4.12Å; I105-L118 PolarHBondContact O-N 3.14Å; I105-Y119 HydrophobicContact CD1-CD1 4.04Å; I105-Y119 HydrophobicContact CD1-CG 4.21Å; I105-Y119 HydrophobicContact CG1-CD1 4.24Å; I105-Y119 HydrophobicContact CG1-CG 4.49Å; I105-Y119 PolarHBondContact N-O 3.36Å; I105-Y119 PolarHBondContact O-N 3.44Å; I105-I125 HydrophobicContact CD1-CD1 4.03Å; I105-I125 HydrophobicContact CG1-CD1 3.69Å; I105-L128 HydrophobicContact CD1-CD1 4.06Å; I105-L128 HydrophobicContact CG1-CD1 4.44Å; I105-L128 HydrophobicContact CG2-CD1 4.13Å; I105-W139 HydrophobicContact CD1-CB 4.25Å; I105-W139 HydrophobicContact CD1-CD2 3.69Å; I105-W139 HydrophobicContact CD1-CE3 3.8Å; I105-W139 HydrophobicContact CD1-CG 3.92Å; I105-W139 HydrophobicContact CD1-CZ3 4.4Å; I105-M150 HydrophobicContact CB-CE 4.23Å; I105-M150 HydrophobicContact CD1-CE 3.87Å; I105-M150 HydrophobicContact CG2-CE 3.94Å
106	Y	89.6	Confident	79.9	Confident	38 Å²	38	55 Å²	55	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	158.4	177.8	-63.3	-84.8	0	0	0	111.2	Y96 W97 I104 R115 Q116 K117	Y96-Y106 WeakPolarHBondContact CA-O 3.44Å; W97-Y106 VanDerWaalsContact CE2-CB 3.44Å; W97-Y106 AromaticContact CE2-CD2 3.95Å; W97-Y106 AromaticContact CE2-CG 3.9Å; W97-Y106 VanDerWaalsContact CZ2-CB 3.44Å; W97-Y106 HydrophobicContact CZ2-CD2 4.31Å; W97-Y106 AromaticContact CZ2-CG 3.88Å; W97-Y106 HydrophobicContact CZ2-CG 3.88Å; W97-Y106 PolarHBondContact N-O 2.84Å; W97-Y106 VanDerWaalsContact N-O 3.08Å; W97-Y106 AromaticContact NE1-CD2 3.5Å; W97-Y106 AromaticContact NE1-CG 3.94Å; W97-Y106 PolarHBondContact O-N 3.21Å; I104-Y106 HydrophobicContact CB-CD2 4.48Å; I104-Y106 HydrophobicContact CB-CE2 3.77Å; I104-Y106 HydrophobicContact CG2-CD1 4.25Å; I104-Y106 HydrophobicContact CG2-CD2 3.95Å; I104-Y106 HydrophobicContact CG2-CE1 3.75Å; I104-Y106 HydrophobicContact CG2-CE2 3.42Å; I104-Y106 VanDerWaalsContact CG2-CE2 3.42Å; I104-Y106 HydrophobicContact CG2-CG 4.34Å; Y106-R115 HydrophobicContact CD1-CB 4.48Å; Y106-Q116 CarbonylContact C-O 3.37Å; Y106-Q116 VanDerWaalsContact CA-O 3.3Å; Y106-Q116 WeakPolarHBondContact CA-O 3.39Å; Y106-K117 HydrophobicContact CD1-CB 4.35Å; Y106-K117 HydrophobicContact CE1-CB 4.33Å
107	K	89	Confident	79.7	Confident	15 Å²	15	60.3 Å²	60.3	7%	0.065	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.6	173.9	177.2	-177.3	-174.3	166.9	0	109.1	L95 Y96 Q116 L118 L152	L95-K107 CarbonylContact O-C 3.5Å; L95-K107 WeakPolarHBondContact O-CA 3.28Å; Y96-K107 HydrophobicContact CD1-CB 4.11Å; Y96-K107 HydrophobicContact CD1-CG 4.19Å; Y96-K107 HydrophobicContact CE1-CB 4.07Å; Y96-K107 HydrophobicContact CE1-CD 3.7Å; Y96-K107 HydrophobicContact CE1-CG 3.76Å; Y96-K107 WeakPolarHBondContact OH-CE 3.47Å; Y96-K107 PolarHBondContact OH-NZ 2.87Å; K107-Q116 PolarHBondContact N-O 2.95Å; K107-Q116 PolarHBondContact O-N 3.33Å; K107-L118 HydrophobicContact CB-CD1 3.78Å; K107-L118 HydrophobicContact CB-CD2 4.25Å; K107-L118 HydrophobicContact CB-CG 3.87Å; K107-L118 HydrophobicContact CD-CD1 4.16Å; K107-L118 HydrophobicContact CD-CD2 4.18Å; K107-L152 PolarHBondContact NZ-O 2.71Å
108	A	85.2	Confident	79.3	Confident	12 Å²	12	61.1 Å²	61.1	10%	0.099	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.6	167.6	0	0	0	0	0	111	R94 L95 W97	R94-A108 WeakPolarHBondContact CA-O 3.46Å; L95-A108 PolarHBondContact N-O 3Å; L95-A108 PolarHBondContact O-N 2.73Å; W97-A108 HydrophobicContact CH2-CB 3.9Å; W97-A108 HydrophobicContact CZ3-CB 3.68Å
109	S	80.6	Confident	78.7	Confident	58 Å²	58	61.8 Å²	61.8	41%	0.406	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	145.8	160.9	170	0	0	0	0	109.1	Q111 G112	S109-Q111 PolarHBondContact O-N 2.93Å; S109-Q111 PolarHBondContact OG-N 2.86Å; S109-G112 PolarHBondContact O-N 2.93Å
110	V	69.5	Low	78	Confident	17 Å²	17	64 Å²	64	10%	0.103	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.9	175.9	176.5	0	0	0	0	112.7	W35 E93	W35-V110 HydrophobicContact CD2-CG1 4.3Å; W35-V110 HydrophobicContact CD2-CG2 4.11Å; W35-V110 HydrophobicContact CE3-CB 4.12Å; W35-V110 HydrophobicContact CE3-CG1 3.54Å; W35-V110 HydrophobicContact CE3-CG2 3.58Å; W35-V110 HydrophobicContact CH2-CG2 3.34Å; W35-V110 HydrophobicContact CZ2-CG2 3.84Å; W35-V110 HydrophobicContact CZ3-CB 4.15Å; W35-V110 HydrophobicContact CZ3-CG1 3.84Å; W35-V110 HydrophobicContact CZ3-CG2 3.18Å; E93-V110 HydrophobicContact CB-CG2 4.48Å; E93-V110 WeakPolarHBondContact O-CG2 3.39Å; E93-V110 PolarHBondContact O-N 3.41Å
111	Q	63	Low	77.2	Confident	114 Å²	114	63.7 Å²	63.7	53%	0.533	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-10	-173.4	-52.8	-179	23.4	0	0	113.5	A33 E93 S109	A33-Q111 VanDerWaalsContact C-NE2 3.35Å; A33-Q111 VanDerWaalsContact CB-OE1 3.23Å; A33-Q111 PolarHBondContact O-NE2 2.64Å; A33-Q111 VanDerWaalsContact O-NE2 3.14Å; E93-Q111 PolarHBondContact OE2-NE2 2.78Å; S109-Q111 PolarHBondContact O-N 2.93Å; S109-Q111 PolarHBondContact OG-N 2.86Å
112	G	56.4	Low	76.5	Confident	37 Å²	37	55 Å²	55	38%	0.381	30%	0.304	S	S	.	.			trans	-126.7	132.3	-164.4	0	0	0	0	0	115.1	S109 H114	S109-G112 PolarHBondContact O-N 2.93Å; G112-H114 PolarHBondContact O-N 2.93Å; G112-H114 VanDerWaalsContact O-N 3.07Å
113	A	50.3	Low	76	Confident	108 Å²	108	60.1 Å²	60.1	89%	0.893	32%	0.323	S	S	*	.	S	Bend	trans	-69.7	-2	-175.6	0	0	0	0	0	116.1
114	H	63.8	Low	75.9	Confident	174 Å²	174	63.2 Å²	63.2	81%	0.806	34%	0.337	S	S	*	.			trans	-94.7	106.5	-176.7	-86.7	48.4	0	0	0	112	G112	G112-H114 PolarHBondContact O-N 2.93Å; G112-H114 VanDerWaalsContact O-N 3.07Å
115	R	77.4	Confident	76	Confident	129 Å²	129	62.1 Å²	62.1	49%	0.487	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-75.2	127.3	167.7	61.4	-176.3	166.6	-174.1	-7.5	110.8	G79 W97 Y106	G79-R115 PolarHBondContact O-NH1 3.32Å; W97-R115 HydrophobicContact CH2-CB 3.81Å; W97-R115 HydrophobicContact CZ2-CB 4.11Å; Y106-R115 HydrophobicContact CD1-CB 4.48Å
116	Q	84.5	Confident	76	Confident	105 Å²	105	62.4 Å²	62.4	49%	0.491	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.3	167.3	-172.3	178.7	4.3	0	0	109.2	Y106 K107 L118	Y106-Q116 CarbonylContact C-O 3.37Å; Y106-Q116 VanDerWaalsContact CA-O 3.3Å; Y106-Q116 WeakPolarHBondContact CA-O 3.39Å; K107-Q116 PolarHBondContact N-O 2.95Å; K107-Q116 PolarHBondContact O-N 3.33Å; Q116-L118 HydrophobicContact CG-CD2 4.31Å
117	K	86.2	Confident	76.1	Confident	110 Å²	110	60.6 Å²	60.6	48%	0.478	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.4	170.2	178.3	172.1	174.6	-180	0	108.6	I104 Y106 S120	I104-K117 HydrophobicContact CG2-CD 3.93Å; I104-K117 HydrophobicContact CG2-CG 3.78Å; Y106-K117 HydrophobicContact CD1-CB 4.35Å; Y106-K117 HydrophobicContact CE1-CB 4.33Å; K117-S120 VanDerWaalsContact CE-OG 3.24Å; K117-S120 WeakPolarHBondContact CE-OG 3.46Å; K117-S120 PolarHBondContact NZ-OG 3.16Å
118	L	82.9	Confident	76.3	Confident	21 Å²	21	60.4 Å²	60.4	11%	0.11	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-42.3	178.2	-64.3	-175.2	0	0	0	112.4	Y96 I105 K107 Q116 M150	Y96-L118 HydrophobicContact CD1-CD1 3.95Å; Y96-L118 HydrophobicContact CE1-CD1 3.81Å; I105-L118 PolarHBondContact O-N 3.14Å; K107-L118 HydrophobicContact CB-CD1 3.78Å; K107-L118 HydrophobicContact CB-CD2 4.25Å; K107-L118 HydrophobicContact CB-CG 3.87Å; K107-L118 HydrophobicContact CD-CD1 4.16Å; K107-L118 HydrophobicContact CD-CD2 4.18Å; Q116-L118 HydrophobicContact CG-CD2 4.31Å; L118-M150 HydrophobicContact CB-CE 3.89Å; L118-M150 HydrophobicContact CB-SD 4.35Å; L118-M150 HydrophobicContact CD1-CE 3.78Å
119	Y	79.3	Confident	76.7	Confident	13 Å²	13	60 Å²	60	5%	0.051	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156	-168.6	-167.8	-107.6	0	0	0	112.8	I104 I105 S121 D122 W139 K148 M150 E157	I104-Y119 WeakPolarHBondContact CA-O 3.4Å; I104-Y119 WeakPolarHBondContact CG2-O 3.35Å; I105-Y119 HydrophobicContact CD1-CD1 4.04Å; I105-Y119 HydrophobicContact CD1-CG 4.21Å; I105-Y119 HydrophobicContact CG1-CD1 4.24Å; I105-Y119 HydrophobicContact CG1-CG 4.49Å; I105-Y119 PolarHBondContact N-O 3.36Å; I105-Y119 PolarHBondContact O-N 3.44Å; Y119-S121 WeakPolarHBondContact CE2-OG 3.31Å; Y119-S121 PolarHBondContact OH-OG 2.82Å; Y119-D122 HydrophobicContact CE1-CB 3.98Å; Y119-D122 PolarHBondContact OH-OD2 2.87Å; Y119-W139 HydrophobicContact CD1-CZ2 4.01Å; Y119-W139 HydrophobicContact CD2-CH2 4.24Å; Y119-W139 HydrophobicContact CD2-CZ2 4.08Å; Y119-W139 AromaticContact CE1-CE2 3.83Å; Y119-W139 AromaticContact CE1-CZ2 3.62Å; Y119-W139 HydrophobicContact CE1-CZ2 3.62Å; Y119-W139 AromaticContact CE1-NE1 3.77Å; Y119-W139 HydrophobicContact CE2-CH2 4.14Å; Y119-W139 AromaticContact CE2-CZ2 3.71Å; Y119-W139 HydrophobicContact CE2-CZ2 3.71Å; Y119-W139 HydrophobicContact CG-CZ2 4.21Å; Y119-W139 AromaticContact CZ-CZ2 3.45Å; Y119-W139 VanDerWaalsContact CZ-CZ2 3.45Å; Y119-K148 PolarHBondContact OH-NZ 3.05Å; Y119-M150 HydrophobicContact CD2-SD 4.46Å; Y119-E157 VanDerWaalsContact CE2-CD 3.45Å; Y119-E157 HydrophobicContact CE2-CG 4.22Å; Y119-E157 WeakPolarHBondContact CE2-OE2 3.47Å; Y119-E157 PolarHBondContact OH-OE1 3.26Å
120	S	71.4	Confident	77.3	Confident	58 Å²	58	57.2 Å²	57.2	41%	0.406	30%	0.303	S	S	.	.			trans	-157.7	-2.6	-175	-158.4	0	0	0	0	118	K117	K117-S120 VanDerWaalsContact CE-OG 3.24Å; K117-S120 WeakPolarHBondContact CE-OG 3.46Å; K117-S120 PolarHBondContact NZ-OG 3.16Å
121	S	68	Low	78.2	Confident	75 Å²	75	56.8 Å²	56.8	52%	0.524	30%	0.3	S	S	.	.	S	Bend	trans	-94.8	-16.4	-164.5	14.5	0	0	0	0	115.1	Y119	Y119-S121 WeakPolarHBondContact CE2-OG 3.31Å; Y119-S121 PolarHBondContact OH-OG 2.82Å
122	D	68.8	Low	79.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.			trans	-98.9	129.1	172.2	-65.3	-35.5	0	0	0	110.1	G103 Y119 W139 K144 K148	G103-D122 VanDerWaalsContact CA-O 3.27Å; G103-D122 WeakPolarHBondContact CA-O 3.49Å; Y119-D122 HydrophobicContact CE1-CB 3.98Å; Y119-D122 PolarHBondContact OH-OD2 2.87Å; D122-W139 PolarHBondContact OD2-NE1 3.17Å; D122-K144 WeakPolarHBondContact OD1-CE 3.19Å; D122-K144 IonicContact OD1-NZ 3.91Å; D122-K144 PolarHBondContact OD1-NZ 3.42Å; D122-K148 VanDerWaalsContact CG-NZ 3.26Å; D122-K148 IonicContact OD1-NZ 2.94Å; D122-K148 PolarHBondContact OD1-NZ 3.14Å; D122-K148 WeakPolarHBondContact OD2-CD 3.33Å; D122-K148 WeakPolarHBondContact OD2-CE 3.22Å; D122-K148 IonicContact OD2-NZ 3.82Å; D122-K148 PolarHBondContact OD2-NZ 3.01Å
123	K	71.9	Confident	80.2	Confident	153 Å²	153	52.3 Å²	52.3	67%	0.665	27%	0.272	S	S	*	.	S	Bend	trans	-95.5	141.2	166.1	-63	178.4	-179.1	176.7	0	107.9
124	H	79.3	Confident	81.2	Confident	65 Å²	65	49 Å²	49	30%	0.301	25%	0.249	S	C	.	.			trans	70	74.4	-175.1	-43.1	85.3	0	0	0	112.9	R100 S141 R143	R100-H124 VanDerWaalsContact O-CA 3.26Å; R100-H124 WeakPolarHBondContact O-CA 3.31Å; H124-S141 PolarHBondContact O-OG 3.48Å; H124-R143 HydrophobicContact CB-CG 4.25Å; H124-R143 PolarHBondContact CD2-NE 2.87Å; H124-R143 PolarHBondContact CE1-NE 3.22Å; H124-R143 VanDerWaalsContact CE1-NE 3.27Å; H124-R143 PolarHBondContact ND1-NE 3.15Å; H124-R143 PolarHBondContact NE2-NE 3.47Å; H124-R143 PolarHBondContact NE2-NH2 2.04Å
125	I	89.5	Confident	82	Confident	2 Å²	2	45 Å²	45	1%	0.01	23%	0.233	C	C	.	.			trans	-84.1	130.9	167.2	-65.7	-179.6	0	0	0	108.2	L85 A98 R100 G103 I105 G127 W139 T140	L85-I125 HydrophobicContact CD1-CG2 4.01Å; A98-I125 HydrophobicContact CB-CD1 4.24Å; A98-I125 HydrophobicContact CB-CG2 4.31Å; R100-I125 PolarHBondContact O-N 3.25Å; G103-I125 VanDerWaalsContact O-CD1 3.3Å; G103-I125 WeakPolarHBondContact O-CD1 3.3Å; I105-I125 HydrophobicContact CD1-CD1 4.03Å; I105-I125 HydrophobicContact CG1-CD1 3.69Å; I125-G127 WeakPolarHBondContact CG2-O 3.46Å; I125-W139 HydrophobicContact CD1-CG 4.41Å; I125-W139 HydrophobicContact CG2-CB 4.15Å; I125-T140 WeakPolarHBondContact CA-O 3.37Å
126	S	89.3	Confident	82.5	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.042	21%	0.21	C	C	.	.			trans	-111.5	-12.5	-171.9	39	0	0	0	0	114.3	R100 T140 S142 P167 F169	R100-S126 PolarHBondContact NH2-O 2.75Å; S126-T140 PolarHBondContact N-O 3.18Å; S126-T140 PolarHBondContact OG-O 2.69Å; S126-T140 PolarHBondContact OG-OG1 3.23Å; S126-S142 WeakPolarHBondContact OG-CB 3.38Å; S126-S142 PolarHBondContact OG-N 3.3Å; S126-P167 WeakPolarHBondContact CB-O 3.43Å; S126-P167 PolarHBondContact OG-O 3.35Å; S126-F169 PolarHBondContact O-N 3Å
127	G	91.1	Very high	82.8	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	152.5	174.4	0	0	0	0	0	110.8	I125 W139 T140	I125-G127 WeakPolarHBondContact CG2-O 3.46Å; G127-W139 VanDerWaalsContact O-CA 3.29Å; G127-W139 WeakPolarHBondContact O-CA 3.5Å; G127-W139 WeakPolarHBondContact O-CB 3.34Å; G127-T140 PolarHBondContact N-OG1 3.08Å; G127-T140 PolarHBondContact O-N 3.18Å
128	L	93.3	Very high	83.1	Confident	11 Å²	11	28.8 Å²	28.8	6%	0.058	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135.6	-179.9	-178.4	74.2	0	0	0	108.7	L85 A98 I105 V137 F138 W139	L85-L128 HydrophobicContact CB-CB 3.98Å; A98-L128 HydrophobicContact CB-CD2 4.09Å; I105-L128 HydrophobicContact CD1-CD1 4.06Å; I105-L128 HydrophobicContact CG1-CD1 4.44Å; I105-L128 HydrophobicContact CG2-CD1 4.13Å; L128-V137 HydrophobicContact CD1-CG1 3.6Å; L128-V137 HydrophobicContact CG-CG1 4.5Å; L128-F138 WeakPolarHBondContact CA-O 3.42Å; L128-W139 HydrophobicContact CD1-CB 4.12Å
129	T	94.6	Very high	83.6	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	156.2	169.1	-168.8	0	0	0	0	112.3	D87 F138 I170 V172	D87-T129 WeakPolarHBondContact OD2-CA 3.44Å; D87-T129 WeakPolarHBondContact OD2-CB 2.92Å; D87-T129 PolarHBondContact OD2-OG1 2.93Å; T129-F138 HydrophobicContact CG2-CB 3.97Å; T129-F138 PolarHBondContact N-O 3.05Å; T129-F138 PolarHBondContact O-N 2.92Å; T129-I170 WeakPolarHBondContact CB-O 3.46Å; T129-I170 HydrophobicContact CG2-CB 4.47Å; T129-I170 HydrophobicContact CG2-CG1 4.07Å; T129-I170 HydrophobicContact CG2-CG2 3.94Å; T129-V172 HydrophobicContact CG2-CB 4.13Å; T129-V172 HydrophobicContact CG2-CG1 4.05Å
130	V	92.7	Very high	84.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129	-178.9	173.9	0	0	0	0	110.2	D87 H89 Y96 W132 V137 L152 V172	D87-V130 HydrophobicContact CB-CB 4.46Å; D87-V130 HydrophobicContact CB-CG2 4.02Å; D87-V130 PolarHBondContact OD2-N 3.01Å; H89-V130 HydrophobicContact CB-CG1 4.26Å; Y96-V130 HydrophobicContact CD2-CG2 3.63Å; Y96-V130 HydrophobicContact CE2-CG2 4.23Å; Y96-V130 HydrophobicContact CG-CG2 3.85Å; V130-W132 VanDerWaalsContact O-CE3 3.23Å; V130-V137 HydrophobicContact CG2-CG2 4.45Å; V130-L152 HydrophobicContact CG1-CD2 4.04Å; V130-V172 VanDerWaalsContact O-CG1 3.29Å; V130-V172 WeakPolarHBondContact O-CG1 3.29Å
131	D	88.1	Confident	85.1	Confident	7 Å²	7	24.6 Å²	24.6	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	95.6	172.5	166.7	19.5	0	0	0	108.2	V133 G134 N135 G136 F138 K149 V172 P174	D131-V133 VanDerWaalsContact C-N 3.34Å; D131-G134 VanDerWaalsContact OD1-CA 3.3Å; D131-G134 WeakPolarHBondContact OD1-CA 3.46Å; D131-G134 PolarHBondContact OD1-N 3.34Å; D131-G134 VanDerWaalsContact OD2-CA 3.32Å; D131-G134 WeakPolarHBondContact OD2-CA 3.43Å; D131-N135 WeakPolarHBondContact O-CA 3.41Å; D131-N135 PolarHBondContact O-N 2.84Å; D131-G136 PolarHBondContact N-O 2.84Å; D131-G136 PolarHBondContact O-N 3.01Å; D131-F138 HydrophobicContact CB-CD2 3.95Å; D131-F138 HydrophobicContact CB-CE2 3.63Å; D131-K149 IonicContact OD2-NZ 2.64Å; D131-K149 PolarHBondContact OD2-NZ 3.09Å; D131-V172 HydrophobicContact CB-CG1 4.34Å; D131-P174 WeakPolarHBondContact OD1-CB 3.41Å
132	W	84.8	Confident	85.9	Confident	8 Å²	8	22.7 Å²	22.7	3%	0.03	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.1	-174.5	64.1	89.9	0	0	0	114.2	V130 V172 P174 Q308 P309	V130-W132 VanDerWaalsContact O-CE3 3.23Å; W132-V172 HydrophobicContact CZ3-CG1 4.15Å; W132-P174 HydrophobicContact CD2-CG 3.87Å; W132-P174 VanDerWaalsContact CE2-CG 3.49Å; W132-P174 HydrophobicContact CE3-CG 4.07Å; W132-P174 HydrophobicContact CH2-CG 3.57Å; W132-P174 VanDerWaalsContact CZ2-CD 3.41Å; W132-P174 HydrophobicContact CZ2-CG 3.35Å; W132-P174 HydrophobicContact CZ3-CG 3.93Å; W132-Q308 HydrophobicContact CD2-CB 3.76Å; W132-Q308 HydrophobicContact CD2-CG 3.57Å; W132-Q308 HydrophobicContact CE3-CB 4.36Å; W132-Q308 HydrophobicContact CE3-CG 3.65Å; W132-Q308 HydrophobicContact CG-CB 3.93Å; W132-Q308 HydrophobicContact CG-CG 4.11Å; W132-Q308 HydrophobicContact CH2-CG 4.18Å; W132-Q308 HydrophobicContact CZ2-CB 4.19Å; W132-Q308 HydrophobicContact CZ2-CG 4.1Å; W132-Q308 HydrophobicContact CZ3-CG 3.97Å; W132-P309 PolarHBondContact NE1-O 2.9Å
133	V	76.6	Confident	86.7	Confident	50 Å²	50	31.7 Å²	31.7	30%	0.303	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-48.4	174.5	-173.7	0	0	0	0	109.7	D131 N135 P174	D131-V133 VanDerWaalsContact C-N 3.34Å; V133-N135 VanDerWaalsContact C-N 3.26Å; V133-N135 PolarHBondContact O-N 2.84Å; V133-P174 HydrophobicContact CB-CB 4.02Å; V133-P174 HydrophobicContact CB-CG 4.32Å; V133-P174 HydrophobicContact CG2-CB 3.98Å; V133-P174 HydrophobicContact CG2-CG 3.77Å
134	G	71.5	Confident	87.3	Confident	39 Å²	39	29.1 Å²	29.1	40%	0.402	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	17.1	176.4	0	0	0	0	0	114.6	D131 G136 K149	D131-G134 VanDerWaalsContact OD1-CA 3.3Å; D131-G134 WeakPolarHBondContact OD1-CA 3.46Å; D131-G134 PolarHBondContact OD1-N 3.34Å; D131-G134 VanDerWaalsContact OD2-CA 3.32Å; D131-G134 WeakPolarHBondContact OD2-CA 3.43Å; G134-G136 PolarHBondContact O-N 3.26Å; G134-K149 PolarHBondContact O-NZ 2.93Å
135	N	81.1	Confident	87.6	Confident	89 Å²	89	26.3 Å²	26.3	48%	0.476	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	55.6	172.1	-76.4	-40.8	0	0	0	115.4	D131 V133 L152	D131-N135 WeakPolarHBondContact O-CA 3.41Å; D131-N135 PolarHBondContact O-N 2.84Å; V133-N135 VanDerWaalsContact C-N 3.26Å; V133-N135 PolarHBondContact O-N 2.84Å; N135-L152 HydrophobicContact CB-CD1 4.06Å; N135-L152 HydrophobicContact CB-CG 4.42Å; N135-L152 PolarHBondContact O-N 3.41Å; N135-L152 WeakPolarHBondContact OD1-CD1 3.15Å
136	G	86.7	Confident	87.6	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	177.4	173.2	0	0	0	0	0	116	D131 G134 M150	D131-G136 PolarHBondContact N-O 2.84Å; D131-G136 PolarHBondContact O-N 3.01Å; G134-G136 PolarHBondContact O-N 3.26Å; G136-M150 CarbonylContact C-O 3.55Å; G136-M150 WeakPolarHBondContact CA-O 3.5Å
137	V	91.1	Very high	87.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.4	179.1	-172.4	0	0	0	0	108.2	Y96 L128 V130 K149 M150 L152	Y96-V137 HydrophobicContact CD1-CG2 3.9Å; Y96-V137 HydrophobicContact CE1-CG2 3.88Å; L128-V137 HydrophobicContact CD1-CG1 3.6Å; L128-V137 HydrophobicContact CG-CG1 4.5Å; V130-V137 HydrophobicContact CG2-CG2 4.45Å; V137-K149 WeakPolarHBondContact O-CA 3.48Å; V137-M150 HydrophobicContact CB-CE 3.79Å; V137-M150 HydrophobicContact CB-CG 4.14Å; V137-M150 HydrophobicContact CG1-CE 4Å; V137-M150 HydrophobicContact CG2-CE 4.05Å; V137-M150 PolarHBondContact N-O 3.45Å; V137-M150 PolarHBondContact O-N 2.95Å; V137-L152 HydrophobicContact CG2-CD2 3.94Å
138	F	92.8	Very high	87.6	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.8	174.2	-71	-95	0	0	0	110.6	L128 T129 D131 I147 K148 K149 I160 I170 L179 L193	L128-F138 WeakPolarHBondContact CA-O 3.42Å; T129-F138 HydrophobicContact CG2-CB 3.97Å; T129-F138 PolarHBondContact N-O 3.05Å; T129-F138 PolarHBondContact O-N 2.92Å; D131-F138 HydrophobicContact CB-CD2 3.95Å; D131-F138 HydrophobicContact CB-CE2 3.63Å; F138-I147 HydrophobicContact CD1-CG2 4.35Å; F138-K148 VanDerWaalsContact CA-O 3.28Å; F138-K148 WeakPolarHBondContact CA-O 3.05Å; F138-K149 HydrophobicContact CD1-CB 3.96Å; F138-K149 HydrophobicContact CD1-CG 4.33Å; F138-K149 HydrophobicContact CD2-CG 4.45Å; F138-K149 HydrophobicContact CE1-CB 3.89Å; F138-K149 HydrophobicContact CE1-CD 4Å; F138-K149 HydrophobicContact CE1-CG 4.14Å; F138-K149 HydrophobicContact CE2-CD 3.86Å; F138-K149 HydrophobicContact CE2-CG 4.25Å; F138-K149 HydrophobicContact CZ-CB 4.36Å; F138-K149 HydrophobicContact CZ-CD 3.58Å; F138-K149 HydrophobicContact CZ-CG 4.11Å; F138-I160 HydrophobicContact CE1-CG1 4.13Å; F138-I170 HydrophobicContact CB-CD1 4.26Å; F138-L179 HydrophobicContact CD1-CD1 4.33Å; F138-L179 HydrophobicContact CD1-CD2 4.02Å; F138-L179 HydrophobicContact CD2-CD1 4.48Å; F138-L179 HydrophobicContact CE1-CD2 3.96Å; F138-L179 HydrophobicContact CG-CD1 4.27Å; F138-L193 HydrophobicContact CE1-CD2 4.13Å; F138-L193 HydrophobicContact CZ-CD2 3.7Å
139	W	93.4	Very high	87.4	Confident	1 Å²	1	28.8 Å²	28.8	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.8	171	69.2	99.7	0	0	0	112.2	I105 Y119 D122 I125 G127 L128 I147 K148 M150 E157	I105-W139 HydrophobicContact CD1-CB 4.25Å; I105-W139 HydrophobicContact CD1-CD2 3.69Å; I105-W139 HydrophobicContact CD1-CE3 3.8Å; I105-W139 HydrophobicContact CD1-CG 3.92Å; I105-W139 HydrophobicContact CD1-CZ3 4.4Å; Y119-W139 HydrophobicContact CD1-CZ2 4.01Å; Y119-W139 HydrophobicContact CD2-CH2 4.24Å; Y119-W139 HydrophobicContact CD2-CZ2 4.08Å; Y119-W139 AromaticContact CE1-CE2 3.83Å; Y119-W139 AromaticContact CE1-CZ2 3.62Å; Y119-W139 HydrophobicContact CE1-CZ2 3.62Å; Y119-W139 AromaticContact CE1-NE1 3.77Å; Y119-W139 HydrophobicContact CE2-CH2 4.14Å; Y119-W139 AromaticContact CE2-CZ2 3.71Å; Y119-W139 HydrophobicContact CE2-CZ2 3.71Å; Y119-W139 HydrophobicContact CG-CZ2 4.21Å; Y119-W139 AromaticContact CZ-CZ2 3.45Å; Y119-W139 VanDerWaalsContact CZ-CZ2 3.45Å; D122-W139 PolarHBondContact OD2-NE1 3.17Å; I125-W139 HydrophobicContact CD1-CG 4.41Å; I125-W139 HydrophobicContact CG2-CB 4.15Å; G127-W139 VanDerWaalsContact O-CA 3.29Å; G127-W139 WeakPolarHBondContact O-CA 3.5Å; G127-W139 WeakPolarHBondContact O-CB 3.34Å; L128-W139 HydrophobicContact CD1-CB 4.12Å; W139-I147 WeakPolarHBondContact O-CA 3.34Å; W139-K148 HydrophobicContact CD2-CB 4Å; W139-K148 HydrophobicContact CE3-CB 4.24Å; W139-K148 HydrophobicContact CH2-CB 3.76Å; W139-K148 HydrophobicContact CH2-CD 4.33Å; W139-K148 HydrophobicContact CZ2-CB 3.47Å; W139-K148 VanDerWaalsContact CZ2-CB 3.47Å; W139-K148 HydrophobicContact CZ2-CD 3.44Å; W139-K148 VanDerWaalsContact CZ2-CD 3.44Å; W139-K148 HydrophobicContact CZ2-CG 4.13Å; W139-K148 HydrophobicContact CZ3-CB 4.13Å; W139-K148 PolarHBondContact N-O 2.83Å; W139-K148 VanDerWaalsContact N-O 3.07Å; W139-K148 PolarHBondContact O-N 2.79Å; W139-M150 HydrophobicContact CH2-CB 3.98Å; W139-M150 HydrophobicContact CH2-CG 4.16Å; W139-M150 HydrophobicContact CH2-SD 4.14Å; W139-M150 HydrophobicContact CZ3-CB 3.8Å; W139-M150 HydrophobicContact CZ3-CE 4.39Å; W139-M150 HydrophobicContact CZ3-CG 3.64Å; W139-M150 HydrophobicContact CZ3-SD 3.91Å; W139-E157 HydrophobicContact CH2-CG 4.14Å; W139-E157 HydrophobicContact CZ2-CG 4.35Å
140	T	92.4	Very high	87.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	144.2	177.1	71.8	0	0	0	0	110.9	I125 S126 G127 I147 P167 I170	I125-T140 WeakPolarHBondContact CA-O 3.37Å; S126-T140 PolarHBondContact N-O 3.18Å; S126-T140 PolarHBondContact OG-O 2.69Å; S126-T140 PolarHBondContact OG-OG1 3.23Å; G127-T140 PolarHBondContact N-OG1 3.08Å; G127-T140 PolarHBondContact O-N 3.18Å; T140-I147 HydrophobicContact CG2-CD1 4.26Å; T140-I147 HydrophobicContact CG2-CG1 3.89Å; T140-P167 PolarHBondContact OG1-O 3.35Å; T140-I170 HydrophobicContact CG2-CB 3.64Å; T140-I170 HydrophobicContact CG2-CD1 3.72Å; T140-I170 HydrophobicContact CG2-CG1 4.27Å; T140-I170 HydrophobicContact CG2-CG2 3.77Å
141	S	89.9	Confident	86.7	Confident	2 Å²	2	31 Å²	31	1%	0.014	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	102.6	171.8	-175.3	0	0	0	0	109.8	H124 R143 K144 G145 Q146	H124-S141 PolarHBondContact O-OG 3.48Å; S141-R143 PolarHBondContact O-N 3.29Å; S141-K144 PolarHBondContact O-N 3.17Å; S141-G145 PolarHBondContact O-N 2.99Å; S141-Q146 PolarHBondContact N-O 3.38Å; S141-Q146 PolarHBondContact O-N 3.02Å
142	S	85.6	Confident	86.5	Confident	36 Å²	36	31.1 Å²	31.1	25%	0.252	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-46.1	-177.1	56.3	0	0	0	0	112.3	S126 K144 G145 P167	S126-S142 WeakPolarHBondContact OG-CB 3.38Å; S126-S142 PolarHBondContact OG-N 3.3Å; S142-K144 PolarHBondContact O-N 3.47Å; S142-G145 PolarHBondContact O-N 3.39Å; S142-P167 WeakPolarHBondContact CA-O 3.45Å
143	R	84.5	Confident	86.3	Confident	188 Å²	188	34.8 Å²	34.8	71%	0.709	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-29.4	179	-69.8	-166.5	-172.7	-119.4	7.2	114.2	H124 S141	H124-R143 HydrophobicContact CB-CG 4.25Å; H124-R143 PolarHBondContact CD2-NE 2.87Å; H124-R143 PolarHBondContact CE1-NE 3.22Å; H124-R143 VanDerWaalsContact CE1-NE 3.27Å; H124-R143 PolarHBondContact ND1-NE 3.15Å; H124-R143 PolarHBondContact NE2-NE 3.47Å; H124-R143 PolarHBondContact NE2-NH2 2.04Å; S141-R143 PolarHBondContact O-N 3.29Å
144	K	84.8	Confident	86.5	Confident	99 Å²	99	33.7 Å²	33.7	43%	0.43	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-9.7	-178.9	-67.3	-172.9	179	-178.8	0	113.4	D122 S141 S142 Q146	D122-K144 WeakPolarHBondContact OD1-CE 3.19Å; D122-K144 IonicContact OD1-NZ 3.91Å; D122-K144 PolarHBondContact OD1-NZ 3.42Å; S141-K144 PolarHBondContact O-N 3.17Å; S142-K144 PolarHBondContact O-N 3.47Å; K144-Q146 HydrophobicContact CB-CB 4.46Å; K144-Q146 HydrophobicContact CB-CG 4.48Å; K144-Q146 WeakPolarHBondContact O-CG 3.3Å; K144-Q146 PolarHBondContact O-N 3.35Å
145	G	86.4	Confident	86.9	Confident	7 Å²	7	38.5 Å²	38.5	7%	0.072	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	41.3	-176.8	0	0	0	0	0	113.2	S141 S142 R162 H163 L164	S141-G145 PolarHBondContact O-N 2.99Å; S142-G145 PolarHBondContact O-N 3.39Å; G145-R162 CarbonylContact O-C 3.56Å; G145-H163 PolarHBondContact O-N 2.87Å; G145-L164 WeakPolarHBondContact CA-O 3.4Å; G145-L164 PolarHBondContact O-N 3.11Å
146	Q	89.3	Confident	86.8	Confident	38 Å²	38	39.7 Å²	39.7	18%	0.178	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	148.5	-171.2	-75.7	172.1	26.2	0	0	113	S141 K144 T159 L161 R162	S141-Q146 PolarHBondContact N-O 3.38Å; S141-Q146 PolarHBondContact O-N 3.02Å; K144-Q146 HydrophobicContact CB-CB 4.46Å; K144-Q146 HydrophobicContact CB-CG 4.48Å; K144-Q146 WeakPolarHBondContact O-CG 3.3Å; K144-Q146 PolarHBondContact O-N 3.35Å; Q146-T159 HydrophobicContact CB-CG2 4.21Å; Q146-T159 HydrophobicContact CG-CG2 4.01Å; Q146-L161 WeakPolarHBondContact CA-O 3.37Å; Q146-R162 HydrophobicContact CG-CG 4.29Å
147	I	90.4	Very high	86.8	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.8	165.2	-60.3	176	0	0	0	107.8	F138 W139 T140 I160 L161 L164 I170 L179 W181	F138-I147 HydrophobicContact CD1-CG2 4.35Å; W139-I147 WeakPolarHBondContact O-CA 3.34Å; T140-I147 HydrophobicContact CG2-CD1 4.26Å; T140-I147 HydrophobicContact CG2-CG1 3.89Å; I147-I160 PolarHBondContact O-N 2.95Å; I147-L161 HydrophobicContact CB-CB 4.29Å; I147-L161 HydrophobicContact CD1-CD1 4.21Å; I147-L161 PolarHBondContact N-O 3.26Å; I147-L161 PolarHBondContact O-N 2.94Å; I147-L164 HydrophobicContact CB-CD1 4.42Å; I147-L164 HydrophobicContact CD1-CD1 3.63Å; I147-L164 HydrophobicContact CG1-CD1 3.54Å; I147-I170 HydrophobicContact CD1-CD1 4.1Å; I147-I170 HydrophobicContact CG1-CD1 4.49Å; I147-I170 HydrophobicContact CG2-CD1 3.72Å; I147-L179 HydrophobicContact CG2-CD2 4.32Å; I147-W181 HydrophobicContact CD1-CB 4.44Å; I147-W181 HydrophobicContact CD1-CD2 3.53Å; I147-W181 HydrophobicContact CD1-CE3 3.85Å; I147-W181 HydrophobicContact CD1-CG 3.8Å; I147-W181 HydrophobicContact CD1-CZ2 4.33Å; I147-W181 HydrophobicContact CD1-CZ3 4.4Å
148	K	89.1	Confident	86.4	Confident	13 Å²	13	51.4 Å²	51.4	6%	0.057	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	155	-179	-67.4	-179.4	176.7	179	0	111.1	Y119 D122 F138 W139 E157 R158 T159	Y119-K148 PolarHBondContact OH-NZ 3.05Å; D122-K148 VanDerWaalsContact CG-NZ 3.26Å; D122-K148 IonicContact OD1-NZ 2.94Å; D122-K148 PolarHBondContact OD1-NZ 3.14Å; D122-K148 WeakPolarHBondContact OD2-CD 3.33Å; D122-K148 WeakPolarHBondContact OD2-CE 3.22Å; D122-K148 IonicContact OD2-NZ 3.82Å; D122-K148 PolarHBondContact OD2-NZ 3.01Å; F138-K148 VanDerWaalsContact CA-O 3.28Å; F138-K148 WeakPolarHBondContact CA-O 3.05Å; W139-K148 HydrophobicContact CD2-CB 4Å; W139-K148 HydrophobicContact CE3-CB 4.24Å; W139-K148 HydrophobicContact CH2-CB 3.76Å; W139-K148 HydrophobicContact CH2-CD 4.33Å; W139-K148 HydrophobicContact CZ2-CB 3.47Å; W139-K148 VanDerWaalsContact CZ2-CB 3.47Å; W139-K148 HydrophobicContact CZ2-CD 3.44Å; W139-K148 VanDerWaalsContact CZ2-CD 3.44Å; W139-K148 HydrophobicContact CZ2-CG 4.13Å; W139-K148 HydrophobicContact CZ3-CB 4.13Å; W139-K148 PolarHBondContact N-O 2.83Å; W139-K148 VanDerWaalsContact N-O 3.07Å; W139-K148 PolarHBondContact O-N 2.79Å; K148-E157 HydrophobicContact CD-CG 4.46Å; K148-E157 WeakPolarHBondContact CD-OE1 3.26Å; K148-E157 WeakPolarHBondContact CE-OE1 3.49Å; K148-E157 IonicContact NZ-OE1 3.44Å; K148-E157 PolarHBondContact NZ-OE1 2.81Å; K148-R158 CarbonylContact C-O 3.57Å; K148-R158 WeakPolarHBondContact CA-O 3.06Å; K148-T159 HydrophobicContact CG-CG2 4.38Å
149	K	89.6	Confident	86	Confident	21 Å²	21	53 Å²	53	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145.5	168.5	-172.7	176.6	-177.2	165.4	0	109.3	D131 G134 V137 F138 E157 R158 I160	D131-K149 IonicContact OD2-NZ 2.64Å; D131-K149 PolarHBondContact OD2-NZ 3.09Å; G134-K149 PolarHBondContact O-NZ 2.93Å; V137-K149 WeakPolarHBondContact O-CA 3.48Å; F138-K149 HydrophobicContact CD1-CB 3.96Å; F138-K149 HydrophobicContact CD1-CG 4.33Å; F138-K149 HydrophobicContact CD2-CG 4.45Å; F138-K149 HydrophobicContact CE1-CB 3.89Å; F138-K149 HydrophobicContact CE1-CD 4Å; F138-K149 HydrophobicContact CE1-CG 4.14Å; F138-K149 HydrophobicContact CE2-CD 3.86Å; F138-K149 HydrophobicContact CE2-CG 4.25Å; F138-K149 HydrophobicContact CZ-CB 4.36Å; F138-K149 HydrophobicContact CZ-CD 3.58Å; F138-K149 HydrophobicContact CZ-CG 4.11Å; K149-E157 WeakPolarHBondContact O-CA 3.29Å; K149-R158 HydrophobicContact CB-CG 4.5Å; K149-R158 PolarHBondContact N-O 2.97Å; K149-R158 PolarHBondContact O-N 3.1Å; K149-I160 HydrophobicContact CB-CD1 3.94Å; K149-I160 HydrophobicContact CB-CG1 3.82Å
150	M	89.3	Confident	85.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	163.2	161.2	71.3	-172.4	170.2	0	0	109.1	I105 L118 Y119 G136 V137 W139	I105-M150 HydrophobicContact CB-CE 4.23Å; I105-M150 HydrophobicContact CD1-CE 3.87Å; I105-M150 HydrophobicContact CG2-CE 3.94Å; L118-M150 HydrophobicContact CB-CE 3.89Å; L118-M150 HydrophobicContact CB-SD 4.35Å; L118-M150 HydrophobicContact CD1-CE 3.78Å; Y119-M150 HydrophobicContact CD2-SD 4.46Å; G136-M150 CarbonylContact C-O 3.55Å; G136-M150 WeakPolarHBondContact CA-O 3.5Å; V137-M150 HydrophobicContact CB-CE 3.79Å; V137-M150 HydrophobicContact CB-CG 4.14Å; V137-M150 HydrophobicContact CG1-CE 4Å; V137-M150 HydrophobicContact CG2-CE 4.05Å; V137-M150 PolarHBondContact N-O 3.45Å; V137-M150 PolarHBondContact O-N 2.95Å; W139-M150 HydrophobicContact CH2-CB 3.98Å; W139-M150 HydrophobicContact CH2-CG 4.16Å; W139-M150 HydrophobicContact CH2-SD 4.14Å; W139-M150 HydrophobicContact CZ3-CB 3.8Å; W139-M150 HydrophobicContact CZ3-CE 4.39Å; W139-M150 HydrophobicContact CZ3-CG 3.64Å; W139-M150 HydrophobicContact CZ3-SD 3.91Å
151	D	83.9	Confident	85	Confident	47 Å²	47	56.4 Å²	56.4	25%	0.251	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	158.7	173.8	-61.2	-12.9	0	0	0	110.7	N153 G154 K155 N156	D151-N153 WeakPolarHBondContact CB-OD1 3.24Å; D151-N153 PolarHBondContact O-N 2.74Å; D151-G154 PolarHBondContact O-N 2.97Å; D151-K155 PolarHBondContact N-O 2.94Å; D151-N156 PolarHBondContact OD2-ND2 2.85Å
152	L	83.6	Confident	84.7	Confident	11 Å²	11	63 Å²	63	6%	0.058	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-12.7	179.3	-61.6	175.3	0	0	0	114.7	Y96 K107 V130 N135 V137	Y96-L152 HydrophobicContact CE1-CD2 4.42Å; K107-L152 PolarHBondContact NZ-O 2.71Å; V130-L152 HydrophobicContact CG1-CD2 4.04Å; N135-L152 HydrophobicContact CB-CD1 4.06Å; N135-L152 HydrophobicContact CB-CG 4.42Å; N135-L152 PolarHBondContact O-N 3.41Å; N135-L152 WeakPolarHBondContact OD1-CD1 3.15Å; V137-L152 HydrophobicContact CG2-CD2 3.94Å
153	N	81.1	Confident	84.5	Confident	85 Å²	85	69.8 Å²	69.8	46%	0.455	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.4	176.7	65.1	23	0	0	0	113.8	D151 K155	D151-N153 WeakPolarHBondContact CB-OD1 3.24Å; D151-N153 PolarHBondContact O-N 2.74Å; N153-K155 VanDerWaalsContact OD1-CB 3.23Å; N153-K155 WeakPolarHBondContact OD1-CB 3.36Å; N153-K155 WeakPolarHBondContact OD1-CG 3.48Å; N153-K155 PolarHBondContact OD1-N 2.89Å
154	G	80.1	Confident	84.5	Confident	26 Å²	26	61.4 Å²	61.4	27%	0.268	29%	0.291	S	S	.	.	S	Bend	trans	84.5	8.8	-177.9	0	0	0	0	0	115.5	D151	D151-G154 PolarHBondContact O-N 2.97Å
155	K	79.4	Confident	84.5	Confident	141 Å²	141	60.4 Å²	60.4	61%	0.613	30%	0.297	S	S	*	.			trans	-97.9	174.3	175.6	-59.5	-177	176.5	-178.2	0	111.5	D151 N153 E157	D151-K155 PolarHBondContact N-O 2.94Å; N153-K155 VanDerWaalsContact OD1-CB 3.23Å; N153-K155 WeakPolarHBondContact OD1-CB 3.36Å; N153-K155 WeakPolarHBondContact OD1-CG 3.48Å; N153-K155 PolarHBondContact OD1-N 2.89Å; K155-E157 PolarHBondContact O-N 3.5Å
156	N	79.9	Confident	84.6	Confident	114 Å²	114	66.8 Å²	66.8	61%	0.61	33%	0.325	S	S	*	.			trans	55.1	43.6	174.5	-59	-31.4	0	0	0	114.2	D151 R158	D151-N156 PolarHBondContact OD2-ND2 2.85Å; N156-R158 PolarHBondContact O-N 3.37Å
157	E	85.8	Confident	84.7	Confident	90 Å²	90	65 Å²	65	42%	0.421	32%	0.316	S	S	.	.			trans	-54.9	124.3	169.2	178.5	-171.4	-174.9	0	0	110.2	Y119 W139 K148 K149 K155	Y119-E157 VanDerWaalsContact CE2-CD 3.45Å; Y119-E157 HydrophobicContact CE2-CG 4.22Å; Y119-E157 WeakPolarHBondContact CE2-OE2 3.47Å; Y119-E157 PolarHBondContact OH-OE1 3.26Å; W139-E157 HydrophobicContact CH2-CG 4.14Å; W139-E157 HydrophobicContact CZ2-CG 4.35Å; K148-E157 HydrophobicContact CD-CG 4.46Å; K148-E157 WeakPolarHBondContact CD-OE1 3.26Å; K148-E157 WeakPolarHBondContact CE-OE1 3.49Å; K148-E157 IonicContact NZ-OE1 3.44Å; K148-E157 PolarHBondContact NZ-OE1 2.81Å; K149-E157 WeakPolarHBondContact O-CA 3.29Å; K155-E157 PolarHBondContact O-N 3.5Å
158	R	82.4	Confident	84.7	Confident	155 Å²	155	66 Å²	66	59%	0.585	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.3	171.5	61.6	-175.3	-170.7	-165.2	4.3	111.7	K148 K149 N156 I160	K148-R158 CarbonylContact C-O 3.57Å; K148-R158 WeakPolarHBondContact CA-O 3.06Å; K149-R158 HydrophobicContact CB-CG 4.5Å; K149-R158 PolarHBondContact N-O 2.97Å; K149-R158 PolarHBondContact O-N 3.1Å; N156-R158 PolarHBondContact O-N 3.37Å; R158-I160 HydrophobicContact CG-CD1 3.84Å
159	T	84.6	Confident	84.7	Confident	38 Å²	38	67.1 Å²	67.1	23%	0.233	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.7	170.3	-50.7	0	0	0	0	109.4	Q146 K148 L161 R162	Q146-T159 HydrophobicContact CB-CG2 4.21Å; Q146-T159 HydrophobicContact CG-CG2 4.01Å; K148-T159 HydrophobicContact CG-CG2 4.38Å; T159-L161 VanDerWaalsContact CG2-O 3.24Å; T159-L161 WeakPolarHBondContact CG2-O 3.46Å; T159-R162 HydrophobicContact CG2-CG 3.58Å
160	I	83.4	Confident	84.9	Confident	47 Å²	47	66.4 Å²	66.4	24%	0.241	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-42.5	179.7	-54	-62.4	0	0	0	110.3	F138 I147 K149 R158 F191	F138-I160 HydrophobicContact CE1-CG1 4.13Å; I147-I160 PolarHBondContact O-N 2.95Å; K149-I160 HydrophobicContact CB-CD1 3.94Å; K149-I160 HydrophobicContact CB-CG1 3.82Å; R158-I160 HydrophobicContact CG-CD1 3.84Å; I160-F191 HydrophobicContact CG2-CE1 3.8Å; I160-F191 HydrophobicContact CG2-CZ 4.34Å
161	L	81.9	Confident	85.1	Confident	25 Å²	25	66.9 Å²	66.9	13%	0.131	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	145.4	178.5	-66.4	171.8	0	0	0	111.3	Q146 I147 T159 L164 W181 F191	Q146-L161 WeakPolarHBondContact CA-O 3.37Å; I147-L161 HydrophobicContact CB-CB 4.29Å; I147-L161 HydrophobicContact CD1-CD1 4.21Å; I147-L161 PolarHBondContact N-O 3.26Å; I147-L161 PolarHBondContact O-N 2.94Å; T159-L161 VanDerWaalsContact CG2-O 3.24Å; T159-L161 WeakPolarHBondContact CG2-O 3.46Å; L161-L164 HydrophobicContact CB-CD1 3.87Å; L161-L164 HydrophobicContact CB-CD2 4.4Å; L161-L164 HydrophobicContact CB-CG 4.33Å; L161-W181 HydrophobicContact CD1-CH2 3.6Å; L161-W181 HydrophobicContact CD1-CZ2 4.05Å; L161-W181 HydrophobicContact CD1-CZ3 4.11Å; L161-F191 HydrophobicContact CD1-CB 4.18Å; L161-F191 HydrophobicContact CD1-CD1 4.37Å; L161-F191 HydrophobicContact CD1-CD2 4.18Å; L161-F191 HydrophobicContact CD1-CG 4.01Å; L161-F191 HydrophobicContact CD2-CD2 4.13Å; L161-F191 HydrophobicContact CD2-CE2 3.94Å; L161-F191 HydrophobicContact CD2-CZ 4.31Å
162	R	84.5	Confident	85.4	Confident	140 Å²	140	65 Å²	65	53%	0.528	32%	0.318	S	S	.	.			trans	-129.3	167.4	-179.2	-63.4	178.7	-175.1	-89.7	-0.6	110.2	G145 Q146 T159 L164	G145-R162 CarbonylContact O-C 3.56Å; Q146-R162 HydrophobicContact CG-CG 4.29Å; T159-R162 HydrophobicContact CG2-CG 3.58Å; R162-L164 VanDerWaalsContact C-N 3.27Å; R162-L164 PolarHBondContact O-N 3.18Å
163	H	80.8	Confident	85.6	Confident	180 Å²	180	64.4 Å²	64.4	83%	0.833	32%	0.315	S	S	*	.	S	Bend	trans	56.5	36.6	175.4	-50.3	-78.9	0	0	0	114	G145	G145-H163 PolarHBondContact O-N 2.87Å
164	L	84.8	Confident	85.3	Confident	11 Å²	11	61 Å²	61	6%	0.058	30%	0.298	C	S	.	.			trans	-88.4	138.2	177.7	-57.5	176	0	0	0	111.6	G145 I147 L161 R162 Q166 P167 W181 K198	G145-L164 WeakPolarHBondContact CA-O 3.4Å; G145-L164 PolarHBondContact O-N 3.11Å; I147-L164 HydrophobicContact CB-CD1 4.42Å; I147-L164 HydrophobicContact CD1-CD1 3.63Å; I147-L164 HydrophobicContact CG1-CD1 3.54Å; L161-L164 HydrophobicContact CB-CD1 3.87Å; L161-L164 HydrophobicContact CB-CD2 4.4Å; L161-L164 HydrophobicContact CB-CG 4.33Å; R162-L164 VanDerWaalsContact C-N 3.27Å; R162-L164 PolarHBondContact O-N 3.18Å; L164-Q166 PolarHBondContact O-N 2.85Å; L164-P167 HydrophobicContact CB-CB 4.24Å; L164-P167 HydrophobicContact CB-CG 3.91Å; L164-P167 HydrophobicContact CD1-CB 4.12Å; L164-P167 HydrophobicContact CD1-CG 4.14Å; L164-W181 HydrophobicContact CD1-CZ2 4.43Å; L164-W181 HydrophobicContact CD2-CZ2 4.11Å; L164-K198 HydrophobicContact CD2-CD 4.46Å; L164-K198 VanDerWaalsContact CD2-NZ 3.27Å
165	S	84.5	Confident	85	Confident	78 Å²	78	62.5 Å²	62.5	55%	0.545	30%	0.302	S	S	.	.	S	Bend	trans	-71.3	98.2	175.3	-54.3	0	0	0	0	110.7	S183 G184	S165-S183 PolarHBondContact O-OG 3Å; S165-S183 VanDerWaalsContact O-OG 3.09Å; S165-G184 PolarHBondContact O-N 2.89Å
166	Q	88.2	Confident	84.7	Confident	141 Å²	141	58.9 Å²	58.9	66%	0.659	29%	0.287	S	S	*	.	S	Bend	trans	42	59.1	175.8	-57.1	-167.7	25.9	0	0	115.3	L164 S168	L164-Q166 PolarHBondContact O-N 2.85Å; Q166-S168 PolarHBondContact O-N 3.42Å
167	P	91.9	Very high	84.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.282	C	S	.	.			trans	-63.3	135.4	-177.7	28.8	-37	0	0	0	111.4	S126 T140 S142 L164 L182	S126-P167 WeakPolarHBondContact CB-O 3.43Å; S126-P167 PolarHBondContact OG-O 3.35Å; T140-P167 PolarHBondContact OG1-O 3.35Å; S142-P167 WeakPolarHBondContact CA-O 3.45Å; L164-P167 HydrophobicContact CB-CB 4.24Å; L164-P167 HydrophobicContact CB-CG 3.91Å; L164-P167 HydrophobicContact CD1-CB 4.12Å; L164-P167 HydrophobicContact CD1-CG 4.14Å; P167-L182 CarbonylContact C-O 3.44Å; P167-L182 WeakPolarHBondContact CA-O 3.42Å
168	S	89.9	Confident	84.5	Confident	22 Å²	22	57.7 Å²	57.7	15%	0.154	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	163.8	177.6	65.9	0	0	0	0	110.3	Q166 L182	Q166-S168 PolarHBondContact O-N 3.42Å; S168-L182 PolarHBondContact N-O 3.28Å; S168-L182 PolarHBondContact O-N 3.49Å
169	F	89.8	Confident	84.8	Confident	37 Å²	37	50.3 Å²	50.3	16%	0.162	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	40.9	97.3	176.6	-65.4	-83.2	0	0	0	115.9	L85 S126 W181 L182 E209 V210 L211	L85-F169 HydrophobicContact CD2-CE1 4.3Å; S126-F169 PolarHBondContact O-N 3Å; F169-W181 VanDerWaalsContact O-CA 3.28Å; F169-W181 WeakPolarHBondContact O-CA 3.37Å; F169-L182 HydrophobicContact CB-CD1 4.02Å; F169-L182 HydrophobicContact CB-CG 4.18Å; F169-L182 HydrophobicContact CD2-CD1 4.18Å; F169-L182 HydrophobicContact CG-CD1 4.43Å; F169-L182 PolarHBondContact O-N 3.36Å; F169-E209 VanDerWaalsContact CD2-O 3.29Å; F169-E209 WeakPolarHBondContact CD2-O 3.36Å; F169-E209 WeakPolarHBondContact CE2-O 3.27Å; F169-E209 VanDerWaalsContact CZ-O 3.31Å; F169-E209 WeakPolarHBondContact CZ-O 3.24Å; F169-V210 HydrophobicContact CD1-CB 4.45Å; F169-V210 HydrophobicContact CD1-CG2 3.94Å; F169-V210 HydrophobicContact CE1-CB 4.32Å; F169-V210 HydrophobicContact CE1-CG2 3.9Å; F169-L211 HydrophobicContact CB-CB 4.3Å
170	I	92.8	Very high	85.2	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.4	-176.3	-170.4	165.1	0	0	0	110.5	T129 F138 T140 I147 L179 F180 W181	T129-I170 WeakPolarHBondContact CB-O 3.46Å; T129-I170 HydrophobicContact CG2-CB 4.47Å; T129-I170 HydrophobicContact CG2-CG1 4.07Å; T129-I170 HydrophobicContact CG2-CG2 3.94Å; F138-I170 HydrophobicContact CB-CD1 4.26Å; T140-I170 HydrophobicContact CG2-CB 3.64Å; T140-I170 HydrophobicContact CG2-CD1 3.72Å; T140-I170 HydrophobicContact CG2-CG1 4.27Å; T140-I170 HydrophobicContact CG2-CG2 3.77Å; I147-I170 HydrophobicContact CD1-CD1 4.1Å; I147-I170 HydrophobicContact CG1-CD1 4.49Å; I147-I170 HydrophobicContact CG2-CD1 3.72Å; I170-L179 HydrophobicContact CD1-CD1 3.77Å; I170-L179 HydrophobicContact CD1-CD2 4.05Å; I170-L179 HydrophobicContact CD1-CG 3.93Å; I170-L179 HydrophobicContact CG1-CD1 3.81Å; I170-L179 HydrophobicContact CG1-CG 4.18Å; I170-F180 CarbonylContact C-O 3.54Å; I170-F180 VanDerWaalsContact CA-O 3.27Å; I170-F180 WeakPolarHBondContact CA-O 3.01Å; I170-F180 WeakPolarHBondContact CG1-O 3.46Å; I170-W181 HydrophobicContact CB-CB 4.26Å; I170-W181 HydrophobicContact CG1-CB 4.3Å
171	N	94.1	Very high	85.7	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.064	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	153.8	169.2	-65.7	-91.1	0	0	0	108.9	F180 L211 V213 K301	N171-F180 PolarHBondContact N-O 2.86Å; N171-F180 PolarHBondContact O-N 2.89Å; N171-L211 PolarHBondContact ND2-O 2.95Å; N171-V213 HydrophobicContact CB-CB 4.36Å; N171-V213 HydrophobicContact CB-CG2 3.46Å; N171-V213 VanDerWaalsContact CB-CG2 3.46Å; N171-K301 PolarHBondContact OD1-NZ 2.84Å
172	V	89.7	Confident	86.2	Confident	6 Å²	6	45 Å²	45	4%	0.036	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.5	179.3	65.2	0	0	0	0	110.2	T129 V130 D131 W132 P174 F178 L179 L193	T129-V172 HydrophobicContact CG2-CB 4.13Å; T129-V172 HydrophobicContact CG2-CG1 4.05Å; V130-V172 VanDerWaalsContact O-CG1 3.29Å; V130-V172 WeakPolarHBondContact O-CG1 3.29Å; D131-V172 HydrophobicContact CB-CG1 4.34Å; W132-V172 HydrophobicContact CZ3-CG1 4.15Å; V172-P174 HydrophobicContact CG2-CB 4.26Å; V172-F178 WeakPolarHBondContact CG2-O 3.48Å; V172-L179 HydrophobicContact CB-CD1 3.91Å; V172-L179 HydrophobicContact CG2-CD1 4.09Å; V172-L193 HydrophobicContact CG2-CD1 3.88Å
173	D	87.8	Confident	86.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	94.9	158.7	-178.1	-24.2	0	0	0	106.9	T175 H176 R177 F178 Q215 Y238	D173-T175 VanDerWaalsContact C-N 3.26Å; D173-T175 PolarHBondContact O-N 3.15Å; D173-T175 PolarHBondContact OD1-N 3.09Å; D173-T175 PolarHBondContact OD1-OG1 2.68Å; D173-H176 IonicContact OD1-CG 3.55Å; D173-H176 PolarHBondContact OD1-N 3.17Å; D173-H176 IonicContact OD1-ND1 2.88Å; D173-H176 PolarHBondContact OD1-ND1 3.38Å; D173-H176 IonicContact OD2-CE1 2.68Å; D173-H176 IonicContact OD2-CG 1.87Å; D173-H176 IonicContact OD2-ND1 3.18Å; D173-H176 PolarHBondContact OD2-ND1 2.02Å; D173-R177 CarbonylContact O-C 3.59Å; D173-R177 WeakPolarHBondContact O-CA 3.49Å; D173-R177 PolarHBondContact O-N 3.29Å; D173-F178 PolarHBondContact N-O 2.85Å; D173-F178 PolarHBondContact O-N 2Å; D173-Q215 HydrophobicContact CB-CG 4.44Å; D173-Y238 HydrophobicContact CB-CE2 4.17Å; D173-Y238 VanDerWaalsContact OD2-CE2 3.25Å; D173-Y238 WeakPolarHBondContact OD2-CE2 3.32Å; D173-Y238 PolarHBondContact OD2-OH 2.89Å
174	P	76	Confident	86.5	Confident	13 Å²	13	31.9 Å²	31.9	8%	0.084	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.3	-175.9	33.9	-35.1	0	0	0	112.2	D131 W132 V133 V172	D131-P174 WeakPolarHBondContact OD1-CB 3.41Å; W132-P174 HydrophobicContact CD2-CG 3.87Å; W132-P174 VanDerWaalsContact CE2-CG 3.49Å; W132-P174 HydrophobicContact CE3-CG 4.07Å; W132-P174 HydrophobicContact CH2-CG 3.57Å; W132-P174 VanDerWaalsContact CZ2-CD 3.41Å; W132-P174 HydrophobicContact CZ2-CG 3.35Å; W132-P174 HydrophobicContact CZ3-CG 3.93Å; V133-P174 HydrophobicContact CB-CB 4.02Å; V133-P174 HydrophobicContact CB-CG 4.32Å; V133-P174 HydrophobicContact CG2-CB 3.98Å; V133-P174 HydrophobicContact CG2-CG 3.77Å; V172-P174 HydrophobicContact CG2-CB 4.26Å
175	T	72.3	Confident	86.1	Confident	57 Å²	57	32.4 Å²	32.4	35%	0.35	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-43	175.7	67	0	0	0	0	111.4	D173 R177 P309	D173-T175 VanDerWaalsContact C-N 3.26Å; D173-T175 PolarHBondContact O-N 3.15Å; D173-T175 PolarHBondContact OD1-N 3.09Å; D173-T175 PolarHBondContact OD1-OG1 2.68Å; T175-R177 VanDerWaalsContact C-N 3.34Å; T175-P309 HydrophobicContact CG2-CG 4.12Å
176	H	72.8	Confident	86.1	Confident	65 Å²	65	30.2 Å²	30.2	30%	0.301	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	4.6	172.7	-59.1	101.6	0	0	0	113.2	D173 F178 K218	D173-H176 IonicContact OD1-CG 3.55Å; D173-H176 PolarHBondContact OD1-N 3.17Å; D173-H176 IonicContact OD1-ND1 2.88Å; D173-H176 PolarHBondContact OD1-ND1 3.38Å; D173-H176 IonicContact OD2-CE1 2.68Å; D173-H176 IonicContact OD2-CG 1.87Å; D173-H176 IonicContact OD2-ND1 3.18Å; D173-H176 PolarHBondContact OD2-ND1 2.02Å; H176-F178 VanDerWaalsContact C-N 3.3Å; H176-F178 HydrophobicContact CB-CD2 3.7Å; H176-F178 HydrophobicContact CB-CE2 3.92Å; H176-F178 WeakPolarHBondContact O-CD2 3.38Å; H176-F178 PolarHBondContact O-N 2.84Å; H176-K218 WeakPolarHBondContact NE2-CE 3.15Å; H176-K218 PolarHBondContact NE2-NZ 3.25Å; H176-K218 VanDerWaalsContact NE2-NZ 3.15Å
177	R	77.4	Confident	86.2	Confident	133 Å²	133	25.1 Å²	25.1	50%	0.502	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	25.8	178.7	-57.6	-173.1	64.1	172	2	115.8	D173 T175 L193 S194	D173-R177 CarbonylContact O-C 3.59Å; D173-R177 WeakPolarHBondContact O-CA 3.49Å; D173-R177 PolarHBondContact O-N 3.29Å; T175-R177 VanDerWaalsContact C-N 3.34Å; R177-L193 HydrophobicContact CB-CB 4.35Å; R177-L193 PolarHBondContact NH2-O 2.82Å; R177-L193 WeakPolarHBondContact O-CB 3.3Å; R177-L193 WeakPolarHBondContact O-CG 3.39Å; R177-L193 PolarHBondContact O-N 3.13Å; R177-S194 VanDerWaalsContact NH2-CA 3.33Å
178	F	85.3	Confident	86.2	Confident	46 Å²	46	25.1 Å²	25.1	20%	0.202	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	146.2	179.6	-63.7	-55.8	0	0	0	113.7	V172 D173 H176 F180 R190 Y238	V172-F178 WeakPolarHBondContact CG2-O 3.48Å; D173-F178 PolarHBondContact N-O 2.85Å; D173-F178 PolarHBondContact O-N 2Å; H176-F178 VanDerWaalsContact C-N 3.3Å; H176-F178 HydrophobicContact CB-CD2 3.7Å; H176-F178 HydrophobicContact CB-CE2 3.92Å; H176-F178 WeakPolarHBondContact O-CD2 3.38Å; H176-F178 PolarHBondContact O-N 2.84Å; F178-F180 HydrophobicContact CB-CD2 4.21Å; F178-F180 HydrophobicContact CB-CE2 3.43Å; F178-F180 VanDerWaalsContact CB-CE2 3.43Å; F178-F180 HydrophobicContact CB-CZ 3.71Å; F178-F180 HydrophobicContact CD2-CZ 4.37Å; F178-F180 HydrophobicContact CG-CE2 4.33Å; F178-F180 HydrophobicContact CG-CZ 4.16Å; F178-R190 HydrophobicContact CB-CG 4.37Å; F178-R190 HydrophobicContact CD1-CG 3.92Å; F178-R190 HydrophobicContact CG-CG 4.34Å; F178-Y238 AromaticContact CD2-CD2 3.76Å; F178-Y238 HydrophobicContact CD2-CD2 3.76Å; F178-Y238 HydrophobicContact CD2-CE2 4.1Å; F178-Y238 HydrophobicContact CE2-CD2 4.2Å
179	L	88.3	Confident	86.1	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120.6	173	-171.2	69.9	0	0	0	108.9	F138 I147 I170 V172 R190 F191 L193	F138-L179 HydrophobicContact CD1-CD1 4.33Å; F138-L179 HydrophobicContact CD1-CD2 4.02Å; F138-L179 HydrophobicContact CD2-CD1 4.48Å; F138-L179 HydrophobicContact CE1-CD2 3.96Å; F138-L179 HydrophobicContact CG-CD1 4.27Å; I147-L179 HydrophobicContact CG2-CD2 4.32Å; I170-L179 HydrophobicContact CD1-CD1 3.77Å; I170-L179 HydrophobicContact CD1-CD2 4.05Å; I170-L179 HydrophobicContact CD1-CG 3.93Å; I170-L179 HydrophobicContact CG1-CD1 3.81Å; I170-L179 HydrophobicContact CG1-CG 4.18Å; V172-L179 HydrophobicContact CB-CD1 3.91Å; V172-L179 HydrophobicContact CG2-CD1 4.09Å; L179-R190 CarbonylContact O-C 3.57Å; L179-R190 WeakPolarHBondContact O-CA 3.41Å; L179-F191 HydrophobicContact CB-CB 4.45Å; L179-F191 HydrophobicContact CD2-CD1 4.43Å; L179-F191 PolarHBondContact N-O 3.18Å; L179-F191 PolarHBondContact O-N 2.86Å; L179-L193 HydrophobicContact CB-CD2 4.05Å; L179-L193 HydrophobicContact CB-CG 4.35Å; L179-L193 HydrophobicContact CD2-CD2 4.18Å
180	F	93.6	Very high	86	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.6	-176.3	-60.5	-88.4	0	0	0	111.1	I170 N171 F178 Q189 R190 V201 L211 V213 L220 Y238	I170-F180 CarbonylContact C-O 3.54Å; I170-F180 VanDerWaalsContact CA-O 3.27Å; I170-F180 WeakPolarHBondContact CA-O 3.01Å; I170-F180 WeakPolarHBondContact CG1-O 3.46Å; N171-F180 PolarHBondContact N-O 2.86Å; N171-F180 PolarHBondContact O-N 2.89Å; F178-F180 HydrophobicContact CB-CD2 4.21Å; F178-F180 HydrophobicContact CB-CE2 3.43Å; F178-F180 VanDerWaalsContact CB-CE2 3.43Å; F178-F180 HydrophobicContact CB-CZ 3.71Å; F178-F180 HydrophobicContact CD2-CZ 4.37Å; F178-F180 HydrophobicContact CG-CE2 4.33Å; F178-F180 HydrophobicContact CG-CZ 4.16Å; F180-Q189 CarbonylContact C-O 3.57Å; F180-Q189 WeakPolarHBondContact CA-O 3.47Å; F180-R190 HydrophobicContact CD1-CB 3.88Å; F180-R190 HydrophobicContact CD1-CG 3.94Å; F180-R190 HydrophobicContact CE1-CB 3.87Å; F180-R190 VanDerWaalsContact CE1-CD 3.41Å; F180-R190 HydrophobicContact CE1-CG 3.57Å; F180-R190 HydrophobicContact CZ-CG 4.06Å; F180-V201 HydrophobicContact CD1-CG2 4.45Å; F180-V201 HydrophobicContact CE1-CG2 4.37Å; F180-L211 HydrophobicContact CB-CD2 3.96Å; F180-V213 HydrophobicContact CD2-CG2 4.29Å; F180-L220 HydrophobicContact CD1-CD1 3.68Å; F180-L220 HydrophobicContact CD1-CD2 3.82Å; F180-L220 HydrophobicContact CD1-CG 4.38Å; F180-L220 HydrophobicContact CD2-CD2 3.97Å; F180-L220 HydrophobicContact CE1-CD1 3.79Å; F180-L220 HydrophobicContact CE1-CD2 3.88Å; F180-L220 HydrophobicContact CE1-CG 4.32Å; F180-L220 HydrophobicContact CE2-CD2 4.05Å; F180-L220 HydrophobicContact CG-CD1 4.43Å; F180-L220 HydrophobicContact CG-CD2 3.86Å; F180-L220 HydrophobicContact CZ-CD2 4.01Å; F180-Y238 HydrophobicContact CE1-CG 4.32Å; F180-Y238 HydrophobicContact CE2-CD1 4.28Å; F180-Y238 HydrophobicContact CE2-CD2 4.11Å; F180-Y238 HydrophobicContact CE2-CE1 4.28Å; F180-Y238 HydrophobicContact CE2-CE2 4.1Å; F180-Y238 HydrophobicContact CE2-CG 4.21Å; F180-Y238 AromaticContact CZ-CD1 3.85Å; F180-Y238 HydrophobicContact CZ-CD1 3.85Å; F180-Y238 AromaticContact CZ-CD2 3.67Å; F180-Y238 HydrophobicContact CZ-CD2 3.67Å; F180-Y238 HydrophobicContact CZ-CE1 4.31Å; F180-Y238 HydrophobicContact CZ-CE2 4.14Å; F180-Y238 AromaticContact CZ-CG 3.51Å; F180-Y238 HydrophobicContact CZ-CG 3.51Å
181	W	93.6	Very high	85.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.8	172.7	71.4	96.4	0	0	0	113.2	I147 L161 L164 F169 I170 Q189 F191 K198	I147-W181 HydrophobicContact CD1-CB 4.44Å; I147-W181 HydrophobicContact CD1-CD2 3.53Å; I147-W181 HydrophobicContact CD1-CE3 3.85Å; I147-W181 HydrophobicContact CD1-CG 3.8Å; I147-W181 HydrophobicContact CD1-CZ2 4.33Å; I147-W181 HydrophobicContact CD1-CZ3 4.4Å; L161-W181 HydrophobicContact CD1-CH2 3.6Å; L161-W181 HydrophobicContact CD1-CZ2 4.05Å; L161-W181 HydrophobicContact CD1-CZ3 4.11Å; L164-W181 HydrophobicContact CD1-CZ2 4.43Å; L164-W181 HydrophobicContact CD2-CZ2 4.11Å; F169-W181 VanDerWaalsContact O-CA 3.28Å; F169-W181 WeakPolarHBondContact O-CA 3.37Å; I170-W181 HydrophobicContact CB-CB 4.26Å; I170-W181 HydrophobicContact CG1-CB 4.3Å; W181-Q189 HydrophobicContact CD2-CB 4.06Å; W181-Q189 HydrophobicContact CE3-CB 4.43Å; W181-Q189 HydrophobicContact CH2-CB 3.93Å; W181-Q189 HydrophobicContact CZ2-CB 3.51Å; W181-Q189 HydrophobicContact CZ2-CG 4.44Å; W181-Q189 VanDerWaalsContact CZ2-OE1 3.28Å; W181-Q189 HydrophobicContact CZ3-CB 4.36Å; W181-Q189 PolarHBondContact N-O 3.27Å; W181-Q189 PolarHBondContact O-N 3.45Å; W181-F191 HydrophobicContact CH2-CB 3.82Å; W181-F191 HydrophobicContact CZ3-CB 3.5Å; W181-F191 VanDerWaalsContact CZ3-CB 3.5Å; W181-K198 HydrophobicContact CH2-CD 4.37Å; W181-K198 HydrophobicContact CH2-CG 4.17Å; W181-K198 HydrophobicContact CZ2-CD 4.3Å; W181-K198 HydrophobicContact CZ2-CG 4.5Å
182	L	92.4	Very high	84.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132	171.2	-57.2	-176.9	0	0	0	110.6	P167 S168 F169 E187 I188 L208 L211	P167-L182 CarbonylContact C-O 3.44Å; P167-L182 WeakPolarHBondContact CA-O 3.42Å; S168-L182 PolarHBondContact N-O 3.28Å; S168-L182 PolarHBondContact O-N 3.49Å; F169-L182 HydrophobicContact CB-CD1 4.02Å; F169-L182 HydrophobicContact CB-CG 4.18Å; F169-L182 HydrophobicContact CD2-CD1 4.18Å; F169-L182 HydrophobicContact CG-CD1 4.43Å; F169-L182 PolarHBondContact O-N 3.36Å; L182-E187 CarbonylContact C-O 3.57Å; L182-E187 WeakPolarHBondContact CA-O 3.31Å; L182-I188 HydrophobicContact CD2-CD1 4.44Å; L182-I188 HydrophobicContact CD2-CG1 3.8Å; L182-L208 HydrophobicContact CD1-CB 4.03Å; L182-L208 HydrophobicContact CD2-CB 4.13Å; L182-L208 HydrophobicContact CD2-CD1 4.09Å; L182-L211 HydrophobicContact CD1-CB 4.34Å; L182-L211 HydrophobicContact CD2-CB 4.17Å; L182-L211 HydrophobicContact CD2-CD2 4.26Å; L182-L211 HydrophobicContact CG-CB 4.11Å; L182-L211 HydrophobicContact CG-CD2 4.49Å
183	S	91	Very high	83.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141	-179	-173.2	0	0	0	0	110.2	S165 G185 S186 E187 Q189	S165-S183 PolarHBondContact O-OG 3Å; S165-S183 VanDerWaalsContact O-OG 3.09Å; S183-G185 PolarHBondContact O-N 3Å; S183-S186 PolarHBondContact O-N 3.07Å; S183-E187 PolarHBondContact N-O 3.36Å; S183-E187 WeakPolarHBondContact O-CB 3.27Å; S183-E187 PolarHBondContact O-N 3.11Å; S183-Q189 PolarHBondContact OG-NE2 3.07Å; S183-Q189 PolarHBondContact OG-OE1 2.96Å
184	G	80.9	Confident	81.9	Confident	44 Å²	44	30.5 Å²	30.5	45%	0.454	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-5.7	178	0	0	0	0	0	116	S165 S186	S165-G184 PolarHBondContact O-N 2.89Å; G184-S186 VanDerWaalsContact C-N 3.31Å
185	G	77	Confident	80.7	Confident	21 Å²	21	32.4 Å²	32.4	22%	0.216	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-5.5	-170.8	0	0	0	0	0	114.3	S183 Q207 L208	S183-G185 PolarHBondContact O-N 3Å; G185-Q207 CarbonylContact O-C 3.53Å; G185-Q207 WeakPolarHBondContact O-CA 2.98Å; G185-L208 PolarHBondContact O-N 3.07Å
186	S	84.1	Confident	79.5	Confident	32 Å²	32	37.9 Å²	37.9	22%	0.224	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.7	4.2	-176.4	70.9	0	0	0	0	114.9	S183 G184 L204 E206	S183-S186 PolarHBondContact O-N 3.07Å; G184-S186 VanDerWaalsContact C-N 3.31Å; S186-L204 WeakPolarHBondContact CB-O 3.37Å; S186-L204 PolarHBondContact O-N 3.17Å; S186-E206 WeakPolarHBondContact CB-O 3.47Å
187	E	89.9	Confident	78.5	Confident	34 Å²	34	39.8 Å²	39.8	16%	0.159	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.4	177.6	-62.7	178.2	-178.9	0	0	111.4	L182 S183 Q189 T200 L202 K203	L182-E187 CarbonylContact C-O 3.57Å; L182-E187 WeakPolarHBondContact CA-O 3.31Å; S183-E187 PolarHBondContact N-O 3.36Å; S183-E187 WeakPolarHBondContact O-CB 3.27Å; S183-E187 PolarHBondContact O-N 3.11Å; E187-Q189 HydrophobicContact CB-CG 4.49Å; E187-Q189 PolarHBondContact OE2-NE2 3.06Å; E187-T200 HydrophobicContact CB-CG2 4.26Å; E187-T200 HydrophobicContact CG-CG2 4.4Å; E187-L202 CarbonylContact C-O 3.44Å; E187-L202 WeakPolarHBondContact CA-O 3Å; E187-K203 HydrophobicContact CG-CB 4.14Å; E187-K203 HydrophobicContact CG-CD 4.09Å; E187-K203 HydrophobicContact CG-CG 3.91Å; E187-K203 WeakPolarHBondContact OE1-CE 3.32Å; E187-K203 IonicContact OE1-NZ 2.86Å; E187-K203 PolarHBondContact OE1-NZ 3.37Å
188	I	91.1	Very high	77.8	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.4	164.7	-50	-174	0	0	0	107.5	L182 V201 L202 L208 L211 L220 W222	L182-I188 HydrophobicContact CD2-CD1 4.44Å; L182-I188 HydrophobicContact CD2-CG1 3.8Å; I188-V201 HydrophobicContact CB-CB 4.39Å; I188-V201 HydrophobicContact CG2-CB 4.36Å; I188-V201 PolarHBondContact O-N 3.5Å; I188-L202 HydrophobicContact CB-CB 4.4Å; I188-L202 HydrophobicContact CD1-CB 4.46Å; I188-L202 HydrophobicContact CD1-CD1 4.38Å; I188-L202 HydrophobicContact CG1-CB 4.35Å; I188-L202 PolarHBondContact N-O 2.85Å; I188-L202 PolarHBondContact O-N 2.85Å; I188-L208 HydrophobicContact CD1-CD1 4.31Å; I188-L208 HydrophobicContact CG1-CD1 3.63Å; I188-L211 HydrophobicContact CD1-CD1 4.41Å; I188-L211 HydrophobicContact CG2-CD2 4.46Å; I188-L220 HydrophobicContact CG2-CD1 3.98Å; I188-W222 HydrophobicContact CD1-CD2 3.79Å; I188-W222 HydrophobicContact CD1-CE3 3.66Å; I188-W222 HydrophobicContact CD1-CG 4.29Å; I188-W222 HydrophobicContact CD1-CZ3 4.06Å
189	Q	88.2	Confident	77	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	141.9	-179.8	-68.2	-179.4	1.4	0	0	110.8	F180 W181 S183 E187 M199	F180-Q189 CarbonylContact C-O 3.57Å; F180-Q189 WeakPolarHBondContact CA-O 3.47Å; W181-Q189 HydrophobicContact CD2-CB 4.06Å; W181-Q189 HydrophobicContact CE3-CB 4.43Å; W181-Q189 HydrophobicContact CH2-CB 3.93Å; W181-Q189 HydrophobicContact CZ2-CB 3.51Å; W181-Q189 HydrophobicContact CZ2-CG 4.44Å; W181-Q189 VanDerWaalsContact CZ2-OE1 3.28Å; W181-Q189 HydrophobicContact CZ3-CB 4.36Å; W181-Q189 PolarHBondContact N-O 3.27Å; W181-Q189 PolarHBondContact O-N 3.45Å; S183-Q189 PolarHBondContact OG-NE2 3.07Å; S183-Q189 PolarHBondContact OG-OE1 2.96Å; E187-Q189 HydrophobicContact CB-CG 4.49Å; E187-Q189 PolarHBondContact OE2-NE2 3.06Å; Q189-M199 CarbonylContact C-O 3.41Å; Q189-M199 WeakPolarHBondContact CA-O 3.17Å
190	R	88.6	Confident	76.7	Confident	35 Å²	35	42.6 Å²	42.6	13%	0.132	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.3	177.9	-177.2	178.4	80.4	-172.9	6.8	110	F178 L179 F180 K198 M199 V201 Y238 S239	F178-R190 HydrophobicContact CB-CG 4.37Å; F178-R190 HydrophobicContact CD1-CG 3.92Å; F178-R190 HydrophobicContact CG-CG 4.34Å; L179-R190 CarbonylContact O-C 3.57Å; L179-R190 WeakPolarHBondContact O-CA 3.41Å; F180-R190 HydrophobicContact CD1-CB 3.88Å; F180-R190 HydrophobicContact CD1-CG 3.94Å; F180-R190 HydrophobicContact CE1-CB 3.87Å; F180-R190 VanDerWaalsContact CE1-CD 3.41Å; F180-R190 HydrophobicContact CE1-CG 3.57Å; F180-R190 HydrophobicContact CZ-CG 4.06Å; R190-K198 WeakPolarHBondContact O-CA 3.5Å; R190-M199 PolarHBondContact N-O 2.04Å; R190-M199 PolarHBondContact NH2-SD 3.42Å; R190-M199 VanDerWaalsContact NH2-SD 3.43Å; R190-M199 PolarHBondContact O-N 3.42Å; R190-V201 HydrophobicContact CB-CG2 3.42Å; R190-V201 VanDerWaalsContact CB-CG2 3.42Å; R190-V201 HydrophobicContact CG-CG2 4.49Å; R190-Y238 PolarHBondContact NH1-O 2.92Å; R190-S239 PolarHBondContact NH1-OG 2.61Å
191	F	82.9	Confident	76	Confident	22 Å²	22	43.3 Å²	43.3	10%	0.096	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.8	171.2	177.7	-109	0	0	0	109.2	I160 L161 L179 W181 L193 M197 K198	I160-F191 HydrophobicContact CG2-CE1 3.8Å; I160-F191 HydrophobicContact CG2-CZ 4.34Å; L161-F191 HydrophobicContact CD1-CB 4.18Å; L161-F191 HydrophobicContact CD1-CD1 4.37Å; L161-F191 HydrophobicContact CD1-CD2 4.18Å; L161-F191 HydrophobicContact CD1-CG 4.01Å; L161-F191 HydrophobicContact CD2-CD2 4.13Å; L161-F191 HydrophobicContact CD2-CE2 3.94Å; L161-F191 HydrophobicContact CD2-CZ 4.31Å; L179-F191 HydrophobicContact CB-CB 4.45Å; L179-F191 HydrophobicContact CD2-CD1 4.43Å; L179-F191 PolarHBondContact N-O 3.18Å; L179-F191 PolarHBondContact O-N 2.86Å; W181-F191 HydrophobicContact CH2-CB 3.82Å; W181-F191 HydrophobicContact CZ3-CB 3.5Å; W181-F191 VanDerWaalsContact CZ3-CB 3.5Å; F191-L193 HydrophobicContact CD1-CD2 4.36Å; F191-M197 WeakPolarHBondContact CD2-O 3.42Å; F191-K198 HydrophobicContact CD2-CB 4.31Å
192	D	75.8	Confident	75.4	Confident	42 Å²	42	44.6 Å²	44.6	23%	0.225	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.9	170.4	178.3	0.1	0	0	0	109.6	S194 G195 M197	D192-S194 PolarHBondContact O-N 3.33Å; D192-S194 VanDerWaalsContact O-N 3.07Å; D192-S194 VanDerWaalsContact OD1-CB 3.3Å; D192-S194 WeakPolarHBondContact OD1-CB 3.15Å; D192-S194 PolarHBondContact OD1-N 2.94Å; D192-S194 PolarHBondContact OD1-OG 2.97Å; D192-S194 WeakPolarHBondContact OD2-CB 3.31Å; D192-S194 PolarHBondContact OD2-OG 2.76Å; D192-G195 PolarHBondContact O-N 2.88Å; D192-M197 PolarHBondContact N-O 2.87Å
193	L	63.2	Low	75.1	Confident	41 Å²	41	51.3 Å²	51.3	22%	0.215	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	1.2	175.6	-62.6	174.9	0	0	0	113.4	F138 V172 R177 L179 F191 G195	F138-L193 HydrophobicContact CE1-CD2 4.13Å; F138-L193 HydrophobicContact CZ-CD2 3.7Å; V172-L193 HydrophobicContact CG2-CD1 3.88Å; R177-L193 HydrophobicContact CB-CB 4.35Å; R177-L193 PolarHBondContact NH2-O 2.82Å; R177-L193 WeakPolarHBondContact O-CB 3.3Å; R177-L193 WeakPolarHBondContact O-CG 3.39Å; R177-L193 PolarHBondContact O-N 3.13Å; L179-L193 HydrophobicContact CB-CD2 4.05Å; L179-L193 HydrophobicContact CB-CG 4.35Å; L179-L193 HydrophobicContact CD2-CD2 4.18Å; F191-L193 HydrophobicContact CD1-CD2 4.36Å; L193-G195 VanDerWaalsContact C-N 3.31Å
194	S	56	Low	74.6	Confident	47 Å²	47	53.1 Å²	53.1	33%	0.329	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.9	161.3	81.8	0	0	0	0	113.6	R177 D192 Q196	R177-S194 VanDerWaalsContact NH2-CA 3.33Å; D192-S194 PolarHBondContact O-N 3.33Å; D192-S194 VanDerWaalsContact O-N 3.07Å; D192-S194 VanDerWaalsContact OD1-CB 3.3Å; D192-S194 WeakPolarHBondContact OD1-CB 3.15Å; D192-S194 PolarHBondContact OD1-N 2.94Å; D192-S194 PolarHBondContact OD1-OG 2.97Å; D192-S194 WeakPolarHBondContact OD2-CB 3.31Å; D192-S194 PolarHBondContact OD2-OG 2.76Å; S194-Q196 PolarHBondContact OG-N 2.91Å
195	G	50.9	Low	74.5	Confident	53 Å²	53	59.7 Å²	59.7	55%	0.546	31%	0.314	S	S	.	.	S	Bend	trans	88.8	6.8	178.7	0	0	0	0	0	115.4	D192 L193	D192-G195 PolarHBondContact O-N 2.88Å; L193-G195 VanDerWaalsContact C-N 3.31Å
196	Q	47.1	Very low	74.7	Confident	172 Å²	172	61.3 Å²	61.3	80%	0.804	32%	0.316	S	S	*	.	S	Bend	trans	-89.9	-28.1	-173.8	-65.9	-171.4	-4.1	0	0	115.3	S194	S194-Q196 PolarHBondContact OG-N 2.91Å
197	M	50.2	Low	74.8	Confident	106 Å²	106	65.1 Å²	65.1	52%	0.522	33%	0.33	S	S	.	.			trans	-150.9	138	-172.5	-139.4	164.5	82.7	0	0	115	F191 D192 M199	F191-M197 WeakPolarHBondContact CD2-O 3.42Å; D192-M197 PolarHBondContact N-O 2.87Å; M197-M199 HydrophobicContact CE-CB 4.47Å; M197-M199 HydrophobicContact CE-CE 3.59Å; M197-M199 HydrophobicContact CE-SD 4.2Å
198	K	63	Low	74.7	Confident	94 Å²	94	63.8 Å²	63.8	41%	0.409	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.4	163.7	172.2	-176.3	170.6	-179.8	0	107.9	L164 W181 R190 F191	L164-K198 HydrophobicContact CD2-CD 4.46Å; L164-K198 VanDerWaalsContact CD2-NZ 3.27Å; W181-K198 HydrophobicContact CH2-CD 4.37Å; W181-K198 HydrophobicContact CH2-CG 4.17Å; W181-K198 HydrophobicContact CZ2-CD 4.3Å; W181-K198 HydrophobicContact CZ2-CG 4.5Å; R190-K198 WeakPolarHBondContact O-CA 3.5Å; F191-K198 HydrophobicContact CD2-CB 4.31Å
199	M	69.7	Low	74.4	Confident	76 Å²	76	65.6 Å²	65.6	37%	0.374	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.5	-175.6	177.3	172.6	-105.9	0	0	110.2	Q189 R190 M197	Q189-M199 CarbonylContact C-O 3.41Å; Q189-M199 WeakPolarHBondContact CA-O 3.17Å; R190-M199 PolarHBondContact N-O 2.04Å; R190-M199 PolarHBondContact NH2-SD 3.42Å; R190-M199 VanDerWaalsContact NH2-SD 3.43Å; R190-M199 PolarHBondContact O-N 3.42Å; M197-M199 HydrophobicContact CE-CB 4.47Å; M197-M199 HydrophobicContact CE-CE 3.59Å; M197-M199 HydrophobicContact CE-SD 4.2Å
200	T	80.8	Confident	74.5	Confident	68 Å²	68	65.3 Å²	65.3	42%	0.417	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	120.5	165.3	-59.5	0	0	0	0	107.5	E187 L202 K203	E187-T200 HydrophobicContact CB-CG2 4.26Å; E187-T200 HydrophobicContact CG-CG2 4.4Å; T200-L202 WeakPolarHBondContact CG2-O 3.43Å; T200-K203 HydrophobicContact CG2-CB 4.34Å
201	V	80.4	Confident	74.6	Confident	14 Å²	14	63.9 Å²	63.9	9%	0.085	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-46.5	-179.4	-179.6	0	0	0	0	110	F180 I188 R190 L220	F180-V201 HydrophobicContact CD1-CG2 4.45Å; F180-V201 HydrophobicContact CE1-CG2 4.37Å; I188-V201 HydrophobicContact CB-CB 4.39Å; I188-V201 HydrophobicContact CG2-CB 4.36Å; I188-V201 PolarHBondContact O-N 3.5Å; R190-V201 HydrophobicContact CB-CG2 3.42Å; R190-V201 VanDerWaalsContact CB-CG2 3.42Å; R190-V201 HydrophobicContact CG-CG2 4.49Å; V201-L220 HydrophobicContact CG1-CD1 4.14Å
202	L	80.3	Confident	75	Confident	27 Å²	27	63 Å²	63	14%	0.141	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.7	177	-82.3	174.7	0	0	0	109.8	E187 I188 T200 W222 C236 G240	E187-L202 CarbonylContact C-O 3.44Å; E187-L202 WeakPolarHBondContact CA-O 3Å; I188-L202 HydrophobicContact CB-CB 4.4Å; I188-L202 HydrophobicContact CD1-CB 4.46Å; I188-L202 HydrophobicContact CD1-CD1 4.38Å; I188-L202 HydrophobicContact CG1-CB 4.35Å; I188-L202 PolarHBondContact N-O 2.85Å; I188-L202 PolarHBondContact O-N 2.85Å; T200-L202 WeakPolarHBondContact CG2-O 3.43Å; L202-W222 HydrophobicContact CD1-CH2 3.35Å; L202-W222 HydrophobicContact CD1-CZ2 3.77Å; L202-W222 HydrophobicContact CD1-CZ3 4.05Å; L202-C236 HydrophobicContact CD1-CB 4Å; L202-C236 VanDerWaalsContact CD1-SG 3.52Å; L202-G240 WeakPolarHBondContact CD2-O 3.33Å
203	K	85.2	Confident	75.8	Confident	142 Å²	142	62 Å²	62	62%	0.617	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.6	168	178.1	165.7	-171.5	143.3	0	107.4	E187 T200	E187-K203 HydrophobicContact CG-CB 4.14Å; E187-K203 HydrophobicContact CG-CD 4.09Å; E187-K203 HydrophobicContact CG-CG 3.91Å; E187-K203 WeakPolarHBondContact OE1-CE 3.32Å; E187-K203 IonicContact OE1-NZ 2.86Å; E187-K203 PolarHBondContact OE1-NZ 3.37Å; T200-K203 HydrophobicContact CG2-CB 4.34Å
204	L	81.4	Confident	76.8	Confident	38 Å²	38	60.5 Å²	60.5	20%	0.199	31%	0.311	C	S	.	.			trans	-117.7	162.5	-177.3	-65.1	166.3	0	0	0	108.7	S186 L208 W222	S186-L204 WeakPolarHBondContact CB-O 3.37Å; S186-L204 PolarHBondContact O-N 3.17Å; L204-L208 HydrophobicContact CB-CD2 4.48Å; L204-L208 HydrophobicContact CD1-CD1 4.45Å; L204-L208 HydrophobicContact CD1-CD2 3.63Å; L204-W222 HydrophobicContact CD1-CZ2 4.11Å
205	E	78.2	Confident	77.8	Confident	182 Å²	182	59.7 Å²	59.7	85%	0.85	30%	0.302	S	S	*	.	S	Bend	trans	-84.4	-22.2	169.6	-59.6	-165.9	158.4	0	0	111.4
206	E	81.6	Confident	78.9	Confident	55 Å²	55	63.3 Å²	63.3	26%	0.257	30%	0.304	S	S	.	.	S	Bend	trans	-77	158.3	178.4	-64.6	-178.8	-153.5	0	0	113.4	S186 Q224	S186-E206 WeakPolarHBondContact CB-O 3.47Å; E206-Q224 HydrophobicContact CB-CB 4.31Å; E206-Q224 WeakPolarHBondContact OE2-CB 3.35Å; E206-Q224 WeakPolarHBondContact OE2-CG 3.07Å; E206-Q224 PolarHBondContact OE2-NE2 3.09Å
207	Q	85.6	Confident	79.9	Confident	111 Å²	111	57.6 Å²	57.6	52%	0.519	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.6	-179.9	-177	177.1	-4.2	0	0	111.5	G185 Q224 L225	G185-Q207 CarbonylContact O-C 3.53Å; G185-Q207 WeakPolarHBondContact O-CA 2.98Å; Q207-Q224 CarbonylContact O-C 3.59Å; Q207-Q224 WeakPolarHBondContact O-CA 3.38Å; Q207-L225 HydrophobicContact CB-CB 4.3Å; Q207-L225 PolarHBondContact N-O 2.8Å; Q207-L225 PolarHBondContact O-N 3.39Å
208	L	89.3	Confident	81.3	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.9	-179.6	-45.6	-178.8	0	0	0	110.4	L182 G185 I188 L204 Q224	L182-L208 HydrophobicContact CD1-CB 4.03Å; L182-L208 HydrophobicContact CD2-CB 4.13Å; L182-L208 HydrophobicContact CD2-CD1 4.09Å; G185-L208 PolarHBondContact O-N 3.07Å; I188-L208 HydrophobicContact CD1-CD1 4.31Å; I188-L208 HydrophobicContact CG1-CD1 3.63Å; L204-L208 HydrophobicContact CB-CD2 4.48Å; L204-L208 HydrophobicContact CD1-CD1 4.45Å; L204-L208 HydrophobicContact CD1-CD2 3.63Å; L208-Q224 HydrophobicContact CD2-CB 3.87Å
209	E	85.1	Confident	82.4	Confident	38 Å²	38	55.4 Å²	55.4	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-35.9	-171.6	-71.6	-168.8	163.8	0	0	114.3	F169 V223 R231	F169-E209 VanDerWaalsContact CD2-O 3.29Å; F169-E209 WeakPolarHBondContact CD2-O 3.36Å; F169-E209 WeakPolarHBondContact CE2-O 3.27Å; F169-E209 VanDerWaalsContact CZ-O 3.31Å; F169-E209 WeakPolarHBondContact CZ-O 3.24Å; E209-V223 PolarHBondContact N-O 2.88Å; E209-R231 VanDerWaalsContact CD-NE 3.26Å; E209-R231 IonicContact OE1-CZ 2.68Å; E209-R231 IonicContact OE1-NE 2.67Å; E209-R231 PolarHBondContact OE1-NE 3.06Å; E209-R231 IonicContact OE1-NH2 3.1Å; E209-R231 PolarHBondContact OE1-NH2 2.98Å; E209-R231 WeakPolarHBondContact OE2-CD 3.41Å; E209-R231 IonicContact OE2-CZ 2.81Å; E209-R231 IonicContact OE2-NE 2.88Å; E209-R231 PolarHBondContact OE2-NE 3.45Å; E209-R231 IonicContact OE2-NH2 3.01Å
210	V	88.5	Confident	83.4	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.1	-174.8	62.1	0	0	0	0	110.9	F169 W222 V223 L255 I257	F169-V210 HydrophobicContact CD1-CB 4.45Å; F169-V210 HydrophobicContact CD1-CG2 3.94Å; F169-V210 HydrophobicContact CE1-CB 4.32Å; F169-V210 HydrophobicContact CE1-CG2 3.9Å; V210-W222 WeakPolarHBondContact O-CA 3.3Å; V210-W222 WeakPolarHBondContact O-CB 3.49Å; V210-V223 HydrophobicContact CG1-CB 3.91Å; V210-V223 HydrophobicContact CG1-CG2 3.69Å; V210-V223 PolarHBondContact O-N 3.23Å; V210-L255 HydrophobicContact CG1-CB 4.38Å; V210-I257 HydrophobicContact CB-CG2 4.18Å; V210-I257 HydrophobicContact CG1-CB 4.48Å; V210-I257 HydrophobicContact CG1-CG2 3.52Å; V210-I257 HydrophobicContact CG2-CG2 3.65Å
211	L	91.7	Very high	83.9	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.4	-177.8	-178.1	66.4	0	0	0	111.1	F169 N171 F180 L182 I188 L220 F221 W222	F169-L211 HydrophobicContact CB-CB 4.3Å; N171-L211 PolarHBondContact ND2-O 2.95Å; F180-L211 HydrophobicContact CB-CD2 3.96Å; L182-L211 HydrophobicContact CD1-CB 4.34Å; L182-L211 HydrophobicContact CD2-CB 4.17Å; L182-L211 HydrophobicContact CD2-CD2 4.26Å; L182-L211 HydrophobicContact CG-CB 4.11Å; L182-L211 HydrophobicContact CG-CD2 4.49Å; I188-L211 HydrophobicContact CD1-CD1 4.41Å; I188-L211 HydrophobicContact CG2-CD2 4.46Å; L211-L220 HydrophobicContact CD1-CB 4.26Å; L211-F221 CarbonylContact C-O 3.08Å; L211-F221 WeakPolarHBondContact CA-O 3.49Å; L211-W222 HydrophobicContact CD1-CB 4.4Å
212	S	92	Very high	84.4	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	164.7	171.5	-139.7	0	0	0	0	110.6	F221 I257	S212-F221 PolarHBondContact N-O 3.49Å; S212-F221 PolarHBondContact O-N 3.46Å; S212-I257 WeakPolarHBondContact CB-O 3.13Å; S212-I257 PolarHBondContact OG-O 3.33Å
213	V	90.7	Very high	84.8	Confident	20 Å²	20	46.7 Å²	46.7	12%	0.121	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	130.9	-171.2	176.4	0	0	0	0	109.5	N171 F180 Q215 L220 Y238	N171-V213 HydrophobicContact CB-CB 4.36Å; N171-V213 HydrophobicContact CB-CG2 3.46Å; N171-V213 VanDerWaalsContact CB-CG2 3.46Å; F180-V213 HydrophobicContact CD2-CG2 4.29Å; V213-Q215 HydrophobicContact CG1-CG 4.26Å; V213-L220 HydrophobicContact CG2-CD2 3.86Å; V213-Y238 HydrophobicContact CG1-CE1 3.78Å; V213-Y238 WeakPolarHBondContact CG1-OH 3.48Å
214	D	86	Confident	84.9	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.059	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.6	169.6	-170.1	-23.9	0	0	0	108.7	E216 D217 K218 R219 F221 V259 K279	D214-E216 PolarHBondContact OD1-N 3.25Å; D214-E216 VanDerWaalsContact OD1-N 3.08Å; D214-D217 PolarHBondContact OD1-N 3.31Å; D214-K218 CarbonylContact O-C 3.56Å; D214-K218 WeakPolarHBondContact O-CA 2.99Å; D214-K218 PolarHBondContact O-N 3.24Å; D214-R219 HydrophobicContact CB-CB 4.46Å; D214-R219 PolarHBondContact N-O 3.06Å; D214-R219 PolarHBondContact O-N 3.37Å; D214-F221 HydrophobicContact CB-CD2 4.27Å; D214-F221 HydrophobicContact CB-CE2 3.93Å; D214-V259 HydrophobicContact CB-CB 4.42Å; D214-V259 HydrophobicContact CB-CG1 4.15Å; D214-V259 WeakPolarHBondContact OD2-CG1 3.36Å; D214-K279 IonicContact OD2-NZ 3.03Å; D214-K279 PolarHBondContact OD2-NZ 3.5Å
215	Q	76.7	Confident	85.1	Confident	30 Å²	30	40 Å²	40	14%	0.14	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-21.5	-177.2	-70.2	167	61.7	0	0	112.9	D173 V213 I307	D173-Q215 HydrophobicContact CB-CG 4.44Å; V213-Q215 HydrophobicContact CG1-CG 4.26Å; Q215-I307 PolarHBondContact NE2-O 2.83Å
216	E	73.8	Confident	84.9	Confident	129 Å²	129	31.8 Å²	31.8	60%	0.603	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-53.6	-177.7	-171.9	167.3	-158.3	0	0	109.2	D214 K218	D214-E216 PolarHBondContact OD1-N 3.25Å; D214-E216 VanDerWaalsContact OD1-N 3.08Å; E216-K218 VanDerWaalsContact C-N 3.32Å; E216-K218 PolarHBondContact O-N 2.88Å
217	D	67.8	Low	84.2	Confident	51 Å²	51	36.1 Å²	36.1	27%	0.273	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.5	177	-69.1	24.9	0	0	0	113.3	D214 R219 K279 Y280	D214-D217 PolarHBondContact OD1-N 3.31Å; D217-R219 VanDerWaalsContact C-N 3.35Å; D217-R219 HydrophobicContact CB-CB 4.45Å; D217-R219 HydrophobicContact CB-CG 4.03Å; D217-R219 PolarHBondContact O-N 3.22Å; D217-K279 IonicContact OD1-NZ 3.41Å; D217-K279 PolarHBondContact OD1-NZ 3.41Å; D217-K279 WeakPolarHBondContact OD2-CE 3.49Å; D217-K279 IonicContact OD2-NZ 3.35Å; D217-K279 PolarHBondContact OD2-NZ 3.41Å; D217-Y280 PolarHBondContact OD1-OH 2.92Å; D217-Y280 WeakPolarHBondContact OD2-CE1 3.2Å; D217-Y280 VanDerWaalsContact OD2-CZ 3.3Å; D217-Y280 PolarHBondContact OD2-OH 3.2Å
218	K	80.5	Confident	83.5	Confident	102 Å²	102	39.3 Å²	39.3	44%	0.443	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	45.8	-172.5	-54.7	179.5	-171.1	-171.5	0	112.8	H176 D214 E216 Y238	H176-K218 WeakPolarHBondContact NE2-CE 3.15Å; H176-K218 PolarHBondContact NE2-NZ 3.25Å; H176-K218 VanDerWaalsContact NE2-NZ 3.15Å; D214-K218 CarbonylContact O-C 3.56Å; D214-K218 WeakPolarHBondContact O-CA 2.99Å; D214-K218 PolarHBondContact O-N 3.24Å; E216-K218 VanDerWaalsContact C-N 3.32Å; E216-K218 PolarHBondContact O-N 2.88Å; K218-Y238 HydrophobicContact CB-CD1 4.44Å; K218-Y238 HydrophobicContact CB-CD2 4.38Å; K218-Y238 HydrophobicContact CB-CE1 4.42Å; K218-Y238 HydrophobicContact CB-CE2 4.37Å; K218-Y238 HydrophobicContact CB-CG 4.41Å; K218-Y238 WeakPolarHBondContact O-CD1 3.22Å; K218-Y238 PolarHBondContact O-N 1.87Å
219	R	85.2	Confident	82.6	Confident	52 Å²	52	41.3 Å²	41.3	20%	0.196	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.9	-178.6	-65.4	-175.3	92.2	156.2	3.9	112.9	D214 D217 F221 C236 S242	D214-R219 HydrophobicContact CB-CB 4.46Å; D214-R219 PolarHBondContact N-O 3.06Å; D214-R219 PolarHBondContact O-N 3.37Å; D217-R219 VanDerWaalsContact C-N 3.35Å; D217-R219 HydrophobicContact CB-CB 4.45Å; D217-R219 HydrophobicContact CB-CG 4.03Å; D217-R219 PolarHBondContact O-N 3.22Å; R219-F221 HydrophobicContact CB-CD2 4.39Å; R219-F221 HydrophobicContact CB-CE2 3.86Å; R219-C236 CarbonylContact C-O 3.58Å; R219-C236 WeakPolarHBondContact CA-O 3.2Å; R219-C236 VanDerWaalsContact CB-O 3.27Å; R219-C236 WeakPolarHBondContact CB-O 3.1Å; R219-S242 PolarHBondContact NH2-O 3.35Å
220	L	90	Very high	82.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.1	168.6	-54.4	-178.9	0	0	0	108.3	F180 I188 V201 L211 V213 W222 S235 C236 Y238	F180-L220 HydrophobicContact CD1-CD1 3.68Å; F180-L220 HydrophobicContact CD1-CD2 3.82Å; F180-L220 HydrophobicContact CD1-CG 4.38Å; F180-L220 HydrophobicContact CD2-CD2 3.97Å; F180-L220 HydrophobicContact CE1-CD1 3.79Å; F180-L220 HydrophobicContact CE1-CD2 3.88Å; F180-L220 HydrophobicContact CE1-CG 4.32Å; F180-L220 HydrophobicContact CE2-CD2 4.05Å; F180-L220 HydrophobicContact CG-CD1 4.43Å; F180-L220 HydrophobicContact CG-CD2 3.86Å; F180-L220 HydrophobicContact CZ-CD2 4.01Å; I188-L220 HydrophobicContact CG2-CD1 3.98Å; V201-L220 HydrophobicContact CG1-CD1 4.14Å; L211-L220 HydrophobicContact CD1-CB 4.26Å; V213-L220 HydrophobicContact CG2-CD2 3.86Å; L220-W222 HydrophobicContact CB-CZ3 4.47Å; L220-S235 CarbonylContact O-C 3.48Å; L220-S235 WeakPolarHBondContact O-CA 3.24Å; L220-S235 VanDerWaalsContact O-CB 3.31Å; L220-S235 WeakPolarHBondContact O-CB 3.5Å; L220-C236 PolarHBondContact N-O 2.84Å; L220-C236 PolarHBondContact O-N 3.45Å; L220-Y238 HydrophobicContact CD2-CD1 3.74Å; L220-Y238 HydrophobicContact CD2-CE1 3.91Å; L220-Y238 HydrophobicContact CG-CD1 4.04Å
221	F	91.7	Very high	81.9	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.3	173.2	-74	-100.6	0	0	0	109.3	L211 S212 D214 R219 I233 A234 I257 V259 V264 K279	L211-F221 CarbonylContact C-O 3.08Å; L211-F221 WeakPolarHBondContact CA-O 3.49Å; S212-F221 PolarHBondContact N-O 3.49Å; S212-F221 PolarHBondContact O-N 3.46Å; D214-F221 HydrophobicContact CB-CD2 4.27Å; D214-F221 HydrophobicContact CB-CE2 3.93Å; R219-F221 HydrophobicContact CB-CD2 4.39Å; R219-F221 HydrophobicContact CB-CE2 3.86Å; F221-I233 HydrophobicContact CD1-CG2 4.44Å; F221-A234 WeakPolarHBondContact CA-O 3.21Å; F221-I257 HydrophobicContact CB-CD1 4.14Å; F221-V259 HydrophobicContact CB-CG2 4.11Å; F221-V259 HydrophobicContact CD2-CG2 3.64Å; F221-V259 HydrophobicContact CE2-CG1 4.31Å; F221-V259 HydrophobicContact CE2-CG2 4.16Å; F221-V259 HydrophobicContact CG-CG2 3.84Å; F221-V264 HydrophobicContact CD1-CG2 3.88Å; F221-V264 HydrophobicContact CE1-CG2 3.83Å; F221-K279 HydrophobicContact CE1-CB 3.99Å; F221-K279 HydrophobicContact CZ-CB 3.88Å; F221-K279 HydrophobicContact CZ-CD 4.18Å; F221-K279 HydrophobicContact CZ-CG 4.27Å
222	W	91.8	Very high	81.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	169.6	176.4	66.2	95.6	0	0	0	111.7	I188 L202 L204 V210 L211 L220 I233 A234 S235 C236 L243	I188-W222 HydrophobicContact CD1-CD2 3.79Å; I188-W222 HydrophobicContact CD1-CE3 3.66Å; I188-W222 HydrophobicContact CD1-CG 4.29Å; I188-W222 HydrophobicContact CD1-CZ3 4.06Å; L202-W222 HydrophobicContact CD1-CH2 3.35Å; L202-W222 HydrophobicContact CD1-CZ2 3.77Å; L202-W222 HydrophobicContact CD1-CZ3 4.05Å; L204-W222 HydrophobicContact CD1-CZ2 4.11Å; V210-W222 WeakPolarHBondContact O-CA 3.3Å; V210-W222 WeakPolarHBondContact O-CB 3.49Å; L211-W222 HydrophobicContact CD1-CB 4.4Å; L220-W222 HydrophobicContact CB-CZ3 4.47Å; W222-I233 WeakPolarHBondContact O-CA 3.18Å; W222-A234 HydrophobicContact CD2-CB 4.21Å; W222-A234 HydrophobicContact CH2-CB 4.22Å; W222-A234 HydrophobicContact CZ2-CB 3.54Å; W222-A234 PolarHBondContact N-O 3.31Å; W222-A234 PolarHBondContact O-N 2.98Å; W222-S235 VanDerWaalsContact CZ3-C 3.45Å; W222-C236 HydrophobicContact CH2-CB 3.8Å; W222-C236 HydrophobicContact CZ3-CB 3.89Å; W222-C236 WeakPolarHBondContact CZ3-SG 3.26Å; W222-L243 HydrophobicContact CH2-CD1 3.51Å; W222-L243 HydrophobicContact CZ2-CD1 3.54Å
223	V	88.7	Confident	81.3	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.2	162.4	-179.1	0	0	0	0	108.6	E209 V210 R231 L232 I233 L250 L255	E209-V223 PolarHBondContact N-O 2.88Å; V210-V223 HydrophobicContact CG1-CB 3.91Å; V210-V223 HydrophobicContact CG1-CG2 3.69Å; V210-V223 PolarHBondContact O-N 3.23Å; V223-R231 HydrophobicContact CG1-CB 4.07Å; V223-R231 HydrophobicContact CG1-CG 4.42Å; V223-L232 WeakPolarHBondContact CA-O 3.12Å; V223-L232 WeakPolarHBondContact CG1-O 3.43Å; V223-I233 HydrophobicContact CG2-CG1 4.2Å; V223-L250 HydrophobicContact CG1-CD1 3.96Å; V223-L250 HydrophobicContact CG2-CD1 3.95Å; V223-L255 HydrophobicContact CB-CD1 4.21Å; V223-L255 HydrophobicContact CG1-CD1 3.66Å; V223-L255 HydrophobicContact CG2-CD1 4.06Å
224	Q	87.2	Confident	81.1	Confident	5 Å²	5	44.8 Å²	44.8	2%	0.023	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.8	170.9	59.7	-170	54.7	0	0	110.4	E206 Q207 L208 R231 L232 A234	E206-Q224 HydrophobicContact CB-CB 4.31Å; E206-Q224 WeakPolarHBondContact OE2-CB 3.35Å; E206-Q224 WeakPolarHBondContact OE2-CG 3.07Å; E206-Q224 PolarHBondContact OE2-NE2 3.09Å; Q207-Q224 CarbonylContact O-C 3.59Å; Q207-Q224 WeakPolarHBondContact O-CA 3.38Å; L208-Q224 HydrophobicContact CD2-CB 3.87Å; Q224-R231 VanDerWaalsContact O-CA 3.32Å; Q224-R231 WeakPolarHBondContact O-CA 3.48Å; Q224-L232 HydrophobicContact CG-CB 4.41Å; Q224-L232 PolarHBondContact N-O 2.88Å; Q224-L232 PolarHBondContact O-N 2.91Å; Q224-A234 HydrophobicContact CG-CB 4.46Å
225	L	84.4	Confident	81.1	Confident	36 Å²	36	44.3 Å²	44.3	19%	0.188	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	108.7	174.6	176.4	70.5	0	0	0	108	Q207 E230 R231	Q207-L225 HydrophobicContact CB-CB 4.3Å; Q207-L225 PolarHBondContact N-O 2.8Å; Q207-L225 PolarHBondContact O-N 3.39Å; L225-E230 CarbonylContact C-O 3.58Å; L225-E230 WeakPolarHBondContact CA-O 3Å; L225-R231 HydrophobicContact CB-CG 4.38Å; L225-R231 HydrophobicContact CD1-CG 3.59Å
226	G	73.9	Confident	81.3	Confident	8 Å²	8	42.9 Å²	42.9	8%	0.082	22%	0.218	C	C	.	.			trans	-70	161.5	179.5	0	0	0	0	0	112.7	Q228 G229 E230	G226-Q228 PolarHBondContact O-N 2.84Å; G226-G229 PolarHBondContact O-N 2.88Å; G226-E230 PolarHBondContact N-O 2.73Å
227	L	68.7	Low	81.6	Confident	146 Å²	146	38.1 Å²	38.1	76%	0.764	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.4	-175.8	-63.1	174.9	0	0	0	113.5	G229	L227-G229 VanDerWaalsContact C-N 3.31Å
228	Q	69.3	Low	82.2	Confident	178 Å²	178	36.3 Å²	36.3	83%	0.832	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	1.1	175.3	-47.9	-167	18.9	0	0	113.1	G226 E230	G226-Q228 PolarHBondContact O-N 2.84Å; Q228-E230 WeakPolarHBondContact CB-OE1 3.4Å
229	G	71.1	Confident	81.9	Confident	48 Å²	48	34.5 Å²	34.5	50%	0.495	19%	0.186	S	C	.	.	S	Bend	trans	88.9	3	179.1	0	0	0	0	0	114.9	G226 L227	G226-G229 PolarHBondContact O-N 2.88Å; L227-G229 VanDerWaalsContact C-N 3.31Å
230	E	77.8	Confident	81.3	Confident	82 Å²	82	32.5 Å²	32.5	38%	0.383	18%	0.181	S	C	.	.			trans	-71.4	151.8	169.9	68.1	-126.8	132.1	0	0	111.8	L225 G226 Q228	L225-E230 CarbonylContact C-O 3.58Å; L225-E230 WeakPolarHBondContact CA-O 3Å; G226-E230 PolarHBondContact N-O 2.73Å; Q228-E230 WeakPolarHBondContact CB-OE1 3.4Å
231	R	82.2	Confident	79.5	Confident	32 Å²	32	36.6 Å²	36.6	12%	0.121	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.4	175.1	-76.1	-173	-178.9	72.8	12.2	109.8	E209 V223 Q224 L225 L250 S252	E209-R231 VanDerWaalsContact CD-NE 3.26Å; E209-R231 IonicContact OE1-CZ 2.68Å; E209-R231 IonicContact OE1-NE 2.67Å; E209-R231 PolarHBondContact OE1-NE 3.06Å; E209-R231 IonicContact OE1-NH2 3.1Å; E209-R231 PolarHBondContact OE1-NH2 2.98Å; E209-R231 WeakPolarHBondContact OE2-CD 3.41Å; E209-R231 IonicContact OE2-CZ 2.81Å; E209-R231 IonicContact OE2-NE 2.88Å; E209-R231 PolarHBondContact OE2-NE 3.45Å; E209-R231 IonicContact OE2-NH2 3.01Å; V223-R231 HydrophobicContact CG1-CB 4.07Å; V223-R231 HydrophobicContact CG1-CG 4.42Å; Q224-R231 VanDerWaalsContact O-CA 3.32Å; Q224-R231 WeakPolarHBondContact O-CA 3.48Å; L225-R231 HydrophobicContact CB-CG 4.38Å; L225-R231 HydrophobicContact CD1-CG 3.59Å; R231-L250 HydrophobicContact CB-CB 3.8Å; R231-L250 HydrophobicContact CB-CD1 4.49Å; R231-L250 WeakPolarHBondContact O-CB 3.48Å; R231-L250 PolarHBondContact O-N 3.38Å; R231-S252 VanDerWaalsContact CD-O 3.28Å; R231-S252 WeakPolarHBondContact CD-O 3.3Å; R231-S252 PolarHBondContact NE-O 2.83Å; R231-S252 PolarHBondContact NH1-O 3Å
232	L	84.6	Confident	77.9	Confident	28 Å²	28	39 Å²	39	15%	0.147	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147	-176.4	-59.9	176.1	0	0	0	110.3	V223 Q224 I245	V223-L232 WeakPolarHBondContact CA-O 3.12Å; V223-L232 WeakPolarHBondContact CG1-O 3.43Å; Q224-L232 HydrophobicContact CG-CB 4.41Å; Q224-L232 PolarHBondContact N-O 2.88Å; Q224-L232 PolarHBondContact O-N 2.91Å; L232-I245 HydrophobicContact CB-CG2 4.09Å; L232-I245 HydrophobicContact CD1-CG2 3.86Å
233	I	86.6	Confident	76.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124	171	-61.1	174.1	0	0	0	107	F221 W222 V223 I246 L250 I257 V264 Y266 I277	F221-I233 HydrophobicContact CD1-CG2 4.44Å; W222-I233 WeakPolarHBondContact O-CA 3.18Å; V223-I233 HydrophobicContact CG2-CG1 4.2Å; I233-I246 HydrophobicContact CB-CB 4.35Å; I233-I246 HydrophobicContact CB-CD1 4.45Å; I233-I246 HydrophobicContact CG2-CD1 4.17Å; I233-I246 WeakPolarHBondContact O-CB 3.33Å; I233-I246 PolarHBondContact O-N 2.83Å; I233-L250 HydrophobicContact CD1-CD1 4.21Å; I233-L250 HydrophobicContact CD1-CD2 4.31Å; I233-L250 HydrophobicContact CG1-CD1 3.75Å; I233-L250 HydrophobicContact CG1-CG 4.41Å; I233-I257 HydrophobicContact CG2-CD1 4.02Å; I233-V264 HydrophobicContact CD1-CG1 4.37Å; I233-Y266 HydrophobicContact CD1-CD1 4.08Å; I233-Y266 HydrophobicContact CD1-CE1 4.39Å; I233-Y266 HydrophobicContact CD1-CG 4.37Å; I233-I277 HydrophobicContact CD1-CD1 3.65Å
234	A	85.8	Confident	76.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.2	175.7	0	0	0	0	0	110.4	F221 W222 Q224 L243 H244 I245	F221-A234 WeakPolarHBondContact CA-O 3.21Å; W222-A234 HydrophobicContact CD2-CB 4.21Å; W222-A234 HydrophobicContact CH2-CB 4.22Å; W222-A234 HydrophobicContact CZ2-CB 3.54Å; W222-A234 PolarHBondContact N-O 3.31Å; W222-A234 PolarHBondContact O-N 2.98Å; Q224-A234 HydrophobicContact CG-CB 4.46Å; A234-L243 HydrophobicContact CB-CD1 4.49Å; A234-H244 CarbonylContact C-O 3.53Å; A234-H244 WeakPolarHBondContact CA-O 3.42Å; A234-I245 HydrophobicContact CB-CG1 4.2Å
235	S	85.9	Confident	75.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	153.4	-179.8	69.5	0	0	0	0	112	L220 W222 L243 H244	L220-S235 CarbonylContact O-C 3.48Å; L220-S235 WeakPolarHBondContact O-CA 3.24Å; L220-S235 VanDerWaalsContact O-CB 3.31Å; L220-S235 WeakPolarHBondContact O-CB 3.5Å; W222-S235 VanDerWaalsContact CZ3-C 3.45Å; S235-L243 CarbonylContact O-C 3.56Å; S235-L243 VanDerWaalsContact O-CA 3.29Å; S235-L243 WeakPolarHBondContact O-CA 3.4Å; S235-H244 PolarHBondContact N-O 3.47Å; S235-H244 PolarHBondContact O-N 2.83Å; S235-H244 PolarHBondContact OG-O 2.91Å
236	C	79.9	Confident	75.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	167.6	172.8	67.6	0	0	0	0	110.5	L202 R219 L220 W222 S242	L202-C236 HydrophobicContact CD1-CB 4Å; L202-C236 VanDerWaalsContact CD1-SG 3.52Å; R219-C236 CarbonylContact C-O 3.58Å; R219-C236 WeakPolarHBondContact CA-O 3.2Å; R219-C236 VanDerWaalsContact CB-O 3.27Å; R219-C236 WeakPolarHBondContact CB-O 3.1Å; L220-C236 PolarHBondContact N-O 2.84Å; L220-C236 PolarHBondContact O-N 3.45Å; W222-C236 HydrophobicContact CH2-CB 3.8Å; W222-C236 HydrophobicContact CZ3-CB 3.89Å; W222-C236 WeakPolarHBondContact CZ3-SG 3.26Å; C236-S242 WeakPolarHBondContact CA-O 3.37Å
237	D	79.8	Confident	75	Confident	30 Å²	30	53.5 Å²	53.5	16%	0.16	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	164.4	164.1	57.9	65.3	0	0	0	111.6	S239 G240 N241 S242	D237-S239 PolarHBondContact O-N 3.17Å; D237-S239 VanDerWaalsContact OD1-CA 3.25Å; D237-S239 WeakPolarHBondContact OD1-CA 3.42Å; D237-S239 WeakPolarHBondContact OD1-CB 3.39Å; D237-S239 PolarHBondContact OD1-N 2.87Å; D237-G240 PolarHBondContact O-N 3.13Å; D237-G240 PolarHBondContact OD1-N 2.72Å; D237-N241 PolarHBondContact OD1-N 3.47Å; D237-N241 VanDerWaalsContact OD1-N 3.13Å; D237-N241 PolarHBondContact OD1-ND2 2.68Å; D237-N241 VanDerWaalsContact OD1-ND2 3.11Å; D237-N241 WeakPolarHBondContact OD2-CB 3Å; D237-N241 PolarHBondContact OD2-N 2.88Å; D237-S242 WeakPolarHBondContact OD2-CB 3.43Å; D237-S242 PolarHBondContact OD2-N 2.83Å; D237-S242 PolarHBondContact OD2-OG 2.74Å
238	Y	80.6	Confident	74.9	Confident	12 Å²	12	48.2 Å²	48.2	5%	0.047	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-10.1	176.9	-78	10.1	0	0	0	115.6	D173 F178 F180 R190 V213 K218 L220	D173-Y238 HydrophobicContact CB-CE2 4.17Å; D173-Y238 VanDerWaalsContact OD2-CE2 3.25Å; D173-Y238 WeakPolarHBondContact OD2-CE2 3.32Å; D173-Y238 PolarHBondContact OD2-OH 2.89Å; F178-Y238 AromaticContact CD2-CD2 3.76Å; F178-Y238 HydrophobicContact CD2-CD2 3.76Å; F178-Y238 HydrophobicContact CD2-CE2 4.1Å; F178-Y238 HydrophobicContact CE2-CD2 4.2Å; F180-Y238 HydrophobicContact CE1-CG 4.32Å; F180-Y238 HydrophobicContact CE2-CD1 4.28Å; F180-Y238 HydrophobicContact CE2-CD2 4.11Å; F180-Y238 HydrophobicContact CE2-CE1 4.28Å; F180-Y238 HydrophobicContact CE2-CE2 4.1Å; F180-Y238 HydrophobicContact CE2-CG 4.21Å; F180-Y238 AromaticContact CZ-CD1 3.85Å; F180-Y238 HydrophobicContact CZ-CD1 3.85Å; F180-Y238 AromaticContact CZ-CD2 3.67Å; F180-Y238 HydrophobicContact CZ-CD2 3.67Å; F180-Y238 HydrophobicContact CZ-CE1 4.31Å; F180-Y238 HydrophobicContact CZ-CE2 4.14Å; F180-Y238 AromaticContact CZ-CG 3.51Å; F180-Y238 HydrophobicContact CZ-CG 3.51Å; R190-Y238 PolarHBondContact NH1-O 2.92Å; V213-Y238 HydrophobicContact CG1-CE1 3.78Å; V213-Y238 WeakPolarHBondContact CG1-OH 3.48Å; K218-Y238 HydrophobicContact CB-CD1 4.44Å; K218-Y238 HydrophobicContact CB-CD2 4.38Å; K218-Y238 HydrophobicContact CB-CE1 4.42Å; K218-Y238 HydrophobicContact CB-CE2 4.37Å; K218-Y238 HydrophobicContact CB-CG 4.41Å; K218-Y238 WeakPolarHBondContact O-CD1 3.22Å; K218-Y238 PolarHBondContact O-N 1.87Å; L220-Y238 HydrophobicContact CD2-CD1 3.74Å; L220-Y238 HydrophobicContact CD2-CE1 3.91Å; L220-Y238 HydrophobicContact CG-CD1 4.04Å
239	S	74.4	Confident	74.6	Confident	64 Å²	64	43.9 Å²	43.9	45%	0.448	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	3.9	178.3	-63.6	0	0	0	0	113.2	R190 D237 N241	R190-S239 PolarHBondContact NH1-OG 2.61Å; D237-S239 PolarHBondContact O-N 3.17Å; D237-S239 VanDerWaalsContact OD1-CA 3.25Å; D237-S239 WeakPolarHBondContact OD1-CA 3.42Å; D237-S239 WeakPolarHBondContact OD1-CB 3.39Å; D237-S239 PolarHBondContact OD1-N 2.87Å; S239-N241 VanDerWaalsContact CB-ND2 3.34Å; S239-N241 WeakPolarHBondContact CB-ND2 3.08Å; S239-N241 PolarHBondContact O-ND2 2.91Å
240	G	73.4	Confident	74.4	Confident	10 Å²	10	42.3 Å²	42.3	10%	0.103	23%	0.233	C	C	.	.	S	Bend	trans	89.5	0.6	169.8	0	0	0	0	0	116.6	L202 D237	L202-G240 WeakPolarHBondContact CD2-O 3.33Å; D237-G240 PolarHBondContact O-N 3.13Å; D237-G240 PolarHBondContact OD1-N 2.72Å
241	N	51.5	Low	73.7	Confident	86 Å²	86	46.3 Å²	46.3	46%	0.46	25%	0.252	S	S	.	.			trans	-89.7	-42.9	-163.6	-48.4	-89.5	0	0	0	114.1	D237 S239 L243 R463	D237-N241 PolarHBondContact OD1-N 3.47Å; D237-N241 VanDerWaalsContact OD1-N 3.13Å; D237-N241 PolarHBondContact OD1-ND2 2.68Å; D237-N241 VanDerWaalsContact OD1-ND2 3.11Å; D237-N241 WeakPolarHBondContact OD2-CB 3Å; D237-N241 PolarHBondContact OD2-N 2.88Å; S239-N241 VanDerWaalsContact CB-ND2 3.34Å; S239-N241 WeakPolarHBondContact CB-ND2 3.08Å; S239-N241 PolarHBondContact O-ND2 2.91Å; N241-L243 PolarHBondContact O-N 2.93Å; N241-R463 PolarHBondContact OD1-NH2 3.41Å
242	S	59.5	Low	72.7	Confident	52 Å²	52	45 Å²	45	36%	0.364	25%	0.247	S	C	.	.	S	Bend	trans	-84.8	56.9	-173.3	-48.9	0	0	0	0	111.1	R219 C236 D237 H244	R219-S242 PolarHBondContact NH2-O 3.35Å; C236-S242 WeakPolarHBondContact CA-O 3.37Å; D237-S242 WeakPolarHBondContact OD2-CB 3.43Å; D237-S242 PolarHBondContact OD2-N 2.83Å; D237-S242 PolarHBondContact OD2-OG 2.74Å; S242-H244 PolarHBondContact O-N 2.71Å
243	L	70.8	Confident	71.5	Confident	82 Å²	82	51.7 Å²	51.7	43%	0.429	28%	0.278	S	S	.	.			trans	-63.5	124.2	-178.6	-177.5	65.3	0	0	0	110.3	W222 A234 S235 N241	W222-L243 HydrophobicContact CH2-CD1 3.51Å; W222-L243 HydrophobicContact CZ2-CD1 3.54Å; A234-L243 HydrophobicContact CB-CD1 4.49Å; S235-L243 CarbonylContact O-C 3.56Å; S235-L243 VanDerWaalsContact O-CA 3.29Å; S235-L243 WeakPolarHBondContact O-CA 3.4Å; N241-L243 PolarHBondContact O-N 2.93Å
244	H	74.4	Confident	70.1	Confident	69 Å²	69	53.7 Å²	53.7	32%	0.319	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	117.6	175.6	178.8	-91.3	0	0	0	108.8	A234 S235 S242 Y280	A234-H244 CarbonylContact C-O 3.53Å; A234-H244 WeakPolarHBondContact CA-O 3.42Å; S235-H244 PolarHBondContact N-O 3.47Å; S235-H244 PolarHBondContact O-N 2.83Å; S235-H244 PolarHBondContact OG-O 2.91Å; S242-H244 PolarHBondContact O-N 2.71Å; H244-Y280 PolarHBondContact CE1-O 2.73Å; H244-Y280 VanDerWaalsContact CE1-O 3.27Å
245	I	77.6	Confident	69.3	Low	63 Å²	63	54.7 Å²	54.7	32%	0.323	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.3	176.9	-56.8	177.4	0	0	0	107.6	L232 A234	L232-I245 HydrophobicContact CB-CG2 4.09Å; L232-I245 HydrophobicContact CD1-CG2 3.86Å; A234-I245 HydrophobicContact CB-CG1 4.2Å
246	I	78.4	Confident	69.1	Low	4 Å²	4	54.8 Å²	54.8	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	106.6	171.7	-63.7	171.2	0	0	0	106.7	I233 L248 I277	I233-I246 HydrophobicContact CB-CB 4.35Å; I233-I246 HydrophobicContact CB-CD1 4.45Å; I233-I246 HydrophobicContact CG2-CD1 4.17Å; I233-I246 WeakPolarHBondContact O-CB 3.33Å; I233-I246 PolarHBondContact O-N 2.83Å; I246-L248 HydrophobicContact CG2-CB 4Å; I246-L248 PolarHBondContact O-N 2.69Å; I246-I277 HydrophobicContact CD1-CD1 4.01Å; I246-I277 HydrophobicContact CG2-CD1 4.12Å
247	D	63	Low	69.7	Low	137 Å²	137	54.9 Å²	54.9	73%	0.733	30%	0.299	S	S	*	.			trans	-73	62.1	-177.4	-67.5	-25.2	0	0	0	112.3
248	L	66.6	Low	70.2	Confident	35 Å²	35	53.7 Å²	53.7	18%	0.183	29%	0.293	C	S	.	.			trans	-123.7	105.4	177.7	-174.7	87.5	0	0	0	109.2	I246 L250 I277 P285	I246-L248 HydrophobicContact CG2-CB 4Å; I246-L248 PolarHBondContact O-N 2.69Å; L248-L250 HydrophobicContact CD2-CD2 4.18Å; L248-L250 PolarHBondContact O-N 2.75Å; L248-I277 HydrophobicContact CD2-CG2 4.28Å; L248-P285 HydrophobicContact CD1-CG 3.65Å; L248-P285 HydrophobicContact CD2-CG 3.48Å; L248-P285 VanDerWaalsContact CD2-CG 3.48Å; L248-P285 HydrophobicContact CG-CG 4.18Å
249	P	63.4	Low	70.7	Confident	87 Å²	87	53.5 Å²	53.5	57%	0.565	29%	0.293	S	S	*	.			trans	-67.1	106.7	-178.2	25.5	-33.4	0	0	0	111.4	Q251	P249-Q251 PolarHBondContact O-N 2.89Å
250	L	65.9	Low	71.2	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.073	28%	0.275	C	S	.	.			trans	-74.7	118	176.6	-62.1	179.4	0	0	0	110.7	V223 R231 I233 L248 S252 L255 Y266	V223-L250 HydrophobicContact CG1-CD1 3.96Å; V223-L250 HydrophobicContact CG2-CD1 3.95Å; R231-L250 HydrophobicContact CB-CB 3.8Å; R231-L250 HydrophobicContact CB-CD1 4.49Å; R231-L250 WeakPolarHBondContact O-CB 3.48Å; R231-L250 PolarHBondContact O-N 3.38Å; I233-L250 HydrophobicContact CD1-CD1 4.21Å; I233-L250 HydrophobicContact CD1-CD2 4.31Å; I233-L250 HydrophobicContact CG1-CD1 3.75Å; I233-L250 HydrophobicContact CG1-CG 4.41Å; L248-L250 HydrophobicContact CD2-CD2 4.18Å; L248-L250 PolarHBondContact O-N 2.75Å; L250-S252 VanDerWaalsContact C-N 3.26Å; L250-S252 PolarHBondContact O-N 2.9Å; L250-L255 HydrophobicContact CD1-CD1 3.82Å; L250-Y266 HydrophobicContact CD2-CD2 3.93Å; L250-Y266 HydrophobicContact CD2-CE2 3.39Å
251	Q	62.7	Low	71.6	Confident	167 Å²	167	54.4 Å²	54.4	78%	0.78	29%	0.289	S	S	*	.			trans	-77.8	-0.3	-174.1	-62.8	-120.7	-32.2	0	0	115.1	P249	P249-Q251 PolarHBondContact O-N 2.89Å
252	S	62.7	Low	72.9	Confident	5 Å²	5	55.7 Å²	55.7	4%	0.035	29%	0.292	C	S	.	.			trans	-120.2	149.6	-163.9	-154.4	0	0	0	0	115.4	R231 L250 D268 A269 A270	R231-S252 VanDerWaalsContact CD-O 3.28Å; R231-S252 WeakPolarHBondContact CD-O 3.3Å; R231-S252 PolarHBondContact NE-O 2.83Å; R231-S252 PolarHBondContact NH1-O 3Å; L250-S252 VanDerWaalsContact C-N 3.26Å; L250-S252 PolarHBondContact O-N 2.9Å; S252-D268 WeakPolarHBondContact CB-OD1 3.2Å; S252-A269 WeakPolarHBondContact OG-CA 3.22Å; S252-A269 WeakPolarHBondContact OG-CB 3.31Å; S252-A269 PolarHBondContact OG-N 2.63Å; S252-A270 PolarHBondContact OG-N 3.07Å
253	Q	58.1	Low	74	Confident	167 Å²	167	55.1 Å²	55.1	78%	0.78	29%	0.285	S	S	*	.	S	Bend	trans	-96.5	-1.7	-174.3	-61.2	-177	-6.9	0	0	114.9
254	S	58.5	Low	74.9	Confident	43 Å²	43	51.2 Å²	51.2	30%	0.301	27%	0.265	S	S	.	.			trans	-135.5	102	-179.6	169.8	0	0	0	0	109.4	T267	S254-T267 PolarHBondContact O-OG1 2.99Å
255	L	68.6	Low	75.7	Confident	20 Å²	20	48.3 Å²	48.3	11%	0.105	25%	0.251	C	S	.	.			trans	-122.3	118.2	-167.6	-57.5	178.1	0	0	0	110.8	V210 V223 L250 T267	V210-L255 HydrophobicContact CG1-CB 4.38Å; V223-L255 HydrophobicContact CB-CD1 4.21Å; V223-L255 HydrophobicContact CG1-CD1 3.66Å; V223-L255 HydrophobicContact CG2-CD1 4.06Å; L250-L255 HydrophobicContact CD1-CD1 3.82Å; L255-T267 WeakPolarHBondContact CA-OG1 3.47Å; L255-T267 WeakPolarHBondContact CD2-O 3.2Å
256	G	81.9	Confident	76.3	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.031	24%	0.237	C	C	.	.			trans	-104.5	149.8	157.4	0	0	0	0	0	109.3	Y266 T267 I300	G256-Y266 VanDerWaalsContact O-CA 3.25Å; G256-Y266 WeakPolarHBondContact O-CA 3.3Å; G256-T267 PolarHBondContact N-OG1 2.94Å; G256-T267 PolarHBondContact O-N 2.82Å; G256-T267 VanDerWaalsContact O-N 3.12Å; G256-I300 WeakPolarHBondContact O-CG2 3.47Å
257	I	90.8	Very high	76.7	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.6	-178.3	-179.8	168.6	0	0	0	111.2	V210 S212 F221 I233 V264 Y265	V210-I257 HydrophobicContact CB-CG2 4.18Å; V210-I257 HydrophobicContact CG1-CB 4.48Å; V210-I257 HydrophobicContact CG1-CG2 3.52Å; V210-I257 HydrophobicContact CG2-CG2 3.65Å; S212-I257 WeakPolarHBondContact CB-O 3.13Å; S212-I257 PolarHBondContact OG-O 3.33Å; F221-I257 HydrophobicContact CB-CD1 4.14Å; I233-I257 HydrophobicContact CG2-CD1 4.02Å; I257-V264 HydrophobicContact CD1-CG1 3.42Å; I257-V264 VanDerWaalsContact CD1-CG1 3.42Å; I257-V264 HydrophobicContact CG1-CG1 3.54Å; I257-Y265 CarbonylContact C-O 3.09Å; I257-Y265 WeakPolarHBondContact CA-O 3.28Å
258	S	91.7	Very high	77.8	Confident	5 Å²	5	39.3 Å²	39.3	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	135.4	176	-169.5	0	0	0	0	109.9	Y265 V302	S258-Y265 PolarHBondContact N-O 2.93Å; S258-Y265 PolarHBondContact O-N 3.18Å; S258-V302 PolarHBondContact OG-N 3.28Å
259	V	90.5	Very high	78.2	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144	178	-167.6	0	0	0	0	109.6	D214 F221 V264 K279	D214-V259 HydrophobicContact CB-CB 4.42Å; D214-V259 HydrophobicContact CB-CG1 4.15Å; D214-V259 WeakPolarHBondContact OD2-CG1 3.36Å; F221-V259 HydrophobicContact CB-CG2 4.11Å; F221-V259 HydrophobicContact CD2-CG2 3.64Å; F221-V259 HydrophobicContact CE2-CG1 4.31Å; F221-V259 HydrophobicContact CE2-CG2 4.16Å; F221-V259 HydrophobicContact CG-CG2 3.84Å; V259-V264 HydrophobicContact CG2-CG2 4.4Å; V259-K279 HydrophobicContact CG1-CD 3.92Å
260	F	86.1	Confident	78.9	Confident	16 Å²	16	38.2 Å²	38.2	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	125.7	170.9	178.9	-115.7	0	0	0	111.1	P53 L68 E262 N263 Y265 V302 H304 L306 I307	P53-F260 HydrophobicContact CB-CD1 4.42Å; P53-F260 HydrophobicContact CB-CE1 3.72Å; P53-F260 HydrophobicContact CB-CZ 3.95Å; P53-F260 HydrophobicContact CG-CE1 3.75Å; P53-F260 HydrophobicContact CG-CZ 4.14Å; L68-F260 HydrophobicContact CD1-CD1 4.01Å; L68-F260 HydrophobicContact CD1-CE1 4.09Å; F260-E262 PolarHBondContact O-N 3.14Å; F260-N263 PolarHBondContact N-O 3.14Å; F260-N263 PolarHBondContact O-N 3.2Å; F260-Y265 HydrophobicContact CB-CE2 4.19Å; F260-V302 HydrophobicContact CB-CB 4.05Å; F260-V302 HydrophobicContact CB-CG1 3.8Å; F260-V302 HydrophobicContact CB-CG2 3.93Å; F260-V302 HydrophobicContact CD1-CG1 4.01Å; F260-V302 HydrophobicContact CD2-CG1 4.2Å; F260-V302 HydrophobicContact CG-CG1 3.73Å; F260-H304 HydrophobicContact CD2-CB 4.42Å; F260-H304 HydrophobicContact CE2-CB 3.73Å; F260-H304 AromaticContact CE2-CG 3.67Å; F260-H304 AromaticContact CE2-ND1 3.48Å; F260-H304 WeakPolarHBondContact CE2-ND1 3.41Å; F260-H304 HydrophobicContact CZ-CB 4.06Å; F260-H304 AromaticContact CZ-CG 3.69Å; F260-H304 AromaticContact CZ-ND1 3.62Å; F260-L306 HydrophobicContact CE2-CB 4.43Å; F260-L306 HydrophobicContact CE2-CD1 4.45Å; F260-I307 HydrophobicContact CB-CD1 4.22Å; F260-I307 HydrophobicContact CD2-CD1 3.69Å; F260-I307 HydrophobicContact CD2-CG1 3.91Å; F260-I307 HydrophobicContact CE2-CD1 4.48Å; F260-I307 HydrophobicContact CG-CD1 4.27Å
261	L	80.1	Confident	79.6	Confident	78 Å²	78	39.5 Å²	39.5	41%	0.408	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	-132.8	-171.3	-56	174.9	0	0	0	109.3	N263 K279 L306	L261-N263 PolarHBondContact O-N 3.24Å; L261-K279 VanDerWaalsContact O-CD 3.23Å; L261-K279 WeakPolarHBondContact O-CD 3.02Å; L261-K279 WeakPolarHBondContact O-CE 3.42Å; L261-K279 PolarHBondContact O-NZ 3.04Å; L261-L306 HydrophobicContact CD2-CD1 4.35Å
262	E	80	Confident	80.6	Confident	112 Å²	112	31.8 Å²	31.8	52%	0.523	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	2	179.3	-54.1	176	-165.5	0	0	114.9	F260 N278 K279 Y280	F260-E262 PolarHBondContact O-N 3.14Å; E262-N278 CarbonylContact O-C 3.58Å; E262-N278 WeakPolarHBondContact O-CA 3.31Å; E262-K279 PolarHBondContact O-N 3.22Å; E262-Y280 HydrophobicContact CB-CE2 4.36Å; E262-Y280 HydrophobicContact CG-CE2 4.22Å
263	N	82.8	Confident	81.8	Confident	40 Å²	40	31.8 Å²	31.8	21%	0.214	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.4	-166	-69.6	-102.9	0	0	0	113.3	F260 L261 Y265 I277	F260-N263 PolarHBondContact N-O 3.14Å; F260-N263 PolarHBondContact O-N 3.2Å; L261-N263 PolarHBondContact O-N 3.24Å; N263-Y265 HydrophobicContact CB-CD2 4.31Å; N263-Y265 HydrophobicContact CB-CE2 3.59Å; N263-I277 WeakPolarHBondContact CA-O 3.41Å
264	V	89.3	Confident	83.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.2	164.5	179.8	0	0	0	0	108.8	F221 I233 I257 V259 K276 I277 K279	F221-V264 HydrophobicContact CD1-CG2 3.88Å; F221-V264 HydrophobicContact CE1-CG2 3.83Å; I233-V264 HydrophobicContact CD1-CG1 4.37Å; I257-V264 HydrophobicContact CD1-CG1 3.42Å; I257-V264 VanDerWaalsContact CD1-CG1 3.42Å; I257-V264 HydrophobicContact CG1-CG1 3.54Å; V259-V264 HydrophobicContact CG2-CG2 4.4Å; V264-K276 VanDerWaalsContact O-CA 3.28Å; V264-K276 WeakPolarHBondContact O-CA 3.48Å; V264-I277 HydrophobicContact CB-CD1 4.47Å; V264-I277 HydrophobicContact CB-CG1 3.91Å; V264-I277 PolarHBondContact N-O 3.27Å; V264-I277 PolarHBondContact O-N 2.79Å; V264-K279 HydrophobicContact CG2-CB 3.6Å
265	Y	91.1	Very high	84.7	Confident	9 Å²	9	24.5 Å²	24.5	4%	0.035	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.5	173	-63.8	-95.3	0	0	0	109.6	L55 L68 I257 S258 F260 N263 R275 K276 V288 V302	L55-Y265 HydrophobicContact CD1-CD1 4.41Å; L55-Y265 HydrophobicContact CD2-CD1 4.05Å; L55-Y265 HydrophobicContact CD2-CG 4.2Å; L68-Y265 HydrophobicContact CD2-CE1 4.09Å; I257-Y265 CarbonylContact C-O 3.09Å; I257-Y265 WeakPolarHBondContact CA-O 3.28Å; S258-Y265 PolarHBondContact N-O 2.93Å; S258-Y265 PolarHBondContact O-N 3.18Å; F260-Y265 HydrophobicContact CB-CE2 4.19Å; N263-Y265 HydrophobicContact CB-CD2 4.31Å; N263-Y265 HydrophobicContact CB-CE2 3.59Å; Y265-R275 CarbonylContact C-O 3.59Å; Y265-R275 WeakPolarHBondContact CA-O 3.43Å; Y265-K276 HydrophobicContact CD1-CB 3.91Å; Y265-K276 HydrophobicContact CE1-CB 3.84Å; Y265-K276 HydrophobicContact CE1-CD 4.1Å; Y265-K276 HydrophobicContact CG-CB 4.49Å; Y265-V288 HydrophobicContact CD1-CG2 4.1Å; Y265-V288 HydrophobicContact CE1-CG2 4.2Å; Y265-V302 HydrophobicContact CD2-CG2 3.69Å; Y265-V302 HydrophobicContact CE2-CG2 4.11Å; Y265-V302 HydrophobicContact CG-CG2 4.16Å
266	Y	89.8	Confident	85.6	Confident	7 Å²	7	26.6 Å²	26.6	3%	0.027	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.5	179.4	68.7	-85	0	0	0	112.9	I233 L250 G256 I274 R275 I277	I233-Y266 HydrophobicContact CD1-CD1 4.08Å; I233-Y266 HydrophobicContact CD1-CE1 4.39Å; I233-Y266 HydrophobicContact CD1-CG 4.37Å; L250-Y266 HydrophobicContact CD2-CD2 3.93Å; L250-Y266 HydrophobicContact CD2-CE2 3.39Å; G256-Y266 VanDerWaalsContact O-CA 3.25Å; G256-Y266 WeakPolarHBondContact O-CA 3.3Å; Y266-I274 WeakPolarHBondContact O-CA 3.32Å; Y266-R275 HydrophobicContact CD1-CB 4.18Å; Y266-R275 HydrophobicContact CD2-CB 4.45Å; Y266-R275 HydrophobicContact CE1-CB 3.6Å; Y266-R275 HydrophobicContact CE2-CB 3.92Å; Y266-R275 VanDerWaalsContact CZ-CB 3.47Å; Y266-R275 PolarHBondContact N-O 3.29Å; Y266-R275 PolarHBondContact O-N 3.07Å; Y266-R275 WeakPolarHBondContact OH-CD 3.12Å; Y266-I277 HydrophobicContact CE1-CD1 4.43Å; Y266-I277 HydrophobicContact CE1-CG1 4.19Å; Y266-I277 HydrophobicContact CE1-CG2 4.03Å
267	T	87.8	Confident	85.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.3	178.1	57.3	0	0	0	0	111.6	S254 L255 G256 I274 P297 I300	S254-T267 PolarHBondContact O-OG1 2.99Å; L255-T267 WeakPolarHBondContact CA-OG1 3.47Å; L255-T267 WeakPolarHBondContact CD2-O 3.2Å; G256-T267 PolarHBondContact N-OG1 2.94Å; G256-T267 PolarHBondContact O-N 2.82Å; G256-T267 VanDerWaalsContact O-N 3.12Å; T267-I274 HydrophobicContact CG2-CG1 4.48Å; T267-P297 HydrophobicContact CG2-CB 3.92Å; T267-P297 HydrophobicContact CG2-CG 3.81Å; T267-I300 HydrophobicContact CG2-CB 4.21Å; T267-I300 HydrophobicContact CG2-CG2 4.18Å
268	D	84.8	Confident	85.4	Confident	7 Å²	7	28.4 Å²	28.4	4%	0.037	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	99.3	162.8	-173.4	-23.6	0	0	0	109.1	S252 A270 A271 G272 V273 R275	S252-D268 WeakPolarHBondContact CB-OD1 3.2Å; D268-A270 VanDerWaalsContact C-N 3.26Å; D268-A270 PolarHBondContact O-N 2.8Å; D268-A270 WeakPolarHBondContact OD1-CA 3.03Å; D268-A270 WeakPolarHBondContact OD1-CB 3.47Å; D268-A270 PolarHBondContact OD1-N 2.87Å; D268-A271 HydrophobicContact CB-CB 4.35Å; D268-A271 PolarHBondContact OD1-N 2.82Å; D268-G272 CarbonylContact O-C 3.53Å; D268-G272 WeakPolarHBondContact O-CA 3.39Å; D268-G272 PolarHBondContact O-N 2.62Å; D268-V273 HydrophobicContact CB-CG2 4.09Å; D268-V273 PolarHBondContact N-O 3.29Å; D268-V273 PolarHBondContact O-N 3.26Å; D268-R275 IonicContact OD2-CZ 2.75Å; D268-R275 IonicContact OD2-NH1 3.68Å; D268-R275 PolarHBondContact OD2-NH1 3.2Å; D268-R275 IonicContact OD2-NH2 2.84Å
269	A	76.8	Confident	84.7	Confident	24 Å²	24	28.3 Å²	28.3	20%	0.198	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.9	178	0	0	0	0	0	114.3	S252 P296	S252-A269 WeakPolarHBondContact OG-CA 3.22Å; S252-A269 WeakPolarHBondContact OG-CB 3.31Å; S252-A269 PolarHBondContact OG-N 2.63Å; A269-P296 HydrophobicContact CB-CB 3.44Å; A269-P296 VanDerWaalsContact CB-CB 3.44Å
270	A	77.9	Confident	83.8	Confident	75 Å²	75	32.6 Å²	32.6	62%	0.62	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-44.8	178.9	0	0	0	0	0	110.5	S252 D268 G272	S252-A270 PolarHBondContact OG-N 3.07Å; D268-A270 VanDerWaalsContact C-N 3.26Å; D268-A270 PolarHBondContact O-N 2.8Å; D268-A270 WeakPolarHBondContact OD1-CA 3.03Å; D268-A270 WeakPolarHBondContact OD1-CB 3.47Å; D268-A270 PolarHBondContact OD1-N 2.87Å; A270-G272 VanDerWaalsContact C-N 3.34Å
271	A	80.2	Confident	83	Confident	41 Å²	41	37.1 Å²	37.1	34%	0.339	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-14.7	170.5	0	0	0	0	0	113.3	D268 V273	D268-A271 HydrophobicContact CB-CB 4.35Å; D268-A271 PolarHBondContact OD1-N 2.82Å; A271-V273 VanDerWaalsContact C-N 3.35Å; A271-V273 HydrophobicContact CB-CG2 3.86Å
272	G	83.6	Confident	82.3	Confident	6 Å²	6	34.1 Å²	34.1	6%	0.062	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	28.2	-178.7	0	0	0	0	0	113.3	D268 A270 M293	D268-G272 CarbonylContact O-C 3.53Å; D268-G272 WeakPolarHBondContact O-CA 3.39Å; D268-G272 PolarHBondContact O-N 2.62Å; A270-G272 VanDerWaalsContact C-N 3.34Å; G272-M293 WeakPolarHBondContact O-CB 3.22Å; G272-M293 WeakPolarHBondContact O-CG 3.42Å; G272-M293 PolarHBondContact O-N 2.88Å
273	V	87.1	Confident	81.9	Confident	5 Å²	5	30.3 Å²	30.3	3%	0.03	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	162.4	-176.7	-61.6	0	0	0	0	111.3	D268 A271 R275 P292	D268-V273 HydrophobicContact CB-CG2 4.09Å; D268-V273 PolarHBondContact N-O 3.29Å; D268-V273 PolarHBondContact O-N 3.26Å; A271-V273 VanDerWaalsContact C-N 3.35Å; A271-V273 HydrophobicContact CB-CG2 3.86Å; V273-R275 HydrophobicContact CG2-CG 4.23Å; V273-P292 HydrophobicContact CG1-CG 4.5Å
274	I	89.2	Confident	81.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.2	164.5	-59.5	174.7	0	0	0	106.2	L55 F57 M66 Y266 T267 V288 N289 M293 P297 I300	L55-I274 HydrophobicContact CD1-CD1 4.06Å; L55-I274 HydrophobicContact CD1-CG2 3.92Å; F57-I274 HydrophobicContact CD1-CD1 3.92Å; F57-I274 HydrophobicContact CD2-CD1 4.35Å; F57-I274 HydrophobicContact CE1-CD1 4.14Å; F57-I274 HydrophobicContact CG-CD1 4.03Å; F57-I274 HydrophobicContact CZ-CD1 4.46Å; M66-I274 HydrophobicContact CE-CD1 4Å; Y266-I274 WeakPolarHBondContact O-CA 3.32Å; T267-I274 HydrophobicContact CG2-CG1 4.48Å; I274-V288 HydrophobicContact CB-CB 4.33Å; I274-V288 HydrophobicContact CG2-CB 4.33Å; I274-V288 HydrophobicContact CG2-CG2 4.28Å; I274-V288 WeakPolarHBondContact O-CB 3.42Å; I274-V288 PolarHBondContact O-N 2.93Å; I274-N289 PolarHBondContact N-OD1 3.37Å; I274-M293 HydrophobicContact CD1-CE 4.13Å; I274-M293 HydrophobicContact CG1-CE 4.38Å; I274-P297 HydrophobicContact CG1-CG 4.15Å; I274-I300 HydrophobicContact CD1-CD1 3.99Å; I274-I300 HydrophobicContact CG1-CD1 4.37Å; I274-I300 HydrophobicContact CG2-CD1 3.53Å
275	R	88.3	Confident	81.2	Confident	56 Å²	56	41.8 Å²	41.8	21%	0.211	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	157.5	176.9	-80.6	176.9	-179.6	141	15.3	111	Y265 Y266 D268 V273 P285 V286 D287	Y265-R275 CarbonylContact C-O 3.59Å; Y265-R275 WeakPolarHBondContact CA-O 3.43Å; Y266-R275 HydrophobicContact CD1-CB 4.18Å; Y266-R275 HydrophobicContact CD2-CB 4.45Å; Y266-R275 HydrophobicContact CE1-CB 3.6Å; Y266-R275 HydrophobicContact CE2-CB 3.92Å; Y266-R275 VanDerWaalsContact CZ-CB 3.47Å; Y266-R275 PolarHBondContact N-O 3.29Å; Y266-R275 PolarHBondContact O-N 3.07Å; Y266-R275 WeakPolarHBondContact OH-CD 3.12Å; D268-R275 IonicContact OD2-CZ 2.75Å; D268-R275 IonicContact OD2-NH1 3.68Å; D268-R275 PolarHBondContact OD2-NH1 3.2Å; D268-R275 IonicContact OD2-NH2 2.84Å; V273-R275 HydrophobicContact CG2-CG 4.23Å; R275-P285 HydrophobicContact CG-CB 4.48Å; R275-V286 CarbonylContact C-O 3.59Å; R275-V286 WeakPolarHBondContact CA-O 3.21Å; R275-D287 WeakPolarHBondContact CD-OD1 3.31Å; R275-D287 WeakPolarHBondContact CG-OD1 3.13Å; R275-D287 IonicContact CZ-OD1 3.76Å; R275-D287 IonicContact NE-OD1 2.68Å; R275-D287 PolarHBondContact NE-OD1 2.82Å; R275-D287 IonicContact NH2-OD1 3.35Å
276	K	88.7	Confident	81	Confident	64 Å²	64	45 Å²	45	28%	0.278	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.7	165.3	66.9	178.2	-174.8	174.4	0	110.9	V264 Y265 V286 V288	V264-K276 VanDerWaalsContact O-CA 3.28Å; V264-K276 WeakPolarHBondContact O-CA 3.48Å; Y265-K276 HydrophobicContact CD1-CB 3.91Å; Y265-K276 HydrophobicContact CE1-CB 3.84Å; Y265-K276 HydrophobicContact CE1-CD 4.1Å; Y265-K276 HydrophobicContact CG-CB 4.49Å; K276-V286 HydrophobicContact CG-CB 4.01Å; K276-V286 PolarHBondContact N-O 3.49Å; K276-V286 PolarHBondContact O-N 3.11Å; K276-V288 HydrophobicContact CB-CG2 4.03Å; K276-V288 HydrophobicContact CD-CG2 4.35Å; K276-V288 HydrophobicContact CG-CG2 4.03Å
277	I	86.5	Confident	80.9	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	157.2	169.8	54.8	170.7	0	0	0	109.1	I233 I246 L248 N263 V264 Y266 G283 P285	I233-I277 HydrophobicContact CD1-CD1 3.65Å; I246-I277 HydrophobicContact CD1-CD1 4.01Å; I246-I277 HydrophobicContact CG2-CD1 4.12Å; L248-I277 HydrophobicContact CD2-CG2 4.28Å; N263-I277 WeakPolarHBondContact CA-O 3.41Å; V264-I277 HydrophobicContact CB-CD1 4.47Å; V264-I277 HydrophobicContact CB-CG1 3.91Å; V264-I277 PolarHBondContact N-O 3.27Å; V264-I277 PolarHBondContact O-N 2.79Å; Y266-I277 HydrophobicContact CE1-CD1 4.43Å; Y266-I277 HydrophobicContact CE1-CG1 4.19Å; Y266-I277 HydrophobicContact CE1-CG2 4.03Å; I277-G283 WeakPolarHBondContact CG2-O 3.38Å; I277-P285 HydrophobicContact CG2-CB 3.84Å; I277-P285 HydrophobicContact CG2-CG 3.75Å
278	N	82.1	Confident	80.9	Confident	39 Å²	39	48.7 Å²	48.7	21%	0.209	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.7	170.5	-177	-70.5	0	0	0	109.7	E262 Y280 T281 G282	E262-N278 CarbonylContact O-C 3.58Å; E262-N278 WeakPolarHBondContact O-CA 3.31Å; N278-Y280 VanDerWaalsContact C-N 3.3Å; N278-Y280 PolarHBondContact O-N 3.3Å; N278-Y280 WeakPolarHBondContact OD1-CA 3.2Å; N278-Y280 WeakPolarHBondContact OD1-CB 3.47Å; N278-Y280 PolarHBondContact OD1-N 3.49Å; N278-T281 WeakPolarHBondContact CB-OG1 3.23Å; N278-T281 PolarHBondContact OD1-N 3.36Å; N278-T281 PolarHBondContact OD1-OG1 2.79Å; N278-G282 WeakPolarHBondContact O-CA 3.43Å; N278-G282 PolarHBondContact O-N 3.04Å; N278-G282 VanDerWaalsContact O-N 3.08Å
279	K	76.4	Confident	80.9	Confident	3 Å²	3	48.8 Å²	48.8	1%	0.013	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-20.3	-173.5	80.1	-178.5	-179.7	-177	0	113.9	D214 D217 F221 V259 L261 E262 V264	D214-K279 IonicContact OD2-NZ 3.03Å; D214-K279 PolarHBondContact OD2-NZ 3.5Å; D217-K279 IonicContact OD1-NZ 3.41Å; D217-K279 PolarHBondContact OD1-NZ 3.41Å; D217-K279 WeakPolarHBondContact OD2-CE 3.49Å; D217-K279 IonicContact OD2-NZ 3.35Å; D217-K279 PolarHBondContact OD2-NZ 3.41Å; F221-K279 HydrophobicContact CE1-CB 3.99Å; F221-K279 HydrophobicContact CZ-CB 3.88Å; F221-K279 HydrophobicContact CZ-CD 4.18Å; F221-K279 HydrophobicContact CZ-CG 4.27Å; V259-K279 HydrophobicContact CG1-CD 3.92Å; L261-K279 VanDerWaalsContact O-CD 3.23Å; L261-K279 WeakPolarHBondContact O-CD 3.02Å; L261-K279 WeakPolarHBondContact O-CE 3.42Å; L261-K279 PolarHBondContact O-NZ 3.04Å; E262-K279 PolarHBondContact O-N 3.22Å; V264-K279 HydrophobicContact CG2-CB 3.6Å
280	Y	71.4	Confident	80.8	Confident	99 Å²	99	54.4 Å²	54.4	39%	0.388	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-50.6	179.8	-52.8	-67.7	0	0	0	111.6	D217 H244 E262 N278	D217-Y280 PolarHBondContact OD1-OH 2.92Å; D217-Y280 WeakPolarHBondContact OD2-CE1 3.2Å; D217-Y280 VanDerWaalsContact OD2-CZ 3.3Å; D217-Y280 PolarHBondContact OD2-OH 3.2Å; H244-Y280 PolarHBondContact CE1-O 2.73Å; H244-Y280 VanDerWaalsContact CE1-O 3.27Å; E262-Y280 HydrophobicContact CB-CE2 4.36Å; E262-Y280 HydrophobicContact CG-CE2 4.22Å; N278-Y280 VanDerWaalsContact C-N 3.3Å; N278-Y280 PolarHBondContact O-N 3.3Å; N278-Y280 WeakPolarHBondContact OD1-CA 3.2Å; N278-Y280 WeakPolarHBondContact OD1-CB 3.47Å; N278-Y280 PolarHBondContact OD1-N 3.49Å
281	T	70.1	Confident	80.9	Confident	110 Å²	110	59.1 Å²	59.1	68%	0.675	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-12.8	-171.8	63.3	0	0	0	0	114.3	N278 G283	N278-T281 WeakPolarHBondContact CB-OG1 3.23Å; N278-T281 PolarHBondContact OD1-N 3.36Å; N278-T281 PolarHBondContact OD1-OG1 2.79Å; T281-G283 PolarHBondContact O-N 3.43Å; T281-G283 VanDerWaalsContact O-N 3.07Å
282	G	65.4	Low	81	Confident	15 Å²	15	61.7 Å²	61.7	16%	0.155	32%	0.318	C	S	.	.			trans	63.4	15.2	179.3	0	0	0	0	0	115.1	N278	N278-G282 WeakPolarHBondContact O-CA 3.43Å; N278-G282 PolarHBondContact O-N 3.04Å; N278-G282 VanDerWaalsContact O-N 3.08Å
283	G	70.1	Confident	81	Confident	33 Å²	33	62.4 Å²	62.4	34%	0.34	32%	0.32	S	S	.	.			trans	-61.4	179.3	-170.2	0	0	0	0	0	115.8	I277 T281	I277-G283 WeakPolarHBondContact CG2-O 3.38Å; T281-G283 PolarHBondContact O-N 3.43Å; T281-G283 VanDerWaalsContact O-N 3.07Å
284	R	75.4	Confident	80.7	Confident	232 Å²	232	69 Å²	69	88%	0.875	36%	0.359	S	S	*	.			trans	-47.3	124.3	-170.3	-70.6	-173.9	-178.9	172.7	2.6	112.9
285	P	82.6	Confident	80.4	Confident	48 Å²	48	74.6 Å²	74.6	31%	0.312	38%	0.384	S	S	.	.			trans	-61.5	138	179.3	-23.9	33.5	0	0	0	113.1	L248 R275 I277	L248-P285 HydrophobicContact CD1-CG 3.65Å; L248-P285 HydrophobicContact CD2-CG 3.48Å; L248-P285 VanDerWaalsContact CD2-CG 3.48Å; L248-P285 HydrophobicContact CG-CG 4.18Å; R275-P285 HydrophobicContact CG-CB 4.48Å; I277-P285 HydrophobicContact CG2-CB 3.84Å; I277-P285 HydrophobicContact CG2-CG 3.75Å
286	V	87.5	Confident	79.9	Confident	76 Å²	76	74.7 Å²	74.7	46%	0.461	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.2	176.3	-177.6	0	0	0	0	108.8	R275 K276 V288	R275-V286 CarbonylContact C-O 3.59Å; R275-V286 WeakPolarHBondContact CA-O 3.21Å; K276-V286 HydrophobicContact CG-CB 4.01Å; K276-V286 PolarHBondContact N-O 3.49Å; K276-V286 PolarHBondContact O-N 3.11Å; V286-V288 PolarHBondContact O-N 2.82Å
287	D	87.4	Confident	79.7	Confident	80 Å²	80	71.6 Å²	71.6	43%	0.428	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.6	172	-71.9	-15.3	0	0	0	109.4	R275	R275-D287 WeakPolarHBondContact CD-OD1 3.31Å; R275-D287 WeakPolarHBondContact CG-OD1 3.13Å; R275-D287 IonicContact CZ-OD1 3.76Å; R275-D287 IonicContact NE-OD1 2.68Å; R275-D287 PolarHBondContact NE-OD1 2.82Å; R275-D287 IonicContact NH2-OD1 3.35Å
288	V	86.5	Confident	79.4	Confident	6 Å²	6	72.9 Å²	72.9	4%	0.036	39%	0.386	C	S	.	.	S	Bend	trans	-84	-30.4	-179.1	177.2	0	0	0	0	111	L55 M66 D69 G70 Y265 I274 K276 V286	L55-V288 HydrophobicContact CD1-CG1 3.92Å; M66-V288 HydrophobicContact CE-CG1 4.03Å; D69-V288 CarbonylContact C-O 3.57Å; G70-V288 WeakPolarHBondContact CA-O 3.42Å; G70-V288 PolarHBondContact N-O 3.14Å; G70-V288 VanDerWaalsContact N-O 3.12Å; Y265-V288 HydrophobicContact CD1-CG2 4.1Å; Y265-V288 HydrophobicContact CE1-CG2 4.2Å; I274-V288 HydrophobicContact CB-CB 4.33Å; I274-V288 HydrophobicContact CG2-CB 4.33Å; I274-V288 HydrophobicContact CG2-CG2 4.28Å; I274-V288 WeakPolarHBondContact O-CB 3.42Å; I274-V288 PolarHBondContact O-N 2.93Å; K276-V288 HydrophobicContact CB-CG2 4.03Å; K276-V288 HydrophobicContact CD-CG2 4.35Å; K276-V288 HydrophobicContact CG-CG2 4.03Å; V286-V288 PolarHBondContact O-N 2.82Å
289	N	85.1	Confident	79.6	Confident	9 Å²	9	72.1 Å²	72.1	5%	0.048	38%	0.382	C	S	.	.	S	Bend	trans	-116.5	120.9	178.4	57.8	-79.9	0	0	0	112.1	M66 I274 K291 M293	M66-N289 HydrophobicContact CE-CB 4.04Å; M66-N289 HydrophobicContact SD-CB 3.93Å; I274-N289 PolarHBondContact N-OD1 3.37Å; N289-K291 PolarHBondContact ND2-O 2.66Å; N289-K291 PolarHBondContact O-N 3.18Å; N289-M293 HydrophobicContact CB-CE 4.42Å
290	D	74.9	Confident	80.3	Confident	142 Å²	142	72 Å²	72	76%	0.759	38%	0.382	S	S	*	.	S	Bend	trans	-58	-21.1	-176.9	-50.2	-44.4	0	0	0	115
291	K	79.4	Confident	81.3	Confident	173 Å²	173	68.4 Å²	68.4	75%	0.752	37%	0.368	S	S	*	.	S	Bend	trans	-123.7	126.2	-175.6	-66.6	-173.4	-179.1	-178.9	0	110.9	N289	N289-K291 PolarHBondContact ND2-O 2.66Å; N289-K291 PolarHBondContact O-N 3.18Å
292	P	82.8	Confident	82.3	Confident	95 Å²	95	63.2 Å²	63.2	62%	0.617	34%	0.336	S	S	*	.			trans	-54.3	138.5	172.6	-29.1	36.7	0	0	0	112.9	V273	V273-P292 HydrophobicContact CG1-CG 4.5Å
293	M	84.3	Confident	83.3	Confident	22 Å²	22	62.5 Å²	62.5	11%	0.108	33%	0.329	C	S	.	.			trans	-84	132.1	178.3	-59	-168.3	-168.3	0	0	110.6	F57 M66 G272 I274 N289 K295 P297	F57-M293 HydrophobicContact CE2-CE 3.72Å; F57-M293 HydrophobicContact CE2-SD 3.65Å; F57-M293 HydrophobicContact CZ-CE 3.64Å; F57-M293 HydrophobicContact CZ-SD 4.14Å; M66-M293 HydrophobicContact CE-CE 4.34Å; M66-M293 HydrophobicContact SD-CE 4.28Å; G272-M293 WeakPolarHBondContact O-CB 3.22Å; G272-M293 WeakPolarHBondContact O-CG 3.42Å; G272-M293 PolarHBondContact O-N 2.88Å; I274-M293 HydrophobicContact CD1-CE 4.13Å; I274-M293 HydrophobicContact CG1-CE 4.38Å; N289-M293 HydrophobicContact CB-CE 4.42Å; M293-K295 WeakPolarHBondContact CB-O 3.17Å; M293-K295 PolarHBondContact O-N 2.89Å; M293-P297 HydrophobicContact SD-CB 4.47Å
294	V	81.5	Confident	83.9	Confident	142 Å²	142	62.4 Å²	62.4	86%	0.861	32%	0.32	S	S	*	.	S	Bend	trans	-58.7	-14.4	-178	-178.8	0	0	0	0	114.3
295	K	82.6	Confident	83.7	Confident	118 Å²	118	53.7 Å²	53.7	51%	0.513	29%	0.293	S	S	.	.	S	Bend	trans	-139.3	149.6	174.8	-67	-173.9	178	-179.7	0	107.5	H59 M293	H59-K295 PolarHBondContact CD2-O 3Å; H59-K295 PolarHBondContact NE2-O 2.96Å; M293-K295 WeakPolarHBondContact CB-O 3.17Å; M293-K295 PolarHBondContact O-N 2.89Å
296	P	78.3	Confident	83.3	Confident	58 Å²	58	56.3 Å²	56.3	38%	0.377	30%	0.304	S	S	.	.			trans	-62.8	139.4	177.8	26.8	-35.4	0	0	0	110.6	A269	A269-P296 HydrophobicContact CB-CB 3.44Å; A269-P296 VanDerWaalsContact CB-CB 3.44Å
297	P	83.8	Confident	82.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	147.1	165.7	26.4	-28.8	0	0	0	110.4	F57 G58 T267 I274 M293	F57-P297 HydrophobicContact CD2-CB 3.9Å; G58-P297 CarbonylContact O-C 3.47Å; G58-P297 VanDerWaalsContact O-CA 3.22Å; G58-P297 WeakPolarHBondContact O-CA 3.28Å; T267-P297 HydrophobicContact CG2-CB 3.92Å; T267-P297 HydrophobicContact CG2-CG 3.81Å; I274-P297 HydrophobicContact CG1-CG 4.15Å; M293-P297 HydrophobicContact SD-CB 4.47Å
298	V	80.8	Confident	82.6	Confident	30 Å²	30	51.1 Å²	51.1	18%	0.182	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	114.7	-174.2	-179.3	0	0	0	0	108.9	G58	G58-V298 WeakPolarHBondContact CA-O 3.37Å; G58-V298 PolarHBondContact N-O 2.81Å; G58-V298 PolarHBondContact O-N 3.14Å
299	D	86.5	Confident	81.7	Confident	24 Å²	24	53.2 Å²	53.2	13%	0.128	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61	142.8	-172.3	-157.2	7.6	0	0	0	113.5	F57 G58 L85 L86	F57-D299 VanDerWaalsContact CA-O 3.23Å; F57-D299 WeakPolarHBondContact CA-O 3.38Å; F57-D299 VanDerWaalsContact CB-O 3.27Å; F57-D299 WeakPolarHBondContact CB-O 3.21Å; G58-D299 PolarHBondContact N-O 2.85Å; L85-D299 VanDerWaalsContact CA-OD2 3.3Å; L85-D299 WeakPolarHBondContact CA-OD2 3.48Å; L86-D299 HydrophobicContact CG-CB 4.21Å; L86-D299 PolarHBondContact N-OD2 3.11Å
300	I	90.8	Very high	80.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	134	-170.8	-173.2	176	0	0	0	110.4	L55 L56 F57 G256 T267 I274	L55-I300 HydrophobicContact CD1-CD1 4.24Å; L55-I300 HydrophobicContact CD2-CD1 4.08Å; L55-I300 HydrophobicContact CD2-CG1 4.32Å; L56-I300 WeakPolarHBondContact O-CA 3.18Å; F57-I300 HydrophobicContact CB-CB 4.41Å; F57-I300 HydrophobicContact CB-CG1 4.41Å; G256-I300 WeakPolarHBondContact O-CG2 3.47Å; T267-I300 HydrophobicContact CG2-CB 4.21Å; T267-I300 HydrophobicContact CG2-CG2 4.18Å; I274-I300 HydrophobicContact CD1-CD1 3.99Å; I274-I300 HydrophobicContact CG1-CD1 4.37Å; I274-I300 HydrophobicContact CG2-CD1 3.53Å
301	K	91.6	Very high	78.9	Confident	24 Å²	24	52.4 Å²	52.4	10%	0.104	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.9	170.3	-65.4	-66.8	-179.3	-179.8	0	110	L56 L86 F88 N171	L56-K301 PolarHBondContact N-O 2.97Å; L56-K301 PolarHBondContact O-N 3.42Å; L86-K301 HydrophobicContact CD1-CB 4.11Å; L86-K301 HydrophobicContact CD1-CG 3.69Å; F88-K301 HydrophobicContact CD1-CB 4.21Å; F88-K301 HydrophobicContact CE1-CB 4.01Å; N171-K301 PolarHBondContact OD1-NZ 2.84Å
302	V	91.3	Very high	76.8	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	135.5	163	-179.5	0	0	0	0	107.7	P53 L55 L68 F88 S258 F260 Y265 I307	P53-V302 HydrophobicContact CB-CG1 4.42Å; L55-V302 HydrophobicContact CD2-CB 4.5Å; L55-V302 HydrophobicContact CD2-CG2 3.62Å; L68-V302 HydrophobicContact CD2-CG1 4.32Å; F88-V302 WeakPolarHBondContact CE1-O 3.4Å; F88-V302 WeakPolarHBondContact CZ-O 3.35Å; S258-V302 PolarHBondContact OG-N 3.28Å; F260-V302 HydrophobicContact CB-CB 4.05Å; F260-V302 HydrophobicContact CB-CG1 3.8Å; F260-V302 HydrophobicContact CB-CG2 3.93Å; F260-V302 HydrophobicContact CD1-CG1 4.01Å; F260-V302 HydrophobicContact CD2-CG1 4.2Å; F260-V302 HydrophobicContact CG-CG1 3.73Å; Y265-V302 HydrophobicContact CD2-CG2 3.69Å; Y265-V302 HydrophobicContact CE2-CG2 4.11Å; Y265-V302 HydrophobicContact CG-CG2 4.16Å; V302-I307 HydrophobicContact CB-CD1 3.62Å; V302-I307 HydrophobicContact CG1-CD1 3.72Å; V302-I307 VanDerWaalsContact O-CD1 3.27Å; V302-I307 WeakPolarHBondContact O-CD1 3.38Å
303	V	85.8	Confident	74.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.7	179.3	-177.5	0	0	0	0	109.2	W35 F54 L56 F88 F90	W35-V303 HydrophobicContact CH2-CG1 4.05Å; W35-V303 HydrophobicContact CZ2-CG1 4.32Å; W35-V303 HydrophobicContact CZ3-CG1 4.16Å; F54-V303 HydrophobicContact CD1-CB 4.48Å; F54-V303 HydrophobicContact CD2-CB 4.12Å; F54-V303 HydrophobicContact CD2-CG2 4.34Å; F54-V303 HydrophobicContact CE1-CB 3.97Å; F54-V303 HydrophobicContact CE1-CG1 3.91Å; F54-V303 HydrophobicContact CE2-CB 3.57Å; F54-V303 HydrophobicContact CE2-CG1 4.01Å; F54-V303 HydrophobicContact CE2-CG2 3.69Å; F54-V303 HydrophobicContact CZ-CB 3.46Å; F54-V303 VanDerWaalsContact CZ-CB 3.46Å; F54-V303 HydrophobicContact CZ-CG1 3.41Å; F54-V303 VanDerWaalsContact CZ-CG1 3.41Å; F54-V303 HydrophobicContact CZ-CG2 4.01Å; F54-V303 PolarHBondContact N-O 2.91Å; F54-V303 PolarHBondContact O-N 3.22Å; L56-V303 HydrophobicContact CB-CG2 3.93Å; F88-V303 HydrophobicContact CD1-CG2 3.96Å; F88-V303 HydrophobicContact CD2-CG1 3.9Å; F88-V303 HydrophobicContact CD2-CG2 4.33Å; F88-V303 HydrophobicContact CE1-CG2 3.97Å; F88-V303 HydrophobicContact CE2-CB 4.31Å; F88-V303 HydrophobicContact CE2-CG1 3.77Å; F88-V303 HydrophobicContact CE2-CG2 4.34Å; F88-V303 HydrophobicContact CG-CG1 4.5Å; F88-V303 HydrophobicContact CG-CG2 4.15Å; F88-V303 HydrophobicContact CZ-CB 4.3Å; F88-V303 HydrophobicContact CZ-CG1 4.26Å; F88-V303 HydrophobicContact CZ-CG2 4.17Å; F90-V303 HydrophobicContact CD2-CG1 3.8Å; F90-V303 HydrophobicContact CE2-CG1 4.16Å
304	H	82.4	Confident	71.8	Confident	31 Å²	31	58 Å²	58	14%	0.144	34%	0.339	C	S	.	.			trans	-158.8	150.5	178.5	-165.6	-108.4	0	0	0	110.1	P53 F260 L306 I307	P53-H304 HydrophobicContact CB-CB 4.18Å; F260-H304 HydrophobicContact CD2-CB 4.42Å; F260-H304 HydrophobicContact CE2-CB 3.73Å; F260-H304 AromaticContact CE2-CG 3.67Å; F260-H304 AromaticContact CE2-ND1 3.48Å; F260-H304 WeakPolarHBondContact CE2-ND1 3.41Å; F260-H304 HydrophobicContact CZ-CB 4.06Å; F260-H304 AromaticContact CZ-CG 3.69Å; F260-H304 AromaticContact CZ-ND1 3.62Å; H304-L306 WeakPolarHBondContact ND1-CG 3.24Å; H304-L306 PolarHBondContact ND1-N 3.13Å; H304-L306 PolarHBondContact O-N 3.01Å; H304-I307 HydrophobicContact CB-CD1 4.47Å; H304-I307 PolarHBondContact O-N 3.15Å; H304-I307 VanDerWaalsContact O-N 3.12Å
305	P	72.3	Confident	69.2	Low	49 Å²	49	55.9 Å²	55.9	32%	0.318	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-53.8	-37.2	175.9	-22.1	26.7	0	0	0	114.1	F90 I307 Q308	F90-P305 HydrophobicContact CD1-CB 4.38Å; F90-P305 HydrophobicContact CD1-CG 4.26Å; F90-P305 HydrophobicContact CE1-CB 4.12Å; F90-P305 HydrophobicContact CE1-CG 3.56Å; F90-P305 HydrophobicContact CE2-CG 4.24Å; F90-P305 HydrophobicContact CZ-CB 4.49Å; F90-P305 HydrophobicContact CZ-CG 3.55Å; P305-I307 PolarHBondContact O-N 3.28Å; P305-Q308 CarbonylContact O-C 3.58Å; P305-Q308 PolarHBondContact O-N 3.26Å
306	L	74.6	Confident	67.1	Low	103 Å²	103	55.9 Å²	55.9	54%	0.539	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-64.5	-19.6	-179.2	-63.5	172.9	0	0	0	114	F260 L261 H304	F260-L306 HydrophobicContact CE2-CB 4.43Å; F260-L306 HydrophobicContact CE2-CD1 4.45Å; L261-L306 HydrophobicContact CD2-CD1 4.35Å; H304-L306 WeakPolarHBondContact ND1-CG 3.24Å; H304-L306 PolarHBondContact ND1-N 3.13Å; H304-L306 PolarHBondContact O-N 3.01Å
307	I	78.7	Confident	64.7	Low	34 Å²	34	62.6 Å²	62.6	17%	0.174	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-85	-17.7	175.5	-65.7	171.8	0	0	0	111.1	F88 Q215 F260 V302 H304 P305 P309	F88-I307 HydrophobicContact CZ-CG2 4.12Å; Q215-I307 PolarHBondContact NE2-O 2.83Å; F260-I307 HydrophobicContact CB-CD1 4.22Å; F260-I307 HydrophobicContact CD2-CD1 3.69Å; F260-I307 HydrophobicContact CD2-CG1 3.91Å; F260-I307 HydrophobicContact CE2-CD1 4.48Å; F260-I307 HydrophobicContact CG-CD1 4.27Å; V302-I307 HydrophobicContact CB-CD1 3.62Å; V302-I307 HydrophobicContact CG1-CD1 3.72Å; V302-I307 VanDerWaalsContact O-CD1 3.27Å; V302-I307 WeakPolarHBondContact O-CD1 3.38Å; H304-I307 HydrophobicContact CB-CD1 4.47Å; H304-I307 PolarHBondContact O-N 3.15Å; H304-I307 VanDerWaalsContact O-N 3.12Å; P305-I307 PolarHBondContact O-N 3.28Å; I307-P309 VanDerWaalsContact C-CD 3.47Å
308	Q	80.4	Confident	62.9	Low	12 Å²	12	68 Å²	68	6%	0.056	40%	0.401	C	S	.	.	S	Bend	trans	-132.3	62.6	175.7	-66.4	-166.8	-19.3	0	0	111.3	F88 F90 W132 P305	F88-Q308 HydrophobicContact CE2-CG 4.05Å; F88-Q308 HydrophobicContact CZ-CG 4.3Å; F88-Q308 PolarHBondContact O-NE2 2.91Å; F90-Q308 HydrophobicContact CB-CB 4.31Å; W132-Q308 HydrophobicContact CD2-CB 3.76Å; W132-Q308 HydrophobicContact CD2-CG 3.57Å; W132-Q308 HydrophobicContact CE3-CB 4.36Å; W132-Q308 HydrophobicContact CE3-CG 3.65Å; W132-Q308 HydrophobicContact CG-CB 3.93Å; W132-Q308 HydrophobicContact CG-CG 4.11Å; W132-Q308 HydrophobicContact CH2-CG 4.18Å; W132-Q308 HydrophobicContact CZ2-CB 4.19Å; W132-Q308 HydrophobicContact CZ2-CG 4.1Å; W132-Q308 HydrophobicContact CZ3-CG 3.97Å; P305-Q308 CarbonylContact O-C 3.58Å; P305-Q308 PolarHBondContact O-N 3.26Å
309	P	68.7	Low	60.4	Low	50 Å²	50	73.5 Å²	73.5	33%	0.325	43%	0.434	S	S	.	.			trans	-64.4	155.3	175.8	29.7	-34.7	0	0	0	110.3	W132 T175 I307	W132-P309 PolarHBondContact NE1-O 2.9Å; T175-P309 HydrophobicContact CG2-CG 4.12Å; I307-P309 VanDerWaalsContact C-CD 3.47Å
310	M	55.4	Low	57.7	Low	62 Å²	62	76.6 Å²	76.6	31%	0.305	46%	0.458	S	S	.	.			trans	-115.3	143.3	176	-64.5	-147	68.9	0	0	110.1	R91 D312	R91-M310 PolarHBondContact NE-SD 3.15Å; R91-M310 VanDerWaalsContact NE-SD 3.41Å; R91-M310 PolarHBondContact NH1-SD 3.34Å; M310-D312 PolarHBondContact O-N 2.91Å
311	A	44.5	Very low	54.9	Low	73 Å²	73	83 Å²	83	60%	0.603	50%	0.499	S	S	*	.			trans	-70.4	116	172	0	0	0	0	0	109.1	T313	A311-T313 PolarHBondContact O-N 2.76Å
312	D	35	Very low	51.9	Low	156 Å²	156	89.5 Å²	89.5	83%	0.834	53%	0.53	S	S	*	.			trans	-71.7	113.2	179.1	-84.6	-29.3	0	0	0	111	M310	M310-D312 PolarHBondContact O-N 2.91Å
313	T	32.8	Very low	48.9	Very low	126 Å²	126	97.3 Å²	97.3	77%	0.773	57%	0.571	S	S	*	*			trans	-83.7	126.9	162.2	46.2	0	0	0	0	108.9	A311	A311-T313 PolarHBondContact O-N 2.76Å
314	S	30.1	Very low	46	Very low	125 Å²	125	101.9 Å²	101.9	87%	0.874	60%	0.603	S	S	*	*	S	Bend	trans	84.1	76	174.9	71.9	0	0	0	0	119.6
315	S	27.3	Very low	43.3	Very low	98 Å²	98	105 Å²	105	69%	0.685	63%	0.627	S	S	*	*			trans	-164	144.4	134.9	-170.8	0	0	0	0	110.8
316	P	37.4	Very low	41.1	Very low	118 Å²	118	109.4 Å²	109.4	77%	0.766	65%	0.648	S	S	*	*			trans	-70.3	140.1	159.1	-6.3	23.8	0	0	0	109.7
317	F	29.7	Very low	39.2	Very low	198 Å²	198	112.5 Å²	112.5	87%	0.868	67%	0.665	S	S	*	*			trans	-73.3	169.9	174.7	-66.7	-79.4	0	0	0	111.6
318	P	45.4	Very low	37.4	Very low	113 Å²	113	119.5 Å²	119.5	73%	0.734	70%	0.697	S	S	*	*			cis	-139.7	135.1	10.9	36.3	-16.1	0	0	0	116.7
319	V	27.8	Very low	35.1	Very low	146 Å²	146	120.9 Å²	120.9	89%	0.885	71%	0.708	S	S	*	*			trans	-149.6	121	154.5	-155.4	0	0	0	0	111
320	S	30.6	Very low	34.1	Very low	89 Å²	89	120.1 Å²	120.1	62%	0.622	71%	0.709	S	S	*	*			trans	-66	143.4	163.8	-52.3	0	0	0	0	110	H322	S320-H322 PolarHBondContact O-N 2.87Å
321	P	31	Very low	33.1	Very low	134 Å²	134	121.9 Å²	121.9	87%	0.87	73%	0.728	S	S	*	*			trans	-72.8	82.7	164.5	31.7	-32.3	0	0	0	108.8	L323	P321-L323 PolarHBondContact O-N 2.93Å
322	H	28.6	Very low	32.9	Very low	161 Å²	161	119.1 Å²	119.1	75%	0.745	70%	0.704	S	S	*	*			trans	-59.4	105.5	159.6	-90.5	-75.8	0	0	0	107.9	S320	S320-H322 PolarHBondContact O-N 2.87Å
323	L	27.9	Very low	33	Very low	166 Å²	166	117.3 Å²	117.3	87%	0.869	70%	0.698	S	S	*	*				-66.9	124	128.1	-134.4	73.4	0	0	0	105.5	P321	P321-L323 PolarHBondContact O-N 2.93Å
324	S	25.9	Very low	33.1	Very low	95 Å²	95	116.7 Å²	116.7	66%	0.664	69%	0.69	S	S	*	*			trans	-57	145.9	174.8	54.3	0	0	0	0	110.1
325	C	24.6	Very low	33.4	Very low	96 Å²	96	116.4 Å²	116.4	65%	0.649	68%	0.683	S	S	*	*				-147.8	170.3	68.8	-81.5	0	0	0	0	115.8
326	N	26.5	Very low	33.3	Very low	142 Å²	142	117.5 Å²	117.5	76%	0.759	69%	0.689	S	S	*	*			trans	-60.8	166.1	176.5	-91.6	0.4	0	0	0	115.3	Q328	N326-Q328 PolarHBondContact O-N 3.46Å
327	D	34.7	Very low	32.8	Very low	169 Å²	169	117 Å²	117	90%	0.904	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	34.5	176.6	-57.4	-52.3	0	0	0	117.1
328	Q	40.6	Very low	32.9	Very low	180 Å²	180	119 Å²	119	84%	0.841	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139	8.5	177.9	-73.7	-163.4	-20.7	0	0	115.5	N326	N326-Q328 PolarHBondContact O-N 3.46Å
329	S	32.5	Very low	32.6	Very low	41 Å²	41	120.7 Å²	120.7	29%	0.287	69%	0.692	S	S	.	*			trans	-160.3	94.6	-177.4	56.7	0	0	0	0	111.1	H359	S329-H359 VanDerWaalsContact CA-CD2 3.43Å; S329-H359 WeakPolarHBondContact CA-CD2 3.04Å; S329-H359 WeakPolarHBondContact CA-NE2 3.3Å; S329-H359 WeakPolarHBondContact CB-CD2 3.5Å; S329-H359 VanDerWaalsContact CB-CE1 3.5Å; S329-H359 WeakPolarHBondContact CB-CE1 3.34Å; S329-H359 VanDerWaalsContact CB-NE2 3.3Å; S329-H359 WeakPolarHBondContact CB-NE2 3.15Å
330	G	47.7	Very low	33.2	Very low	34 Å²	34	122.3 Å²	122.3	35%	0.351	69%	0.69	S	S	.	*			trans	-61.7	147.3	170.1	0	0	0	0	0	109.4	H359 C360	G330-H359 CarbonylContact O-C 3.59Å; G330-H359 WeakPolarHBondContact O-CA 3.35Å; G330-H359 WeakPolarHBondContact O-CB 3.44Å; G330-H359 PolarHBondContact O-CD2 3.47Å; G330-C360 CarbonylContact C-O 3.59Å; G330-C360 WeakPolarHBondContact CA-O 3.33Å; G330-C360 PolarHBondContact N-O 3.12Å; G330-C360 CarbonylContact O-C 3.53Å; G330-C360 WeakPolarHBondContact O-CA 3.28Å; G330-C360 PolarHBondContact O-N 3.33Å
331	S	34.7	Very low	33.7	Very low	100 Å²	100	127.3 Å²	127.3	70%	0.699	70%	0.704	S	S	*	*	B	Isolated β-bridge	trans	-106.1	128.9	-156.4	-162.6	0	0	0	0	114.3
332	C	40.6	Very low	34.1	Very low	15 Å²	15	129 Å²	129	10%	0.101	70%	0.704	C	S	.	*			trans	-85.1	150.5	157.9	152.5	0	0	0	0	109.8	C345	C332-C345 HydrophobicContact CB-CB 3.43Å; C332-C345 VanDerWaalsContact CB-CB 3.43Å; C332-C345 WeakPolarHBondContact CB-SG 3.35Å; C332-C345 WeakPolarHBondContact SG-CA 3.43Å; C332-C345 WeakPolarHBondContact SG-CB 3.49Å; C332-C345 CovalentContact SG-SG 2.01Å; C332-C345 PolarHBondContact SG-SG 2.95Å
333	V	36.7	Very low	34.9	Very low	117 Å²	117	123.3 Å²	123.3	71%	0.709	69%	0.689	S	S	*	*			trans	-103.5	124	171.2	-178.4	0	0	0	0	111	V335	V333-V335 PolarHBondContact O-N 2.69Å; V333-V335 VanDerWaalsContact O-N 3.15Å
334	N	34.8	Very low	35.8	Very low	114 Å²	114	121.4 Å²	121.4	61%	0.61	69%	0.685	S	S	*	*			trans	-58.5	112.4	168.9	-102.4	-41.7	0	0	0	111.2	C336	N334-C336 PolarHBondContact O-N 2.92Å
335	V	35.8	Very low	37.1	Very low	119 Å²	119	117.7 Å²	117.7	72%	0.721	66%	0.658	S	S	*	*			trans	-86.4	101.3	170.5	-178.6	0	0	0	0	109.5	V333 S337	V333-V335 PolarHBondContact O-N 2.69Å; V333-V335 VanDerWaalsContact O-N 3.15Å; V335-S337 PolarHBondContact O-N 2.95Å
336	C	26.8	Very low	38.3	Very low	121 Å²	121	121.6 Å²	121.6	82%	0.818	67%	0.667	S	S	*	*			trans	-78.8	97.9	170.3	-73.3	0	0	0	0	111.4	N334	N334-C336 PolarHBondContact O-N 2.92Å
337	S	26.9	Very low	39.7	Very low	108 Å²	108	116.6 Å²	116.6	76%	0.755	64%	0.643	S	S	*	*			trans	-68.8	155.4	150.9	38.6	0	0	0	0	109.9	V335 L339	V335-S337 PolarHBondContact O-N 2.95Å; S337-L339 PolarHBondContact O-N 3.3Å
338	R	30.5	Very low	40.4	Very low	239 Å²	239	112 Å²	112	90%	0.902	62%	0.624	S	S	*	*	S	Bend	trans	-74.5	128.2	-174.3	-77.1	-177.3	178.8	167.1	-0.4	112.4
339	L	39.8	Very low	40.9	Very low	148 Å²	148	112.7 Å²	112.7	78%	0.775	63%	0.627	S	S	*	*	S	Bend	trans	65.6	112.1	169.9	-81.5	80.6	0	0	0	116.5	S337	S337-L339 PolarHBondContact O-N 3.3Å
340	E	39.7	Very low	42	Very low	180 Å²	180	111.5 Å²	111.5	84%	0.841	62%	0.622	S	S	*	*	S	Bend	trans	79.7	121.6	153	-61	177.4	177.7	0	0	118.4
341	E	40.5	Very low	42.7	Very low	195 Å²	195	112.6 Å²	112.6	91%	0.911	62%	0.617	S	S	*	*	S	Bend	trans	77.9	158.3	175.2	-52.2	-159.4	159.4	0	0	119.3
342	L	41.3	Very low	44.1	Very low	168 Å²	168	110.1 Å²	110.1	88%	0.88	60%	0.602	S	S	*	*			trans	-72.5	140.9	-148.7	-71	107.1	0	0	0	115.7
343	G	45.2	Very low	45.2	Very low	42 Å²	42	113.2 Å²	113.2	43%	0.433	62%	0.617	S	S	.	*			trans	-74.8	144.3	173	0	0	0	0	0	113.5
344	V	47.1	Very low	46.4	Very low	127 Å²	127	108 Å²	108	77%	0.77	59%	0.586	S	S	*	*			trans	-116.2	144.2	178.2	177.8	0	0	0	0	109.9
345	C	52	Low	47.5	Very low	16 Å²	16	110.2 Å²	110.2	11%	0.108	60%	0.598	C	S	.	*			trans	-89.5	151.9	-176	-79.1	0	0	0	0	114.5	C332 L353 G357	C332-C345 HydrophobicContact CB-CB 3.43Å; C332-C345 VanDerWaalsContact CB-CB 3.43Å; C332-C345 WeakPolarHBondContact CB-SG 3.35Å; C332-C345 WeakPolarHBondContact SG-CA 3.43Å; C332-C345 WeakPolarHBondContact SG-CB 3.49Å; C332-C345 CovalentContact SG-SG 2.01Å; C332-C345 PolarHBondContact SG-SG 2.95Å; C345-L353 HydrophobicContact CB-CD1 3.72Å; C345-L353 HydrophobicContact CB-CG 4.45Å; C345-L353 VanDerWaalsContact O-CD1 3.3Å; C345-L353 WeakPolarHBondContact O-CD1 3.28Å; C345-G357 WeakPolarHBondContact CB-O 3.27Å; C345-G357 PolarHBondContact SG-O 2.88Å; C345-G357 VanDerWaalsContact SG-O 3.35Å
346	Q	50.7	Low	48.3	Very low	179 Å²	179	112.6 Å²	112.6	84%	0.836	60%	0.601	S	S	*	*			trans	-141	136.8	175.3	-172.1	170.4	3.7	0	0	110.2
347	C	54.6	Low	49.7	Very low	36 Å²	36	108.2 Å²	108.2	24%	0.243	58%	0.576	C	S	.	*			trans	-109.8	160.1	-174.8	-55.1	0	0	0	0	112.9	F351 C360	C347-F351 HydrophobicContact CB-CB 4.03Å; C347-F351 WeakPolarHBondContact CB-O 3.43Å; C347-C360 WeakPolarHBondContact CA-SG 3.31Å; C347-C360 HydrophobicContact CB-CB 3.8Å; C347-C360 WeakPolarHBondContact CB-SG 3.47Å; C347-C360 WeakPolarHBondContact SG-CA 3.37Å; C347-C360 WeakPolarHBondContact SG-CB 3.49Å; C347-C360 CovalentContact SG-SG 2.03Å; C347-C360 PolarHBondContact SG-SG 2.99Å
348	S	49.4	Very low	50.8	Low	74 Å²	74	107.3 Å²	107.3	52%	0.517	57%	0.566	S	S	.	*			trans	-70.9	160.1	167.5	37.7	0	0	0	0	112	F351	S348-F351 PolarHBondContact O-N 3.11Å; S348-F351 VanDerWaalsContact O-N 3.09Å; S348-F351 VanDerWaalsContact OG-CD2 3.26Å; S348-F351 WeakPolarHBondContact OG-CD2 3.29Å
349	E	52.8	Low	51.8	Low	194 Å²	194	97.5 Å²	97.5	91%	0.907	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	146.9	167.2	-65.7	-172.8	149.4	0	0	110.3	F351	E349-F351 VanDerWaalsContact C-N 3.26Å; E349-F351 PolarHBondContact O-N 3.09Å
350	G	54.4	Low	52.8	Low	16 Å²	16	90.9 Å²	90.9	17%	0.165	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-0.3	-167	0	0	0	0	0	114.7	V363	G350-V363 WeakPolarHBondContact O-CB 3.28Å; G350-V363 PolarHBondContact O-N 2.83Å
351	F	62.1	Low	53.6	Low	57 Å²	57	86.6 Å²	86.6	25%	0.25	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139.2	178.3	-64	-97.9	0	0	0	112.2	C347 S348 E349 C360 E361 D362 P381	C347-F351 HydrophobicContact CB-CB 4.03Å; C347-F351 WeakPolarHBondContact CB-O 3.43Å; S348-F351 PolarHBondContact O-N 3.11Å; S348-F351 VanDerWaalsContact O-N 3.09Å; S348-F351 VanDerWaalsContact OG-CD2 3.26Å; S348-F351 WeakPolarHBondContact OG-CD2 3.29Å; E349-F351 VanDerWaalsContact C-N 3.26Å; E349-F351 PolarHBondContact O-N 3.09Å; F351-C360 HydrophobicContact CB-CB 4.25Å; F351-E361 CarbonylContact C-O 3.57Å; F351-E361 VanDerWaalsContact CA-O 3.25Å; F351-E361 WeakPolarHBondContact CA-O 3.48Å; F351-D362 HydrophobicContact CD1-CB 4.14Å; F351-D362 HydrophobicContact CE1-CB 3.92Å; F351-P381 HydrophobicContact CZ-CB 4.18Å
352	A	64.1	Low	54.5	Low	48 Å²	48	80.1 Å²	80.1	40%	0.397	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	150.7	-179.4	0	0	0	0	0	111.8	S354 C360 E361 V363	A352-S354 PolarHBondContact O-N 2.83Å; A352-C360 CarbonylContact O-C 3.52Å; A352-C360 WeakPolarHBondContact O-CA 3.48Å; A352-E361 PolarHBondContact N-O 2.82Å; A352-E361 PolarHBondContact O-N 2.82Å; A352-V363 HydrophobicContact CB-CG2 3.71Å
353	L	64.1	Low	56	Low	80 Å²	80	74.7 Å²	74.7	42%	0.419	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.9	174.5	-139.4	85.7	0	0	0	109.9	C345	C345-L353 HydrophobicContact CB-CD1 3.72Å; C345-L353 HydrophobicContact CB-CG 4.45Å; C345-L353 VanDerWaalsContact O-CD1 3.3Å; C345-L353 WeakPolarHBondContact O-CD1 3.28Å
354	S	61	Low	57.1	Low	6 Å²	6	76.4 Å²	76.4	4%	0.042	42%	0.421	C	S	.	.			trans	-61.9	155.3	173.4	67.3	0	0	0	0	111.6	A352 H356 G357 H359 E361	A352-S354 PolarHBondContact O-N 2.83Å; S354-H356 PolarHBondContact O-N 2.87Å; S354-G357 PolarHBondContact O-N 2.89Å; S354-H359 WeakPolarHBondContact CB-NE2 3.49Å; S354-H359 PolarHBondContact N-O 2.73Å; S354-H359 PolarHBondContact OG-CE1 3.3Å; S354-H359 VanDerWaalsContact OG-CE1 3.31Å; S354-H359 PolarHBondContact OG-ND1 3.24Å; S354-H359 PolarHBondContact OG-O 2.89Å; S354-E361 WeakPolarHBondContact CB-OE1 3.47Å
355	N	59.8	Low	58.6	Low	161 Å²	161	71.7 Å²	71.7	86%	0.861	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.7	-176.9	-74.6	-45.6	0	0	0	114.8
356	H	52.6	Low	59.5	Low	170 Å²	170	71.9 Å²	71.9	79%	0.787	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	3.1	176.9	-62.8	-58.4	0	0	0	113.7	S354 T358	S354-H356 PolarHBondContact O-N 2.87Å; H356-T358 PolarHBondContact O-N 2.82Å
357	G	55.5	Low	60.3	Low	29 Å²	29	67 Å²	67	30%	0.299	38%	0.382	S	S	.	.	S	Bend	trans	69.3	13	170.8	0	0	0	0	0	116	C345 S354	C345-G357 WeakPolarHBondContact CB-O 3.27Å; C345-G357 PolarHBondContact SG-O 2.88Å; C345-G357 VanDerWaalsContact SG-O 3.35Å; S354-G357 PolarHBondContact O-N 2.89Å
358	T	50	Low	60.3	Low	89 Å²	89	72.3 Å²	72.3	55%	0.546	40%	0.403	S	S	.	.	S	Bend	trans	-92.2	-21.4	-174.3	50.1	0	0	0	0	113.7	H356	H356-T358 PolarHBondContact O-N 2.82Å
359	H	51.5	Low	60.3	Low	33 Å²	33	80.5 Å²	80.5	15%	0.153	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-162	161.4	-161.4	79.2	-110.8	0	0	0	110.6	S329 G330 S354 E361	S329-H359 VanDerWaalsContact CA-CD2 3.43Å; S329-H359 WeakPolarHBondContact CA-CD2 3.04Å; S329-H359 WeakPolarHBondContact CA-NE2 3.3Å; S329-H359 WeakPolarHBondContact CB-CD2 3.5Å; S329-H359 VanDerWaalsContact CB-CE1 3.5Å; S329-H359 WeakPolarHBondContact CB-CE1 3.34Å; S329-H359 VanDerWaalsContact CB-NE2 3.3Å; S329-H359 WeakPolarHBondContact CB-NE2 3.15Å; G330-H359 CarbonylContact O-C 3.59Å; G330-H359 WeakPolarHBondContact O-CA 3.35Å; G330-H359 WeakPolarHBondContact O-CB 3.44Å; G330-H359 PolarHBondContact O-CD2 3.47Å; S354-H359 WeakPolarHBondContact CB-NE2 3.49Å; S354-H359 PolarHBondContact N-O 2.73Å; S354-H359 PolarHBondContact OG-CE1 3.3Å; S354-H359 VanDerWaalsContact OG-CE1 3.31Å; S354-H359 PolarHBondContact OG-ND1 3.24Å; S354-H359 PolarHBondContact OG-O 2.89Å; H359-E361 IonicContact NE2-OE1 3.72Å; H359-E361 PolarHBondContact NE2-OE1 3.22Å
360	C	61.1	Low	60.8	Low	8 Å²	8	73.6 Å²	73.6	5%	0.054	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	108.6	-175.7	-65.8	0	0	0	0	111.7	G330 C347 F351 A352	G330-C360 CarbonylContact C-O 3.59Å; G330-C360 WeakPolarHBondContact CA-O 3.33Å; G330-C360 PolarHBondContact N-O 3.12Å; G330-C360 CarbonylContact O-C 3.53Å; G330-C360 WeakPolarHBondContact O-CA 3.28Å; G330-C360 PolarHBondContact O-N 3.33Å; C347-C360 WeakPolarHBondContact CA-SG 3.31Å; C347-C360 HydrophobicContact CB-CB 3.8Å; C347-C360 WeakPolarHBondContact CB-SG 3.47Å; C347-C360 WeakPolarHBondContact SG-CA 3.37Å; C347-C360 WeakPolarHBondContact SG-CB 3.49Å; C347-C360 CovalentContact SG-SG 2.03Å; C347-C360 PolarHBondContact SG-SG 2.99Å; F351-C360 HydrophobicContact CB-CB 4.25Å; A352-C360 CarbonylContact O-C 3.52Å; A352-C360 WeakPolarHBondContact O-CA 3.48Å
361	E	56.5	Low	61.6	Low	90 Å²	90	76.5 Å²	76.5	42%	0.421	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	145.3	174.1	-67.7	170.7	-155.9	0	0	110.6	F351 A352 S354 H359	F351-E361 CarbonylContact C-O 3.57Å; F351-E361 VanDerWaalsContact CA-O 3.25Å; F351-E361 WeakPolarHBondContact CA-O 3.48Å; A352-E361 PolarHBondContact N-O 2.82Å; A352-E361 PolarHBondContact O-N 2.82Å; S354-E361 WeakPolarHBondContact CB-OE1 3.47Å; H359-E361 IonicContact NE2-OE1 3.72Å; H359-E361 PolarHBondContact NE2-OE1 3.22Å
362	D	59.7	Low	61.7	Low	59 Å²	59	75.9 Å²	75.9	32%	0.316	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	130.2	174.5	-176.6	62.3	0	0	0	110.5	F351 N364 N379 P381 G382	F351-D362 HydrophobicContact CD1-CB 4.14Å; F351-D362 HydrophobicContact CE1-CB 3.92Å; D362-N364 PolarHBondContact O-N 3.33Å; D362-N379 PolarHBondContact OD2-ND2 2.9Å; D362-P381 WeakPolarHBondContact OD1-CA 3.46Å; D362-G382 PolarHBondContact OD1-N 3.12Å
363	V	72.4	Confident	62.2	Low	55 Å²	55	74 Å²	74	33%	0.333	39%	0.394	S	S	.	.			trans	-79.6	103	176.8	176.2	0	0	0	0	107.6	G350 A352 E365	G350-V363 WeakPolarHBondContact O-CB 3.28Å; G350-V363 PolarHBondContact O-N 2.83Å; A352-V363 HydrophobicContact CB-CG2 3.71Å; V363-E365 VanDerWaalsContact C-N 3.33Å; V363-E365 HydrophobicContact CG1-CG 4.43Å; V363-E365 VanDerWaalsContact O-CD 3.27Å; V363-E365 PolarHBondContact O-N 3.03Å
364	N	68.3	Low	62.7	Low	78 Å²	78	72.7 Å²	72.7	42%	0.417	39%	0.392	S	S	.	.			trans	-68.5	92.6	173.4	-172	-38.8	0	0	0	110.3	D362 C366 A367 N379	D362-N364 PolarHBondContact O-N 3.33Å; N364-C366 VanDerWaalsContact C-N 3.27Å; N364-C366 PolarHBondContact O-N 2.83Å; N364-C366 WeakPolarHBondContact OD1-CB 3.1Å; N364-C366 PolarHBondContact OD1-N 3.48Å; N364-A367 HydrophobicContact CB-CB 4.14Å; N364-A367 WeakPolarHBondContact O-CB 3.36Å; N364-A367 PolarHBondContact O-N 2.81Å; N364-A367 VanDerWaalsContact O-N 3.16Å; N364-A367 PolarHBondContact OD1-N 2.79Å; N364-N379 VanDerWaalsContact CA-OD1 3.24Å; N364-N379 WeakPolarHBondContact CA-OD1 3.48Å
365	E	77.4	Confident	63.2	Low	27 Å²	27	76.6 Å²	76.6	13%	0.126	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-63.1	-35.6	-177.8	-82	102.5	-163.1	0	0	112	V363 A367 H368 H371 N379 S383 Y384	V363-E365 VanDerWaalsContact C-N 3.33Å; V363-E365 HydrophobicContact CG1-CG 4.43Å; V363-E365 VanDerWaalsContact O-CD 3.27Å; V363-E365 PolarHBondContact O-N 3.03Å; E365-A367 PolarHBondContact O-N 3.15Å; E365-H368 PolarHBondContact O-N 3.35Å; E365-H371 HydrophobicContact CB-CB 4.18Å; E365-H371 WeakPolarHBondContact CB-ND1 3.28Å; E365-N379 PolarHBondContact N-OD1 3.21Å; E365-N379 VanDerWaalsContact N-OD1 3.09Å; E365-S383 VanDerWaalsContact OE2-CA 3.32Å; E365-S383 WeakPolarHBondContact OE2-CA 3.24Å; E365-Y384 HydrophobicContact CB-CD1 3.39Å; E365-Y384 HydrophobicContact CB-CE1 4.13Å; E365-Y384 HydrophobicContact CB-CG 3.85Å; E365-Y384 HydrophobicContact CG-CD1 3.66Å; E365-Y384 HydrophobicContact CG-CE1 4.18Å
366	C	71.8	Confident	63.6	Low	20 Å²	20	69.6 Å²	69.6	14%	0.135	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-62.2	-27.1	177.4	-57.3	0	0	0	0	112.7	N364 H368 N370 C377	N364-C366 VanDerWaalsContact C-N 3.27Å; N364-C366 PolarHBondContact O-N 2.83Å; N364-C366 WeakPolarHBondContact OD1-CB 3.1Å; N364-C366 PolarHBondContact OD1-N 3.48Å; C366-H368 PolarHBondContact O-N 3.06Å; C366-N370 WeakPolarHBondContact O-CA 3.16Å; C366-N370 PolarHBondContact O-N 3.44Å; C366-C377 WeakPolarHBondContact CA-SG 3.09Å; C366-C377 HydrophobicContact CB-CB 3.64Å; C366-C377 WeakPolarHBondContact CB-SG 3.38Å; C366-C377 WeakPolarHBondContact SG-CB 3.27Å; C366-C377 CovalentContact SG-SG 2.04Å; C366-C377 PolarHBondContact SG-SG 3.18Å
367	A	66.6	Low	64.5	Low	76 Å²	76	62.5 Å²	62.5	63%	0.628	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-66.1	-21.2	178.2	0	0	0	0	0	113.5	N364 E365	N364-A367 HydrophobicContact CB-CB 4.14Å; N364-A367 WeakPolarHBondContact O-CB 3.36Å; N364-A367 PolarHBondContact O-N 2.81Å; N364-A367 VanDerWaalsContact O-N 3.16Å; N364-A367 PolarHBondContact OD1-N 2.79Å; E365-A367 PolarHBondContact O-N 3.15Å
368	H	54.5	Low	65.1	Low	149 Å²	149	66 Å²	66	69%	0.69	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	96.6	174.4	-93.2	-69.7	0	0	0	111.3	E365 C366 N370 H371	E365-H368 PolarHBondContact O-N 3.35Å; C366-H368 PolarHBondContact O-N 3.06Å; H368-N370 PolarHBondContact O-N 3.3Å; H368-N370 VanDerWaalsContact O-N 3.16Å; H368-H371 PolarHBondContact O-N 3.18Å
369	W	50.7	Low	65.4	Low	246 Å²	246	64 Å²	64	93%	0.932	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	51.9	37.6	175.7	-70.3	74.7	0	0	0	113.5	H371 G372	W369-H371 PolarHBondContact O-N 3.46Å; W369-G372 PolarHBondContact O-N 3.06Å
370	N	62.7	Low	65.5	Low	48 Å²	48	66 Å²	66	26%	0.257	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	57.8	19.9	-179.5	-142.2	35.9	0	0	0	113	C366 H368 G372 C373 C377	C366-N370 WeakPolarHBondContact O-CA 3.16Å; C366-N370 PolarHBondContact O-N 3.44Å; H368-N370 PolarHBondContact O-N 3.3Å; H368-N370 VanDerWaalsContact O-N 3.16Å; N370-G372 PolarHBondContact O-N 3.07Å; N370-C373 HydrophobicContact CB-CB 4.41Å; N370-C373 WeakPolarHBondContact CB-O 3.22Å; N370-C373 PolarHBondContact ND2-O 3.42Å; N370-C373 WeakPolarHBondContact O-CB 3.45Å; N370-C373 PolarHBondContact O-N 3.06Å; N370-C373 PolarHBondContact O-SG 2.97Å; N370-C377 WeakPolarHBondContact OD1-CB 3.48Å
371	H	70.6	Confident	64.8	Low	78 Å²	78	71.2 Å²	71.2	36%	0.361	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	44.8	28.1	-165.8	-143.9	101.2	0	0	0	115.7	E365 H368 W369 C373 Y384	E365-H371 HydrophobicContact CB-CB 4.18Å; E365-H371 WeakPolarHBondContact CB-ND1 3.28Å; H368-H371 PolarHBondContact O-N 3.18Å; W369-H371 PolarHBondContact O-N 3.46Å; H371-C373 VanDerWaalsContact C-N 3.34Å; H371-Y384 HydrophobicContact CB-CD1 4.34Å; H371-Y384 HydrophobicContact CB-CD2 4.03Å; H371-Y384 HydrophobicContact CB-CE1 4.07Å; H371-Y384 HydrophobicContact CB-CE2 3.75Å; H371-Y384 HydrophobicContact CB-CG 4.35Å; H371-Y384 AromaticContact CD2-CE1 3.45Å; H371-Y384 VanDerWaalsContact CD2-CE1 3.45Å; H371-Y384 WeakPolarHBondContact CD2-CE1 3.3Å; H371-Y384 AromaticContact CD2-CZ 3.24Å; H371-Y384 PolarHBondContact CD2-OH 2.91Å; H371-Y384 AromaticContact CG-CE1 3.58Å; H371-Y384 AromaticContact CG-CZ 3.58Å; H371-Y384 AromaticContact ND1-CE1 4Å; H371-Y384 AromaticContact NE2-CE1 3.78Å; H371-Y384 AromaticContact NE2-CZ 3.97Å
372	G	64.1	Low	64.7	Low	44 Å²	44	68.1 Å²	68.1	45%	0.454	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	80.7	8.8	-175.3	0	0	0	0	0	115	W369 N370	W369-G372 PolarHBondContact O-N 3.06Å; N370-G372 PolarHBondContact O-N 3.07Å
373	C	74.7	Confident	64.8	Low	7 Å²	7	68 Å²	68	5%	0.047	38%	0.382	C	S	.	.			trans	-68.1	139.3	160.6	-55.2	0	0	0	0	110.2	N370 H371 G376 C377 C386	N370-C373 HydrophobicContact CB-CB 4.41Å; N370-C373 WeakPolarHBondContact CB-O 3.22Å; N370-C373 PolarHBondContact ND2-O 3.42Å; N370-C373 WeakPolarHBondContact O-CB 3.45Å; N370-C373 PolarHBondContact O-N 3.06Å; N370-C373 PolarHBondContact O-SG 2.97Å; H371-C373 VanDerWaalsContact C-N 3.34Å; C373-G376 WeakPolarHBondContact CB-O 3.45Å; C373-C377 HydrophobicContact CB-CB 3.99Å; C373-C386 VanDerWaalsContact CA-SG 3.52Å; C373-C386 HydrophobicContact CB-CB 3.64Å; C373-C386 WeakPolarHBondContact CB-SG 3.49Å; C373-C386 WeakPolarHBondContact SG-CA 3.5Å; C373-C386 WeakPolarHBondContact SG-CB 3.34Å; C373-C386 CovalentContact SG-SG 2.02Å; C373-C386 PolarHBondContact SG-SG 3.31Å
374	S	75.7	Confident	64.8	Low	53 Å²	53	67.6 Å²	67.6	37%	0.371	38%	0.375	S	S	.	.	S	Bend	trans	-76	-48.3	-174	53.5	0	0	0	0	115.4	R399 T400 C401	S374-R399 WeakPolarHBondContact CB-O 3.47Å; S374-R399 PolarHBondContact N-O 3.31Å; S374-R399 PolarHBondContact OG-O 3.18Å; S374-T400 WeakPolarHBondContact OG-CA 3.38Å; S374-C401 WeakPolarHBondContact OG-CB 3.41Å; S374-C401 PolarHBondContact OG-N 3.41Å
375	L	71.1	Confident	64.7	Low	89 Å²	89	68.3 Å²	68.3	47%	0.466	38%	0.375	S	S	.	.	S	Bend	trans	-121.8	-35.3	-175	-65.6	-177.8	0	0	0	114.3	P389 Y392 C401	L375-P389 HydrophobicContact CB-CG 4.2Å; L375-P389 HydrophobicContact CD1-CG 3.83Å; L375-Y392 HydrophobicContact CD1-CD1 3.49Å; L375-Y392 VanDerWaalsContact CD1-CD1 3.49Å; L375-Y392 HydrophobicContact CD1-CD2 4.38Å; L375-Y392 HydrophobicContact CD1-CE1 3.9Å; L375-Y392 HydrophobicContact CD1-CG 3.81Å; L375-C401 HydrophobicContact CB-CB 4.08Å; L375-C401 HydrophobicContact CD1-CB 3.6Å; L375-C401 HydrophobicContact CG-CB 3.84Å
376	G	67.4	Low	64.3	Low	13 Å²	13	67.6 Å²	67.6	13%	0.134	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.4	179.8	0	0	0	0	0	112.1	C373 C386 T387	C373-G376 WeakPolarHBondContact CB-O 3.45Å; G376-C386 WeakPolarHBondContact O-CA 3.5Å; G376-T387 CarbonylContact C-O 3.35Å; G376-T387 WeakPolarHBondContact CA-O 3.39Å; G376-T387 PolarHBondContact N-O 3.27Å; G376-T387 PolarHBondContact O-N 2.81Å
377	C	71.6	Confident	64.1	Low	22 Å²	22	68 Å²	68	15%	0.149	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	127.3	177.2	-176.6	0	0	0	0	107.4	C366 N370 C373 F385	C366-C377 WeakPolarHBondContact CA-SG 3.09Å; C366-C377 HydrophobicContact CB-CB 3.64Å; C366-C377 WeakPolarHBondContact CB-SG 3.38Å; C366-C377 WeakPolarHBondContact SG-CB 3.27Å; C366-C377 CovalentContact SG-SG 2.04Å; C366-C377 PolarHBondContact SG-SG 3.18Å; N370-C377 WeakPolarHBondContact OD1-CB 3.48Å; C373-C377 HydrophobicContact CB-CB 3.99Å; C377-F385 WeakPolarHBondContact CA-O 3.48Å
378	E	68.8	Low	64.2	Low	103 Å²	103	65.2 Å²	65.2	48%	0.481	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.6	174.5	-73.5	-174.5	-160	0	0	109.6	Y384 F385 T387	E378-Y384 WeakPolarHBondContact O-CA 3.48Å; E378-F385 HydrophobicContact CB-CD1 4.36Å; E378-F385 HydrophobicContact CB-CE1 3.8Å; E378-F385 HydrophobicContact CB-CE2 4.1Å; E378-F385 HydrophobicContact CB-CZ 3.65Å; E378-F385 HydrophobicContact CG-CZ 4.43Å; E378-F385 PolarHBondContact N-O 2.84Å; E378-F385 PolarHBondContact O-N 3.21Å; E378-F385 WeakPolarHBondContact OE2-CZ 3.44Å; E378-T387 HydrophobicContact CB-CG2 4.31Å; E378-T387 HydrophobicContact CG-CG2 3.91Å
379	N	55.9	Low	64.7	Low	45 Å²	45	61.1 Å²	61.1	24%	0.241	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.8	-176.8	-167.8	79.9	0	0	0	109.8	D362 N364 E365	D362-N379 PolarHBondContact OD2-ND2 2.9Å; N364-N379 VanDerWaalsContact CA-OD1 3.24Å; N364-N379 WeakPolarHBondContact CA-OD1 3.48Å; E365-N379 PolarHBondContact N-OD1 3.21Å; E365-N379 VanDerWaalsContact N-OD1 3.09Å
380	I	53.2	Low	65.2	Low	76 Å²	76	59.7 Å²	59.7	39%	0.39	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	155.8	177.6	58.2	171.9	0	0	0	109.3	G382 S383 F385	I380-G382 PolarHBondContact O-N 2.94Å; I380-S383 CarbonylContact C-O 3.59Å; I380-S383 WeakPolarHBondContact CG1-O 3.42Å; I380-S383 PolarHBondContact N-O 2.77Å; I380-S383 CarbonylContact O-C 3.51Å; I380-S383 PolarHBondContact O-N 2.75Å; I380-F385 HydrophobicContact CD1-CD1 4.5Å; I380-F385 HydrophobicContact CG2-CD1 4.16Å; I380-F385 HydrophobicContact CG2-CE1 3.75Å
381	P	48.3	Very low	65.1	Low	117 Å²	117	59.3 Å²	59.3	76%	0.76	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	110.4	-177.6	-29	37.1	0	0	0	112.9	F351 D362	F351-P381 HydrophobicContact CZ-CB 4.18Å; D362-P381 WeakPolarHBondContact OD1-CA 3.46Å
382	G	53.5	Low	65	Low	25 Å²	25	59.5 Å²	59.5	26%	0.258	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	11.7	-178.6	0	0	0	0	0	117.2	D362 I380	D362-G382 PolarHBondContact OD1-N 3.12Å; I380-G382 PolarHBondContact O-N 2.94Å
383	S	61.7	Low	65.1	Low	56 Å²	56	58.7 Å²	58.7	39%	0.392	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	-179.3	176.9	-165	0	0	0	0	112.8	E365 I380	E365-S383 VanDerWaalsContact OE2-CA 3.32Å; E365-S383 WeakPolarHBondContact OE2-CA 3.24Å; I380-S383 CarbonylContact C-O 3.59Å; I380-S383 WeakPolarHBondContact CG1-O 3.42Å; I380-S383 PolarHBondContact N-O 2.77Å; I380-S383 CarbonylContact O-C 3.51Å; I380-S383 PolarHBondContact O-N 2.75Å
384	Y	73.3	Confident	64.8	Low	48 Å²	48	61.5 Å²	61.5	19%	0.188	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	164.9	172.2	69.9	-77	0	0	0	111.3	E365 H371 E378 R399	E365-Y384 HydrophobicContact CB-CD1 3.39Å; E365-Y384 HydrophobicContact CB-CE1 4.13Å; E365-Y384 HydrophobicContact CB-CG 3.85Å; E365-Y384 HydrophobicContact CG-CD1 3.66Å; E365-Y384 HydrophobicContact CG-CE1 4.18Å; H371-Y384 HydrophobicContact CB-CD1 4.34Å; H371-Y384 HydrophobicContact CB-CD2 4.03Å; H371-Y384 HydrophobicContact CB-CE1 4.07Å; H371-Y384 HydrophobicContact CB-CE2 3.75Å; H371-Y384 HydrophobicContact CB-CG 4.35Å; H371-Y384 AromaticContact CD2-CE1 3.45Å; H371-Y384 VanDerWaalsContact CD2-CE1 3.45Å; H371-Y384 WeakPolarHBondContact CD2-CE1 3.3Å; H371-Y384 AromaticContact CD2-CZ 3.24Å; H371-Y384 PolarHBondContact CD2-OH 2.91Å; H371-Y384 AromaticContact CG-CE1 3.58Å; H371-Y384 AromaticContact CG-CZ 3.58Å; H371-Y384 AromaticContact ND1-CE1 4Å; H371-Y384 AromaticContact NE2-CE1 3.78Å; H371-Y384 AromaticContact NE2-CZ 3.97Å; E378-Y384 WeakPolarHBondContact O-CA 3.48Å; Y384-R399 PolarHBondContact OH-NH2 3.05Å
385	F	65.1	Low	64.1	Low	93 Å²	93	61 Å²	61	41%	0.408	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.6	166	64.8	-82.3	0	0	0	111.3	C377 E378 I380 T387	C377-F385 WeakPolarHBondContact CA-O 3.48Å; E378-F385 HydrophobicContact CB-CD1 4.36Å; E378-F385 HydrophobicContact CB-CE1 3.8Å; E378-F385 HydrophobicContact CB-CE2 4.1Å; E378-F385 HydrophobicContact CB-CZ 3.65Å; E378-F385 HydrophobicContact CG-CZ 4.43Å; E378-F385 PolarHBondContact N-O 2.84Å; E378-F385 PolarHBondContact O-N 3.21Å; E378-F385 WeakPolarHBondContact OE2-CZ 3.44Å; I380-F385 HydrophobicContact CD1-CD1 4.5Å; I380-F385 HydrophobicContact CG2-CD1 4.16Å; I380-F385 HydrophobicContact CG2-CE1 3.75Å; F385-T387 HydrophobicContact CD2-CG2 3.74Å; F385-T387 HydrophobicContact CE2-CG2 3.36Å; F385-T387 HydrophobicContact CZ-CG2 4.31Å
386	C	69.8	Low	63.4	Low	11 Å²	11	63.5 Å²	63.5	7%	0.074	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	138.9	178.1	-54.2	0	0	0	0	111	C373 G376 L394 G398	C373-C386 VanDerWaalsContact CA-SG 3.52Å; C373-C386 HydrophobicContact CB-CB 3.64Å; C373-C386 WeakPolarHBondContact CB-SG 3.49Å; C373-C386 WeakPolarHBondContact SG-CA 3.5Å; C373-C386 WeakPolarHBondContact SG-CB 3.34Å; C373-C386 CovalentContact SG-SG 2.02Å; C373-C386 PolarHBondContact SG-SG 3.31Å; G376-C386 WeakPolarHBondContact O-CA 3.5Å; C386-L394 HydrophobicContact CB-CD1 3.9Å; C386-L394 HydrophobicContact CB-CD2 4.39Å; C386-G398 WeakPolarHBondContact CB-O 3.35Å; C386-G398 PolarHBondContact SG-O 2.76Å
387	T	66.2	Low	63	Low	29 Å²	29	66.9 Å²	66.9	18%	0.178	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.8	176.5	55.1	0	0	0	0	110.5	G376 E378 F385 C401	G376-T387 CarbonylContact C-O 3.35Å; G376-T387 WeakPolarHBondContact CA-O 3.39Å; G376-T387 PolarHBondContact N-O 3.27Å; G376-T387 PolarHBondContact O-N 2.81Å; E378-T387 HydrophobicContact CB-CG2 4.31Å; E378-T387 HydrophobicContact CG-CG2 3.91Å; F385-T387 HydrophobicContact CD2-CG2 3.74Å; F385-T387 HydrophobicContact CE2-CG2 3.36Å; F385-T387 HydrophobicContact CZ-CG2 4.31Å; T387-C401 PolarHBondContact O-SG 3.15Å
388	C	68.8	Low	62.3	Low	18 Å²	18	67.5 Å²	67.5	12%	0.122	38%	0.382	C	S	.	.			trans	-118.8	138.3	178.2	-60.2	0	0	0	0	110.8	T393 L394 C401	C388-T393 VanDerWaalsContact SG-C 3.52Å; C388-L394 VanDerWaalsContact SG-CA 3.55Å; C388-L394 PolarHBondContact SG-N 3.43Å; C388-L394 VanDerWaalsContact SG-N 3.38Å; C388-C401 WeakPolarHBondContact CA-SG 3.43Å; C388-C401 HydrophobicContact CB-CB 3.87Å; C388-C401 WeakPolarHBondContact CB-SG 3.5Å; C388-C401 WeakPolarHBondContact SG-CB 3.35Å; C388-C401 CovalentContact SG-SG 2.04Å; C388-C401 PolarHBondContact SG-SG 3.39Å
389	P	65.1	Low	62.3	Low	62 Å²	62	67.7 Å²	67.7	40%	0.403	38%	0.379	S	S	.	.			trans	-66	156.5	175.6	27.5	-33.6	0	0	0	111.3	L375 G391 Y392	L375-P389 HydrophobicContact CB-CG 4.2Å; L375-P389 HydrophobicContact CD1-CG 3.83Å; P389-G391 PolarHBondContact O-N 3Å; P389-Y392 HydrophobicContact CG-CD2 3.86Å; P389-Y392 HydrophobicContact CG-CE2 4.5Å; P389-Y392 HydrophobicContact CG-CG 4.25Å; P389-Y392 WeakPolarHBondContact O-CB 3.11Å; P389-Y392 PolarHBondContact O-N 2.99Å
390	K	60.9	Low	63.1	Low	216 Å²	216	68.3 Å²	68.3	94%	0.939	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	126.4	179.5	-69.2	-175.5	177.9	-179.4	0	111.1
391	G	62.2	Low	64.1	Low	40 Å²	40	65.3 Å²	65.3	41%	0.412	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-2.2	-173.2	0	0	0	0	0	114.3	P389 I404	P389-G391 PolarHBondContact O-N 3Å; G391-I404 PolarHBondContact O-N 2.84Å
392	Y	68.8	Low	65.4	Low	82 Å²	82	62.6 Å²	62.6	32%	0.322	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	154.9	176.2	-65.7	-105.7	0	0	0	110.8	L375 P389 Q402 E403	L375-Y392 HydrophobicContact CD1-CD1 3.49Å; L375-Y392 VanDerWaalsContact CD1-CD1 3.49Å; L375-Y392 HydrophobicContact CD1-CD2 4.38Å; L375-Y392 HydrophobicContact CD1-CE1 3.9Å; L375-Y392 HydrophobicContact CD1-CG 3.81Å; P389-Y392 HydrophobicContact CG-CD2 3.86Å; P389-Y392 HydrophobicContact CG-CE2 4.5Å; P389-Y392 HydrophobicContact CG-CG 4.25Å; P389-Y392 WeakPolarHBondContact O-CB 3.11Å; P389-Y392 PolarHBondContact O-N 2.99Å; Y392-Q402 CarbonylContact C-O 3.59Å; Y392-Q402 VanDerWaalsContact CA-O 3.23Å; Y392-Q402 WeakPolarHBondContact CA-O 3.37Å; Y392-E403 HydrophobicContact CD1-CB 3.89Å; Y392-E403 HydrophobicContact CD1-CG 4.4Å; Y392-E403 HydrophobicContact CE1-CB 3.49Å; Y392-E403 VanDerWaalsContact CE1-CB 3.49Å; Y392-E403 HydrophobicContact CE1-CG 3.88Å; Y392-E403 HydrophobicContact CE2-CG 4.17Å; Y392-E403 PolarHBondContact OH-OE2 3.01Å
393	T	64.7	Low	66.2	Low	27 Å²	27	66.5 Å²	66.5	17%	0.166	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145.6	178.4	-167.2	0	0	0	0	111.4	C388 C401 Q402 I404 I418 V427	C388-T393 VanDerWaalsContact SG-C 3.52Å; T393-C401 CarbonylContact O-C 3.56Å; T393-C401 VanDerWaalsContact O-CA 3.25Å; T393-C401 WeakPolarHBondContact O-CA 3.42Å; T393-Q402 PolarHBondContact N-O 2.59Å; T393-Q402 PolarHBondContact O-N 3.23Å; T393-I404 HydrophobicContact CG2-CG1 4.3Å; T393-I418 HydrophobicContact CG2-CG2 3.82Å; T393-V427 HydrophobicContact CG2-CG1 3.92Å; T393-V427 HydrophobicContact CG2-CG2 4.36Å; T393-V427 WeakPolarHBondContact OG1-CG1 3.44Å
394	L	68.1	Low	66.5	Low	66 Å²	66	65.7 Å²	65.7	35%	0.346	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	127.2	178.7	-165.3	69.4	0	0	0	110.2	C386 C388	C386-L394 HydrophobicContact CB-CD1 3.9Å; C386-L394 HydrophobicContact CB-CD2 4.39Å; C388-L394 VanDerWaalsContact SG-CA 3.55Å; C388-L394 PolarHBondContact SG-N 3.43Å; C388-L394 VanDerWaalsContact SG-N 3.38Å
395	L	62.8	Low	66.2	Low	43 Å²	43	66.2 Å²	66.2	23%	0.225	36%	0.358	C	S	.	.			trans	-74.6	165	178.9	-69.3	-177.4	0	0	0	112	D397 G398 T400 Q402 I418	L395-D397 PolarHBondContact O-N 2.93Å; L395-G398 PolarHBondContact O-N 2.68Å; L395-T400 WeakPolarHBondContact CB-O 3.16Å; L395-T400 HydrophobicContact CD1-CG2 3.92Å; L395-T400 WeakPolarHBondContact CG-O 3.12Å; L395-T400 PolarHBondContact N-O 3.41Å; L395-Q402 HydrophobicContact CD1-CB 4.35Å; L395-Q402 HydrophobicContact CD2-CB 4.22Å; L395-Q402 HydrophobicContact CG-CB 4.28Å; L395-I418 HydrophobicContact CD2-CD1 3.9Å
396	P	55.7	Low	66.2	Low	142 Å²	142	67.8 Å²	67.8	92%	0.922	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-8.7	-179.1	-24.8	35.6	0	0	0	115.6	G398	P396-G398 PolarHBondContact O-N 2.67Å
397	D	58	Low	66.1	Low	83 Å²	83	69.3 Å²	69.3	44%	0.444	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.6	170.7	69.5	-5	0	0	0	113.2	L395 R399 T400	L395-D397 PolarHBondContact O-N 2.93Å; D397-R399 PolarHBondContact O-N 3.35Å; D397-R399 PolarHBondContact OD1-N 2.68Å; D397-T400 PolarHBondContact OD1-N 2.97Å; D397-T400 WeakPolarHBondContact OD2-CB 3.48Å; D397-T400 PolarHBondContact OD2-N 3.46Å; D397-T400 PolarHBondContact OD2-OG1 2.75Å
398	G	58.3	Low	65.5	Low	35 Å²	35	71.9 Å²	71.9	36%	0.361	42%	0.42	S	S	.	.	S	Bend	trans	68.2	14.9	-178.2	0	0	0	0	0	113.9	C386 L395 P396	C386-G398 WeakPolarHBondContact CB-O 3.35Å; C386-G398 PolarHBondContact SG-O 2.76Å; L395-G398 PolarHBondContact O-N 2.68Å; P396-G398 PolarHBondContact O-N 2.67Å
399	R	67.3	Low	65	Low	108 Å²	108	73.9 Å²	73.9	41%	0.408	44%	0.444	S	S	.	.	S	Bend	trans	-139.2	-36.7	-168.9	-68.6	-179.6	-176.5	-139.3	-6.6	114.4	S374 Y384 D397	S374-R399 WeakPolarHBondContact CB-O 3.47Å; S374-R399 PolarHBondContact N-O 3.31Å; S374-R399 PolarHBondContact OG-O 3.18Å; Y384-R399 PolarHBondContact OH-NH2 3.05Å; D397-R399 PolarHBondContact O-N 3.35Å; D397-R399 PolarHBondContact OD1-N 2.68Å
400	T	73.3	Confident	64.6	Low	57 Å²	57	79.5 Å²	79.5	35%	0.35	47%	0.468	S	S	.	.			trans	-96.8	129	-173.2	-55.9	0	0	0	0	111.4	S374 L395 D397	S374-T400 WeakPolarHBondContact OG-CA 3.38Å; L395-T400 WeakPolarHBondContact CB-O 3.16Å; L395-T400 HydrophobicContact CD1-CG2 3.92Å; L395-T400 WeakPolarHBondContact CG-O 3.12Å; L395-T400 PolarHBondContact N-O 3.41Å; D397-T400 PolarHBondContact OD1-N 2.97Å; D397-T400 WeakPolarHBondContact OD2-CB 3.48Å; D397-T400 PolarHBondContact OD2-N 3.46Å; D397-T400 PolarHBondContact OD2-OG1 2.75Å
401	C	75.3	Confident	64.5	Low	14 Å²	14	72.8 Å²	72.8	10%	0.095	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.4	179.2	-67.6	0	0	0	0	109.6	S374 L375 T387 C388 T393	S374-C401 WeakPolarHBondContact OG-CB 3.41Å; S374-C401 PolarHBondContact OG-N 3.41Å; L375-C401 HydrophobicContact CB-CB 4.08Å; L375-C401 HydrophobicContact CD1-CB 3.6Å; L375-C401 HydrophobicContact CG-CB 3.84Å; T387-C401 PolarHBondContact O-SG 3.15Å; C388-C401 WeakPolarHBondContact CA-SG 3.43Å; C388-C401 HydrophobicContact CB-CB 3.87Å; C388-C401 WeakPolarHBondContact CB-SG 3.5Å; C388-C401 WeakPolarHBondContact SG-CB 3.35Å; C388-C401 CovalentContact SG-SG 2.04Å; C388-C401 PolarHBondContact SG-SG 3.39Å; T393-C401 CarbonylContact O-C 3.56Å; T393-C401 VanDerWaalsContact O-CA 3.25Å; T393-C401 WeakPolarHBondContact O-CA 3.42Å
402	Q	74.3	Confident	64.6	Low	60 Å²	60	80 Å²	80	28%	0.28	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	140.6	177.9	-171	175	4.9	0	0	110.9	Y392 T393 L395 I418 A419	Y392-Q402 CarbonylContact C-O 3.59Å; Y392-Q402 VanDerWaalsContact CA-O 3.23Å; Y392-Q402 WeakPolarHBondContact CA-O 3.37Å; T393-Q402 PolarHBondContact N-O 2.59Å; T393-Q402 PolarHBondContact O-N 3.23Å; L395-Q402 HydrophobicContact CD1-CB 4.35Å; L395-Q402 HydrophobicContact CD2-CB 4.22Å; L395-Q402 HydrophobicContact CG-CB 4.28Å; Q402-I418 HydrophobicContact CB-CG2 4.28Å; Q402-I418 HydrophobicContact CG-CB 4.42Å; Q402-I418 HydrophobicContact CG-CG2 4.05Å; Q402-A419 PolarHBondContact NE2-O 2.67Å
403	E	70.5	Confident	64.6	Low	107 Å²	107	77.2 Å²	77.2	50%	0.5	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.9	179.8	-161.5	171	141.7	0	0	111.9	Y392 T405	Y392-E403 HydrophobicContact CD1-CB 3.89Å; Y392-E403 HydrophobicContact CD1-CG 4.4Å; Y392-E403 HydrophobicContact CE1-CB 3.49Å; Y392-E403 VanDerWaalsContact CE1-CB 3.49Å; Y392-E403 HydrophobicContact CE1-CG 3.88Å; Y392-E403 HydrophobicContact CE2-CG 4.17Å; Y392-E403 PolarHBondContact OH-OE2 3.01Å; E403-T405 PolarHBondContact O-N 2.76Å
404	I	67.6	Low	64.6	Low	38 Å²	38	78.8 Å²	78.8	20%	0.195	48%	0.475	C	S	.	.			trans	-84.8	106.9	179	-56	174.3	0	0	0	108.3	G391 T393	G391-I404 PolarHBondContact O-N 2.84Å; T393-I404 HydrophobicContact CG2-CG1 4.3Å
405	T	68.1	Low	64.7	Low	60 Å²	60	80.6 Å²	80.6	37%	0.368	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-88.7	148.1	-179.3	55.3	0	0	0	0	112.7	E403 C407 C417	E403-T405 PolarHBondContact O-N 2.76Å; T405-C407 PolarHBondContact O-N 2.9Å; T405-C417 PolarHBondContact N-O 3.39Å; T405-C417 PolarHBondContact O-N 2.85Å; T405-C417 PolarHBondContact OG1-O 2.8Å
406	P	63.6	Low	65.2	Low	125 Å²	125	78.8 Å²	78.8	81%	0.812	47%	0.473	S	S	*	.			trans	-66.6	127.9	169.7	-17.9	31.4	0	0	0	111.2	G408	P406-G408 PolarHBondContact O-N 3.01Å; P406-G408 VanDerWaalsContact O-N 3.08Å
407	C	67.9	Low	66.3	Low	43 Å²	43	72.2 Å²	72.2	29%	0.291	43%	0.431	S	S	.	.			trans	-74.2	103.8	-173.3	-48.9	0	0	0	0	112.2	T405 G409 C413 C417	T405-C407 PolarHBondContact O-N 2.9Å; C407-G409 PolarHBondContact O-N 3.44Å; C407-C413 PolarHBondContact SG-SG 2.79Å; C407-C417 WeakPolarHBondContact CA-SG 3.37Å; C407-C417 HydrophobicContact CB-CB 4.42Å; C407-C417 WeakPolarHBondContact CB-SG 3.39Å; C407-C417 WeakPolarHBondContact SG-CB 3.44Å; C407-C417 PolarHBondContact SG-N 3.23Å; C407-C417 VanDerWaalsContact SG-N 3.39Å; C407-C417 CovalentContact SG-SG 2.04Å; C407-C417 PolarHBondContact SG-SG 3.36Å
408	G	54.1	Low	67.3	Low	84 Å²	84	69 Å²	69	87%	0.866	41%	0.414	S	S	*	.			trans	-83	97	178.6	0	0	0	0	0	113.5	P406	P406-G408 PolarHBondContact O-N 3.01Å; P406-G408 VanDerWaalsContact O-N 3.08Å
409	G	58.7	Low	67.7	Low	60 Å²	60	70.7 Å²	70.7	62%	0.619	42%	0.424	S	S	*	.	S	Bend	trans	96.5	131.8	163.7	0	0	0	0	0	116.1	C407 M411	C407-G409 PolarHBondContact O-N 3.44Å; G409-M411 PolarHBondContact O-N 3.06Å
410	I	57	Low	67.7	Low	179 Å²	179	68.2 Å²	68.2	92%	0.918	42%	0.421	S	S	*	.	S	Bend	trans	58.9	-52.4	179.3	-55.7	-178.1	0	0	0	115.8	K412	I410-K412 PolarHBondContact O-N 2.94Å
411	M	57.9	Low	67.1	Low	76 Å²	76	74.8 Å²	74.8	37%	0.374	45%	0.448	S	S	.	.			trans	-78	119.5	179.3	-67.3	-179.2	83.2	0	0	111.5	G409 A424	G409-M411 PolarHBondContact O-N 3.06Å; M411-A424 WeakPolarHBondContact CE-O 3.39Å
412	K	64.8	Low	66.3	Low	190 Å²	190	83 Å²	83	83%	0.826	48%	0.484	S	S	*	.			trans	-102.8	84.9	174.3	-69	-173.7	177.7	-175.5	0	110.3	I410	I410-K412 PolarHBondContact O-N 2.94Å
413	C	69.3	Low	65.9	Low	25 Å²	25	81.9 Å²	81.9	17%	0.169	49%	0.489	C	S	.	.			trans	-70.1	144.8	171.4	-58.2	0	0	0	0	111.2	C407 H415 G416 C426	C407-C413 PolarHBondContact SG-SG 2.79Å; C413-H415 VanDerWaalsContact C-N 3.27Å; C413-H415 PolarHBondContact O-N 2.77Å; C413-G416 WeakPolarHBondContact CB-O 3.19Å; C413-C426 WeakPolarHBondContact CA-SG 3.05Å; C413-C426 HydrophobicContact CB-CB 3.62Å; C413-C426 WeakPolarHBondContact CB-SG 3.41Å; C413-C426 WeakPolarHBondContact SG-CA 3.37Å; C413-C426 WeakPolarHBondContact SG-CB 3.47Å; C413-C426 CovalentContact SG-SG 2.03Å; C413-C426 PolarHBondContact SG-SG 2.77Å
414	G	63.9	Low	66	Low	60 Å²	60	79 Å²	79	62%	0.619	48%	0.483	S	S	*	.	S	Bend	trans	-72.8	-10.8	-179.7	0	0	0	0	0	115.7	H439	G414-H439 PolarHBondContact N-O 2.63Å
415	H	70.4	Confident	66.3	Low	103 Å²	103	80.4 Å²	80.4	48%	0.477	49%	0.494	S	S	.	.	S	Bend	trans	-142.5	-61.5	178.6	177.4	68.3	0	0	0	112.1	C413 V427	C413-H415 VanDerWaalsContact C-N 3.27Å; C413-H415 PolarHBondContact O-N 2.77Å; H415-V427 WeakPolarHBondContact CB-O 3.3Å
416	G	73.8	Confident	66.8	Low	5 Å²	5	77.9 Å²	77.9	5%	0.052	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	-172.5	174.3	0	0	0	0	0	112.3	C413 C426 V427	C413-G416 WeakPolarHBondContact CB-O 3.19Å; G416-C426 WeakPolarHBondContact O-CA 3.5Å; G416-V427 PolarHBondContact O-N 3.41Å
417	C	78.7	Confident	67.4	Low	4 Å²	4	72.7 Å²	72.7	3%	0.027	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.8	176.8	48.7	0	0	0	0	113.7	T405 C407 A424 V425	T405-C417 PolarHBondContact N-O 3.39Å; T405-C417 PolarHBondContact O-N 2.85Å; T405-C417 PolarHBondContact OG1-O 2.8Å; C407-C417 WeakPolarHBondContact CA-SG 3.37Å; C407-C417 HydrophobicContact CB-CB 4.42Å; C407-C417 WeakPolarHBondContact CB-SG 3.39Å; C407-C417 WeakPolarHBondContact SG-CB 3.44Å; C407-C417 PolarHBondContact SG-N 3.23Å; C407-C417 VanDerWaalsContact SG-N 3.39Å; C407-C417 CovalentContact SG-SG 2.04Å; C407-C417 PolarHBondContact SG-SG 3.36Å; C417-A424 HydrophobicContact CB-CB 4.49Å; C417-V425 CarbonylContact C-O 3.59Å; C417-V425 WeakPolarHBondContact CA-O 3.43Å; C417-V425 WeakPolarHBondContact CB-O 3.42Å
418	I	77.8	Confident	67.7	Low	17 Å²	17	71.6 Å²	71.6	9%	0.087	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	144.5	170.4	56.7	176.9	0	0	0	110	T393 L395 Q402 T420 A424 V425 V427	T393-I418 HydrophobicContact CG2-CG2 3.82Å; L395-I418 HydrophobicContact CD2-CD1 3.9Å; Q402-I418 HydrophobicContact CB-CG2 4.28Å; Q402-I418 HydrophobicContact CG-CB 4.42Å; Q402-I418 HydrophobicContact CG-CG2 4.05Å; I418-T420 HydrophobicContact CD1-CG2 4.32Å; I418-T420 HydrophobicContact CG1-CG2 4.19Å; I418-A424 WeakPolarHBondContact O-CA 3.3Å; I418-V425 HydrophobicContact CG1-CB 4.44Å; I418-V425 PolarHBondContact N-O 2.04Å; I418-V425 PolarHBondContact O-N 2.83Å; I418-V427 HydrophobicContact CB-CG2 4.34Å; I418-V427 HydrophobicContact CD1-CG2 4.05Å; I418-V427 HydrophobicContact CG1-CG2 3.74Å; I418-V427 HydrophobicContact CG2-CG2 3.97Å
419	A	68.5	Low	68.3	Low	69 Å²	69	68.8 Å²	68.8	57%	0.57	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	124.5	171.2	0	0	0	0	0	109.7	Q402	Q402-A419 PolarHBondContact NE2-O 2.67Å
420	T	66.1	Low	68.5	Low	56 Å²	56	73.1 Å²	73.1	34%	0.344	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	163.1	172.8	79	0	0	0	0	109.8	I418 H422 G423 V425	I418-T420 HydrophobicContact CD1-CG2 4.32Å; I418-T420 HydrophobicContact CG1-CG2 4.19Å; T420-H422 PolarHBondContact O-N 2.8Å; T420-H422 PolarHBondContact OG1-N 2.76Å; T420-G423 WeakPolarHBondContact CB-O 3.38Å; T420-G423 PolarHBondContact N-O 3.04Å; T420-G423 PolarHBondContact O-N 2.68Å; T420-G423 PolarHBondContact OG1-O 2.95Å; T420-V425 HydrophobicContact CG2-CB 4.32Å; T420-V425 HydrophobicContact CG2-CG2 3.84Å
421	E	60.7	Low	68.6	Low	196 Å²	196	65 Å²	65	92%	0.916	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.5	178.1	-61.5	-173.3	149.4	0	0	113.6
422	H	59.6	Low	69.3	Low	186 Å²	186	62 Å²	62	86%	0.861	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	4.4	179.2	-63.8	81.9	0	0	0	113.4	T420	T420-H422 PolarHBondContact O-N 2.8Å; T420-H422 PolarHBondContact OG1-N 2.76Å
423	G	65.6	Low	69.8	Low	37 Å²	37	55.4 Å²	55.4	38%	0.381	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.1	-179.6	-178	0	0	0	0	0	113.6	T420	T420-G423 WeakPolarHBondContact CB-O 3.38Å; T420-G423 PolarHBondContact N-O 3.04Å; T420-G423 PolarHBondContact O-N 2.68Å; T420-G423 PolarHBondContact OG1-O 2.95Å
424	A	71.1	Confident	70	Confident	46 Å²	46	57.3 Å²	57.3	38%	0.38	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126.9	175.6	0	0	0	0	0	110.7	M411 C417 I418	M411-A424 WeakPolarHBondContact CE-O 3.39Å; C417-A424 HydrophobicContact CB-CB 4.49Å; I418-A424 WeakPolarHBondContact O-CA 3.3Å
425	V	74.8	Confident	70.4	Confident	68 Å²	68	58.5 Å²	58.5	41%	0.412	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.9	179.4	-179.5	0	0	0	0	109.3	C417 I418 T420	C417-V425 CarbonylContact C-O 3.59Å; C417-V425 WeakPolarHBondContact CA-O 3.43Å; C417-V425 WeakPolarHBondContact CB-O 3.42Å; I418-V425 HydrophobicContact CG1-CB 4.44Å; I418-V425 PolarHBondContact N-O 2.04Å; I418-V425 PolarHBondContact O-N 2.83Å; T420-V425 HydrophobicContact CG2-CB 4.32Å; T420-V425 HydrophobicContact CG2-CG2 3.84Å
426	C	78.6	Confident	70.6	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.041	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	141.4	177.6	-60.8	0	0	0	0	111.5	C413 G416 L434 G438 H439	C413-C426 WeakPolarHBondContact CA-SG 3.05Å; C413-C426 HydrophobicContact CB-CB 3.62Å; C413-C426 WeakPolarHBondContact CB-SG 3.41Å; C413-C426 WeakPolarHBondContact SG-CA 3.37Å; C413-C426 WeakPolarHBondContact SG-CB 3.47Å; C413-C426 CovalentContact SG-SG 2.03Å; C413-C426 PolarHBondContact SG-SG 2.77Å; G416-C426 WeakPolarHBondContact O-CA 3.5Å; C426-L434 HydrophobicContact CB-CD1 3.83Å; C426-L434 HydrophobicContact CB-CD2 4.47Å; C426-G438 WeakPolarHBondContact CB-O 3.44Å; C426-G438 PolarHBondContact SG-O 2.86Å; C426-H439 PolarHBondContact SG-ND1 3.34Å; C426-H439 VanDerWaalsContact SG-ND1 3.44Å
427	V	75.8	Confident	70.4	Confident	17 Å²	17	67 Å²	67	10%	0.103	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.4	-178.1	-179.3	0	0	0	0	109.7	T393 H415 G416 I418	T393-V427 HydrophobicContact CG2-CG1 3.92Å; T393-V427 HydrophobicContact CG2-CG2 4.36Å; T393-V427 WeakPolarHBondContact OG1-CG1 3.44Å; H415-V427 WeakPolarHBondContact CB-O 3.3Å; G416-V427 PolarHBondContact O-N 3.41Å; I418-V427 HydrophobicContact CB-CG2 4.34Å; I418-V427 HydrophobicContact CD1-CG2 4.05Å; I418-V427 HydrophobicContact CG1-CG2 3.74Å; I418-V427 HydrophobicContact CG2-CG2 3.97Å
428	C	73.8	Confident	69.9	Low	19 Å²	19	68.2 Å²	68.2	13%	0.128	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-103.6	153.8	-179.6	-65.3	0	0	0	0	112.4	S432 V433 L434 C441	C428-S432 WeakPolarHBondContact CB-O 3.45Å; C428-V433 VanDerWaalsContact SG-C 3.56Å; C428-L434 WeakPolarHBondContact SG-CA 3.09Å; C428-L434 PolarHBondContact SG-N 3.39Å; C428-L434 VanDerWaalsContact SG-N 3.42Å; C428-C441 WeakPolarHBondContact CA-SG 3.49Å; C428-C441 HydrophobicContact CB-CB 3.76Å; C428-C441 WeakPolarHBondContact CB-SG 3.4Å; C428-C441 VanDerWaalsContact SG-CA 3.54Å; C428-C441 WeakPolarHBondContact SG-CB 3.46Å; C428-C441 CovalentContact SG-SG 2.03Å; C428-C441 PolarHBondContact SG-SG 3.3Å
429	P	67.6	Low	69.7	Low	25 Å²	25	70.7 Å²	70.7	16%	0.162	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-68.2	157.6	175.9	30	-34.9	0	0	0	111	G431 S432	P429-G431 PolarHBondContact O-N 2.82Å; P429-S432 WeakPolarHBondContact O-CB 3.01Å; P429-S432 PolarHBondContact O-N 2.86Å
430	E	63.1	Low	69.9	Low	151 Å²	151	70 Å²	70	71%	0.706	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	135.4	176.8	-63.7	-177.4	154.2	0	0	111.7	S445	E430-S445 WeakPolarHBondContact O-CB 2.96Å; E430-S445 PolarHBondContact O-OG 3.18Å
431	G	60	Low	70.4	Confident	10 Å²	10	68.2 Å²	68.2	10%	0.103	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	14.1	-173	0	0	0	0	0	114.7	P429 G443 C444 P461	P429-G431 PolarHBondContact O-N 2.82Å; G431-G443 CarbonylContact O-C 3.54Å; G431-G443 VanDerWaalsContact O-CA 3.3Å; G431-G443 WeakPolarHBondContact O-CA 3.36Å; G431-C444 PolarHBondContact O-N 2.89Å; G431-P461 CarbonylContact C-O 3.55Å; G431-P461 VanDerWaalsContact C-O 3.22Å; G431-P461 WeakPolarHBondContact CA-O 3.38Å
432	S	70.8	Confident	71.2	Confident	12 Å²	12	60 Å²	60	8%	0.084	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.9	176.3	-48.6	0	0	0	0	113	C428 P429 T442 S446 P461	C428-S432 WeakPolarHBondContact CB-O 3.45Å; P429-S432 WeakPolarHBondContact O-CB 3.01Å; P429-S432 PolarHBondContact O-N 2.86Å; S432-T442 CarbonylContact C-O 3.55Å; S432-T442 WeakPolarHBondContact CA-O 3.05Å; S432-S446 PolarHBondContact OG-N 2.73Å; S432-P461 PolarHBondContact N-O 2.93Å
433	V	75.1	Confident	72	Confident	52 Å²	52	51.1 Å²	51.1	32%	0.315	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.2	178.5	-66	0	0	0	0	111.5	C428 C441 T442 W464	C428-V433 VanDerWaalsContact SG-C 3.56Å; V433-C441 CarbonylContact O-C 3.6Å; V433-C441 WeakPolarHBondContact O-CA 3.15Å; V433-T442 HydrophobicContact CG2-CG2 3.96Å; V433-T442 WeakPolarHBondContact CG2-O 3.23Å; V433-T442 PolarHBondContact N-O 2.82Å; V433-T442 PolarHBondContact O-N 2.91Å; V433-W464 HydrophobicContact CG2-CH2 3.95Å; V433-W464 HydrophobicContact CG2-CZ3 4.21Å
434	L	75.2	Confident	72.6	Confident	64 Å²	64	50.5 Å²	50.5	34%	0.335	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	135.3	174.1	-163.8	71.9	0	0	0	109.6	C426 C428 T440	C426-L434 HydrophobicContact CB-CD1 3.83Å; C426-L434 HydrophobicContact CB-CD2 4.47Å; C428-L434 WeakPolarHBondContact SG-CA 3.09Å; C428-L434 PolarHBondContact SG-N 3.39Å; C428-L434 VanDerWaalsContact SG-N 3.42Å; L434-T440 WeakPolarHBondContact CA-O 3.49Å
435	Q	71.2	Confident	72.7	Confident	85 Å²	85	51.7 Å²	51.7	40%	0.397	29%	0.289	S	S	.	.			trans	-77.5	168.8	176.4	-62.6	-169.3	33.1	0	0	111.5	D437 G438 T440 T442	Q435-D437 PolarHBondContact O-N 2.73Å; Q435-G438 PolarHBondContact O-N 2.73Å; Q435-T440 VanDerWaalsContact CD-OG1 3.25Å; Q435-T440 PolarHBondContact N-O 3.28Å; Q435-T442 HydrophobicContact CG-CG2 3.84Å
436	E	73.9	Confident	72.7	Confident	212 Å²	212	49 Å²	49	99%	0.991	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.9	178.6	-62.6	-178.4	171.1	0	0	114	G438	E436-G438 PolarHBondContact O-N 3.42Å
437	D	69.6	Low	72.1	Confident	75 Å²	75	52 Å²	52	40%	0.401	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.8	174.8	70.6	1.8	0	0	0	113.9	Q435 H439 T440	Q435-D437 PolarHBondContact O-N 2.73Å; D437-H439 PolarHBondContact O-CD2 3.39Å; D437-H439 PolarHBondContact O-N 3.3Å; D437-H439 PolarHBondContact OD1-N 2.82Å; D437-T440 VanDerWaalsContact CG-OG1 3.28Å; D437-T440 PolarHBondContact OD1-N 2.83Å; D437-T440 PolarHBondContact OD1-OG1 2.83Å; D437-T440 WeakPolarHBondContact OD2-CB 3.34Å; D437-T440 VanDerWaalsContact OD2-CG2 3.22Å; D437-T440 WeakPolarHBondContact OD2-CG2 3.37Å; D437-T440 PolarHBondContact OD2-OG1 3.29Å
438	G	69.7	Low	72	Confident	30 Å²	30	52.9 Å²	52.9	31%	0.309	30%	0.302	S	S	.	.	S	Bend	trans	67.8	11.8	-178.2	0	0	0	0	0	114.5	C426 Q435 E436	C426-G438 WeakPolarHBondContact CB-O 3.44Å; C426-G438 PolarHBondContact SG-O 2.86Å; Q435-G438 PolarHBondContact O-N 2.73Å; E436-G438 PolarHBondContact O-N 3.42Å
439	H	73.2	Confident	72.1	Confident	69 Å²	69	55.6 Å²	55.6	32%	0.319	31%	0.31	S	S	.	.	S	Bend	trans	-135.5	-37.6	-168.9	-69.3	-49.6	0	0	0	114.5	G414 C426 D437	G414-H439 PolarHBondContact N-O 2.63Å; C426-H439 PolarHBondContact SG-ND1 3.34Å; C426-H439 VanDerWaalsContact SG-ND1 3.44Å; D437-H439 PolarHBondContact O-CD2 3.39Å; D437-H439 PolarHBondContact O-N 3.3Å; D437-H439 PolarHBondContact OD1-N 2.82Å
440	T	73.6	Confident	72.5	Confident	55 Å²	55	54.4 Å²	54.4	34%	0.337	30%	0.302	S	S	.	.			trans	-101.6	152.2	-176.9	61.4	0	0	0	0	112.3	L434 Q435 D437	L434-T440 WeakPolarHBondContact CA-O 3.49Å; Q435-T440 VanDerWaalsContact CD-OG1 3.25Å; Q435-T440 PolarHBondContact N-O 3.28Å; D437-T440 VanDerWaalsContact CG-OG1 3.28Å; D437-T440 PolarHBondContact OD1-N 2.83Å; D437-T440 PolarHBondContact OD1-OG1 2.83Å; D437-T440 WeakPolarHBondContact OD2-CB 3.34Å; D437-T440 VanDerWaalsContact OD2-CG2 3.22Å; D437-T440 WeakPolarHBondContact OD2-CG2 3.37Å; D437-T440 PolarHBondContact OD2-OG1 3.29Å
441	C	75.9	Confident	73.3	Confident	17 Å²	17	48.7 Å²	48.7	12%	0.115	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.8	-178.5	-61.6	0	0	0	0	110.7	C428 V433 S446	C428-C441 WeakPolarHBondContact CA-SG 3.49Å; C428-C441 HydrophobicContact CB-CB 3.76Å; C428-C441 WeakPolarHBondContact CB-SG 3.4Å; C428-C441 VanDerWaalsContact SG-CA 3.54Å; C428-C441 WeakPolarHBondContact SG-CB 3.46Å; C428-C441 CovalentContact SG-SG 2.03Å; C428-C441 PolarHBondContact SG-SG 3.3Å; V433-C441 CarbonylContact O-C 3.6Å; V433-C441 WeakPolarHBondContact O-CA 3.15Å; C441-S446 WeakPolarHBondContact O-CB 3.48Å; C441-S446 PolarHBondContact O-OG 3.45Å
442	T	78.1	Confident	74.6	Confident	24 Å²	24	48.2 Å²	48.2	15%	0.147	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.6	172.4	-171.8	0	0	0	0	111.1	S432 V433 Q435 S446 D448 W464	S432-T442 CarbonylContact C-O 3.55Å; S432-T442 WeakPolarHBondContact CA-O 3.05Å; V433-T442 HydrophobicContact CG2-CG2 3.96Å; V433-T442 WeakPolarHBondContact CG2-O 3.23Å; V433-T442 PolarHBondContact N-O 2.82Å; V433-T442 PolarHBondContact O-N 2.91Å; Q435-T442 HydrophobicContact CG-CG2 3.84Å; T442-S446 VanDerWaalsContact C-OG 3.28Å; T442-S446 WeakPolarHBondContact CA-OG 2.84Å; T442-D448 WeakPolarHBondContact CB-OD2 2.96Å; T442-D448 PolarHBondContact OG1-OD2 3.15Å; T442-W464 HydrophobicContact CG2-CH2 4.04Å; T442-W464 HydrophobicContact CG2-CZ2 4.3Å; T442-W464 WeakPolarHBondContact O-CH2 3.16Å
443	G	76.5	Confident	75.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.9	175.6	-170.9	0	0	0	0	0	112	G431 S445 S446 R449 G450	G431-G443 CarbonylContact O-C 3.54Å; G431-G443 VanDerWaalsContact O-CA 3.3Å; G431-G443 WeakPolarHBondContact O-CA 3.36Å; G443-S445 PolarHBondContact O-N 3.45Å; G443-S446 PolarHBondContact N-OG 3.21Å; G443-S446 PolarHBondContact O-N 3.35Å; G443-S446 PolarHBondContact O-OG 3.24Å; G443-R449 CarbonylContact O-C 3.55Å; G443-R449 VanDerWaalsContact O-CA 3.26Å; G443-R449 WeakPolarHBondContact O-CA 3.01Å; G443-G450 PolarHBondContact O-N 2.78Å
444	C	78	Confident	75.8	Confident	23 Å²	23	45.7 Å²	45.7	16%	0.155	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.2	-176.7	-64.3	0	0	0	0	113.3	G431 C456 S458 W464	G431-C444 PolarHBondContact O-N 2.89Å; C444-C456 WeakPolarHBondContact CA-SG 3.45Å; C444-C456 HydrophobicContact CB-CB 3.8Å; C444-C456 WeakPolarHBondContact CB-SG 3.36Å; C444-C456 WeakPolarHBondContact SG-CB 3.19Å; C444-C456 CovalentContact SG-SG 2.05Å; C444-C456 PolarHBondContact SG-SG 2.74Å; C444-S458 PolarHBondContact SG-N 3.43Å; C444-W464 WeakPolarHBondContact SG-CB 3.34Å
445	S	72.3	Confident	76.2	Confident	72 Å²	72	46.5 Å²	46.5	50%	0.503	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.7	-178.9	-47.7	0	0	0	0	114.1	E430 G443	E430-S445 WeakPolarHBondContact O-CB 2.96Å; E430-S445 PolarHBondContact O-OG 3.18Å; G443-S445 PolarHBondContact O-N 3.45Å
446	S	73.9	Confident	76.8	Confident	12 Å²	12	43.9 Å²	43.9	8%	0.084	26%	0.257	C	S	.	.	S	Bend	trans	-92.2	165.1	177.4	56.9	0	0	0	0	112.6	S432 C441 T442 G443 D448 R449	S432-S446 PolarHBondContact OG-N 2.73Å; C441-S446 WeakPolarHBondContact O-CB 3.48Å; C441-S446 PolarHBondContact O-OG 3.45Å; T442-S446 VanDerWaalsContact C-OG 3.28Å; T442-S446 WeakPolarHBondContact CA-OG 2.84Å; G443-S446 PolarHBondContact N-OG 3.21Å; G443-S446 PolarHBondContact O-N 3.35Å; G443-S446 PolarHBondContact O-OG 3.24Å; S446-D448 WeakPolarHBondContact CB-OD1 2.93Å; S446-D448 PolarHBondContact O-N 2.01Å; S446-D448 PolarHBondContact OG-OD1 3.39Å; S446-R449 PolarHBondContact O-N 2.67Å
447	A	67.6	Low	77	Confident	68 Å²	68	36.7 Å²	36.7	56%	0.562	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20	-172.8	0	0	0	0	0	115.1	R682	A447-R682 PolarHBondContact O-NH1 2.93Å
448	D	72	Confident	76.7	Confident	35 Å²	35	36.9 Å²	36.9	19%	0.187	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-6.1	176.2	72.5	-33.9	0	0	0	114.2	T442 S446 G450 G451	T442-D448 WeakPolarHBondContact CB-OD2 2.96Å; T442-D448 PolarHBondContact OG1-OD2 3.15Å; S446-D448 WeakPolarHBondContact CB-OD1 2.93Å; S446-D448 PolarHBondContact O-N 2.01Å; S446-D448 PolarHBondContact OG-OD1 3.39Å; D448-G450 PolarHBondContact O-N 2.91Å; D448-G450 PolarHBondContact OD1-N 2.73Å; D448-G451 WeakPolarHBondContact O-CA 3.26Å; D448-G451 PolarHBondContact O-N 2.74Å; D448-G451 PolarHBondContact OD2-N 2.73Å
449	R	77	Confident	76.2	Confident	77 Å²	77	39.5 Å²	39.5	29%	0.291	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	45	45.6	-169.6	-65.5	-166.7	-174.5	152.4	11	113	G443 S446 G451 C452 C456 D658	G443-R449 CarbonylContact O-C 3.55Å; G443-R449 VanDerWaalsContact O-CA 3.26Å; G443-R449 WeakPolarHBondContact O-CA 3.01Å; S446-R449 PolarHBondContact O-N 2.67Å; R449-G451 PolarHBondContact O-N 3.44Å; R449-C452 WeakPolarHBondContact O-CB 2.94Å; R449-C452 PolarHBondContact O-N 3.35Å; R449-C456 HydrophobicContact CB-CB 4.33Å; R449-C456 PolarHBondContact O-SG 2.94Å; R449-D658 IonicContact CZ-OD1 3.89Å; R449-D658 IonicContact CZ-OD2 2.7Å; R449-D658 IonicContact NH1-OD1 3.36Å; R449-D658 PolarHBondContact NH1-OD1 3.33Å; R449-D658 IonicContact NH1-OD2 3.29Å; R449-D658 IonicContact NH2-OD1 3.64Å; R449-D658 PolarHBondContact NH2-OD1 2.64Å; R449-D658 IonicContact NH2-OD2 3.34Å; R449-D658 PolarHBondContact NH2-OD2 3.34Å
450	G	76	Confident	75.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	67.8	13	177	0	0	0	0	0	114	G443 D448 W464 K479	G443-G450 PolarHBondContact O-N 2.78Å; D448-G450 PolarHBondContact O-N 2.91Å; D448-G450 PolarHBondContact OD1-N 2.73Å; G450-W464 PolarHBondContact O-NE1 2.98Å; G450-K479 PolarHBondContact O-NZ 3.24Å
451	G	79.6	Confident	74.2	Confident	30 Å²	30	41.3 Å²	41.3	31%	0.309	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	80.7	8.4	-171.4	0	0	0	0	0	115.2	D448 R449	D448-G451 WeakPolarHBondContact O-CA 3.26Å; D448-G451 PolarHBondContact O-N 2.74Å; D448-G451 PolarHBondContact OD2-N 2.73Å; R449-G451 PolarHBondContact O-N 3.44Å
452	C	87.3	Confident	73.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	28%	0.281	C	S	.	.			trans	-82.4	118.7	-177.4	-60.6	0	0	0	0	112.5	R449 Q454 L455 C456 C466 R718	R449-C452 WeakPolarHBondContact O-CB 2.94Å; R449-C452 PolarHBondContact O-N 3.35Å; C452-Q454 VanDerWaalsContact C-N 3.27Å; C452-Q454 PolarHBondContact O-N 3.05Å; C452-Q454 VanDerWaalsContact O-N 3.13Å; C452-L455 VanDerWaalsContact CB-O 3.32Å; C452-L455 WeakPolarHBondContact CB-O 3.44Å; C452-C456 HydrophobicContact CB-CB 3.98Å; C452-C466 WeakPolarHBondContact CA-SG 3.42Å; C452-C466 HydrophobicContact CB-CB 3.48Å; C452-C466 VanDerWaalsContact CB-CB 3.48Å; C452-C466 WeakPolarHBondContact CB-SG 3.39Å; C452-C466 WeakPolarHBondContact SG-CA 3.22Å; C452-C466 WeakPolarHBondContact SG-CB 3.27Å; C452-C466 CovalentContact SG-SG 2.03Å; C452-C466 PolarHBondContact SG-SG 2.96Å; C452-R718 VanDerWaalsContact O-CZ 3.27Å; C452-R718 PolarHBondContact O-NH1 2.87Å; C452-R718 PolarHBondContact O-NH2 2.79Å
453	S	86.9	Confident	72.2	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.021	29%	0.291	C	S	.	.	S	Bend	trans	-62.3	-23	-170.3	-68.4	0	0	0	0	116.8	K479 R480 D700 R718	S453-K479 PolarHBondContact N-O 3.18Å; S453-K479 PolarHBondContact OG-O 2.84Å; S453-R480 VanDerWaalsContact OG-CA 3.3Å; S453-R480 WeakPolarHBondContact OG-CA 3.5Å; S453-D700 WeakPolarHBondContact CB-OD1 3.48Å; S453-D700 WeakPolarHBondContact CB-OD2 3.44Å; S453-D700 PolarHBondContact OG-OD1 2.83Å; S453-D700 PolarHBondContact OG-OD2 2.65Å; S453-R718 PolarHBondContact O-NH2 2.81Å
454	Q	85.3	Confident	72.3	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.037	30%	0.299	C	S	.	.	S	Bend	trans	-134.2	-84.6	176.2	-71.6	174.1	-19.8	0	0	110.5	C452 L469 C481	C452-Q454 VanDerWaalsContact C-N 3.27Å; C452-Q454 PolarHBondContact O-N 3.05Å; C452-Q454 VanDerWaalsContact O-N 3.13Å; Q454-L469 HydrophobicContact CB-CG 4.35Å; Q454-L469 HydrophobicContact CG-CD1 4.4Å; Q454-C481 HydrophobicContact CG-CB 4.05Å
455	L	82.8	Confident	72.6	Confident	81 Å²	81	54 Å²	54	42%	0.424	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	141.6	-177	-53.7	172.6	0	0	0	110.6	C452 C466 G467 L469	C452-L455 VanDerWaalsContact CB-O 3.32Å; C452-L455 WeakPolarHBondContact CB-O 3.44Å; L455-C466 WeakPolarHBondContact O-CA 3.34Å; L455-G467 WeakPolarHBondContact CB-O 3.32Å; L455-G467 PolarHBondContact N-O 3.13Å; L455-G467 PolarHBondContact O-N 2.7Å; L455-L469 HydrophobicContact CD1-CD2 4.28Å; L455-L469 HydrophobicContact CD2-CD2 3.97Å; L455-L469 HydrophobicContact CG-CD2 4.26Å
456	C	84.6	Confident	73.2	Confident	31 Å²	31	51.5 Å²	51.5	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.8	172.3	-171.8	0	0	0	0	108.3	C444 R449 C452 W464 E465	C444-C456 WeakPolarHBondContact CA-SG 3.45Å; C444-C456 HydrophobicContact CB-CB 3.8Å; C444-C456 WeakPolarHBondContact CB-SG 3.36Å; C444-C456 WeakPolarHBondContact SG-CB 3.19Å; C444-C456 CovalentContact SG-SG 2.05Å; C444-C456 PolarHBondContact SG-SG 2.74Å; R449-C456 HydrophobicContact CB-CB 4.33Å; R449-C456 PolarHBondContact O-SG 2.94Å; C452-C456 HydrophobicContact CB-CB 3.98Å; C456-W464 VanDerWaalsContact SG-CD1 3.59Å; C456-E465 WeakPolarHBondContact CA-O 3.4Å
457	S	77.1	Confident	73.6	Confident	60 Å²	60	52 Å²	52	42%	0.42	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115.6	177.6	-60.1	0	0	0	0	109.2	I459 W464 E465	S457-I459 PolarHBondContact O-N 2.83Å; S457-W464 CarbonylContact O-C 3.55Å; S457-W464 WeakPolarHBondContact O-CA 3.4Å; S457-W464 VanDerWaalsContact O-CB 3.32Å; S457-W464 WeakPolarHBondContact O-CB 3.3Å; S457-E465 PolarHBondContact N-O 2.91Å; S457-E465 PolarHBondContact O-N 2.81Å
458	S	62.5	Low	74.4	Confident	79 Å²	79	50.3 Å²	50.3	55%	0.552	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.6	174.3	52.4	0	0	0	0	110.1	C444	C444-S458 PolarHBondContact SG-N 3.43Å
459	I	60.9	Low	74.4	Confident	86 Å²	86	51 Å²	51	44%	0.441	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-36	176	-58.6	171.4	0	0	0	109.7	S457 R463 E465	S457-I459 PolarHBondContact O-N 2.83Å; I459-R463 PolarHBondContact N-O 2.93Å; I459-E465 HydrophobicContact CD1-CB 3.99Å; I459-E465 HydrophobicContact CD1-CG 3.91Å; I459-E465 HydrophobicContact CG1-CG 4.28Å
460	T	50.9	Low	74	Confident	61 Å²	61	51.6 Å²	51.6	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	170	170.5	70.7	0	0	0	0	109.3	S462 R463	T460-S462 PolarHBondContact O-N 2.93Å; T460-S462 PolarHBondContact OG1-N 2.91Å; T460-S462 PolarHBondContact OG1-OG 2.92Å; T460-R463 PolarHBondContact N-O 3.39Å; T460-R463 PolarHBondContact O-N 2.98Å; T460-R463 VanDerWaalsContact O-N 3.16Å; T460-R463 WeakPolarHBondContact OG1-CB 3.1Å; T460-R463 PolarHBondContact OG1-N 3.48Å; T460-R463 VanDerWaalsContact OG1-N 3.13Å
461	P	52.6	Low	73.5	Confident	100 Å²	100	52.9 Å²	52.9	65%	0.649	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19	174.9	-28.5	37.1	0	0	0	115	G431 S432	G431-P461 CarbonylContact C-O 3.55Å; G431-P461 VanDerWaalsContact C-O 3.22Å; G431-P461 WeakPolarHBondContact CA-O 3.38Å; S432-P461 PolarHBondContact N-O 2.93Å
462	S	52.2	Low	73.5	Confident	76 Å²	76	52.8 Å²	52.8	53%	0.531	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	1.3	-179.2	57	0	0	0	0	115	T460 W464	T460-S462 PolarHBondContact O-N 2.93Å; T460-S462 PolarHBondContact OG1-N 2.91Å; T460-S462 PolarHBondContact OG1-OG 2.92Å; S462-W464 WeakPolarHBondContact O-CZ3 3.45Å
463	R	60.1	Low	73.2	Confident	94 Å²	94	60.1 Å²	60.1	36%	0.355	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.8	-175.2	-172.6	177.1	172.1	-154.2	-9.9	112.8	N241 I459 T460	N241-R463 PolarHBondContact OD1-NH2 3.41Å; I459-R463 PolarHBondContact N-O 2.93Å; T460-R463 PolarHBondContact N-O 3.39Å; T460-R463 PolarHBondContact O-N 2.98Å; T460-R463 VanDerWaalsContact O-N 3.16Å; T460-R463 WeakPolarHBondContact OG1-CB 3.1Å; T460-R463 PolarHBondContact OG1-N 3.48Å; T460-R463 VanDerWaalsContact OG1-N 3.13Å
464	W	79.6	Confident	73.1	Confident	46 Å²	46	64 Å²	64	17%	0.174	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	164.8	-178.5	54.8	91.8	0	0	0	111.9	V433 T442 C444 G450 C456 S457 S462	V433-W464 HydrophobicContact CG2-CH2 3.95Å; V433-W464 HydrophobicContact CG2-CZ3 4.21Å; T442-W464 HydrophobicContact CG2-CH2 4.04Å; T442-W464 HydrophobicContact CG2-CZ2 4.3Å; T442-W464 WeakPolarHBondContact O-CH2 3.16Å; C444-W464 WeakPolarHBondContact SG-CB 3.34Å; G450-W464 PolarHBondContact O-NE1 2.98Å; C456-W464 VanDerWaalsContact SG-CD1 3.59Å; S457-W464 CarbonylContact O-C 3.55Å; S457-W464 WeakPolarHBondContact O-CA 3.4Å; S457-W464 VanDerWaalsContact O-CB 3.32Å; S457-W464 WeakPolarHBondContact O-CB 3.3Å; S462-W464 WeakPolarHBondContact O-CZ3 3.45Å
465	E	82.9	Confident	73.2	Confident	116 Å²	116	67 Å²	67	54%	0.542	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	156.7	171	63.5	176.8	-165.3	0	0	111.8	C456 S457 I459	C456-E465 WeakPolarHBondContact CA-O 3.4Å; S457-E465 PolarHBondContact N-O 2.91Å; S457-E465 PolarHBondContact O-N 2.81Å; I459-E465 HydrophobicContact CD1-CB 3.99Å; I459-E465 HydrophobicContact CD1-CG 3.91Å; I459-E465 HydrophobicContact CG1-CG 4.28Å
466	C	85.6	Confident	73.1	Confident	18 Å²	18	72.4 Å²	72.4	12%	0.122	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130	-178	-52.9	0	0	0	0	111.3	C452 L455 L474 G478	C452-C466 WeakPolarHBondContact CA-SG 3.42Å; C452-C466 HydrophobicContact CB-CB 3.48Å; C452-C466 VanDerWaalsContact CB-CB 3.48Å; C452-C466 WeakPolarHBondContact CB-SG 3.39Å; C452-C466 WeakPolarHBondContact SG-CA 3.22Å; C452-C466 WeakPolarHBondContact SG-CB 3.27Å; C452-C466 CovalentContact SG-SG 2.03Å; C452-C466 PolarHBondContact SG-SG 2.96Å; L455-C466 WeakPolarHBondContact O-CA 3.34Å; C466-L474 HydrophobicContact CB-CD1 4.35Å; C466-G478 WeakPolarHBondContact CB-O 3.18Å
467	G	82.2	Confident	73	Confident	24 Å²	24	73.9 Å²	73.9	25%	0.247	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	162.7	174.1	0	0	0	0	0	112.4	L455 C481	L455-G467 WeakPolarHBondContact CB-O 3.32Å; L455-G467 PolarHBondContact N-O 3.13Å; L455-G467 PolarHBondContact O-N 2.7Å; G467-C481 PolarHBondContact O-SG 2.99Å; G467-C481 VanDerWaalsContact O-SG 3.41Å
468	C	83.3	Confident	73.2	Confident	32 Å²	32	72.7 Å²	72.7	22%	0.216	40%	0.399	C	S	.	.			trans	-120.3	148	176.4	-57.3	0	0	0	0	111.4	C481	C468-C481 WeakPolarHBondContact CA-SG 3.11Å; C468-C481 HydrophobicContact CB-CB 3.81Å; C468-C481 WeakPolarHBondContact CB-SG 3.3Å; C468-C481 WeakPolarHBondContact SG-CA 3.19Å; C468-C481 WeakPolarHBondContact SG-CB 3.46Å; C468-C481 CovalentContact SG-SG 2.04Å; C468-C481 PolarHBondContact SG-SG 2.93Å
469	L	73.2	Confident	74.2	Confident	50 Å²	50	72.9 Å²	72.9	26%	0.262	39%	0.39	S	S	.	.			trans	-71	158.7	174.8	-66.8	170.9	0	0	0	111.2	Q454 L455 G471 Y472 T657	Q454-L469 HydrophobicContact CB-CG 4.35Å; Q454-L469 HydrophobicContact CG-CD1 4.4Å; L455-L469 HydrophobicContact CD1-CD2 4.28Å; L455-L469 HydrophobicContact CD2-CD2 3.97Å; L455-L469 HydrophobicContact CG-CD2 4.26Å; L469-G471 PolarHBondContact O-N 3.08Å; L469-Y472 HydrophobicContact CB-CD2 4.26Å; L469-Y472 WeakPolarHBondContact O-CB 3.24Å; L469-Y472 PolarHBondContact O-N 3.42Å; L469-T657 HydrophobicContact CD1-CG2 3.96Å
470	P	67.4	Low	75.5	Confident	88 Å²	88	74 Å²	74	57%	0.571	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	138	175.3	-27.3	35.8	0	0	0	112.7	Y472 L767	P470-Y472 VanDerWaalsContact C-N 3.3Å; P470-L767 HydrophobicContact CB-CD2 3.77Å
471	G	67	Low	77.4	Confident	27 Å²	27	71.1 Å²	71.1	28%	0.278	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-9.4	-173.7	0	0	0	0	0	114.6	L469 T484 L742	L469-G471 PolarHBondContact O-N 3.08Å; G471-T484 WeakPolarHBondContact O-CB 2.94Å; G471-T484 WeakPolarHBondContact O-CG2 3.35Å; G471-T484 PolarHBondContact O-N 2.86Å; G471-T484 PolarHBondContact O-OG1 2.85Å; G471-L742 WeakPolarHBondContact O-CD1 3.15Å
472	Y	79.3	Confident	79	Confident	28 Å²	28	68.2 Å²	68.2	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	154.3	171.8	-63.1	-97.8	0	0	0	110.9	L469 P470 C481 I482 A483 T657 E699 L742	L469-Y472 HydrophobicContact CB-CD2 4.26Å; L469-Y472 WeakPolarHBondContact O-CB 3.24Å; L469-Y472 PolarHBondContact O-N 3.42Å; P470-Y472 VanDerWaalsContact C-N 3.3Å; Y472-C481 HydrophobicContact CD1-CB 4.49Å; Y472-I482 CarbonylContact C-O 3.6Å; Y472-I482 WeakPolarHBondContact CA-O 3.44Å; Y472-A483 HydrophobicContact CD1-CB 4.13Å; Y472-A483 HydrophobicContact CE1-CB 3.91Å; Y472-T657 HydrophobicContact CE2-CG2 4.45Å; Y472-E699 HydrophobicContact CE1-CG 4.15Å; Y472-L742 HydrophobicContact CD2-CD1 4.14Å; Y472-L742 HydrophobicContact CE1-CD1 4.49Å; Y472-L742 HydrophobicContact CE2-CB 4.24Å; Y472-L742 HydrophobicContact CE2-CD1 3.79Å
473	R	81.2	Confident	80.6	Confident	154 Å²	154	65.5 Å²	65.5	58%	0.581	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.2	172.6	61.9	178.3	176.1	146.7	2.6	110.2	H475 I482 T484	R473-H475 PolarHBondContact O-N 2.8Å; R473-I482 HydrophobicContact CG-CD1 4.14Å; R473-I482 HydrophobicContact CG-CG1 3.56Å; R473-I482 PolarHBondContact N-O 2.95Å; R473-I482 PolarHBondContact O-N 2.93Å; R473-T484 HydrophobicContact CB-CG2 4.05Å; R473-T484 HydrophobicContact CG-CG2 3.97Å
474	L	84.6	Confident	81.5	Confident	84 Å²	84	64 Å²	64	44%	0.44	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.2	175.2	-165.1	69.1	0	0	0	109.5	C466 R480	C466-L474 HydrophobicContact CB-CD1 4.35Å; L474-R480 CarbonylContact C-O 3.57Å; L474-R480 WeakPolarHBondContact CA-O 3.23Å
475	H	86.8	Confident	81.1	Confident	71 Å²	71	64.9 Å²	64.9	33%	0.329	36%	0.357	S	S	.	.			trans	-76.1	163.4	177.8	177.9	-99.9	0	0	0	110.7	R473 D477 G478 R480 I482	R473-H475 PolarHBondContact O-N 2.8Å; H475-D477 IonicContact CG-OD1 2.79Å; H475-D477 PolarHBondContact ND1-N 2.99Å; H475-D477 IonicContact ND1-OD1 2.74Å; H475-D477 PolarHBondContact ND1-OD1 3.4Å; H475-D477 IonicContact ND1-OD2 3.53Å; H475-D477 PolarHBondContact ND1-OD2 3.22Å; H475-D477 PolarHBondContact O-N 3.3Å; H475-G478 PolarHBondContact O-N 3.15Å; H475-R480 HydrophobicContact CB-CB 3.83Å; H475-R480 VanDerWaalsContact CB-O 3.23Å; H475-R480 WeakPolarHBondContact CB-O 3.03Å; H475-R480 PolarHBondContact N-O 3Å; H475-I482 HydrophobicContact CB-CG2 4.48Å
476	Q	81.4	Confident	80.9	Confident	195 Å²	195	62.6 Å²	62.6	91%	0.911	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.3	-173.9	-65	-178.5	-2.4	0	0	114.6	G478	Q476-G478 VanDerWaalsContact C-N 3.27Å
477	D	81.6	Confident	80.9	Confident	62 Å²	62	67.2 Å²	67.2	33%	0.332	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	1.9	174.9	64.7	-3.4	0	0	0	113.8	H475 K479 R480	H475-D477 IonicContact CG-OD1 2.79Å; H475-D477 PolarHBondContact ND1-N 2.99Å; H475-D477 IonicContact ND1-OD1 2.74Å; H475-D477 PolarHBondContact ND1-OD1 3.4Å; H475-D477 IonicContact ND1-OD2 3.53Å; H475-D477 PolarHBondContact ND1-OD2 3.22Å; H475-D477 PolarHBondContact O-N 3.3Å; D477-K479 PolarHBondContact O-N 2.04Å; D477-K479 VanDerWaalsContact O-N 3.11Å; D477-K479 PolarHBondContact OD1-N 2.75Å; D477-R480 PolarHBondContact OD1-N 2.9Å; D477-R480 IonicContact OD2-CZ 3.42Å; D477-R480 IonicContact OD2-NE 2.75Å; D477-R480 IonicContact OD2-NH1 3.62Å; D477-R480 PolarHBondContact OD2-NH1 2.92Å; D477-R480 IonicContact OD2-NH2 3.26Å
478	G	81.5	Confident	81.4	Confident	35 Å²	35	67 Å²	67	36%	0.361	38%	0.377	S	S	.	.	S	Bend	trans	66.3	10.8	178	0	0	0	0	0	114.3	C466 H475 Q476	C466-G478 WeakPolarHBondContact CB-O 3.18Å; H475-G478 PolarHBondContact O-N 3.15Å; Q476-G478 VanDerWaalsContact C-N 3.27Å
479	K	84.7	Confident	81.9	Confident	84 Å²	84	67.1 Å²	67.1	37%	0.365	37%	0.374	S	S	.	.	S	Bend	trans	-128.4	-38	-175.7	-68.2	-159.4	176.9	-157.5	0	113.7	G450 S453 D477	G450-K479 PolarHBondContact O-NZ 3.24Å; S453-K479 PolarHBondContact N-O 3.18Å; S453-K479 PolarHBondContact OG-O 2.84Å; D477-K479 PolarHBondContact O-N 2.04Å; D477-K479 VanDerWaalsContact O-N 3.11Å; D477-K479 PolarHBondContact OD1-N 2.75Å
480	R	88.3	Confident	83	Confident	108 Å²	108	64.8 Å²	64.8	41%	0.408	36%	0.362	S	S	.	.			trans	-86.9	143.6	-176.5	-63.6	-167.5	-167.3	83.7	28.6	114.2	S453 L474 H475 D477 D700	S453-R480 VanDerWaalsContact OG-CA 3.3Å; S453-R480 WeakPolarHBondContact OG-CA 3.5Å; L474-R480 CarbonylContact C-O 3.57Å; L474-R480 WeakPolarHBondContact CA-O 3.23Å; H475-R480 HydrophobicContact CB-CB 3.83Å; H475-R480 VanDerWaalsContact CB-O 3.23Å; H475-R480 WeakPolarHBondContact CB-O 3.03Å; H475-R480 PolarHBondContact N-O 3Å; D477-R480 PolarHBondContact OD1-N 2.9Å; D477-R480 IonicContact OD2-CZ 3.42Å; D477-R480 IonicContact OD2-NE 2.75Å; D477-R480 IonicContact OD2-NH1 3.62Å; D477-R480 PolarHBondContact OD2-NH1 2.92Å; D477-R480 IonicContact OD2-NH2 3.26Å; R480-D700 WeakPolarHBondContact CG-OD2 3.5Å
481	C	89.1	Confident	84.4	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.007	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110.1	175.6	-66.6	0	0	0	0	109.2	Q454 G467 C468 Y472	Q454-C481 HydrophobicContact CG-CB 4.05Å; G467-C481 PolarHBondContact O-SG 2.99Å; G467-C481 VanDerWaalsContact O-SG 3.41Å; C468-C481 WeakPolarHBondContact CA-SG 3.11Å; C468-C481 HydrophobicContact CB-CB 3.81Å; C468-C481 WeakPolarHBondContact CB-SG 3.3Å; C468-C481 WeakPolarHBondContact SG-CA 3.19Å; C468-C481 WeakPolarHBondContact SG-CB 3.46Å; C468-C481 CovalentContact SG-SG 2.04Å; C468-C481 PolarHBondContact SG-SG 2.93Å; Y472-C481 HydrophobicContact CD1-CB 4.49Å
482	I	88.2	Confident	85.7	Confident	40 Å²	40	59.3 Å²	59.3	21%	0.205	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	140.9	179.9	60.7	179	0	0	0	110.1	Y472 R473 H475 E699	Y472-I482 CarbonylContact C-O 3.6Å; Y472-I482 WeakPolarHBondContact CA-O 3.44Å; R473-I482 HydrophobicContact CG-CD1 4.14Å; R473-I482 HydrophobicContact CG-CG1 3.56Å; R473-I482 PolarHBondContact N-O 2.95Å; R473-I482 PolarHBondContact O-N 2.93Å; H475-I482 HydrophobicContact CB-CG2 4.48Å; I482-E699 WeakPolarHBondContact CA-OE1 3.5Å
483	A	84.8	Confident	86.5	Confident	18 Å²	18	58 Å²	58	15%	0.149	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	148.3	-176.9	0	0	0	0	0	111.8	Y472 F698 E699 L742	Y472-A483 HydrophobicContact CD1-CB 4.13Å; Y472-A483 HydrophobicContact CE1-CB 3.91Å; A483-F698 HydrophobicContact CB-CE1 4.1Å; A483-F698 HydrophobicContact CB-CZ 3.6Å; A483-E699 HydrophobicContact CB-CG 4.5Å; A483-E699 WeakPolarHBondContact CB-OE1 3.02Å; A483-E699 PolarHBondContact N-OE1 2.84Å; A483-L742 HydrophobicContact CB-CD1 4.17Å
484	T	78.6	Confident	87	Confident	62 Å²	62	50.7 Å²	50.7	38%	0.38	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-102.6	132.9	169.6	67	0	0	0	0	109.3	G471 R473	G471-T484 WeakPolarHBondContact O-CB 2.94Å; G471-T484 WeakPolarHBondContact O-CG2 3.35Å; G471-T484 PolarHBondContact O-N 2.86Å; G471-T484 PolarHBondContact O-OG1 2.85Å; R473-T484 HydrophobicContact CB-CG2 4.05Å; R473-T484 HydrophobicContact CG-CG2 3.97Å
485	G	71.2	Confident	87.2	Confident	66 Å²	66	48.4 Å²	48.4	68%	0.68	28%	0.277	S	S	*	.	S	Bend	trans	138.3	-161.8	-173.7	0	0	0	0	0	112.6
486	P	79.1	Confident	87.4	Confident	68 Å²	68	48.1 Å²	48.1	44%	0.442	28%	0.277	S	S	.	.	S	Bend	trans	-66.9	158.4	171.3	31.3	-35.2	0	0	0	111.1	A488 H740 P741	P486-A488 PolarHBondContact O-N 3.04Å; P486-H740 PolarHBondContact O-CD2 3.42Å; P486-H740 VanDerWaalsContact O-CD2 3.22Å; P486-H740 PolarHBondContact O-NE2 3.49Å; P486-P741 HydrophobicContact CG-CG 4.47Å
487	P	86.5	Confident	87.9	Confident	115 Å²	115	39.7 Å²	39.7	75%	0.747	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-59.8	133.9	172.4	26.7	-34.3	0	0	0	110.6
488	A	92.3	Very high	88.5	Confident	18 Å²	18	36.8 Å²	36.8	15%	0.149	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-68	147.4	172.9	0	0	0	0	0	110.7	P486 P503 F698 V738 V739 H740	P486-A488 PolarHBondContact O-N 3.04Å; A488-P503 VanDerWaalsContact O-CD 3.23Å; A488-P503 WeakPolarHBondContact O-CD 3.34Å; A488-P503 WeakPolarHBondContact O-CG 3.38Å; A488-F698 HydrophobicContact CB-CD1 4.07Å; A488-F698 HydrophobicContact CB-CE1 3.74Å; A488-V738 HydrophobicContact CB-CG1 4.16Å; A488-V739 WeakPolarHBondContact CA-O 3.08Å; A488-H740 HydrophobicContact CB-CB 3.93Å
489	F	94.2	Very high	89	Confident	36 Å²	36	36.5 Å²	36.5	16%	0.158	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.1	174.1	64.4	-92.5	0	0	0	110.9	I491 R500 V739	F489-I491 HydrophobicContact CD2-CG1 4.25Å; F489-I491 HydrophobicContact CE2-CD1 4.04Å; F489-I491 HydrophobicContact CE2-CG1 3.91Å; F489-R500 HydrophobicContact CD2-CG 3.72Å; F489-R500 HydrophobicContact CE2-CG 3.93Å; F489-V739 HydrophobicContact CD1-CB 4.32Å; F489-V739 HydrophobicContact CD1-CG1 4.37Å; F489-V739 HydrophobicContact CD2-CB 4.07Å; F489-V739 HydrophobicContact CD2-CG2 4.38Å; F489-V739 HydrophobicContact CE1-CB 4Å; F489-V739 HydrophobicContact CE1-CG1 3.63Å; F489-V739 HydrophobicContact CE2-CB 3.74Å; F489-V739 HydrophobicContact CE2-CG1 3.97Å; F489-V739 HydrophobicContact CE2-CG2 3.88Å; F489-V739 HydrophobicContact CG-CB 4.37Å; F489-V739 HydrophobicContact CZ-CB 3.71Å; F489-V739 HydrophobicContact CZ-CG1 3.41Å; F489-V739 VanDerWaalsContact CZ-CG1 3.41Å; F489-V739 HydrophobicContact CZ-CG2 4.18Å; F489-V739 PolarHBondContact N-O 2.94Å; F489-V739 PolarHBondContact O-N 3.04Å
490	L	95.8	Very high	89.4	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	143.7	-179.6	-56.6	178.2	0	0	0	110.6	V492 R500 M501 W703 V737 V738	L490-V492 HydrophobicContact CB-CG2 4.36Å; L490-R500 WeakPolarHBondContact O-CA 3.34Å; L490-M501 HydrophobicContact CB-CG 3.88Å; L490-M501 HydrophobicContact CD1-CG 4.38Å; L490-M501 PolarHBondContact N-O 3.22Å; L490-M501 PolarHBondContact O-N 3.11Å; L490-W703 HydrophobicContact CD1-CG 4.27Å; L490-W703 HydrophobicContact CD2-CD2 4.18Å; L490-W703 HydrophobicContact CD2-CG 4.18Å; L490-V737 WeakPolarHBondContact CA-O 3.39Å; L490-V738 HydrophobicContact CD2-CB 4.47Å; L490-V738 HydrophobicContact CD2-CG2 3.66Å
491	I	95.9	Very high	89.6	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.9	161.2	-60.9	-175.1	0	0	0	108.1	F489 V498 R499 L511 L522 V531 L546 V736 V737 V739	F489-I491 HydrophobicContact CD2-CG1 4.25Å; F489-I491 HydrophobicContact CE2-CD1 4.04Å; F489-I491 HydrophobicContact CE2-CG1 3.91Å; I491-V498 HydrophobicContact CG2-CG1 3.6Å; I491-R499 CarbonylContact C-O 3.55Å; I491-R499 VanDerWaalsContact CA-O 3.28Å; I491-R499 WeakPolarHBondContact CA-O 3.39Å; I491-L511 HydrophobicContact CD1-CD1 4.03Å; I491-L511 HydrophobicContact CG1-CD1 4.42Å; I491-L511 HydrophobicContact CG2-CD1 4.35Å; I491-L522 HydrophobicContact CB-CD1 4.28Å; I491-L522 HydrophobicContact CG2-CD1 3.86Å; I491-L522 HydrophobicContact CG2-CD2 4.31Å; I491-V531 HydrophobicContact CD1-CG2 3.44Å; I491-V531 VanDerWaalsContact CD1-CG2 3.44Å; I491-V531 HydrophobicContact CG2-CG1 4.32Å; I491-L546 HydrophobicContact CD1-CD1 4.16Å; I491-V736 WeakPolarHBondContact O-CA 3.27Å; I491-V737 PolarHBondContact N-O 3Å; I491-V737 PolarHBondContact O-N 2.82Å; I491-V739 HydrophobicContact CD1-CG2 3.66Å; I491-V739 HydrophobicContact CG1-CG2 3.83Å
492	V	95.5	Very high	89.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.4	-173	-178.6	0	0	0	0	109.4	L490 V498 R499 M501 I712 P733 S735 V736	L490-V492 HydrophobicContact CB-CG2 4.36Å; V492-V498 WeakPolarHBondContact O-CA 3.35Å; V492-R499 PolarHBondContact N-O 3.14Å; V492-R499 PolarHBondContact O-N 3.08Å; V492-M501 HydrophobicContact CB-CE 3.92Å; V492-M501 HydrophobicContact CG2-CE 3.63Å; V492-M501 HydrophobicContact CG2-SD 4.1Å; V492-I712 HydrophobicContact CG1-CD1 4.16Å; V492-I712 HydrophobicContact CG2-CD1 4.35Å; V492-I712 HydrophobicContact CG2-CG1 4.38Å; V492-P733 HydrophobicContact CG1-CB 3.86Å; V492-S735 WeakPolarHBondContact CA-O 3.49Å; V492-V736 HydrophobicContact CG2-CB 4.37Å; V492-V736 HydrophobicContact CG2-CG2 4.01Å
493	A	94.9	Very high	89.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	130.6	165.5	0	0	0	0	0	107.9	I519 L522 P733 A734 S735	A493-I519 HydrophobicContact CB-CB 4.45Å; A493-I519 HydrophobicContact CB-CG2 3.85Å; A493-L522 HydrophobicContact CB-CD2 3.56Å; A493-P733 CarbonylContact O-C 3.58Å; A493-P733 WeakPolarHBondContact O-CA 3.31Å; A493-A734 HydrophobicContact CB-CB 4.33Å; A493-A734 PolarHBondContact O-N 2.95Å; A493-S735 PolarHBondContact N-O 2.96Å
494	N	92.3	Very high	90	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	57.1	-170.5	173.4	55.8	0	0	0	109.6	M496 D497 R499 L730 V731 Q732	N494-M496 PolarHBondContact O-N 2.99Å; N494-D497 WeakPolarHBondContact CB-OD1 3.44Å; N494-D497 PolarHBondContact N-O 2.83Å; N494-D497 PolarHBondContact ND2-OD1 3.2Å; N494-D497 PolarHBondContact O-N 2.87Å; N494-R499 PolarHBondContact ND2-NE 2.89Å; N494-R499 PolarHBondContact ND2-NH2 2.98Å; N494-L730 HydrophobicContact CB-CD2 4.11Å; N494-V731 PolarHBondContact OD1-N 2.86Å; N494-Q732 WeakPolarHBondContact CA-O 3.3Å; N494-Q732 PolarHBondContact OD1-N 2.81Å
495	L	89.2	Confident	90.3	Very high	36 Å²	36	33.7 Å²	33.7	19%	0.188	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	61.9	-66.1	179.5	-166.8	75.8	0	0	0	115	T518 I519 V731 Q732	L495-T518 HydrophobicContact CD1-CG2 3.89Å; L495-T518 WeakPolarHBondContact O-CA 3.45Å; L495-I519 PolarHBondContact O-N 3.31Å; L495-V731 HydrophobicContact CD2-CG1 4.47Å; L495-Q732 HydrophobicContact CB-CB 4.28Å
496	M	89.8	Confident	91	Very high	66 Å²	66	33.7 Å²	33.7	33%	0.325	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-9.6	-175.3	-45.5	-53.4	-58.3	0	0	113	N494 E514 P515 G517	N494-M496 PolarHBondContact O-N 2.99Å; M496-E514 CarbonylContact O-C 3.59Å; M496-E514 PolarHBondContact O-N 3.04Å; M496-P515 WeakPolarHBondContact CE-O 3.41Å; M496-G517 VanDerWaalsContact CE-O 3.31Å; M496-G517 WeakPolarHBondContact CE-O 3.3Å
497	D	92	Very high	91.2	Very high	18 Å²	18	36.9 Å²	36.9	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	162.2	177.7	60.7	31.8	0	0	0	113	N494 R499 T510 V512 K513	N494-D497 WeakPolarHBondContact CB-OD1 3.44Å; N494-D497 PolarHBondContact N-O 2.83Å; N494-D497 PolarHBondContact ND2-OD1 3.2Å; N494-D497 PolarHBondContact O-N 2.87Å; D497-R499 VanDerWaalsContact CG-NE 3.26Å; D497-R499 WeakPolarHBondContact OD1-CG 3.49Å; D497-R499 IonicContact OD1-CZ 2.68Å; D497-R499 IonicContact OD1-NE 2.79Å; D497-R499 PolarHBondContact OD1-NE 2.83Å; D497-R499 IonicContact OD1-NH2 3.64Å; D497-R499 IonicContact OD2-CZ 3.01Å; D497-R499 IonicContact OD2-NE 2.91Å; D497-R499 PolarHBondContact OD2-NE 2.68Å; D497-R499 IonicContact OD2-NH2 2.77Å; D497-R499 PolarHBondContact OD2-NH2 2.76Å; D497-T510 HydrophobicContact CB-CG2 3.74Å; D497-V512 CarbonylContact C-O 3.57Å; D497-V512 VanDerWaalsContact CA-O 3.23Å; D497-V512 WeakPolarHBondContact CA-O 3.39Å; D497-V512 WeakPolarHBondContact CB-O 3.38Å; D497-K513 HydrophobicContact CB-CG 4.45Å
498	V	94.1	Very high	91.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.4	168.6	-178.8	0	0	0	0	107.4	I491 V492 L511 V512 I519 F533	I491-V498 HydrophobicContact CG2-CG1 3.6Å; V492-V498 WeakPolarHBondContact O-CA 3.35Å; V498-L511 HydrophobicContact CG1-CD1 4.47Å; V498-L511 PolarHBondContact O-N 3.38Å; V498-V512 HydrophobicContact CB-CB 4.1Å; V498-V512 HydrophobicContact CB-CG2 4.43Å; V498-V512 HydrophobicContact CG2-CB 4.2Å; V498-V512 PolarHBondContact N-O 2.92Å; V498-V512 PolarHBondContact O-N 3.33Å; V498-I519 HydrophobicContact CG2-CD1 3.78Å; V498-I519 HydrophobicContact CG2-CG2 4.14Å; V498-F533 HydrophobicContact CG2-CG 4.47Å
499	R	92.4	Very high	91	Very high	29 Å²	29	38.5 Å²	38.5	11%	0.109	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143.6	-174.6	-57.4	-166.9	-177.5	-179.6	4	112.1	I491 V492 N494 D497 M501 E508 Q509 S729	I491-R499 CarbonylContact C-O 3.55Å; I491-R499 VanDerWaalsContact CA-O 3.28Å; I491-R499 WeakPolarHBondContact CA-O 3.39Å; V492-R499 PolarHBondContact N-O 3.14Å; V492-R499 PolarHBondContact O-N 3.08Å; N494-R499 PolarHBondContact ND2-NE 2.89Å; N494-R499 PolarHBondContact ND2-NH2 2.98Å; D497-R499 VanDerWaalsContact CG-NE 3.26Å; D497-R499 WeakPolarHBondContact OD1-CG 3.49Å; D497-R499 IonicContact OD1-CZ 2.68Å; D497-R499 IonicContact OD1-NE 2.79Å; D497-R499 PolarHBondContact OD1-NE 2.83Å; D497-R499 IonicContact OD1-NH2 3.64Å; D497-R499 IonicContact OD2-CZ 3.01Å; D497-R499 IonicContact OD2-NE 2.91Å; D497-R499 PolarHBondContact OD2-NE 2.68Å; D497-R499 IonicContact OD2-NH2 2.77Å; D497-R499 PolarHBondContact OD2-NH2 2.76Å; R499-M501 HydrophobicContact CB-CE 4.36Å; R499-E508 WeakPolarHBondContact CD-OE1 3.34Å; R499-E508 IonicContact CZ-OE1 2.93Å; R499-E508 IonicContact NE-OE1 2.78Å; R499-E508 IonicContact NH1-OE1 3.41Å; R499-E508 PolarHBondContact NH1-OE1 3.28Å; R499-E508 IonicContact NH1-OE2 2.76Å; R499-Q509 WeakPolarHBondContact CA-O 3.43Å; R499-S729 PolarHBondContact NH1-O 3.45Å
500	R	93.1	Very high	90.9	Very high	75 Å²	75	39.2 Å²	39.2	28%	0.283	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.7	164	168	172.1	177.4	-106.1	-10.3	108.3	F489 L490 E508 Q509 L511	F489-R500 HydrophobicContact CD2-CG 3.72Å; F489-R500 HydrophobicContact CE2-CG 3.93Å; L490-R500 WeakPolarHBondContact O-CA 3.34Å; R500-E508 WeakPolarHBondContact O-CA 3.2Å; R500-Q509 HydrophobicContact CB-CB 4.39Å; R500-Q509 PolarHBondContact N-O 2.92Å; R500-Q509 PolarHBondContact O-N 2.78Å; R500-L511 HydrophobicContact CB-CD1 4.05Å; R500-L511 HydrophobicContact CB-CD2 4.12Å; R500-L511 HydrophobicContact CB-CG 4.03Å
501	M	92.9	Very high	90.6	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	156.5	174.6	66.3	-172.4	71.3	0	0	110.2	L490 V492 R499 L730	L490-M501 HydrophobicContact CB-CG 3.88Å; L490-M501 HydrophobicContact CD1-CG 4.38Å; L490-M501 PolarHBondContact N-O 3.22Å; L490-M501 PolarHBondContact O-N 3.11Å; V492-M501 HydrophobicContact CB-CE 3.92Å; V492-M501 HydrophobicContact CG2-CE 3.63Å; V492-M501 HydrophobicContact CG2-SD 4.1Å; R499-M501 HydrophobicContact CB-CE 4.36Å; M501-L730 HydrophobicContact CE-CD1 4.31Å; M501-L730 HydrophobicContact CE-CD2 3.94Å
502	N	92.3	Very high	90.3	Very high	30 Å²	30	41.9 Å²	41.9	16%	0.16	21%	0.214	C	C	.	.			trans	-71	159.9	171	-72.1	-24	0	0	0	111.1	D504 G505 T506 E507	N502-D504 WeakPolarHBondContact CB-OD1 3.36Å; N502-D504 PolarHBondContact O-N 2.79Å; N502-G505 PolarHBondContact O-N 3.14Å; N502-T506 WeakPolarHBondContact CB-O 3.3Å; N502-T506 WeakPolarHBondContact CB-OG1 3.38Å; N502-T506 PolarHBondContact N-O 2.75Å; N502-T506 PolarHBondContact ND2-OG1 3.4Å; N502-T506 VanDerWaalsContact ND2-OG1 3.14Å; N502-E507 VanDerWaalsContact ND2-CD 3.28Å; N502-E507 WeakPolarHBondContact ND2-CG 3.42Å; N502-E507 PolarHBondContact ND2-OE2 2.95Å
503	P	90.3	Very high	90	Very high	42 Å²	42	48.9 Å²	48.9	27%	0.273	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-10.2	-176.5	-22	34.9	0	0	0	115.2	A488 W703 I726	A488-P503 VanDerWaalsContact O-CD 3.23Å; A488-P503 WeakPolarHBondContact O-CD 3.34Å; A488-P503 WeakPolarHBondContact O-CG 3.38Å; P503-W703 HydrophobicContact CB-CZ2 3.95Å; P503-I726 WeakPolarHBondContact O-CD1 3.22Å
504	D	87.6	Confident	89.5	Confident	94 Å²	94	50.4 Å²	50.4	50%	0.503	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-8.5	172.9	65.3	-7.3	0	0	0	113.7	N502 T506	N502-D504 WeakPolarHBondContact CB-OD1 3.36Å; N502-D504 PolarHBondContact O-N 2.79Å; D504-T506 WeakPolarHBondContact OD1-CB 3.38Å; D504-T506 WeakPolarHBondContact OD1-CG2 3.33Å; D504-T506 PolarHBondContact OD1-N 3.14Å; D504-T506 PolarHBondContact OD1-OG1 2.94Å; D504-T506 WeakPolarHBondContact OD2-CG2 3.5Å; D504-T506 PolarHBondContact OD2-OG1 3.45Å
505	G	84.8	Confident	88.6	Confident	11 Å²	11	55.2 Å²	55.2	11%	0.113	28%	0.283	C	S	.	.	S	Bend	trans	97.4	-1.6	-176.8	0	0	0	0	0	114.8	N502 H727	N502-G505 PolarHBondContact O-N 3.14Å; G505-H727 WeakPolarHBondContact CA-O 3.48Å
506	T	87.1	Confident	88	Confident	66 Å²	66	63.2 Å²	63.2	41%	0.405	31%	0.311	S	S	.	.			trans	-79	169.8	178.9	65.2	0	0	0	0	112.7	N502 D504 E508	N502-T506 WeakPolarHBondContact CB-O 3.3Å; N502-T506 WeakPolarHBondContact CB-OG1 3.38Å; N502-T506 PolarHBondContact N-O 2.75Å; N502-T506 PolarHBondContact ND2-OG1 3.4Å; N502-T506 VanDerWaalsContact ND2-OG1 3.14Å; D504-T506 WeakPolarHBondContact OD1-CB 3.38Å; D504-T506 WeakPolarHBondContact OD1-CG2 3.33Å; D504-T506 PolarHBondContact OD1-N 3.14Å; D504-T506 PolarHBondContact OD1-OG1 2.94Å; D504-T506 WeakPolarHBondContact OD2-CG2 3.5Å; D504-T506 PolarHBondContact OD2-OG1 3.45Å; T506-E508 VanDerWaalsContact C-N 3.33Å; T506-E508 PolarHBondContact O-N 2.58Å
507	E	83.2	Confident	87.3	Confident	136 Å²	136	60.1 Å²	60.1	64%	0.636	30%	0.296	S	S	*	.	S	Bend	trans	54.3	41.3	175.5	-56.6	-172.9	153.5	0	0	114.6	N502 Q509	N502-E507 VanDerWaalsContact ND2-CD 3.28Å; N502-E507 WeakPolarHBondContact ND2-CG 3.42Å; N502-E507 PolarHBondContact ND2-OE2 2.95Å; E507-Q509 PolarHBondContact O-N 2.91Å
508	E	84.6	Confident	87.2	Confident	71 Å²	71	61.4 Å²	61.4	33%	0.332	30%	0.304	S	S	.	.			trans	-62.4	119.8	178.9	-175.1	166.3	-144.5	0	0	112.3	R499 R500 T506 S729	R499-E508 WeakPolarHBondContact CD-OE1 3.34Å; R499-E508 IonicContact CZ-OE1 2.93Å; R499-E508 IonicContact NE-OE1 2.78Å; R499-E508 IonicContact NH1-OE1 3.41Å; R499-E508 PolarHBondContact NH1-OE1 3.28Å; R499-E508 IonicContact NH1-OE2 2.76Å; R500-E508 WeakPolarHBondContact O-CA 3.2Å; T506-E508 VanDerWaalsContact C-N 3.33Å; T506-E508 PolarHBondContact O-N 2.58Å; E508-S729 PolarHBondContact OE2-N 2.82Å
509	Q	89.3	Confident	87.1	Confident	95 Å²	95	61.4 Å²	61.4	44%	0.444	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	124	-178.4	-179.1	-176	14.4	0	0	110.3	R499 R500 E507 L511	R499-Q509 WeakPolarHBondContact CA-O 3.43Å; R500-Q509 HydrophobicContact CB-CB 4.39Å; R500-Q509 PolarHBondContact N-O 2.92Å; R500-Q509 PolarHBondContact O-N 2.78Å; E507-Q509 PolarHBondContact O-N 2.91Å; Q509-L511 PolarHBondContact O-N 2.69Å
510	T	91.2	Very high	87.1	Confident	52 Å²	52	60.6 Å²	60.6	32%	0.319	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.7	171.8	-40.4	0	0	0	0	111	D497 V512 K513	D497-T510 HydrophobicContact CB-CG2 3.74Å; T510-V512 WeakPolarHBondContact CG2-O 3.34Å; T510-K513 HydrophobicContact CG2-CD 4.28Å; T510-K513 HydrophobicContact CG2-CG 3.53Å
511	L	90.5	Very high	87.2	Confident	46 Å²	46	57.1 Å²	57.1	24%	0.241	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-46.2	176.4	-60.7	178.3	0	0	0	111.8	I491 V498 R500 Q509 L546	I491-L511 HydrophobicContact CD1-CD1 4.03Å; I491-L511 HydrophobicContact CG1-CD1 4.42Å; I491-L511 HydrophobicContact CG2-CD1 4.35Å; V498-L511 HydrophobicContact CG1-CD1 4.47Å; V498-L511 PolarHBondContact O-N 3.38Å; R500-L511 HydrophobicContact CB-CD1 4.05Å; R500-L511 HydrophobicContact CB-CD2 4.12Å; R500-L511 HydrophobicContact CB-CG 4.03Å; Q509-L511 PolarHBondContact O-N 2.69Å; L511-L546 HydrophobicContact CD1-CD2 3.78Å; L511-L546 HydrophobicContact CD2-CD2 4.3Å
512	V	90.4	Very high	87.4	Confident	10 Å²	10	57.2 Å²	57.2	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136	-179.9	-177.4	0	0	0	0	108.5	D497 V498 T510 F533 V544	D497-V512 CarbonylContact C-O 3.57Å; D497-V512 VanDerWaalsContact CA-O 3.23Å; D497-V512 WeakPolarHBondContact CA-O 3.39Å; D497-V512 WeakPolarHBondContact CB-O 3.38Å; V498-V512 HydrophobicContact CB-CB 4.1Å; V498-V512 HydrophobicContact CB-CG2 4.43Å; V498-V512 HydrophobicContact CG2-CB 4.2Å; V498-V512 PolarHBondContact N-O 2.92Å; V498-V512 PolarHBondContact O-N 3.33Å; T510-V512 WeakPolarHBondContact CG2-O 3.34Å; V512-F533 HydrophobicContact CG1-CE2 4.39Å; V512-F533 HydrophobicContact CG1-CZ 3.93Å; V512-F533 HydrophobicContact CG2-CE1 4.03Å; V512-F533 HydrophobicContact CG2-CZ 4.26Å; V512-V544 HydrophobicContact CG2-CB 4.14Å; V512-V544 HydrophobicContact CG2-CG1 3.83Å; V512-V544 HydrophobicContact CG2-CG2 4.36Å
513	K	88.9	Confident	87.6	Confident	146 Å²	146	56.5 Å²	56.5	64%	0.635	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.1	169.1	-70.1	-177.1	178.5	-179.2	0	108.5	D497 T510	D497-K513 HydrophobicContact CB-CG 4.45Å; T510-K513 HydrophobicContact CG2-CD 4.28Å; T510-K513 HydrophobicContact CG2-CG 3.53Å
514	E	83.2	Confident	87.8	Confident	32 Å²	32	55 Å²	55	15%	0.15	28%	0.275	C	S	.	.			trans	-131.3	78.4	177	-164.6	48.2	-99.6	0	0	109.6	M496 R516 G517 I519 R551	M496-E514 CarbonylContact O-C 3.59Å; M496-E514 PolarHBondContact O-N 3.04Å; E514-R516 PolarHBondContact O-N 3Å; E514-G517 WeakPolarHBondContact O-CA 3.32Å; E514-G517 PolarHBondContact O-N 3.25Å; E514-I519 HydrophobicContact CB-CD1 4.12Å; E514-R551 IonicContact OE2-CZ 3.01Å; E514-R551 VanDerWaalsContact OE2-CZ 3.27Å; E514-R551 IonicContact OE2-NH1 3.88Å; E514-R551 PolarHBondContact OE2-NH1 2.97Å; E514-R551 IonicContact OE2-NH2 2.81Å; E514-R551 PolarHBondContact OE2-NH2 3.26Å
515	P	74.6	Confident	88	Confident	103 Å²	103	50.5 Å²	50.5	67%	0.669	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	2.1	-172.4	30.5	-36.7	0	0	0	114.3	M496	M496-P515 WeakPolarHBondContact CE-O 3.41Å
516	R	75.3	Confident	88	Confident	203 Å²	203	50.5 Å²	50.5	77%	0.766	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.3	5.5	167.9	-64.1	178.4	177.3	161.5	-1.4	112.3	E514 S537 Q538	E514-R516 PolarHBondContact O-N 3Å; R516-S537 PolarHBondContact O-OG 3.26Å; R516-Q538 PolarHBondContact O-NE2 3.22Å; R516-Q538 VanDerWaalsContact O-NE2 3.15Å
517	G	74.9	Confident	87.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	24%	0.235	C	C	.	.			trans	-84.8	168.5	-178.2	0	0	0	0	0	113	M496 E514 S537	M496-G517 VanDerWaalsContact CE-O 3.31Å; M496-G517 WeakPolarHBondContact CE-O 3.3Å; E514-G517 WeakPolarHBondContact O-CA 3.32Å; E514-G517 PolarHBondContact O-N 3.25Å; G517-S537 WeakPolarHBondContact CA-OG 3.36Å
518	T	90.6	Very high	87.6	Confident	45 Å²	45	46.7 Å²	46.7	28%	0.276	22%	0.224	S	C	.	.			trans	-142.2	88.7	162.7	-61.2	0	0	0	0	105.7	L495 L520 S535 I536 S537	L495-T518 HydrophobicContact CD1-CG2 3.89Å; L495-T518 WeakPolarHBondContact O-CA 3.45Å; T518-L520 HydrophobicContact CG2-CD2 4.18Å; T518-L520 HydrophobicContact CG2-CG 4.24Å; T518-S535 WeakPolarHBondContact O-CA 3.33Å; T518-I536 PolarHBondContact O-N 3.19Å; T518-S537 PolarHBondContact N-OG 3.19Å; T518-S537 VanDerWaalsContact N-OG 3.17Å
519	I	92.8	Very high	87.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108.8	-175.8	-52.2	176.2	0	0	0	107.5	A493 L495 V498 E514 F533 A534	A493-I519 HydrophobicContact CB-CB 4.45Å; A493-I519 HydrophobicContact CB-CG2 3.85Å; L495-I519 PolarHBondContact O-N 3.31Å; V498-I519 HydrophobicContact CG2-CD1 3.78Å; V498-I519 HydrophobicContact CG2-CG2 4.14Å; E514-I519 HydrophobicContact CB-CD1 4.12Å; I519-F533 HydrophobicContact CD1-CD2 3.87Å; I519-F533 HydrophobicContact CD1-CE2 4.02Å; I519-F533 HydrophobicContact CG1-CD2 4.23Å; I519-F533 HydrophobicContact CG2-CB 3.94Å; I519-F533 HydrophobicContact CG2-CD2 4.02Å; I519-F533 HydrophobicContact CG2-CG 4.37Å; I519-A534 WeakPolarHBondContact CA-O 3.3Å
520	L	92.6	Very high	87.8	Confident	13 Å²	13	42.8 Å²	42.8	7%	0.068	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-39.8	177.7	-63.4	-164.1	0	0	0	113	T518 I536 E563 F693 W707 A734 S735	T518-L520 HydrophobicContact CG2-CD2 4.18Å; T518-L520 HydrophobicContact CG2-CG 4.24Å; L520-I536 HydrophobicContact CB-CD1 4.14Å; L520-I536 HydrophobicContact CD1-CD1 3.46Å; L520-I536 VanDerWaalsContact CD1-CD1 3.46Å; L520-I536 HydrophobicContact CG-CD1 3.7Å; L520-E563 HydrophobicContact CD1-CG 4.42Å; L520-F693 HydrophobicContact CB-CZ 4.38Å; L520-F693 HydrophobicContact CD1-CZ 4.31Å; L520-W707 HydrophobicContact CD2-CZ2 4.38Å; L520-A734 HydrophobicContact CB-CB 4.32Å; L520-A734 HydrophobicContact CD2-CB 3.74Å; L520-A734 WeakPolarHBondContact O-CB 3.3Å; L520-S735 WeakPolarHBondContact O-CB 3.23Å; L520-S735 PolarHBondContact O-N 2.97Å
521	A	94.6	Very high	88	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.6	-178.8	0	0	0	0	0	112	F533 A534 L565	A521-F533 WeakPolarHBondContact O-CA 3.48Å; A521-A534 HydrophobicContact CB-CB 4.17Å; A521-A534 PolarHBondContact O-N 3.27Å; A521-L565 HydrophobicContact CB-CB 3.81Å
522	L	95.9	Very high	88.3	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.6	169.3	81.8	98.6	0	0	0	110.5	I491 A493 V531 Y532 F533 S735 V737	I491-L522 HydrophobicContact CB-CD1 4.28Å; I491-L522 HydrophobicContact CG2-CD1 3.86Å; I491-L522 HydrophobicContact CG2-CD2 4.31Å; A493-L522 HydrophobicContact CB-CD2 3.56Å; L522-V531 HydrophobicContact CD1-CG1 4.29Å; L522-Y532 CarbonylContact C-O 3.57Å; L522-Y532 VanDerWaalsContact CA-O 3.22Å; L522-Y532 WeakPolarHBondContact CA-O 3.39Å; L522-F533 HydrophobicContact CB-CB 4.21Å; L522-S735 VanDerWaalsContact CD2-O 3.28Å; L522-S735 WeakPolarHBondContact CD2-O 3.28Å; L522-S735 PolarHBondContact O-OG 3.01Å; L522-V737 HydrophobicContact CD1-CB 3.81Å; L522-V737 HydrophobicContact CD1-CG2 3.59Å; L522-V737 HydrophobicContact CG-CG2 4.17Å
523	D	97.1	Very high	88.6	Confident	16 Å²	16	37.6 Å²	37.6	9%	0.086	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	157.8	165.4	-169.8	17.4	0	0	0	111.6	Y532 I567 K744	D523-Y532 PolarHBondContact N-O 3.02Å; D523-Y532 PolarHBondContact O-N 3.37Å; D523-I567 HydrophobicContact CB-CG1 3.98Å; D523-I567 WeakPolarHBondContact OD2-CB 3.3Å; D523-I567 PolarHBondContact OD2-N 3.49Å; D523-K744 VanDerWaalsContact OD1-CE 3.31Å; D523-K744 WeakPolarHBondContact OD1-CE 3.44Å; D523-K744 IonicContact OD1-NZ 3.46Å; D523-K744 PolarHBondContact OD1-NZ 2.97Å; D523-K744 IonicContact OD2-NZ 3.79Å; D523-K744 PolarHBondContact OD2-NZ 2.79Å
524	F	94.4	Very high	88.9	Confident	9 Å²	9	30.7 Å²	30.7	4%	0.039	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.9	-172.9	174.6	-111.1	0	0	0	112.4	P526 R530 V531 L546 V737 V739 K744	F524-P526 HydrophobicContact CD1-CB 4.41Å; F524-P526 VanDerWaalsContact CE1-CA 3.45Å; F524-P526 HydrophobicContact CE1-CB 3.83Å; F524-P526 WeakPolarHBondContact O-CD 3.47Å; F524-R530 WeakPolarHBondContact CD2-O 3.04Å; F524-V531 HydrophobicContact CD2-CG2 4.15Å; F524-L546 HydrophobicContact CD2-CD1 4.26Å; F524-L546 HydrophobicContact CE2-CD1 3.73Å; F524-V737 HydrophobicContact CB-CG1 4.07Å; F524-V739 HydrophobicContact CB-CG2 4.34Å; F524-V739 HydrophobicContact CD1-CB 4.5Å; F524-V739 HydrophobicContact CD1-CG1 4.17Å; F524-V739 HydrophobicContact CD1-CG2 4.01Å; F524-V739 HydrophobicContact CD2-CG2 4.22Å; F524-V739 HydrophobicContact CE1-CB 4.49Å; F524-V739 HydrophobicContact CE1-CG1 3.7Å; F524-V739 HydrophobicContact CE1-CG2 4.36Å; F524-V739 HydrophobicContact CE2-CG1 4.34Å; F524-V739 HydrophobicContact CG-CG2 3.92Å; F524-V739 HydrophobicContact CZ-CG1 3.79Å; F524-K744 WeakPolarHBondContact O-CD 3.45Å; F524-K744 PolarHBondContact O-NZ 3.18Å
525	D	91.4	Very high	89.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	107.6	171	-180	-2.6	0	0	0	110.8	V527 Y528 H529 R530 Y532 I567	D525-V527 PolarHBondContact O-N 3.49Å; D525-V527 WeakPolarHBondContact OD1-CB 3.46Å; D525-V527 PolarHBondContact OD1-N 3.07Å; D525-Y528 PolarHBondContact OD1-N 2.91Å; D525-Y528 VanDerWaalsContact OD2-CD2 3.28Å; D525-Y528 WeakPolarHBondContact OD2-CD2 3.23Å; D525-H529 VanDerWaalsContact O-CA 3.31Å; D525-H529 WeakPolarHBondContact O-CA 3.09Å; D525-H529 PolarHBondContact O-N 2.76Å; D525-R530 PolarHBondContact N-O 2.89Å; D525-R530 PolarHBondContact O-N 2.68Å; D525-Y532 HydrophobicContact CB-CD2 4.28Å; D525-Y532 HydrophobicContact CB-CE2 3.57Å; D525-I567 HydrophobicContact CB-CG2 4.23Å
526	P	84.6	Confident	90.2	Very high	11 Å²	11	25.9 Å²	25.9	7%	0.071	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.1	178.4	32.8	-39.9	0	0	0	114.3	F524 H529 W569 K744 A747	F524-P526 HydrophobicContact CD1-CB 4.41Å; F524-P526 VanDerWaalsContact CE1-CA 3.45Å; F524-P526 HydrophobicContact CE1-CB 3.83Å; F524-P526 WeakPolarHBondContact O-CD 3.47Å; P526-H529 PolarHBondContact O-CE1 2.68Å; P526-W569 HydrophobicContact CG-CB 4.15Å; P526-W569 HydrophobicContact CG-CG 4.13Å; P526-K744 HydrophobicContact CG-CB 3.91Å; P526-K744 HydrophobicContact CG-CD 4.31Å; P526-A747 HydrophobicContact CB-CB 3.83Å; P526-A747 HydrophobicContact CG-CB 3.4Å
527	V	80.9	Confident	90.9	Very high	16 Å²	16	19 Å²	19	10%	0.097	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-47.9	-179.3	-179.2	0	0	0	0	110.4	D525 W569 A747 L751	D525-V527 PolarHBondContact O-N 3.49Å; D525-V527 WeakPolarHBondContact OD1-CB 3.46Å; D525-V527 PolarHBondContact OD1-N 3.07Å; V527-W569 HydrophobicContact CG2-CB 4.25Å; V527-A747 HydrophobicContact CG2-CB 4Å; V527-L751 HydrophobicContact CB-CD1 4.41Å; V527-L751 HydrophobicContact CG1-CD1 3.62Å; V527-L751 WeakPolarHBondContact O-CD1 3.37Å
528	Y	82.8	Confident	91.6	Very high	106 Å²	106	23.1 Å²	23.1	42%	0.416	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-1.6	-178.6	-61.5	-61.2	0	0	0	114.3	D525 R530 L589	D525-Y528 PolarHBondContact OD1-N 2.91Å; D525-Y528 VanDerWaalsContact OD2-CD2 3.28Å; D525-Y528 WeakPolarHBondContact OD2-CD2 3.23Å; Y528-R530 WeakPolarHBondContact O-CG 3.47Å; Y528-L589 HydrophobicContact CD2-CD1 4.42Å; Y528-L589 HydrophobicContact CE2-CD1 4.42Å
529	H	87.1	Confident	91.7	Very high	22 Å²	22	27.6 Å²	27.6	10%	0.102	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	47.8	-176.6	-51.8	-48.8	0	0	0	113.3	D525 P526 L546 H752	D525-H529 VanDerWaalsContact O-CA 3.31Å; D525-H529 WeakPolarHBondContact O-CA 3.09Å; D525-H529 PolarHBondContact O-N 2.76Å; P526-H529 PolarHBondContact O-CE1 2.68Å; H529-L546 WeakPolarHBondContact O-CB 3.32Å; H529-L546 WeakPolarHBondContact O-CG 3.32Å; H529-L546 PolarHBondContact O-N 3.07Å; H529-H752 AromaticContact CD2-CE1 3.71Å; H529-H752 AromaticContact CE1-CD2 3.66Å; H529-H752 AromaticContact CE1-CE1 2.96Å; H529-H752 PolarHBondContact CE1-CE1 2.79Å; H529-H752 AromaticContact CE1-CG 3.93Å; H529-H752 AromaticContact CE1-ND1 3.5Å; H529-H752 AromaticContact CE1-NE2 3.07Å; H529-H752 PolarHBondContact CE1-NE2 3.39Å; H529-H752 AromaticContact CG-CE1 3.88Å; H529-H752 AromaticContact ND1-CE1 3.42Å; H529-H752 PolarHBondContact ND1-CE1 3.14Å; H529-H752 AromaticContact ND1-NE2 3.42Å; H529-H752 PolarHBondContact ND1-NE2 3.29Å; H529-H752 AromaticContact NE2-CE1 3.11Å; H529-H752 PolarHBondContact NE2-CE1 2.83Å; H529-H752 AromaticContact NE2-ND1 3.37Å; H529-H752 PolarHBondContact NE2-ND1 3.28Å; H529-H752 AromaticContact NE2-NE2 3.72Å
530	R	90.3	Very high	91.8	Very high	62 Å²	62	28.2 Å²	28.2	23%	0.234	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.7	-177.1	-53.9	-169.2	175.6	153.2	-4.9	110.8	F524 D525 Y528 Y532 R543 V544 D545	F524-R530 WeakPolarHBondContact CD2-O 3.04Å; D525-R530 PolarHBondContact N-O 2.89Å; D525-R530 PolarHBondContact O-N 2.68Å; Y528-R530 WeakPolarHBondContact O-CG 3.47Å; R530-Y532 HydrophobicContact CB-CE2 3.84Å; R530-R543 HydrophobicContact CB-CG 3.83Å; R530-R543 VanDerWaalsContact CD-CD 3.45Å; R530-R543 HydrophobicContact CG-CG 4.45Å; R530-V544 CarbonylContact C-O 3.49Å; R530-V544 VanDerWaalsContact CA-O 3.3Å; R530-V544 WeakPolarHBondContact CA-O 3.41Å; R530-D545 HydrophobicContact CG-CB 4.31Å; R530-D545 IonicContact CZ-OD2 2.59Å; R530-D545 IonicContact NE-OD2 3.28Å; R530-D545 PolarHBondContact NE-OD2 2.86Å; R530-D545 IonicContact NH2-OD2 2.76Å
531	V	95.8	Very high	92	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.2	171.8	-179.5	0	0	0	0	107.5	I491 L522 F524 R543 V544 L546	I491-V531 HydrophobicContact CD1-CG2 3.44Å; I491-V531 VanDerWaalsContact CD1-CG2 3.44Å; I491-V531 HydrophobicContact CG2-CG1 4.32Å; L522-V531 HydrophobicContact CD1-CG1 4.29Å; F524-V531 HydrophobicContact CD2-CG2 4.15Å; V531-R543 CarbonylContact O-C 3.51Å; V531-R543 WeakPolarHBondContact O-CA 3.07Å; V531-V544 HydrophobicContact CB-CG1 3.86Å; V531-V544 PolarHBondContact N-O 2.73Å; V531-V544 PolarHBondContact O-N 3.16Å; V531-L546 HydrophobicContact CG2-CD1 4.05Å; V531-L546 HydrophobicContact CG2-CD2 3.77Å; V531-L546 HydrophobicContact CG2-CG 4.02Å
532	Y	96.9	Very high	92	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.8	173.5	-60.7	-110	0	0	0	107.4	L522 D523 D525 R530 E542 R543 L554 I567 M574 L589	L522-Y532 CarbonylContact C-O 3.57Å; L522-Y532 VanDerWaalsContact CA-O 3.22Å; L522-Y532 WeakPolarHBondContact CA-O 3.39Å; D523-Y532 PolarHBondContact N-O 3.02Å; D523-Y532 PolarHBondContact O-N 3.37Å; D525-Y532 HydrophobicContact CB-CD2 4.28Å; D525-Y532 HydrophobicContact CB-CE2 3.57Å; R530-Y532 HydrophobicContact CB-CE2 3.84Å; Y532-E542 CarbonylContact C-O 3.57Å; Y532-E542 VanDerWaalsContact CA-O 3.27Å; Y532-E542 WeakPolarHBondContact CA-O 3.45Å; Y532-R543 HydrophobicContact CD1-CB 4.14Å; Y532-R543 HydrophobicContact CD1-CG 4.1Å; Y532-R543 HydrophobicContact CD2-CG 4.47Å; Y532-R543 HydrophobicContact CE1-CB 4.25Å; Y532-R543 HydrophobicContact CE1-CG 3.89Å; Y532-R543 HydrophobicContact CE2-CG 4.23Å; Y532-R543 HydrophobicContact CG-CG 4.39Å; Y532-R543 WeakPolarHBondContact OH-CD 3.14Å; Y532-L554 HydrophobicContact CD1-CD1 3.62Å; Y532-L554 HydrophobicContact CE1-CD1 3.59Å; Y532-I567 HydrophobicContact CD1-CD1 3.99Å; Y532-I567 HydrophobicContact CD2-CD1 3.8Å; Y532-I567 HydrophobicContact CD2-CG1 3.95Å; Y532-I567 HydrophobicContact CE1-CD1 4.43Å; Y532-I567 HydrophobicContact CE2-CD1 4.31Å; Y532-I567 HydrophobicContact CG-CD1 3.66Å; Y532-I567 HydrophobicContact CG-CG1 4.22Å; Y532-M574 HydrophobicContact CD1-SD 4.2Å; Y532-L589 HydrophobicContact CE1-CB 4.37Å; Y532-L589 HydrophobicContact CE1-CD2 4.35Å; Y532-L589 WeakPolarHBondContact CE1-O 3.35Å
533	F	96.4	Very high	92	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.2	179.8	62.9	-86.2	0	0	0	111.1	V498 V512 I519 A521 L522 E542 V544	V498-F533 HydrophobicContact CG2-CG 4.47Å; V512-F533 HydrophobicContact CG1-CE2 4.39Å; V512-F533 HydrophobicContact CG1-CZ 3.93Å; V512-F533 HydrophobicContact CG2-CE1 4.03Å; V512-F533 HydrophobicContact CG2-CZ 4.26Å; I519-F533 HydrophobicContact CD1-CD2 3.87Å; I519-F533 HydrophobicContact CD1-CE2 4.02Å; I519-F533 HydrophobicContact CG1-CD2 4.23Å; I519-F533 HydrophobicContact CG2-CB 3.94Å; I519-F533 HydrophobicContact CG2-CD2 4.02Å; I519-F533 HydrophobicContact CG2-CG 4.37Å; A521-F533 WeakPolarHBondContact O-CA 3.48Å; L522-F533 HydrophobicContact CB-CB 4.21Å; F533-E542 HydrophobicContact CD1-CB 4.44Å; F533-E542 HydrophobicContact CD2-CB 4.34Å; F533-E542 HydrophobicContact CE1-CB 3.9Å; F533-E542 HydrophobicContact CE2-CB 3.78Å; F533-E542 HydrophobicContact CE2-CG 4.32Å; F533-E542 HydrophobicContact CZ-CB 3.53Å; F533-E542 HydrophobicContact CZ-CG 4.38Å; F533-E542 PolarHBondContact N-O 3.42Å; F533-E542 PolarHBondContact O-N 2.85Å; F533-V544 HydrophobicContact CE1-CB 4.49Å; F533-V544 HydrophobicContact CE1-CG1 4.32Å
534	A	95	Very high	91.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.7	179	0	0	0	0	0	111.1	I519 A521 T540 I541 P562	I519-A534 WeakPolarHBondContact CA-O 3.3Å; A521-A534 HydrophobicContact CB-CB 4.17Å; A521-A534 PolarHBondContact O-N 3.27Å; A534-T540 WeakPolarHBondContact CA-O 3.05Å; A534-I541 HydrophobicContact CB-CG1 4.03Å; A534-P562 HydrophobicContact CB-CB 3.82Å; A534-P562 HydrophobicContact CB-CG 3.88Å
535	S	92.6	Very high	91.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.3	179	-177.1	0	0	0	0	110.1	T518 Q538 R539 T540	T518-S535 WeakPolarHBondContact O-CA 3.33Å; S535-Q538 WeakPolarHBondContact OG-CG 3.47Å; S535-R539 VanDerWaalsContact O-CA 3.31Å; S535-R539 WeakPolarHBondContact O-CA 3.25Å; S535-R539 PolarHBondContact O-N 3.05Å; S535-T540 PolarHBondContact N-O 3.09Å; S535-T540 PolarHBondContact O-N 2.8Å
536	I	91.8	Very high	91.5	Very high	34 Å²	34	31.1 Å²	31.1	17%	0.174	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-41.9	-175.6	-63.9	172.8	0	0	0	111.2	T518 L520 Q538 R539 P562 E563	T518-I536 PolarHBondContact O-N 3.19Å; L520-I536 HydrophobicContact CB-CD1 4.14Å; L520-I536 HydrophobicContact CD1-CD1 3.46Å; L520-I536 VanDerWaalsContact CD1-CD1 3.46Å; L520-I536 HydrophobicContact CG-CD1 3.7Å; I536-Q538 PolarHBondContact O-N 2.98Å; I536-R539 WeakPolarHBondContact O-CG 3.24Å; I536-R539 PolarHBondContact O-N 2.85Å; I536-P562 HydrophobicContact CG1-CG 4.49Å; I536-E563 HydrophobicContact CD1-CG 3.74Å
537	S	89.8	Confident	91.5	Very high	58 Å²	58	36.1 Å²	36.1	41%	0.406	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.9	-179.5	65.3	0	0	0	0	113.5	R516 G517 T518	R516-S537 PolarHBondContact O-OG 3.26Å; G517-S537 WeakPolarHBondContact CA-OG 3.36Å; T518-S537 PolarHBondContact N-OG 3.19Å; T518-S537 VanDerWaalsContact N-OG 3.17Å
538	Q	90.2	Very high	91.9	Very high	89 Å²	89	40.2 Å²	40.2	42%	0.416	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-16.7	174.4	-59.3	-56.4	-56.7	0	0	112.7	R516 S535 I536 T540	R516-Q538 PolarHBondContact O-NE2 3.22Å; R516-Q538 VanDerWaalsContact O-NE2 3.15Å; S535-Q538 WeakPolarHBondContact OG-CG 3.47Å; I536-Q538 PolarHBondContact O-N 2.98Å; Q538-T540 VanDerWaalsContact C-N 3.29Å; Q538-T540 HydrophobicContact CB-CG2 4.24Å; Q538-T540 WeakPolarHBondContact CB-OG1 3.47Å; Q538-T540 PolarHBondContact O-N 2.83Å
539	R	93.2	Very high	92.1	Very high	139 Å²	139	37.8 Å²	37.8	53%	0.525	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	43.7	-173	-61.1	173.8	173.9	-178.8	-3	112.3	S535 I536 L559	S535-R539 VanDerWaalsContact O-CA 3.31Å; S535-R539 WeakPolarHBondContact O-CA 3.25Å; S535-R539 PolarHBondContact O-N 3.05Å; I536-R539 WeakPolarHBondContact O-CG 3.24Å; I536-R539 PolarHBondContact O-N 2.85Å; R539-L559 HydrophobicContact CB-CB 4.24Å; R539-L559 WeakPolarHBondContact CD-O 3.21Å; R539-L559 WeakPolarHBondContact O-CD1 3.09Å
540	T	94.6	Very high	92.2	Very high	13 Å²	13	39.1 Å²	39.1	8%	0.08	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.1	-178.7	50	0	0	0	0	111.9	A534 S535 Q538 E542 V553 V555	A534-T540 WeakPolarHBondContact CA-O 3.05Å; S535-T540 PolarHBondContact N-O 3.09Å; S535-T540 PolarHBondContact O-N 2.8Å; Q538-T540 VanDerWaalsContact C-N 3.29Å; Q538-T540 HydrophobicContact CB-CG2 4.24Å; Q538-T540 WeakPolarHBondContact CB-OG1 3.47Å; Q538-T540 PolarHBondContact O-N 2.83Å; T540-E542 PolarHBondContact OG1-OE1 2.04Å; T540-V553 HydrophobicContact CG2-CG1 3.83Å; T540-V555 CarbonylContact C-O 3.55Å; T540-V555 VanDerWaalsContact CA-O 3.25Å; T540-V555 WeakPolarHBondContact CA-O 3.16Å
541	I	96.3	Very high	92.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.6	155.6	-64	166.3	0	0	0	106.7	A534 L554 V555 L559 L565 M574 W576	A534-I541 HydrophobicContact CB-CG1 4.03Å; I541-L554 PolarHBondContact O-N 2.84Å; I541-V555 HydrophobicContact CB-CB 4.19Å; I541-V555 HydrophobicContact CB-CG2 4.44Å; I541-V555 PolarHBondContact N-O 3.29Å; I541-V555 PolarHBondContact O-N 2.77Å; I541-V555 VanDerWaalsContact O-N 3.16Å; I541-L559 HydrophobicContact CB-CD1 4.47Å; I541-L559 HydrophobicContact CD1-CD1 4.09Å; I541-L559 HydrophobicContact CD1-CD2 4.07Å; I541-L559 HydrophobicContact CG1-CD1 3.81Å; I541-L565 HydrophobicContact CG2-CD1 4.45Å; I541-M574 HydrophobicContact CG2-CE 4.13Å; I541-M574 HydrophobicContact CG2-SD 3.97Å; I541-W576 HydrophobicContact CD1-CB 4.25Å; I541-W576 HydrophobicContact CD1-CD2 3.54Å; I541-W576 HydrophobicContact CD1-CE3 3.9Å; I541-W576 HydrophobicContact CD1-CG 3.7Å; I541-W576 HydrophobicContact CD1-CZ2 4.43Å; I541-W576 HydrophobicContact CD1-CZ3 4.49Å
542	E	95.3	Very high	92.3	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.033	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	163.7	-169.9	-59.1	-171.7	-128.5	0	0	110.9	Y532 F533 T540 R551 D552 V553	Y532-E542 CarbonylContact C-O 3.57Å; Y532-E542 VanDerWaalsContact CA-O 3.27Å; Y532-E542 WeakPolarHBondContact CA-O 3.45Å; F533-E542 HydrophobicContact CD1-CB 4.44Å; F533-E542 HydrophobicContact CD2-CB 4.34Å; F533-E542 HydrophobicContact CE1-CB 3.9Å; F533-E542 HydrophobicContact CE2-CB 3.78Å; F533-E542 HydrophobicContact CE2-CG 4.32Å; F533-E542 HydrophobicContact CZ-CB 3.53Å; F533-E542 HydrophobicContact CZ-CG 4.38Å; F533-E542 PolarHBondContact N-O 3.42Å; F533-E542 PolarHBondContact O-N 2.85Å; T540-E542 PolarHBondContact OG1-OE1 2.04Å; E542-R551 VanDerWaalsContact CD-NH2 3.26Å; E542-R551 IonicContact OE1-NH2 3.71Å; E542-R551 PolarHBondContact OE1-NH2 2.93Å; E542-R551 VanDerWaalsContact OE1-NH2 3.09Å; E542-R551 IonicContact OE2-CZ 2.73Å; E542-R551 IonicContact OE2-NE 3.69Å; E542-R551 PolarHBondContact OE2-NE 2.93Å; E542-R551 IonicContact OE2-NH2 3.82Å; E542-R551 PolarHBondContact OE2-NH2 3.23Å; E542-D552 CarbonylContact C-O 3.53Å; E542-D552 VanDerWaalsContact CA-O 3.31Å; E542-D552 WeakPolarHBondContact CA-O 3.36Å; E542-V553 HydrophobicContact CG-CB 4.43Å; E542-V553 HydrophobicContact CG-CG1 4.33Å; E542-V553 HydrophobicContact CG-CG2 4.11Å
543	R	95.4	Very high	92.2	Very high	18 Å²	18	47.7 Å²	47.7	7%	0.068	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.9	-176.3	-176.6	177.8	72.7	-166.4	-3.4	110.3	R530 V531 Y532 R551 D552 L554 L589 D590	R530-R543 HydrophobicContact CB-CG 3.83Å; R530-R543 VanDerWaalsContact CD-CD 3.45Å; R530-R543 HydrophobicContact CG-CG 4.45Å; V531-R543 CarbonylContact O-C 3.51Å; V531-R543 WeakPolarHBondContact O-CA 3.07Å; Y532-R543 HydrophobicContact CD1-CB 4.14Å; Y532-R543 HydrophobicContact CD1-CG 4.1Å; Y532-R543 HydrophobicContact CD2-CG 4.47Å; Y532-R543 HydrophobicContact CE1-CB 4.25Å; Y532-R543 HydrophobicContact CE1-CG 3.89Å; Y532-R543 HydrophobicContact CE2-CG 4.23Å; Y532-R543 HydrophobicContact CG-CG 4.39Å; Y532-R543 WeakPolarHBondContact OH-CD 3.14Å; R543-R551 CarbonylContact O-C 3.6Å; R543-R551 VanDerWaalsContact O-CA 3.3Å; R543-R551 WeakPolarHBondContact O-CA 3.44Å; R543-D552 IonicContact CZ-OD2 3.51Å; R543-D552 PolarHBondContact N-O 2.03Å; R543-D552 IonicContact NE-OD2 3.86Å; R543-D552 PolarHBondContact NE-OD2 3.23Å; R543-D552 IonicContact NH2-OD2 3.71Å; R543-D552 PolarHBondContact NH2-OD2 3.09Å; R543-D552 PolarHBondContact O-N 3.49Å; R543-L554 HydrophobicContact CB-CD1 3.88Å; R543-L554 HydrophobicContact CB-CD2 4.37Å; R543-L554 HydrophobicContact CB-CG 4.13Å; R543-L589 PolarHBondContact NH1-O 3.43Å; R543-L589 VanDerWaalsContact NH1-O 3.11Å; R543-D590 IonicContact CZ-OD1 3.63Å; R543-D590 IonicContact NH1-OD1 3.71Å; R543-D590 PolarHBondContact NH1-OD1 3.04Å; R543-D590 IonicContact NH2-OD1 3.8Å
544	V	95.1	Very high	92.1	Very high	9 Å²	9	49 Å²	49	6%	0.055	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.3	169	63.6	0	0	0	0	110.4	V512 R530 V531 F533 S550	V512-V544 HydrophobicContact CG2-CB 4.14Å; V512-V544 HydrophobicContact CG2-CG1 3.83Å; V512-V544 HydrophobicContact CG2-CG2 4.36Å; R530-V544 CarbonylContact C-O 3.49Å; R530-V544 VanDerWaalsContact CA-O 3.3Å; R530-V544 WeakPolarHBondContact CA-O 3.41Å; V531-V544 HydrophobicContact CB-CG1 3.86Å; V531-V544 PolarHBondContact N-O 2.73Å; V531-V544 PolarHBondContact O-N 3.16Å; F533-V544 HydrophobicContact CE1-CB 4.49Å; F533-V544 HydrophobicContact CE1-CG1 4.32Å; V544-S550 WeakPolarHBondContact CA-O 3.02Å
545	D	90.1	Very high	92.1	Very high	14 Å²	14	49.3 Å²	49.3	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.6	174.9	-168.9	-65.2	0	0	0	110	R530 N547 T548 G549 S550	R530-D545 HydrophobicContact CG-CB 4.31Å; R530-D545 IonicContact CZ-OD2 2.59Å; R530-D545 IonicContact NE-OD2 3.28Å; R530-D545 PolarHBondContact NE-OD2 2.86Å; R530-D545 IonicContact NH2-OD2 2.76Å; D545-N547 VanDerWaalsContact C-N 3.27Å; D545-N547 PolarHBondContact O-N 2.84Å; D545-N547 WeakPolarHBondContact OD1-CB 3.33Å; D545-N547 PolarHBondContact OD1-N 2.95Å; D545-N547 PolarHBondContact OD1-ND2 3.23Å; D545-T548 WeakPolarHBondContact CB-OG1 3.17Å; D545-T548 PolarHBondContact OD1-N 2.79Å; D545-G549 VanDerWaalsContact O-CA 3.24Å; D545-G549 WeakPolarHBondContact O-CA 3.26Å; D545-G549 PolarHBondContact O-N 2.91Å; D545-S550 WeakPolarHBondContact CB-OG 3.39Å; D545-S550 PolarHBondContact N-O 2.97Å
546	L	87.6	Confident	92.2	Very high	55 Å²	55	53.3 Å²	53.3	29%	0.288	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.2	-174.9	-65.3	-177.7	0	0	0	113.6	I491 L511 F524 H529 V531	I491-L546 HydrophobicContact CD1-CD1 4.16Å; L511-L546 HydrophobicContact CD1-CD2 3.78Å; L511-L546 HydrophobicContact CD2-CD2 4.3Å; F524-L546 HydrophobicContact CD2-CD1 4.26Å; F524-L546 HydrophobicContact CE2-CD1 3.73Å; H529-L546 WeakPolarHBondContact O-CB 3.32Å; H529-L546 WeakPolarHBondContact O-CG 3.32Å; H529-L546 PolarHBondContact O-N 3.07Å; V531-L546 HydrophobicContact CG2-CD1 4.05Å; V531-L546 HydrophobicContact CG2-CD2 3.77Å; V531-L546 HydrophobicContact CG2-CG 4.02Å
547	N	84.6	Confident	92	Very high	117 Å²	117	57 Å²	57	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-41.3	-179.8	-53.5	-67.5	0	0	0	111.7	D545	D545-N547 VanDerWaalsContact C-N 3.27Å; D545-N547 PolarHBondContact O-N 2.84Å; D545-N547 WeakPolarHBondContact OD1-CB 3.33Å; D545-N547 PolarHBondContact OD1-N 2.95Å; D545-N547 PolarHBondContact OD1-ND2 3.23Å
548	T	88.3	Confident	91.8	Very high	102 Å²	102	56 Å²	56	63%	0.626	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-20.9	-175.3	64.8	0	0	0	0	113.6	D545 S550	D545-T548 WeakPolarHBondContact CB-OG1 3.17Å; D545-T548 PolarHBondContact OD1-N 2.79Å; T548-S550 PolarHBondContact O-N 2.77Å; T548-S550 WeakPolarHBondContact OG1-CB 3.34Å; T548-S550 PolarHBondContact OG1-N 3.43Å; T548-S550 VanDerWaalsContact OG1-N 3.14Å; T548-S550 PolarHBondContact OG1-OG 2.65Å
549	G	87.4	Confident	92	Very high	54 Å²	54	52.1 Å²	52.1	56%	0.557	30%	0.299	S	S	*	.			trans	71.9	9.2	-169.1	0	0	0	0	0	114.3	D545	D545-G549 VanDerWaalsContact O-CA 3.24Å; D545-G549 WeakPolarHBondContact O-CA 3.26Å; D545-G549 PolarHBondContact O-N 2.91Å
550	S	90.6	Very high	92	Very high	51 Å²	51	49.2 Å²	49.2	36%	0.357	29%	0.292	S	S	.	.			trans	-66.6	134.5	178	59.6	0	0	0	0	111.1	V544 D545 T548	V544-S550 WeakPolarHBondContact CA-O 3.02Å; D545-S550 WeakPolarHBondContact CB-OG 3.39Å; D545-S550 PolarHBondContact N-O 2.97Å; T548-S550 PolarHBondContact O-N 2.77Å; T548-S550 WeakPolarHBondContact OG1-CB 3.34Å; T548-S550 PolarHBondContact OG1-N 3.43Å; T548-S550 VanDerWaalsContact OG1-N 3.14Å; T548-S550 PolarHBondContact OG1-OG 2.65Å
551	R	92.9	Very high	92	Very high	98 Å²	98	49.2 Å²	49.2	37%	0.37	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123.8	-179.5	-178.8	178.5	174.5	-176.5	-1.9	110.4	E514 E542 R543	E514-R551 IonicContact OE2-CZ 3.01Å; E514-R551 VanDerWaalsContact OE2-CZ 3.27Å; E514-R551 IonicContact OE2-NH1 3.88Å; E514-R551 PolarHBondContact OE2-NH1 2.97Å; E514-R551 IonicContact OE2-NH2 2.81Å; E514-R551 PolarHBondContact OE2-NH2 3.26Å; E542-R551 VanDerWaalsContact CD-NH2 3.26Å; E542-R551 IonicContact OE1-NH2 3.71Å; E542-R551 PolarHBondContact OE1-NH2 2.93Å; E542-R551 VanDerWaalsContact OE1-NH2 3.09Å; E542-R551 IonicContact OE2-CZ 2.73Å; E542-R551 IonicContact OE2-NE 3.69Å; E542-R551 PolarHBondContact OE2-NE 2.93Å; E542-R551 IonicContact OE2-NH2 3.82Å; E542-R551 PolarHBondContact OE2-NH2 3.23Å; R543-R551 CarbonylContact O-C 3.6Å; R543-R551 VanDerWaalsContact O-CA 3.3Å; R543-R551 WeakPolarHBondContact O-CA 3.44Å
552	D	93.9	Very high	91.9	Very high	60 Å²	60	49.2 Å²	49.2	32%	0.321	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.9	178.5	-54.6	-41.6	0	0	0	110.5	E542 R543 L554	E542-D552 CarbonylContact C-O 3.53Å; E542-D552 VanDerWaalsContact CA-O 3.31Å; E542-D552 WeakPolarHBondContact CA-O 3.36Å; R543-D552 IonicContact CZ-OD2 3.51Å; R543-D552 PolarHBondContact N-O 2.03Å; R543-D552 IonicContact NE-OD2 3.86Å; R543-D552 PolarHBondContact NE-OD2 3.23Å; R543-D552 IonicContact NH2-OD2 3.71Å; R543-D552 PolarHBondContact NH2-OD2 3.09Å; R543-D552 PolarHBondContact O-N 3.49Å; D552-L554 HydrophobicContact CB-CD2 4.13Å
553	V	94.9	Very high	91.8	Very high	84 Å²	84	49.8 Å²	49.8	51%	0.509	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.9	166.6	-176.4	0	0	0	0	108.1	T540 E542	T540-V553 HydrophobicContact CG2-CG1 3.83Å; E542-V553 HydrophobicContact CG-CB 4.43Å; E542-V553 HydrophobicContact CG-CG1 4.33Å; E542-V553 HydrophobicContact CG-CG2 4.11Å
554	L	95.9	Very high	91.8	Very high	27 Å²	27	49.2 Å²	49.2	14%	0.141	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-39.5	-173.8	-55.6	-177.9	0	0	0	112.8	Y532 I541 R543 D552 M574 L589	Y532-L554 HydrophobicContact CD1-CD1 3.62Å; Y532-L554 HydrophobicContact CE1-CD1 3.59Å; I541-L554 PolarHBondContact O-N 2.84Å; R543-L554 HydrophobicContact CB-CD1 3.88Å; R543-L554 HydrophobicContact CB-CD2 4.37Å; R543-L554 HydrophobicContact CB-CG 4.13Å; D552-L554 HydrophobicContact CB-CD2 4.13Å; L554-M574 HydrophobicContact CB-CE 4.17Å; L554-M574 HydrophobicContact CD1-CE 4.11Å; L554-M574 HydrophobicContact CD1-SD 4.22Å; L554-L589 WeakPolarHBondContact CD1-O 3.33Å
555	V	94.9	Very high	92	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.036	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.9	177.5	-173.2	0	0	0	0	107.5	T540 I541 L559 M574	T540-V555 CarbonylContact C-O 3.55Å; T540-V555 VanDerWaalsContact CA-O 3.25Å; T540-V555 WeakPolarHBondContact CA-O 3.16Å; I541-V555 HydrophobicContact CB-CB 4.19Å; I541-V555 HydrophobicContact CB-CG2 4.44Å; I541-V555 PolarHBondContact N-O 3.29Å; I541-V555 PolarHBondContact O-N 2.77Å; I541-V555 VanDerWaalsContact O-N 3.16Å; V555-L559 HydrophobicContact CB-CD1 4Å; V555-L559 HydrophobicContact CG1-CD1 3.68Å; V555-L559 HydrophobicContact CG1-CD2 4.46Å; V555-L559 HydrophobicContact CG1-CG 3.94Å; V555-M574 HydrophobicContact CG2-CE 3.76Å
556	S	93	Very high	92.3	Very high	84 Å²	84	48.8 Å²	48.8	59%	0.587	29%	0.292	S	S	*	.			trans	-138.4	-2.9	180	56.9	0	0	0	0	113.3
557	D	89	Confident	92.7	Very high	111 Å²	111	46.2 Å²	46.2	59%	0.594	28%	0.279	S	S	*	.	S	Bend	trans	-117.7	150	179.9	68.8	-52.7	0	0	0	111.1	L559 R594	D557-L559 PolarHBondContact O-N 2.93Å; D557-L559 VanDerWaalsContact O-N 3.08Å; D557-R594 PolarHBondContact O-NH1 3.28Å
558	G	85.3	Confident	93.1	Very high	39 Å²	39	40.6 Å²	40.6	40%	0.402	25%	0.249	S	C	.	.	S	Bend	trans	60.9	21.6	175.1	0	0	0	0	0	115.5	K581 R594	G558-K581 WeakPolarHBondContact O-CE 3.48Å; G558-K581 PolarHBondContact O-NZ 2.81Å; G558-R594 PolarHBondContact O-NH2 2.82Å
559	L	93	Very high	93.2	Very high	6 Å²	6	36 Å²	36	3%	0.031	22%	0.22	C	C	.	.			trans	-103.3	143.4	168.4	-65.7	171.3	0	0	0	109.8	R539 I541 V555 D557 P562 W576	R539-L559 HydrophobicContact CB-CB 4.24Å; R539-L559 WeakPolarHBondContact CD-O 3.21Å; R539-L559 WeakPolarHBondContact O-CD1 3.09Å; I541-L559 HydrophobicContact CB-CD1 4.47Å; I541-L559 HydrophobicContact CD1-CD1 4.09Å; I541-L559 HydrophobicContact CD1-CD2 4.07Å; I541-L559 HydrophobicContact CG1-CD1 3.81Å; V555-L559 HydrophobicContact CB-CD1 4Å; V555-L559 HydrophobicContact CG1-CD1 3.68Å; V555-L559 HydrophobicContact CG1-CD2 4.46Å; V555-L559 HydrophobicContact CG1-CG 3.94Å; D557-L559 PolarHBondContact O-N 2.93Å; D557-L559 VanDerWaalsContact O-N 3.08Å; L559-P562 HydrophobicContact CD2-CB 4.46Å; L559-W576 HydrophobicContact CD2-CZ2 4.37Å; L559-W576 VanDerWaalsContact CD2-NE1 3.28Å
560	E	93.5	Very high	93	Very high	79 Å²	79	36.2 Å²	36.2	37%	0.369	21%	0.21	S	C	.	.	S	Bend	trans	-125.9	-58.6	176.3	-78.2	168.8	-130.7	0	0	112.7	D578 K581	E560-D578 PolarHBondContact N-OD2 3.08Å; E560-K581 HydrophobicContact CB-CG 4.3Å; E560-K581 HydrophobicContact CG-CG 4.45Å; E560-K581 WeakPolarHBondContact OE1-CE 3.19Å; E560-K581 IonicContact OE1-NZ 2.66Å; E560-K581 PolarHBondContact OE1-NZ 3.16Å
561	S	94.5	Very high	92.6	Very high	13 Å²	13	37.3 Å²	37.3	9%	0.091	21%	0.21	C	C	.	.			trans	-139.4	75.9	173.2	-161.9	0	0	0	0	111.4	E563 D578 R579 S580	S561-E563 PolarHBondContact O-N 3.04Å; S561-E563 VanDerWaalsContact O-N 3.14Å; S561-E563 PolarHBondContact OG-OE1 3.28Å; S561-D578 PolarHBondContact N-OD1 3.05Å; S561-D578 PolarHBondContact N-OD2 3.11Å; S561-D578 WeakPolarHBondContact O-CA 3.39Å; S561-R579 PolarHBondContact O-N 3.25Å; S561-S580 WeakPolarHBondContact CB-OG 3.22Å
562	P	94.9	Very high	92.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	103.6	174.9	29.1	-34.4	0	0	0	110.6	A534 I536 L559 T577	A534-P562 HydrophobicContact CB-CB 3.82Å; A534-P562 HydrophobicContact CB-CG 3.88Å; I536-P562 HydrophobicContact CG1-CG 4.49Å; L559-P562 HydrophobicContact CD2-CB 4.46Å; P562-T577 VanDerWaalsContact CA-O 3.29Å; P562-T577 WeakPolarHBondContact CA-O 3.36Å
563	E	93.9	Very high	92.1	Very high	19 Å²	19	35.8 Å²	35.8	9%	0.089	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-13.8	-171.7	-77.4	-175.5	-139.7	0	0	114.3	L520 I536 S561 T577 R579 R606	L520-E563 HydrophobicContact CD1-CG 4.42Å; I536-E563 HydrophobicContact CD1-CG 3.74Å; S561-E563 PolarHBondContact O-N 3.04Å; S561-E563 VanDerWaalsContact O-N 3.14Å; S561-E563 PolarHBondContact OG-OE1 3.28Å; E563-T577 PolarHBondContact N-O 3.41Å; E563-R579 HydrophobicContact CG-CB 4.5Å; E563-R579 WeakPolarHBondContact OE1-CD 3.21Å; E563-R579 IonicContact OE1-NH1 3.62Å; E563-R579 IonicContact OE2-NH1 3.46Å; E563-R606 IonicContact OE2-CZ 3.9Å; E563-R606 IonicContact OE2-NE 2.68Å; E563-R606 PolarHBondContact OE2-NE 2.82Å; E563-R606 IonicContact OE2-NH2 3.76Å; E563-R606 PolarHBondContact OE2-NH2 3.4Å
564	G	95.3	Very high	92.1	Very high	6 Å²	6	31.8 Å²	31.8	6%	0.062	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	150.2	173.2	0	0	0	0	0	112	W576 T577 R606 I608	G564-W576 VanDerWaalsContact O-CA 3.24Å; G564-W576 WeakPolarHBondContact O-CA 3.48Å; G564-W576 VanDerWaalsContact O-CB 3.27Å; G564-W576 WeakPolarHBondContact O-CB 3.01Å; G564-T577 WeakPolarHBondContact CA-OG1 3.38Å; G564-T577 PolarHBondContact N-OG1 3.13Å; G564-T577 PolarHBondContact O-N 2.88Å; G564-T577 VanDerWaalsContact O-N 3.11Å; G564-T577 PolarHBondContact O-OG1 2.78Å; G564-R606 WeakPolarHBondContact CA-O 3.43Å; G564-I608 VanDerWaalsContact C-CG2 3.45Å
565	L	97.6	Very high	92.2	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.058	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	132.1	-174.9	-177.9	66.2	0	0	0	109.4	A521 I541 Y575 W576	A521-L565 HydrophobicContact CB-CB 3.81Å; I541-L565 HydrophobicContact CG2-CD1 4.45Å; L565-Y575 CarbonylContact C-O 3.57Å; L565-Y575 WeakPolarHBondContact CA-O 3.37Å; L565-W576 HydrophobicContact CD1-CB 4.04Å
566	A	97.6	Very high	92.4	Very high	3 Å²	3	30.2 Å²	30.2	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129	177.5	0	0	0	0	0	111.1	M574 Y575 I608 V610	A566-M574 WeakPolarHBondContact O-CA 3.36Å; A566-Y575 PolarHBondContact N-O 3.23Å; A566-Y575 PolarHBondContact O-N 3.01Å; A566-I608 HydrophobicContact CB-CG1 4.22Å; A566-I608 HydrophobicContact CB-CG2 4.09Å; A566-V610 HydrophobicContact CB-CB 4.46Å; A566-V610 HydrophobicContact CB-CG1 4.23Å
567	I	96.4	Very high	92.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.8	178.4	-59.6	-55.5	0	0	0	109.5	D523 D525 Y532 W569 M574 L589 V610	D523-I567 HydrophobicContact CB-CG1 3.98Å; D523-I567 WeakPolarHBondContact OD2-CB 3.3Å; D523-I567 PolarHBondContact OD2-N 3.49Å; D525-I567 HydrophobicContact CB-CG2 4.23Å; Y532-I567 HydrophobicContact CD1-CD1 3.99Å; Y532-I567 HydrophobicContact CD2-CD1 3.8Å; Y532-I567 HydrophobicContact CD2-CG1 3.95Å; Y532-I567 HydrophobicContact CE1-CD1 4.43Å; Y532-I567 HydrophobicContact CE2-CD1 4.31Å; Y532-I567 HydrophobicContact CG-CD1 3.66Å; Y532-I567 HydrophobicContact CG-CG1 4.22Å; I567-W569 WeakPolarHBondContact O-CZ3 3.26Å; I567-M574 HydrophobicContact CD1-CB 3.52Å; I567-L589 HydrophobicContact CD1-CD2 4.1Å; I567-L589 HydrophobicContact CG2-CD2 3.88Å; I567-V610 WeakPolarHBondContact O-CG1 3.45Å
568	D	93	Very high	92.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	95.6	165.3	-177.1	-17.9	0	0	0	108.6	V570 H571 H572 R573 Y575 V610 P612	D568-V570 PolarHBondContact O-N 2.96Å; D568-V570 PolarHBondContact OD1-N 2.92Å; D568-V570 VanDerWaalsContact OD1-N 3.08Å; D568-H571 IonicContact OD1-CG 3.58Å; D568-H571 PolarHBondContact OD1-N 3.07Å; D568-H571 IonicContact OD1-ND1 3.75Å; D568-H571 PolarHBondContact OD1-ND1 3.01Å; D568-H571 WeakPolarHBondContact OD2-CB 3.49Å; D568-H571 IonicContact OD2-CE1 2.7Å; D568-H571 IonicContact OD2-CG 2.74Å; D568-H571 IonicContact OD2-ND1 3.94Å; D568-H571 PolarHBondContact OD2-ND1 3.44Å; D568-H572 WeakPolarHBondContact O-CA 3.32Å; D568-H572 PolarHBondContact O-N 3.29Å; D568-R573 HydrophobicContact CB-CB 4.34Å; D568-R573 PolarHBondContact N-O 3.34Å; D568-R573 PolarHBondContact O-N 3.06Å; D568-R573 VanDerWaalsContact O-N 3.14Å; D568-Y575 HydrophobicContact CB-CE2 4.07Å; D568-V610 HydrophobicContact CB-CG1 4.25Å; D568-V610 HydrophobicContact CB-CG2 4.28Å; D568-P612 WeakPolarHBondContact OD1-CB 3.3Å; D568-P612 WeakPolarHBondContact OD1-CG 3.44Å
569	W	89.3	Confident	93.4	Very high	5 Å²	5	22.3 Å²	22.3	2%	0.019	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.2	-178.6	59.8	88.7	0	0	0	113.8	P526 V527 I567 V610 P612 F656 K744 P745 A747	P526-W569 HydrophobicContact CG-CB 4.15Å; P526-W569 HydrophobicContact CG-CG 4.13Å; V527-W569 HydrophobicContact CG2-CB 4.25Å; I567-W569 WeakPolarHBondContact O-CZ3 3.26Å; W569-V610 HydrophobicContact CZ3-CG1 4.38Å; W569-P612 HydrophobicContact CD2-CG 4.42Å; W569-P612 HydrophobicContact CE3-CG 4.49Å; W569-P612 HydrophobicContact CH2-CG 4Å; W569-P612 HydrophobicContact CZ2-CG 3.93Å; W569-P612 HydrophobicContact CZ3-CG 4.28Å; W569-F656 HydrophobicContact CH2-CE1 4.27Å; W569-F656 HydrophobicContact CH2-CE2 4.18Å; W569-F656 AromaticContact CH2-CZ 3.7Å; W569-F656 HydrophobicContact CH2-CZ 3.7Å; W569-F656 HydrophobicContact CZ2-CZ 4.45Å; W569-K744 HydrophobicContact CD2-CB 3.92Å; W569-K744 HydrophobicContact CD2-CD 4.09Å; W569-K744 HydrophobicContact CD2-CG 4.3Å; W569-K744 HydrophobicContact CE3-CB 4.08Å; W569-K744 HydrophobicContact CE3-CD 3.48Å; W569-K744 VanDerWaalsContact CE3-CD 3.48Å; W569-K744 HydrophobicContact CE3-CG 3.93Å; W569-K744 HydrophobicContact CH2-CB 3.97Å; W569-K744 HydrophobicContact CH2-CD 4.21Å; W569-K744 HydrophobicContact CH2-CG 3.79Å; W569-K744 HydrophobicContact CZ2-CB 3.77Å; W569-K744 HydrophobicContact CZ2-CG 4.13Å; W569-K744 HydrophobicContact CZ3-CB 4.12Å; W569-K744 HydrophobicContact CZ3-CD 3.56Å; W569-K744 HydrophobicContact CZ3-CG 3.68Å; W569-K744 PolarHBondContact NE1-O 3.47Å; W569-P745 VanDerWaalsContact CE2-O 3.3Å; W569-P745 WeakPolarHBondContact CZ2-O 3.39Å; W569-P745 PolarHBondContact NE1-O 2.05Å; W569-A747 VanDerWaalsContact CD1-N 3.33Å
570	V	83.4	Confident	93.4	Very high	59 Å²	59	25.5 Å²	25.5	36%	0.358	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-43.1	-179.8	-178.4	0	0	0	0	110.8	D568 P612	D568-V570 PolarHBondContact O-N 2.96Å; D568-V570 PolarHBondContact OD1-N 2.92Å; D568-V570 VanDerWaalsContact OD1-N 3.08Å; V570-P612 HydrophobicContact CB-CB 3.78Å; V570-P612 HydrophobicContact CB-CG 4.47Å; V570-P612 HydrophobicContact CG2-CB 3.69Å; V570-P612 HydrophobicContact CG2-CG 4.12Å
571	H	81.5	Confident	93.5	Very high	74 Å²	74	24.7 Å²	24.7	34%	0.343	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	3.7	178.1	-51.1	101.3	0	0	0	113.5	D568 P612	D568-H571 IonicContact OD1-CG 3.58Å; D568-H571 PolarHBondContact OD1-N 3.07Å; D568-H571 IonicContact OD1-ND1 3.75Å; D568-H571 PolarHBondContact OD1-ND1 3.01Å; D568-H571 WeakPolarHBondContact OD2-CB 3.49Å; D568-H571 IonicContact OD2-CE1 2.7Å; D568-H571 IonicContact OD2-CG 2.74Å; D568-H571 IonicContact OD2-ND1 3.94Å; D568-H571 PolarHBondContact OD2-ND1 3.44Å; H571-P612 PolarHBondContact CE1-O 2.84Å
572	H	86.5	Confident	93.6	Very high	78 Å²	78	25.8 Å²	25.8	36%	0.361	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	53	-179.7	-55.3	-65.6	0	0	0	113.4	D568 L589	D568-H572 WeakPolarHBondContact O-CA 3.32Å; D568-H572 PolarHBondContact O-N 3.29Å; H572-L589 HydrophobicContact CB-CD1 3.97Å; H572-L589 HydrophobicContact CB-CG 4.27Å; H572-L589 PolarHBondContact O-N 3.28Å
573	R	90.1	Very high	93.6	Very high	48 Å²	48	26 Å²	26	18%	0.181	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	155.5	177.7	-68.4	-174.4	-69	-174.5	-0.6	111.6	D568 Y575 S587 L589 E634	D568-R573 HydrophobicContact CB-CB 4.34Å; D568-R573 PolarHBondContact N-O 3.34Å; D568-R573 PolarHBondContact O-N 3.06Å; D568-R573 VanDerWaalsContact O-N 3.14Å; R573-Y575 HydrophobicContact CB-CE2 3.97Å; R573-Y575 PolarHBondContact NE-OH 3.49Å; R573-Y575 PolarHBondContact NH1-OH 3.31Å; R573-Y575 PolarHBondContact NH2-OH 3.47Å; R573-S587 CarbonylContact C-O 3.56Å; R573-S587 VanDerWaalsContact CA-O 3.28Å; R573-S587 WeakPolarHBondContact CA-O 3.39Å; R573-S587 WeakPolarHBondContact CB-O 3.49Å; R573-L589 WeakPolarHBondContact O-CD2 3.34Å; R573-E634 IonicContact CZ-OE1 2.73Å; R573-E634 IonicContact NH1-OE1 3.81Å; R573-E634 PolarHBondContact NH1-OE1 2.55Å; R573-E634 IonicContact NH2-OE1 3.61Å
574	M	96.1	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143	167.1	64.7	-179.3	-179.9	0	0	110.4	Y532 I541 L554 V555 A566 I567 W576 C586 S587 L589	Y532-M574 HydrophobicContact CD1-SD 4.2Å; I541-M574 HydrophobicContact CG2-CE 4.13Å; I541-M574 HydrophobicContact CG2-SD 3.97Å; L554-M574 HydrophobicContact CB-CE 4.17Å; L554-M574 HydrophobicContact CD1-CE 4.11Å; L554-M574 HydrophobicContact CD1-SD 4.22Å; V555-M574 HydrophobicContact CG2-CE 3.76Å; A566-M574 WeakPolarHBondContact O-CA 3.36Å; I567-M574 HydrophobicContact CD1-CB 3.52Å; M574-W576 HydrophobicContact CE-CZ3 4.37Å; M574-W576 HydrophobicContact CG-CE3 4.33Å; M574-W576 HydrophobicContact CG-CZ3 4.13Å; M574-C586 CarbonylContact O-C 3.59Å; M574-C586 WeakPolarHBondContact O-CA 3.17Å; M574-C586 WeakPolarHBondContact O-CB 3.41Å; M574-S587 WeakPolarHBondContact CE-OG 3.29Å; M574-S587 PolarHBondContact N-O 3.12Å; M574-S587 PolarHBondContact O-N 2.68Å; M574-L589 HydrophobicContact CB-CD2 4.33Å
575	Y	98	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.1	179.7	-66.3	-96	0	0	0	108.8	L565 A566 D568 R573 D585 C586 V597 L617 L633	L565-Y575 CarbonylContact C-O 3.57Å; L565-Y575 WeakPolarHBondContact CA-O 3.37Å; A566-Y575 PolarHBondContact N-O 3.23Å; A566-Y575 PolarHBondContact O-N 3.01Å; D568-Y575 HydrophobicContact CB-CE2 4.07Å; R573-Y575 HydrophobicContact CB-CE2 3.97Å; R573-Y575 PolarHBondContact NE-OH 3.49Å; R573-Y575 PolarHBondContact NH1-OH 3.31Å; R573-Y575 PolarHBondContact NH2-OH 3.47Å; Y575-D585 CarbonylContact C-O 3.57Å; Y575-D585 WeakPolarHBondContact CA-O 3.28Å; Y575-C586 HydrophobicContact CD1-CB 3.42Å; Y575-C586 VanDerWaalsContact CD1-CB 3.42Å; Y575-C586 HydrophobicContact CE1-CB 3.53Å; Y575-C586 HydrophobicContact CG-CB 4.03Å; Y575-V597 HydrophobicContact CD1-CG2 4.3Å; Y575-V597 HydrophobicContact CE1-CG2 4.12Å; Y575-L617 HydrophobicContact CD1-CD1 4.04Å; Y575-L617 HydrophobicContact CD1-CD2 3.78Å; Y575-L617 HydrophobicContact CD2-CD1 4.34Å; Y575-L617 HydrophobicContact CE1-CD2 4.2Å; Y575-L617 HydrophobicContact CG-CD1 3.93Å; Y575-L617 HydrophobicContact CG-CD2 4.45Å; Y575-L633 WeakPolarHBondContact CE1-O 3.27Å; Y575-L633 PolarHBondContact OH-O 2.03Å
576	W	97.6	Very high	93.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.3	176.9	65.9	92.8	0	0	0	112.4	I541 L559 G564 L565 M574 V584 D585 S587 R594	I541-W576 HydrophobicContact CD1-CB 4.25Å; I541-W576 HydrophobicContact CD1-CD2 3.54Å; I541-W576 HydrophobicContact CD1-CE3 3.9Å; I541-W576 HydrophobicContact CD1-CG 3.7Å; I541-W576 HydrophobicContact CD1-CZ2 4.43Å; I541-W576 HydrophobicContact CD1-CZ3 4.49Å; L559-W576 HydrophobicContact CD2-CZ2 4.37Å; L559-W576 VanDerWaalsContact CD2-NE1 3.28Å; G564-W576 VanDerWaalsContact O-CA 3.24Å; G564-W576 WeakPolarHBondContact O-CA 3.48Å; G564-W576 VanDerWaalsContact O-CB 3.27Å; G564-W576 WeakPolarHBondContact O-CB 3.01Å; L565-W576 HydrophobicContact CD1-CB 4.04Å; M574-W576 HydrophobicContact CE-CZ3 4.37Å; M574-W576 HydrophobicContact CG-CE3 4.33Å; M574-W576 HydrophobicContact CG-CZ3 4.13Å; W576-V584 WeakPolarHBondContact O-CG1 3.3Å; W576-D585 HydrophobicContact CD2-CB 3.96Å; W576-D585 HydrophobicContact CG-CB 4.46Å; W576-D585 HydrophobicContact CH2-CB 4.14Å; W576-D585 HydrophobicContact CZ2-CB 3.5Å; W576-D585 VanDerWaalsContact CZ2-CB 3.5Å; W576-D585 PolarHBondContact N-O 3.37Å; W576-D585 PolarHBondContact O-N 2.93Å; W576-S587 WeakPolarHBondContact CZ3-OG 3.36Å; W576-R594 HydrophobicContact CH2-CG 4.14Å; W576-R594 HydrophobicContact CZ2-CG 4.34Å
577	T	97.3	Very high	93.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.4	172.6	46.9	0	0	0	0	108.8	P562 E563 G564 V584 P605 R606 I608	P562-T577 VanDerWaalsContact CA-O 3.29Å; P562-T577 WeakPolarHBondContact CA-O 3.36Å; E563-T577 PolarHBondContact N-O 3.41Å; G564-T577 WeakPolarHBondContact CA-OG1 3.38Å; G564-T577 PolarHBondContact N-OG1 3.13Å; G564-T577 PolarHBondContact O-N 2.88Å; G564-T577 VanDerWaalsContact O-N 3.11Å; G564-T577 PolarHBondContact O-OG1 2.78Å; T577-V584 HydrophobicContact CG2-CG2 3.63Å; T577-P605 HydrophobicContact CG2-CB 3.88Å; T577-R606 WeakPolarHBondContact CB-O 3.04Å; T577-R606 WeakPolarHBondContact CG2-O 3.37Å; T577-R606 PolarHBondContact OG1-O 2.89Å; T577-I608 HydrophobicContact CG2-CB 3.86Å; T577-I608 HydrophobicContact CG2-CD1 4.16Å; T577-I608 HydrophobicContact CG2-CG1 4.49Å; T577-I608 HydrophobicContact CG2-CG2 4.21Å
578	D	96.5	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	108.3	168.1	-168.3	-37.8	0	0	0	109.1	E560 S561 S580 K581 S582 A583	E560-D578 PolarHBondContact N-OD2 3.08Å; S561-D578 PolarHBondContact N-OD1 3.05Å; S561-D578 PolarHBondContact N-OD2 3.11Å; S561-D578 WeakPolarHBondContact O-CA 3.39Å; D578-S580 PolarHBondContact OD1-N 3.03Å; D578-K581 HydrophobicContact CB-CB 4.08Å; D578-K581 HydrophobicContact CB-CD 4.24Å; D578-K581 HydrophobicContact CB-CG 4.35Å; D578-K581 PolarHBondContact O-N 3.29Å; D578-K581 PolarHBondContact OD1-N 2.91Å; D578-K581 WeakPolarHBondContact OD2-CD 3.24Å; D578-K581 WeakPolarHBondContact OD2-CE 3.48Å; D578-S582 PolarHBondContact O-N 2.85Å; D578-S582 VanDerWaalsContact O-N 3.08Å; D578-A583 PolarHBondContact N-O 3.29Å; D578-A583 PolarHBondContact O-N 3.16Å
579	R	95	Very high	93.5	Very high	68 Å²	68	27.2 Å²	27.2	26%	0.257	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-46.8	-174.7	-179.1	-170.2	174.6	159.5	5.2	111.4	S561 E563 K581 S582 E604	S561-R579 PolarHBondContact O-N 3.25Å; E563-R579 HydrophobicContact CG-CB 4.5Å; E563-R579 WeakPolarHBondContact OE1-CD 3.21Å; E563-R579 IonicContact OE1-NH1 3.62Å; E563-R579 IonicContact OE2-NH1 3.46Å; R579-K581 PolarHBondContact O-N 2.99Å; R579-S582 PolarHBondContact O-N 2.7Å; R579-E604 HydrophobicContact CG-CB 4Å; R579-E604 HydrophobicContact CG-CG 4.3Å; R579-E604 IonicContact CZ-OE1 3.38Å; R579-E604 IonicContact CZ-OE2 3.83Å; R579-E604 IonicContact NE-OE1 3.57Å; R579-E604 PolarHBondContact NE-OE1 2.82Å; R579-E604 IonicContact NE-OE2 3.83Å; R579-E604 PolarHBondContact NE-OE2 2.95Å; R579-E604 IonicContact NH2-OE1 2.76Å; R579-E604 PolarHBondContact NH2-OE1 2.88Å; R579-E604 IonicContact NH2-OE2 2.65Å; R579-E604 PolarHBondContact NH2-OE2 3.35Å
580	S	94.3	Very high	93.6	Very high	73 Å²	73	31.3 Å²	31.3	51%	0.51	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.2	-175.9	-62	0	0	0	0	112.8	S561 D578	S561-S580 WeakPolarHBondContact CB-OG 3.22Å; D578-S580 PolarHBondContact OD1-N 3.03Å
581	K	94.8	Very high	94	Very high	62 Å²	62	29.1 Å²	29.1	27%	0.27	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.1	176.4	-63.5	-179.3	-175.3	-101.6	0	114.1	G558 E560 D578 R579 A583	G558-K581 WeakPolarHBondContact O-CE 3.48Å; G558-K581 PolarHBondContact O-NZ 2.81Å; E560-K581 HydrophobicContact CB-CG 4.3Å; E560-K581 HydrophobicContact CG-CG 4.45Å; E560-K581 WeakPolarHBondContact OE1-CE 3.19Å; E560-K581 IonicContact OE1-NZ 2.66Å; E560-K581 PolarHBondContact OE1-NZ 3.16Å; D578-K581 HydrophobicContact CB-CB 4.08Å; D578-K581 HydrophobicContact CB-CD 4.24Å; D578-K581 HydrophobicContact CB-CG 4.35Å; D578-K581 PolarHBondContact O-N 3.29Å; D578-K581 PolarHBondContact OD1-N 2.91Å; D578-K581 WeakPolarHBondContact OD2-CD 3.24Å; D578-K581 WeakPolarHBondContact OD2-CE 3.48Å; R579-K581 PolarHBondContact O-N 2.99Å; K581-A583 VanDerWaalsContact C-N 3.31Å; K581-A583 HydrophobicContact CB-CB 3.97Å; K581-A583 PolarHBondContact O-N 2.64Å
582	S	95.5	Very high	94.4	Very high	36 Å²	36	31.3 Å²	31.3	25%	0.252	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	51.2	-172.1	-46.5	0	0	0	0	111.1	D578 R579 L602 E603	D578-S582 PolarHBondContact O-N 2.85Å; D578-S582 VanDerWaalsContact O-N 3.08Å; R579-S582 PolarHBondContact O-N 2.7Å; S582-L602 WeakPolarHBondContact CB-O 3.2Å; S582-L602 VanDerWaalsContact O-CB 3.31Å; S582-L602 WeakPolarHBondContact O-CB 3.3Å; S582-L602 WeakPolarHBondContact O-CD1 3.49Å; S582-E603 WeakPolarHBondContact CB-O 3.32Å; S582-E603 PolarHBondContact OG-O 2.84Å
583	A	96.1	Very high	94.6	Very high	5 Å²	5	36.5 Å²	36.5	4%	0.041	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.6	-167	0	0	0	0	0	115.7	D578 K581 T596	D578-A583 PolarHBondContact N-O 3.29Å; D578-A583 PolarHBondContact O-N 3.16Å; K581-A583 VanDerWaalsContact C-N 3.31Å; K581-A583 HydrophobicContact CB-CB 3.97Å; K581-A583 PolarHBondContact O-N 2.64Å; A583-T596 HydrophobicContact CB-CG2 4.49Å
584	V	97.4	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	83.6	152.6	-142.7	0	0	0	0	116.1	W576 T577 V597 V598 L602 P605 I608 L617	W576-V584 WeakPolarHBondContact O-CG1 3.3Å; T577-V584 HydrophobicContact CG2-CG2 3.63Å; V584-V597 WeakPolarHBondContact O-CA 3.4Å; V584-V597 WeakPolarHBondContact O-CB 3.41Å; V584-V597 PolarHBondContact O-N 3.21Å; V584-V598 VanDerWaalsContact CA-O 3.28Å; V584-V598 WeakPolarHBondContact CA-O 3.17Å; V584-V598 HydrophobicContact CB-CB 4.06Å; V584-V598 PolarHBondContact N-O 3.18Å; V584-V598 PolarHBondContact O-N 3.28Å; V584-V598 VanDerWaalsContact O-N 3.13Å; V584-L602 HydrophobicContact CG2-CD1 4.12Å; V584-P605 HydrophobicContact CG2-CB 4.34Å; V584-I608 HydrophobicContact CG1-CD1 3.65Å; V584-L617 HydrophobicContact CG1-CD2 4.15Å
585	D	96.5	Very high	94.6	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	153.8	178.9	-92.4	-0.9	0	0	0	113.1	Y575 W576 R594 T596	Y575-D585 CarbonylContact C-O 3.57Å; Y575-D585 WeakPolarHBondContact CA-O 3.28Å; W576-D585 HydrophobicContact CD2-CB 3.96Å; W576-D585 HydrophobicContact CG-CB 4.46Å; W576-D585 HydrophobicContact CH2-CB 4.14Å; W576-D585 HydrophobicContact CZ2-CB 3.5Å; W576-D585 VanDerWaalsContact CZ2-CB 3.5Å; W576-D585 PolarHBondContact N-O 3.37Å; W576-D585 PolarHBondContact O-N 2.93Å; D585-R594 IonicContact OD2-CZ 3.44Å; D585-R594 VanDerWaalsContact OD2-CZ 3.28Å; D585-R594 IonicContact OD2-NE 3.53Å; D585-R594 PolarHBondContact OD2-NE 2.78Å; D585-R594 IonicContact OD2-NH2 3.35Å; D585-R594 PolarHBondContact OD2-NH2 2.99Å; D585-T596 WeakPolarHBondContact OD1-CA 3.17Å; D585-T596 VanDerWaalsContact OD1-CB 3.23Å; D585-T596 WeakPolarHBondContact OD1-CB 3.14Å; D585-T596 WeakPolarHBondContact OD1-CG2 3.34Å; D585-T596 PolarHBondContact OD1-OG1 2.86Å
586	C	96.3	Very high	94.5	Very high	7 Å²	7	46 Å²	46	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.3	170.2	80.9	0	0	0	0	113.6	M574 Y575 R594 K595 V597	M574-C586 CarbonylContact O-C 3.59Å; M574-C586 WeakPolarHBondContact O-CA 3.17Å; M574-C586 WeakPolarHBondContact O-CB 3.41Å; Y575-C586 HydrophobicContact CD1-CB 3.42Å; Y575-C586 VanDerWaalsContact CD1-CB 3.42Å; Y575-C586 HydrophobicContact CE1-CB 3.53Å; Y575-C586 HydrophobicContact CG-CB 4.03Å; C586-R594 CarbonylContact O-C 3.19Å; C586-R594 VanDerWaalsContact O-CA 3.29Å; C586-R594 WeakPolarHBondContact O-CA 3.41Å; C586-K595 PolarHBondContact N-O 2.89Å; C586-K595 PolarHBondContact O-N 2.87Å; C586-V597 HydrophobicContact CB-CG2 3.58Å; C586-V597 WeakPolarHBondContact SG-CG2 3.1Å
587	S	96.3	Very high	94.4	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	-179.6	170.4	67.2	0	0	0	0	111	R573 M574 W576 L592	R573-S587 CarbonylContact C-O 3.56Å; R573-S587 VanDerWaalsContact CA-O 3.28Å; R573-S587 WeakPolarHBondContact CA-O 3.39Å; R573-S587 WeakPolarHBondContact CB-O 3.49Å; M574-S587 WeakPolarHBondContact CE-OG 3.29Å; M574-S587 PolarHBondContact N-O 3.12Å; M574-S587 PolarHBondContact O-N 2.68Å; W576-S587 WeakPolarHBondContact CZ3-OG 3.36Å; S587-L592 WeakPolarHBondContact CB-O 3.25Å
588	T	92.9	Very high	94.3	Very high	41 Å²	41	47 Å²	47	25%	0.252	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	163.8	168	59.1	0	0	0	0	111.7	D590 G591 L592 K593	T588-D590 PolarHBondContact O-N 2.83Å; T588-G591 PolarHBondContact O-N 2.65Å; T588-L592 PolarHBondContact N-O 3.4Å; T588-L592 WeakPolarHBondContact OG1-CA 3.49Å; T588-L592 WeakPolarHBondContact OG1-CB 3.33Å; T588-L592 PolarHBondContact OG1-N 3.01Å; T588-L592 VanDerWaalsContact OG1-N 3.15Å; T588-L592 PolarHBondContact OG1-O 3.19Å; T588-K593 HydrophobicContact CG2-CB 4.45Å; T588-K593 HydrophobicContact CG2-CD 4.48Å
589	L	92.1	Very high	94.1	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.042	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-8.5	177.4	-61.7	-178.7	0	0	0	115.5	Y528 Y532 R543 L554 I567 H572 R573 M574	Y528-L589 HydrophobicContact CD2-CD1 4.42Å; Y528-L589 HydrophobicContact CE2-CD1 4.42Å; Y532-L589 HydrophobicContact CE1-CB 4.37Å; Y532-L589 HydrophobicContact CE1-CD2 4.35Å; Y532-L589 WeakPolarHBondContact CE1-O 3.35Å; R543-L589 PolarHBondContact NH1-O 3.43Å; R543-L589 VanDerWaalsContact NH1-O 3.11Å; L554-L589 WeakPolarHBondContact CD1-O 3.33Å; I567-L589 HydrophobicContact CD1-CD2 4.1Å; I567-L589 HydrophobicContact CG2-CD2 3.88Å; H572-L589 HydrophobicContact CB-CD1 3.97Å; H572-L589 HydrophobicContact CB-CG 4.27Å; H572-L589 PolarHBondContact O-N 3.28Å; R573-L589 WeakPolarHBondContact O-CD2 3.34Å; M574-L589 HydrophobicContact CB-CD2 4.33Å
590	D	91.1	Very high	93.9	Very high	91 Å²	91	58.3 Å²	58.3	49%	0.487	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	17.1	173.4	-61.6	-52.6	0	0	0	112.4	R543 T588 L592	R543-D590 IonicContact CZ-OD1 3.63Å; R543-D590 IonicContact NH1-OD1 3.71Å; R543-D590 PolarHBondContact NH1-OD1 3.04Å; R543-D590 IonicContact NH2-OD1 3.8Å; T588-D590 PolarHBondContact O-N 2.83Å; D590-L592 PolarHBondContact O-N 3.39Å
591	G	91.8	Very high	93.5	Very high	13 Å²	13	58.4 Å²	58.4	13%	0.134	31%	0.306	C	S	.	.	S	Bend	trans	79.5	-11.1	178.5	0	0	0	0	0	115.4	T588	T588-G591 PolarHBondContact O-N 2.65Å
592	L	90.5	Very high	93.4	Very high	120 Å²	120	56 Å²	56	63%	0.628	30%	0.297	S	S	*	.			trans	-76.8	159.3	-176.1	-55.1	177.7	0	0	0	112.9	S587 T588 D590	S587-L592 WeakPolarHBondContact CB-O 3.25Å; T588-L592 PolarHBondContact N-O 3.4Å; T588-L592 WeakPolarHBondContact OG1-CA 3.49Å; T588-L592 WeakPolarHBondContact OG1-CB 3.33Å; T588-L592 PolarHBondContact OG1-N 3.01Å; T588-L592 VanDerWaalsContact OG1-N 3.15Å; T588-L592 PolarHBondContact OG1-O 3.19Å; D590-L592 PolarHBondContact O-N 3.39Å
593	K	90.3	Very high	93.3	Very high	188 Å²	188	58.7 Å²	58.7	82%	0.817	31%	0.305	S	S	*	.	S	Bend	trans	57.3	47.5	179.3	-56.6	-178.6	179.5	178	0	113.6	T588	T588-K593 HydrophobicContact CG2-CB 4.45Å; T588-K593 HydrophobicContact CG2-CD 4.48Å
594	R	93	Very high	93.2	Very high	85 Å²	85	61.3 Å²	61.3	32%	0.321	32%	0.317	S	S	.	.			trans	-58.7	135.4	175.6	-175.5	177.4	-178.8	168.2	4.9	111.9	D557 G558 W576 D585 C586	D557-R594 PolarHBondContact O-NH1 3.28Å; G558-R594 PolarHBondContact O-NH2 2.82Å; W576-R594 HydrophobicContact CH2-CG 4.14Å; W576-R594 HydrophobicContact CZ2-CG 4.34Å; D585-R594 IonicContact OD2-CZ 3.44Å; D585-R594 VanDerWaalsContact OD2-CZ 3.28Å; D585-R594 IonicContact OD2-NE 3.53Å; D585-R594 PolarHBondContact OD2-NE 2.78Å; D585-R594 IonicContact OD2-NH2 3.35Å; D585-R594 PolarHBondContact OD2-NH2 2.99Å; C586-R594 CarbonylContact O-C 3.19Å; C586-R594 VanDerWaalsContact O-CA 3.29Å; C586-R594 WeakPolarHBondContact O-CA 3.41Å
595	K	93.6	Very high	93.1	Very high	94 Å²	94	61.3 Å²	61.3	41%	0.409	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.8	176.2	171.4	-177.4	168.8	-172.7	0	109.3	C586 E634	C586-K595 PolarHBondContact N-O 2.89Å; C586-K595 PolarHBondContact O-N 2.87Å; K595-E634 IonicContact NZ-OE2 3.44Å; K595-E634 PolarHBondContact NZ-OE2 2.86Å
596	T	95.2	Very high	93.1	Very high	69 Å²	69	62.4 Å²	62.4	42%	0.423	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123	164.5	-53	0	0	0	0	109.3	A583 D585 V598 K599	A583-T596 HydrophobicContact CB-CG2 4.49Å; D585-T596 WeakPolarHBondContact OD1-CA 3.17Å; D585-T596 VanDerWaalsContact OD1-CB 3.23Å; D585-T596 WeakPolarHBondContact OD1-CB 3.14Å; D585-T596 WeakPolarHBondContact OD1-CG2 3.34Å; D585-T596 PolarHBondContact OD1-OG1 2.86Å; T596-V598 WeakPolarHBondContact CG2-O 3.46Å; T596-K599 HydrophobicContact CG2-CB 3.96Å
597	V	95.5	Very high	93	Very high	17 Å²	17	62.5 Å²	62.5	10%	0.103	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-42.2	-176.8	-170	0	0	0	0	110.6	Y575 V584 C586 G635	Y575-V597 HydrophobicContact CD1-CG2 4.3Å; Y575-V597 HydrophobicContact CE1-CG2 4.12Å; V584-V597 WeakPolarHBondContact O-CA 3.4Å; V584-V597 WeakPolarHBondContact O-CB 3.41Å; V584-V597 PolarHBondContact O-N 3.21Å; C586-V597 HydrophobicContact CB-CG2 3.58Å; C586-V597 WeakPolarHBondContact SG-CG2 3.1Å; V597-G635 VanDerWaalsContact CG1-N 3.32Å
598	V	95.3	Very high	93.1	Very high	3 Å²	3	63 Å²	63	2%	0.018	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.6	-173.3	176.6	0	0	0	0	107.7	V584 T596 L602 W619 R638	V584-V598 VanDerWaalsContact CA-O 3.28Å; V584-V598 WeakPolarHBondContact CA-O 3.17Å; V584-V598 HydrophobicContact CB-CB 4.06Å; V584-V598 PolarHBondContact N-O 3.18Å; V584-V598 PolarHBondContact O-N 3.28Å; V584-V598 VanDerWaalsContact O-N 3.13Å; T596-V598 WeakPolarHBondContact CG2-O 3.46Å; V598-L602 HydrophobicContact CB-CD1 4.16Å; V598-L602 HydrophobicContact CG1-CD1 3.53Å; V598-L602 HydrophobicContact CG1-CD2 4.11Å; V598-L602 HydrophobicContact CG1-CG 3.76Å; V598-W619 HydrophobicContact CG1-CH2 4.1Å; V598-W619 HydrophobicContact CG1-CZ2 3.76Å; V598-W619 HydrophobicContact CG2-CH2 3.94Å; V598-W619 HydrophobicContact CG2-CZ2 4.42Å; V598-W619 HydrophobicContact CG2-CZ3 4.34Å; V598-R638 VanDerWaalsContact CG1-NH2 3.29Å
599	K	92.6	Very high	93.3	Very high	140 Å²	140	61.6 Å²	61.6	61%	0.609	32%	0.318	S	S	*	.			trans	-150.2	-42.1	179.5	-173	171.7	-178.1	174.9	0	113.6	T596	T596-K599 HydrophobicContact CG2-CB 3.96Å
600	E	90.3	Very high	93.6	Very high	166 Å²	166	61.5 Å²	61.5	78%	0.776	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	139.3	176.7	-61.6	179.4	170.8	0	0	110.4	L602 R638	E600-L602 PolarHBondContact O-N 3.21Å; E600-L602 VanDerWaalsContact O-N 3.13Å; E600-R638 PolarHBondContact O-NH1 3.36Å; E600-R638 PolarHBondContact O-NH2 3.08Å
601	G	85.8	Confident	93.7	Very high	74 Å²	74	58.1 Å²	58.1	76%	0.763	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	10.5	177.5	0	0	0	0	0	116.1
602	L	92.8	Very high	93.5	Very high	13 Å²	13	57.5 Å²	57.5	7%	0.068	29%	0.292	C	S	.	.			trans	-90.1	148	164.8	-72	178.5	0	0	0	109.7	S582 V584 V598 E600 P605 W619 D621	S582-L602 WeakPolarHBondContact CB-O 3.2Å; S582-L602 VanDerWaalsContact O-CB 3.31Å; S582-L602 WeakPolarHBondContact O-CB 3.3Å; S582-L602 WeakPolarHBondContact O-CD1 3.49Å; V584-L602 HydrophobicContact CG2-CD1 4.12Å; V598-L602 HydrophobicContact CB-CD1 4.16Å; V598-L602 HydrophobicContact CG1-CD1 3.53Å; V598-L602 HydrophobicContact CG1-CD2 4.11Å; V598-L602 HydrophobicContact CG1-CG 3.76Å; E600-L602 PolarHBondContact O-N 3.21Å; E600-L602 VanDerWaalsContact O-N 3.13Å; L602-P605 HydrophobicContact CD1-CG 4.34Å; L602-P605 HydrophobicContact CD2-CB 4.26Å; L602-W619 VanDerWaalsContact CD2-NE1 3.34Å; L602-D621 WeakPolarHBondContact CA-OD2 3.03Å
603	E	93.1	Very high	93.2	Very high	91 Å²	91	55.4 Å²	55.4	43%	0.425	28%	0.279	S	S	.	.	S	Bend	trans	-125.8	-65.7	172.8	-71.3	-173.7	-165.2	0	0	110.8	S582 D621 G623 A624	S582-E603 WeakPolarHBondContact CB-O 3.32Å; S582-E603 PolarHBondContact OG-O 2.84Å; E603-D621 PolarHBondContact N-OD2 2.93Å; E603-G623 WeakPolarHBondContact OE2-CA 3.35Å; E603-A624 WeakPolarHBondContact OE2-CB 3.34Å; E603-A624 PolarHBondContact OE2-N 2.82Å
604	E	95	Very high	93	Very high	61 Å²	61	48.7 Å²	48.7	29%	0.285	26%	0.259	S	S	.	.	S	Bend	trans	-130.1	70.1	179.7	-61.4	-156.4	131.9	0	0	111.7	R579 D621 T622	R579-E604 HydrophobicContact CG-CB 4Å; R579-E604 HydrophobicContact CG-CG 4.3Å; R579-E604 IonicContact CZ-OE1 3.38Å; R579-E604 IonicContact CZ-OE2 3.83Å; R579-E604 IonicContact NE-OE1 3.57Å; R579-E604 PolarHBondContact NE-OE1 2.82Å; R579-E604 IonicContact NE-OE2 3.83Å; R579-E604 PolarHBondContact NE-OE2 2.95Å; R579-E604 IonicContact NH2-OE1 2.76Å; R579-E604 PolarHBondContact NH2-OE1 2.88Å; R579-E604 IonicContact NH2-OE2 2.65Å; R579-E604 PolarHBondContact NH2-OE2 3.35Å; E604-D621 PolarHBondContact N-OD1 3.47Å; E604-D621 PolarHBondContact N-OD2 3.24Å; E604-D621 WeakPolarHBondContact O-CA 3.02Å; E604-T622 WeakPolarHBondContact CB-OG1 3.42Å; E604-T622 PolarHBondContact O-N 2.74Å; E604-T622 PolarHBondContact O-OG1 3.17Å; E604-T622 PolarHBondContact OE2-OG1 3.23Å; E604-T622 VanDerWaalsContact OE2-OG1 3.13Å
605	P	96.1	Very high	92.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136.8	178.6	27.8	-36	0	0	0	111.9	T577 V584 L602 T620	T577-P605 HydrophobicContact CG2-CB 3.88Å; V584-P605 HydrophobicContact CG2-CB 4.34Å; L602-P605 HydrophobicContact CD1-CG 4.34Å; L602-P605 HydrophobicContact CD2-CB 4.26Å; P605-T620 CarbonylContact C-O 3.52Å; P605-T620 WeakPolarHBondContact CA-O 3.33Å
606	R	94.8	Very high	92.8	Very high	26 Å²	26	49.5 Å²	49.5	10%	0.098	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-90.4	-177.6	-65.4	-170.3	111.6	-167.7	2.6	113.7	E563 G564 T577 T620 T622 T650	E563-R606 IonicContact OE2-CZ 3.9Å; E563-R606 IonicContact OE2-NE 2.68Å; E563-R606 PolarHBondContact OE2-NE 2.82Å; E563-R606 IonicContact OE2-NH2 3.76Å; E563-R606 PolarHBondContact OE2-NH2 3.4Å; G564-R606 WeakPolarHBondContact CA-O 3.43Å; T577-R606 WeakPolarHBondContact CB-O 3.04Å; T577-R606 WeakPolarHBondContact CG2-O 3.37Å; T577-R606 PolarHBondContact OG1-O 2.89Å; R606-T620 PolarHBondContact N-O 2.79Å; R606-T622 HydrophobicContact CG-CG2 4.19Å; R606-T650 VanDerWaalsContact NH1-CG2 3.32Å
607	G	95.6	Very high	92.9	Very high	10 Å²	10	46.2 Å²	46.2	10%	0.103	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	146.9	-178.9	0	0	0	0	0	111.3	W619 T620 T650	G607-W619 CarbonylContact O-C 3.57Å; G607-W619 WeakPolarHBondContact O-CA 3.23Å; G607-W619 VanDerWaalsContact O-CB 3.3Å; G607-W619 WeakPolarHBondContact O-CB 3.32Å; G607-T620 WeakPolarHBondContact CA-OG1 3.04Å; G607-T620 PolarHBondContact N-OG1 3.06Å; G607-T620 PolarHBondContact O-N 2.84Å; G607-T650 WeakPolarHBondContact CA-O 3.32Å; G607-T650 PolarHBondContact N-O 3.05Å; G607-T650 VanDerWaalsContact N-O 3.17Å
608	I	98	Very high	93.1	Very high	13 Å²	13	45.4 Å²	45.4	7%	0.067	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	137.5	-179.9	-173.1	173.7	0	0	0	110.3	G564 A566 T577 V584 L617 F618	G564-I608 VanDerWaalsContact C-CG2 3.45Å; A566-I608 HydrophobicContact CB-CG1 4.22Å; A566-I608 HydrophobicContact CB-CG2 4.09Å; T577-I608 HydrophobicContact CG2-CB 3.86Å; T577-I608 HydrophobicContact CG2-CD1 4.16Å; T577-I608 HydrophobicContact CG2-CG1 4.49Å; T577-I608 HydrophobicContact CG2-CG2 4.21Å; V584-I608 HydrophobicContact CG1-CD1 3.65Å; I608-L617 HydrophobicContact CD1-CD1 4.05Å; I608-L617 HydrophobicContact CD1-CD2 4.3Å; I608-L617 HydrophobicContact CD1-CG 4.35Å; I608-L617 HydrophobicContact CG1-CD1 4.06Å; I608-L617 HydrophobicContact CG1-CG 4.4Å; I608-F618 CarbonylContact C-O 3.57Å; I608-F618 VanDerWaalsContact CA-O 3.3Å; I608-F618 WeakPolarHBondContact CA-O 3.25Å
609	A	97.8	Very high	93.2	Very high	12 Å²	12	45.3 Å²	45.3	10%	0.099	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.4	171.4	0	0	0	0	0	110.9	F618 L652 I654	A609-F618 PolarHBondContact N-O 2.88Å; A609-F618 PolarHBondContact O-N 3.38Å; A609-L652 HydrophobicContact CB-CD2 3.43Å; A609-L652 VanDerWaalsContact CB-CD2 3.43Å; A609-I654 HydrophobicContact CB-CD1 3.63Å; A609-I654 HydrophobicContact CB-CG1 3.89Å
610	V	96.5	Very high	93.4	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.03	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.5	-178.9	66.3	0	0	0	0	110.6	A566 I567 D568 W569 L617 L633	A566-V610 HydrophobicContact CB-CB 4.46Å; A566-V610 HydrophobicContact CB-CG1 4.23Å; I567-V610 WeakPolarHBondContact O-CG1 3.45Å; D568-V610 HydrophobicContact CB-CG1 4.25Å; D568-V610 HydrophobicContact CB-CG2 4.28Å; W569-V610 HydrophobicContact CZ3-CG1 4.38Å; V610-L617 HydrophobicContact CB-CD1 3.96Å; V610-L617 HydrophobicContact CG2-CD1 4.15Å; V610-L633 HydrophobicContact CG2-CD2 3.51Å
611	H	94.5	Very high	93.7	Very high	20 Å²	20	30.9 Å²	30.9	9%	0.093	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	94.4	170.1	-164.6	-36.3	0	0	0	108.6	Q613 A614 K615 K616 F618 I654 F656 D659	H611-Q613 WeakPolarHBondContact CE1-CB 3.41Å; H611-Q613 PolarHBondContact O-N 2.98Å; H611-A614 HydrophobicContact CB-CB 4.1Å; H611-A614 PolarHBondContact ND1-N 2.74Å; H611-A614 PolarHBondContact O-N 2.83Å; H611-K615 PolarHBondContact O-N 2.67Å; H611-K616 PolarHBondContact N-O 3.2Å; H611-K616 PolarHBondContact O-N 3.16Å; H611-K616 VanDerWaalsContact O-N 3.15Å; H611-F618 HydrophobicContact CB-CE2 4.15Å; H611-I654 HydrophobicContact CB-CD1 4.19Å; H611-F656 HydrophobicContact CB-CE1 4.36Å; H611-F656 AromaticContact CD2-CD1 3.95Å; H611-F656 AromaticContact CG-CE1 3.99Å; H611-D659 IonicContact CD2-OD1 3.43Å; H611-D659 IonicContact NE2-OD1 2.74Å; H611-D659 PolarHBondContact NE2-OD1 2.84Å; H611-D659 IonicContact NE2-OD2 3.22Å
612	P	87.8	Confident	94.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.5	-172	-25.7	35.4	0	0	0	113.6	D568 W569 V570 H571 K615	D568-P612 WeakPolarHBondContact OD1-CB 3.3Å; D568-P612 WeakPolarHBondContact OD1-CG 3.44Å; W569-P612 HydrophobicContact CD2-CG 4.42Å; W569-P612 HydrophobicContact CE3-CG 4.49Å; W569-P612 HydrophobicContact CH2-CG 4Å; W569-P612 HydrophobicContact CZ2-CG 3.93Å; W569-P612 HydrophobicContact CZ3-CG 4.28Å; V570-P612 HydrophobicContact CB-CB 3.78Å; V570-P612 HydrophobicContact CB-CG 4.47Å; V570-P612 HydrophobicContact CG2-CB 3.69Å; V570-P612 HydrophobicContact CG2-CG 4.12Å; H571-P612 PolarHBondContact CE1-O 2.84Å; P612-K615 WeakPolarHBondContact O-CG 3.37Å; P612-K615 PolarHBondContact O-N 2.02Å; P612-K615 VanDerWaalsContact O-N 3.17Å
613	Q	83.2	Confident	94	Very high	76 Å²	76	27.9 Å²	27.9	36%	0.355	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-45.5	-178.1	-65.5	80	-7.4	0	0	111.5	H611 K615 P745	H611-Q613 WeakPolarHBondContact CE1-CB 3.41Å; H611-Q613 PolarHBondContact O-N 2.98Å; Q613-K615 PolarHBondContact O-N 3.04Å; Q613-P745 PolarHBondContact NE2-O 3.28Å
614	A	86.4	Confident	93.8	Very high	47 Å²	47	27.1 Å²	27.1	39%	0.388	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-8.8	173.5	0	0	0	0	0	113	H611 K616	H611-A614 HydrophobicContact CB-CB 4.1Å; H611-A614 PolarHBondContact ND1-N 2.74Å; H611-A614 PolarHBondContact O-N 2.83Å; A614-K616 HydrophobicContact CB-CG 4.46Å; A614-K616 PolarHBondContact O-N 2.87Å
615	K	88.9	Confident	93.6	Very high	130 Å²	130	31.3 Å²	31.3	57%	0.565	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.6	-173	-60.3	179.4	-178.4	175.7	0	113	H611 P612 Q613 T632 L633	H611-K615 PolarHBondContact O-N 2.67Å; P612-K615 WeakPolarHBondContact O-CG 3.37Å; P612-K615 PolarHBondContact O-N 2.02Å; P612-K615 VanDerWaalsContact O-N 3.17Å; Q613-K615 PolarHBondContact O-N 3.04Å; K615-T632 WeakPolarHBondContact O-CA 3.48Å; K615-L633 HydrophobicContact CB-CD1 4.2Å; K615-L633 HydrophobicContact CB-CG 4.13Å; K615-L633 HydrophobicContact CG-CD1 4.37Å; K615-L633 WeakPolarHBondContact O-CG 3.05Å; K615-L633 PolarHBondContact O-N 2.83Å; K615-L633 VanDerWaalsContact O-N 3.09Å
616	K	94.6	Very high	93.5	Very high	66 Å²	66	32.3 Å²	32.3	29%	0.287	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.1	178.7	-71.5	-163	176.3	-167.8	0	112.5	H611 A614 F618 A631	H611-K616 PolarHBondContact N-O 3.2Å; H611-K616 PolarHBondContact O-N 3.16Å; H611-K616 VanDerWaalsContact O-N 3.15Å; A614-K616 HydrophobicContact CB-CG 4.46Å; A614-K616 PolarHBondContact O-N 2.87Å; K616-F618 HydrophobicContact CB-CD2 4.41Å; K616-F618 HydrophobicContact CB-CE2 3.57Å; K616-F618 HydrophobicContact CB-CZ 3.71Å; K616-F618 HydrophobicContact CD-CE1 4.32Å; K616-F618 HydrophobicContact CD-CE2 4.48Å; K616-F618 HydrophobicContact CD-CZ 3.75Å; K616-F618 HydrophobicContact CG-CZ 4.4Å; K616-A631 CarbonylContact C-O 3.57Å; K616-A631 VanDerWaalsContact CA-O 3.29Å; K616-A631 WeakPolarHBondContact CA-O 3.39Å
617	L	97.2	Very high	93.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.3	168.7	-166.2	68.8	0	0	0	107.8	Y575 V584 I608 V610 W619 S630 A631	Y575-L617 HydrophobicContact CD1-CD1 4.04Å; Y575-L617 HydrophobicContact CD1-CD2 3.78Å; Y575-L617 HydrophobicContact CD2-CD1 4.34Å; Y575-L617 HydrophobicContact CE1-CD2 4.2Å; Y575-L617 HydrophobicContact CG-CD1 3.93Å; Y575-L617 HydrophobicContact CG-CD2 4.45Å; V584-L617 HydrophobicContact CG1-CD2 4.15Å; I608-L617 HydrophobicContact CD1-CD1 4.05Å; I608-L617 HydrophobicContact CD1-CD2 4.3Å; I608-L617 HydrophobicContact CD1-CG 4.35Å; I608-L617 HydrophobicContact CG1-CD1 4.06Å; I608-L617 HydrophobicContact CG1-CG 4.4Å; V610-L617 HydrophobicContact CB-CD1 3.96Å; V610-L617 HydrophobicContact CG2-CD1 4.15Å; L617-W619 HydrophobicContact CG-CE3 4.44Å; L617-S630 CarbonylContact O-C 3.48Å; L617-S630 VanDerWaalsContact O-CA 3.24Å; L617-S630 WeakPolarHBondContact O-CA 3.09Å; L617-S630 PolarHBondContact O-OG 2.04Å; L617-A631 PolarHBondContact N-O 3.16Å; L617-A631 PolarHBondContact O-N 3.38Å
618	F	98.2	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.6	179.7	-59	-90.6	0	0	0	109.3	I608 A609 H611 K616 E629 S630 I641 L652 I654 L661 L676	I608-F618 CarbonylContact C-O 3.57Å; I608-F618 VanDerWaalsContact CA-O 3.3Å; I608-F618 WeakPolarHBondContact CA-O 3.25Å; A609-F618 PolarHBondContact N-O 2.88Å; A609-F618 PolarHBondContact O-N 3.38Å; H611-F618 HydrophobicContact CB-CE2 4.15Å; K616-F618 HydrophobicContact CB-CD2 4.41Å; K616-F618 HydrophobicContact CB-CE2 3.57Å; K616-F618 HydrophobicContact CB-CZ 3.71Å; K616-F618 HydrophobicContact CD-CE1 4.32Å; K616-F618 HydrophobicContact CD-CE2 4.48Å; K616-F618 HydrophobicContact CD-CZ 3.75Å; K616-F618 HydrophobicContact CG-CZ 4.4Å; F618-E629 WeakPolarHBondContact CA-O 3.21Å; F618-S630 VanDerWaalsContact CD1-CB 3.48Å; F618-S630 WeakPolarHBondContact CD1-OG 3.08Å; F618-S630 WeakPolarHBondContact CE1-OG 3.44Å; F618-I641 HydrophobicContact CD1-CG1 4.47Å; F618-L652 HydrophobicContact CB-CD1 4.38Å; F618-L652 HydrophobicContact CB-CD2 3.91Å; F618-I654 HydrophobicContact CD2-CD1 3.85Å; F618-I654 HydrophobicContact CE2-CD1 4.16Å; F618-L661 HydrophobicContact CB-CD2 4.15Å; F618-L661 HydrophobicContact CD1-CD1 3.65Å; F618-L661 HydrophobicContact CD1-CD2 4.01Å; F618-L661 HydrophobicContact CD1-CG 4.39Å; F618-L661 HydrophobicContact CD2-CD2 4.31Å; F618-L661 HydrophobicContact CE1-CD1 3.78Å; F618-L661 HydrophobicContact CE1-CD2 4.48Å; F618-L661 HydrophobicContact CG-CD1 4.39Å; F618-L661 HydrophobicContact CG-CD2 3.9Å; F618-L676 HydrophobicContact CE1-CB 4.4Å; F618-L676 HydrophobicContact CE2-CD2 4.48Å; F618-L676 HydrophobicContact CZ-CB 4.01Å; F618-L676 HydrophobicContact CZ-CD1 4.37Å; F618-L676 HydrophobicContact CZ-CD2 4.09Å; F618-L676 HydrophobicContact CZ-CG 4.35Å
619	W	97.8	Very high	93.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163.2	176.5	65.5	91.5	0	0	0	112.7	V598 L602 G607 L617 V628 E629 A631 R638	V598-W619 HydrophobicContact CG1-CH2 4.1Å; V598-W619 HydrophobicContact CG1-CZ2 3.76Å; V598-W619 HydrophobicContact CG2-CH2 3.94Å; V598-W619 HydrophobicContact CG2-CZ2 4.42Å; V598-W619 HydrophobicContact CG2-CZ3 4.34Å; L602-W619 VanDerWaalsContact CD2-NE1 3.34Å; G607-W619 CarbonylContact O-C 3.57Å; G607-W619 WeakPolarHBondContact O-CA 3.23Å; G607-W619 VanDerWaalsContact O-CB 3.3Å; G607-W619 WeakPolarHBondContact O-CB 3.32Å; L617-W619 HydrophobicContact CG-CE3 4.44Å; W619-V628 WeakPolarHBondContact O-CA 3.46Å; W619-E629 HydrophobicContact CD2-CB 4.27Å; W619-E629 HydrophobicContact CH2-CB 4.23Å; W619-E629 HydrophobicContact CZ2-CB 3.64Å; W619-E629 HydrophobicContact CZ2-CG 4.42Å; W619-E629 VanDerWaalsContact CZ2-OE2 3.22Å; W619-E629 WeakPolarHBondContact CZ2-OE2 3.33Å; W619-E629 PolarHBondContact N-O 3.13Å; W619-E629 PolarHBondContact O-N 3.39Å; W619-A631 HydrophobicContact CH2-CB 3.68Å; W619-A631 HydrophobicContact CZ3-CB 3.71Å; W619-R638 HydrophobicContact CH2-CG 4.49Å
620	T	97.5	Very high	93.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	143.9	170.5	59.9	0	0	0	0	110.1	P605 R606 G607 V628 P649 T650 L652	P605-T620 CarbonylContact C-O 3.52Å; P605-T620 WeakPolarHBondContact CA-O 3.33Å; R606-T620 PolarHBondContact N-O 2.79Å; G607-T620 WeakPolarHBondContact CA-OG1 3.04Å; G607-T620 PolarHBondContact N-OG1 3.06Å; G607-T620 PolarHBondContact O-N 2.84Å; T620-V628 HydrophobicContact CG2-CG2 4.25Å; T620-P649 WeakPolarHBondContact CB-O 3.5Å; T620-P649 HydrophobicContact CG2-CB 3.99Å; T620-P649 PolarHBondContact OG1-O 3.4Å; T620-T650 PolarHBondContact OG1-O 3.21Å; T620-L652 HydrophobicContact CG2-CB 4.01Å; T620-L652 HydrophobicContact CG2-CD1 3.74Å
621	D	96.4	Very high	93.5	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.1	171	-163.4	-49.8	0	0	0	109.3	L602 E603 E604 G623 P626 V627 P649	L602-D621 WeakPolarHBondContact CA-OD2 3.03Å; E603-D621 PolarHBondContact N-OD2 2.93Å; E604-D621 PolarHBondContact N-OD1 3.47Å; E604-D621 PolarHBondContact N-OD2 3.24Å; E604-D621 WeakPolarHBondContact O-CA 3.02Å; D621-G623 PolarHBondContact OD1-N 3.01Å; D621-P626 VanDerWaalsContact O-CA 3.28Å; D621-P626 WeakPolarHBondContact O-CA 3.35Å; D621-V627 HydrophobicContact CB-CG2 3.88Å; D621-V627 PolarHBondContact N-O 2.87Å; D621-V627 PolarHBondContact O-N 3.34Å; D621-V627 VanDerWaalsContact O-N 3.11Å; D621-P649 WeakPolarHBondContact O-CG 3.27Å
622	T	94.3	Very high	93.6	Very high	9 Å²	9	32.6 Å²	32.6	6%	0.055	18%	0.182	C	C	.	.			trans	-104.4	15.6	-178.4	66	0	0	0	0	114.6	E604 R606 P649	E604-T622 WeakPolarHBondContact CB-OG1 3.42Å; E604-T622 PolarHBondContact O-N 2.74Å; E604-T622 PolarHBondContact O-OG1 3.17Å; E604-T622 PolarHBondContact OE2-OG1 3.23Å; E604-T622 VanDerWaalsContact OE2-OG1 3.13Å; R606-T622 HydrophobicContact CG-CG2 4.19Å; T622-P649 HydrophobicContact CG2-CG 4.43Å; T622-P649 WeakPolarHBondContact CG2-O 3.08Å
623	G	91.1	Very high	93.8	Very high	14 Å²	14	33 Å²	33	14%	0.144	18%	0.184	C	C	.	.	S	Bend	trans	-63	-166.4	179.1	0	0	0	0	0	115	E603 D621 Q625	E603-G623 WeakPolarHBondContact OE2-CA 3.35Å; D621-G623 PolarHBondContact OD1-N 3.01Å; G623-Q625 PolarHBondContact O-N 2.03Å
624	A	88.6	Confident	94.2	Very high	76 Å²	76	33.4 Å²	33.4	63%	0.628	19%	0.186	S	C	*	.	S	Bend	trans	-60.4	-24.7	178.7	0	0	0	0	0	112.9	E603	E603-A624 WeakPolarHBondContact OE2-CB 3.34Å; E603-A624 PolarHBondContact OE2-N 2.82Å
625	Q	89.9	Confident	94.4	Very high	148 Å²	148	31.7 Å²	31.7	69%	0.692	17%	0.173	S	C	*	.	S	Bend	trans	-119.7	88.7	168.9	-64	-60.2	-66.7	0	0	109.2	G623 V627	G623-Q625 PolarHBondContact O-N 2.03Å; Q625-V627 PolarHBondContact O-N 2.86Å
626	P	94.8	Very high	94.5	Very high	22 Å²	22	28.7 Å²	28.7	14%	0.143	17%	0.168	C	C	.	.			trans	-70.1	128.3	-175.3	27.3	-34.1	0	0	0	111.4	D621 L646 P649	D621-P626 VanDerWaalsContact O-CA 3.28Å; D621-P626 WeakPolarHBondContact O-CA 3.35Å; P626-L646 HydrophobicContact CB-CB 3.99Å; P626-L646 HydrophobicContact CG-CB 4.02Å; P626-L646 VanDerWaalsContact CG-O 3.29Å; P626-L646 WeakPolarHBondContact CG-O 3.19Å; P626-L646 WeakPolarHBondContact O-CD1 3.47Å; P626-P649 HydrophobicContact CB-CG 4.25Å
627	V	96.3	Very high	94.3	Very high	22 Å²	22	30.1 Å²	30.1	13%	0.133	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.6	-173.7	-70	0	0	0	0	112.5	D621 Q625 E629 A642	D621-V627 HydrophobicContact CB-CG2 3.88Å; D621-V627 PolarHBondContact N-O 2.87Å; D621-V627 PolarHBondContact O-N 3.34Å; D621-V627 VanDerWaalsContact O-N 3.11Å; Q625-V627 PolarHBondContact O-N 2.86Å; V627-E629 HydrophobicContact CB-CG 4.26Å; V627-E629 HydrophobicContact CG2-CG 3.86Å; V627-A642 CarbonylContact C-O 3.57Å; V627-A642 WeakPolarHBondContact CA-O 3.42Å
628	V	97.4	Very high	94.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.6	160.9	-172.7	0	0	0	0	106.7	W619 T620 I641 A642 L646 P649 L652 W663	W619-V628 WeakPolarHBondContact O-CA 3.46Å; T620-V628 HydrophobicContact CG2-CG2 4.25Å; V628-I641 HydrophobicContact CB-CB 4.33Å; V628-I641 HydrophobicContact CG1-CB 4.18Å; V628-I641 HydrophobicContact CG1-CG2 4.42Å; V628-I641 WeakPolarHBondContact O-CA 3.04Å; V628-I641 WeakPolarHBondContact O-CB 3.23Å; V628-I641 PolarHBondContact O-N 3.05Å; V628-A642 HydrophobicContact CB-CB 4.18Å; V628-A642 HydrophobicContact CG2-CB 4.21Å; V628-A642 PolarHBondContact N-O 3.44Å; V628-A642 PolarHBondContact O-N 3.24Å; V628-A642 VanDerWaalsContact O-N 3.14Å; V628-L646 HydrophobicContact CG2-CD1 4.02Å; V628-P649 HydrophobicContact CG2-CB 4.35Å; V628-L652 HydrophobicContact CG1-CD1 3.67Å; V628-W663 HydrophobicContact CG2-CD2 4.17Å; V628-W663 HydrophobicContact CG2-CG 4.2Å
629	E	96	Very high	93.9	Very high	24 Å²	24	37.5 Å²	37.5	11%	0.112	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	161.4	-176.9	-65.4	-153.9	131.8	0	0	112	F618 W619 V627 R638 I640	F618-E629 WeakPolarHBondContact CA-O 3.21Å; W619-E629 HydrophobicContact CD2-CB 4.27Å; W619-E629 HydrophobicContact CH2-CB 4.23Å; W619-E629 HydrophobicContact CZ2-CB 3.64Å; W619-E629 HydrophobicContact CZ2-CG 4.42Å; W619-E629 VanDerWaalsContact CZ2-OE2 3.22Å; W619-E629 WeakPolarHBondContact CZ2-OE2 3.33Å; W619-E629 PolarHBondContact N-O 3.13Å; W619-E629 PolarHBondContact O-N 3.39Å; V627-E629 HydrophobicContact CB-CG 4.26Å; V627-E629 HydrophobicContact CG2-CG 3.86Å; E629-R638 IonicContact OE2-NH1 2.69Å; E629-R638 PolarHBondContact OE2-NH1 2.67Å; E629-I640 HydrophobicContact CG-CG1 4.45Å
630	S	96.9	Very high	93.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.6	171.2	-173.1	0	0	0	0	110.8	L617 F618 R638 V639	L617-S630 CarbonylContact O-C 3.48Å; L617-S630 VanDerWaalsContact O-CA 3.24Å; L617-S630 WeakPolarHBondContact O-CA 3.09Å; L617-S630 PolarHBondContact O-OG 2.04Å; F618-S630 VanDerWaalsContact CD1-CB 3.48Å; F618-S630 WeakPolarHBondContact CD1-OG 3.08Å; F618-S630 WeakPolarHBondContact CE1-OG 3.44Å; S630-R638 CarbonylContact O-C 3.57Å; S630-R638 VanDerWaalsContact O-CA 3.26Å; S630-R638 WeakPolarHBondContact O-CA 3.19Å; S630-V639 PolarHBondContact N-O 2.7Å; S630-V639 PolarHBondContact O-N 2.83Å
631	A	96.6	Very high	93.8	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.017	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	177.5	168.5	0	0	0	0	0	111.1	K616 L617 W619 R638	K616-A631 CarbonylContact C-O 3.57Å; K616-A631 VanDerWaalsContact CA-O 3.29Å; K616-A631 WeakPolarHBondContact CA-O 3.39Å; L617-A631 PolarHBondContact N-O 3.16Å; L617-A631 PolarHBondContact O-N 3.38Å; W619-A631 HydrophobicContact CH2-CB 3.68Å; W619-A631 HydrophobicContact CZ3-CB 3.71Å; A631-R638 HydrophobicContact CB-CG 4.15Å
632	T	95.4	Very high	93.7	Very high	43 Å²	43	42.5 Å²	42.5	26%	0.264	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	164.7	164.5	64.3	0	0	0	0	111.4	K615 E634 G635 S636	K615-T632 WeakPolarHBondContact O-CA 3.48Å; T632-E634 PolarHBondContact O-N 2.84Å; T632-E634 PolarHBondContact OG1-N 3.46Å; T632-G635 PolarHBondContact O-N 2.98Å; T632-G635 PolarHBondContact OG1-N 3.29Å; T632-S636 WeakPolarHBondContact CG2-O 3.35Å; T632-S636 PolarHBondContact N-O 2.79Å; T632-S636 PolarHBondContact OG1-N 2.89Å; T632-S636 VanDerWaalsContact OG1-N 3.14Å; T632-S636 PolarHBondContact OG1-O 3.26Å; T632-S636 PolarHBondContact OG1-OG 3.03Å
633	L	92.4	Very high	93.7	Very high	9 Å²	9	45.3 Å²	45.3	5%	0.047	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-12.4	173.1	-60.7	-172.7	0	0	0	115.2	Y575 V610 K615	Y575-L633 WeakPolarHBondContact CE1-O 3.27Å; Y575-L633 PolarHBondContact OH-O 2.03Å; V610-L633 HydrophobicContact CG2-CD2 3.51Å; K615-L633 HydrophobicContact CB-CD1 4.2Å; K615-L633 HydrophobicContact CB-CG 4.13Å; K615-L633 HydrophobicContact CG-CD1 4.37Å; K615-L633 WeakPolarHBondContact O-CG 3.05Å; K615-L633 PolarHBondContact O-N 2.83Å; K615-L633 VanDerWaalsContact O-N 3.09Å
634	E	91.3	Very high	93.7	Very high	84 Å²	84	49.2 Å²	49.2	39%	0.393	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	3.7	176.8	-61.6	-58	137.5	0	0	113.3	R573 K595 T632	R573-E634 IonicContact CZ-OE1 2.73Å; R573-E634 IonicContact NH1-OE1 3.81Å; R573-E634 PolarHBondContact NH1-OE1 2.55Å; R573-E634 IonicContact NH2-OE1 3.61Å; K595-E634 IonicContact NZ-OE2 3.44Å; K595-E634 PolarHBondContact NZ-OE2 2.86Å; T632-E634 PolarHBondContact O-N 2.84Å; T632-E634 PolarHBondContact OG1-N 3.46Å
635	G	90.5	Very high	93.7	Very high	12 Å²	12	47.8 Å²	47.8	12%	0.124	28%	0.282	C	S	.	.	S	Bend	trans	87.4	-4.5	175.2	0	0	0	0	0	115.8	V597 T632	V597-G635 VanDerWaalsContact CG1-N 3.32Å; T632-G635 PolarHBondContact O-N 2.98Å; T632-G635 PolarHBondContact OG1-N 3.29Å
636	S	90.9	Very high	93.9	Very high	66 Å²	66	41.4 Å²	41.4	46%	0.462	25%	0.253	S	S	.	.			trans	-80	164.7	175.1	67.4	0	0	0	0	112.3	T632	T632-S636 WeakPolarHBondContact CG2-O 3.35Å; T632-S636 PolarHBondContact N-O 2.79Å; T632-S636 PolarHBondContact OG1-N 2.89Å; T632-S636 VanDerWaalsContact OG1-N 3.14Å; T632-S636 PolarHBondContact OG1-O 3.26Å; T632-S636 PolarHBondContact OG1-OG 3.03Å
637	S	91.3	Very high	93.8	Very high	96 Å²	96	45.5 Å²	45.5	67%	0.671	27%	0.271	S	S	*	.	S	Bend	trans	54.9	56.9	179.3	-56.6	0	0	0	0	113
638	R	93.4	Very high	93.7	Very high	84 Å²	84	44.7 Å²	44.7	32%	0.317	27%	0.266	S	S	.	.			trans	-65.6	141.3	175.5	-64.4	-151.8	-160.7	165.1	18	112.2	V598 E600 W619 E629 S630 A631	V598-R638 VanDerWaalsContact CG1-NH2 3.29Å; E600-R638 PolarHBondContact O-NH1 3.36Å; E600-R638 PolarHBondContact O-NH2 3.08Å; W619-R638 HydrophobicContact CH2-CG 4.49Å; E629-R638 IonicContact OE2-NH1 2.69Å; E629-R638 PolarHBondContact OE2-NH1 2.67Å; S630-R638 CarbonylContact O-C 3.57Å; S630-R638 VanDerWaalsContact O-CA 3.26Å; S630-R638 WeakPolarHBondContact O-CA 3.19Å; A631-R638 HydrophobicContact CB-CG 4.15Å
639	V	94.1	Very high	93.6	Very high	71 Å²	71	44.7 Å²	44.7	43%	0.43	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.7	175.8	-178.1	0	0	0	0	108.6	S630	S630-V639 PolarHBondContact N-O 2.7Å; S630-V639 PolarHBondContact O-N 2.83Å
640	I	94.6	Very high	93.5	Very high	93 Å²	93	43.7 Å²	43.7	48%	0.477	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	120.8	172.3	-62.5	171.9	0	0	0	108.2	E629	E629-I640 HydrophobicContact CG-CG1 4.45Å
641	I	96.6	Very high	93.4	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.062	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-39.1	175.9	-56.9	-57.1	0	0	0	110.2	F618 V628 L661	F618-I641 HydrophobicContact CD1-CG1 4.47Å; V628-I641 HydrophobicContact CB-CB 4.33Å; V628-I641 HydrophobicContact CG1-CB 4.18Å; V628-I641 HydrophobicContact CG1-CG2 4.42Å; V628-I641 WeakPolarHBondContact O-CA 3.04Å; V628-I641 WeakPolarHBondContact O-CB 3.23Å; V628-I641 PolarHBondContact O-N 3.05Å; I641-L661 HydrophobicContact CG1-CD1 4.47Å; I641-L661 HydrophobicContact CG2-CD1 3.94Å
642	A	95.9	Very high	93.4	Very high	4 Å²	4	44 Å²	44	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	138	174.5	0	0	0	0	0	111.6	V627 V628 L646 W663	V627-A642 CarbonylContact C-O 3.57Å; V627-A642 WeakPolarHBondContact CA-O 3.42Å; V628-A642 HydrophobicContact CB-CB 4.18Å; V628-A642 HydrophobicContact CG2-CB 4.21Å; V628-A642 PolarHBondContact N-O 3.44Å; V628-A642 PolarHBondContact O-N 3.24Å; V628-A642 VanDerWaalsContact O-N 3.14Å; A642-L646 HydrophobicContact CB-CD1 4.02Å; A642-L646 WeakPolarHBondContact O-CD1 3.22Å; A642-W663 HydrophobicContact CB-CH2 4.42Å; A642-W663 HydrophobicContact CB-CZ2 4.01Å
643	S	93.3	Very high	93.5	Very high	69 Å²	69	43.1 Å²	43.1	48%	0.483	26%	0.258	S	S	.	.			trans	-135.6	-9.2	175.4	54.3	0	0	0	0	114
644	T	91.9	Very high	93.7	Very high	96 Å²	96	43 Å²	43	59%	0.589	26%	0.258	S	S	*	.	S	Bend	trans	-107	143.7	-176.9	54.8	0	0	0	0	111.1	L646 R681	T644-L646 PolarHBondContact O-N 3.01Å; T644-R681 VanDerWaalsContact O-CZ 3.29Å; T644-R681 PolarHBondContact O-NH1 3.31Å; T644-R681 PolarHBondContact O-NH2 2.79Å; T644-R681 PolarHBondContact OG1-NH1 2.94Å
645	G	88.2	Confident	93.8	Very high	46 Å²	46	39.5 Å²	39.5	47%	0.474	24%	0.241	S	C	.	.	S	Bend	trans	70.3	14.3	177.3	0	0	0	0	0	115.2	R668	G645-R668 WeakPolarHBondContact O-CD 3.42Å; G645-R668 PolarHBondContact O-NH1 2.87Å
646	L	93.4	Very high	93.7	Very high	13 Å²	13	41.2 Å²	41.2	7%	0.068	25%	0.246	C	C	.	.			trans	-97.7	146	177.2	-58.2	176	0	0	0	110.1	P626 V628 A642 T644 P649	P626-L646 HydrophobicContact CB-CB 3.99Å; P626-L646 HydrophobicContact CG-CB 4.02Å; P626-L646 VanDerWaalsContact CG-O 3.29Å; P626-L646 WeakPolarHBondContact CG-O 3.19Å; P626-L646 WeakPolarHBondContact O-CD1 3.47Å; V628-L646 HydrophobicContact CG2-CD1 4.02Å; A642-L646 HydrophobicContact CB-CD1 4.02Å; A642-L646 WeakPolarHBondContact O-CD1 3.22Å; T644-L646 PolarHBondContact O-N 3.01Å; L646-P649 HydrophobicContact CB-CG 4.47Å; L646-P649 HydrophobicContact CD1-CG 4.42Å; L646-P649 HydrophobicContact CD2-CB 4.44Å
647	M	93.2	Very high	93.5	Very high	108 Å²	108	39.7 Å²	39.7	53%	0.532	23%	0.234	S	C	.	.	S	Bend	trans	-134.8	-31.8	179.4	-70.8	-72.1	-69.1	0	0	112.5	D665 K667 R668	M647-D665 WeakPolarHBondContact CA-OD2 3.5Å; M647-D665 PolarHBondContact N-OD2 2.68Å; M647-K667 HydrophobicContact CB-CB 4.07Å; M647-K667 HydrophobicContact CB-CD 4.39Å; M647-K667 PolarHBondContact O-NZ 2.86Å; M647-R668 HydrophobicContact CB-CG 4.08Å; M647-R668 HydrophobicContact CG-CG 3.83Å
648	S	94.4	Very high	93.3	Very high	5 Å²	5	36.8 Å²	36.8	4%	0.035	21%	0.211	C	C	.	.			trans	-167.1	66.8	176.8	-174.6	0	0	0	0	110.4	T650 D665 Q666	S648-T650 PolarHBondContact O-N 2.78Å; S648-D665 PolarHBondContact N-OD1 2.62Å; S648-D665 PolarHBondContact N-OD2 2.81Å; S648-D665 WeakPolarHBondContact O-CA 3.28Å; S648-Q666 PolarHBondContact O-N 3.35Å
649	P	95.9	Very high	93.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	117.9	174.8	28.5	-34.7	0	0	0	109.8	T620 D621 T622 P626 V628 L646 C664	T620-P649 WeakPolarHBondContact CB-O 3.5Å; T620-P649 HydrophobicContact CG2-CB 3.99Å; T620-P649 PolarHBondContact OG1-O 3.4Å; D621-P649 WeakPolarHBondContact O-CG 3.27Å; T622-P649 HydrophobicContact CG2-CG 4.43Å; T622-P649 WeakPolarHBondContact CG2-O 3.08Å; P626-P649 HydrophobicContact CB-CG 4.25Å; V628-P649 HydrophobicContact CG2-CB 4.35Å; L646-P649 HydrophobicContact CB-CG 4.47Å; L646-P649 HydrophobicContact CD1-CG 4.42Å; L646-P649 HydrophobicContact CD2-CB 4.44Å; P649-C664 CarbonylContact C-O 3.52Å; P649-C664 WeakPolarHBondContact CA-O 3.27Å
650	T	93.7	Very high	93.1	Very high	4 Å²	4	33.7 Å²	33.7	3%	0.025	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-86.6	-177.6	58.1	0	0	0	0	111.5	R606 G607 T620 S648 C664 Q666 F693	R606-T650 VanDerWaalsContact NH1-CG2 3.32Å; G607-T650 WeakPolarHBondContact CA-O 3.32Å; G607-T650 PolarHBondContact N-O 3.05Å; G607-T650 VanDerWaalsContact N-O 3.17Å; T620-T650 PolarHBondContact OG1-O 3.21Å; S648-T650 PolarHBondContact O-N 2.78Å; T650-C664 PolarHBondContact N-O 2.89Å; T650-C664 PolarHBondContact OG1-SG 2.78Å; T650-C664 VanDerWaalsContact OG1-SG 3.41Å; T650-Q666 HydrophobicContact CG2-CB 3.74Å; T650-F693 WeakPolarHBondContact CB-O 3.14Å; T650-F693 PolarHBondContact OG1-O 3.44Å
651	G	94.3	Very high	93.2	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	146	-175.3	0	0	0	0	0	112.4	W663 C664 F693 D694	G651-W663 WeakPolarHBondContact O-CA 3.25Å; G651-W663 VanDerWaalsContact O-CB 3.3Å; G651-W663 WeakPolarHBondContact O-CB 3.49Å; G651-C664 PolarHBondContact N-SG 2.81Å; G651-C664 PolarHBondContact O-N 3.07Å; G651-C664 VanDerWaalsContact O-N 3.15Å; G651-F693 VanDerWaalsContact CA-O 3.28Å; G651-F693 WeakPolarHBondContact CA-O 3.35Å; G651-F693 PolarHBondContact N-O 2.98Å; G651-D694 WeakPolarHBondContact CA-OD1 3.34Å
652	L	96.6	Very high	93.3	Very high	8 Å²	8	29 Å²	29	4%	0.042	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	130	179.3	-175.6	149.2	0	0	0	110.2	A609 F618 T620 V628 L661 F662	A609-L652 HydrophobicContact CB-CD2 3.43Å; A609-L652 VanDerWaalsContact CB-CD2 3.43Å; F618-L652 HydrophobicContact CB-CD1 4.38Å; F618-L652 HydrophobicContact CB-CD2 3.91Å; T620-L652 HydrophobicContact CG2-CB 4.01Å; T620-L652 HydrophobicContact CG2-CD1 3.74Å; V628-L652 HydrophobicContact CG1-CD1 3.67Å; L652-L661 HydrophobicContact CD1-CD2 4.46Å; L652-L661 HydrophobicContact CD2-CD2 3.87Å; L652-L661 HydrophobicContact CG-CD2 4.29Å; L652-F662 CarbonylContact C-O 3.58Å; L652-F662 WeakPolarHBondContact CA-O 3.35Å
653	T	97.5	Very high	93.3	Very high	24 Å²	24	28.8 Å²	28.8	15%	0.147	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.3	179.9	-161.7	0	0	0	0	111.5	F662 L695 V697 L702	T653-F662 HydrophobicContact CG2-CB 3.91Å; T653-F662 PolarHBondContact N-O 2.78Å; T653-F662 PolarHBondContact O-N 3.19Å; T653-L695 VanDerWaalsContact CB-O 3.31Å; T653-L695 WeakPolarHBondContact CB-O 3.48Å; T653-L695 HydrophobicContact CG2-CB 3.7Å; T653-V697 HydrophobicContact CG2-CB 4.21Å; T653-V697 HydrophobicContact CG2-CG1 3.97Å; T653-L702 HydrophobicContact CG2-CD1 4.12Å
654	I	96.6	Very high	93.5	Very high	7 Å²	7	25.5 Å²	25.5	4%	0.036	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.8	-174.6	-60.4	167	0	0	0	109.1	A609 H611 F618 F656 R660 L661 L676 V697	A609-I654 HydrophobicContact CB-CD1 3.63Å; A609-I654 HydrophobicContact CB-CG1 3.89Å; H611-I654 HydrophobicContact CB-CD1 4.19Å; F618-I654 HydrophobicContact CD2-CD1 3.85Å; F618-I654 HydrophobicContact CE2-CD1 4.16Å; I654-F656 HydrophobicContact CB-CE1 4.11Å; I654-F656 HydrophobicContact CB-CE2 4.38Å; I654-F656 HydrophobicContact CB-CZ 3.99Å; I654-F656 HydrophobicContact CD1-CE1 4.4Å; I654-F656 HydrophobicContact CD1-CZ 4.45Å; I654-F656 HydrophobicContact CG2-CD1 3.78Å; I654-F656 HydrophobicContact CG2-CE1 3.67Å; I654-F656 HydrophobicContact CG2-CG 4.24Å; I654-F656 HydrophobicContact CG2-CZ 4.05Å; I654-F656 PolarHBondContact O-N 3.13Å; I654-R660 WeakPolarHBondContact CA-O 3.5Å; I654-L661 HydrophobicContact CG1-CD2 3.79Å; I654-L676 HydrophobicContact CG2-CD2 4.37Å; I654-V697 WeakPolarHBondContact O-CG1 3.43Å
655	D	94.3	Very high	93.6	Very high	10 Å²	10	20.9 Å²	20.9	5%	0.053	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	96.8	165.2	-173	-9.4	0	0	0	109.7	T657 D658 D659 R660 F662 V697 K717	D655-T657 PolarHBondContact O-N 2.94Å; D655-T657 VanDerWaalsContact O-N 3.13Å; D655-T657 WeakPolarHBondContact OD1-CB 3.37Å; D655-T657 PolarHBondContact OD1-N 2.93Å; D655-T657 PolarHBondContact OD1-OG1 3.11Å; D655-D658 PolarHBondContact O-N 2.86Å; D655-D658 VanDerWaalsContact O-N 3.15Å; D655-D659 PolarHBondContact O-N 3.41Å; D655-R660 HydrophobicContact CB-CB 4.44Å; D655-R660 PolarHBondContact N-O 2.76Å; D655-R660 PolarHBondContact O-N 2.85Å; D655-F662 HydrophobicContact CB-CD2 4.4Å; D655-F662 HydrophobicContact CB-CE2 3.81Å; D655-V697 HydrophobicContact CB-CG1 3.94Å; D655-V697 HydrophobicContact CB-CG2 4.17Å; D655-K717 IonicContact OD1-NZ 3.27Å; D655-K717 WeakPolarHBondContact OD2-CD 3.43Å; D655-K717 VanDerWaalsContact OD2-CE 3.3Å; D655-K717 WeakPolarHBondContact OD2-CE 3.12Å; D655-K717 IonicContact OD2-NZ 3.09Å; D655-K717 PolarHBondContact OD2-NZ 2.85Å
656	F	88.4	Confident	93.9	Very high	48 Å²	48	20.1 Å²	20.1	21%	0.211	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-6.9	177.3	-55.9	-75.9	0	0	0	114.2	W569 H611 I654 A743 P745	W569-F656 HydrophobicContact CH2-CE1 4.27Å; W569-F656 HydrophobicContact CH2-CE2 4.18Å; W569-F656 AromaticContact CH2-CZ 3.7Å; W569-F656 HydrophobicContact CH2-CZ 3.7Å; W569-F656 HydrophobicContact CZ2-CZ 4.45Å; H611-F656 HydrophobicContact CB-CE1 4.36Å; H611-F656 AromaticContact CD2-CD1 3.95Å; H611-F656 AromaticContact CG-CE1 3.99Å; I654-F656 HydrophobicContact CB-CE1 4.11Å; I654-F656 HydrophobicContact CB-CE2 4.38Å; I654-F656 HydrophobicContact CB-CZ 3.99Å; I654-F656 HydrophobicContact CD1-CE1 4.4Å; I654-F656 HydrophobicContact CD1-CZ 4.45Å; I654-F656 HydrophobicContact CG2-CD1 3.78Å; I654-F656 HydrophobicContact CG2-CE1 3.67Å; I654-F656 HydrophobicContact CG2-CG 4.24Å; I654-F656 HydrophobicContact CG2-CZ 4.05Å; I654-F656 PolarHBondContact O-N 3.13Å; F656-A743 WeakPolarHBondContact CD2-O 3.35Å; F656-P745 HydrophobicContact CB-CG 3.6Å; F656-P745 HydrophobicContact CD1-CG 4.39Å; F656-P745 HydrophobicContact CD2-CG 4.26Å; F656-P745 HydrophobicContact CG-CG 3.84Å
657	T	85.6	Confident	93.8	Very high	35 Å²	35	26.2 Å²	26.2	22%	0.215	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-12.3	174.3	68.3	0	0	0	0	113.3	L469 Y472 D655 K717	L469-T657 HydrophobicContact CD1-CG2 3.96Å; Y472-T657 HydrophobicContact CE2-CG2 4.45Å; D655-T657 PolarHBondContact O-N 2.94Å; D655-T657 VanDerWaalsContact O-N 3.13Å; D655-T657 WeakPolarHBondContact OD1-CB 3.37Å; D655-T657 PolarHBondContact OD1-N 2.93Å; D655-T657 PolarHBondContact OD1-OG1 3.11Å; T657-K717 PolarHBondContact OG1-NZ 2.91Å
658	D	86.5	Confident	93.7	Very high	35 Å²	35	25 Å²	25	19%	0.187	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138.8	7.9	-175.1	-157.3	24.6	0	0	0	113.5	R449 D655 R660	R449-D658 IonicContact CZ-OD1 3.89Å; R449-D658 IonicContact CZ-OD2 2.7Å; R449-D658 IonicContact NH1-OD1 3.36Å; R449-D658 PolarHBondContact NH1-OD1 3.33Å; R449-D658 IonicContact NH1-OD2 3.29Å; R449-D658 IonicContact NH2-OD1 3.64Å; R449-D658 PolarHBondContact NH2-OD1 2.64Å; R449-D658 IonicContact NH2-OD2 3.34Å; R449-D658 PolarHBondContact NH2-OD2 3.34Å; D655-D658 PolarHBondContact O-N 2.86Å; D655-D658 VanDerWaalsContact O-N 3.15Å; D658-R660 VanDerWaalsContact C-N 3.27Å; D658-R660 HydrophobicContact CB-CB 4.2Å; D658-R660 PolarHBondContact O-N 2.87Å
659	D	90.6	Very high	93.6	Very high	79 Å²	79	25 Å²	25	42%	0.422	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	40.9	56.3	-171.8	-79.4	-26	0	0	0	111.8	H611 D655 L676	H611-D659 IonicContact CD2-OD1 3.43Å; H611-D659 IonicContact NE2-OD1 2.74Å; H611-D659 PolarHBondContact NE2-OD1 2.84Å; H611-D659 IonicContact NE2-OD2 3.22Å; D655-D659 PolarHBondContact O-N 3.41Å; D659-L676 HydrophobicContact CB-CD1 3.9Å; D659-L676 HydrophobicContact CB-CG 3.95Å; D659-L676 VanDerWaalsContact O-CG 3.27Å; D659-L676 WeakPolarHBondContact O-CG 3.13Å; D659-L676 PolarHBondContact O-N 3.27Å
660	R	93.8	Very high	93.4	Very high	11 Å²	11	25 Å²	25	4%	0.042	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.1	-170.2	-146.1	172.8	-146.8	-78.6	-14.1	112.6	I654 D655 D658 F662 T673 A674 D680	I654-R660 WeakPolarHBondContact CA-O 3.5Å; D655-R660 HydrophobicContact CB-CB 4.44Å; D655-R660 PolarHBondContact N-O 2.76Å; D655-R660 PolarHBondContact O-N 2.85Å; D658-R660 VanDerWaalsContact C-N 3.27Å; D658-R660 HydrophobicContact CB-CB 4.2Å; D658-R660 PolarHBondContact O-N 2.87Å; R660-F662 HydrophobicContact CB-CE2 4.21Å; R660-F662 HydrophobicContact CG-CE2 4.49Å; R660-T673 VanDerWaalsContact NH1-CB 3.34Å; R660-T673 PolarHBondContact NH1-O 3Å; R660-T673 PolarHBondContact NH1-OG1 2.95Å; R660-A674 WeakPolarHBondContact CG-O 3.35Å; R660-D680 IonicContact CZ-OD2 2.68Å; R660-D680 PolarHBondContact NH2-O 3.3Å; R660-D680 IonicContact NH2-OD1 3.01Å; R660-D680 IonicContact NH2-OD2 3.19Å; R660-D680 PolarHBondContact NH2-OD2 3.39Å
661	L	97.1	Very high	93.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	143.2	173.4	-72.7	162.3	0	0	0	110.4	F618 I641 L652 I654 W663 T673 A674 L676	F618-L661 HydrophobicContact CB-CD2 4.15Å; F618-L661 HydrophobicContact CD1-CD1 3.65Å; F618-L661 HydrophobicContact CD1-CD2 4.01Å; F618-L661 HydrophobicContact CD1-CG 4.39Å; F618-L661 HydrophobicContact CD2-CD2 4.31Å; F618-L661 HydrophobicContact CE1-CD1 3.78Å; F618-L661 HydrophobicContact CE1-CD2 4.48Å; F618-L661 HydrophobicContact CG-CD1 4.39Å; F618-L661 HydrophobicContact CG-CD2 3.9Å; I641-L661 HydrophobicContact CG1-CD1 4.47Å; I641-L661 HydrophobicContact CG2-CD1 3.94Å; L652-L661 HydrophobicContact CD1-CD2 4.46Å; L652-L661 HydrophobicContact CD2-CD2 3.87Å; L652-L661 HydrophobicContact CG-CD2 4.29Å; I654-L661 HydrophobicContact CG1-CD2 3.79Å; L661-W663 HydrophobicContact CB-CE3 4.24Å; L661-W663 HydrophobicContact CB-CZ3 4.19Å; L661-T673 WeakPolarHBondContact O-CA 3.37Å; L661-T673 WeakPolarHBondContact O-CB 3.39Å; L661-T673 PolarHBondContact O-OG1 3.03Å; L661-A674 PolarHBondContact N-O 3.18Å; L661-A674 PolarHBondContact O-N 2.85Å; L661-A674 VanDerWaalsContact O-N 3.15Å; L661-L676 HydrophobicContact CD1-CD2 4.47Å; L661-L676 HydrophobicContact CD2-CD2 4.49Å; L661-L676 HydrophobicContact CG-CD2 3.93Å
662	F	97.6	Very high	93.6	Very high	5 Å²	5	25.2 Å²	25.2	2%	0.022	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.1	166.7	-67	-98.1	0	0	0	108.3	L652 T653 D655 R660 E672 T673 L684 L695 L702 K717	L652-F662 CarbonylContact C-O 3.58Å; L652-F662 WeakPolarHBondContact CA-O 3.35Å; T653-F662 HydrophobicContact CG2-CB 3.91Å; T653-F662 PolarHBondContact N-O 2.78Å; T653-F662 PolarHBondContact O-N 3.19Å; D655-F662 HydrophobicContact CB-CD2 4.4Å; D655-F662 HydrophobicContact CB-CE2 3.81Å; R660-F662 HydrophobicContact CB-CE2 4.21Å; R660-F662 HydrophobicContact CG-CE2 4.49Å; F662-E672 WeakPolarHBondContact CA-O 3.17Å; F662-T673 VanDerWaalsContact CD1-CB 3.44Å; F662-T673 HydrophobicContact CD1-CG2 4.03Å; F662-T673 HydrophobicContact CE1-CG2 3.76Å; F662-T673 WeakPolarHBondContact CE1-OG1 3.16Å; F662-T673 WeakPolarHBondContact CZ-OG1 3.41Å; F662-L684 HydrophobicContact CD1-CD2 4.26Å; F662-L684 HydrophobicContact CE1-CD2 4.11Å; F662-L695 HydrophobicContact CB-CD1 4.09Å; F662-L702 HydrophobicContact CB-CD1 4.26Å; F662-L702 HydrophobicContact CD1-CD1 4.31Å; F662-L702 HydrophobicContact CD1-CD2 4.2Å; F662-L702 HydrophobicContact CG-CD1 4.22Å; F662-K717 WeakPolarHBondContact CE1-O 3.35Å; F662-K717 HydrophobicContact CZ-CB 4.41Å
663	W	97.4	Very high	93.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	156.3	172.6	66.1	91.5	0	0	0	111.4	V628 A642 G651 L661 I671 E672 A674 R681	V628-W663 HydrophobicContact CG2-CD2 4.17Å; V628-W663 HydrophobicContact CG2-CG 4.2Å; A642-W663 HydrophobicContact CB-CH2 4.42Å; A642-W663 HydrophobicContact CB-CZ2 4.01Å; G651-W663 WeakPolarHBondContact O-CA 3.25Å; G651-W663 VanDerWaalsContact O-CB 3.3Å; G651-W663 WeakPolarHBondContact O-CB 3.49Å; L661-W663 HydrophobicContact CB-CE3 4.24Å; L661-W663 HydrophobicContact CB-CZ3 4.19Å; W663-I671 WeakPolarHBondContact O-CA 3.39Å; W663-E672 HydrophobicContact CD2-CB 4.18Å; W663-E672 HydrophobicContact CH2-CB 4.29Å; W663-E672 HydrophobicContact CZ2-CB 3.62Å; W663-E672 HydrophobicContact CZ2-CG 4.38Å; W663-E672 PolarHBondContact N-O 3.08Å; W663-E672 PolarHBondContact NE1-OE2 3.07Å; W663-E672 PolarHBondContact O-N 2.88Å; W663-A674 HydrophobicContact CH2-CB 3.74Å; W663-A674 HydrophobicContact CZ3-CB 3.82Å; W663-R681 HydrophobicContact CH2-CG 4.1Å; W663-R681 HydrophobicContact CZ2-CG 4.29Å
664	C	95.9	Very high	93.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	146.8	176.4	62.2	0	0	0	0	111.5	P649 T650 G651 L670 I671 P692 F693 L695	P649-C664 CarbonylContact C-O 3.52Å; P649-C664 WeakPolarHBondContact CA-O 3.27Å; T650-C664 PolarHBondContact N-O 2.89Å; T650-C664 PolarHBondContact OG1-SG 2.78Å; T650-C664 VanDerWaalsContact OG1-SG 3.41Å; G651-C664 PolarHBondContact N-SG 2.81Å; G651-C664 PolarHBondContact O-N 3.07Å; G651-C664 VanDerWaalsContact O-N 3.15Å; C664-L670 WeakPolarHBondContact CA-O 3.35Å; C664-I671 HydrophobicContact CB-CG1 4.03Å; C664-P692 HydrophobicContact CB-CB 3.77Å; C664-P692 HydrophobicContact CB-CG 3.83Å; C664-F693 PolarHBondContact SG-O 2.95Å; C664-L695 HydrophobicContact CB-CD1 4.06Å; C664-L695 HydrophobicContact CB-CD2 4.26Å; C664-L695 HydrophobicContact CB-CG 4.18Å
665	D	95.2	Very high	93.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	113	171	-172.1	-57.9	0	0	0	109.7	M647 S648 K667 R668 G669 L670	M647-D665 WeakPolarHBondContact CA-OD2 3.5Å; M647-D665 PolarHBondContact N-OD2 2.68Å; S648-D665 PolarHBondContact N-OD1 2.62Å; S648-D665 PolarHBondContact N-OD2 2.81Å; S648-D665 WeakPolarHBondContact O-CA 3.28Å; D665-K667 VanDerWaalsContact C-N 3.31Å; D665-K667 PolarHBondContact O-N 2.92Å; D665-K667 PolarHBondContact OD1-N 2.97Å; D665-R668 HydrophobicContact CB-CB 4.08Å; D665-R668 PolarHBondContact OD1-N 2.88Å; D665-G669 PolarHBondContact O-N 2.84Å; D665-L670 HydrophobicContact CB-CD1 4.23Å; D665-L670 HydrophobicContact CB-CG 4.45Å; D665-L670 PolarHBondContact N-O 2.77Å; D665-L670 PolarHBondContact O-N 2.91Å
666	Q	93.1	Very high	93.3	Very high	30 Å²	30	25.2 Å²	25.2	14%	0.14	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-29.3	-174.4	-174.3	174.4	32.6	0	0	113	S648 T650 R691 P692 W707	S648-Q666 PolarHBondContact O-N 3.35Å; T650-Q666 HydrophobicContact CG2-CB 3.74Å; Q666-R691 HydrophobicContact CG-CB 4.36Å; Q666-P692 WeakPolarHBondContact CB-O 3.3Å; Q666-P692 WeakPolarHBondContact CG-O 3.41Å; Q666-W707 VanDerWaalsContact NE2-CE3 3.3Å
667	K	91.9	Very high	93.4	Very high	141 Å²	141	27.8 Å²	27.8	61%	0.613	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-33.4	-178.6	-74.1	178.8	-159.4	151.5	0	112.1	M647 D665	M647-K667 HydrophobicContact CB-CB 4.07Å; M647-K667 HydrophobicContact CB-CD 4.39Å; M647-K667 PolarHBondContact O-NZ 2.86Å; D665-K667 VanDerWaalsContact C-N 3.31Å; D665-K667 PolarHBondContact O-N 2.92Å; D665-K667 PolarHBondContact OD1-N 2.97Å
668	R	91.4	Very high	93.7	Very high	82 Å²	82	27 Å²	27	31%	0.309	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-18.5	175.4	-67.4	-170.6	64.5	-166.9	-5.9	113.6	G645 M647 D665 L670 E686	G645-R668 WeakPolarHBondContact O-CD 3.42Å; G645-R668 PolarHBondContact O-NH1 2.87Å; M647-R668 HydrophobicContact CB-CG 4.08Å; M647-R668 HydrophobicContact CG-CG 3.83Å; D665-R668 HydrophobicContact CB-CB 4.08Å; D665-R668 PolarHBondContact OD1-N 2.88Å; R668-L670 HydrophobicContact CB-CD2 4.03Å; R668-L670 HydrophobicContact CB-CG 3.84Å; R668-L670 VanDerWaalsContact NH2-CD2 3.26Å; R668-E686 IonicContact CZ-OE1 2.82Å; R668-E686 IonicContact NH2-OE1 2.69Å; R668-E686 PolarHBondContact NH2-OE1 3Å
669	G	91.3	Very high	93.8	Very high	6 Å²	6	28 Å²	28	6%	0.062	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	36.4	179.9	0	0	0	0	0	113.3	D665 N687 G690	D665-G669 PolarHBondContact O-N 2.84Å; G669-N687 PolarHBondContact O-N 2.86Å; G669-G690 WeakPolarHBondContact CA-O 3.4Å
670	L	93.2	Very high	93.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	166.4	-174.6	73.7	67.2	0	0	0	113	C664 D665 R668 E672 V683 I685 E686	C664-L670 WeakPolarHBondContact CA-O 3.35Å; D665-L670 HydrophobicContact CB-CD1 4.23Å; D665-L670 HydrophobicContact CB-CG 4.45Å; D665-L670 PolarHBondContact N-O 2.77Å; D665-L670 PolarHBondContact O-N 2.91Å; R668-L670 HydrophobicContact CB-CD2 4.03Å; R668-L670 HydrophobicContact CB-CG 3.84Å; R668-L670 VanDerWaalsContact NH2-CD2 3.26Å; L670-E672 HydrophobicContact CD1-CG 3.48Å; L670-E672 VanDerWaalsContact CD1-CG 3.48Å; L670-V683 HydrophobicContact CD2-CG1 4.46Å; L670-I685 CarbonylContact C-O 3.53Å; L670-I685 WeakPolarHBondContact CA-O 3.32Å; L670-I685 WeakPolarHBondContact CB-O 3.24Å; L670-E686 HydrophobicContact CB-CB 4.18Å; L670-E686 HydrophobicContact CB-CG 4.04Å; L670-E686 HydrophobicContact CD2-CG 3.99Å
671	I	96.1	Very high	93.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.4	175.8	-61.4	172.7	0	0	0	108.5	W663 C664 L684 I685 V689 L695 L702 I704	W663-I671 WeakPolarHBondContact O-CA 3.39Å; C664-I671 HydrophobicContact CB-CG1 4.03Å; I671-L684 HydrophobicContact CG2-CB 4.33Å; I671-L684 HydrophobicContact CG2-CD2 4.16Å; I671-L684 PolarHBondContact O-N 2.94Å; I671-I685 PolarHBondContact N-O 3.07Å; I671-I685 PolarHBondContact O-N 2.79Å; I671-V689 HydrophobicContact CD1-CG1 4.23Å; I671-V689 HydrophobicContact CD1-CG2 4.37Å; I671-V689 HydrophobicContact CG1-CG2 4.48Å; I671-L695 HydrophobicContact CD1-CD2 3.95Å; I671-L695 HydrophobicContact CG1-CD2 4.42Å; I671-L695 HydrophobicContact CG2-CD1 4.24Å; I671-L702 HydrophobicContact CD1-CD2 4.12Å; I671-L702 HydrophobicContact CG2-CD2 3.91Å; I671-I704 HydrophobicContact CD1-CD1 3.39Å; I671-I704 HydrophobicContact CD1-CG1 3.61Å; I671-I704 HydrophobicContact CD1-CG2 4.29Å
672	E	95.4	Very high	93.2	Very high	9 Å²	9	34.7 Å²	34.7	4%	0.042	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	165.5	174.9	-57.3	-170.4	87.2	0	0	111.3	F662 W663 L670 R681 R682 V683	F662-E672 WeakPolarHBondContact CA-O 3.17Å; W663-E672 HydrophobicContact CD2-CB 4.18Å; W663-E672 HydrophobicContact CH2-CB 4.29Å; W663-E672 HydrophobicContact CZ2-CB 3.62Å; W663-E672 HydrophobicContact CZ2-CG 4.38Å; W663-E672 PolarHBondContact N-O 3.08Å; W663-E672 PolarHBondContact NE1-OE2 3.07Å; W663-E672 PolarHBondContact O-N 2.88Å; L670-E672 HydrophobicContact CD1-CG 3.48Å; L670-E672 VanDerWaalsContact CD1-CG 3.48Å; E672-R681 IonicContact OE1-CZ 3.56Å; E672-R681 VanDerWaalsContact OE1-CZ 3.26Å; E672-R681 IonicContact OE1-NE 3.11Å; E672-R681 PolarHBondContact OE1-NE 2.89Å; E672-R681 IonicContact OE1-NH2 3.33Å; E672-R681 PolarHBondContact OE1-NH2 3Å; E672-R681 IonicContact OE2-CZ 2.95Å; E672-R681 IonicContact OE2-NE 2.73Å; E672-R681 IonicContact OE2-NH2 2.71Å; E672-R681 PolarHBondContact OE2-NH2 2.89Å; E672-R682 WeakPolarHBondContact CA-O 3.33Å; E672-V683 HydrophobicContact CG-CG2 4.29Å
673	T	95.9	Very high	92.9	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	140.5	177.4	174.7	0	0	0	0	111.9	R660 L661 F662 R681 R682 L684	R660-T673 VanDerWaalsContact NH1-CB 3.34Å; R660-T673 PolarHBondContact NH1-O 3Å; R660-T673 PolarHBondContact NH1-OG1 2.95Å; L661-T673 WeakPolarHBondContact O-CA 3.37Å; L661-T673 WeakPolarHBondContact O-CB 3.39Å; L661-T673 PolarHBondContact O-OG1 3.03Å; F662-T673 VanDerWaalsContact CD1-CB 3.44Å; F662-T673 HydrophobicContact CD1-CG2 4.03Å; F662-T673 HydrophobicContact CE1-CG2 3.76Å; F662-T673 WeakPolarHBondContact CE1-OG1 3.16Å; F662-T673 WeakPolarHBondContact CZ-OG1 3.41Å; T673-R681 WeakPolarHBondContact O-CA 3.02Å; T673-R682 HydrophobicContact CG2-CG 3.92Å; T673-R682 PolarHBondContact N-O 3.33Å; T673-R682 PolarHBondContact O-N 2.04Å; T673-L684 HydrophobicContact CG2-CB 4.29Å
674	A	95.8	Very high	92.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	165.9	-179.9	0	0	0	0	0	110.3	R660 L661 W663 R681	R660-A674 WeakPolarHBondContact CG-O 3.35Å; L661-A674 PolarHBondContact N-O 3.18Å; L661-A674 PolarHBondContact O-N 2.85Å; L661-A674 VanDerWaalsContact O-N 3.15Å; W663-A674 HydrophobicContact CH2-CB 3.74Å; W663-A674 HydrophobicContact CZ3-CB 3.82Å; A674-R681 HydrophobicContact CB-CB 3.89Å; A674-R681 HydrophobicContact CB-CG 4.35Å
675	A	93.4	Very high	92.4	Very high	24 Å²	24	39.1 Å²	39.1	20%	0.198	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	166	168.3	0	0	0	0	0	111.6	D677 G678 S679	A675-D677 WeakPolarHBondContact CB-OD1 3Å; A675-D677 PolarHBondContact O-N 2.91Å; A675-G678 PolarHBondContact O-N 2.6Å; A675-S679 PolarHBondContact N-O 3.02Å
676	L	93.4	Very high	92	Very high	22 Å²	22	43.1 Å²	43.1	12%	0.115	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-9.8	-178.9	-56.2	-169.8	0	0	0	115.3	F618 I654 D659 L661	F618-L676 HydrophobicContact CE1-CB 4.4Å; F618-L676 HydrophobicContact CE2-CD2 4.48Å; F618-L676 HydrophobicContact CZ-CB 4.01Å; F618-L676 HydrophobicContact CZ-CD1 4.37Å; F618-L676 HydrophobicContact CZ-CD2 4.09Å; F618-L676 HydrophobicContact CZ-CG 4.35Å; I654-L676 HydrophobicContact CG2-CD2 4.37Å; D659-L676 HydrophobicContact CB-CD1 3.9Å; D659-L676 HydrophobicContact CB-CG 3.95Å; D659-L676 VanDerWaalsContact O-CG 3.27Å; D659-L676 WeakPolarHBondContact O-CG 3.13Å; D659-L676 PolarHBondContact O-N 3.27Å; L661-L676 HydrophobicContact CD1-CD2 4.47Å; L661-L676 HydrophobicContact CD2-CD2 4.49Å; L661-L676 HydrophobicContact CG-CD2 3.93Å
677	D	91	Very high	91.3	Very high	101 Å²	101	48 Å²	48	54%	0.54	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.5	175.6	68.4	-11.3	0	0	0	113.5	A675 S679	A675-D677 WeakPolarHBondContact CB-OD1 3Å; A675-D677 PolarHBondContact O-N 2.91Å; D677-S679 VanDerWaalsContact OD1-CB 3.24Å; D677-S679 WeakPolarHBondContact OD1-CB 3.15Å; D677-S679 PolarHBondContact OD1-N 2.9Å; D677-S679 PolarHBondContact OD1-OG 2.74Å; D677-S679 PolarHBondContact OD2-OG 2.61Å
678	G	91	Very high	90.7	Very high	19 Å²	19	46.9 Å²	46.9	20%	0.196	24%	0.244	C	C	.	.	S	Bend	trans	90.5	-3.8	-175.2	0	0	0	0	0	115.2	A675	A675-G678 PolarHBondContact O-N 2.6Å
679	S	89.1	Confident	90.2	Very high	57 Å²	57	43 Å²	43	40%	0.399	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	163	174.4	71.6	0	0	0	0	112.5	A675 D677 R681	A675-S679 PolarHBondContact N-O 3.02Å; D677-S679 VanDerWaalsContact OD1-CB 3.24Å; D677-S679 WeakPolarHBondContact OD1-CB 3.15Å; D677-S679 PolarHBondContact OD1-N 2.9Å; D677-S679 PolarHBondContact OD1-OG 2.74Å; D677-S679 PolarHBondContact OD2-OG 2.61Å; S679-R681 PolarHBondContact O-N 3.41Å; S679-R681 VanDerWaalsContact O-N 3.12Å
680	D	87.3	Confident	90.1	Very high	92 Å²	92	43.5 Å²	43.5	49%	0.492	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	36	-178.5	-173.2	19.8	0	0	0	113.4	R660 R682	R660-D680 IonicContact CZ-OD2 2.68Å; R660-D680 PolarHBondContact NH2-O 3.3Å; R660-D680 IonicContact NH2-OD1 3.01Å; R660-D680 IonicContact NH2-OD2 3.19Å; R660-D680 PolarHBondContact NH2-OD2 3.39Å; D680-R682 PolarHBondContact O-N 3.08Å; D680-R682 IonicContact OD1-CZ 3.19Å; D680-R682 IonicContact OD1-NE 2.7Å; D680-R682 PolarHBondContact OD1-NE 3.04Å; D680-R682 IonicContact OD1-NH2 2.68Å; D680-R682 PolarHBondContact OD1-NH2 2.85Å; D680-R682 IonicContact OD2-CZ 2.72Å; D680-R682 IonicContact OD2-NE 3.47Å; D680-R682 IonicContact OD2-NH2 3.35Å; D680-R682 PolarHBondContact OD2-NH2 3.46Å
681	R	92.6	Very high	90.1	Very high	72 Å²	72	50.4 Å²	50.4	27%	0.272	26%	0.26	S	S	.	.			trans	-65.3	123.4	175.1	-179.3	179.3	172.8	-169.2	6.6	110.5	T644 W663 E672 T673 A674 S679	T644-R681 VanDerWaalsContact O-CZ 3.29Å; T644-R681 PolarHBondContact O-NH1 3.31Å; T644-R681 PolarHBondContact O-NH2 2.79Å; T644-R681 PolarHBondContact OG1-NH1 2.94Å; W663-R681 HydrophobicContact CH2-CG 4.1Å; W663-R681 HydrophobicContact CZ2-CG 4.29Å; E672-R681 IonicContact OE1-CZ 3.56Å; E672-R681 VanDerWaalsContact OE1-CZ 3.26Å; E672-R681 IonicContact OE1-NE 3.11Å; E672-R681 PolarHBondContact OE1-NE 2.89Å; E672-R681 IonicContact OE1-NH2 3.33Å; E672-R681 PolarHBondContact OE1-NH2 3Å; E672-R681 IonicContact OE2-CZ 2.95Å; E672-R681 IonicContact OE2-NE 2.73Å; E672-R681 IonicContact OE2-NH2 2.71Å; E672-R681 PolarHBondContact OE2-NH2 2.89Å; T673-R681 WeakPolarHBondContact O-CA 3.02Å; A674-R681 HydrophobicContact CB-CB 3.89Å; A674-R681 HydrophobicContact CB-CG 4.35Å; S679-R681 PolarHBondContact O-N 3.41Å; S679-R681 VanDerWaalsContact O-N 3.12Å
682	R	90.1	Very high	90	Very high	65 Å²	65	50.4 Å²	50.4	25%	0.245	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.7	178.8	61	178.1	107.4	154.4	2.3	112	A447 E672 T673 D680	A447-R682 PolarHBondContact O-NH1 2.93Å; E672-R682 WeakPolarHBondContact CA-O 3.33Å; T673-R682 HydrophobicContact CG2-CG 3.92Å; T673-R682 PolarHBondContact N-O 3.33Å; T673-R682 PolarHBondContact O-N 2.04Å; D680-R682 PolarHBondContact O-N 3.08Å; D680-R682 IonicContact OD1-CZ 3.19Å; D680-R682 IonicContact OD1-NE 2.7Å; D680-R682 PolarHBondContact OD1-NE 3.04Å; D680-R682 IonicContact OD1-NH2 2.68Å; D680-R682 PolarHBondContact OD1-NH2 2.85Å; D680-R682 IonicContact OD2-CZ 2.72Å; D680-R682 IonicContact OD2-NE 3.47Å; D680-R682 IonicContact OD2-NH2 3.35Å; D680-R682 PolarHBondContact OD2-NH2 3.46Å
683	V	91.4	Very high	90	Very high	71 Å²	71	50.5 Å²	50.5	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.3	169.5	-178.2	0	0	0	0	108.5	L670 E672 E686	L670-V683 HydrophobicContact CD2-CG1 4.46Å; E672-V683 HydrophobicContact CG-CG2 4.29Å; V683-E686 HydrophobicContact CG1-CB 4.18Å
684	L	90.9	Very high	90	Very high	21 Å²	21	51.4 Å²	51.4	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-44.5	-179.5	-175.9	66.9	0	0	0	112	F662 I671 T673 L702 K717	F662-L684 HydrophobicContact CD1-CD2 4.26Å; F662-L684 HydrophobicContact CE1-CD2 4.11Å; I671-L684 HydrophobicContact CG2-CB 4.33Å; I671-L684 HydrophobicContact CG2-CD2 4.16Å; I671-L684 PolarHBondContact O-N 2.94Å; T673-L684 HydrophobicContact CG2-CB 4.29Å; L684-L702 HydrophobicContact CD2-CD2 3.93Å; L684-K717 VanDerWaalsContact CD1-O 3.3Å; L684-K717 WeakPolarHBondContact CD1-O 3.43Å; L684-K717 WeakPolarHBondContact CD2-O 3.4Å
685	I	90.1	Very high	90	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	139.1	175.5	-57.8	172.1	0	0	0	108.2	L670 I671 Q688 V689 V715	L670-I685 CarbonylContact C-O 3.53Å; L670-I685 WeakPolarHBondContact CA-O 3.32Å; L670-I685 WeakPolarHBondContact CB-O 3.24Å; I671-I685 PolarHBondContact N-O 3.07Å; I671-I685 PolarHBondContact O-N 2.79Å; I685-Q688 HydrophobicContact CG2-CB 3.82Å; I685-Q688 HydrophobicContact CG2-CG 4.42Å; I685-V689 HydrophobicContact CB-CG2 4.01Å; I685-V689 HydrophobicContact CG2-CG2 3.51Å; I685-V715 HydrophobicContact CD1-CB 4.07Å; I685-V715 HydrophobicContact CD1-CG1 3.83Å; I685-V715 HydrophobicContact CD1-CG2 3.63Å
686	E	87.1	Confident	90.2	Very high	84 Å²	84	50.6 Å²	50.6	39%	0.393	26%	0.258	S	S	.	.			trans	-126.4	149.9	170.5	-166.3	170.5	-140.4	0	0	110.3	R668 L670 V683 Q688	R668-E686 IonicContact CZ-OE1 2.82Å; R668-E686 IonicContact NH2-OE1 2.69Å; R668-E686 PolarHBondContact NH2-OE1 3Å; L670-E686 HydrophobicContact CB-CB 4.18Å; L670-E686 HydrophobicContact CB-CG 4.04Å; L670-E686 HydrophobicContact CD2-CG 3.99Å; V683-E686 HydrophobicContact CG1-CB 4.18Å; E686-Q688 PolarHBondContact O-N 3.39Å
687	N	78.8	Confident	90.4	Very high	132 Å²	132	50.4 Å²	50.4	71%	0.706	26%	0.258	S	S	*	.	S	Bend	trans	59.9	-11	174	-60.3	-43.6	0	0	0	118.3	G669	G669-N687 PolarHBondContact O-N 2.86Å
688	Q	79.6	Confident	90.5	Very high	118 Å²	118	46.1 Å²	46.1	55%	0.551	23%	0.234	S	C	*	.	S	Bend	trans	-93.3	-12.7	-177.1	-65.6	174.1	64.6	0	0	113.8	I685 E686 R713 L723	I685-Q688 HydrophobicContact CG2-CB 3.82Å; I685-Q688 HydrophobicContact CG2-CG 4.42Å; E686-Q688 PolarHBondContact O-N 3.39Å; Q688-R713 PolarHBondContact O-NH1 2.03Å; Q688-L723 HydrophobicContact CB-CD2 4.06Å
689	V	81.3	Confident	90.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	-99.2	0.8	-166.7	-142.5	0	0	0	0	114	I671 I685 R691 P692 I704 E706	I671-V689 HydrophobicContact CD1-CG1 4.23Å; I671-V689 HydrophobicContact CD1-CG2 4.37Å; I671-V689 HydrophobicContact CG1-CG2 4.48Å; I685-V689 HydrophobicContact CB-CG2 4.01Å; I685-V689 HydrophobicContact CG2-CG2 3.51Å; V689-R691 PolarHBondContact O-N 3.44Å; V689-P692 HydrophobicContact CG1-CB 4.37Å; V689-I704 HydrophobicContact CG1-CD1 4.01Å; V689-I704 HydrophobicContact CG1-CG2 3.86Å; V689-E706 WeakPolarHBondContact O-CG 3.36Å
690	G	87.8	Confident	90.7	Very high	17 Å²	17	45.9 Å²	45.9	18%	0.175	22%	0.223	C	C	.	.	S	Bend	trans	63.2	-122.1	-178.8	0	0	0	0	0	111.5	G669 P692 E708	G669-G690 WeakPolarHBondContact CA-O 3.4Å; G690-P692 VanDerWaalsContact O-CD 3.27Å; G690-P692 WeakPolarHBondContact O-CD 3.06Å; G690-E708 VanDerWaalsContact CA-OE2 3.24Å; G690-E708 WeakPolarHBondContact CA-OE2 3.33Å
691	R	93	Very high	91	Very high	144 Å²	144	46 Å²	46	54%	0.543	22%	0.216	S	C	.	.	S	Bend	trans	-112.2	83.8	176	-67.1	-178.1	-178.9	-157.9	-2.1	110.7	Q666 V689 E706 W707 E708	Q666-R691 HydrophobicContact CG-CB 4.36Å; V689-R691 PolarHBondContact O-N 3.44Å; R691-E706 PolarHBondContact N-OE1 3.21Å; R691-W707 HydrophobicContact CB-CB 4.31Å; R691-W707 PolarHBondContact O-N 3.26Å; R691-E708 HydrophobicContact CB-CB 4.2Å; R691-E708 HydrophobicContact CG-CB 4.14Å
692	P	95	Very high	91.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	145.1	175.7	30.5	-35.7	0	0	0	110.3	C664 Q666 V689 G690 I704 S705	C664-P692 HydrophobicContact CB-CB 3.77Å; C664-P692 HydrophobicContact CB-CG 3.83Å; Q666-P692 WeakPolarHBondContact CB-O 3.3Å; Q666-P692 WeakPolarHBondContact CG-O 3.41Å; V689-P692 HydrophobicContact CG1-CB 4.37Å; G690-P692 VanDerWaalsContact O-CD 3.27Å; G690-P692 WeakPolarHBondContact O-CD 3.06Å; P692-I704 HydrophobicContact CB-CG2 3.8Å; P692-S705 CarbonylContact C-O 3.58Å; P692-S705 WeakPolarHBondContact CA-O 3.47Å
693	F	94.6	Very high	91.5	Very high	12 Å²	12	39.9 Å²	39.9	5%	0.053	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-55.6	177.9	-178.6	-96.5	0	0	0	112.1	L520 T650 G651 C664 S705 W707 A734	L520-F693 HydrophobicContact CB-CZ 4.38Å; L520-F693 HydrophobicContact CD1-CZ 4.31Å; T650-F693 WeakPolarHBondContact CB-O 3.14Å; T650-F693 PolarHBondContact OG1-O 3.44Å; G651-F693 VanDerWaalsContact CA-O 3.28Å; G651-F693 WeakPolarHBondContact CA-O 3.35Å; G651-F693 PolarHBondContact N-O 2.98Å; C664-F693 PolarHBondContact SG-O 2.95Å; F693-S705 PolarHBondContact N-O 3.46Å; F693-W707 HydrophobicContact CB-CD2 4.25Å; F693-W707 HydrophobicContact CB-CG 4.26Å; F693-W707 HydrophobicContact CB-CZ2 4.34Å; F693-W707 HydrophobicContact CD1-CZ2 4.07Å; F693-W707 HydrophobicContact CD2-CD2 4.14Å; F693-W707 AromaticContact CD2-CE2 3.47Å; F693-W707 VanDerWaalsContact CD2-CE2 3.47Å; F693-W707 HydrophobicContact CD2-CE3 4.46Å; F693-W707 AromaticContact CD2-CH2 3.61Å; F693-W707 HydrophobicContact CD2-CH2 3.61Å; F693-W707 AromaticContact CD2-CZ2 3.19Å; F693-W707 HydrophobicContact CD2-CZ2 3.19Å; F693-W707 HydrophobicContact CD2-CZ3 4.22Å; F693-W707 AromaticContact CD2-NE1 3.97Å; F693-W707 HydrophobicContact CE1-CZ2 4.18Å; F693-W707 AromaticContact CE2-CH2 3.52Å; F693-W707 HydrophobicContact CE2-CH2 3.52Å; F693-W707 AromaticContact CE2-CZ2 3.33Å; F693-W707 HydrophobicContact CE2-CZ2 3.33Å; F693-W707 HydrophobicContact CE2-CZ3 4.41Å; F693-W707 HydrophobicContact CG-CD2 4.35Å; F693-W707 AromaticContact CG-CE2 3.52Å; F693-W707 HydrophobicContact CG-CH2 4.43Å; F693-W707 AromaticContact CG-CZ2 3.59Å; F693-W707 HydrophobicContact CG-CZ2 3.59Å; F693-W707 AromaticContact CG-NE1 3.5Å; F693-W707 HydrophobicContact CZ-CH2 4.28Å; F693-W707 AromaticContact CZ-CZ2 3.83Å; F693-W707 HydrophobicContact CZ-CZ2 3.83Å; F693-A734 HydrophobicContact CD1-CB 4.09Å; F693-A734 HydrophobicContact CE1-CB 3.8Å
694	D	96.5	Very high	91.7	Very high	21 Å²	21	36.5 Å²	36.5	11%	0.112	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	164.5	-179.9	-163	24	0	0	0	113.1	G651 I704 S705 S735 V736	G651-D694 WeakPolarHBondContact CA-OD1 3.34Å; D694-I704 WeakPolarHBondContact O-CA 3.4Å; D694-S705 WeakPolarHBondContact CA-OG 3.4Å; D694-S705 WeakPolarHBondContact CB-OG 3.44Å; D694-S705 PolarHBondContact N-OG 3.45Å; D694-S705 PolarHBondContact O-N 3.42Å; D694-S705 PolarHBondContact O-OG 3.38Å; D694-S735 WeakPolarHBondContact OD2-CA 3.48Å; D694-S735 VanDerWaalsContact OD2-CB 3.24Å; D694-S735 WeakPolarHBondContact OD2-CB 3.3Å; D694-S735 PolarHBondContact OD2-OG 3.42Å; D694-V736 HydrophobicContact CB-CG1 4.41Å; D694-V736 PolarHBondContact OD2-N 3.43Å; D694-V736 VanDerWaalsContact OD2-N 3.12Å
695	L	96.9	Very high	91.9	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.3	-173.7	-62.2	179.5	0	0	0	112.4	T653 F662 C664 I671 L702 W703 I704	T653-L695 VanDerWaalsContact CB-O 3.31Å; T653-L695 WeakPolarHBondContact CB-O 3.48Å; T653-L695 HydrophobicContact CG2-CB 3.7Å; F662-L695 HydrophobicContact CB-CD1 4.09Å; C664-L695 HydrophobicContact CB-CD1 4.06Å; C664-L695 HydrophobicContact CB-CD2 4.26Å; C664-L695 HydrophobicContact CB-CG 4.18Å; I671-L695 HydrophobicContact CD1-CD2 3.95Å; I671-L695 HydrophobicContact CG1-CD2 4.42Å; I671-L695 HydrophobicContact CG2-CD1 4.24Å; L695-L702 HydrophobicContact CB-CD1 4.37Å; L695-L702 HydrophobicContact CD2-CD2 4.23Å; L695-L702 HydrophobicContact CD2-CG 4.39Å; L695-W703 WeakPolarHBondContact CA-O 3.04Å; L695-I704 HydrophobicContact CD2-CB 4.11Å; L695-I704 HydrophobicContact CD2-CG1 3.64Å; L695-I704 HydrophobicContact CD2-CG2 3.97Å
696	A	97	Very high	92	Very high	5 Å²	5	35.1 Å²	35.1	4%	0.041	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.4	165.4	0	0	0	0	0	111.1	L702 W703 V736 V738	A696-L702 CarbonylContact O-C 3.48Å; A696-L702 WeakPolarHBondContact O-CA 3Å; A696-W703 PolarHBondContact N-O 2.78Å; A696-W703 PolarHBondContact O-N 2.82Å; A696-V736 HydrophobicContact CB-CG1 4.31Å; A696-V736 HydrophobicContact CB-CG2 4.34Å; A696-V736 WeakPolarHBondContact CB-O 3.46Å; A696-V738 HydrophobicContact CB-CG2 3.94Å
697	V	96.2	Very high	92.2	Very high	18 Å²	18	33.9 Å²	33.9	11%	0.109	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.9	-179.5	64.5	0	0	0	0	111.4	T653 I654 D655 L702 K717	T653-V697 HydrophobicContact CG2-CB 4.21Å; T653-V697 HydrophobicContact CG2-CG1 3.97Å; I654-V697 WeakPolarHBondContact O-CG1 3.43Å; D655-V697 HydrophobicContact CB-CG1 3.94Å; D655-V697 HydrophobicContact CB-CG2 4.17Å; V697-L702 HydrophobicContact CB-CD1 3.91Å; V697-L702 HydrophobicContact CG2-CD1 4.39Å; V697-K717 HydrophobicContact CG2-CB 4.34Å; V697-K717 HydrophobicContact CG2-CD 3.92Å
698	F	94.7	Very high	92.7	Very high	10 Å²	10	32.9 Å²	32.9	4%	0.044	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	142.5	175.5	-173.5	-109.6	0	0	0	110.6	A483 A488 D700 R701 W703 V738 H740 L742 A743	A483-F698 HydrophobicContact CB-CE1 4.1Å; A483-F698 HydrophobicContact CB-CZ 3.6Å; A488-F698 HydrophobicContact CB-CD1 4.07Å; A488-F698 HydrophobicContact CB-CE1 3.74Å; F698-D700 PolarHBondContact O-N 3.21Å; F698-R701 PolarHBondContact N-O 2.68Å; F698-R701 PolarHBondContact O-N 2.98Å; F698-R701 VanDerWaalsContact O-O 3.12Å; F698-W703 HydrophobicContact CB-CH2 4.1Å; F698-W703 HydrophobicContact CB-CZ3 3.68Å; F698-W703 WeakPolarHBondContact O-CZ3 3.22Å; F698-V738 HydrophobicContact CB-CB 4.15Å; F698-V738 HydrophobicContact CB-CG1 3.75Å; F698-V738 HydrophobicContact CB-CG2 3.98Å; F698-V738 HydrophobicContact CD1-CG1 4.01Å; F698-V738 HydrophobicContact CD2-CG1 4.33Å; F698-V738 HydrophobicContact CG-CG1 3.78Å; F698-H740 HydrophobicContact CE1-CB 4.2Å; F698-H740 HydrophobicContact CE2-CB 3.85Å; F698-H740 AromaticContact CE2-CG 3.9Å; F698-H740 AromaticContact CE2-ND1 3.64Å; F698-H740 HydrophobicContact CZ-CB 3.65Å; F698-H740 AromaticContact CZ-CE1 3.98Å; F698-H740 AromaticContact CZ-CG 3.37Å; F698-H740 AromaticContact CZ-ND1 3.27Å; F698-H740 VanDerWaalsContact CZ-ND1 3.27Å; F698-H740 WeakPolarHBondContact CZ-ND1 3.38Å; F698-L742 HydrophobicContact CE2-CB 4.29Å; F698-A743 HydrophobicContact CD2-CB 3.89Å; F698-A743 HydrophobicContact CE2-CB 4.18Å
699	E	92.8	Very high	93.2	Very high	59 Å²	59	31.9 Å²	31.9	28%	0.276	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-121.8	-169.8	-65.6	178.3	161.3	0	0	111.2	Y472 I482 A483 K717	Y472-E699 HydrophobicContact CE1-CG 4.15Å; I482-E699 WeakPolarHBondContact CA-OE1 3.5Å; A483-E699 HydrophobicContact CB-CG 4.5Å; A483-E699 WeakPolarHBondContact CB-OE1 3.02Å; A483-E699 PolarHBondContact N-OE1 2.84Å; E699-K717 VanDerWaalsContact O-CD 3.3Å; E699-K717 WeakPolarHBondContact O-CD 3.45Å; E699-K717 WeakPolarHBondContact O-CE 3.29Å; E699-K717 PolarHBondContact O-NZ 2.99Å
700	D	91.7	Very high	93.6	Very high	13 Å²	13	36.9 Å²	36.9	7%	0.07	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	5.9	178.7	-71.4	-36.8	0	0	0	113.7	S453 R480 F698 H716 K717	S453-D700 WeakPolarHBondContact CB-OD1 3.48Å; S453-D700 WeakPolarHBondContact CB-OD2 3.44Å; S453-D700 PolarHBondContact OG-OD1 2.83Å; S453-D700 PolarHBondContact OG-OD2 2.65Å; R480-D700 WeakPolarHBondContact CG-OD2 3.5Å; F698-D700 PolarHBondContact O-N 3.21Å; D700-H716 CarbonylContact O-C 3.56Å; D700-H716 WeakPolarHBondContact O-CA 3.41Å; D700-H716 PolarHBondContact O-CD2 2.81Å; D700-K717 PolarHBondContact O-N 3Å
701	R	93.7	Very high	93.8	Very high	93 Å²	93	37.3 Å²	37.3	35%	0.351	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.7	-170.6	-76.5	-179.7	175.9	-89.2	5.2	112.2	F698 W703 S714 V715	F698-R701 PolarHBondContact N-O 2.68Å; F698-R701 PolarHBondContact O-N 2.98Å; F698-R701 VanDerWaalsContact O-O 3.12Å; R701-W703 HydrophobicContact CB-CD2 4.46Å; R701-W703 HydrophobicContact CB-CE3 4.12Å; R701-W703 HydrophobicContact CB-CH2 3.45Å; R701-W703 VanDerWaalsContact CB-CH2 3.45Å; R701-W703 HydrophobicContact CB-CZ2 3.83Å; R701-W703 HydrophobicContact CB-CZ3 3.58Å; R701-W703 HydrophobicContact CG-CH2 4.45Å; R701-W703 VanDerWaalsContact O-CZ3 3.3Å; R701-W703 WeakPolarHBondContact O-CZ3 3.4Å; R701-S714 PolarHBondContact NH1-OG 3.13Å; R701-V715 WeakPolarHBondContact CA-O 3.5Å
702	L	95.6	Very high	93.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.9	166.7	-172.8	74.9	0	0	0	107.2	T653 F662 I671 L684 L695 A696 V697 I704 S714 V715 K717	T653-L702 HydrophobicContact CG2-CD1 4.12Å; F662-L702 HydrophobicContact CB-CD1 4.26Å; F662-L702 HydrophobicContact CD1-CD1 4.31Å; F662-L702 HydrophobicContact CD1-CD2 4.2Å; F662-L702 HydrophobicContact CG-CD1 4.22Å; I671-L702 HydrophobicContact CD1-CD2 4.12Å; I671-L702 HydrophobicContact CG2-CD2 3.91Å; L684-L702 HydrophobicContact CD2-CD2 3.93Å; L695-L702 HydrophobicContact CB-CD1 4.37Å; L695-L702 HydrophobicContact CD2-CD2 4.23Å; L695-L702 HydrophobicContact CD2-CG 4.39Å; A696-L702 CarbonylContact O-C 3.48Å; A696-L702 WeakPolarHBondContact O-CA 3Å; V697-L702 HydrophobicContact CB-CD1 3.91Å; V697-L702 HydrophobicContact CG2-CD1 4.39Å; L702-I704 HydrophobicContact CD2-CG1 4.44Å; L702-I704 HydrophobicContact CG-CG1 4.41Å; L702-S714 CarbonylContact O-C 3.55Å; L702-S714 WeakPolarHBondContact O-CA 3.44Å; L702-V715 HydrophobicContact CB-CG1 4.03Å; L702-V715 HydrophobicContact CD2-CG1 4.4Å; L702-V715 PolarHBondContact N-O 2.88Å; L702-V715 PolarHBondContact O-N 3.43Å; L702-K717 HydrophobicContact CB-CB 4.35Å
703	W	96.2	Very high	93.8	Very high	9 Å²	9	31.2 Å²	31.2	3%	0.034	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.8	171.5	-66.2	-99.3	0	0	0	109.1	L490 P503 L695 A696 F698 R701 I712 R713 V738	L490-W703 HydrophobicContact CD1-CG 4.27Å; L490-W703 HydrophobicContact CD2-CD2 4.18Å; L490-W703 HydrophobicContact CD2-CG 4.18Å; P503-W703 HydrophobicContact CB-CZ2 3.95Å; L695-W703 WeakPolarHBondContact CA-O 3.04Å; A696-W703 PolarHBondContact N-O 2.78Å; A696-W703 PolarHBondContact O-N 2.82Å; F698-W703 HydrophobicContact CB-CH2 4.1Å; F698-W703 HydrophobicContact CB-CZ3 3.68Å; F698-W703 WeakPolarHBondContact O-CZ3 3.22Å; R701-W703 HydrophobicContact CB-CD2 4.46Å; R701-W703 HydrophobicContact CB-CE3 4.12Å; R701-W703 HydrophobicContact CB-CH2 3.45Å; R701-W703 VanDerWaalsContact CB-CH2 3.45Å; R701-W703 HydrophobicContact CB-CZ2 3.83Å; R701-W703 HydrophobicContact CB-CZ3 3.58Å; R701-W703 HydrophobicContact CG-CH2 4.45Å; R701-W703 VanDerWaalsContact O-CZ3 3.3Å; R701-W703 WeakPolarHBondContact O-CZ3 3.4Å; W703-I712 HydrophobicContact CB-CG2 4.33Å; W703-R713 CarbonylContact C-O 3.51Å; W703-R713 WeakPolarHBondContact CA-O 3.49Å; W703-V738 HydrophobicContact CD2-CG2 4.42Å; W703-V738 HydrophobicContact CE3-CG2 3.82Å; W703-V738 HydrophobicContact CZ3-CG2 3.9Å
704	I	95.9	Very high	93.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.2	-169.5	-53.6	149.6	0	0	0	107.5	I671 V689 P692 D694 L695 L702 I712 R713 V715	I671-I704 HydrophobicContact CD1-CD1 3.39Å; I671-I704 HydrophobicContact CD1-CG1 3.61Å; I671-I704 HydrophobicContact CD1-CG2 4.29Å; V689-I704 HydrophobicContact CG1-CD1 4.01Å; V689-I704 HydrophobicContact CG1-CG2 3.86Å; P692-I704 HydrophobicContact CB-CG2 3.8Å; D694-I704 WeakPolarHBondContact O-CA 3.4Å; L695-I704 HydrophobicContact CD2-CB 4.11Å; L695-I704 HydrophobicContact CD2-CG1 3.64Å; L695-I704 HydrophobicContact CD2-CG2 3.97Å; L702-I704 HydrophobicContact CD2-CG1 4.44Å; L702-I704 HydrophobicContact CG-CG1 4.41Å; I704-I712 CarbonylContact O-C 3.52Å; I704-I712 WeakPolarHBondContact O-CA 3.42Å; I704-R713 HydrophobicContact CB-CB 4.45Å; I704-R713 PolarHBondContact N-O 2.83Å; I704-R713 PolarHBondContact O-N 2.95Å; I704-V715 HydrophobicContact CD1-CG1 3.92Å
705	S	94.9	Very high	93.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	136.5	168.9	61.4	0	0	0	0	110.7	P692 F693 D694 P733 A734	P692-S705 CarbonylContact C-O 3.58Å; P692-S705 WeakPolarHBondContact CA-O 3.47Å; F693-S705 PolarHBondContact N-O 3.46Å; D694-S705 WeakPolarHBondContact CA-OG 3.4Å; D694-S705 WeakPolarHBondContact CB-OG 3.44Å; D694-S705 PolarHBondContact N-OG 3.45Å; D694-S705 PolarHBondContact O-N 3.42Å; D694-S705 PolarHBondContact O-OG 3.38Å; S705-P733 WeakPolarHBondContact CB-O 3.41Å; S705-A734 WeakPolarHBondContact CB-O 3.4Å; S705-A734 PolarHBondContact OG-O 2.88Å
706	E	92.3	Very high	93.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	121	-164.4	-154.5	-83.4	105.3	0	0	111.5	V689 R691 E708 H709 Q710 Q711 R713	V689-E706 WeakPolarHBondContact O-CG 3.36Å; R691-E706 PolarHBondContact N-OE1 3.21Å; E706-E708 WeakPolarHBondContact OE1-CA 3.45Å; E706-E708 WeakPolarHBondContact OE1-CB 2.99Å; E706-E708 PolarHBondContact OE1-N 3.2Å; E706-H709 IonicContact OE1-ND1 3.63Å; E706-H709 VanDerWaalsContact OE2-CB 3.28Å; E706-H709 WeakPolarHBondContact OE2-CB 3.35Å; E706-H709 IonicContact OE2-CG 2.68Å; E706-H709 PolarHBondContact OE2-N 3.12Å; E706-H709 IonicContact OE2-ND1 3.02Å; E706-H709 PolarHBondContact OE2-ND1 3.04Å; E706-Q710 VanDerWaalsContact O-CA 3.31Å; E706-Q710 WeakPolarHBondContact O-CA 3.47Å; E706-Q710 PolarHBondContact O-N 3.08Å; E706-Q710 VanDerWaalsContact O-N 3.14Å; E706-Q711 WeakPolarHBondContact CB-O 3.31Å; E706-Q711 PolarHBondContact N-O 2.88Å; E706-Q711 PolarHBondContact O-N 3.27Å; E706-Q711 VanDerWaalsContact O-N 3.11Å; E706-R713 HydrophobicContact CB-CG 4.47Å; E706-R713 IonicContact OE2-CZ 3.6Å; E706-R713 IonicContact OE2-NE 3.55Å; E706-R713 PolarHBondContact OE2-NE 3.38Å; E706-R713 IonicContact OE2-NH2 2.83Å; E706-R713 PolarHBondContact OE2-NH2 3.41Å
707	W	91.8	Very high	93.2	Very high	57 Å²	57	31.8 Å²	31.8	22%	0.216	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-25.9	-166.2	-78.6	15.7	0	0	0	115.1	L520 Q666 R691 F693 Q732 P733	L520-W707 HydrophobicContact CD2-CZ2 4.38Å; Q666-W707 VanDerWaalsContact NE2-CE3 3.3Å; R691-W707 HydrophobicContact CB-CB 4.31Å; R691-W707 PolarHBondContact O-N 3.26Å; F693-W707 HydrophobicContact CB-CD2 4.25Å; F693-W707 HydrophobicContact CB-CG 4.26Å; F693-W707 HydrophobicContact CB-CZ2 4.34Å; F693-W707 HydrophobicContact CD1-CZ2 4.07Å; F693-W707 HydrophobicContact CD2-CD2 4.14Å; F693-W707 AromaticContact CD2-CE2 3.47Å; F693-W707 VanDerWaalsContact CD2-CE2 3.47Å; F693-W707 HydrophobicContact CD2-CE3 4.46Å; F693-W707 AromaticContact CD2-CH2 3.61Å; F693-W707 HydrophobicContact CD2-CH2 3.61Å; F693-W707 AromaticContact CD2-CZ2 3.19Å; F693-W707 HydrophobicContact CD2-CZ2 3.19Å; F693-W707 HydrophobicContact CD2-CZ3 4.22Å; F693-W707 AromaticContact CD2-NE1 3.97Å; F693-W707 HydrophobicContact CE1-CZ2 4.18Å; F693-W707 AromaticContact CE2-CH2 3.52Å; F693-W707 HydrophobicContact CE2-CH2 3.52Å; F693-W707 AromaticContact CE2-CZ2 3.33Å; F693-W707 HydrophobicContact CE2-CZ2 3.33Å; F693-W707 HydrophobicContact CE2-CZ3 4.41Å; F693-W707 HydrophobicContact CG-CD2 4.35Å; F693-W707 AromaticContact CG-CE2 3.52Å; F693-W707 HydrophobicContact CG-CH2 4.43Å; F693-W707 AromaticContact CG-CZ2 3.59Å; F693-W707 HydrophobicContact CG-CZ2 3.59Å; F693-W707 AromaticContact CG-NE1 3.5Å; F693-W707 HydrophobicContact CZ-CH2 4.28Å; F693-W707 AromaticContact CZ-CZ2 3.83Å; F693-W707 HydrophobicContact CZ-CZ2 3.83Å; W707-Q732 HydrophobicContact CD2-CG 4.15Å; W707-Q732 VanDerWaalsContact CE3-NE2 3.3Å; W707-Q732 HydrophobicContact CG-CG 4.21Å; W707-Q732 HydrophobicContact CZ2-CG 4.43Å; W707-Q732 VanDerWaalsContact CZ3-NE2 3.34Å; W707-P733 PolarHBondContact NE1-O 2.82Å
708	E	89.3	Confident	92.7	Very high	111 Å²	111	32.3 Å²	32.3	52%	0.519	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-35.6	-178.9	-173.9	173.9	-131.8	0	0	111.4	G690 R691 E706	G690-E708 VanDerWaalsContact CA-OE2 3.24Å; G690-E708 WeakPolarHBondContact CA-OE2 3.33Å; R691-E708 HydrophobicContact CB-CB 4.2Å; R691-E708 HydrophobicContact CG-CB 4.14Å; E706-E708 WeakPolarHBondContact OE1-CA 3.45Å; E706-E708 WeakPolarHBondContact OE1-CB 2.99Å; E706-E708 PolarHBondContact OE1-N 3.2Å
709	H	89.3	Confident	92.2	Very high	97 Å²	97	34.5 Å²	34.5	45%	0.449	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	11.7	178.6	-51.6	73.1	0	0	0	113.2	E706 Q711 R713	E706-H709 IonicContact OE1-ND1 3.63Å; E706-H709 VanDerWaalsContact OE2-CB 3.28Å; E706-H709 WeakPolarHBondContact OE2-CB 3.35Å; E706-H709 IonicContact OE2-CG 2.68Å; E706-H709 PolarHBondContact OE2-N 3.12Å; E706-H709 IonicContact OE2-ND1 3.02Å; E706-H709 PolarHBondContact OE2-ND1 3.04Å; H709-Q711 VanDerWaalsContact C-N 3.34Å; H709-Q711 HydrophobicContact CB-CG 4.14Å; H709-Q711 PolarHBondContact O-N 3.07Å; H709-R713 PolarHBondContact ND1-NH2 2.82Å; H709-R713 VanDerWaalsContact ND1-NH2 3.16Å
710	Q	91.1	Very high	91.9	Very high	105 Å²	105	32 Å²	32	49%	0.491	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	42.5	171.1	-58.8	173.8	-42.6	0	0	114.6	E706 V731	E706-Q710 VanDerWaalsContact O-CA 3.31Å; E706-Q710 WeakPolarHBondContact O-CA 3.47Å; E706-Q710 PolarHBondContact O-N 3.08Å; E706-Q710 VanDerWaalsContact O-N 3.14Å; Q710-V731 VanDerWaalsContact CG-O 3.3Å; Q710-V731 WeakPolarHBondContact CG-O 3.28Å; Q710-V731 PolarHBondContact NE2-O 2.93Å
711	Q	91	Very high	91.5	Very high	27 Å²	27	37.3 Å²	37.3	13%	0.126	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	161.9	-170.9	64.5	-175.5	-34	0	0	112.8	E706 H709 R713	E706-Q711 WeakPolarHBondContact CB-O 3.31Å; E706-Q711 PolarHBondContact N-O 2.88Å; E706-Q711 PolarHBondContact O-N 3.27Å; E706-Q711 VanDerWaalsContact O-N 3.11Å; H709-Q711 VanDerWaalsContact C-N 3.34Å; H709-Q711 HydrophobicContact CB-CG 4.14Å; H709-Q711 PolarHBondContact O-N 3.07Å; Q711-R713 HydrophobicContact CG-CG 4.21Å
712	I	94.3	Very high	91.1	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.9	163.6	-58.1	-56.3	0	0	0	108.7	V492 W703 I704 I726 L730 P733	V492-I712 HydrophobicContact CG1-CD1 4.16Å; V492-I712 HydrophobicContact CG2-CD1 4.35Å; V492-I712 HydrophobicContact CG2-CG1 4.38Å; W703-I712 HydrophobicContact CB-CG2 4.33Å; I704-I712 CarbonylContact O-C 3.52Å; I704-I712 WeakPolarHBondContact O-CA 3.42Å; I712-I726 HydrophobicContact CB-CB 4.07Å; I712-I726 HydrophobicContact CB-CG1 4.43Å; I712-I726 HydrophobicContact CG2-CB 4.24Å; I712-I726 HydrophobicContact CG2-CG1 4.06Å; I712-I726 WeakPolarHBondContact O-CB 3.37Å; I712-I726 PolarHBondContact O-N 3.04Å; I712-L730 HydrophobicContact CD1-CD1 4.47Å; I712-L730 HydrophobicContact CG1-CD1 3.79Å; I712-P733 HydrophobicContact CD1-CB 3.64Å; I712-P733 HydrophobicContact CD1-CG 4.17Å
713	R	93.4	Very high	90.8	Very high	16 Å²	16	42.7 Å²	42.7	6%	0.06	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	150.8	170.8	-55.1	-174.9	-174.9	-154.7	7.6	109.6	Q688 W703 I704 E706 H709 Q711 L723 Q724	Q688-R713 PolarHBondContact O-NH1 2.03Å; W703-R713 CarbonylContact C-O 3.51Å; W703-R713 WeakPolarHBondContact CA-O 3.49Å; I704-R713 HydrophobicContact CB-CB 4.45Å; I704-R713 PolarHBondContact N-O 2.83Å; I704-R713 PolarHBondContact O-N 2.95Å; E706-R713 HydrophobicContact CB-CG 4.47Å; E706-R713 IonicContact OE2-CZ 3.6Å; E706-R713 IonicContact OE2-NE 3.55Å; E706-R713 PolarHBondContact OE2-NE 3.38Å; E706-R713 IonicContact OE2-NH2 2.83Å; E706-R713 PolarHBondContact OE2-NH2 3.41Å; H709-R713 PolarHBondContact ND1-NH2 2.82Å; H709-R713 VanDerWaalsContact ND1-NH2 3.16Å; Q711-R713 HydrophobicContact CG-CG 4.21Å; R713-L723 HydrophobicContact CB-CD1 4.05Å; R713-Q724 CarbonylContact C-O 3.51Å; R713-Q724 VanDerWaalsContact CA-O 3.3Å; R713-Q724 WeakPolarHBondContact CA-O 3.49Å
714	S	94.6	Very high	90.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	142.1	173.9	-174.8	0	0	0	0	110.3	R701 L702 L723 Q724	R701-S714 PolarHBondContact NH1-OG 3.13Å; L702-S714 CarbonylContact O-C 3.55Å; L702-S714 WeakPolarHBondContact O-CA 3.44Å; S714-L723 WeakPolarHBondContact O-CA 3.43Å; S714-Q724 PolarHBondContact N-O 2.96Å; S714-Q724 PolarHBondContact O-N 3.09Å
715	V	94.4	Very high	90.3	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	160.9	179.7	73.5	0	0	0	0	111.5	I685 R701 L702 I704 K717 G720 Q721 L723	I685-V715 HydrophobicContact CD1-CB 4.07Å; I685-V715 HydrophobicContact CD1-CG1 3.83Å; I685-V715 HydrophobicContact CD1-CG2 3.63Å; R701-V715 WeakPolarHBondContact CA-O 3.5Å; L702-V715 HydrophobicContact CB-CG1 4.03Å; L702-V715 HydrophobicContact CD2-CG1 4.4Å; L702-V715 PolarHBondContact N-O 2.88Å; L702-V715 PolarHBondContact O-N 3.43Å; I704-V715 HydrophobicContact CD1-CG1 3.92Å; V715-K717 PolarHBondContact O-N 3.07Å; V715-G720 WeakPolarHBondContact CG2-O 3.29Å; V715-Q721 VanDerWaalsContact CG2-O 3.22Å; V715-Q721 WeakPolarHBondContact CG2-O 3.08Å; V715-L723 HydrophobicContact CB-CD1 4.16Å; V715-L723 HydrophobicContact CG2-CB 4.42Å; V715-L723 HydrophobicContact CG2-CD1 4.43Å
716	H	92.1	Very high	90.1	Very high	49 Å²	49	54.8 Å²	54.8	23%	0.227	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.3	175.3	-171.8	-107.1	0	0	0	111.6	D700 R718 T719 G720 Q721	D700-H716 CarbonylContact O-C 3.56Å; D700-H716 WeakPolarHBondContact O-CA 3.41Å; D700-H716 PolarHBondContact O-CD2 2.81Å; H716-R718 PolarHBondContact O-N 2.92Å; H716-R718 VanDerWaalsContact O-N 3.08Å; H716-T719 PolarHBondContact ND1-OG1 2.94Å; H716-T719 PolarHBondContact O-N 3.38Å; H716-G720 PolarHBondContact O-N 2.83Å; H716-Q721 WeakPolarHBondContact CB-O 3.37Å; H716-Q721 PolarHBondContact N-O 2.85Å; H716-Q721 VanDerWaalsContact N-O 3.13Å
717	K	91.8	Very high	89.4	Confident	3 Å²	3	62.1 Å²	62.1	1%	0.013	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-27.7	-166.8	74.5	178.1	-177.3	-178.2	0	114.9	D655 T657 F662 L684 V697 E699 D700 L702 V715	D655-K717 IonicContact OD1-NZ 3.27Å; D655-K717 WeakPolarHBondContact OD2-CD 3.43Å; D655-K717 VanDerWaalsContact OD2-CE 3.3Å; D655-K717 WeakPolarHBondContact OD2-CE 3.12Å; D655-K717 IonicContact OD2-NZ 3.09Å; D655-K717 PolarHBondContact OD2-NZ 2.85Å; T657-K717 PolarHBondContact OG1-NZ 2.91Å; F662-K717 WeakPolarHBondContact CE1-O 3.35Å; F662-K717 HydrophobicContact CZ-CB 4.41Å; L684-K717 VanDerWaalsContact CD1-O 3.3Å; L684-K717 WeakPolarHBondContact CD1-O 3.43Å; L684-K717 WeakPolarHBondContact CD2-O 3.4Å; V697-K717 HydrophobicContact CG2-CB 4.34Å; V697-K717 HydrophobicContact CG2-CD 3.92Å; E699-K717 VanDerWaalsContact O-CD 3.3Å; E699-K717 WeakPolarHBondContact O-CD 3.45Å; E699-K717 WeakPolarHBondContact O-CE 3.29Å; E699-K717 PolarHBondContact O-NZ 2.99Å; D700-K717 PolarHBondContact O-N 3Å; L702-K717 HydrophobicContact CB-CB 4.35Å; V715-K717 PolarHBondContact O-N 3.07Å
718	R	86.1	Confident	88.5	Confident	28 Å²	28	61.1 Å²	61.1	11%	0.106	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-28.5	-176.9	-61.7	-143.5	-165.2	108.7	-18.4	115.5	C452 S453 H716	C452-R718 VanDerWaalsContact O-CZ 3.27Å; C452-R718 PolarHBondContact O-NH1 2.87Å; C452-R718 PolarHBondContact O-NH2 2.79Å; S453-R718 PolarHBondContact O-NH2 2.81Å; H716-R718 PolarHBondContact O-N 2.92Å; H716-R718 VanDerWaalsContact O-N 3.08Å
719	T	84.2	Confident	88.1	Confident	56 Å²	56	60.2 Å²	60.2	34%	0.344	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-11.9	-169.9	59.6	0	0	0	0	113.7	H716 Q721	H716-T719 PolarHBondContact ND1-OG1 2.94Å; H716-T719 PolarHBondContact O-N 3.38Å; T719-Q721 PolarHBondContact O-N 2.78Å; T719-Q721 VanDerWaalsContact O-N 3.08Å
720	G	85.8	Confident	87.9	Confident	8 Å²	8	56.5 Å²	56.5	8%	0.082	28%	0.281	C	S	.	.			trans	66.8	5.4	-174.7	0	0	0	0	0	114	V715 H716	V715-G720 WeakPolarHBondContact CG2-O 3.29Å; H716-G720 PolarHBondContact O-N 2.83Å
721	Q	84.2	Confident	87.7	Confident	124 Å²	124	55 Å²	55	58%	0.579	28%	0.279	S	S	*	.			trans	-91.7	164.5	-176.7	-65.1	-179.9	3.4	0	0	112.5	V715 H716 T719	V715-Q721 VanDerWaalsContact CG2-O 3.22Å; V715-Q721 WeakPolarHBondContact CG2-O 3.08Å; H716-Q721 WeakPolarHBondContact CB-O 3.37Å; H716-Q721 PolarHBondContact N-O 2.85Å; H716-Q721 VanDerWaalsContact N-O 3.13Å; T719-Q721 PolarHBondContact O-N 2.78Å; T719-Q721 VanDerWaalsContact O-N 3.08Å
722	K	85.4	Confident	87.7	Confident	149 Å²	149	56.1 Å²	56.1	65%	0.648	28%	0.284	S	S	*	.			trans	59.8	48.3	-178.5	-53.9	-177.6	-178.7	-179.7	0	112.6	Q724	K722-Q724 WeakPolarHBondContact O-CG 3.29Å; K722-Q724 PolarHBondContact O-N 2.9Å; K722-Q724 VanDerWaalsContact O-N 3.16Å
723	L	89.4	Confident	87.6	Confident	56 Å²	56	56.1 Å²	56.1	29%	0.293	28%	0.284	S	S	.	.			trans	-59.4	115.2	171.5	-175.2	64.3	0	0	0	110	Q688 R713 S714 V715	Q688-L723 HydrophobicContact CB-CD2 4.06Å; R713-L723 HydrophobicContact CB-CD1 4.05Å; S714-L723 WeakPolarHBondContact O-CA 3.43Å; V715-L723 HydrophobicContact CB-CD1 4.16Å; V715-L723 HydrophobicContact CG2-CB 4.42Å; V715-L723 HydrophobicContact CG2-CD1 4.43Å
724	Q	90.8	Very high	87.6	Confident	86 Å²	86	55.4 Å²	55.4	40%	0.402	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.3	-177.2	-75.3	174.3	-30.7	0	0	110	R713 S714 K722	R713-Q724 CarbonylContact C-O 3.51Å; R713-Q724 VanDerWaalsContact CA-O 3.3Å; R713-Q724 WeakPolarHBondContact CA-O 3.49Å; S714-Q724 PolarHBondContact N-O 2.96Å; S714-Q724 PolarHBondContact O-N 3.09Å; K722-Q724 WeakPolarHBondContact O-CG 3.29Å; K722-Q724 PolarHBondContact O-N 2.9Å; K722-Q724 VanDerWaalsContact O-N 3.16Å
725	R	90.6	Very high	87.7	Confident	162 Å²	162	55.8 Å²	55.8	61%	0.611	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.6	171.6	-60.3	178.5	-169.2	-176.8	3.6	108.7
726	I	90.5	Very high	87.8	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.077	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.3	175.2	-53.9	-50.5	0	0	0	106.7	P503 I712	P503-I726 WeakPolarHBondContact O-CD1 3.22Å; I712-I726 HydrophobicContact CB-CB 4.07Å; I712-I726 HydrophobicContact CB-CG1 4.43Å; I712-I726 HydrophobicContact CG2-CB 4.24Å; I712-I726 HydrophobicContact CG2-CG1 4.06Å; I712-I726 WeakPolarHBondContact O-CB 3.37Å; I712-I726 PolarHBondContact O-N 3.04Å
727	H	77.8	Confident	88	Confident	154 Å²	154	54.5 Å²	54.5	71%	0.713	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-84.9	120	-173.4	-64.4	80.9	0	0	0	109.8	G505	G505-H727 WeakPolarHBondContact CA-O 3.48Å
728	G	73.7	Confident	88.1	Confident	37 Å²	37	54.9 Å²	54.9	38%	0.381	28%	0.282	S	S	.	.			trans	-159.5	157.2	176.7	0	0	0	0	0	110.8	L730	G728-L730 PolarHBondContact O-N 3.38Å
729	S	80.2	Confident	88.5	Confident	91 Å²	91	54.1 Å²	54.1	64%	0.636	28%	0.281	S	S	*	.			trans	-86.8	58	-173.8	-166.1	0	0	0	0	112.1	R499 E508	R499-S729 PolarHBondContact NH1-O 3.45Å; E508-S729 PolarHBondContact OE2-N 2.82Å
730	L	85.4	Confident	88.7	Confident	19 Å²	19	51.9 Å²	51.9	10%	0.099	27%	0.266	C	S	.	.			trans	-87.4	147.1	-172.3	-59	169.3	0	0	0	111.4	N494 M501 I712 G728 P733	N494-L730 HydrophobicContact CB-CD2 4.11Å; M501-L730 HydrophobicContact CE-CD1 4.31Å; M501-L730 HydrophobicContact CE-CD2 3.94Å; I712-L730 HydrophobicContact CD1-CD1 4.47Å; I712-L730 HydrophobicContact CG1-CD1 3.79Å; G728-L730 PolarHBondContact O-N 3.38Å; L730-P733 HydrophobicContact CD1-CB 4.19Å; L730-P733 HydrophobicContact CD1-CG 4.36Å
731	V	86.3	Confident	88.4	Confident	74 Å²	74	53 Å²	53	45%	0.448	27%	0.272	S	S	.	.	S	Bend	trans	-98.2	-49.2	-179.9	177.7	0	0	0	0	109.7	N494 L495 Q710	N494-V731 PolarHBondContact OD1-N 2.86Å; L495-V731 HydrophobicContact CD2-CG1 4.47Å; Q710-V731 VanDerWaalsContact CG-O 3.3Å; Q710-V731 WeakPolarHBondContact CG-O 3.28Å; Q710-V731 PolarHBondContact NE2-O 2.93Å
732	Q	90.3	Very high	88.3	Confident	51 Å²	51	48.7 Å²	48.7	24%	0.238	25%	0.253	C	S	.	.			trans	-162.5	91	175.4	-176.8	173.8	-4.1	0	0	107.7	N494 L495 W707 A734	N494-Q732 WeakPolarHBondContact CA-O 3.3Å; N494-Q732 PolarHBondContact OD1-N 2.81Å; L495-Q732 HydrophobicContact CB-CB 4.28Å; W707-Q732 HydrophobicContact CD2-CG 4.15Å; W707-Q732 VanDerWaalsContact CE3-NE2 3.3Å; W707-Q732 HydrophobicContact CG-CG 4.21Å; W707-Q732 HydrophobicContact CZ2-CG 4.43Å; W707-Q732 VanDerWaalsContact CZ3-NE2 3.34Å; Q732-A734 PolarHBondContact O-N 3.19Å
733	P	92.6	Very high	88.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.229	C	C	.	.			trans	-67.8	119.3	179.6	26.5	-31.2	0	0	0	109.9	V492 A493 S705 W707 I712 L730	V492-P733 HydrophobicContact CG1-CB 3.86Å; A493-P733 CarbonylContact O-C 3.58Å; A493-P733 WeakPolarHBondContact O-CA 3.31Å; S705-P733 WeakPolarHBondContact CB-O 3.41Å; W707-P733 PolarHBondContact NE1-O 2.82Å; I712-P733 HydrophobicContact CD1-CB 3.64Å; I712-P733 HydrophobicContact CD1-CG 4.17Å; L730-P733 HydrophobicContact CD1-CB 4.19Å; L730-P733 HydrophobicContact CD1-CG 4.36Å
734	A	93.7	Very high	88.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.			trans	-96	-117.3	175.5	0	0	0	0	0	109	A493 L520 F693 S705 Q732	A493-A734 HydrophobicContact CB-CB 4.33Å; A493-A734 PolarHBondContact O-N 2.95Å; L520-A734 HydrophobicContact CB-CB 4.32Å; L520-A734 HydrophobicContact CD2-CB 3.74Å; L520-A734 WeakPolarHBondContact O-CB 3.3Å; F693-A734 HydrophobicContact CD1-CB 4.09Å; F693-A734 HydrophobicContact CE1-CB 3.8Å; S705-A734 WeakPolarHBondContact CB-O 3.4Å; S705-A734 PolarHBondContact OG-O 2.88Å; Q732-A734 PolarHBondContact O-N 3.19Å
735	S	96	Very high	87.6	Confident	10 Å²	10	38.5 Å²	38.5	7%	0.07	21%	0.212	C	C	.	.			trans	-65.9	146.7	179.1	-175.8	0	0	0	0	113.4	V492 A493 L520 L522 D694	V492-S735 WeakPolarHBondContact CA-O 3.49Å; A493-S735 PolarHBondContact N-O 2.96Å; L520-S735 WeakPolarHBondContact O-CB 3.23Å; L520-S735 PolarHBondContact O-N 2.97Å; L522-S735 VanDerWaalsContact CD2-O 3.28Å; L522-S735 WeakPolarHBondContact CD2-O 3.28Å; L522-S735 PolarHBondContact O-OG 3.01Å; D694-S735 WeakPolarHBondContact OD2-CA 3.48Å; D694-S735 VanDerWaalsContact OD2-CB 3.24Å; D694-S735 WeakPolarHBondContact OD2-CB 3.3Å; D694-S735 PolarHBondContact OD2-OG 3.42Å
736	V	96.5	Very high	86.3	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.1	179.5	53.1	0	0	0	0	109.8	I491 V492 D694 A696	I491-V736 WeakPolarHBondContact O-CA 3.27Å; V492-V736 HydrophobicContact CG2-CB 4.37Å; V492-V736 HydrophobicContact CG2-CG2 4.01Å; D694-V736 HydrophobicContact CB-CG1 4.41Å; D694-V736 PolarHBondContact OD2-N 3.43Å; D694-V736 VanDerWaalsContact OD2-N 3.12Å; A696-V736 HydrophobicContact CB-CG1 4.31Å; A696-V736 HydrophobicContact CB-CG2 4.34Å; A696-V736 WeakPolarHBondContact CB-O 3.46Å
737	V	96.4	Very high	85	Confident	20 Å²	20	31.2 Å²	31.2	12%	0.121	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.8	179.3	177.3	0	0	0	0	110.8	L490 I491 L522 F524	L490-V737 WeakPolarHBondContact CA-O 3.39Å; I491-V737 PolarHBondContact N-O 3Å; I491-V737 PolarHBondContact O-N 2.82Å; L522-V737 HydrophobicContact CD1-CB 3.81Å; L522-V737 HydrophobicContact CD1-CG2 3.59Å; L522-V737 HydrophobicContact CG-CG2 4.17Å; F524-V737 HydrophobicContact CB-CG1 4.07Å
738	V	95.6	Very high	84.1	Confident	11 Å²	11	27 Å²	27	7%	0.067	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.8	172.9	178.7	0	0	0	0	109.7	A488 L490 A696 F698 W703 A743	A488-V738 HydrophobicContact CB-CG1 4.16Å; L490-V738 HydrophobicContact CD2-CB 4.47Å; L490-V738 HydrophobicContact CD2-CG2 3.66Å; A696-V738 HydrophobicContact CB-CG2 3.94Å; F698-V738 HydrophobicContact CB-CB 4.15Å; F698-V738 HydrophobicContact CB-CG1 3.75Å; F698-V738 HydrophobicContact CB-CG2 3.98Å; F698-V738 HydrophobicContact CD1-CG1 4.01Å; F698-V738 HydrophobicContact CD2-CG1 4.33Å; F698-V738 HydrophobicContact CG-CG1 3.78Å; W703-V738 HydrophobicContact CD2-CG2 4.42Å; W703-V738 HydrophobicContact CE3-CG2 3.82Å; W703-V738 HydrophobicContact CZ3-CG2 3.9Å; V738-A743 HydrophobicContact CG1-CB 4.5Å
739	V	92.8	Very high	83.5	Confident	13 Å²	13	26.6 Å²	26.6	8%	0.079	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	106.3	174.3	177.5	0	0	0	0	109.4	A488 F489 I491 F524	A488-V739 WeakPolarHBondContact CA-O 3.08Å; F489-V739 HydrophobicContact CD1-CB 4.32Å; F489-V739 HydrophobicContact CD1-CG1 4.37Å; F489-V739 HydrophobicContact CD2-CB 4.07Å; F489-V739 HydrophobicContact CD2-CG2 4.38Å; F489-V739 HydrophobicContact CE1-CB 4Å; F489-V739 HydrophobicContact CE1-CG1 3.63Å; F489-V739 HydrophobicContact CE2-CB 3.74Å; F489-V739 HydrophobicContact CE2-CG1 3.97Å; F489-V739 HydrophobicContact CE2-CG2 3.88Å; F489-V739 HydrophobicContact CG-CB 4.37Å; F489-V739 HydrophobicContact CZ-CB 3.71Å; F489-V739 HydrophobicContact CZ-CG1 3.41Å; F489-V739 VanDerWaalsContact CZ-CG1 3.41Å; F489-V739 HydrophobicContact CZ-CG2 4.18Å; F489-V739 PolarHBondContact N-O 2.94Å; F489-V739 PolarHBondContact O-N 3.04Å; I491-V739 HydrophobicContact CD1-CG2 3.66Å; I491-V739 HydrophobicContact CG1-CG2 3.83Å; F524-V739 HydrophobicContact CB-CG2 4.34Å; F524-V739 HydrophobicContact CD1-CB 4.5Å; F524-V739 HydrophobicContact CD1-CG1 4.17Å; F524-V739 HydrophobicContact CD1-CG2 4.01Å; F524-V739 HydrophobicContact CD2-CG2 4.22Å; F524-V739 HydrophobicContact CE1-CB 4.49Å; F524-V739 HydrophobicContact CE1-CG1 3.7Å; F524-V739 HydrophobicContact CE1-CG2 4.36Å; F524-V739 HydrophobicContact CE2-CG1 4.34Å; F524-V739 HydrophobicContact CG-CG2 3.92Å; F524-V739 HydrophobicContact CZ-CG1 3.79Å
740	H	89.1	Confident	82.7	Confident	8 Å²	8	23 Å²	23	4%	0.037	14%	0.138	C	C	.	.			trans	-155.8	146.8	168.8	-173.3	-95.1	0	0	0	109.5	P486 A488 F698 L742 A743	P486-H740 PolarHBondContact O-CD2 3.42Å; P486-H740 VanDerWaalsContact O-CD2 3.22Å; P486-H740 PolarHBondContact O-NE2 3.49Å; A488-H740 HydrophobicContact CB-CB 3.93Å; F698-H740 HydrophobicContact CE1-CB 4.2Å; F698-H740 HydrophobicContact CE2-CB 3.85Å; F698-H740 AromaticContact CE2-CG 3.9Å; F698-H740 AromaticContact CE2-ND1 3.64Å; F698-H740 HydrophobicContact CZ-CB 3.65Å; F698-H740 AromaticContact CZ-CE1 3.98Å; F698-H740 AromaticContact CZ-CG 3.37Å; F698-H740 AromaticContact CZ-ND1 3.27Å; F698-H740 VanDerWaalsContact CZ-ND1 3.27Å; F698-H740 WeakPolarHBondContact CZ-ND1 3.38Å; H740-L742 PolarHBondContact ND1-N 2.91Å; H740-L742 VanDerWaalsContact ND1-N 3.11Å; H740-L742 PolarHBondContact O-N 3.3Å; H740-L742 VanDerWaalsContact O-N 3.09Å; H740-A743 HydrophobicContact CB-CB 4.25Å; H740-A743 WeakPolarHBondContact O-CB 3.12Å; H740-A743 PolarHBondContact O-N 3.05Å
741	P	79.1	Confident	81	Confident	33 Å²	33	26.2 Å²	26.2	21%	0.214	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-31.1	179	-30.3	37.5	0	0	0	115.1	P486	P486-P741 HydrophobicContact CG-CG 4.47Å
742	L	83.4	Confident	79.1	Confident	32 Å²	32	26.7 Å²	26.7	17%	0.168	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-6.1	178.7	-55.2	173.8	0	0	0	114.2	G471 Y472 A483 F698 H740 K744	G471-L742 WeakPolarHBondContact O-CD1 3.15Å; Y472-L742 HydrophobicContact CD2-CD1 4.14Å; Y472-L742 HydrophobicContact CE1-CD1 4.49Å; Y472-L742 HydrophobicContact CE2-CB 4.24Å; Y472-L742 HydrophobicContact CE2-CD1 3.79Å; A483-L742 HydrophobicContact CB-CD1 4.17Å; F698-L742 HydrophobicContact CE2-CB 4.29Å; H740-L742 PolarHBondContact ND1-N 2.91Å; H740-L742 VanDerWaalsContact ND1-N 3.11Å; H740-L742 PolarHBondContact O-N 3.3Å; H740-L742 VanDerWaalsContact O-N 3.09Å; L742-K744 VanDerWaalsContact C-N 3.25Å; L742-K744 PolarHBondContact O-N 3.32Å
743	A	88	Confident	77.1	Confident	18 Å²	18	31.9 Å²	31.9	15%	0.149	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.5	177.3	0	0	0	0	0	112.4	F656 F698 V738 H740	F656-A743 WeakPolarHBondContact CD2-O 3.35Å; F698-A743 HydrophobicContact CD2-CB 3.89Å; F698-A743 HydrophobicContact CE2-CB 4.18Å; V738-A743 HydrophobicContact CG1-CB 4.5Å; H740-A743 HydrophobicContact CB-CB 4.25Å; H740-A743 WeakPolarHBondContact O-CB 3.12Å; H740-A743 PolarHBondContact O-N 3.05Å
744	K	87.1	Confident	75.4	Confident	22 Å²	22	34.3 Å²	34.3	10%	0.096	19%	0.194	C	C	.	.	S	Bend	trans	-132.6	77.7	178.6	-79.2	-173.8	162.4	-158.4	0	110.1	D523 F524 P526 W569 L742	D523-K744 VanDerWaalsContact OD1-CE 3.31Å; D523-K744 WeakPolarHBondContact OD1-CE 3.44Å; D523-K744 IonicContact OD1-NZ 3.46Å; D523-K744 PolarHBondContact OD1-NZ 2.97Å; D523-K744 IonicContact OD2-NZ 3.79Å; D523-K744 PolarHBondContact OD2-NZ 2.79Å; F524-K744 WeakPolarHBondContact O-CD 3.45Å; F524-K744 PolarHBondContact O-NZ 3.18Å; P526-K744 HydrophobicContact CG-CB 3.91Å; P526-K744 HydrophobicContact CG-CD 4.31Å; W569-K744 HydrophobicContact CD2-CB 3.92Å; W569-K744 HydrophobicContact CD2-CD 4.09Å; W569-K744 HydrophobicContact CD2-CG 4.3Å; W569-K744 HydrophobicContact CE3-CB 4.08Å; W569-K744 HydrophobicContact CE3-CD 3.48Å; W569-K744 VanDerWaalsContact CE3-CD 3.48Å; W569-K744 HydrophobicContact CE3-CG 3.93Å; W569-K744 HydrophobicContact CH2-CB 3.97Å; W569-K744 HydrophobicContact CH2-CD 4.21Å; W569-K744 HydrophobicContact CH2-CG 3.79Å; W569-K744 HydrophobicContact CZ2-CB 3.77Å; W569-K744 HydrophobicContact CZ2-CG 4.13Å; W569-K744 HydrophobicContact CZ3-CB 4.12Å; W569-K744 HydrophobicContact CZ3-CD 3.56Å; W569-K744 HydrophobicContact CZ3-CG 3.68Å; W569-K744 PolarHBondContact NE1-O 3.47Å; L742-K744 VanDerWaalsContact C-N 3.25Å; L742-K744 PolarHBondContact O-N 3.32Å
745	P	73.9	Confident	74	Confident	37 Å²	37	34.6 Å²	34.6	24%	0.24	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	144.5	-178.2	27.1	-33.7	0	0	0	110.6	W569 Q613 F656	W569-P745 VanDerWaalsContact CE2-O 3.3Å; W569-P745 WeakPolarHBondContact CZ2-O 3.39Å; W569-P745 PolarHBondContact NE1-O 2.05Å; Q613-P745 PolarHBondContact NE2-O 3.28Å; F656-P745 HydrophobicContact CB-CG 3.6Å; F656-P745 HydrophobicContact CD1-CG 4.39Å; F656-P745 HydrophobicContact CD2-CG 4.26Å; F656-P745 HydrophobicContact CG-CG 3.84Å
746	G	63.9	Low	72.4	Confident	18 Å²	18	36.2 Å²	36.2	19%	0.186	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	110.4	-25.5	-173.5	0	0	0	0	0	113.2	Q765 G766	G746-Q765 WeakPolarHBondContact CA-O 3.4Å; G746-Q765 PolarHBondContact N-O 3.31Å; G746-G766 VanDerWaalsContact CA-CA 3.49Å
747	A	62.4	Low	71.3	Confident	7 Å²	7	36.5 Å²	36.5	6%	0.058	22%	0.217	C	C	.	.	S	Bend	trans	-62.2	154.9	176.2	0	0	0	0	0	112.2	P526 V527 W569 V749 S763	P526-A747 HydrophobicContact CB-CB 3.83Å; P526-A747 HydrophobicContact CG-CB 3.4Å; V527-A747 HydrophobicContact CG2-CB 4Å; W569-A747 VanDerWaalsContact CD1-N 3.33Å; A747-V749 PolarHBondContact O-N 2.84Å; A747-S763 PolarHBondContact O-OG 2.88Å
748	N	59.6	Low	70.1	Confident	64 Å²	64	38.5 Å²	38.5	34%	0.342	24%	0.236	S	C	.	.			trans	-72.8	92.2	179.8	-172.6	-11.6	0	0	0	111.4	C750 L751 S763	N748-C750 PolarHBondContact O-N 3.01Å; N748-C750 WeakPolarHBondContact OD1-CB 3.45Å; N748-C750 PolarHBondContact OD1-N 3.02Å; N748-C750 PolarHBondContact OD1-SG 2.89Å; N748-L751 HydrophobicContact CB-CD1 3.81Å; N748-L751 HydrophobicContact CB-CG 3.93Å; N748-L751 WeakPolarHBondContact O-CB 3.43Å; N748-L751 PolarHBondContact O-N 2.68Å; N748-S763 WeakPolarHBondContact CA-OG 3.4Å; N748-S763 WeakPolarHBondContact OD1-CB 3.33Å
749	V	60.9	Low	69.1	Low	29 Å²	29	40.6 Å²	40.6	18%	0.176	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-54.5	-25.8	-179.3	-165.1	0	0	0	0	112.1	A747 L751 H752 G755 S763 G766	A747-V749 PolarHBondContact O-N 2.84Å; V749-L751 VanDerWaalsContact C-N 3.28Å; V749-L751 PolarHBondContact O-N 2.97Å; V749-H752 PolarHBondContact O-N 2.98Å; V749-G755 WeakPolarHBondContact O-CA 3.29Å; V749-G755 PolarHBondContact O-N 3.25Å; V749-S763 PolarHBondContact N-OG 2.95Å; V749-G766 WeakPolarHBondContact CG2-O 3.44Å
750	C	63.4	Low	68.2	Low	16 Å²	16	44.5 Å²	44.5	11%	0.108	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-69	-19.9	179.3	-51.5	0	0	0	0	114.5	N748 H752 N754 C761 E762 S763	N748-C750 PolarHBondContact O-N 3.01Å; N748-C750 WeakPolarHBondContact OD1-CB 3.45Å; N748-C750 PolarHBondContact OD1-N 3.02Å; N748-C750 PolarHBondContact OD1-SG 2.89Å; C750-H752 PolarHBondContact O-N 2.7Å; C750-N754 WeakPolarHBondContact O-CA 3.43Å; C750-N754 PolarHBondContact O-N 2.95Å; C750-C761 WeakPolarHBondContact CA-SG 2.96Å; C750-C761 HydrophobicContact CB-CB 3.45Å; C750-C761 VanDerWaalsContact CB-CB 3.45Å; C750-C761 WeakPolarHBondContact CB-SG 3.34Å; C750-C761 WeakPolarHBondContact SG-CB 3.37Å; C750-C761 CovalentContact SG-SG 2.02Å; C750-C761 PolarHBondContact SG-SG 2.84Å; C750-E762 PolarHBondContact SG-N 2.91Å; C750-E762 VanDerWaalsContact SG-N 3.36Å; C750-S763 PolarHBondContact SG-N 2.88Å
751	L	49.7	Very low	67.6	Low	87 Å²	87	45 Å²	45	46%	0.455	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-70.7	-17.3	-178.9	-62.8	175.7	0	0	0	112.7	V527 N748 V749	V527-L751 HydrophobicContact CB-CD1 4.41Å; V527-L751 HydrophobicContact CG1-CD1 3.62Å; V527-L751 WeakPolarHBondContact O-CD1 3.37Å; N748-L751 HydrophobicContact CB-CD1 3.81Å; N748-L751 HydrophobicContact CB-CG 3.93Å; N748-L751 WeakPolarHBondContact O-CB 3.43Å; N748-L751 PolarHBondContact O-N 2.68Å; V749-L751 VanDerWaalsContact C-N 3.28Å; V749-L751 PolarHBondContact O-N 2.97Å
752	H	46.1	Very low	67.2	Low	83 Å²	83	47.7 Å²	47.7	38%	0.384	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	117	174.1	-84.2	-23	0	0	0	111.6	H529 V749 C750 N754 G755	H529-H752 AromaticContact CD2-CE1 3.71Å; H529-H752 AromaticContact CE1-CD2 3.66Å; H529-H752 AromaticContact CE1-CE1 2.96Å; H529-H752 PolarHBondContact CE1-CE1 2.79Å; H529-H752 AromaticContact CE1-CG 3.93Å; H529-H752 AromaticContact CE1-ND1 3.5Å; H529-H752 AromaticContact CE1-NE2 3.07Å; H529-H752 PolarHBondContact CE1-NE2 3.39Å; H529-H752 AromaticContact CG-CE1 3.88Å; H529-H752 AromaticContact ND1-CE1 3.42Å; H529-H752 PolarHBondContact ND1-CE1 3.14Å; H529-H752 AromaticContact ND1-NE2 3.42Å; H529-H752 PolarHBondContact ND1-NE2 3.29Å; H529-H752 AromaticContact NE2-CE1 3.11Å; H529-H752 PolarHBondContact NE2-CE1 2.83Å; H529-H752 AromaticContact NE2-ND1 3.37Å; H529-H752 PolarHBondContact NE2-ND1 3.28Å; H529-H752 AromaticContact NE2-NE2 3.72Å; V749-H752 PolarHBondContact O-N 2.98Å; C750-H752 PolarHBondContact O-N 2.7Å; H752-N754 PolarHBondContact O-N 2.77Å; H752-G755 PolarHBondContact O-N 3.07Å
753	L	47.9	Very low	66.1	Low	160 Å²	160	47.9 Å²	47.9	84%	0.838	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	48.8	35.6	179.8	-63	171.2	0	0	0	112.9	G755 G756	L753-G755 PolarHBondContact O-N 3.38Å; L753-G756 WeakPolarHBondContact O-CA 3.3Å; L753-G756 PolarHBondContact O-N 2.99Å
754	N	57.9	Low	64.3	Low	52 Å²	52	52.1 Å²	52.1	28%	0.278	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	54.9	30.6	-175.7	-158.9	33.5	0	0	0	113	C750 H752 G756 C757 Q759 C761	C750-N754 WeakPolarHBondContact O-CA 3.43Å; C750-N754 PolarHBondContact O-N 2.95Å; H752-N754 PolarHBondContact O-N 2.77Å; N754-G756 PolarHBondContact O-N 3.16Å; N754-G756 VanDerWaalsContact O-N 3.17Å; N754-C757 WeakPolarHBondContact CB-O 3.39Å; N754-C757 PolarHBondContact ND2-O 3.04Å; N754-C757 WeakPolarHBondContact O-CB 3.35Å; N754-C757 PolarHBondContact O-N 2.85Å; N754-C757 PolarHBondContact O-SG 2.94Å; N754-Q759 VanDerWaalsContact ND2-C 3.35Å; N754-Q759 PolarHBondContact ND2-O 3.43Å; N754-C761 WeakPolarHBondContact O-CB 3.46Å; N754-C761 PolarHBondContact O-SG 2.8Å; N754-C761 WeakPolarHBondContact OD1-CB 3.37Å
755	G	65	Low	62.6	Low	6 Å²	6	58.7 Å²	58.7	6%	0.062	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	67.3	12.2	-174.3	0	0	0	0	0	114.1	V749 H752 L753 C757 S768 K783	V749-G755 WeakPolarHBondContact O-CA 3.29Å; V749-G755 PolarHBondContact O-N 3.25Å; H752-G755 PolarHBondContact O-N 3.07Å; L753-G755 PolarHBondContact O-N 3.38Å; G755-C757 VanDerWaalsContact C-N 3.32Å; G755-S768 WeakPolarHBondContact O-CB 3.34Å; G755-S768 PolarHBondContact O-OG 3.31Å; G755-K783 PolarHBondContact O-NZ 2.85Å
756	G	62	Low	61.5	Low	43 Å²	43	57.3 Å²	57.3	44%	0.443	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	82.3	3	-166.3	0	0	0	0	0	114.2	L753 N754 K783	L753-G756 WeakPolarHBondContact O-CA 3.3Å; L753-G756 PolarHBondContact O-N 2.99Å; N754-G756 PolarHBondContact O-N 3.16Å; N754-G756 VanDerWaalsContact O-N 3.17Å; G756-K783 WeakPolarHBondContact O-CB 3.38Å
757	C	72.6	Confident	61	Low	8 Å²	8	61 Å²	61	5%	0.054	34%	0.337	C	S	.	.			trans	-76.2	141.1	178	-48.6	0	0	0	0	112	N754 G755 K760 C761 C770 K783	N754-C757 WeakPolarHBondContact CB-O 3.39Å; N754-C757 PolarHBondContact ND2-O 3.04Å; N754-C757 WeakPolarHBondContact O-CB 3.35Å; N754-C757 PolarHBondContact O-N 2.85Å; N754-C757 PolarHBondContact O-SG 2.94Å; G755-C757 VanDerWaalsContact C-N 3.32Å; C757-K760 WeakPolarHBondContact CB-O 3.24Å; C757-C761 HydrophobicContact CB-CB 3.88Å; C757-C761 WeakPolarHBondContact SG-CB 3.48Å; C757-C761 PolarHBondContact SG-SG 2.85Å; C757-C770 VanDerWaalsContact CA-SG 3.51Å; C757-C770 HydrophobicContact CB-CB 3.53Å; C757-C770 WeakPolarHBondContact CB-SG 3.34Å; C757-C770 WeakPolarHBondContact SG-CA 3.27Å; C757-C770 WeakPolarHBondContact SG-CB 3.08Å; C757-C770 CovalentContact SG-SG 2Å; C757-C770 PolarHBondContact SG-SG 2.78Å; C757-K783 CarbonylContact C-O 3.54Å; C757-K783 VanDerWaalsContact CA-O 3.31Å; C757-K783 WeakPolarHBondContact CA-O 3.43Å
758	A	71.8	Confident	60.7	Low	62 Å²	62	62 Å²	62	51%	0.512	34%	0.343	S	S	.	.	S	Bend	trans	-78.5	-21.1	-177.7	0	0	0	0	0	115	K783 C785	A758-K783 PolarHBondContact N-O 3.26Å; A758-C785 HydrophobicContact CB-CB 4.42Å
759	Q	74.6	Confident	61.3	Low	54 Å²	54	64.3 Å²	64.3	25%	0.252	35%	0.352	S	S	.	.	S	Bend	trans	-133.2	-78.5	179.3	-69.1	-177.7	-9.6	0	0	112.5	N754 F776 C785	N754-Q759 VanDerWaalsContact ND2-C 3.35Å; N754-Q759 PolarHBondContact ND2-O 3.43Å; Q759-F776 VanDerWaalsContact NE2-CG 3.33Å; Q759-C785 HydrophobicContact CB-CB 4.26Å; Q759-C785 VanDerWaalsContact CD-CB 3.45Å; Q759-C785 HydrophobicContact CG-CB 3.7Å
760	K	74.6	Confident	61.9	Low	95 Å²	95	63.1 Å²	63.1	41%	0.413	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141.1	-179.7	-170.1	-179.6	172.9	-150.4	0	109.6	C757 E762 C770 S771	C757-K760 WeakPolarHBondContact CB-O 3.24Å; K760-E762 WeakPolarHBondContact CE-OE1 3.45Å; K760-E762 IonicContact NZ-OE1 2.63Å; K760-E762 PolarHBondContact NZ-OE1 2.79Å; K760-C770 WeakPolarHBondContact O-CA 3.5Å; K760-S771 CarbonylContact C-O 3.54Å; K760-S771 WeakPolarHBondContact CA-O 3.49Å; K760-S771 WeakPolarHBondContact CB-O 3.33Å; K760-S771 WeakPolarHBondContact CB-OG 3.14Å; K760-S771 WeakPolarHBondContact CD-OG 3.22Å; K760-S771 PolarHBondContact N-O 2.88Å; K760-S771 PolarHBondContact O-N 2.99Å
761	C	75.2	Confident	62.7	Low	18 Å²	18	63.7 Å²	63.7	12%	0.122	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136	173.3	-177.1	0	0	0	0	108.8	C750 N754 C757	C750-C761 WeakPolarHBondContact CA-SG 2.96Å; C750-C761 HydrophobicContact CB-CB 3.45Å; C750-C761 VanDerWaalsContact CB-CB 3.45Å; C750-C761 WeakPolarHBondContact CB-SG 3.34Å; C750-C761 WeakPolarHBondContact SG-CB 3.37Å; C750-C761 CovalentContact SG-SG 2.02Å; C750-C761 PolarHBondContact SG-SG 2.84Å; N754-C761 WeakPolarHBondContact O-CB 3.46Å; N754-C761 PolarHBondContact O-SG 2.8Å; N754-C761 WeakPolarHBondContact OD1-CB 3.37Å; C757-C761 HydrophobicContact CB-CB 3.88Å; C757-C761 WeakPolarHBondContact SG-CB 3.48Å; C757-C761 PolarHBondContact SG-SG 2.85Å
762	E	70.3	Confident	64.3	Low	90 Å²	90	60.9 Å²	60.9	42%	0.421	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.1	169.7	-67.5	173.6	166.3	0	0	107	C750 K760 H769	C750-E762 PolarHBondContact SG-N 2.91Å; C750-E762 VanDerWaalsContact SG-N 3.36Å; K760-E762 WeakPolarHBondContact CE-OE1 3.45Å; K760-E762 IonicContact NZ-OE1 2.63Å; K760-E762 PolarHBondContact NZ-OE1 2.79Å; E762-H769 PolarHBondContact N-O 3.12Å; E762-H769 WeakPolarHBondContact O-CA 3.44Å; E762-H769 VanDerWaalsContact O-CB 3.3Å; E762-H769 WeakPolarHBondContact O-CB 3.13Å; E762-H769 PolarHBondContact O-N 2.84Å
763	S	61.2	Low	65.7	Low	36 Å²	36	61.7 Å²	61.7	25%	0.252	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	122.1	175.8	-179.4	0	0	0	0	109.1	A747 N748 V749 C750 L767	A747-S763 PolarHBondContact O-OG 2.88Å; N748-S763 WeakPolarHBondContact CA-OG 3.4Å; N748-S763 WeakPolarHBondContact OD1-CB 3.33Å; V749-S763 PolarHBondContact N-OG 2.95Å; C750-S763 PolarHBondContact SG-N 2.88Å; S763-L767 WeakPolarHBondContact CA-O 3.25Å
764	N	50.9	Low	66.4	Low	108 Å²	108	59 Å²	59	58%	0.578	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.9	173.2	-168.9	10.8	0	0	0	108.6	G766 L767	N764-G766 PolarHBondContact O-N 3.33Å; N764-L767 PolarHBondContact N-O 2.87Å; N764-L767 VanDerWaalsContact N-O 3.1Å; N764-L767 PolarHBondContact O-N 2.87Å
765	Q	50.5	Low	66.7	Low	160 Å²	160	63.7 Å²	63.7	75%	0.748	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	20.1	178.3	-62.8	177.5	-3.4	0	0	116.4	G746	G746-Q765 WeakPolarHBondContact CA-O 3.4Å; G746-Q765 PolarHBondContact N-O 3.31Å
766	G	50.6	Low	67.2	Low	8 Å²	8	67.2 Å²	67.2	8%	0.082	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.4	14.2	-177.8	0	0	0	0	0	115.6	G746 V749 N764	G746-G766 VanDerWaalsContact CA-CA 3.49Å; V749-G766 WeakPolarHBondContact CG2-O 3.44Å; N764-G766 PolarHBondContact O-N 3.33Å
767	L	54.5	Low	67.8	Low	95 Å²	95	68.8 Å²	68.8	50%	0.497	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.8	174	-62.5	170.8	0	0	0	109.3	P470 S763 N764 H769	P470-L767 HydrophobicContact CB-CD2 3.77Å; S763-L767 WeakPolarHBondContact CA-O 3.25Å; N764-L767 PolarHBondContact N-O 2.87Å; N764-L767 VanDerWaalsContact N-O 3.1Å; N764-L767 PolarHBondContact O-N 2.87Å; L767-H769 PolarHBondContact O-N 3.29Å
768	S	56.2	Low	67.5	Low	28 Å²	28	71.8 Å²	71.8	20%	0.196	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	106.9	173.3	55.6	0	0	0	0	110.2	G755	G755-S768 WeakPolarHBondContact O-CB 3.34Å; G755-S768 PolarHBondContact O-OG 3.31Å
769	H	72.1	Confident	67.2	Low	113 Å²	113	70.2 Å²	70.2	52%	0.523	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	107	170.5	-177.8	-92.4	0	0	0	109.4	E762 L767	E762-H769 PolarHBondContact N-O 3.12Å; E762-H769 WeakPolarHBondContact O-CA 3.44Å; E762-H769 VanDerWaalsContact O-CB 3.3Å; E762-H769 WeakPolarHBondContact O-CB 3.13Å; E762-H769 PolarHBondContact O-N 2.84Å; L767-H769 PolarHBondContact O-N 3.29Å
770	C	73.8	Confident	65.9	Low	4 Å²	4	73.1 Å²	73.1	3%	0.027	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	145.7	-176.6	-53.8	0	0	0	0	111.6	C757 K760 L778 G782 K783	C757-C770 VanDerWaalsContact CA-SG 3.51Å; C757-C770 HydrophobicContact CB-CB 3.53Å; C757-C770 WeakPolarHBondContact CB-SG 3.34Å; C757-C770 WeakPolarHBondContact SG-CA 3.27Å; C757-C770 WeakPolarHBondContact SG-CB 3.08Å; C757-C770 CovalentContact SG-SG 2Å; C757-C770 PolarHBondContact SG-SG 2.78Å; K760-C770 WeakPolarHBondContact O-CA 3.5Å; C770-L778 HydrophobicContact CB-CD1 3.61Å; C770-L778 HydrophobicContact CB-CD2 4.44Å; C770-L778 VanDerWaalsContact O-CD2 3.31Å; C770-L778 WeakPolarHBondContact O-CD2 3.48Å; C770-G782 WeakPolarHBondContact CB-O 3.32Å; C770-G782 PolarHBondContact SG-O 3.12Å; C770-K783 VanDerWaalsContact SG-CA 3.6Å
771	S	79.9	Confident	64.6	Low	27 Å²	27	72.4 Å²	72.4	19%	0.189	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	167.5	174.1	51.5	0	0	0	0	110.1	K760 C785	K760-S771 CarbonylContact C-O 3.54Å; K760-S771 WeakPolarHBondContact CA-O 3.49Å; K760-S771 WeakPolarHBondContact CB-O 3.33Å; K760-S771 WeakPolarHBondContact CB-OG 3.14Å; K760-S771 WeakPolarHBondContact CD-OG 3.22Å; K760-S771 PolarHBondContact N-O 2.88Å; K760-S771 PolarHBondContact O-N 2.99Å; S771-C785 PolarHBondContact O-SG 3.09Å
772	C	82.8	Confident	63.8	Low	29 Å²	29	73.2 Å²	73.2	20%	0.196	42%	0.415	C	S	.	.			trans	-121.5	157.3	-173.7	-55	0	0	0	0	111.5	F776 L778 C785	C772-F776 HydrophobicContact CB-CB 3.74Å; C772-F776 WeakPolarHBondContact CB-O 3.41Å; C772-L778 WeakPolarHBondContact SG-CA 3.44Å; C772-L778 PolarHBondContact SG-N 2.9Å; C772-C785 WeakPolarHBondContact CA-SG 3.31Å; C772-C785 HydrophobicContact CB-CB 3.82Å; C772-C785 WeakPolarHBondContact CB-SG 3.47Å; C772-C785 VanDerWaalsContact SG-CA 3.54Å; C772-C785 WeakPolarHBondContact SG-CB 3.18Å; C772-C785 CovalentContact SG-SG 2.04Å; C772-C785 PolarHBondContact SG-SG 2.79Å
773	L	75.6	Confident	63.4	Low	99 Å²	99	72.4 Å²	72.4	52%	0.518	41%	0.41	S	S	.	.			trans	-69.4	159.8	174.9	-68.6	169.4	0	0	0	110.6	H775 F776	L773-H775 PolarHBondContact O-N 2.81Å; L773-F776 HydrophobicContact CB-CD2 4.48Å; L773-F776 WeakPolarHBondContact O-CB 2.87Å; L773-F776 PolarHBondContact O-N 2.8Å
774	P	61.5	Low	63.9	Low	103 Å²	103	73 Å²	73	67%	0.669	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	138.9	173.3	-26.3	35.1	0	0	0	111.5	F776	P774-F776 VanDerWaalsContact C-N 3.31Å
775	H	66.1	Low	65.4	Low	151 Å²	151	68.9 Å²	68.9	70%	0.699	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	11.6	-170	-42.7	-75.1	0	0	0	116.2	L773 V788	L773-H775 PolarHBondContact O-N 2.81Å; H775-V788 PolarHBondContact O-N 2.93Å
776	F	74.5	Confident	66.2	Low	81 Å²	81	66.4 Å²	66.4	36%	0.355	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.6	168.7	-67.2	-104.2	0	0	0	111	Q759 C772 L773 P774 C785 M786 S787	Q759-F776 VanDerWaalsContact NE2-CG 3.33Å; C772-F776 HydrophobicContact CB-CB 3.74Å; C772-F776 WeakPolarHBondContact CB-O 3.41Å; L773-F776 HydrophobicContact CB-CD2 4.48Å; L773-F776 WeakPolarHBondContact O-CB 2.87Å; L773-F776 PolarHBondContact O-N 2.8Å; P774-F776 VanDerWaalsContact C-N 3.31Å; F776-C785 HydrophobicContact CB-CB 4.37Å; F776-M786 CarbonylContact C-O 3.22Å; F776-M786 WeakPolarHBondContact CA-O 3.29Å; F776-M786 WeakPolarHBondContact CB-O 3.39Å; F776-M786 VanDerWaalsContact CD1-C 3.49Å; F776-S787 VanDerWaalsContact CD1-CA 3.5Å
777	T	73.8	Confident	66.6	Low	76 Å²	76	70 Å²	70	47%	0.466	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	143.9	175.6	47.2	0	0	0	0	111.1	C785 M786 V788	T777-C785 WeakPolarHBondContact O-CA 3.45Å; T777-M786 PolarHBondContact N-O 2.98Å; T777-M786 PolarHBondContact O-N 3.3Å; T777-V788 HydrophobicContact CG2-CG2 3.75Å
778	L	66.3	Low	66.9	Low	71 Å²	71	69.2 Å²	69.2	37%	0.372	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.9	178.3	-166.1	75.6	0	0	0	109.9	C770 C772 S784	C770-L778 HydrophobicContact CB-CD1 3.61Å; C770-L778 HydrophobicContact CB-CD2 4.44Å; C770-L778 VanDerWaalsContact O-CD2 3.31Å; C770-L778 WeakPolarHBondContact O-CD2 3.48Å; C772-L778 WeakPolarHBondContact SG-CA 3.44Å; C772-L778 PolarHBondContact SG-N 2.9Å; L778-S784 WeakPolarHBondContact CD1-O 3.44Å
779	S	65.5	Low	66.3	Low	28 Å²	28	72.7 Å²	72.7	20%	0.196	43%	0.431	C	S	.	.			trans	-77.9	159	176.8	150.3	0	0	0	0	111.3	D781 G782 S784	S779-D781 WeakPolarHBondContact CB-OD1 3.27Å; S779-D781 PolarHBondContact O-N 2.79Å; S779-D781 VanDerWaalsContact O-N 3.14Å; S779-D781 PolarHBondContact OG-OD1 2.73Å; S779-G782 PolarHBondContact O-N 3.19Å; S779-S784 WeakPolarHBondContact CB-O 3.45Å; S779-S784 PolarHBondContact N-O 2.64Å
780	A	47.8	Very low	65.1	Low	115 Å²	115	72.7 Å²	72.7	95%	0.95	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-9	-176.4	0	0	0	0	0	114.5	G782	A780-G782 PolarHBondContact O-N 3.21Å
781	D	48.6	Very low	63.1	Low	81 Å²	81	77 Å²	77	43%	0.433	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-3.5	166.1	66.4	-24.7	0	0	0	112.9	S779 K783 S784	S779-D781 WeakPolarHBondContact CB-OD1 3.27Å; S779-D781 PolarHBondContact O-N 2.79Å; S779-D781 VanDerWaalsContact O-N 3.14Å; S779-D781 PolarHBondContact OG-OD1 2.73Å; D781-K783 PolarHBondContact O-N 2.88Å; D781-K783 PolarHBondContact OD1-N 3.2Å; D781-S784 VanDerWaalsContact CG-N 3.31Å; D781-S784 PolarHBondContact OD1-N 2.76Å; D781-S784 WeakPolarHBondContact OD2-CB 3.43Å; D781-S784 PolarHBondContact OD2-N 3.43Å; D781-S784 PolarHBondContact OD2-OG 3.19Å
782	G	57	Low	60.9	Low	34 Å²	34	82.8 Å²	82.8	35%	0.351	50%	0.503	S	S	.	.	S	Bend	trans	65.6	15.5	-177.2	0	0	0	0	0	112.8	C770 S779 A780	C770-G782 WeakPolarHBondContact CB-O 3.32Å; C770-G782 PolarHBondContact SG-O 3.12Å; S779-G782 PolarHBondContact O-N 3.19Å; A780-G782 PolarHBondContact O-N 3.21Å
783	K	62.7	Low	58.4	Low	73 Å²	73	88.2 Å²	88.2	32%	0.317	54%	0.535	S	S	.	.	S	Bend	trans	-140.8	-44.7	-167.9	-69.3	-160.2	177.1	-152.5	0	114.5	G755 G756 C757 A758 C770 D781	G755-K783 PolarHBondContact O-NZ 2.85Å; G756-K783 WeakPolarHBondContact O-CB 3.38Å; C757-K783 CarbonylContact C-O 3.54Å; C757-K783 VanDerWaalsContact CA-O 3.31Å; C757-K783 WeakPolarHBondContact CA-O 3.43Å; A758-K783 PolarHBondContact N-O 3.26Å; C770-K783 VanDerWaalsContact SG-CA 3.6Å; D781-K783 PolarHBondContact O-N 2.88Å; D781-K783 PolarHBondContact OD1-N 3.2Å
784	S	70.9	Confident	56.1	Low	49 Å²	49	89.5 Å²	89.5	34%	0.343	55%	0.547	S	S	.	.			trans	-83	160	-177.2	-61.6	0	0	0	0	112.8	L778 S779 D781	L778-S784 WeakPolarHBondContact CD1-O 3.44Å; S779-S784 WeakPolarHBondContact CB-O 3.45Å; S779-S784 PolarHBondContact N-O 2.64Å; D781-S784 VanDerWaalsContact CG-N 3.31Å; D781-S784 PolarHBondContact OD1-N 2.76Å; D781-S784 WeakPolarHBondContact OD2-CB 3.43Å; D781-S784 PolarHBondContact OD2-N 3.43Å; D781-S784 PolarHBondContact OD2-OG 3.19Å
785	C	82.3	Confident	54.5	Low	22 Å²	22	90.7 Å²	90.7	15%	0.149	55%	0.552	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.2	126.9	179.5	-71.6	0	0	0	0	111	A758 Q759 S771 C772 F776 T777	A758-C785 HydrophobicContact CB-CB 4.42Å; Q759-C785 HydrophobicContact CB-CB 4.26Å; Q759-C785 VanDerWaalsContact CD-CB 3.45Å; Q759-C785 HydrophobicContact CG-CB 3.7Å; S771-C785 PolarHBondContact O-SG 3.09Å; C772-C785 WeakPolarHBondContact CA-SG 3.31Å; C772-C785 HydrophobicContact CB-CB 3.82Å; C772-C785 WeakPolarHBondContact CB-SG 3.47Å; C772-C785 VanDerWaalsContact SG-CA 3.54Å; C772-C785 WeakPolarHBondContact SG-CB 3.18Å; C772-C785 CovalentContact SG-SG 2.04Å; C772-C785 PolarHBondContact SG-SG 2.79Å; F776-C785 HydrophobicContact CB-CB 4.37Å; T777-C785 WeakPolarHBondContact O-CA 3.45Å
786	M	68.1	Low	52.7	Low	107 Å²	107	92.8 Å²	92.8	53%	0.527	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.1	140	-176.8	-59.4	-173.4	-72.3	0	0	110.9	F776 T777	F776-M786 CarbonylContact C-O 3.22Å; F776-M786 WeakPolarHBondContact CA-O 3.29Å; F776-M786 WeakPolarHBondContact CB-O 3.39Å; F776-M786 VanDerWaalsContact CD1-C 3.49Å; T777-M786 PolarHBondContact N-O 2.98Å; T777-M786 PolarHBondContact O-N 3.3Å
787	S	58	Low	50.4	Low	83 Å²	83	94.3 Å²	94.3	58%	0.58	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.6	132.4	179.4	48.7	0	0	0	0	112	F776 S789	F776-S787 VanDerWaalsContact CD1-CA 3.5Å; S787-S789 PolarHBondContact O-N 3.12Å
788	V	61.1	Low	48.1	Very low	79 Å²	79	93.9 Å²	93.9	48%	0.479	59%	0.594	S	S	.	*			trans	-79.7	99.4	168.8	-175.7	0	0	0	0	107.6	H775 T777 S790	H775-V788 PolarHBondContact O-N 2.93Å; T777-V788 HydrophobicContact CG2-CG2 3.75Å; V788-S790 PolarHBondContact O-N 3.33Å; V788-S790 VanDerWaalsContact O-N 3.16Å
789	S	44.7	Very low	46.1	Very low	102 Å²	102	98.1 Å²	98.1	71%	0.713	62%	0.616	S	S	*	*			trans	-67.4	110.2	176.7	49.5	0	0	0	0	111	S787 S791	S787-S789 PolarHBondContact O-N 3.12Å; S789-S791 PolarHBondContact O-N 2.82Å
790	S	46.1	Very low	44.2	Very low	113 Å²	113	104.3 Å²	104.3	79%	0.79	64%	0.642	S	S	*	*			trans	-74.9	106.5	172.8	42.7	0	0	0	0	111.4	V788	V788-S790 PolarHBondContact O-N 3.33Å; V788-S790 VanDerWaalsContact O-N 3.16Å
791	S	32.5	Very low	43.2	Very low	95 Å²	95	104.7 Å²	104.7	66%	0.664	63%	0.633	S	S	*	*			trans	-178.2	138.6	158.6	31.8	0	0	0	0	110.3	S789	S789-S791 PolarHBondContact O-N 2.82Å
792	N	32.5	Very low	42.2	Very low	147 Å²	147	105.9 Å²	105.9	79%	0.786	65%	0.648	S	S	*	*			cis	-144.5	131.1	-13.2	-87.9	-28.2	0	0	0	107.6	T794	N792-T794 PolarHBondContact O-N 2.81Å
793	V	30.7	Very low	40.7	Very low	144 Å²	144	111.4 Å²	111.4	87%	0.873	67%	0.669	S	S	*	*			trans	-76.7	114.9	159	174.4	0	0	0	0	106.5	V795	V793-V795 PolarHBondContact O-N 2.88Å
794	T	28.3	Very low	39.1	Very low	125 Å²	125	115.3 Å²	115.3	77%	0.767	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-73.6	118.2	174.3	42.3	0	0	0	0	110	N792	N792-T794 PolarHBondContact O-N 2.81Å
795	V	28.1	Very low	37	Very low	128 Å²	128	118.9 Å²	118.9	78%	0.776	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66.3	126.3	167.2	174	0	0	0	0	109.1	V793	V793-V795 PolarHBondContact O-N 2.88Å
796	E	27.7	Very low	34.3	Very low	195 Å²	195	122.4 Å²	122.4	91%	0.911	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-91.1	148	152.4	-76.6	-169.2	148	0	0	109.1
797	S	26.5	Very low	32.4	Very low	114 Å²	114	125.8 Å²	125.8	80%	0.797	76%	0.757	S	S	*	*			trans	-124.3	143.5	-159.5	57.1	0	0	0	0	114.3
798	G	25.6	Very low	30.9	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	77%	0.767	S	S	*	*			trans	117.2	129.9	165.8	0	0	0	0	0	112.7
799	D	24.2	Very low	29.3	Very low	159 Å²	159	134.1 Å²	134.1	85%	0.85	78%	0.784	S	S	*	*			cis	-164.5	168.3	-9.3	-111.8	-54.3	0	0	0	107.2
800	E	25.8	Very low	28.4	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	79%	0.79	S	S	*	*			cis	-133.4	-170.6	12.7	-63.2	-177.4	52.4	0	0	112.7
801	T	25.4	Very low	27.4	Very low	124 Å²	124	138.7 Å²	138.7	76%	0.761	79%	0.786	S	S	*	*			trans	9	146.6	149.6	68.3	0	0	0	0	121.9
802	S	28	Very low	27.1	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	79%	0.791	S	S	*	*			cis	-157	142.3	17.7	56.2	0	0	0	0	115.5
803	D	26.3	Very low	26.8	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	79%	0.788	S	S	*	*			trans	47	92	145.1	-61.8	-22.6	0	0	0	124.3
804	L	28.6	Very low	26.5	Very low	154 Å²	154	142.4 Å²	142.4	81%	0.806	78%	0.783	S	S	*	*				32.4	117.4	108.3	-145.6	81.8	0	0	0	120.6
805	T	26.7	Very low	26.4	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	79%	0.788	S	S	*	*				170.7	113.5	107.8	35.1	0	0	0	0	114.9
806	S	25.5	Very low	26.1	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	79%	0.79	S	S	*	*				35.7	122.4	119.3	170.4	0	0	0	0	121.2
807	L	27.8	Very low	25.8	Very low	177 Å²	177	139.5 Å²	139.5	93%	0.927	79%	0.788	S	S	*	*				-148.3	138.8	129.5	-109.8	153	0	0	0	111.5
808	K	27.7	Very low	25.6	Very low	184 Å²	184	140.8 Å²	140.8	80%	0.8	79%	0.785	S	S	*	*			trans	-104.9	150.6	-172.9	-73	176.2	174.9	174.7	0	112.6
809	N	25.8	Very low	25.5	Very low	154 Å²	154	142.7 Å²	142.7	82%	0.824	79%	0.788	S	S	*	*			trans	5.4	136.4	151.2	-58.9	-0.1	0	0	0	120.6
810	K	26.3	Very low	25.5	Very low	193 Å²	193	142.5 Å²	142.5	84%	0.839	79%	0.787	S	S	*	*				-176.1	108.4	127.1	-101.3	171.5	-178	-175.1	0	109.7
811	T	25	Very low	25.5	Very low	117 Å²	117	138.3 Å²	138.3	72%	0.718	79%	0.786	S	S	*	*				87.9	133.2	82.1	53.3	0	0	0	0	117
812	L	26.4	Very low	25.4	Very low	146 Å²	146	135.7 Å²	135.7	76%	0.764	78%	0.784	S	S	*	*			trans	102.5	134.4	143.2	-76	152	0	0	0	123.2
813	H	26.3	Very low	25.3	Very low	158 Å²	158	137.3 Å²	137.3	73%	0.731	79%	0.789	S	S	*	*			trans	86.5	162.5	151.4	-80.8	-63.7	0	0	0	124.1
814	E	25.2	Very low	25.2	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.752	79%	0.791	S	S	*	*			trans	-99.6	163.2	-149.4	-67.5	145.6	105.9	0	0	115.9
815	A	25.2	Very low	25.1	Very low	107 Å²	107	137.9 Å²	137.9	88%	0.884	79%	0.791	S	S	*	*			trans	49.4	132.8	142.7	0	0	0	0	0	121.7
816	G	22.2	Very low	25.1	Very low	79 Å²	79	139 Å²	139	81%	0.814	80%	0.796	S	S	*	*			trans	153.3	97.6	156.8	0	0	0	0	0	117.2
817	F	21.5	Very low	25	Very low	200 Å²	200	140.7 Å²	140.7	88%	0.877	80%	0.797	S	S	*	*			trans	-38.8	155.5	167.5	-90.4	-98.5	0	0	0	120.1
818	I	22.3	Very low	24.8	Very low	141 Å²	141	142 Å²	142	72%	0.723	80%	0.796	S	S	*	*			trans	98.3	108.2	139.7	-75.4	157.7	0	0	0	121.8
819	S	22.8	Very low	24.7	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	79%	0.788	S	S	*	*			trans	51.6	158.6	134	87.8	0	0	0	0	121.7
820	D	23.8	Very low	24.8	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	79%	0.793	S	S	*	*			cis	-152.1	138.6	-0.5	-157.5	2.1	0	0	0	105.9
821	G	25.8	Very low	24.7	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	79%	0.794	S	S	*	*				107.8	142.6	86.5	0	0	0	0	0	110.1
822	G	23.8	Very low	24.7	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	80%	0.803	S	S	*	*			cis	172.8	156.2	-8.3	0	0	0	0	0	110
823	T	25.6	Very low	24.6	Very low	139 Å²	139	144.9 Å²	144.9	85%	0.853	81%	0.808	S	S	*	*	S	Bend	trans	-161.1	119.9	157	-5.6	0	0	0	0	113.4
824	K	25.6	Very low	24.5	Very low	195 Å²	195	142.1 Å²	142.1	85%	0.848	81%	0.813	S	S	*	*			trans	66.7	115.8	165.5	-62.8	-171.7	178.1	-178.1	0	118.6
825	P	25.2	Very low	24.3	Very low	122 Å²	122	137.9 Å²	137.9	79%	0.792	81%	0.812	S	S	*	*			trans	-88.3	157.4	170.6	36.5	-33.6	0	0	0	112.3
826	V	27.4	Very low	24.2	Very low	146 Å²	146	138.4 Å²	138.4	89%	0.885	80%	0.8	S	S	*	*			trans	-109.9	123.1	157.5	178	0	0	0	0	107.5
827	L	24.3	Very low	24.5	Very low	133 Å²	133	138.6 Å²	138.6	70%	0.696	78%	0.782	S	S	*	*			trans	-102.3	135.6	-176.3	-169.1	93.7	0	0	0	109.1	T829	L827-T829 HydrophobicContact CD2-CG2 3.83Å; L827-T829 HydrophobicContact CG-CG2 4.46Å
828	F	23	Very low	25.1	Very low	205 Å²	205	133.1 Å²	133.1	90%	0.899	76%	0.759	S	S	*	*			trans	-136.5	146.9	146.3	-104.4	-81.8	0	0	0	109.4
829	T	25.2	Very low	26	Very low	103 Å²	103	132.3 Å²	132.3	63%	0.632	76%	0.757	S	S	*	*			trans	-100.2	145.2	-151.3	47.3	0	0	0	0	114.3	L827	L827-T829 HydrophobicContact CD2-CG2 3.83Å; L827-T829 HydrophobicContact CG-CG2 4.46Å
830	E	28.6	Very low	27.1	Very low	197 Å²	197	130.6 Å²	130.6	92%	0.921	74%	0.739	S	S	*	*			trans	-72.6	139.7	148.5	-72.2	-173.2	140.9	0	0	110.6
831	K	23.4	Very low	28.1	Very low	201 Å²	201	125.2 Å²	125.2	87%	0.874	71%	0.713	S	S	*	*			trans	-155.9	124.7	148	-151.5	175.4	-174.7	-178.1	0	110.2
832	M	25.3	Very low	29.1	Very low	184 Å²	184	132.7 Å²	132.7	91%	0.906	72%	0.721	S	S	*	*			trans	-69	143.6	175.6	-68.8	-174	-74	0	0	111.9
833	I	23.7	Very low	30.2	Very low	170 Å²	170	134.5 Å²	134.5	87%	0.872	72%	0.723	S	S	*	*			trans	-130.2	133.4	152.6	-66.3	-178.5	0	0	0	106.6
834	A	25	Very low	31.3	Very low	100 Å²	100	131 Å²	131	83%	0.826	70%	0.699	S	S	*	*			trans	-87.1	140.5	170.3	0	0	0	0	0	109.7
835	G	21.3	Very low	32.6	Very low	71 Å²	71	130.5 Å²	130.5	73%	0.732	70%	0.699	S	S	*	*			trans	152.2	118.6	172.6	0	0	0	0	0	113.8
836	N	23.2	Very low	34.3	Very low	118 Å²	118	126.6 Å²	126.6	63%	0.631	67%	0.674	S	S	*	*			trans	56.5	113.7	158	-75	46.6	0	0	0	121.7	E857	N836-E857 PolarHBondContact ND2-OE1 3.36Å
837	D	26.9	Very low	36	Very low	83 Å²	83	120.8 Å²	120.8	44%	0.444	64%	0.641	S	S	.	*				93.9	108.1	117.5	-54.8	-5.1	0	0	0	122.5	E857	D837-E857 WeakPolarHBondContact OD2-CG 3.5Å
838	Q	35.9	Very low	37.8	Very low	85 Å²	85	121.2 Å²	121.2	40%	0.397	65%	0.649	S	S	.	*			trans	55.9	123.7	131.1	-92.3	81.1	9.6	0	0	121.5	D840	Q838-D840 HydrophobicContact CG-CB 3.72Å; Q838-D840 WeakPolarHBondContact CG-OD2 3.43Å; Q838-D840 PolarHBondContact NE2-OD2 3.11Å
839	N	41.1	Very low	39.9	Very low	125 Å²	125	114.2 Å²	114.2	67%	0.668	62%	0.621	S	S	*	*			trans	-128.4	57.9	137.4	-155.1	3.4	0	0	0	109.9	C841	N839-C841 PolarHBondContact O-N 2.84Å; N839-C841 VanDerWaalsContact O-N 3.13Å
840	D	45.3	Very low	42.3	Very low	71 Å²	71	109.9 Å²	109.9	38%	0.38	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-71.5	1.6	-170.3	-84.4	2.8	0	0	0	115.4	Q838 Y842 S843 P859	Q838-D840 HydrophobicContact CG-CB 3.72Å; Q838-D840 WeakPolarHBondContact CG-OD2 3.43Å; Q838-D840 PolarHBondContact NE2-OD2 3.11Å; D840-Y842 PolarHBondContact O-N 3.43Å; D840-S843 PolarHBondContact O-N 3.36Å; D840-P859 HydrophobicContact CB-CG 4.04Å
841	C	44.2	Very low	44.1	Very low	42 Å²	42	107.8 Å²	107.8	28%	0.284	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-66.7	-2.9	177.7	-66.4	0	0	0	0	114.2	N839 C852	N839-C841 PolarHBondContact O-N 2.84Å; N839-C841 VanDerWaalsContact O-N 3.13Å; C841-C852 HydrophobicContact CB-CB 3.78Å; C841-C852 WeakPolarHBondContact CB-SG 3.27Å; C841-C852 WeakPolarHBondContact SG-CB 3.06Å; C841-C852 CovalentContact SG-SG 2.05Å; C841-C852 PolarHBondContact SG-SG 3.42Å
842	Y	46.4	Very low	46.3	Very low	227 Å²	227	100.2 Å²	100.2	89%	0.89	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-81.5	-12.8	172.4	-99.8	-78.7	0	0	0	114.6	D840	D840-Y842 PolarHBondContact O-N 3.43Å
843	S	47.9	Very low	48.5	Very low	108 Å²	108	93.8 Å²	93.8	76%	0.755	52%	0.523	S	S	*	.	S	Bend	trans	-106	-3.7	-177.5	-62.2	0	0	0	0	114.4	D840	D840-S843 PolarHBondContact O-N 3.36Å
844	L	47.9	Very low	50.3	Low	65 Å²	65	89.6 Å²	89.6	34%	0.34	50%	0.501	S	S	.	.			trans	-107.7	118.5	176.6	-113.3	77.4	0	0	0	111.3	C846	L844-C846 PolarHBondContact O-N 2.94Å; L844-C846 VanDerWaalsContact O-N 3.09Å
845	H	53.5	Low	51.5	Low	185 Å²	185	89 Å²	89	86%	0.856	48%	0.484	S	S	*	.			trans	-76.4	90.9	166.9	-83.4	-65.7	0	0	0	110.4
846	C	59.8	Low	53	Low	39 Å²	39	90 Å²	90	26%	0.264	49%	0.486	S	S	.	.			trans	-73.3	155.6	168.7	-63.2	0	0	0	0	112	L844 A850 C861	L844-C846 PolarHBondContact O-N 2.94Å; L844-C846 VanDerWaalsContact O-N 3.09Å; C846-A850 HydrophobicContact CB-CB 4.07Å; C846-C861 WeakPolarHBondContact CA-SG 3.33Å; C846-C861 HydrophobicContact CB-CB 3.78Å; C846-C861 WeakPolarHBondContact CB-SG 3.45Å; C846-C861 WeakPolarHBondContact SG-CB 3.36Å; C846-C861 CovalentContact SG-SG 2.04Å; C846-C861 PolarHBondContact SG-SG 2.78Å
847	A	64.6	Low	54.6	Low	24 Å²	24	90.3 Å²	90.3	20%	0.198	48%	0.484	C	S	.	.			trans	-61	155.1	173.2	0	0	0	0	0	112.5	N849 A850 G871 Q872 C874	A847-N849 PolarHBondContact O-N 3.27Å; A847-A850 HydrophobicContact CB-CB 4.16Å; A847-A850 WeakPolarHBondContact O-CB 3.44Å; A847-A850 PolarHBondContact O-N 2.99Å; A847-G871 PolarHBondContact N-O 3.15Å; A847-Q872 WeakPolarHBondContact CB-O 3.13Å; A847-C874 HydrophobicContact CB-CB 4.37Å
848	V	61.8	Low	55.8	Low	142 Å²	142	92.1 Å²	92.1	86%	0.861	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-28.4	180	-173.6	0	0	0	0	113.1
849	N	66.4	Low	57.1	Low	59 Å²	59	89.2 Å²	89.2	32%	0.316	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	26.3	179	-60.2	-38.6	0	0	0	113.6	A847 Q864 F867 C874	A847-N849 PolarHBondContact O-N 3.27Å; N849-Q864 WeakPolarHBondContact O-CB 3.44Å; N849-Q864 WeakPolarHBondContact O-CG 3.14Å; N849-Q864 PolarHBondContact O-N 3.01Å; N849-F867 HydrophobicContact CB-CD1 3.97Å; N849-F867 HydrophobicContact CB-CD2 4.1Å; N849-F867 HydrophobicContact CB-CE1 4.1Å; N849-F867 HydrophobicContact CB-CE2 4.21Å; N849-F867 HydrophobicContact CB-CG 4Å; N849-F867 HydrophobicContact CB-CZ 4.21Å; N849-F867 VanDerWaalsContact ND2-CE1 3.3Å; N849-F867 WeakPolarHBondContact ND2-CE1 3.41Å; N849-C874 HydrophobicContact CB-CB 4.23Å
850	A	75.6	Confident	58.4	Low	12 Å²	12	89 Å²	89	10%	0.099	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	157	175.4	0	0	0	0	0	112.1	C846 A847 C861 L862 Q864 G871	C846-A850 HydrophobicContact CB-CB 4.07Å; A847-A850 HydrophobicContact CB-CB 4.16Å; A847-A850 WeakPolarHBondContact O-CB 3.44Å; A847-A850 PolarHBondContact O-N 2.99Å; A850-C861 HydrophobicContact CB-CB 4.25Å; A850-L862 WeakPolarHBondContact CA-O 3.32Å; A850-Q864 PolarHBondContact O-NE2 2.79Å; A850-G871 WeakPolarHBondContact CB-O 3.43Å
851	R	67.5	Low	59.8	Low	152 Å²	152	86.4 Å²	86.4	57%	0.574	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.9	169.1	59.3	175	-175.8	-172.4	1.4	110	V853 L862	R851-V853 HydrophobicContact CG-CG2 4.02Å; R851-L862 WeakPolarHBondContact CG-O 3.49Å; R851-L862 PolarHBondContact N-O 2.73Å; R851-L862 PolarHBondContact O-N 3.01Å
852	C	68.9	Low	61.3	Low	43 Å²	43	87.4 Å²	87.4	29%	0.291	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.9	170.9	-168.5	0	0	0	0	108.8	C841	C841-C852 HydrophobicContact CB-CB 3.78Å; C841-C852 WeakPolarHBondContact CB-SG 3.27Å; C841-C852 WeakPolarHBondContact SG-CB 3.06Å; C841-C852 CovalentContact SG-SG 2.05Å; C841-C852 PolarHBondContact SG-SG 3.42Å
853	V	70.7	Confident	62.7	Low	49 Å²	49	77.5 Å²	77.5	30%	0.297	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.3	175	-170.2	0	0	0	0	107.9	R851 R860 L862	R851-V853 HydrophobicContact CG-CG2 4.02Å; V853-R860 PolarHBondContact N-O 3.06Å; V853-R860 WeakPolarHBondContact O-CG 3.13Å; V853-R860 PolarHBondContact O-N 2.99Å; V853-R860 VanDerWaalsContact O-N 3.12Å; V853-L862 HydrophobicContact CG2-CB 4.01Å
854	L	61.7	Low	63.9	Low	81 Å²	81	76.7 Å²	76.7	42%	0.424	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	123.1	171.7	-72.1	160.4	0	0	0	108.5	P859	L854-P859 HydrophobicContact CD2-CB 4.05Å
855	D	51.3	Low	64.9	Low	87 Å²	87	83 Å²	83	47%	0.465	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	118.1	174.3	-158.7	2.5	0	0	0	108.3	E857 N858 R860	D855-E857 PolarHBondContact O-N 3.07Å; D855-N858 PolarHBondContact N-O 2.97Å; D855-N858 PolarHBondContact O-N 3.43Å; D855-R860 IonicContact OD2-CZ 3.74Å; D855-R860 IonicContact OD2-NE 2.67Å; D855-R860 IonicContact OD2-NH2 3.64Å; D855-R860 PolarHBondContact OD2-NH2 3.22Å
856	A	52.5	Low	65.1	Low	93 Å²	93	75.8 Å²	75.8	77%	0.769	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.1	64.7	-174.5	0	0	0	0	0	114.2	N858	A856-N858 PolarHBondContact O-N 2.99Å; A856-N858 VanDerWaalsContact O-N 3.1Å
857	E	56.8	Low	65.2	Low	125 Å²	125	77.1 Å²	77.1	58%	0.584	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	2.2	170.8	-56.5	176.6	-174.8	0	0	117.1	N836 D837 D855	N836-E857 PolarHBondContact ND2-OE1 3.36Å; D837-E857 WeakPolarHBondContact OD2-CG 3.5Å; D855-E857 PolarHBondContact O-N 3.07Å
858	N	50.9	Low	65.1	Low	120 Å²	120	78.5 Å²	78.5	64%	0.642	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.4	170.1	-90	-53.7	0	0	0	112.7	D855 A856 R860	D855-N858 PolarHBondContact N-O 2.97Å; D855-N858 PolarHBondContact O-N 3.43Å; A856-N858 PolarHBondContact O-N 2.99Å; A856-N858 VanDerWaalsContact O-N 3.1Å; N858-R860 PolarHBondContact O-N 3.39Å
859	P	65	Low	65.5	Low	25 Å²	25	74.3 Å²	74.3	16%	0.162	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	120.9	173.9	30.3	-33.1	0	0	0	110.6	D840 L854	D840-P859 HydrophobicContact CB-CG 4.04Å; L854-P859 HydrophobicContact CD2-CB 4.05Å
860	R	67.2	Low	65.6	Low	121 Å²	121	76.9 Å²	76.9	46%	0.457	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.8	176.9	59.3	180	-174.7	151.7	-0.3	112.4	V853 D855 N858	V853-R860 PolarHBondContact N-O 3.06Å; V853-R860 WeakPolarHBondContact O-CG 3.13Å; V853-R860 PolarHBondContact O-N 2.99Å; V853-R860 VanDerWaalsContact O-N 3.12Å; D855-R860 IonicContact OD2-CZ 3.74Å; D855-R860 IonicContact OD2-NE 2.67Å; D855-R860 IonicContact OD2-NH2 3.64Å; D855-R860 PolarHBondContact OD2-NH2 3.22Å; N858-R860 PolarHBondContact O-N 3.39Å
861	C	75.8	Confident	65.1	Low	15 Å²	15	76.3 Å²	76.3	10%	0.101	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	137.2	171.7	-54.5	0	0	0	0	109.6	C846 A850 G871	C846-C861 WeakPolarHBondContact CA-SG 3.33Å; C846-C861 HydrophobicContact CB-CB 3.78Å; C846-C861 WeakPolarHBondContact CB-SG 3.45Å; C846-C861 WeakPolarHBondContact SG-CB 3.36Å; C846-C861 CovalentContact SG-SG 2.04Å; C846-C861 PolarHBondContact SG-SG 2.78Å; A850-C861 HydrophobicContact CB-CB 4.25Å; C861-G871 VanDerWaalsContact CB-C 3.47Å; C861-G871 WeakPolarHBondContact CB-O 3.42Å
862	L	74.4	Confident	65	Low	63 Å²	63	75.4 Å²	75.4	33%	0.33	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.4	-178.1	-156.5	132	0	0	0	109.2	A850 R851 V853	A850-L862 WeakPolarHBondContact CA-O 3.32Å; R851-L862 WeakPolarHBondContact CG-O 3.49Å; R851-L862 PolarHBondContact N-O 2.73Å; R851-L862 PolarHBondContact O-N 3.01Å; V853-L862 HydrophobicContact CG2-CB 4.01Å
863	C	77.1	Confident	64.4	Low	19 Å²	19	77.3 Å²	77.3	13%	0.128	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	142.7	-174.7	-59.7	0	0	0	0	112.4	F867 G869 C874	C863-F867 HydrophobicContact CB-CB 4.04Å; C863-G869 PolarHBondContact SG-N 3.02Å; C863-C874 WeakPolarHBondContact CA-SG 3.36Å; C863-C874 HydrophobicContact CB-CB 3.85Å; C863-C874 WeakPolarHBondContact CB-SG 3.32Å; C863-C874 VanDerWaalsContact SG-CA 3.51Å; C863-C874 WeakPolarHBondContact SG-CB 3.49Å; C863-C874 CovalentContact SG-SG 2.04Å; C863-C874 PolarHBondContact SG-SG 2.82Å
864	Q	72.6	Confident	64.2	Low	92 Å²	92	75.8 Å²	75.8	43%	0.43	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-72.3	164.2	179.2	-66.1	-176.6	14.9	0	0	111.9	N849 A850 G866 F867	N849-Q864 WeakPolarHBondContact O-CB 3.44Å; N849-Q864 WeakPolarHBondContact O-CG 3.14Å; N849-Q864 PolarHBondContact O-N 3.01Å; A850-Q864 PolarHBondContact O-NE2 2.79Å; Q864-G866 PolarHBondContact O-N 2.8Å; Q864-F867 PolarHBondContact O-N 2.82Å
865	E	68.1	Low	64.2	Low	198 Å²	198	75.9 Å²	75.9	93%	0.925	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	121.7	-173.2	-161.2	166	-148.8	0	0	111.3
866	G	57.5	Low	64.7	Low	33 Å²	33	72.2 Å²	72.2	34%	0.34	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.3	-13.3	-170.1	0	0	0	0	0	114.2	Q864 K877	Q864-G866 PolarHBondContact O-N 2.8Å; G866-K877 WeakPolarHBondContact O-CB 3.39Å; G866-K877 WeakPolarHBondContact O-CG 3.45Å; G866-K877 PolarHBondContact O-N 3.04Å
867	F	63.1	Low	64.7	Low	67 Å²	67	73.6 Å²	73.6	29%	0.294	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	161.1	176.5	-60.8	-96.6	0	0	0	111.6	N849 C863 Q864 C874 L875	N849-F867 HydrophobicContact CB-CD1 3.97Å; N849-F867 HydrophobicContact CB-CD2 4.1Å; N849-F867 HydrophobicContact CB-CE1 4.1Å; N849-F867 HydrophobicContact CB-CE2 4.21Å; N849-F867 HydrophobicContact CB-CG 4Å; N849-F867 HydrophobicContact CB-CZ 4.21Å; N849-F867 VanDerWaalsContact ND2-CE1 3.3Å; N849-F867 WeakPolarHBondContact ND2-CE1 3.41Å; C863-F867 HydrophobicContact CB-CB 4.04Å; Q864-F867 PolarHBondContact O-N 2.82Å; F867-C874 HydrophobicContact CB-CB 4.21Å; F867-L875 CarbonylContact C-O 3.58Å; F867-L875 WeakPolarHBondContact CA-O 3.47Å
868	T	63.1	Low	64.2	Low	52 Å²	52	71.2 Å²	71.2	32%	0.319	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	143.6	178	46.2	0	0	0	0	110.3	L875 K877 I880	T868-L875 PolarHBondContact N-O 2.87Å; T868-L875 PolarHBondContact O-N 3.4Å; T868-K877 HydrophobicContact CG2-CG 4.17Å; T868-I880 WeakPolarHBondContact OG1-CD1 3.28Å
869	G	69.8	Low	63.9	Low	54 Å²	54	70.2 Å²	70.2	56%	0.557	38%	0.383	S	S	*	.	S	Bend	trans	160	-168.1	-175.6	0	0	0	0	0	110.8	C863 T873	C863-G869 PolarHBondContact SG-N 3.02Å; G869-T873 CarbonylContact C-O 3.48Å; G869-T873 WeakPolarHBondContact CA-O 3.42Å
870	D	67.1	Low	62.9	Low	113 Å²	113	71.8 Å²	71.8	60%	0.604	39%	0.389	S	S	*	.	S	Bend	trans	-86.1	-5.4	-178.7	64.2	7.3	0	0	0	114.1	Q872 T873	D870-Q872 PolarHBondContact OD1-N 2.86Å; D870-T873 PolarHBondContact N-O 3Å; D870-T873 PolarHBondContact OD1-N 2.93Å; D870-T873 PolarHBondContact OD1-OG1 2.79Å
871	G	67.1	Low	61.7	Low	0 Å²	0	70 Å²	70	0%	0	39%	0.392	C	S	.	.	S	Bend	trans	94.6	-22.3	178.7	0	0	0	0	0	114.7	A847 A850 C861 T873	A847-G871 PolarHBondContact N-O 3.15Å; A850-G871 WeakPolarHBondContact CB-O 3.43Å; C861-G871 VanDerWaalsContact CB-C 3.47Å; C861-G871 WeakPolarHBondContact CB-O 3.42Å; G871-T873 PolarHBondContact N-O 2.78Å
872	Q	64.6	Low	60.1	Low	133 Å²	133	74.3 Å²	74.3	62%	0.621	41%	0.413	S	S	*	.	S	Bend	trans	-87.1	-22.4	162.6	-71	-170.2	-4.6	0	0	111.3	A847 D870	A847-Q872 WeakPolarHBondContact CB-O 3.13Å; D870-Q872 PolarHBondContact OD1-N 2.86Å
873	T	55.6	Low	58.4	Low	83 Å²	83	76 Å²	76	51%	0.509	42%	0.422	S	S	.	.	S	Bend	trans	-126.5	135.5	163.9	57	0	0	0	0	109.5	G869 D870 G871	G869-T873 CarbonylContact C-O 3.48Å; G869-T873 WeakPolarHBondContact CA-O 3.42Å; D870-T873 PolarHBondContact N-O 3Å; D870-T873 PolarHBondContact OD1-N 2.93Å; D870-T873 PolarHBondContact OD1-OG1 2.79Å; G871-T873 PolarHBondContact N-O 2.78Å
874	C	66.3	Low	56.6	Low	18 Å²	18	79.6 Å²	79.6	12%	0.122	44%	0.44	C	S	.	.			trans	-139.2	105.7	179.7	-71.5	0	0	0	0	109.6	A847 N849 C863 F867	A847-C874 HydrophobicContact CB-CB 4.37Å; N849-C874 HydrophobicContact CB-CB 4.23Å; C863-C874 WeakPolarHBondContact CA-SG 3.36Å; C863-C874 HydrophobicContact CB-CB 3.85Å; C863-C874 WeakPolarHBondContact CB-SG 3.32Å; C863-C874 VanDerWaalsContact SG-CA 3.51Å; C863-C874 WeakPolarHBondContact SG-CB 3.49Å; C863-C874 CovalentContact SG-SG 2.04Å; C863-C874 PolarHBondContact SG-SG 2.82Å; F867-C874 HydrophobicContact CB-CB 4.21Å
875	L	63.2	Low	55	Low	83 Å²	83	84.1 Å²	84.1	44%	0.435	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	147	-179	-64.8	169.6	0	0	0	110.4	F867 T868	F867-L875 CarbonylContact C-O 3.58Å; F867-L875 WeakPolarHBondContact CA-O 3.47Å; T868-L875 PolarHBondContact N-O 2.87Å; T868-L875 PolarHBondContact O-N 3.4Å
876	G	60.1	Low	53.7	Low	9 Å²	9	78.9 Å²	78.9	9%	0.093	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	141.9	179.1	0	0	0	0	0	111.6	A878 E879 I880	G876-A878 PolarHBondContact O-N 2.92Å; G876-A878 VanDerWaalsContact O-N 3.09Å; G876-E879 PolarHBondContact N-OE2 3.03Å; G876-E879 WeakPolarHBondContact O-CB 3.32Å; G876-E879 PolarHBondContact O-N 3.05Å; G876-I880 PolarHBondContact O-N 2.95Å
877	K	53.4	Low	52.7	Low	122 Å²	122	82 Å²	82	53%	0.53	44%	0.44	S	S	.	.	H	α-helix	trans	-58.5	-23.8	173.6	-75.8	178.1	179.8	180	0	112.8	G866 T868 T881	G866-K877 WeakPolarHBondContact O-CB 3.39Å; G866-K877 WeakPolarHBondContact O-CG 3.45Å; G866-K877 PolarHBondContact O-N 3.04Å; T868-K877 HydrophobicContact CG2-CG 4.17Å; K877-T881 PolarHBondContact O-OG1 3.35Å
878	A	46.8	Very low	51.3	Low	76 Å²	76	81.9 Å²	81.9	63%	0.628	45%	0.451	S	S	*	.	H	α-helix	trans	-67	-41.2	169.9	0	0	0	0	0	112.7	G876 I880 T881	G876-A878 PolarHBondContact O-N 2.92Å; G876-A878 VanDerWaalsContact O-N 3.09Å; A878-I880 PolarHBondContact O-N 2.77Å; A878-T881 VanDerWaalsContact O-CB 3.26Å; A878-T881 WeakPolarHBondContact O-CB 3.43Å; A878-T881 PolarHBondContact O-N 3.43Å
879	E	43.3	Very low	50.1	Low	98 Å²	98	87.1 Å²	87.1	46%	0.458	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-34	179.7	-60.7	176	125.4	0	0	111.8	G876 T881 I882 L883	G876-E879 PolarHBondContact N-OE2 3.03Å; G876-E879 WeakPolarHBondContact O-CB 3.32Å; G876-E879 PolarHBondContact O-N 3.05Å; E879-T881 PolarHBondContact O-N 3.2Å; E879-I882 CarbonylContact O-C 3.44Å; E879-I882 WeakPolarHBondContact O-CA 3.45Å; E879-I882 WeakPolarHBondContact O-CB 3.26Å; E879-I882 PolarHBondContact O-N 3.27Å; E879-L883 PolarHBondContact O-N 3.46Å
880	I	45.5	Very low	48.4	Very low	58 Å²	58	91 Å²	91	30%	0.297	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-25.9	171.2	-71.2	-176.7	0	0	0	112.1	T868 G876 A878 I882 N884	T868-I880 WeakPolarHBondContact OG1-CD1 3.28Å; G876-I880 PolarHBondContact O-N 2.95Å; A878-I880 PolarHBondContact O-N 2.77Å; I880-I882 VanDerWaalsContact C-N 3.26Å; I880-I882 PolarHBondContact O-N 3.22Å; I880-N884 WeakPolarHBondContact CG2-ND2 3.39Å; I880-N884 WeakPolarHBondContact O-CB 3.13Å; I880-N884 VanDerWaalsContact O-CG 3.28Å; I880-N884 PolarHBondContact O-N 3.48Å; I880-N884 PolarHBondContact O-ND2 3.14Å
881	T	42.3	Very low	46.6	Very low	83 Å²	83	89.4 Å²	89.4	51%	0.509	48%	0.48	S	S	.	.	H	α-helix	trans	-72.3	-24.2	173.4	-49.1	0	0	0	0	111.6	K877 A878 E879 R885	K877-T881 PolarHBondContact O-OG1 3.35Å; A878-T881 VanDerWaalsContact O-CB 3.26Å; A878-T881 WeakPolarHBondContact O-CB 3.43Å; A878-T881 PolarHBondContact O-N 3.43Å; E879-T881 PolarHBondContact O-N 3.2Å; T881-R885 WeakPolarHBondContact O-CB 3.42Å; T881-R885 WeakPolarHBondContact O-CG 3.44Å; T881-R885 PolarHBondContact O-N 2.9Å
882	I	42	Very low	45.1	Very low	107 Å²	107	95.4 Å²	95.4	55%	0.549	52%	0.516	S	S	.	.	H	α-helix	trans	-85.1	-43.6	174.2	-57.7	174.1	0	0	0	110.2	E879 I880 N884 R885 N886	E879-I882 CarbonylContact O-C 3.44Å; E879-I882 WeakPolarHBondContact O-CA 3.45Å; E879-I882 WeakPolarHBondContact O-CB 3.26Å; E879-I882 PolarHBondContact O-N 3.27Å; I880-I882 VanDerWaalsContact C-N 3.26Å; I880-I882 PolarHBondContact O-N 3.22Å; I882-N884 PolarHBondContact O-N 2.84Å; I882-R885 PolarHBondContact O-N 3.42Å; I882-N886 PolarHBondContact O-N 2.83Å
883	L	38.1	Very low	43.7	Very low	97 Å²	97	95.7 Å²	95.7	51%	0.508	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-43.7	173.5	-116.9	93.2	0	0	0	111.8	E879 R885 N886 L887	E879-L883 PolarHBondContact O-N 3.46Å; L883-R885 VanDerWaalsContact C-N 3.32Å; L883-R885 PolarHBondContact O-N 2.68Å; L883-N886 CarbonylContact O-C 3.55Å; L883-N886 PolarHBondContact O-N 3.27Å; L883-N886 VanDerWaalsContact O-N 3.11Å; L883-L887 WeakPolarHBondContact O-CB 3.47Å; L883-L887 PolarHBondContact O-N 3.33Å
884	N	39.8	Very low	42.4	Very low	95 Å²	95	99.3 Å²	99.3	51%	0.508	54%	0.536	S	S	.	.	H	α-helix	trans	-68.5	-28	176.3	-74.9	-21.1	0	0	0	112.7	I880 I882 N886 A888	I880-N884 WeakPolarHBondContact CG2-ND2 3.39Å; I880-N884 WeakPolarHBondContact O-CB 3.13Å; I880-N884 VanDerWaalsContact O-CG 3.28Å; I880-N884 PolarHBondContact O-N 3.48Å; I880-N884 PolarHBondContact O-ND2 3.14Å; I882-N884 PolarHBondContact O-N 2.84Å; N884-N886 VanDerWaalsContact C-N 3.33Å; N884-A888 WeakPolarHBondContact O-CB 3.45Å; N884-A888 PolarHBondContact O-N 3.41Å
885	R	38.5	Very low	40.5	Very low	188 Å²	188	102.9 Å²	102.9	71%	0.709	57%	0.567	S	S	*	*	H	α-helix	trans	-68.8	-31.1	169.7	-88.4	178.5	168.1	177.4	-2.1	112.7	T881 I882 L883 K889	T881-R885 WeakPolarHBondContact O-CB 3.42Å; T881-R885 WeakPolarHBondContact O-CG 3.44Å; T881-R885 PolarHBondContact O-N 2.9Å; I882-R885 PolarHBondContact O-N 3.42Å; L883-R885 VanDerWaalsContact C-N 3.32Å; L883-R885 PolarHBondContact O-N 2.68Å; R885-K889 PolarHBondContact O-N 2.92Å
886	N	40.4	Very low	38.9	Very low	87 Å²	87	108.1 Å²	108.1	47%	0.465	59%	0.587	S	S	.	*	H	α-helix	trans	-83.2	-36.8	176.1	-71	-18.8	0	0	0	112.4	I882 L883 N884 K889 L890	I882-N886 PolarHBondContact O-N 2.83Å; L883-N886 CarbonylContact O-C 3.55Å; L883-N886 PolarHBondContact O-N 3.27Å; L883-N886 VanDerWaalsContact O-N 3.11Å; N884-N886 VanDerWaalsContact C-N 3.33Å; N886-K889 WeakPolarHBondContact O-CA 3.34Å; N886-K889 WeakPolarHBondContact O-CB 3.34Å; N886-K889 PolarHBondContact O-N 2.83Å; N886-L890 WeakPolarHBondContact O-CD1 3.28Å; N886-L890 PolarHBondContact O-N 2.83Å
887	L	37.3	Very low	37.5	Very low	100 Å²	100	114 Å²	114	52%	0.524	62%	0.621	S	S	.	*	H	α-helix	trans	-64.2	-37.2	169.8	-83.8	154.7	0	0	0	112.1	L883 K889 L890 A891	L883-L887 WeakPolarHBondContact O-CB 3.47Å; L883-L887 PolarHBondContact O-N 3.33Å; L887-K889 PolarHBondContact O-N 3.22Å; L887-L890 PolarHBondContact O-N 2.91Å; L887-A891 WeakPolarHBondContact O-CB 3.37Å; L887-A891 PolarHBondContact O-N 2.95Å
888	A	33.6	Very low	36.2	Very low	64 Å²	64	117.3 Å²	117.3	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-65.7	-20.1	171.1	0	0	0	0	0	113.6	N884	N884-A888 WeakPolarHBondContact O-CB 3.45Å; N884-A888 PolarHBondContact O-N 3.41Å
889	K	37.7	Very low	35.2	Very low	162 Å²	162	119.6 Å²	119.6	70%	0.704	64%	0.638	S	S	*	*	H	α-helix	trans	-84.5	-30.6	170.5	-79	-178.9	173.5	-179.4	0	113.1	R885 N886 L887	R885-K889 PolarHBondContact O-N 2.92Å; N886-K889 WeakPolarHBondContact O-CA 3.34Å; N886-K889 WeakPolarHBondContact O-CB 3.34Å; N886-K889 PolarHBondContact O-N 2.83Å; L887-K889 PolarHBondContact O-N 3.22Å
890	L	35	Very low	34.5	Very low	134 Å²	134	121.9 Å²	121.9	70%	0.702	65%	0.652	S	S	*	*	H	α-helix	trans	-74.8	-25.4	171.1	-89.3	94.6	0	0	0	113.2	N886 L887 V892 I893	N886-L890 WeakPolarHBondContact O-CD1 3.28Å; N886-L890 PolarHBondContact O-N 2.83Å; L887-L890 PolarHBondContact O-N 2.91Å; L890-V892 PolarHBondContact O-N 2.98Å; L890-I893 PolarHBondContact O-N 3.35Å
891	A	28.9	Very low	33.7	Very low	81 Å²	81	123.9 Å²	123.9	67%	0.669	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	0.1	-178.9	0	0	0	0	0	115.8	L887	L887-A891 WeakPolarHBondContact O-CB 3.37Å; L887-A891 PolarHBondContact O-N 2.95Å
892	V	34.9	Very low	32.9	Very low	125 Å²	125	123.2 Å²	123.2	76%	0.758	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-12.3	176.8	-178.3	0	0	0	0	112.3	L890	L890-V892 PolarHBondContact O-N 2.98Å
893	I	35.7	Very low	32.2	Very low	140 Å²	140	124.7 Å²	124.7	72%	0.718	70%	0.701	S	S	*	*	S	Bend	trans	-125.9	70.2	178.3	-47.1	178.4	0	0	0	110	L890	L890-I893 PolarHBondContact O-N 3.35Å
894	N	28.2	Very low	31.7	Very low	158 Å²	158	128.9 Å²	128.9	85%	0.845	72%	0.718	S	S	*	*			trans	178.3	85.3	139.6	-91	-19.8	0	0	0	110.8
895	A	25.6	Very low	31.9	Very low	93 Å²	93	130.1 Å²	130.1	77%	0.769	73%	0.731	S	S	*	*			trans	-142.8	61.2	166.6	0	0	0	0	0	110.4
896	F	30.3	Very low	31.2	Very low	194 Å²	194	126 Å²	126	85%	0.851	74%	0.737	S	S	*	*			trans	-137.8	128	158.3	-99.6	-81.3	0	0	0	111.1
897	T	29.6	Very low	30.4	Very low	132 Å²	132	130.7 Å²	130.7	81%	0.81	76%	0.756	S	S	*	*			trans	67.6	107.7	163.8	46.8	0	0	0	0	120.4
898	F	26.6	Very low	30.8	Very low	191 Å²	191	131.2 Å²	131.2	84%	0.838	77%	0.765	S	S	*	*			trans	-41.3	162.5	137	-81.8	-113	0	0	0	111.9
899	D	26.8	Very low	30.3	Very low	125 Å²	125	135.3 Å²	135.3	67%	0.668	77%	0.774	S	S	*	*			cis	-167.3	158.9	48.6	-133.9	-18.3	0	0	0	115.4
900	L	28.6	Very low	29.6	Very low	145 Å²	145	135.3 Å²	135.3	76%	0.759	77%	0.773	S	S	*	*			trans	55.2	121.5	150.8	-72.7	157.1	0	0	0	124.8
901	A	27.5	Very low	28.9	Very low	101 Å²	101	136.8 Å²	136.8	84%	0.835	78%	0.779	S	S	*	*			trans	36.4	143.6	131.9	0	0	0	0	0	122.2
902	G	25.1	Very low	28.6	Very low	68 Å²	68	137 Å²	137	70%	0.701	78%	0.781	S	S	*	*			cis	165.5	-161.4	5.2	0	0	0	0	0	111.1
903	V	27.4	Very low	28.1	Very low	139 Å²	139	137.2 Å²	137.2	84%	0.842	78%	0.782	S	S	*	*			trans	85.8	102.2	170	-168.5	0	0	0	0	118.9
904	E	27.6	Very low	27.6	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	78%	0.781	S	S	*	*			trans	36.6	158	134	-73.2	-167.4	141.6	0	0	126.3
905	P	45	Very low	27.4	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	77%	0.77	S	S	*	*			trans	-113.4	164.7	-164.3	42.3	-31.9	0	0	0	115.8
906	A	24.6	Very low	27.4	Very low	102 Å²	102	138.4 Å²	138.4	84%	0.843	77%	0.772	S	S	*	*			trans	-159.2	145.5	157.1	0	0	0	0	0	114.1
907	Q	22.9	Very low	27.2	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.864	76%	0.764	S	S	*	*			trans	-93.3	-166.4	161.5	-67.8	-174.4	-30.6	0	0	109.5
908	P	46.2	Very low	27.1	Very low	110 Å²	110	133.1 Å²	133.1	71%	0.714	76%	0.764	S	S	*	*				-123.8	-144	-62.8	36.3	-18.4	0	0	0	110.5
909	E	23.3	Very low	27.1	Very low	151 Å²	151	130.6 Å²	130.6	71%	0.706	76%	0.759	S	S	*	*			trans	79	154.3	172.9	-58.1	-143.7	124.4	0	0	116.9
910	K	22.6	Very low	27.1	Very low	161 Å²	161	133.2 Å²	133.2	70%	0.7	76%	0.764	S	S	*	*			cis	-171.3	150.9	-38	-114.9	-179.8	-165.9	146.8	0	107.6
911	M	20.6	Very low	27	Very low	166 Å²	166	131.7 Å²	131.7	82%	0.818	76%	0.761	S	S	*	*			trans	44.3	126.5	151.5	-74.8	170.7	61.2	0	0	122.3
912	A	22.8	Very low	26.9	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	76%	0.756	S	S	*	*			trans	65.8	154.4	139	0	0	0	0	0	117.8
913	T	23	Very low	26.8	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	76%	0.758	S	S	*	*			cis	-164.7	172.4	-11.6	20.3	0	0	0	0	105.5
914	N	25	Very low	26.7	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	75%	0.75	S	S	*	*			cis	-155.4	-159.8	16	-149.5	47.9	0	0	0	109.6
915	D	24.3	Very low	26.5	Very low	116 Å²	116	132.7 Å²	132.7	62%	0.62	74%	0.744	S	S	*	*			trans	69.4	132.4	153	-75.5	22.6	0	0	0	118.2
916	Q	25.6	Very low	25.4	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	74%	0.739	S	S	*	*			cis	-158.2	162.4	8.2	-100.4	159.4	30.5	0	0	107
917	A	26.4	Very low	25.5	Very low	84 Å²	84	133.6 Å²	133.6	69%	0.694	74%	0.735	S	S	*	*			cis	-168.3	-178.4	-5.5	0	0	0	0	0	110.8
918	V	28.3	Very low	25.5	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	73%	0.733	S	S	*	*			trans	83.5	79.1	158.6	-160.3	0	0	0	0	120.2
919	N	25.8	Very low	24.3	Very low	137 Å²	137	132.3 Å²	132.3	73%	0.733	73%	0.73	S	S	*	*				40.9	125.9	118.2	-82.7	-25.3	0	0	0	124.1
920	K	26.9	Very low	24.3	Very low	180 Å²	180	131.4 Å²	131.4	78%	0.783	74%	0.735	S	S	*	*				69.9	145.9	127.7	-76.7	-173.1	173.8	-177.2	0	121.4
921	T	25.2	Very low	24.3	Very low	113 Å²	113	129.4 Å²	129.4	69%	0.693	74%	0.741	S	S	*	*			cis	-170.4	154.8	-25.3	13.6	0	0	0	0	109.6
922	L	25.8	Very low	24.6	Very low	140 Å²	140	130.1 Å²	130.1	73%	0.733	74%	0.743	S	S	*	*			trans	76.3	123.2	151	-106.1	73.9	0	0	0	123.5
923	E	24.5	Very low	24.8	Very low	157 Å²	157	132.2 Å²	132.2	73%	0.734	75%	0.749	S	S	*	*				67.9	98.2	129.2	-81.6	171.1	-162.9	0	0	124.9
924	S	23.4	Very low	24.8	Very low	96 Å²	96	131.6 Å²	131.6	67%	0.671	75%	0.75	S	S	*	*				79.9	154.4	111.4	87.4	0	0	0	0	123.7
925	T	24.1	Very low	25	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	76%	0.757	S	S	*	*			trans	77.8	87.8	162.3	57.2	0	0	0	0	121.9
926	S	22.8	Very low	24.9	Very low	97 Å²	97	136 Å²	136	68%	0.678	77%	0.77	S	S	*	*				61	141.8	114.1	84.4	0	0	0	0	124.6
927	L	25.3	Very low	25.1	Very low	146 Å²	146	133 Å²	133	76%	0.764	76%	0.763	S	S	*	*			trans	91.3	119.1	141.8	-76.6	162.2	0	0	0	122.1
928	K	23.2	Very low	25	Very low	188 Å²	188	136.1 Å²	136.1	82%	0.817	77%	0.773	S	S	*	*			trans	81.5	109.4	135	-87	177.2	174.7	177.3	0	122.1
929	A	22.3	Very low	25	Very low	79 Å²	79	135.6 Å²	135.6	65%	0.653	77%	0.771	S	S	*	*				104.2	129.5	102.7	0	0	0	0	0	120.8
930	T	22	Very low	25	Very low	132 Å²	132	140.8 Å²	140.8	81%	0.81	78%	0.78	S	S	*	*			trans	49.5	121.7	144	49.4	0	0	0	0	120.4
931	S	22.9	Very low	25	Very low	120 Å²	120	141 Å²	141	84%	0.839	78%	0.783	S	S	*	*				-178	154.3	93.1	36.8	0	0	0	0	112.3
932	Q	26	Very low	25.2	Very low	181 Å²	181	144.8 Å²	144.8	85%	0.846	79%	0.793	S	S	*	*			trans	-75.4	169.5	169.2	-61.7	162.9	-76.7	0	0	110.1
933	P	28.3	Very low	25.6	Very low	129 Å²	129	144.8 Å²	144.8	84%	0.838	79%	0.794	S	S	*	*				-139.8	-175.3	97	33.8	-17.1	0	0	0	115
934	S	22.5	Very low	25.9	Very low	115 Å²	115	141.8 Å²	141.8	80%	0.804	79%	0.79	S	S	*	*			trans	-89.8	174	-159.2	51.6	0	0	0	0	116.6
935	M	29.7	Very low	26.9	Very low	173 Å²	173	144.7 Å²	144.7	85%	0.852	80%	0.798	S	S	*	*			trans	-45.9	153.8	172.2	-49.1	174.4	-171.6	0	0	114.6
936	D	22.8	Very low	27.8	Very low	166 Å²	166	142.3 Å²	142.3	89%	0.888	79%	0.786	S	S	*	*				-151.9	152.9	111.9	-135.3	-23	0	0	0	112.6
937	V	28.7	Very low	29	Very low	108 Å²	108	141.1 Å²	141.1	66%	0.655	78%	0.782	S	S	*	*			trans	-111.8	128.2	-173	173	0	0	0	0	110.8
938	T	24.4	Very low	30.6	Very low	148 Å²	148	139.6 Å²	139.6	91%	0.908	77%	0.771	S	S	*	*			trans	-138.9	122.8	153.2	36.3	0	0	0	0	111.8
939	T	27.8	Very low	32.2	Very low	121 Å²	121	139.8 Å²	139.8	74%	0.742	77%	0.772	S	S	*	*			trans	-81.3	144.2	177.9	44.7	0	0	0	0	111.7
940	R	25.7	Very low	34.3	Very low	246 Å²	246	136.6 Å²	136.6	93%	0.928	75%	0.745	S	S	*	*			trans	-128.1	122.6	154	-82.6	-171	175.7	178.8	0.6	109.2
941	H	28.6	Very low	36.3	Very low	184 Å²	184	133.5 Å²	133.5	85%	0.852	73%	0.727	S	S	*	*			trans	-63.8	131.8	173.9	-76.3	-72.1	0	0	0	111.1
942	H	29.1	Very low	37.9	Very low	193 Å²	193	133.5 Å²	133.5	89%	0.894	73%	0.727	S	S	*	*			trans	-105.9	145.8	142.4	-101.5	-78.7	0	0	0	108.8
943	N	32.9	Very low	39.4	Very low	140 Å²	140	129.4 Å²	129.4	75%	0.749	72%	0.719	S	S	*	*			trans	-117.6	114.6	-168.5	-172	16.3	0	0	0	108.9
944	S	31.8	Very low	40.7	Very low	95 Å²	95	127 Å²	127	66%	0.664	70%	0.696	S	S	*	*			trans	-144.5	99	170.6	47.8	0	0	0	0	110.5	S946	S944-S946 PolarHBondContact O-N 3.31Å
945	N	44.2	Very low	42.4	Very low	156 Å²	156	126.7 Å²	126.7	83%	0.834	69%	0.685	S	S	*	*			trans	-64.6	114.1	173.4	-76.6	-35.1	0	0	0	111.2
946	S	43.6	Very low	44	Very low	71 Å²	71	122.5 Å²	122.5	50%	0.497	68%	0.678	S	S	.	*			trans	-149.9	54	151.7	56.5	0	0	0	0	111.1	S944 E948	S944-S946 PolarHBondContact O-N 3.31Å; S946-E948 PolarHBondContact O-N 2.81Å; S946-E948 VanDerWaalsContact O-N 3.14Å
947	A	48.2	Very low	46.5	Very low	72 Å²	72	117.9 Å²	117.9	60%	0.595	65%	0.649	S	S	*	*			trans	-70.7	102	169.4	0	0	0	0	0	109.4	V965	A947-V965 HydrophobicContact CB-CG1 3.72Å
948	E	58	Low	48.5	Very low	114 Å²	114	113.3 Å²	113.3	53%	0.533	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85	147.2	176.6	-67.6	-170.8	151.1	0	0	110.9	S946 Y966	S946-E948 PolarHBondContact O-N 2.81Å; S946-E948 VanDerWaalsContact O-N 3.14Å; E948-Y966 PolarHBondContact O-N 2.8Å
949	K	57.1	Low	50.9	Low	193 Å²	193	109.6 Å²	109.6	84%	0.839	60%	0.595	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.7	139.6	170.4	-85	-168.8	170	-167.9	0	109.8
950	C	65.9	Low	53.2	Low	11 Å²	11	110.1 Å²	110.1	7%	0.074	59%	0.585	C	S	.	*	P	Polyproline II helix	trans	-58.4	144.6	176.9	-60.1	0	0	0	0	111.8	C964 V965 Y973	C950-C964 HydrophobicContact CB-CB 3.83Å; C950-C964 WeakPolarHBondContact CB-SG 3.06Å; C950-C964 WeakPolarHBondContact SG-CB 3.42Å; C950-C964 CovalentContact SG-SG 2.04Å; C950-C964 PolarHBondContact SG-SG 2.03Å; C950-V965 PolarHBondContact SG-N 3.01Å; C950-Y973 HydrophobicContact CB-CD1 4.48Å
951	P	63.8	Low	55.3	Low	68 Å²	68	106.8 Å²	106.8	44%	0.442	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-58.8	151.3	172.3	-23.2	34	0	0	0	111.8	S953 H954 D955	P951-S953 PolarHBondContact O-N 2.88Å; P951-H954 PolarHBondContact O-N 3.31Å; P951-D955 PolarHBondContact O-N 3.03Å
952	S	55.8	Low	57.6	Low	120 Å²	120	98.5 Å²	98.5	84%	0.839	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.2	-173.9	52.3	0	0	0	0	115.5	H954	S952-H954 VanDerWaalsContact C-N 3.33Å
953	S	57.8	Low	60	Low	95 Å²	95	93.7 Å²	93.7	66%	0.664	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.8	171.4	52.6	0	0	0	0	114.1	P951	P951-S953 PolarHBondContact O-N 2.88Å
954	H	56.9	Low	62.3	Low	78 Å²	78	87.4 Å²	87.4	36%	0.361	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	5.5	-174.9	-69.5	67.9	0	0	0	113	P951 S952 A956 Y957 Y973	P951-H954 PolarHBondContact O-N 3.31Å; S952-H954 VanDerWaalsContact C-N 3.33Å; H954-A956 PolarHBondContact O-N 3.06Å; H954-A956 VanDerWaalsContact O-N 3.14Å; H954-Y957 WeakPolarHBondContact O-CB 3.36Å; H954-Y957 PolarHBondContact O-N 3.35Å; H954-Y973 HydrophobicContact CB-CE1 4.39Å; H954-Y973 AromaticContact CD2-CE2 3.95Å; H954-Y973 AromaticContact CD2-CZ 3.86Å
955	D	57	Low	64.5	Low	109 Å²	109	84.3 Å²	84.3	58%	0.583	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.6	179.1	-144.5	24.5	0	0	0	112.2	P951 Y957	P951-D955 PolarHBondContact O-N 3.03Å; D955-Y957 VanDerWaalsContact C-N 3.35Å
956	A	63.4	Low	66.2	Low	84 Å²	84	79.3 Å²	79.3	69%	0.694	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	7.4	172.1	0	0	0	0	0	114.6	H954 C958	H954-A956 PolarHBondContact O-N 3.06Å; H954-A956 VanDerWaalsContact O-N 3.14Å; A956-C958 VanDerWaalsContact C-N 3.28Å; A956-C958 PolarHBondContact O-N 3.4Å
957	Y	75.1	Confident	67.5	Low	70 Å²	70	80 Å²	80	28%	0.275	44%	0.436	S	S	.	.	S	Bend	trans	-64	-34.3	178.2	-179.8	-103.7	0	0	0	111.9	H954 D955 R985	H954-Y957 WeakPolarHBondContact O-CB 3.36Å; H954-Y957 PolarHBondContact O-N 3.35Å; D955-Y957 VanDerWaalsContact C-N 3.35Å; Y957-R985 HydrophobicContact CE1-CG 4.06Å; Y957-R985 PolarHBondContact O-NE 3.36Å; Y957-R985 PolarHBondContact O-NH2 3.21Å
958	C	71.7	Confident	68	Low	11 Å²	11	79 Å²	79	7%	0.074	42%	0.423	C	S	.	.	S	Bend	trans	-93.6	130.1	178.4	-57.5	0	0	0	0	111.5	A956 G962 C964 C975	A956-C958 VanDerWaalsContact C-N 3.28Å; A956-C958 PolarHBondContact O-N 3.4Å; C958-G962 WeakPolarHBondContact CB-O 3.44Å; C958-C964 WeakPolarHBondContact SG-CA 3.39Å; C958-C975 WeakPolarHBondContact CA-SG 3.06Å; C958-C975 HydrophobicContact CB-CB 3.74Å; C958-C975 WeakPolarHBondContact CB-SG 3.43Å; C958-C975 WeakPolarHBondContact SG-CA 3.16Å; C958-C975 WeakPolarHBondContact SG-CB 3.01Å; C958-C975 CovalentContact SG-SG 2.03Å; C958-C975 PolarHBondContact SG-SG 2.97Å
959	L	73.7	Confident	67.9	Low	71 Å²	71	81.3 Å²	81.3	37%	0.372	43%	0.434	S	S	.	.	S	Bend	trans	-85.4	164.7	-179.7	-59.4	174.3	0	0	0	110.8	H961 G962 R985 Q987	L959-H961 VanDerWaalsContact C-N 3.27Å; L959-H961 PolarHBondContact O-N 2.04Å; L959-H961 VanDerWaalsContact O-N 3.13Å; L959-G962 PolarHBondContact O-N 3.48Å; L959-R985 WeakPolarHBondContact CB-O 3.34Å; L959-R985 PolarHBondContact N-O 3.35Å; L959-Q987 HydrophobicContact CD1-CB 3.9Å
960	Y	77.6	Confident	68	Low	132 Å²	132	78 Å²	78	52%	0.518	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	43.1	175.4	-55.3	-75.2	0	0	0	115	G962 Y981 C986	Y960-G962 PolarHBondContact O-N 2.9Å; Y960-Y981 AromaticContact CD1-CE1 3.98Å; Y960-Y981 HydrophobicContact CD1-CE1 3.98Å; Y960-Y981 AromaticContact CD2-CD1 3.93Å; Y960-Y981 HydrophobicContact CD2-CD1 3.93Å; Y960-Y981 AromaticContact CD2-CE1 3.96Å; Y960-Y981 HydrophobicContact CD2-CE1 3.96Å; Y960-Y981 HydrophobicContact CE1-CE1 4.38Å; Y960-Y981 HydrophobicContact CE2-CE1 4.34Å; Y960-Y981 HydrophobicContact CG-CD1 4.01Å; Y960-Y981 AromaticContact CG-CE1 3.75Å; Y960-Y981 HydrophobicContact CG-CE1 3.75Å; Y960-C986 WeakPolarHBondContact CD2-O 3.37Å
961	H	69.9	Low	68	Low	175 Å²	175	85.8 Å²	85.8	81%	0.81	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	21	-178.9	-54.4	-78.2	0	0	0	115.7	L959 V978	L959-H961 VanDerWaalsContact C-N 3.27Å; L959-H961 PolarHBondContact O-N 2.04Å; L959-H961 VanDerWaalsContact O-N 3.13Å; H961-V978 HydrophobicContact CB-CG2 4.36Å; H961-V978 WeakPolarHBondContact O-CG2 2.98Å
962	G	75.6	Confident	68.1	Low	10 Å²	10	85.1 Å²	85.1	10%	0.103	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-58.7	144.4	166.2	0	0	0	0	0	111.7	C958 L959 Y960 N976	C958-G962 WeakPolarHBondContact CB-O 3.44Å; L959-G962 PolarHBondContact O-N 3.48Å; Y960-G962 PolarHBondContact O-N 2.9Å; G962-N976 WeakPolarHBondContact CA-O 3.47Å
963	V	80.3	Confident	69	Low	93 Å²	93	82.2 Å²	82.2	56%	0.564	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	118.7	-176.8	-179.2	0	0	0	0	110	N976	V963-N976 HydrophobicContact CB-CB 4.47Å; V963-N976 PolarHBondContact N-O 3.29Å; V963-N976 PolarHBondContact O-N 3.17Å
964	C	80.2	Confident	69.9	Low	8 Å²	8	79.7 Å²	79.7	5%	0.054	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129.8	176.5	-171	0	0	0	0	111.6	C950 C958	C950-C964 HydrophobicContact CB-CB 3.83Å; C950-C964 WeakPolarHBondContact CB-SG 3.06Å; C950-C964 WeakPolarHBondContact SG-CB 3.42Å; C950-C964 CovalentContact SG-SG 2.04Å; C950-C964 PolarHBondContact SG-SG 2.03Å; C958-C964 WeakPolarHBondContact SG-CA 3.39Å
965	V	78.8	Confident	71.1	Confident	30 Å²	30	77 Å²	77	18%	0.182	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.7	174.2	-176.3	0	0	0	0	108.9	A947 C950 F967 Y973 A974	A947-V965 HydrophobicContact CB-CG1 3.72Å; C950-V965 PolarHBondContact SG-N 3.01Å; V965-F967 HydrophobicContact CB-CE2 4.04Å; V965-F967 HydrophobicContact CG1-CD2 4.31Å; V965-F967 HydrophobicContact CG1-CE2 3.65Å; V965-F967 HydrophobicContact CG1-CZ 3.79Å; V965-Y973 WeakPolarHBondContact O-CA 3.37Å; V965-A974 PolarHBondContact N-O 2.93Å; V965-A974 PolarHBondContact O-N 2.92Å
966	Y	78.9	Confident	72.2	Confident	51 Å²	51	77.4 Å²	77.4	20%	0.2	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	137.1	174.6	-179.8	-120	0	0	0	110.7	E948 P968 S972 Y973	E948-Y966 PolarHBondContact O-N 2.8Å; Y966-P968 HydrophobicContact CD1-CG 3.93Å; Y966-P968 HydrophobicContact CE1-CB 4Å; Y966-P968 HydrophobicContact CE1-CG 3.86Å; Y966-S972 WeakPolarHBondContact CD2-O 3.47Å; Y966-Y973 AromaticContact CD2-CD1 3.5Å; Y966-Y973 HydrophobicContact CD2-CD1 3.5Å; Y966-Y973 AromaticContact CD2-CE1 3.32Å; Y966-Y973 HydrophobicContact CD2-CE1 3.32Å; Y966-Y973 HydrophobicContact CD2-CG 4.22Å; Y966-Y973 AromaticContact CD2-CZ 3.93Å; Y966-Y973 HydrophobicContact CE2-CD1 4.39Å; Y966-Y973 AromaticContact CE2-CE1 3.93Å; Y966-Y973 HydrophobicContact CE2-CE1 3.93Å; Y966-Y973 HydrophobicContact CG-CD1 4.17Å; Y966-Y973 AromaticContact CG-CE1 4Å; Y966-Y973 HydrophobicContact CG-CE1 4Å
967	F	72.1	Confident	73	Confident	85 Å²	85	75.4 Å²	75.4	37%	0.373	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	98.5	175.5	-69.4	-86.9	0	0	0	109.3	V965 E969 I970 K971 S972 A974	V965-F967 HydrophobicContact CB-CE2 4.04Å; V965-F967 HydrophobicContact CG1-CD2 4.31Å; V965-F967 HydrophobicContact CG1-CE2 3.65Å; V965-F967 HydrophobicContact CG1-CZ 3.79Å; F967-E969 PolarHBondContact O-N 3.46Å; F967-I970 HydrophobicContact CB-CD1 4.2Å; F967-I970 HydrophobicContact CB-CG1 3.78Å; F967-I970 PolarHBondContact O-N 3.09Å; F967-K971 PolarHBondContact O-N 3.19Å; F967-S972 PolarHBondContact N-O 2.78Å; F967-S972 PolarHBondContact O-N 2.96Å; F967-A974 HydrophobicContact CD2-CB 4.34Å; F967-A974 HydrophobicContact CE2-CB 3.87Å
968	P	58.5	Low	73	Confident	50 Å²	50	75.6 Å²	75.6	33%	0.325	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-59.6	-33.5	-173.7	-24.8	33.6	0	0	0	113.9	Y966 I970 K971	Y966-P968 HydrophobicContact CD1-CG 3.93Å; Y966-P968 HydrophobicContact CE1-CB 4Å; Y966-P968 HydrophobicContact CE1-CG 3.86Å; P968-I970 VanDerWaalsContact C-N 3.33Å; P968-I970 PolarHBondContact O-N 2.94Å; P968-K971 PolarHBondContact O-N 3.14Å
969	E	56.5	Low	72.9	Confident	163 Å²	163	87 Å²	87	76%	0.762	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-65.9	-32.3	-174.4	-61.3	175.1	168.2	0	0	113.3	F967	F967-E969 PolarHBondContact O-N 3.46Å
970	I	59.3	Low	72.5	Confident	125 Å²	125	85.1 Å²	85.1	64%	0.641	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-112.5	4.9	177.7	57.7	168.2	0	0	0	112.9	F967 P968 S972	F967-I970 HydrophobicContact CB-CD1 4.2Å; F967-I970 HydrophobicContact CB-CG1 3.78Å; F967-I970 PolarHBondContact O-N 3.09Å; P968-I970 VanDerWaalsContact C-N 3.33Å; P968-I970 PolarHBondContact O-N 2.94Å; I970-S972 PolarHBondContact O-N 2.89Å
971	K	64.1	Low	72.3	Confident	174 Å²	174	83.2 Å²	83.2	76%	0.757	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	36.2	-175.4	-58.8	-177.6	179.5	179	0	113.9	F967 P968	F967-K971 PolarHBondContact O-N 3.19Å; P968-K971 PolarHBondContact O-N 3.14Å
972	S	66.4	Low	72.5	Confident	54 Å²	54	78.4 Å²	78.4	38%	0.378	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155.6	-173.5	-167.3	0	0	0	0	112.1	Y966 F967 I970	Y966-S972 WeakPolarHBondContact CD2-O 3.47Å; F967-S972 PolarHBondContact N-O 2.78Å; F967-S972 PolarHBondContact O-N 2.96Å; I970-S972 PolarHBondContact O-N 2.89Å
973	Y	75.8	Confident	72.1	Confident	58 Å²	58	79.4 Å²	79.4	23%	0.227	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.3	177.8	-52	-84.7	0	0	0	108.9	C950 H954 V965 Y966	C950-Y973 HydrophobicContact CB-CD1 4.48Å; H954-Y973 HydrophobicContact CB-CE1 4.39Å; H954-Y973 AromaticContact CD2-CE2 3.95Å; H954-Y973 AromaticContact CD2-CZ 3.86Å; V965-Y973 WeakPolarHBondContact O-CA 3.37Å; Y966-Y973 AromaticContact CD2-CD1 3.5Å; Y966-Y973 HydrophobicContact CD2-CD1 3.5Å; Y966-Y973 AromaticContact CD2-CE1 3.32Å; Y966-Y973 HydrophobicContact CD2-CE1 3.32Å; Y966-Y973 HydrophobicContact CD2-CG 4.22Å; Y966-Y973 AromaticContact CD2-CZ 3.93Å; Y966-Y973 HydrophobicContact CE2-CD1 4.39Å; Y966-Y973 AromaticContact CE2-CE1 3.93Å; Y966-Y973 HydrophobicContact CE2-CE1 3.93Å; Y966-Y973 HydrophobicContact CG-CD1 4.17Å; Y966-Y973 AromaticContact CG-CE1 4Å; Y966-Y973 HydrophobicContact CG-CE1 4Å
974	A	77.1	Confident	71.9	Confident	43 Å²	43	82.9 Å²	82.9	36%	0.355	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151	171.8	0	0	0	0	0	110.7	V965 F967	V965-A974 PolarHBondContact N-O 2.93Å; V965-A974 PolarHBondContact O-N 2.92Å; F967-A974 HydrophobicContact CD2-CB 4.34Å; F967-A974 HydrophobicContact CE2-CB 3.87Å
975	C	82.2	Confident	72	Confident	20 Å²	20	87 Å²	87	14%	0.135	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124.1	179.1	-63.2	0	0	0	0	110.9	C958 E984	C958-C975 WeakPolarHBondContact CA-SG 3.06Å; C958-C975 HydrophobicContact CB-CB 3.74Å; C958-C975 WeakPolarHBondContact CB-SG 3.43Å; C958-C975 WeakPolarHBondContact SG-CA 3.16Å; C958-C975 WeakPolarHBondContact SG-CB 3.01Å; C958-C975 CovalentContact SG-SG 2.03Å; C958-C975 PolarHBondContact SG-SG 2.97Å; C975-E984 WeakPolarHBondContact CB-O 3.46Å
976	N	79.5	Confident	72	Confident	119 Å²	119	85.6 Å²	85.6	64%	0.636	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.2	170.5	-163.9	6.7	0	0	0	109.1	G962 V963	G962-N976 WeakPolarHBondContact CA-O 3.47Å; V963-N976 HydrophobicContact CB-CB 4.47Å; V963-N976 PolarHBondContact N-O 3.29Å; V963-N976 PolarHBondContact O-N 3.17Å
977	C	80.1	Confident	71.7	Confident	41 Å²	41	86.1 Å²	86.1	28%	0.277	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-80.6	146.1	-167.4	-55.7	0	0	0	0	113.8	Y981 C986	C977-Y981 WeakPolarHBondContact CB-O 3Å; C977-C986 WeakPolarHBondContact CA-SG 3.33Å; C977-C986 HydrophobicContact CB-CB 3.74Å; C977-C986 WeakPolarHBondContact CB-SG 3.43Å; C977-C986 WeakPolarHBondContact SG-CA 3.38Å; C977-C986 WeakPolarHBondContact SG-CB 3.22Å; C977-C986 CovalentContact SG-SG 2.04Å; C977-C986 PolarHBondContact SG-SG 3.46Å
978	V	75.2	Confident	71.5	Confident	74 Å²	74	85.9 Å²	85.9	45%	0.448	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-76.5	146.1	172.8	-146.7	0	0	0	0	109	H961 G980 Y981	H961-V978 HydrophobicContact CB-CG2 4.36Å; H961-V978 WeakPolarHBondContact O-CG2 2.98Å; V978-G980 PolarHBondContact O-N 3.13Å; V978-Y981 PolarHBondContact O-N 2.04Å
979	R	68.1	Low	72.1	Confident	252 Å²	252	85.3 Å²	85.3	95%	0.951	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	132.9	-179.4	-86.4	-176.9	167.9	174.3	-3.7	112.1
980	G	67.1	Low	72.3	Confident	30 Å²	30	81.4 Å²	81.4	31%	0.309	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.4	-10.8	-176.7	0	0	0	0	0	114.1	V978 S989 D990	V978-G980 PolarHBondContact O-N 3.13Å; G980-S989 WeakPolarHBondContact O-CA 3.34Å; G980-D990 WeakPolarHBondContact CA-OD2 3.01Å; G980-D990 PolarHBondContact N-OD2 2.92Å; G980-D990 PolarHBondContact O-N 3.24Å
981	Y	72.3	Confident	72.4	Confident	92 Å²	92	81.6 Å²	81.6	36%	0.361	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.8	-178.6	-64.6	-90.3	0	0	0	112.3	Y960 C977 V978 F988	Y960-Y981 AromaticContact CD1-CE1 3.98Å; Y960-Y981 HydrophobicContact CD1-CE1 3.98Å; Y960-Y981 AromaticContact CD2-CD1 3.93Å; Y960-Y981 HydrophobicContact CD2-CD1 3.93Å; Y960-Y981 AromaticContact CD2-CE1 3.96Å; Y960-Y981 HydrophobicContact CD2-CE1 3.96Å; Y960-Y981 HydrophobicContact CE1-CE1 4.38Å; Y960-Y981 HydrophobicContact CE2-CE1 4.34Å; Y960-Y981 HydrophobicContact CG-CD1 4.01Å; Y960-Y981 AromaticContact CG-CE1 3.75Å; Y960-Y981 HydrophobicContact CG-CE1 3.75Å; C977-Y981 WeakPolarHBondContact CB-O 3Å; V978-Y981 PolarHBondContact O-N 2.04Å; Y981-F988 CarbonylContact C-O 3.48Å; Y981-F988 WeakPolarHBondContact CA-O 3.25Å
982	I	73.6	Confident	72.3	Confident	75 Å²	75	78.2 Å²	78.2	39%	0.385	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	164.8	-175.2	-158.7	164.5	0	0	0	111.5	C986 Q987 F988 W993	I982-C986 CarbonylContact O-C 3.53Å; I982-Q987 PolarHBondContact O-N 3.28Å; I982-F988 HydrophobicContact CG2-CB 4.33Å; I982-F988 PolarHBondContact N-O 3.38Å; I982-F988 PolarHBondContact O-N 2.8Å; I982-F988 VanDerWaalsContact O-N 3.09Å; I982-W993 HydrophobicContact CG2-CB 4.18Å; I982-W993 HydrophobicContact CG2-CG 4.23Å
983	G	68.9	Low	72.1	Confident	30 Å²	30	81.4 Å²	81.4	31%	0.309	40%	0.404	S	S	.	.	S	Bend	trans	105.2	161.8	-175.5	0	0	0	0	0	112.9	R985 C986	G983-R985 PolarHBondContact O-N 2.87Å; G983-R985 VanDerWaalsContact O-N 3.09Å; G983-C986 PolarHBondContact O-N 3.4Å
984	E	74.6	Confident	71.1	Confident	167 Å²	167	82.9 Å²	82.9	78%	0.78	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.2	-169.7	-60.1	-177.5	153.8	0	0	114.6	C975	C975-E984 WeakPolarHBondContact CB-O 3.46Å
985	R	82.8	Confident	70.5	Confident	94 Å²	94	87.2 Å²	87.2	36%	0.355	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	16.5	174.1	-62.1	-177.7	64.2	-164.1	-4.6	112.8	Y957 L959 G983 Q987	Y957-R985 HydrophobicContact CE1-CG 4.06Å; Y957-R985 PolarHBondContact O-NE 3.36Å; Y957-R985 PolarHBondContact O-NH2 3.21Å; L959-R985 WeakPolarHBondContact CB-O 3.34Å; L959-R985 PolarHBondContact N-O 3.35Å; G983-R985 PolarHBondContact O-N 2.87Å; G983-R985 VanDerWaalsContact O-N 3.09Å; R985-Q987 VanDerWaalsContact C-N 3.29Å; R985-Q987 PolarHBondContact O-N 3.09Å
986	C	79.1	Confident	69.4	Low	0 Å²	0	91.4 Å²	91.4	0%	0	45%	0.449	C	S	.	.	S	Bend	trans	62.5	28.7	-175.9	-45	0	0	0	0	114.6	Y960 C977 I982 G983	Y960-C986 WeakPolarHBondContact CD2-O 3.37Å; C977-C986 WeakPolarHBondContact CA-SG 3.33Å; C977-C986 HydrophobicContact CB-CB 3.74Å; C977-C986 WeakPolarHBondContact CB-SG 3.43Å; C977-C986 WeakPolarHBondContact SG-CA 3.38Å; C977-C986 WeakPolarHBondContact SG-CB 3.22Å; C977-C986 CovalentContact SG-SG 2.04Å; C977-C986 PolarHBondContact SG-SG 3.46Å; I982-C986 CarbonylContact O-C 3.53Å; G983-C986 PolarHBondContact O-N 3.4Å
987	Q	72.9	Confident	68.3	Low	62 Å²	62	89.8 Å²	89.8	29%	0.29	44%	0.437	S	S	.	.			trans	-79.5	-18.1	-165.6	68.8	-87.7	23.7	0	0	115.9	L959 I982 R985	L959-Q987 HydrophobicContact CD1-CB 3.9Å; I982-Q987 PolarHBondContact O-N 3.28Å; R985-Q987 VanDerWaalsContact C-N 3.29Å; R985-Q987 PolarHBondContact O-N 3.09Å
988	F	67.7	Low	67.2	Low	81 Å²	81	93.7 Å²	93.7	36%	0.355	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	148	-176.2	-56.6	-62.7	0	0	0	111.3	Y981 I982	Y981-F988 CarbonylContact C-O 3.48Å; Y981-F988 WeakPolarHBondContact CA-O 3.25Å; I982-F988 HydrophobicContact CG2-CB 4.33Å; I982-F988 PolarHBondContact N-O 3.38Å; I982-F988 PolarHBondContact O-N 2.8Å; I982-F988 VanDerWaalsContact O-N 3.09Å
989	S	70.7	Confident	66.4	Low	38 Å²	38	93.2 Å²	93.2	27%	0.266	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	150	167.4	71.1	0	0	0	0	111.5	G980 L991 E992 W993	G980-S989 WeakPolarHBondContact O-CA 3.34Å; S989-L991 PolarHBondContact O-N 3.22Å; S989-L991 VanDerWaalsContact O-N 3.09Å; S989-E992 PolarHBondContact O-N 3.37Å; S989-E992 WeakPolarHBondContact OG-CB 3.2Å; S989-W993 PolarHBondContact O-N 3.2Å
990	D	61.3	Low	66	Low	80 Å²	80	87 Å²	87	43%	0.428	44%	0.437	S	S	.	.	H	α-helix	trans	-58.2	-26.3	-176.8	-69.5	-19.6	0	0	0	113.5	G980	G980-D990 WeakPolarHBondContact CA-OD2 3.01Å; G980-D990 PolarHBondContact N-OD2 2.92Å; G980-D990 PolarHBondContact O-N 3.24Å
991	L	60.6	Low	65.4	Low	129 Å²	129	92.8 Å²	92.8	68%	0.675	45%	0.454	S	S	*	.	H	α-helix	trans	-77.4	-46.2	177.9	-80.3	161.9	0	0	0	112.4	S989 W993 L994 E995	S989-L991 PolarHBondContact O-N 3.22Å; S989-L991 VanDerWaalsContact O-N 3.09Å; L991-W993 VanDerWaalsContact C-N 3.31Å; L991-W993 PolarHBondContact O-N 3.09Å; L991-L994 VanDerWaalsContact O-CB 3.3Å; L991-L994 WeakPolarHBondContact O-CB 3.41Å; L991-L994 PolarHBondContact O-N 3.46Å; L991-E995 PolarHBondContact O-N 3.43Å; L991-E995 VanDerWaalsContact O-N 3.12Å
992	E	63.2	Low	64.8	Low	104 Å²	104	93 Å²	93	49%	0.486	46%	0.458	S	S	.	.	H	α-helix	trans	-65.7	-35.8	-177	-168.2	172.2	-150.9	0	0	111.5	S989 L994 E995 L996	S989-E992 PolarHBondContact O-N 3.37Å; S989-E992 WeakPolarHBondContact OG-CB 3.2Å; E992-L994 VanDerWaalsContact C-N 3.32Å; E992-L994 PolarHBondContact O-N 3.22Å; E992-E995 PolarHBondContact O-N 2.99Å; E992-L996 WeakPolarHBondContact O-CG 3.3Å; E992-L996 PolarHBondContact O-N 3.47Å
993	W	61.1	Low	64	Low	121 Å²	121	97 Å²	97	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-64	-35	171	-171.7	87.3	0	0	0	112.8	I982 S989 L991 Q997	I982-W993 HydrophobicContact CG2-CB 4.18Å; I982-W993 HydrophobicContact CG2-CG 4.23Å; S989-W993 PolarHBondContact O-N 3.2Å; L991-W993 VanDerWaalsContact C-N 3.31Å; L991-W993 PolarHBondContact O-N 3.09Å; W993-Q997 HydrophobicContact CE3-CG 4.5Å; W993-Q997 HydrophobicContact CH2-CG 4.12Å; W993-Q997 HydrophobicContact CZ2-CG 4.25Å; W993-Q997 HydrophobicContact CZ3-CG 4.25Å; W993-Q997 PolarHBondContact O-N 3.03Å
994	L	54.5	Low	63.8	Low	89 Å²	89	102.2 Å²	102.2	47%	0.466	49%	0.489	S	S	.	.	H	α-helix	trans	-71.4	-37	179.2	-158.1	80.8	0	0	0	112.2	L991 E992 Q997 Q998	L991-L994 VanDerWaalsContact O-CB 3.3Å; L991-L994 WeakPolarHBondContact O-CB 3.41Å; L991-L994 PolarHBondContact O-N 3.46Å; E992-L994 VanDerWaalsContact C-N 3.32Å; E992-L994 PolarHBondContact O-N 3.22Å; L994-Q997 PolarHBondContact O-N 3.06Å; L994-Q998 WeakPolarHBondContact O-CG 3.48Å; L994-Q998 PolarHBondContact O-N 3.37Å
995	E	64.6	Low	63.3	Low	134 Å²	134	100.5 Å²	100.5	63%	0.626	48%	0.475	S	S	*	.	H	α-helix	trans	-68.3	-41.4	178.4	-70	-177.5	168.9	0	0	111.9	L991 E992 Q997 Q998 A999	L991-E995 PolarHBondContact O-N 3.43Å; L991-E995 VanDerWaalsContact O-N 3.12Å; E992-E995 PolarHBondContact O-N 2.99Å; E995-Q997 VanDerWaalsContact C-N 3.31Å; E995-Q997 PolarHBondContact O-N 3.26Å; E995-Q998 PolarHBondContact O-N 3.48Å; E995-A999 PolarHBondContact O-N 3.42Å
996	L	58.9	Low	62.3	Low	107 Å²	107	100.2 Å²	100.2	56%	0.56	48%	0.481	S	S	*	.	H	α-helix	trans	-58	-42.1	174.7	-71.2	168.1	0	0	0	112.1	E992 Q998 A999 E1000	E992-L996 WeakPolarHBondContact O-CG 3.3Å; E992-L996 PolarHBondContact O-N 3.47Å; L996-Q998 VanDerWaalsContact C-N 3.31Å; L996-Q998 PolarHBondContact O-N 3.48Å; L996-A999 PolarHBondContact O-N 3.12Å; L996-E1000 PolarHBondContact O-N 3.42Å
997	Q	57.3	Low	61.7	Low	85 Å²	85	106.9 Å²	106.9	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-67.5	-25.5	175.7	-79.6	-72.6	-63	0	0	113.9	W993 L994 E995	W993-Q997 HydrophobicContact CE3-CG 4.5Å; W993-Q997 HydrophobicContact CH2-CG 4.12Å; W993-Q997 HydrophobicContact CZ2-CG 4.25Å; W993-Q997 HydrophobicContact CZ3-CG 4.25Å; W993-Q997 PolarHBondContact O-N 3.03Å; L994-Q997 PolarHBondContact O-N 3.06Å; E995-Q997 VanDerWaalsContact C-N 3.31Å; E995-Q997 PolarHBondContact O-N 3.26Å
998	Q	56.2	Low	61.7	Low	124 Å²	124	108.7 Å²	108.7	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-79.4	-40.4	176	-72.4	-177.2	4.5	0	0	112	L994 E995 L996 E1000 K1001 E1002	L994-Q998 WeakPolarHBondContact O-CG 3.48Å; L994-Q998 PolarHBondContact O-N 3.37Å; E995-Q998 PolarHBondContact O-N 3.48Å; L996-Q998 VanDerWaalsContact C-N 3.31Å; L996-Q998 PolarHBondContact O-N 3.48Å; Q998-E1000 VanDerWaalsContact C-N 3.3Å; Q998-E1000 PolarHBondContact O-N 3.39Å; Q998-K1001 PolarHBondContact O-N 3.07Å; Q998-E1002 PolarHBondContact O-N 3.21Å
999	A	58.7	Low	61.9	Low	63 Å²	63	109.3 Å²	109.3	52%	0.521	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-39.1	177.8	0	0	0	0	0	112.6	E995 L996 E1002 K1003	E995-A999 PolarHBondContact O-N 3.42Å; L996-A999 PolarHBondContact O-N 3.12Å; A999-E1002 PolarHBondContact O-N 3.24Å; A999-K1003 PolarHBondContact O-N 3.31Å
1000	E	59.1	Low	62.2	Low	123 Å²	123	109.2 Å²	109.2	58%	0.575	54%	0.542	S	S	*	.	H	α-helix	trans	-66.2	-40.2	179.7	-163.9	159.4	-139.6	0	0	112.2	L996 Q998 E1002 K1003 E1004	L996-E1000 PolarHBondContact O-N 3.42Å; Q998-E1000 VanDerWaalsContact C-N 3.3Å; Q998-E1000 PolarHBondContact O-N 3.39Å; E1000-E1002 PolarHBondContact O-N 3.27Å; E1000-K1003 WeakPolarHBondContact O-CB 3.39Å; E1000-K1003 PolarHBondContact O-N 3.38Å; E1000-E1004 PolarHBondContact O-N 3.5Å
1001	K	55.2	Low	63.1	Low	150 Å²	150	107.6 Å²	107.6	65%	0.652	54%	0.544	S	S	*	.	H	α-helix	trans	-67	-33.4	174.9	-88	176.1	175.3	165.3	0	114.2	Q998 K1003 R1005	Q998-K1001 PolarHBondContact O-N 3.07Å; K1001-K1003 VanDerWaalsContact C-N 3.34Å; K1001-R1005 PolarHBondContact O-N 3.38Å
1002	E	60	Low	63.7	Low	97 Å²	97	105.5 Å²	105.5	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-70.3	-32.8	174.5	-69	-142.7	119.9	0	0	112.3	Q998 A999 E1000 R1005 N1006	Q998-E1002 PolarHBondContact O-N 3.21Å; A999-E1002 PolarHBondContact O-N 3.24Å; E1000-E1002 PolarHBondContact O-N 3.27Å; E1002-R1005 PolarHBondContact O-N 3.3Å; E1002-R1005 IonicContact OE1-CZ 3.19Å; E1002-R1005 IonicContact OE1-NH1 3.35Å; E1002-R1005 PolarHBondContact OE1-NH1 3.28Å; E1002-R1005 IonicContact OE1-NH2 2.67Å; E1002-R1005 PolarHBondContact OE1-NH2 3.02Å; E1002-N1006 WeakPolarHBondContact O-CB 3.49Å; E1002-N1006 PolarHBondContact O-N 3.21Å; E1002-N1006 PolarHBondContact O-ND2 3.33Å
1003	K	56.8	Low	64.3	Low	158 Å²	158	105.9 Å²	105.9	69%	0.687	54%	0.543	S	S	*	.	H	α-helix	trans	-62.4	-45.1	175.7	-166.4	177	-179.8	-178.4	0	111.9	A999 E1000 K1001 N1006 L1007	A999-K1003 PolarHBondContact O-N 3.31Å; E1000-K1003 WeakPolarHBondContact O-CB 3.39Å; E1000-K1003 PolarHBondContact O-N 3.38Å; K1001-K1003 VanDerWaalsContact C-N 3.34Å; K1003-N1006 PolarHBondContact O-N 3.24Å; K1003-L1007 PolarHBondContact O-N 3.35Å
1004	E	63.6	Low	65.3	Low	140 Å²	140	104.6 Å²	104.6	65%	0.654	55%	0.548	S	S	*	.	H	α-helix	trans	-62	-45.5	174.4	-66.7	-166.2	140.2	0	0	112.2	E1000 N1006 L1007 V1008	E1000-E1004 PolarHBondContact O-N 3.5Å; E1004-N1006 VanDerWaalsContact C-N 3.32Å; E1004-N1006 PolarHBondContact O-N 3.24Å; E1004-L1007 PolarHBondContact O-N 3.37Å; E1004-V1008 PolarHBondContact O-N 3.48Å
1005	R	64.1	Low	66.5	Low	132 Å²	132	102.8 Å²	102.8	50%	0.498	55%	0.546	S	S	.	.	H	α-helix	trans	-58.7	-43.2	179.3	-168.3	-175.4	71.5	-146.2	-5.6	112	K1001 E1002 L1007 V1008 I1009	K1001-R1005 PolarHBondContact O-N 3.38Å; E1002-R1005 PolarHBondContact O-N 3.3Å; E1002-R1005 IonicContact OE1-CZ 3.19Å; E1002-R1005 IonicContact OE1-NH1 3.35Å; E1002-R1005 PolarHBondContact OE1-NH1 3.28Å; E1002-R1005 IonicContact OE1-NH2 2.67Å; E1002-R1005 PolarHBondContact OE1-NH2 3.02Å; R1005-L1007 VanDerWaalsContact C-N 3.35Å; R1005-V1008 PolarHBondContact O-N 3.08Å; R1005-I1009 HydrophobicContact CG-CD1 4.29Å; R1005-I1009 WeakPolarHBondContact O-CG1 3.39Å; R1005-I1009 PolarHBondContact O-N 3.46Å
1006	N	63.7	Low	67.3	Low	88 Å²	88	101.3 Å²	101.3	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-69.8	-32.4	-178.2	-67.6	-16	0	0	0	112.4	E1002 K1003 E1004 I1009 G1010	E1002-N1006 WeakPolarHBondContact O-CB 3.49Å; E1002-N1006 PolarHBondContact O-N 3.21Å; E1002-N1006 PolarHBondContact O-ND2 3.33Å; K1003-N1006 PolarHBondContact O-N 3.24Å; E1004-N1006 VanDerWaalsContact C-N 3.32Å; E1004-N1006 PolarHBondContact O-N 3.24Å; N1006-I1009 PolarHBondContact O-N 3.42Å; N1006-G1010 PolarHBondContact O-N 3.28Å; N1006-G1010 VanDerWaalsContact O-N 3.08Å
1007	L	64.6	Low	68.2	Low	139 Å²	139	100.9 Å²	100.9	73%	0.728	54%	0.539	S	S	*	.	H	α-helix	trans	-67.7	-38.8	178.1	-148.3	124.9	0	0	0	112	K1003 E1004 R1005 G1010 G1011	K1003-L1007 PolarHBondContact O-N 3.35Å; E1004-L1007 PolarHBondContact O-N 3.37Å; R1005-L1007 VanDerWaalsContact C-N 3.35Å; L1007-G1010 PolarHBondContact O-N 3.21Å; L1007-G1011 PolarHBondContact O-N 3.16Å
1008	V	73.4	Confident	69.2	Low	101 Å²	101	99.5 Å²	99.5	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-64.4	-44.1	174.3	176.2	0	0	0	0	111.5	E1004 R1005 G1010 G1011 C1012	E1004-V1008 PolarHBondContact O-N 3.48Å; R1005-V1008 PolarHBondContact O-N 3.08Å; V1008-G1010 VanDerWaalsContact C-N 3.34Å; V1008-G1010 PolarHBondContact O-N 3.48Å; V1008-G1011 PolarHBondContact O-N 3.16Å; V1008-C1012 PolarHBondContact O-N 3.45Å; V1008-C1012 VanDerWaalsContact O-N 3.16Å
1009	I	72.8	Confident	70.5	Confident	93 Å²	93	98.7 Å²	98.7	48%	0.477	54%	0.537	S	S	.	.	H	α-helix	trans	-61.9	-42.2	178.5	-66.5	166.1	0	0	0	111	R1005 N1006 G1011 C1012 M1013	R1005-I1009 HydrophobicContact CG-CD1 4.29Å; R1005-I1009 WeakPolarHBondContact O-CG1 3.39Å; R1005-I1009 PolarHBondContact O-N 3.46Å; N1006-I1009 PolarHBondContact O-N 3.42Å; I1009-G1011 PolarHBondContact O-N 3.36Å; I1009-C1012 PolarHBondContact O-N 3.28Å; I1009-M1013 WeakPolarHBondContact O-CG 3.32Å; I1009-M1013 PolarHBondContact O-N 3.49Å; I1009-M1013 VanDerWaalsContact O-N 3.16Å
1010	G	76.5	Confident	71.5	Confident	37 Å²	37	100.4 Å²	100.4	38%	0.381	54%	0.537	S	S	.	.	H	α-helix	trans	-58.6	-45.5	175.6	0	0	0	0	0	112.9	N1006 L1007 V1008 C1012 M1013 V1014	N1006-G1010 PolarHBondContact O-N 3.28Å; N1006-G1010 VanDerWaalsContact O-N 3.08Å; L1007-G1010 PolarHBondContact O-N 3.21Å; V1008-G1010 VanDerWaalsContact C-N 3.34Å; V1008-G1010 PolarHBondContact O-N 3.48Å; G1010-C1012 PolarHBondContact O-N 3.2Å; G1010-M1013 PolarHBondContact O-N 3.3Å; G1010-V1014 PolarHBondContact O-N 3.48Å
1011	G	79.4	Confident	72.2	Confident	46 Å²	46	97.6 Å²	97.6	47%	0.474	53%	0.531	S	S	.	.	H	α-helix	trans	-60.1	-43.8	177.1	0	0	0	0	0	113.4	L1007 V1008 I1009 M1013 V1014 A1015	L1007-G1011 PolarHBondContact O-N 3.16Å; V1008-G1011 PolarHBondContact O-N 3.16Å; I1009-G1011 PolarHBondContact O-N 3.36Å; G1011-M1013 PolarHBondContact O-N 3.47Å; G1011-V1014 PolarHBondContact O-N 3.03Å; G1011-A1015 PolarHBondContact O-N 3.4Å
1012	C	73.8	Confident	73.5	Confident	84 Å²	84	95.4 Å²	95.4	57%	0.568	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-39.8	177.1	-69	0	0	0	0	112.8	V1008 I1009 G1010 A1015 L1016	V1008-C1012 PolarHBondContact O-N 3.45Å; V1008-C1012 VanDerWaalsContact O-N 3.16Å; I1009-C1012 PolarHBondContact O-N 3.28Å; G1010-C1012 PolarHBondContact O-N 3.2Å; C1012-A1015 PolarHBondContact O-N 3.34Å; C1012-L1016 WeakPolarHBondContact O-CB 3.45Å; C1012-L1016 PolarHBondContact O-N 3.45Å; C1012-L1016 VanDerWaalsContact O-N 3.12Å
1013	M	77	Confident	74.2	Confident	113 Å²	113	94.3 Å²	94.3	56%	0.557	53%	0.525	S	S	*	.	H	α-helix	trans	-65	-41.9	178.6	-72.7	-68.8	-73.1	0	0	112.3	I1009 G1010 G1011 L1016 I1017	I1009-M1013 WeakPolarHBondContact O-CG 3.32Å; I1009-M1013 PolarHBondContact O-N 3.49Å; I1009-M1013 VanDerWaalsContact O-N 3.16Å; G1010-M1013 PolarHBondContact O-N 3.3Å; G1011-M1013 PolarHBondContact O-N 3.47Å; M1013-L1016 PolarHBondContact O-N 3.22Å; M1013-I1017 VanDerWaalsContact O-CG1 3.32Å; M1013-I1017 WeakPolarHBondContact O-CG1 3.44Å; M1013-I1017 PolarHBondContact O-N 3.01Å
1014	V	81.3	Confident	74.9	Confident	93 Å²	93	89.4 Å²	89.4	56%	0.564	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-45.8	177.6	174.4	0	0	0	0	111.1	G1010 G1011 L1016 I1017 S1018	G1010-V1014 PolarHBondContact O-N 3.48Å; G1011-V1014 PolarHBondContact O-N 3.03Å; V1014-L1016 VanDerWaalsContact C-N 3.31Å; V1014-L1016 PolarHBondContact O-N 3.31Å; V1014-I1017 PolarHBondContact O-N 3.05Å; V1014-S1018 PolarHBondContact O-N 3.31Å; V1014-S1018 PolarHBondContact O-OG 3.37Å; V1014-S1018 VanDerWaalsContact O-OG 3.05Å
1015	A	78.9	Confident	75	Confident	52 Å²	52	86.7 Å²	86.7	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-41.5	176.9	0	0	0	0	0	112.3	G1011 C1012 S1018 I1019	G1011-A1015 PolarHBondContact O-N 3.4Å; C1012-A1015 PolarHBondContact O-N 3.34Å; A1015-S1018 PolarHBondContact O-N 2.98Å; A1015-I1019 WeakPolarHBondContact O-CG1 3.37Å; A1015-I1019 PolarHBondContact O-N 3.27Å
1016	L	81	Confident	75.5	Confident	103 Å²	103	84.7 Å²	84.7	54%	0.539	51%	0.508	S	S	.	.	H	α-helix	trans	-68.5	-40	-178.7	-152.7	150.7	0	0	0	111.6	C1012 M1013 V1014 I1019 I1020	C1012-L1016 WeakPolarHBondContact O-CB 3.45Å; C1012-L1016 PolarHBondContact O-N 3.45Å; C1012-L1016 VanDerWaalsContact O-N 3.12Å; M1013-L1016 PolarHBondContact O-N 3.22Å; V1014-L1016 VanDerWaalsContact C-N 3.31Å; V1014-L1016 PolarHBondContact O-N 3.31Å; L1016-I1019 PolarHBondContact O-N 2.96Å; L1016-I1020 HydrophobicContact CD2-CD1 3.63Å; L1016-I1020 HydrophobicContact CD2-CG1 4.36Å; L1016-I1020 WeakPolarHBondContact O-CG1 3.32Å; L1016-I1020 PolarHBondContact O-N 3.38Å
1017	I	79	Confident	75.8	Confident	97 Å²	97	85.5 Å²	85.5	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-39.8	172.7	-67.5	164.7	0	0	0	111.4	M1013 V1014 I1020 S1021	M1013-I1017 VanDerWaalsContact O-CG1 3.32Å; M1013-I1017 WeakPolarHBondContact O-CG1 3.44Å; M1013-I1017 PolarHBondContact O-N 3.01Å; V1014-I1017 PolarHBondContact O-N 3.05Å; I1017-I1020 PolarHBondContact O-N 3.46Å; I1017-S1021 WeakPolarHBondContact O-CB 3.32Å; I1017-S1021 PolarHBondContact O-N 3.43Å; I1017-S1021 PolarHBondContact O-OG 2.9Å
1018	S	77.2	Confident	75.7	Confident	57 Å²	57	88.9 Å²	88.9	40%	0.399	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-43.6	175.6	-58.8	0	0	0	0	112.1	V1014 A1015 S1021 I1022	V1014-S1018 PolarHBondContact O-N 3.31Å; V1014-S1018 PolarHBondContact O-OG 3.37Å; V1014-S1018 VanDerWaalsContact O-OG 3.05Å; A1015-S1018 PolarHBondContact O-N 2.98Å; S1018-S1021 PolarHBondContact O-N 3.39Å; S1018-I1022 VanDerWaalsContact O-CG1 3.29Å; S1018-I1022 WeakPolarHBondContact O-CG1 3.39Å; S1018-I1022 PolarHBondContact O-N 3.06Å
1019	I	83.4	Confident	74.9	Confident	106 Å²	106	89.4 Å²	89.4	54%	0.544	53%	0.527	S	S	.	.	H	α-helix	trans	-63.9	-42.7	177.8	-68.1	163.3	0	0	0	111.4	A1015 L1016 S1021 I1022 T1023	A1015-I1019 WeakPolarHBondContact O-CG1 3.37Å; A1015-I1019 PolarHBondContact O-N 3.27Å; L1016-I1019 PolarHBondContact O-N 2.96Å; I1019-S1021 VanDerWaalsContact C-N 3.33Å; I1019-S1021 PolarHBondContact O-N 3.12Å; I1019-I1022 PolarHBondContact O-N 2.97Å; I1019-T1023 PolarHBondContact O-N 3.26Å; I1019-T1023 PolarHBondContact O-OG1 3.49Å
1020	I	81.5	Confident	73.8	Confident	100 Å²	100	96.1 Å²	96.1	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-41.8	175.1	-69.3	170.9	0	0	0	110.8	L1016 I1017 T1023 A1024	L1016-I1020 HydrophobicContact CD2-CD1 3.63Å; L1016-I1020 HydrophobicContact CD2-CG1 4.36Å; L1016-I1020 WeakPolarHBondContact O-CG1 3.32Å; L1016-I1020 PolarHBondContact O-N 3.38Å; I1017-I1020 PolarHBondContact O-N 3.46Å; I1020-T1023 WeakPolarHBondContact CA-OG1 3.29Å; I1020-T1023 PolarHBondContact O-N 3.33Å; I1020-T1023 PolarHBondContact O-OG1 2.94Å; I1020-T1023 VanDerWaalsContact O-OG1 3.12Å; I1020-A1024 WeakPolarHBondContact O-CB 3.45Å; I1020-A1024 PolarHBondContact O-N 2.95Å
1021	S	73.4	Confident	73.6	Confident	64 Å²	64	99.1 Å²	99.1	45%	0.448	56%	0.562	S	S	.	*	H	α-helix	trans	-65.5	-41.3	178.7	-56.7	0	0	0	0	112	I1017 S1018 I1019 A1024 C1025	I1017-S1021 WeakPolarHBondContact O-CB 3.32Å; I1017-S1021 PolarHBondContact O-N 3.43Å; I1017-S1021 PolarHBondContact O-OG 2.9Å; S1018-S1021 PolarHBondContact O-N 3.39Å; I1019-S1021 VanDerWaalsContact C-N 3.33Å; I1019-S1021 PolarHBondContact O-N 3.12Å; S1021-A1024 PolarHBondContact O-N 3.1Å; S1021-C1025 PolarHBondContact O-N 2.96Å; S1021-C1025 PolarHBondContact O-SG 3.48Å; S1021-C1025 VanDerWaalsContact O-SG 3.38Å
1022	I	81.3	Confident	73.3	Confident	103 Å²	103	101.9 Å²	101.9	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-43.9	176.5	-68.5	163.1	0	0	0	111.1	S1018 I1019 C1025 I1026	S1018-I1022 VanDerWaalsContact O-CG1 3.29Å; S1018-I1022 WeakPolarHBondContact O-CG1 3.39Å; S1018-I1022 PolarHBondContact O-N 3.06Å; I1019-I1022 PolarHBondContact O-N 2.97Å; I1022-C1025 PolarHBondContact O-N 3.4Å; I1022-I1026 HydrophobicContact CG2-CD1 3.85Å; I1022-I1026 WeakPolarHBondContact O-CG1 3.42Å; I1022-I1026 PolarHBondContact O-N 3.23Å
1023	T	74.9	Confident	73.3	Confident	75 Å²	75	102.9 Å²	102.9	46%	0.46	57%	0.567	S	S	.	*	H	α-helix	trans	-65.7	-38.9	176.9	35.4	0	0	0	0	112.1	I1019 I1020 I1026 T1027	I1019-T1023 PolarHBondContact O-N 3.26Å; I1019-T1023 PolarHBondContact O-OG1 3.49Å; I1020-T1023 WeakPolarHBondContact CA-OG1 3.29Å; I1020-T1023 PolarHBondContact O-N 3.33Å; I1020-T1023 PolarHBondContact O-OG1 2.94Å; I1020-T1023 VanDerWaalsContact O-OG1 3.12Å; T1023-I1026 PolarHBondContact O-N 3.21Å; T1023-T1027 PolarHBondContact O-N 3.01Å; T1023-T1027 PolarHBondContact O-OG1 3.46Å
1024	A	71.6	Confident	73.1	Confident	54 Å²	54	102.3 Å²	102.3	45%	0.446	57%	0.567	S	S	.	*	H	α-helix	trans	-60	-44.5	173	0	0	0	0	0	112.3	I1020 S1021 T1027 Y1028	I1020-A1024 WeakPolarHBondContact O-CB 3.45Å; I1020-A1024 PolarHBondContact O-N 2.95Å; S1021-A1024 PolarHBondContact O-N 3.1Å; A1024-T1027 WeakPolarHBondContact CA-OG1 3.32Å; A1024-T1027 PolarHBondContact O-N 3.31Å; A1024-T1027 PolarHBondContact O-OG1 3.15Å; A1024-Y1028 PolarHBondContact O-N 3.5Å; A1024-Y1028 VanDerWaalsContact O-N 3.1Å
1025	C	66.5	Low	72.6	Confident	83 Å²	83	102.9 Å²	102.9	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-61.8	-42.9	174.1	-73.5	0	0	0	0	112.4	S1021 I1022 T1027 Y1028 C1029	S1021-C1025 PolarHBondContact O-N 2.96Å; S1021-C1025 PolarHBondContact O-SG 3.48Å; S1021-C1025 VanDerWaalsContact O-SG 3.38Å; I1022-C1025 PolarHBondContact O-N 3.4Å; C1025-T1027 PolarHBondContact O-N 3.41Å; C1025-Y1028 PolarHBondContact O-N 2.88Å; C1025-Y1028 VanDerWaalsContact O-N 3.15Å; C1025-C1029 PolarHBondContact O-N 3.12Å; C1025-C1029 PolarHBondContact O-SG 2.97Å
1026	I	75	Confident	72.2	Confident	91 Å²	91	106.3 Å²	106.3	47%	0.467	58%	0.577	S	S	.	*	H	α-helix	trans	-63.7	-42.5	178.1	-67.5	165.2	0	0	0	110.9	I1022 T1023 Y1028 C1029 F1030	I1022-I1026 HydrophobicContact CG2-CD1 3.85Å; I1022-I1026 WeakPolarHBondContact O-CG1 3.42Å; I1022-I1026 PolarHBondContact O-N 3.23Å; T1023-I1026 PolarHBondContact O-N 3.21Å; I1026-Y1028 PolarHBondContact O-N 2.67Å; I1026-C1029 PolarHBondContact O-N 2.76Å; I1026-F1030 HydrophobicContact CG2-CD2 4.26Å; I1026-F1030 HydrophobicContact CG2-CE2 4.43Å; I1026-F1030 PolarHBondContact O-N 2.95Å
1027	T	70.3	Confident	71.5	Confident	104 Å²	104	106.5 Å²	106.5	64%	0.638	58%	0.579	S	S	*	*	H	α-helix	trans	-71.5	-10.6	175.4	46.8	0	0	0	0	114.7	T1023 A1024 C1025	T1023-T1027 PolarHBondContact O-N 3.01Å; T1023-T1027 PolarHBondContact O-OG1 3.46Å; A1024-T1027 WeakPolarHBondContact CA-OG1 3.32Å; A1024-T1027 PolarHBondContact O-N 3.31Å; A1024-T1027 PolarHBondContact O-OG1 3.15Å; C1025-T1027 PolarHBondContact O-N 3.41Å
1028	Y	61.9	Low	71	Confident	211 Å²	211	107.2 Å²	107.2	83%	0.827	59%	0.586	S	S	*	*	H	α-helix	trans	-93.9	-12.7	173.1	-162.6	-90.7	0	0	0	112.4	A1024 C1025 I1026	A1024-Y1028 PolarHBondContact O-N 3.5Å; A1024-Y1028 VanDerWaalsContact O-N 3.1Å; C1025-Y1028 PolarHBondContact O-N 2.88Å; C1025-Y1028 VanDerWaalsContact O-N 3.15Å; I1026-Y1028 PolarHBondContact O-N 2.67Å
1029	C	55.3	Low	70.4	Confident	112 Å²	112	111.4 Å²	111.4	76%	0.757	60%	0.601	S	S	*	*			trans	-102.3	-3.5	178.5	-69.6	0	0	0	0	114.2	C1025 I1026	C1025-C1029 PolarHBondContact O-N 3.12Å; C1025-C1029 PolarHBondContact O-SG 2.97Å; I1026-C1029 PolarHBondContact O-N 2.76Å
1030	F	50.3	Low	69.3	Low	234 Å²	234	111.9 Å²	111.9	100%	1.026	61%	0.606	S	S	*	*			trans	-105.1	0	169.7	-92	-81.1	0	0	0	110.5	I1026	I1026-F1030 HydrophobicContact CG2-CD2 4.26Å; I1026-F1030 HydrophobicContact CG2-CE2 4.43Å; I1026-F1030 PolarHBondContact O-N 2.95Å

Retrieved 1,030 of 1,030 residues in 222.1 ms (Link to these results)

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