A0A061HU19_CRIGR Loading...

Zinc finger protein 574

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A061HU19, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Znf574, Length 897 aa.

						>A0A061HU19_CRIGR|A0A061HU19|Znf574
MTEESEETVLYIEHRYVCSECNQLYGSLEEVLVHQNSHVPQQHFELVGVADPGVAVATEAASGTGLYQTLIQESQYQCLECGQLLLSPSQLLEHQELHLKMMAPQEAVPAEPPPKACPLSSSTIHYECVDCKALFASQELWLNHRQMHLRATPTKAPAPVVLGSPVVLGSPVGQARVAVEHSYRKAEEGGEGAAVPSAAAASTEVVAEVELLLYKCSECSQLFQLPADFLEHQATHFPAVPEAAEPALKQETLIPSPTEVPASLPEPLPASDHSYELRNGEAAVGRDRRGRKPRRTNSGESGGTATQELFCSACDQLFLSPHQLQQHFRSHREGVFKCPLCSRVFPSPSSLDQHLGDHSSESHFLCVDCGLAFGTEALLLAHRRAHTPNPLHSCPCGKTFVNLTKFLYHRRTHGAGGVPLPAAPVPPEEPAVSLPEPAPAETREPEAPELPTSEENPAEPAAPGTYRCLLCSREFVKALQLTRHQRFVHRLERRHKCSICGKMFKKKSHVRNHLRTHTGERPFPCPDCSKPFNSPANLARHRLTHTGERPYRCGDCGKAFTQSSTLRQHRLVHAQHFPYRCQECGLRFHRPYRLLMHRYHHTGEYPYKCRECSRSFLLRRLLEVHQLVVHAGRQPHHCPSCGAAFPSSLRLYEHRCAAAATQAPRRFECGTCGKKVGSAARLQAHEAAHAAAGPGEVLAKEPPAPRASRATRTPVTPSPPALGGAPSAAPTAPARRRGLECSECKKLFSTETSLQVHRRIHTGERPYPCPDCGKAFRQSTHLKDHRRLHTGERPFACEVCGKAFAISMRLAEHRRIHTGERPYSCPDCGKSYRSFSNLWKHRKTHQQQHQAAVRQQLAEAEAAVGLAVMETAVEALPLVEAIEIYPLAEAEGVQISG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	35.2	Very low	214 Å²	214	159.7 Å²	159.7	100%	1.054	81%	0.81	S	S	*	*				0	86.8	0	-39	-44.2	-73.8	0	0	105.7
2	T	33.9	Very low	35.2	Very low	92 Å²	92	156.4 Å²	156.4	56%	0.564	79%	0.794	S	S	*	*			cis	107.7	109.9	48	43.7	0	0	0	0	107.9
3	E	40.6	Very low	35.4	Very low	175 Å²	175	154.6 Å²	154.6	82%	0.818	78%	0.781	S	S	*	*			trans	63.4	160.7	156.3	-65.9	115.5	-137.8	0	0	117.2
4	E	37.1	Very low	36.1	Very low	194 Å²	194	152.5 Å²	152.5	91%	0.907	77%	0.766	S	S	*	*			cis	-120.4	169.4	7.5	-69.6	172.4	133.6	0	0	112.8
5	S	40.2	Very low	36.8	Very low	109 Å²	109	153.5 Å²	153.5	76%	0.762	76%	0.757	S	S	*	*			trans	-120.4	116	-176.4	57.2	0	0	0	0	112.5
6	E	37.6	Very low	37.8	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.883	73%	0.731	S	S	*	*			trans	-103.6	83.2	168.7	-68.3	-162.8	145	0	0	111.1	T8	E6-T8 PolarHBondContact O-N 2.93Å
7	E	37.5	Very low	38.5	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	71%	0.713	S	S	*	*			trans	-75.5	102.5	166.3	-71.9	-163.7	139.5	0	0	110.1	V9	E7-V9 PolarHBondContact O-N 3.23Å
8	T	34.3	Very low	39.6	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	67%	0.673	S	S	*	*			trans	-69.8	91.7	171.5	48.8	0	0	0	0	110.7	E6 L10	E6-T8 PolarHBondContact O-N 2.93Å; T8-L10 PolarHBondContact O-N 3.13Å
9	V	33.9	Very low	40.4	Very low	115 Å²	115	134.5 Å²	134.5	70%	0.697	67%	0.673	S	S	*	*			trans	-65.2	99	177.7	-178.6	0	0	0	0	110.7	E7 Y11	E7-V9 PolarHBondContact O-N 3.23Å; V9-Y11 HydrophobicContact CG1-CD2 4.47Å; V9-Y11 PolarHBondContact O-N 2.98Å; V9-Y11 VanDerWaalsContact O-N 3.13Å
10	L	31.5	Very low	41	Very low	150 Å²	150	134.6 Å²	134.6	79%	0.785	67%	0.672	S	S	*	*			trans	-70.4	103.6	170.2	-76.9	169.7	0	0	0	110	T8 I12	T8-L10 PolarHBondContact O-N 3.13Å; L10-I12 PolarHBondContact O-N 3.03Å
11	Y	30.8	Very low	42.3	Very low	221 Å²	221	130.9 Å²	130.9	87%	0.867	66%	0.658	S	S	*	*			trans	-69.7	97.4	175.1	-125.3	-91.9	0	0	0	110.6	V9	V9-Y11 HydrophobicContact CG1-CD2 4.47Å; V9-Y11 PolarHBondContact O-N 2.98Å; V9-Y11 VanDerWaalsContact O-N 3.13Å
12	I	35.6	Very low	43.6	Very low	120 Å²	120	126.9 Å²	126.9	62%	0.615	64%	0.641	S	S	*	*			trans	-88.5	106.8	176.5	-60.7	175.8	0	0	0	109	L10 H14	L10-I12 PolarHBondContact O-N 3.03Å; I12-H14 PolarHBondContact O-CD2 3.19Å; I12-H14 PolarHBondContact O-N 2.81Å
13	E	37.9	Very low	44.9	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	64%	0.639	S	S	*	*			trans	-65.4	102.5	167.6	-80.2	-166.9	177.1	0	0	110.7	R15	E13-R15 PolarHBondContact O-N 3.32Å; E13-R15 IonicContact OE1-NH2 2.72Å; E13-R15 IonicContact OE2-CZ 3.62Å; E13-R15 IonicContact OE2-NE 2.7Å; E13-R15 PolarHBondContact OE2-NE 3.43Å; E13-R15 IonicContact OE2-NH2 3.91Å; E13-R15 PolarHBondContact OE2-NH2 2.66Å
14	H	44	Very low	45.6	Very low	125 Å²	125	125 Å²	125	58%	0.579	63%	0.629	S	S	*	*			trans	-74.6	91.9	170.1	-75.9	-83.8	0	0	0	110.6	I12 Y16	I12-H14 PolarHBondContact O-CD2 3.19Å; I12-H14 PolarHBondContact O-N 2.81Å; H14-Y16 HydrophobicContact CB-CE2 3.96Å; H14-Y16 WeakPolarHBondContact O-CD2 3.44Å; H14-Y16 WeakPolarHBondContact O-CE2 3.28Å
15	R	47.4	Very low	47	Very low	168 Å²	168	118 Å²	118	63%	0.634	59%	0.594	S	S	*	*			trans	-85.5	127.1	170.2	-59.8	-174.9	-176.1	-164.2	-1.1	110	E13 L24	E13-R15 PolarHBondContact O-N 3.32Å; E13-R15 IonicContact OE1-NH2 2.72Å; E13-R15 IonicContact OE2-CZ 3.62Å; E13-R15 IonicContact OE2-NE 2.7Å; E13-R15 PolarHBondContact OE2-NE 3.43Å; E13-R15 IonicContact OE2-NH2 3.91Å; E13-R15 PolarHBondContact OE2-NH2 2.66Å; R15-L24 HydrophobicContact CB-CD2 4.04Å
16	Y	52.8	Low	47.3	Very low	86 Å²	86	115.7 Å²	115.7	34%	0.337	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.6	147.3	-175	-61.1	-92.7	0	0	0	110.6	H14 L24 Y25 S27 L28	H14-Y16 HydrophobicContact CB-CE2 3.96Å; H14-Y16 WeakPolarHBondContact O-CD2 3.44Å; H14-Y16 WeakPolarHBondContact O-CE2 3.28Å; Y16-L24 WeakPolarHBondContact O-CA 3.3Å; Y16-Y25 PolarHBondContact N-O 3.02Å; Y16-Y25 PolarHBondContact O-N 3.4Å; Y16-S27 VanDerWaalsContact CD2-C 3.5Å; Y16-L28 HydrophobicContact CD1-CB 4.43Å; Y16-L28 HydrophobicContact CD1-CD1 3.89Å; Y16-L28 HydrophobicContact CD2-CB 4.46Å; Y16-L28 HydrophobicContact CE1-CB 4.19Å; Y16-L28 HydrophobicContact CE1-CD1 4.02Å; Y16-L28 HydrophobicContact CE2-CB 4.22Å
17	V	49	Very low	48.6	Very low	70 Å²	70	108.5 Å²	108.5	42%	0.424	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.6	126.6	179.7	-179.1	0	0	0	0	109.1	S19 Q23 L24	V17-S19 PolarHBondContact O-N 3.4Å; V17-Q23 WeakPolarHBondContact CA-O 3.19Å; V17-L24 HydrophobicContact CG2-CD2 3.51Å; V17-L24 HydrophobicContact CG2-CG 4.02Å
18	C	58.1	Low	49.4	Very low	0 Å²	0	104.4 Å²	104.4	0%	0	54%	0.541	C	S	.	.			trans	-71.8	120.1	172.7	178.9	0	0	0	0	109.9	E20 N22 Q23 Y25 V31	C18-E20 PolarHBondContact O-N 3.39Å; C18-E20 VanDerWaalsContact O-N 3.08Å; C18-N22 WeakPolarHBondContact O-CA 3.07Å; C18-N22 PolarHBondContact O-N 3.29Å; C18-Q23 PolarHBondContact N-O 3.04Å; C18-Y25 HydrophobicContact CB-CE2 4.16Å; C18-V31 HydrophobicContact CB-CG1 4.23Å
19	S	54.7	Low	50.6	Low	96 Å²	96	105.7 Å²	105.7	67%	0.671	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-9.7	-172.9	51.5	0	0	0	0	115.7	V17	V17-S19 PolarHBondContact O-N 3.4Å
20	E	53.8	Low	51.7	Low	137 Å²	137	104.6 Å²	104.6	64%	0.64	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-37.5	-176.3	-53.3	-154.4	147	0	0	113	C18 H38	C18-E20 PolarHBondContact O-N 3.39Å; C18-E20 VanDerWaalsContact O-N 3.08Å; E20-H38 IonicContact OE2-CG 3.14Å
21	C	66.8	Low	53.1	Low	56 Å²	56	97.8 Å²	97.8	38%	0.378	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-12.7	178.5	67.3	0	0	0	0	113.9	Q23 H34	C21-Q23 VanDerWaalsContact C-N 3.26Å; C21-Q23 PolarHBondContact O-N 3.02Å; C21-Q23 VanDerWaalsContact SG-CB 3.52Å; C21-Q23 PolarHBondContact SG-N 3.07Å; C21-H34 PolarHBondContact SG-NE2 2.96Å
22	N	58	Low	54.3	Low	131 Å²	131	91.2 Å²	91.2	70%	0.701	47%	0.47	S	S	*	.			trans	63.3	23	-176.7	-133.9	38.9	0	0	0	115.2	C18	C18-N22 WeakPolarHBondContact O-CA 3.07Å; C18-N22 PolarHBondContact O-N 3.29Å
23	Q	60.5	Low	55.6	Low	113 Å²	113	90.6 Å²	90.6	53%	0.528	47%	0.471	S	S	.	.			trans	-86.5	142.7	178.9	-165.8	162	-9.8	0	0	111.5	V17 C18 C21 Y25	V17-Q23 WeakPolarHBondContact CA-O 3.19Å; C18-Q23 PolarHBondContact N-O 3.04Å; C21-Q23 VanDerWaalsContact C-N 3.26Å; C21-Q23 PolarHBondContact O-N 3.02Å; C21-Q23 VanDerWaalsContact SG-CB 3.52Å; C21-Q23 PolarHBondContact SG-N 3.07Å; Q23-Y25 HydrophobicContact CB-CE2 3.95Å; Q23-Y25 HydrophobicContact CG-CE2 4.13Å; Q23-Y25 WeakPolarHBondContact O-CD2 3.32Å
24	L	55.1	Low	56.9	Low	115 Å²	115	86 Å²	86	60%	0.602	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	139.6	-176.6	-85.9	157.5	0	0	0	112	R15 Y16 V17	R15-L24 HydrophobicContact CB-CD2 4.04Å; Y16-L24 WeakPolarHBondContact O-CA 3.3Å; V17-L24 HydrophobicContact CG2-CD2 3.51Å; V17-L24 HydrophobicContact CG2-CG 4.02Å
25	Y	66.9	Low	57.3	Low	47 Å²	47	83.1 Å²	83.1	18%	0.184	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.1	-178.6	-68.2	-81.1	0	0	0	110.8	Y16 C18 Q23 E30 V31 H34	Y16-Y25 PolarHBondContact N-O 3.02Å; Y16-Y25 PolarHBondContact O-N 3.4Å; C18-Y25 HydrophobicContact CB-CE2 4.16Å; Q23-Y25 HydrophobicContact CB-CE2 3.95Å; Q23-Y25 HydrophobicContact CG-CE2 4.13Å; Q23-Y25 WeakPolarHBondContact O-CD2 3.32Å; Y25-E30 WeakPolarHBondContact CB-OE2 3.48Å; Y25-E30 HydrophobicContact CD1-CB 3.75Å; Y25-E30 HydrophobicContact CG-CB 4.15Å; Y25-V31 HydrophobicContact CD2-CG2 3.76Å; Y25-V31 HydrophobicContact CG-CG2 3.91Å; Y25-H34 AromaticContact CE2-CD2 3.53Å; Y25-H34 AromaticContact CZ-CD2 3.55Å; Y25-H34 AromaticContact CZ-CG 3.94Å; Y25-H34 PolarHBondContact OH-CD2 3.33Å; Y25-H34 PolarHBondContact OH-NE2 3.08Å
26	G	47.8	Very low	57.4	Low	59 Å²	59	80.6 Å²	80.6	61%	0.608	44%	0.436	S	S	*	.	S	Bend	trans	-83	-25	-176.9	0	0	0	0	0	113.7	E30	G26-E30 PolarHBondContact N-OE2 3.08Å
27	S	63.1	Low	57.5	Low	38 Å²	38	80.4 Å²	80.4	27%	0.266	45%	0.447	S	S	.	.	S	Bend	trans	-131.8	164.1	177.6	85.9	0	0	0	0	113.1	Y16 E29 E30	Y16-S27 VanDerWaalsContact CD2-C 3.5Å; S27-E29 VanDerWaalsContact C-N 3.32Å; S27-E29 PolarHBondContact OG-N 3.33Å; S27-E30 PolarHBondContact N-OE2 2.95Å; S27-E30 WeakPolarHBondContact OG-CG 3.49Å; S27-E30 PolarHBondContact OG-N 3.46Å
28	L	54.4	Low	57.4	Low	88 Å²	88	81.4 Å²	81.4	46%	0.461	45%	0.447	S	S	.	.	H	α-helix	trans	-69.7	-31.4	173.6	-175.1	62.9	0	0	0	111.9	Y16 V31 L32	Y16-L28 HydrophobicContact CD1-CB 4.43Å; Y16-L28 HydrophobicContact CD1-CD1 3.89Å; Y16-L28 HydrophobicContact CD2-CB 4.46Å; Y16-L28 HydrophobicContact CE1-CB 4.19Å; Y16-L28 HydrophobicContact CE1-CD1 4.02Å; Y16-L28 HydrophobicContact CE2-CB 4.22Å; L28-V31 PolarHBondContact O-N 2.93Å; L28-L32 HydrophobicContact CG-CD1 4.12Å; L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.07Å
29	E	61.1	Low	56.3	Low	151 Å²	151	85.9 Å²	85.9	71%	0.706	47%	0.474	S	S	*	.	H	α-helix	trans	-67	-40.7	-180	-62.2	-176.5	132.8	0	0	111.6	S27 V31 L32 V33	S27-E29 VanDerWaalsContact C-N 3.32Å; S27-E29 PolarHBondContact OG-N 3.33Å; E29-V31 VanDerWaalsContact C-N 3.31Å; E29-V31 PolarHBondContact O-N 3.45Å; E29-L32 PolarHBondContact O-N 3.46Å; E29-V33 WeakPolarHBondContact O-CG2 3.46Å; E29-V33 PolarHBondContact O-N 2.74Å
30	E	56.2	Low	55.3	Low	93 Å²	93	86.6 Å²	86.6	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-57.4	-43.6	172.8	-71	173.5	166.5	0	0	111.7	Y25 G26 S27 H34	Y25-E30 WeakPolarHBondContact CB-OE2 3.48Å; Y25-E30 HydrophobicContact CD1-CB 3.75Å; Y25-E30 HydrophobicContact CG-CB 4.15Å; G26-E30 PolarHBondContact N-OE2 3.08Å; S27-E30 PolarHBondContact N-OE2 2.95Å; S27-E30 WeakPolarHBondContact OG-CG 3.49Å; S27-E30 PolarHBondContact OG-N 3.46Å; E30-H34 VanDerWaalsContact O-CB 3.31Å; E30-H34 WeakPolarHBondContact O-CB 3.46Å; E30-H34 PolarHBondContact O-N 3.32Å
31	V	60.1	Low	54.3	Low	7 Å²	7	89.2 Å²	89.2	4%	0.042	49%	0.488	C	S	.	.	H	α-helix	trans	-65.5	-40.5	177	178.3	0	0	0	0	111.6	C18 Y25 L28 E29 H34 Q35	C18-V31 HydrophobicContact CB-CG1 4.23Å; Y25-V31 HydrophobicContact CD2-CG2 3.76Å; Y25-V31 HydrophobicContact CG-CG2 3.91Å; L28-V31 PolarHBondContact O-N 2.93Å; E29-V31 VanDerWaalsContact C-N 3.31Å; E29-V31 PolarHBondContact O-N 3.45Å; V31-H34 PolarHBondContact O-N 3.02Å; V31-Q35 HydrophobicContact CG1-CG 4.27Å; V31-Q35 WeakPolarHBondContact O-CB 3.47Å; V31-Q35 WeakPolarHBondContact O-CG 3.35Å; V31-Q35 PolarHBondContact O-N 2.74Å
32	L	55.8	Low	52.7	Low	82 Å²	82	95.2 Å²	95.2	43%	0.429	51%	0.511	S	S	.	.	H	α-helix	trans	-69.6	-41	-180	-70.4	169.6	0	0	0	112.2	L28 E29 H34 Q35 N36	L28-L32 HydrophobicContact CG-CD1 4.12Å; L28-L32 WeakPolarHBondContact O-CG 3.49Å; L28-L32 PolarHBondContact O-N 3.07Å; E29-L32 PolarHBondContact O-N 3.46Å; L32-H34 VanDerWaalsContact C-N 3.33Å; L32-H34 PolarHBondContact O-N 3.3Å; L32-Q35 PolarHBondContact O-N 3.21Å; L32-N36 WeakPolarHBondContact O-CB 3.38Å; L32-N36 VanDerWaalsContact O-CG 3.3Å; L32-N36 PolarHBondContact O-N 2.84Å; L32-N36 PolarHBondContact O-ND2 2.87Å
33	V	63.3	Low	51.5	Low	107 Å²	107	96.3 Å²	96.3	65%	0.648	51%	0.512	S	S	*	.	H	α-helix	trans	-61.3	-43.2	172	172.2	0	0	0	0	110.5	E29 N36 S37	E29-V33 WeakPolarHBondContact O-CG2 3.46Å; E29-V33 PolarHBondContact O-N 2.74Å; V33-N36 PolarHBondContact O-N 3.21Å; V33-S37 PolarHBondContact O-N 2.9Å
34	H	66	Low	49.8	Very low	37 Å²	37	101 Å²	101	17%	0.171	53%	0.531	C	S	.	.	H	α-helix	trans	-66.2	-42.1	176.7	-178.4	41	0	0	0	112.8	C21 Y25 E30 V31 L32 N36 S37 H38	C21-H34 PolarHBondContact SG-NE2 2.96Å; Y25-H34 AromaticContact CE2-CD2 3.53Å; Y25-H34 AromaticContact CZ-CD2 3.55Å; Y25-H34 AromaticContact CZ-CG 3.94Å; Y25-H34 PolarHBondContact OH-CD2 3.33Å; Y25-H34 PolarHBondContact OH-NE2 3.08Å; E30-H34 VanDerWaalsContact O-CB 3.31Å; E30-H34 WeakPolarHBondContact O-CB 3.46Å; E30-H34 PolarHBondContact O-N 3.32Å; V31-H34 PolarHBondContact O-N 3.02Å; L32-H34 VanDerWaalsContact C-N 3.33Å; L32-H34 PolarHBondContact O-N 3.3Å; H34-N36 VanDerWaalsContact C-N 3.33Å; H34-N36 PolarHBondContact O-N 3.26Å; H34-S37 WeakPolarHBondContact O-CB 3.44Å; H34-S37 PolarHBondContact O-N 3.13Å; H34-S37 VanDerWaalsContact O-N 3.09Å; H34-S37 PolarHBondContact O-OG 2.95Å; H34-H38 AromaticContact CE1-NE2 3.56Å; H34-H38 AromaticContact NE2-NE2 3.87Å
35	Q	52.1	Low	48.5	Very low	65 Å²	65	102.8 Å²	102.8	30%	0.304	54%	0.536	S	S	.	.	H	α-helix	trans	-63.3	-37.7	175.3	-78	179.5	-13.7	0	0	112.3	V31 L32 S37 H38	V31-Q35 HydrophobicContact CG1-CG 4.27Å; V31-Q35 WeakPolarHBondContact O-CB 3.47Å; V31-Q35 WeakPolarHBondContact O-CG 3.35Å; V31-Q35 PolarHBondContact O-N 2.74Å; L32-Q35 PolarHBondContact O-N 3.21Å; Q35-S37 PolarHBondContact O-N 3.41Å; Q35-H38 WeakPolarHBondContact O-CB 3.46Å; Q35-H38 PolarHBondContact O-N 2.94Å
36	N	49.9	Very low	46.7	Very low	115 Å²	115	109 Å²	109	62%	0.615	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-24.4	174.2	-74.3	-31	0	0	0	112.9	L32 V33 H34 H38 V39	L32-N36 WeakPolarHBondContact O-CB 3.38Å; L32-N36 VanDerWaalsContact O-CG 3.3Å; L32-N36 PolarHBondContact O-N 2.84Å; L32-N36 PolarHBondContact O-ND2 2.87Å; V33-N36 PolarHBondContact O-N 3.21Å; H34-N36 VanDerWaalsContact C-N 3.33Å; H34-N36 PolarHBondContact O-N 3.26Å; N36-H38 PolarHBondContact O-N 3.5Å; N36-V39 PolarHBondContact O-N 3.33Å
37	S	53.8	Low	45.8	Very low	82 Å²	82	112.7 Å²	112.7	57%	0.573	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-12.3	173	78.2	0	0	0	0	114.6	V33 H34 Q35	V33-S37 PolarHBondContact O-N 2.9Å; H34-S37 WeakPolarHBondContact O-CB 3.44Å; H34-S37 PolarHBondContact O-N 3.13Å; H34-S37 VanDerWaalsContact O-N 3.09Å; H34-S37 PolarHBondContact O-OG 2.95Å; Q35-S37 PolarHBondContact O-N 3.41Å
38	H	47	Very low	44.2	Very low	90 Å²	90	114.4 Å²	114.4	42%	0.417	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89	-4.6	173.6	-71.1	-68.1	0	0	0	113.6	E20 H34 Q35 N36	E20-H38 IonicContact OE2-CG 3.14Å; H34-H38 AromaticContact CE1-NE2 3.56Å; H34-H38 AromaticContact NE2-NE2 3.87Å; Q35-H38 WeakPolarHBondContact O-CB 3.46Å; Q35-H38 PolarHBondContact O-N 2.94Å; N36-H38 PolarHBondContact O-N 3.5Å
39	V	36.5	Very low	43.2	Very low	94 Å²	94	116.8 Å²	116.8	57%	0.57	62%	0.623	S	S	*	*	S	Bend	trans	-84.3	120.9	174.3	-176.1	0	0	0	0	109.6	N36 Q41	N36-V39 PolarHBondContact O-N 3.33Å; V39-Q41 PolarHBondContact O-N 3.07Å
40	P	32.7	Very low	41.6	Very low	112 Å²	112	114.4 Å²	114.4	73%	0.727	63%	0.629	S	S	*	*			trans	-72	115.5	180	28.3	-33.4	0	0	0	110.9	Q42	P40-Q42 PolarHBondContact O-N 3.34Å
41	Q	33.4	Very low	40.1	Very low	191 Å²	191	117.7 Å²	117.7	89%	0.893	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-60.7	132.5	169.4	-68	-180	-19.5	0	0	110	V39	V39-Q41 PolarHBondContact O-N 3.07Å
42	Q	32	Very low	39.4	Very low	182 Å²	182	123 Å²	123	85%	0.85	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-85.3	149.2	169.4	-66.6	-171.2	-10.5	0	0	109.9	P40	P40-Q42 PolarHBondContact O-N 3.34Å
43	H	33.2	Very low	38.1	Very low	155 Å²	155	122.7 Å²	122.7	72%	0.718	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-64.9	134.6	-159	-74.2	-119.5	0	0	0	114.3	E45	H43-E45 IonicContact CE1-OE2 3.75Å; H43-E45 IonicContact ND1-OE2 3.48Å; H43-E45 PolarHBondContact ND1-OE2 3.17Å
44	F	26.1	Very low	36.4	Very low	211 Å²	211	124.2 Å²	124.2	93%	0.925	71%	0.71	S	S	*	*			trans	-120.9	109.7	145.6	-80.7	-91	0	0	0	107.6
45	E	27.8	Very low	34.7	Very low	153 Å²	153	127.3 Å²	127.3	72%	0.715	74%	0.742	S	S	*	*			trans	-122.1	117.9	169.7	-78.1	178	118.2	0	0	109.1	H43 V47	H43-E45 IonicContact CE1-OE2 3.75Å; H43-E45 IonicContact ND1-OE2 3.48Å; H43-E45 PolarHBondContact ND1-OE2 3.17Å; E45-V47 PolarHBondContact O-N 3.48Å
46	L	28.6	Very low	33.6	Very low	178 Å²	178	130.7 Å²	130.7	93%	0.932	77%	0.767	S	S	*	*			trans	-80.6	112.7	170.5	-78.2	161.8	0	0	0	108.5	G48	L46-G48 VanDerWaalsContact C-N 3.34Å; L46-G48 PolarHBondContact O-N 3.38Å
47	V	28.8	Very low	32.4	Very low	136 Å²	136	128.7 Å²	128.7	82%	0.824	77%	0.766	S	S	*	*			trans	-79.7	82.5	178.3	-175	0	0	0	0	110.1	E45 V49	E45-V47 PolarHBondContact O-N 3.48Å; V47-V49 HydrophobicContact CG1-CG2 4.32Å
48	G	29.3	Very low	31.1	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	78%	0.776	S	S	*	*			trans	-85.9	129.4	164.6	0	0	0	0	0	110.8	L46	L46-G48 VanDerWaalsContact C-N 3.34Å; L46-G48 PolarHBondContact O-N 3.38Å
49	V	32.6	Very low	30.2	Very low	139 Å²	139	135.3 Å²	135.3	84%	0.842	80%	0.797	S	S	*	*			trans	-108.6	117.8	178.8	-177.7	0	0	0	0	109.8	V47	V47-V49 HydrophobicContact CG1-CG2 4.32Å
50	A	27.6	Very low	29.7	Very low	100 Å²	100	135.4 Å²	135.4	83%	0.826	81%	0.807	S	S	*	*			trans	-150.7	140.6	169.9	0	0	0	0	0	110.4
51	D	25.5	Very low	29.5	Very low	163 Å²	163	134.2 Å²	134.2	87%	0.872	81%	0.807	S	S	*	*			trans	-87.8	169	-178.2	-106.4	-38.9	0	0	0	112.5
52	P	45.1	Very low	29.2	Very low	119 Å²	119	131.2 Å²	131.2	77%	0.773	81%	0.808	S	S	*	*			trans	-90.9	150.4	-153.8	34	-38.5	0	0	0	116.4
53	G	29.2	Very low	28.9	Very low	75 Å²	75	125.9 Å²	125.9	77%	0.773	80%	0.801	S	S	*	*			trans	112.7	85.5	137.1	0	0	0	0	0	118
54	V	27.4	Very low	28.7	Very low	139 Å²	139	125.6 Å²	125.6	84%	0.842	81%	0.81	S	S	*	*			trans	-141.7	140.1	142.4	168.1	0	0	0	0	107.4	V56	V54-V56 HydrophobicContact CG1-CG2 4.01Å
55	A	31.1	Very low	28.7	Very low	101 Å²	101	119.1 Å²	119.1	84%	0.835	80%	0.803	S	S	*	*			trans	-111.8	123.3	171.8	0	0	0	0	0	110.1
56	V	27.2	Very low	28.5	Very low	137 Å²	137	119.4 Å²	119.4	83%	0.83	81%	0.809	S	S	*	*			trans	-135.7	142.9	166.8	-177.6	0	0	0	0	107.3	V54	V54-V56 HydrophobicContact CG1-CG2 4.01Å
57	A	25.2	Very low	28.4	Very low	73 Å²	73	121.2 Å²	121.2	60%	0.603	81%	0.805	S	S	*	*			trans	-113.6	178.1	-179.1	0	0	0	0	0	110.8
58	T	27.5	Very low	28.3	Very low	125 Å²	125	123.4 Å²	123.4	77%	0.767	81%	0.806	S	S	*	*			trans	68.4	149.6	171.2	71.1	0	0	0	0	114.9
59	E	27.6	Very low	28.4	Very low	186 Å²	186	124.6 Å²	124.6	87%	0.869	80%	0.799	S	S	*	*			cis	-150.6	-166.6	-11.4	-125.2	164.9	-143.7	0	0	112.2
60	A	26.6	Very low	28.1	Very low	95 Å²	95	126.4 Å²	126.4	79%	0.785	80%	0.803	S	S	*	*			trans	-81.6	178.8	-163.1	0	0	0	0	0	117
61	A	26.7	Very low	28.2	Very low	88 Å²	88	128 Å²	128	73%	0.727	80%	0.796	S	S	*	*			trans	96.9	106.4	153.3	0	0	0	0	0	120.3
62	S	27.9	Very low	28.6	Very low	128 Å²	128	129.2 Å²	129.2	90%	0.895	80%	0.796	S	S	*	*				58.8	125.3	123.2	-52.9	0	0	0	0	122.4
63	G	26.3	Very low	28.5	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	80%	0.797	S	S	*	*			trans	125.2	78.8	137.9	0	0	0	0	0	119.2
64	T	29.6	Very low	29.2	Very low	149 Å²	149	131.3 Å²	131.3	91%	0.914	78%	0.784	S	S	*	*			trans	27.7	117.7	142	55.3	0	0	0	0	120.9
65	G	24.2	Very low	30.3	Very low	75 Å²	75	129.8 Å²	129.8	77%	0.773	77%	0.767	S	S	*	*			trans	168.3	98.4	157.2	0	0	0	0	0	118.1
66	L	25.4	Very low	31.4	Very low	160 Å²	160	129 Å²	129	84%	0.838	74%	0.743	S	S	*	*			trans	29.5	133.5	150.7	-59.2	171.1	0	0	0	122.4
67	Y	24.7	Very low	32.4	Very low	216 Å²	216	127.5 Å²	127.5	85%	0.847	73%	0.727	S	S	*	*			trans	23.5	123.5	148.4	-71.6	-99.3	0	0	0	119.9
68	Q	27.7	Very low	33.9	Very low	182 Å²	182	124.1 Å²	124.1	85%	0.85	70%	0.699	S	S	*	*				-164.7	150.5	86.9	-165.9	145.9	-6.5	0	0	113.4
69	T	30.6	Very low	35.2	Very low	97 Å²	97	126 Å²	126	60%	0.595	70%	0.704	S	S	*	*			trans	-42.1	136.5	-176.3	50.3	0	0	0	0	118.9	I71	T69-I71 HydrophobicContact CG2-CD1 4.41Å; T69-I71 HydrophobicContact CG2-CG1 4.37Å
70	L	26.5	Very low	36.3	Very low	177 Å²	177	124.2 Å²	124.2	93%	0.927	70%	0.695	S	S	*	*			trans	-125.2	114.8	134.7	-104.5	168.5	0	0	0	107.8
71	I	30.4	Very low	37.9	Very low	133 Å²	133	122.7 Å²	122.7	68%	0.682	68%	0.678	S	S	*	*			trans	-96.2	126.6	178.2	-61.6	172.1	0	0	0	108.1	T69	T69-I71 HydrophobicContact CG2-CD1 4.41Å; T69-I71 HydrophobicContact CG2-CG1 4.37Å
72	Q	34.2	Very low	39.6	Very low	190 Å²	190	120.3 Å²	120.3	89%	0.888	66%	0.662	S	S	*	*			trans	-117.4	132.6	156.8	-75.9	-171.9	-45.9	0	0	108	S74	Q72-S74 PolarHBondContact O-N 3.38Å
73	E	42.5	Very low	41.3	Very low	168 Å²	168	119.2 Å²	119.2	79%	0.785	64%	0.643	S	S	*	*			trans	-78.5	104	-166.6	-60.3	-178.3	147.5	0	0	111.6	Q75	E73-Q75 PolarHBondContact O-N 3.47Å
74	S	43.9	Very low	42.9	Very low	70 Å²	70	120.4 Å²	120.4	49%	0.49	63%	0.632	S	S	.	*			trans	-76.9	111.5	172.8	56.8	0	0	0	0	110.8	Q72 Y76	Q72-S74 PolarHBondContact O-N 3.38Å; S74-Y76 WeakPolarHBondContact O-CD2 3.42Å; S74-Y76 WeakPolarHBondContact O-CE2 3.4Å; S74-Y76 PolarHBondContact OG-OH 3.22Å
75	Q	50.6	Low	44.6	Very low	107 Å²	107	114.5 Å²	114.5	50%	0.5	60%	0.595	S	S	.	*			trans	-83.2	141.8	168.8	-61	-173.9	4.9	0	0	110.6	E73 L84 L86	E73-Q75 PolarHBondContact O-N 3.47Å; Q75-L84 HydrophobicContact CB-CD2 4.38Å; Q75-L86 HydrophobicContact CG-CD2 4.1Å
76	Y	53.9	Low	46.1	Very low	83 Å²	83	116.7 Å²	116.7	33%	0.325	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.3	128.4	-173.6	-59.8	-89.1	0	0	0	110.5	S74 L84 L85 P88	S74-Y76 WeakPolarHBondContact O-CD2 3.42Å; S74-Y76 WeakPolarHBondContact O-CE2 3.4Å; S74-Y76 PolarHBondContact OG-OH 3.22Å; Y76-L84 CarbonylContact O-C 3.58Å; Y76-L84 WeakPolarHBondContact O-CA 3.36Å; Y76-L85 PolarHBondContact N-O 3.32Å; Y76-L85 PolarHBondContact O-N 2.92Å; Y76-P88 HydrophobicContact CD2-CG 4.47Å; Y76-P88 HydrophobicContact CE1-CG 4.09Å; Y76-P88 HydrophobicContact CE2-CG 3.83Å
77	Q	48.9	Very low	47.6	Very low	107 Å²	107	110.5 Å²	110.5	50%	0.5	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102	130.8	-179.6	-156.8	173.3	18.1	0	0	112	L79 G82 Q83 L84	Q77-L79 PolarHBondContact O-N 3.46Å; Q77-G82 WeakPolarHBondContact CG-O 3.32Å; Q77-G82 PolarHBondContact NE2-O 2.93Å; Q77-Q83 WeakPolarHBondContact CA-O 3.34Å; Q77-L84 HydrophobicContact CB-CD2 3.7Å; Q77-L84 HydrophobicContact CG-CD2 3.86Å; Q77-L84 HydrophobicContact CG-CG 4.19Å
78	C	55.8	Low	48.9	Very low	1 Å²	1	103.8 Å²	103.8	1%	0.007	54%	0.541	C	S	.	.			trans	-74.8	118.7	169	-178.6	0	0	0	0	110.3	E80 C81 G82 Q83 L91	C78-E80 VanDerWaalsContact C-N 3.28Å; C78-E80 PolarHBondContact O-N 2.82Å; C78-C81 VanDerWaalsContact CB-SG 3.55Å; C78-C81 VanDerWaalsContact SG-SG 3.61Å; C78-G82 VanDerWaalsContact O-CA 3.26Å; C78-G82 WeakPolarHBondContact O-CA 3.46Å; C78-G82 PolarHBondContact O-N 3.48Å; C78-Q83 PolarHBondContact N-O 3.3Å; C78-L91 HydrophobicContact CB-CD1 3.62Å
79	L	54.4	Low	50.6	Low	166 Å²	166	99 Å²	99	87%	0.869	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-15.3	-175.9	-70.4	166.6	0	0	0	114.4	Q77	Q77-L79 PolarHBondContact O-N 3.46Å
80	E	51.4	Low	51.9	Low	148 Å²	148	98.3 Å²	98.3	69%	0.692	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-30.6	178.2	-62.6	-164.1	165.1	0	0	113.6	C78 H98	C78-E80 VanDerWaalsContact C-N 3.28Å; C78-E80 PolarHBondContact O-N 2.82Å; E80-H98 IonicContact OE2-CE1 2.73Å; E80-H98 IonicContact OE2-CG 3.65Å; E80-H98 IonicContact OE2-ND1 3.59Å; E80-H98 PolarHBondContact OE2-ND1 3.17Å
81	C	61.3	Low	53.5	Low	62 Å²	62	91.2 Å²	91.2	42%	0.419	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-13.1	-174	68.6	0	0	0	0	114.3	C78 Q83 H94	C78-C81 VanDerWaalsContact CB-SG 3.55Å; C78-C81 VanDerWaalsContact SG-SG 3.61Å; C81-Q83 PolarHBondContact SG-N 3Å; C81-H94 PolarHBondContact SG-NE2 3.18Å
82	G	61.4	Low	55.1	Low	38 Å²	38	90.2 Å²	90.2	39%	0.392	48%	0.476	S	S	.	.			trans	80.8	3.2	-178.3	0	0	0	0	0	115.6	Q77 C78	Q77-G82 WeakPolarHBondContact CG-O 3.32Å; Q77-G82 PolarHBondContact NE2-O 2.93Å; C78-G82 VanDerWaalsContact O-CA 3.26Å; C78-G82 WeakPolarHBondContact O-CA 3.46Å; C78-G82 PolarHBondContact O-N 3.48Å
83	Q	63.1	Low	56.7	Low	106 Å²	106	87.4 Å²	87.4	50%	0.495	46%	0.463	S	S	.	.			trans	-74.8	132.7	-176.3	-170.7	166.1	-4.5	0	0	112.3	Q77 C78 C81 L85 H94	Q77-Q83 WeakPolarHBondContact CA-O 3.34Å; C78-Q83 PolarHBondContact N-O 3.3Å; C81-Q83 PolarHBondContact SG-N 3Å; Q83-L85 HydrophobicContact CG-CD2 4.36Å; Q83-H94 PolarHBondContact OE1-CE1 2.95Å
84	L	59.9	Low	58	Low	94 Å²	94	81 Å²	81	49%	0.492	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	138.1	174.3	-72.8	165.2	0	0	0	111	Q75 Y76 Q77	Q75-L84 HydrophobicContact CB-CD2 4.38Å; Y76-L84 CarbonylContact O-C 3.58Å; Y76-L84 WeakPolarHBondContact O-CA 3.36Å; Q77-L84 HydrophobicContact CB-CD2 3.7Å; Q77-L84 HydrophobicContact CG-CD2 3.86Å; Q77-L84 HydrophobicContact CG-CG 4.19Å
85	L	65.8	Low	58.6	Low	24 Å²	24	81.3 Å²	81.3	13%	0.126	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.8	-173.5	-61.4	170.4	0	0	0	110	Y76 Q83 Q90 L91 H94	Y76-L85 PolarHBondContact N-O 3.32Å; Y76-L85 PolarHBondContact O-N 2.92Å; Q83-L85 HydrophobicContact CG-CD2 4.36Å; L85-Q90 HydrophobicContact CB-CB 4.26Å; L85-L91 HydrophobicContact CD1-CB 4.16Å; L85-L91 HydrophobicContact CD1-CD1 4.17Å; L85-H94 HydrophobicContact CD1-CB 3.92Å
86	L	55.3	Low	59.3	Low	121 Å²	121	80.8 Å²	80.8	63%	0.634	43%	0.425	S	S	*	.	S	Bend	trans	-90.3	-1.2	-167.3	-73.1	155.5	0	0	0	113.8	Q75	Q75-L86 HydrophobicContact CG-CD2 4.1Å
87	S	57.1	Low	59.8	Low	31 Å²	31	82 Å²	82	22%	0.217	44%	0.436	C	S	.	.	S	Bend	trans	-154.9	156	179	60.2	0	0	0	0	112.6	S89 Q90 L91	S87-S89 VanDerWaalsContact C-N 3.28Å; S87-S89 PolarHBondContact O-N 3.32Å; S87-Q90 PolarHBondContact O-N 2.81Å; S87-Q90 VanDerWaalsContact OG-CG 3.27Å; S87-Q90 WeakPolarHBondContact OG-CG 3.39Å; S87-Q90 PolarHBondContact OG-N 3.02Å; S87-Q90 PolarHBondContact OG-OE1 3.2Å; S87-Q90 VanDerWaalsContact OG-OE1 3.05Å; S87-L91 PolarHBondContact O-N 2.91Å
88	P	51.9	Low	60.5	Low	74 Å²	74	79.4 Å²	79.4	48%	0.481	42%	0.424	S	S	.	.	H	α-helix	trans	-61	-35.7	174.9	-22.1	33.2	0	0	0	113	Y76 Q90 L91 L92	Y76-P88 HydrophobicContact CD2-CG 4.47Å; Y76-P88 HydrophobicContact CE1-CG 4.09Å; Y76-P88 HydrophobicContact CE2-CG 3.83Å; P88-Q90 PolarHBondContact O-N 3.31Å; P88-L91 WeakPolarHBondContact O-CB 3.31Å; P88-L91 PolarHBondContact O-N 3.41Å; P88-L92 PolarHBondContact O-N 2.88Å
89	S	63.1	Low	60.7	Low	82 Å²	82	85.5 Å²	85.5	57%	0.573	46%	0.456	S	S	*	.	H	α-helix	trans	-60	-46.6	-179.7	-42.9	0	0	0	0	111.6	S87 L91 L92 E93	S87-S89 VanDerWaalsContact C-N 3.28Å; S87-S89 PolarHBondContact O-N 3.32Å; S89-L91 VanDerWaalsContact C-N 3.31Å; S89-L91 PolarHBondContact O-N 3.08Å; S89-L92 PolarHBondContact O-N 3.41Å; S89-L92 VanDerWaalsContact O-N 3.16Å; S89-E93 WeakPolarHBondContact O-CG 3.42Å; S89-E93 PolarHBondContact O-N 3.19Å
90	Q	57.9	Low	60.8	Low	82 Å²	82	83.8 Å²	83.8	38%	0.383	44%	0.441	S	S	.	.	H	α-helix	trans	-63.4	-35.9	177.2	-73.5	166.9	-22.2	0	0	112.1	L85 S87 P88 H94	L85-Q90 HydrophobicContact CB-CB 4.26Å; S87-Q90 PolarHBondContact O-N 2.81Å; S87-Q90 VanDerWaalsContact OG-CG 3.27Å; S87-Q90 WeakPolarHBondContact OG-CG 3.39Å; S87-Q90 PolarHBondContact OG-N 3.02Å; S87-Q90 PolarHBondContact OG-OE1 3.2Å; S87-Q90 VanDerWaalsContact OG-OE1 3.05Å; P88-Q90 PolarHBondContact O-N 3.31Å; Q90-H94 WeakPolarHBondContact O-CB 3.32Å; Q90-H94 PolarHBondContact O-N 2.85Å
91	L	61.5	Low	60.6	Low	29 Å²	29	84.4 Å²	84.4	15%	0.152	45%	0.446	C	S	.	.	H	α-helix	trans	-65.3	-39.8	174.8	177.8	61.5	0	0	0	111.6	C78 L85 S87 P88 S89 H94 Q95	C78-L91 HydrophobicContact CB-CD1 3.62Å; L85-L91 HydrophobicContact CD1-CB 4.16Å; L85-L91 HydrophobicContact CD1-CD1 4.17Å; S87-L91 PolarHBondContact O-N 2.91Å; P88-L91 WeakPolarHBondContact O-CB 3.31Å; P88-L91 PolarHBondContact O-N 3.41Å; S89-L91 VanDerWaalsContact C-N 3.31Å; S89-L91 PolarHBondContact O-N 3.08Å; L91-H94 PolarHBondContact O-N 3.45Å; L91-Q95 HydrophobicContact CD1-CG 4.34Å; L91-Q95 WeakPolarHBondContact O-CB 3.39Å; L91-Q95 VanDerWaalsContact O-CG 3.31Å; L91-Q95 WeakPolarHBondContact O-CG 3.37Å; L91-Q95 PolarHBondContact O-N 3.5Å
92	L	62.9	Low	59.9	Low	112 Å²	112	89.2 Å²	89.2	59%	0.586	46%	0.464	S	S	*	.	H	α-helix	trans	-68.6	-44.5	178.9	-148.8	74.8	0	0	0	111.8	P88 S89 H94 Q95 E96	P88-L92 PolarHBondContact O-N 2.88Å; S89-L92 PolarHBondContact O-N 3.41Å; S89-L92 VanDerWaalsContact O-N 3.16Å; L92-H94 VanDerWaalsContact C-N 3.31Å; L92-H94 PolarHBondContact O-N 3.08Å; L92-Q95 PolarHBondContact O-N 3.36Å; L92-E96 PolarHBondContact O-N 3.34Å
93	E	68.1	Low	58.9	Low	130 Å²	130	90.3 Å²	90.3	61%	0.607	47%	0.469	S	S	*	.	H	α-helix	trans	-60.7	-39.6	174.1	-70.6	177.8	156.8	0	0	112.1	S89 E96 L97	S89-E93 WeakPolarHBondContact O-CG 3.42Å; S89-E93 PolarHBondContact O-N 3.19Å; E93-E96 PolarHBondContact O-N 3.42Å; E93-L97 PolarHBondContact O-N 3.29Å
94	H	70.2	Confident	57.7	Low	33 Å²	33	91.1 Å²	91.1	15%	0.153	48%	0.484	C	S	.	.	H	α-helix	trans	-67.6	-38.6	177.1	-172.7	95.9	0	0	0	112.4	C81 Q83 L85 Q90 L91 L92 L97 H98	C81-H94 PolarHBondContact SG-NE2 3.18Å; Q83-H94 PolarHBondContact OE1-CE1 2.95Å; L85-H94 HydrophobicContact CD1-CB 3.92Å; Q90-H94 WeakPolarHBondContact O-CB 3.32Å; Q90-H94 PolarHBondContact O-N 2.85Å; L91-H94 PolarHBondContact O-N 3.45Å; L92-H94 VanDerWaalsContact C-N 3.31Å; L92-H94 PolarHBondContact O-N 3.08Å; H94-L97 PolarHBondContact O-N 3.26Å; H94-H98 AromaticContact NE2-NE2 3.86Å; H94-H98 PolarHBondContact O-N 2.98Å; H94-H98 VanDerWaalsContact O-N 3.15Å
95	Q	56.2	Low	56.4	Low	78 Å²	78	96 Å²	96	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-68.3	-37.4	173	-74	174.3	-1.3	0	0	112.2	L91 L92 L97 H98 L99	L91-Q95 HydrophobicContact CD1-CG 4.34Å; L91-Q95 WeakPolarHBondContact O-CB 3.39Å; L91-Q95 VanDerWaalsContact O-CG 3.31Å; L91-Q95 WeakPolarHBondContact O-CG 3.37Å; L91-Q95 PolarHBondContact O-N 3.5Å; L92-Q95 PolarHBondContact O-N 3.36Å; Q95-L97 VanDerWaalsContact C-N 3.32Å; Q95-L97 PolarHBondContact O-N 3.36Å; Q95-H98 WeakPolarHBondContact O-CB 3.42Å; Q95-H98 PolarHBondContact O-N 2.87Å; Q95-L99 PolarHBondContact O-N 3.3Å
96	E	65.3	Low	55.5	Low	96 Å²	96	104.1 Å²	104.1	45%	0.449	54%	0.542	S	S	.	.	H	α-helix	trans	-62.8	-36.4	171.7	-83.4	-160.2	-164.5	0	0	112.7	L92 E93 L99 K100	L92-E96 PolarHBondContact O-N 3.34Å; E93-E96 PolarHBondContact O-N 3.42Å; E96-L99 PolarHBondContact O-N 3.45Å; E96-K100 WeakPolarHBondContact O-CB 3.43Å; E96-K100 VanDerWaalsContact O-CD 3.32Å; E96-K100 WeakPolarHBondContact O-CD 3.44Å; E96-K100 WeakPolarHBondContact O-CG 3.31Å; E96-K100 PolarHBondContact O-N 3.05Å; E96-K100 WeakPolarHBondContact OE2-CE 3.26Å; E96-K100 IonicContact OE2-NZ 3.95Å; E96-K100 PolarHBondContact OE2-NZ 3.09Å
97	L	64.3	Low	54.5	Low	107 Å²	107	103.1 Å²	103.1	56%	0.56	55%	0.551	S	S	*	*	H	α-helix	trans	-65	-41.8	174.5	-78.5	164.5	0	0	0	112	E93 H94 Q95 K100 M101	E93-L97 PolarHBondContact O-N 3.29Å; H94-L97 PolarHBondContact O-N 3.26Å; Q95-L97 VanDerWaalsContact C-N 3.32Å; Q95-L97 PolarHBondContact O-N 3.36Å; L97-K100 PolarHBondContact O-N 2.61Å; L97-M101 PolarHBondContact O-N 3.25Å
98	H	64.3	Low	53.5	Low	54 Å²	54	108.1 Å²	108.1	25%	0.25	58%	0.58	C	S	.	*	H	α-helix	trans	-58	-46.9	171.8	-94.7	-125.3	0	0	0	112.1	E80 H94 Q95 K100 M101 M102	E80-H98 IonicContact OE2-CE1 2.73Å; E80-H98 IonicContact OE2-CG 3.65Å; E80-H98 IonicContact OE2-ND1 3.59Å; E80-H98 PolarHBondContact OE2-ND1 3.17Å; H94-H98 AromaticContact NE2-NE2 3.86Å; H94-H98 PolarHBondContact O-N 2.98Å; H94-H98 VanDerWaalsContact O-N 3.15Å; Q95-H98 WeakPolarHBondContact O-CB 3.42Å; Q95-H98 PolarHBondContact O-N 2.87Å; H98-K100 PolarHBondContact O-N 3.33Å; H98-M101 PolarHBondContact O-N 2.98Å; H98-M102 WeakPolarHBondContact O-CG 3.43Å; H98-M102 PolarHBondContact O-N 2.77Å
99	L	60	Low	53.5	Low	129 Å²	129	109.8 Å²	109.8	68%	0.675	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-40.4	176.4	-74.2	163.8	0	0	0	112.5	Q95 E96 M101 M102	Q95-L99 PolarHBondContact O-N 3.3Å; E96-L99 PolarHBondContact O-N 3.45Å; L99-M101 VanDerWaalsContact C-N 3.35Å; L99-M102 PolarHBondContact O-N 3.08Å
100	K	56.1	Low	51.8	Low	129 Å²	129	110.2 Å²	110.2	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-67.9	-31.6	177.4	-71.8	161	-167.2	167.7	0	112.5	E96 L97 H98 M102	E96-K100 WeakPolarHBondContact O-CB 3.43Å; E96-K100 VanDerWaalsContact O-CD 3.32Å; E96-K100 WeakPolarHBondContact O-CD 3.44Å; E96-K100 WeakPolarHBondContact O-CG 3.31Å; E96-K100 PolarHBondContact O-N 3.05Å; E96-K100 WeakPolarHBondContact OE2-CE 3.26Å; E96-K100 IonicContact OE2-NZ 3.95Å; E96-K100 PolarHBondContact OE2-NZ 3.09Å; L97-K100 PolarHBondContact O-N 2.61Å; H98-K100 PolarHBondContact O-N 3.33Å; K100-M102 VanDerWaalsContact C-N 3.31Å
101	M	47.7	Very low	50.5	Low	162 Å²	162	114.8 Å²	114.8	80%	0.798	62%	0.62	S	S	*	*	H	α-helix	trans	-73.9	-16.7	172.9	-76.9	-166.6	67.1	0	0	114.3	L97 H98 L99	L97-M101 PolarHBondContact O-N 3.25Å; H98-M101 PolarHBondContact O-N 2.98Å; L99-M101 VanDerWaalsContact C-N 3.35Å
102	M	45.6	Very low	49.7	Very low	162 Å²	162	118.5 Å²	118.5	80%	0.798	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	1.2	178.6	-67.7	-68	170.7	0	0	113.7	H98 L99 K100	H98-M102 WeakPolarHBondContact O-CG 3.43Å; H98-M102 PolarHBondContact O-N 2.77Å; L99-M102 PolarHBondContact O-N 3.08Å; K100-M102 VanDerWaalsContact C-N 3.31Å
103	A	40.4	Very low	49.5	Very low	61 Å²	61	118.7 Å²	118.7	50%	0.504	65%	0.654	S	S	.	*	S	Bend	trans	-80.9	135	175.3	0	0	0	0	0	111.7
104	P	37.5	Very low	47.9	Very low	123 Å²	123	117.9 Å²	117.9	80%	0.799	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-68.8	140.9	173.1	29.6	-34.1	0	0	0	110.9
105	Q	33.1	Very low	46	Very low	197 Å²	197	125.9 Å²	125.9	92%	0.921	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-79.1	132.3	179.8	-64.6	179.9	-12.9	0	0	111.9
106	E	47.3	Very low	44.5	Very low	195 Å²	195	127.1 Å²	127.1	91%	0.911	72%	0.718	S	S	*	*			trans	-133.4	122.6	165.4	-76.6	-162.6	153.9	0	0	111.9
107	A	34.4	Very low	42.7	Very low	99 Å²	99	128.3 Å²	128.3	82%	0.818	74%	0.736	S	S	*	*			trans	-169.3	156.5	156.6	0	0	0	0	0	106.3
108	V	36.1	Very low	41.5	Very low	137 Å²	137	129.3 Å²	129.3	83%	0.83	75%	0.748	S	S	*	*			cis	-154	-176.2	16.3	-147.2	0	0	0	0	108.3
109	P	51.7	Low	40.3	Very low	108 Å²	108	134.4 Å²	134.4	70%	0.701	78%	0.777	S	S	*	*				-134.1	-171.5	-112.8	43.5	-24	0	0	0	118.4
110	A	28.2	Very low	38.7	Very low	92 Å²	92	133.6 Å²	133.6	76%	0.76	78%	0.782	S	S	*	*			trans	73.8	153	158.3	0	0	0	0	0	118.4
111	E	30.3	Very low	37.6	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	79%	0.79	S	S	*	*			cis	-171	-175.8	-21	-117.8	-168.8	-152.6	0	0	107.7
112	P	44.2	Very low	37.2	Very low	107 Å²	107	130.5 Å²	130.5	70%	0.695	79%	0.792	S	S	*	*			cis	-125.8	-174.9	-32.9	32.8	-11.9	0	0	0	113.1
113	P	58.4	Low	37.2	Very low	116 Å²	116	127 Å²	127	75%	0.753	78%	0.78	S	S	*	*			trans	-116.5	172.9	-163.3	42.7	-35.2	0	0	0	118.1
114	P	35.7	Very low	37.5	Very low	113 Å²	113	130 Å²	130	73%	0.734	79%	0.787	S	S	*	*				-136.6	164.9	127.5	17.7	4.2	0	0	0	112.9
115	K	29	Very low	38.4	Very low	201 Å²	201	129.4 Å²	129.4	87%	0.874	77%	0.773	S	S	*	*			cis	-161	144.8	3.6	-121.1	165.2	-172.9	175.4	0	111.5
116	A	26.2	Very low	39.5	Very low	104 Å²	104	124 Å²	124	86%	0.86	75%	0.745	S	S	*	*			trans	62.7	131.6	148.3	0	0	0	0	0	124.1
117	C	27.2	Very low	40.4	Very low	121 Å²	121	118.4 Å²	118.4	82%	0.818	72%	0.718	S	S	*	*			trans	-72.9	174.2	168.9	-102.1	0	0	0	0	113.6
118	P	39	Very low	41.8	Very low	128 Å²	128	113.9 Å²	113.9	83%	0.831	68%	0.681	S	S	*	*				-147.7	-173.8	54.3	41.6	-19.1	0	0	0	119.6
119	L	38.6	Very low	43	Very low	162 Å²	162	113 Å²	113	85%	0.848	68%	0.676	S	S	*	*			trans	-82.3	165.5	-164.9	-58.9	130.3	0	0	0	116
120	S	27.2	Very low	43.2	Very low	112 Å²	112	114 Å²	114	78%	0.783	68%	0.675	S	S	*	*				-167.1	142.7	128.3	29.9	0	0	0	0	114.7
121	S	31.7	Very low	45.1	Very low	104 Å²	104	112.4 Å²	112.4	73%	0.727	66%	0.658	S	S	*	*			trans	27.2	122.3	158.7	60.4	0	0	0	0	121.9
122	S	40.3	Very low	47.3	Very low	121 Å²	121	111 Å²	111	85%	0.846	65%	0.649	S	S	*	*			trans	-82.5	109.5	159.6	53.9	0	0	0	0	112.1
123	T	44.2	Very low	48.3	Very low	88 Å²	88	107.4 Å²	107.4	54%	0.54	63%	0.628	S	S	.	*			trans	-83.2	127.4	178.1	-49.5	0	0	0	0	112
124	I	48.3	Very low	48.8	Very low	126 Å²	126	107 Å²	107	65%	0.646	62%	0.619	S	S	*	*			trans	-76.7	135	172.4	-62.9	173.3	0	0	0	109.3	Y126	I124-Y126 HydrophobicContact CG2-CE2 4.46Å
125	H	55.2	Low	50.5	Low	109 Å²	109	103.5 Å²	103.5	51%	0.505	59%	0.592	S	S	.	*			trans	-116.7	134.1	179.2	-69.3	-51.7	0	0	0	112.4	L134 F135	H125-L134 HydrophobicContact CB-CD2 4.05Å; H125-F135 WeakPolarHBondContact CA-O 3.35Å
126	Y	57.3	Low	52.3	Low	85 Å²	85	97 Å²	97	33%	0.333	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.7	118.2	-179.4	-62.6	-94.7	0	0	0	109.9	I124 L134 F135 Q138	I124-Y126 HydrophobicContact CG2-CE2 4.46Å; Y126-L134 WeakPolarHBondContact O-CA 3.46Å; Y126-F135 PolarHBondContact N-O 3.38Å; Y126-F135 PolarHBondContact O-N 2.83Å; Y126-Q138 HydrophobicContact CD1-CB 4.29Å; Y126-Q138 HydrophobicContact CD1-CG 4.27Å; Y126-Q138 HydrophobicContact CD2-CB 4.49Å; Y126-Q138 HydrophobicContact CE1-CB 3.94Å; Y126-Q138 HydrophobicContact CE1-CG 4Å; Y126-Q138 HydrophobicContact CE2-CB 4.17Å
127	E	65	Low	54.5	Low	76 Å²	76	93.9 Å²	93.9	36%	0.355	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.5	179.7	-156.5	-174.9	140	0	0	112.4	V129 K132 A133 L134 W141	E127-V129 PolarHBondContact O-N 3.39Å; E127-K132 WeakPolarHBondContact OE1-CA 3.34Å; E127-K132 VanDerWaalsContact OE1-CB 3.28Å; E127-K132 WeakPolarHBondContact OE1-CB 3.41Å; E127-K132 VanDerWaalsContact OE1-CG 3.23Å; E127-K132 WeakPolarHBondContact OE1-CG 3.22Å; E127-K132 IonicContact OE1-NZ 2.81Å; E127-K132 PolarHBondContact OE1-NZ 3.08Å; E127-K132 IonicContact OE2-NZ 2.66Å; E127-A133 CarbonylContact C-O 3.59Å; E127-A133 WeakPolarHBondContact CA-O 3.18Å; E127-L134 HydrophobicContact CB-CD2 3.62Å; E127-L134 HydrophobicContact CG-CD2 3.75Å; E127-L134 HydrophobicContact CG-CG 4.18Å; E127-W141 PolarHBondContact O-NE1 3.36Å
128	C	64.4	Low	56.3	Low	5 Å²	5	93.1 Å²	93.1	3%	0.034	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-78.5	116.6	168.1	177.4	0	0	0	0	110	D130 C131 K132 A133 F135 H144	C128-D130 VanDerWaalsContact C-N 3.32Å; C128-D130 PolarHBondContact O-N 3.41Å; C128-C131 PolarHBondContact O-N 3.2Å; C128-C131 VanDerWaalsContact SG-SG 3.65Å; C128-K132 VanDerWaalsContact O-CA 3.24Å; C128-K132 WeakPolarHBondContact O-CA 3.47Å; C128-K132 PolarHBondContact O-N 2.96Å; C128-A133 PolarHBondContact N-O 3.5Å; C128-F135 HydrophobicContact CB-CE2 4.02Å; C128-H144 VanDerWaalsContact SG-CD2 3.54Å; C128-H144 PolarHBondContact SG-NE2 3.45Å
129	V	61.8	Low	58	Low	119 Å²	119	93.8 Å²	93.8	72%	0.721	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-38.8	-173.3	-178.9	0	0	0	0	112.2	E127 C131	E127-V129 PolarHBondContact O-N 3.39Å; V129-C131 PolarHBondContact O-N 3.15Å
130	D	56.1	Low	59.6	Low	127 Å²	127	90.6 Å²	90.6	68%	0.679	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-29.7	-174	-58.9	-61.5	0	0	0	113.9	C128	C128-D130 VanDerWaalsContact C-N 3.32Å; C128-D130 PolarHBondContact O-N 3.41Å
131	C	67.4	Low	62.4	Low	59 Å²	59	87.9 Å²	87.9	40%	0.399	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-12	-172.2	78.4	0	0	0	0	114.9	C128 V129 A133 H144	C128-C131 PolarHBondContact O-N 3.2Å; C128-C131 VanDerWaalsContact SG-SG 3.65Å; V129-C131 PolarHBondContact O-N 3.15Å; C131-A133 VanDerWaalsContact C-N 3.33Å; C131-A133 PolarHBondContact O-N 3.4Å; C131-A133 WeakPolarHBondContact SG-CB 3.24Å; C131-A133 PolarHBondContact SG-N 3.47Å; C131-A133 VanDerWaalsContact SG-N 3.36Å; C131-H144 PolarHBondContact SG-NE2 2.87Å
132	K	76	Confident	64.4	Low	147 Å²	147	86.7 Å²	86.7	64%	0.639	47%	0.466	S	S	*	.			trans	60.1	32.4	-174.9	-54.2	-160.5	142.3	-71.8	0	115.3	E127 C128	E127-K132 WeakPolarHBondContact OE1-CA 3.34Å; E127-K132 VanDerWaalsContact OE1-CB 3.28Å; E127-K132 WeakPolarHBondContact OE1-CB 3.41Å; E127-K132 VanDerWaalsContact OE1-CG 3.23Å; E127-K132 WeakPolarHBondContact OE1-CG 3.22Å; E127-K132 IonicContact OE1-NZ 2.81Å; E127-K132 PolarHBondContact OE1-NZ 3.08Å; E127-K132 IonicContact OE2-NZ 2.66Å; C128-K132 VanDerWaalsContact O-CA 3.24Å; C128-K132 WeakPolarHBondContact O-CA 3.47Å; C128-K132 PolarHBondContact O-N 2.96Å
133	A	65.4	Low	65.9	Low	33 Å²	33	85.6 Å²	85.6	27%	0.273	45%	0.451	S	S	.	.			trans	-80.4	132.4	167	0	0	0	0	0	110.4	E127 C128 C131 F135	E127-A133 CarbonylContact C-O 3.59Å; E127-A133 WeakPolarHBondContact CA-O 3.18Å; C128-A133 PolarHBondContact N-O 3.5Å; C131-A133 VanDerWaalsContact C-N 3.33Å; C131-A133 PolarHBondContact O-N 3.4Å; C131-A133 WeakPolarHBondContact SG-CB 3.24Å; C131-A133 PolarHBondContact SG-N 3.47Å; C131-A133 VanDerWaalsContact SG-N 3.36Å; A133-F135 HydrophobicContact CB-CE2 3.56Å; A133-F135 HydrophobicContact CB-CZ 3.61Å; A133-F135 WeakPolarHBondContact O-CE2 3.42Å
134	L	69.9	Low	67.3	Low	106 Å²	106	83.6 Å²	83.6	56%	0.555	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.1	174.6	-72.7	164.2	0	0	0	109.7	H125 Y126 E127	H125-L134 HydrophobicContact CB-CD2 4.05Å; Y126-L134 WeakPolarHBondContact O-CA 3.46Å; E127-L134 HydrophobicContact CB-CD2 3.62Å; E127-L134 HydrophobicContact CG-CD2 3.75Å; E127-L134 HydrophobicContact CG-CG 4.18Å
135	F	69.5	Low	68.3	Low	40 Å²	40	83.9 Å²	83.9	18%	0.175	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145	-179.2	-59.6	-86.6	0	0	0	110.9	H125 Y126 C128 A133 S137 L140 W141 H144	H125-F135 WeakPolarHBondContact CA-O 3.35Å; Y126-F135 PolarHBondContact N-O 3.38Å; Y126-F135 PolarHBondContact O-N 2.83Å; C128-F135 HydrophobicContact CB-CE2 4.02Å; A133-F135 HydrophobicContact CB-CE2 3.56Å; A133-F135 HydrophobicContact CB-CZ 3.61Å; A133-F135 WeakPolarHBondContact O-CE2 3.42Å; F135-S137 VanDerWaalsContact C-N 3.33Å; F135-L140 HydrophobicContact CB-CB 4.12Å; F135-L140 HydrophobicContact CD1-CB 3.78Å; F135-L140 HydrophobicContact CG-CB 4.26Å; F135-W141 HydrophobicContact CB-CB 4.2Å; F135-W141 HydrophobicContact CD2-CB 3.91Å; F135-W141 AromaticContact CD2-CD1 3.91Å; F135-W141 HydrophobicContact CD2-CG 4.32Å; F135-W141 HydrophobicContact CG-CB 4.18Å; F135-H144 HydrophobicContact CE1-CB 4.04Å; F135-H144 HydrophobicContact CE2-CB 4.15Å; F135-H144 AromaticContact CE2-CD2 3.63Å; F135-H144 AromaticContact CE2-CG 3.97Å; F135-H144 HydrophobicContact CZ-CB 3.57Å; F135-H144 AromaticContact CZ-CD2 3.49Å; F135-H144 VanDerWaalsContact CZ-CD2 3.49Å; F135-H144 WeakPolarHBondContact CZ-CD2 3.5Å; F135-H144 AromaticContact CZ-CG 3.39Å
136	A	67.8	Low	68.8	Low	65 Å²	65	83.6 Å²	83.6	54%	0.537	43%	0.427	S	S	.	.	S	Bend	trans	-82.1	-8.2	179.4	0	0	0	0	0	114
137	S	71.4	Confident	69.1	Low	39 Å²	39	86.1 Å²	86.1	27%	0.273	44%	0.443	S	S	.	.	S	Bend	trans	-145.5	157.9	173.2	71.8	0	0	0	0	111.2	F135 L140 W141	F135-S137 VanDerWaalsContact C-N 3.33Å; S137-L140 PolarHBondContact O-N 3.49Å; S137-L140 WeakPolarHBondContact OG-CG 3.49Å; S137-W141 PolarHBondContact O-N 2.79Å
138	Q	66.5	Low	69.2	Low	105 Å²	105	86.4 Å²	86.4	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-68.4	-33.5	-178.3	-167.5	174.5	0.6	0	0	112.4	Y126 L140 W141 L142	Y126-Q138 HydrophobicContact CD1-CB 4.29Å; Y126-Q138 HydrophobicContact CD1-CG 4.27Å; Y126-Q138 HydrophobicContact CD2-CB 4.49Å; Y126-Q138 HydrophobicContact CE1-CB 3.94Å; Y126-Q138 HydrophobicContact CE1-CG 4Å; Y126-Q138 HydrophobicContact CE2-CB 4.17Å; Q138-L140 PolarHBondContact O-N 3.44Å; Q138-W141 WeakPolarHBondContact O-CB 3.49Å; Q138-W141 PolarHBondContact O-N 3.34Å; Q138-L142 HydrophobicContact CG-CD1 4.39Å; Q138-L142 WeakPolarHBondContact O-CG 3.49Å; Q138-L142 PolarHBondContact O-N 2.87Å
139	E	74.1	Confident	68.6	Low	141 Å²	141	92.2 Å²	92.2	66%	0.659	47%	0.474	S	S	*	.	H	α-helix	trans	-64.9	-38.7	177.8	-61.8	-179.8	124.4	0	0	112.9	W141 L142 N143	E139-W141 VanDerWaalsContact C-N 3.31Å; E139-L142 PolarHBondContact O-N 2.87Å; E139-N143 WeakPolarHBondContact O-CB 3.44Å; E139-N143 PolarHBondContact O-N 3.28Å; E139-N143 PolarHBondContact O-ND2 2.93Å
140	L	73	Confident	67.8	Low	95 Å²	95	96.4 Å²	96.4	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-66.7	-36.6	176	-69	172.3	0	0	0	111.1	F135 S137 Q138 H144	F135-L140 HydrophobicContact CB-CB 4.12Å; F135-L140 HydrophobicContact CD1-CB 3.78Å; F135-L140 HydrophobicContact CG-CB 4.26Å; S137-L140 PolarHBondContact O-N 3.49Å; S137-L140 WeakPolarHBondContact OG-CG 3.49Å; Q138-L140 PolarHBondContact O-N 3.44Å; L140-H144 VanDerWaalsContact O-CB 3.26Å; L140-H144 WeakPolarHBondContact O-CB 3.49Å; L140-H144 PolarHBondContact O-N 3.48Å; L140-H144 VanDerWaalsContact O-N 3.08Å
141	W	84.6	Confident	67.1	Low	56 Å²	56	93.9 Å²	93.9	21%	0.212	47%	0.474	C	S	.	.	H	α-helix	trans	-67.3	-41.6	172.8	179.4	96.2	0	0	0	112.1	E127 F135 S137 Q138 E139 H144 R145	E127-W141 PolarHBondContact O-NE1 3.36Å; F135-W141 HydrophobicContact CB-CB 4.2Å; F135-W141 HydrophobicContact CD2-CB 3.91Å; F135-W141 AromaticContact CD2-CD1 3.91Å; F135-W141 HydrophobicContact CD2-CG 4.32Å; F135-W141 HydrophobicContact CG-CB 4.18Å; S137-W141 PolarHBondContact O-N 2.79Å; Q138-W141 WeakPolarHBondContact O-CB 3.49Å; Q138-W141 PolarHBondContact O-N 3.34Å; E139-W141 VanDerWaalsContact C-N 3.31Å; W141-H144 PolarHBondContact O-N 3.11Å; W141-R145 WeakPolarHBondContact O-CB 3.4Å; W141-R145 PolarHBondContact O-N 3.33Å
142	L	74	Confident	65.5	Low	78 Å²	78	96 Å²	96	41%	0.408	49%	0.485	S	S	.	.	H	α-helix	trans	-65.6	-46.9	176.8	-74.9	171.5	0	0	0	112.6	Q138 E139 H144 R145 Q146	Q138-L142 HydrophobicContact CG-CD1 4.39Å; Q138-L142 WeakPolarHBondContact O-CG 3.49Å; Q138-L142 PolarHBondContact O-N 2.87Å; E139-L142 PolarHBondContact O-N 2.87Å; L142-H144 VanDerWaalsContact C-N 3.29Å; L142-H144 PolarHBondContact O-N 2.95Å; L142-R145 WeakPolarHBondContact O-CB 3.31Å; L142-R145 PolarHBondContact O-N 3.11Å; L142-R145 VanDerWaalsContact O-N 3.13Å; L142-Q146 PolarHBondContact O-N 3.39Å
143	N	71.8	Confident	63.6	Low	99 Å²	99	95 Å²	95	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-60.2	-40.7	174.8	-82.1	-63.8	0	0	0	111.6	E139 Q146 M147	E139-N143 WeakPolarHBondContact O-CB 3.44Å; E139-N143 PolarHBondContact O-N 3.28Å; E139-N143 PolarHBondContact O-ND2 2.93Å; N143-Q146 PolarHBondContact O-N 2.94Å; N143-M147 PolarHBondContact O-N 3.03Å
144	H	74.4	Confident	62.1	Low	46 Å²	46	100.1 Å²	100.1	21%	0.213	52%	0.522	C	S	.	.	H	α-helix	trans	-65.2	-37.8	174	177.3	62.3	0	0	0	112.8	C128 C131 F135 L140 W141 L142 M147 H148	C128-H144 VanDerWaalsContact SG-CD2 3.54Å; C128-H144 PolarHBondContact SG-NE2 3.45Å; C131-H144 PolarHBondContact SG-NE2 2.87Å; F135-H144 HydrophobicContact CE1-CB 4.04Å; F135-H144 HydrophobicContact CE2-CB 4.15Å; F135-H144 AromaticContact CE2-CD2 3.63Å; F135-H144 AromaticContact CE2-CG 3.97Å; F135-H144 HydrophobicContact CZ-CB 3.57Å; F135-H144 AromaticContact CZ-CD2 3.49Å; F135-H144 VanDerWaalsContact CZ-CD2 3.49Å; F135-H144 WeakPolarHBondContact CZ-CD2 3.5Å; F135-H144 AromaticContact CZ-CG 3.39Å; L140-H144 VanDerWaalsContact O-CB 3.26Å; L140-H144 WeakPolarHBondContact O-CB 3.49Å; L140-H144 PolarHBondContact O-N 3.48Å; L140-H144 VanDerWaalsContact O-N 3.08Å; W141-H144 PolarHBondContact O-N 3.11Å; L142-H144 VanDerWaalsContact C-N 3.29Å; L142-H144 PolarHBondContact O-N 2.95Å; H144-M147 WeakPolarHBondContact O-CB 3.39Å; H144-M147 PolarHBondContact O-N 3.08Å; H144-H148 AromaticContact CE1-CD2 3.85Å; H144-H148 AromaticContact CE1-NE2 3.59Å; H144-H148 AromaticContact NE2-CD2 3.82Å; H144-H148 AromaticContact NE2-NE2 3.61Å
145	R	68.4	Low	60.2	Low	131 Å²	131	104.9 Å²	104.9	49%	0.494	54%	0.538	S	S	.	.	H	α-helix	trans	-65.4	-38	174.7	-171.9	176.6	176.2	-165.4	-3	112.3	W141 L142 M147 H148 L149	W141-R145 WeakPolarHBondContact O-CB 3.4Å; W141-R145 PolarHBondContact O-N 3.33Å; L142-R145 WeakPolarHBondContact O-CB 3.31Å; L142-R145 PolarHBondContact O-N 3.11Å; L142-R145 VanDerWaalsContact O-N 3.13Å; R145-M147 VanDerWaalsContact C-N 3.31Å; R145-M147 PolarHBondContact O-N 2.95Å; R145-H148 PolarHBondContact O-N 3.33Å; R145-L149 PolarHBondContact O-N 3.02Å
146	Q	66.3	Low	58.2	Low	104 Å²	104	107.4 Å²	107.4	49%	0.486	57%	0.566	S	S	.	*	H	α-helix	trans	-64.3	-32.3	174.4	-72.7	-170.3	1	0	0	113.1	L142 N143 H148 L149 R150	L142-Q146 PolarHBondContact O-N 3.39Å; N143-Q146 PolarHBondContact O-N 2.94Å; Q146-H148 VanDerWaalsContact C-N 3.27Å; Q146-H148 PolarHBondContact O-N 3.32Å; Q146-L149 PolarHBondContact O-N 3.45Å; Q146-R150 PolarHBondContact O-N 3.49Å; Q146-R150 VanDerWaalsContact O-N 3.07Å
147	M	63.5	Low	56.7	Low	138 Å²	138	110.3 Å²	110.3	68%	0.68	58%	0.58	S	S	*	*	H	α-helix	trans	-62.6	-32.4	174.1	-70.2	-77.7	174	0	0	112.7	N143 H144 R145	N143-M147 PolarHBondContact O-N 3.03Å; H144-M147 WeakPolarHBondContact O-CB 3.39Å; H144-M147 PolarHBondContact O-N 3.08Å; R145-M147 VanDerWaalsContact C-N 3.31Å; R145-M147 PolarHBondContact O-N 2.95Å
148	H	67.1	Low	54.6	Low	82 Å²	82	113 Å²	113	38%	0.38	61%	0.605	S	S	.	*	H	α-helix	trans	-71.9	-36	173.5	-82.3	-87.8	0	0	0	112.5	H144 R145 Q146 A151	H144-H148 AromaticContact CE1-CD2 3.85Å; H144-H148 AromaticContact CE1-NE2 3.59Å; H144-H148 AromaticContact NE2-CD2 3.82Å; H144-H148 AromaticContact NE2-NE2 3.61Å; R145-H148 PolarHBondContact O-N 3.33Å; Q146-H148 VanDerWaalsContact C-N 3.27Å; Q146-H148 PolarHBondContact O-N 3.32Å; H148-A151 PolarHBondContact O-N 3.38Å
149	L	52.4	Low	52.9	Low	126 Å²	126	113.6 Å²	113.6	66%	0.66	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-33	178	-66.1	171.8	0	0	0	113	R145 Q146 A151 T152	R145-L149 PolarHBondContact O-N 3.02Å; Q146-L149 PolarHBondContact O-N 3.45Å; L149-A151 PolarHBondContact O-N 3.44Å; L149-T152 PolarHBondContact O-OG1 2.58Å
150	R	44.7	Very low	50.9	Low	208 Å²	208	113.2 Å²	113.2	79%	0.785	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-1.8	175.9	-69	-175.4	178.3	-175.9	0.5	114.3	Q146	Q146-R150 PolarHBondContact O-N 3.49Å; Q146-R150 VanDerWaalsContact O-N 3.07Å
151	A	41.5	Very low	48.6	Very low	74 Å²	74	114.9 Å²	114.9	61%	0.612	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	2.7	-173.2	0	0	0	0	0	115	H148 L149	H148-A151 PolarHBondContact O-N 3.38Å; L149-A151 PolarHBondContact O-N 3.44Å
152	T	32.7	Very low	45.9	Very low	102 Å²	102	120.1 Å²	120.1	63%	0.626	67%	0.669	S	S	*	*			trans	-97.7	117.9	179.4	51.9	0	0	0	0	111.9	L149 T154	L149-T152 PolarHBondContact O-OG1 2.58Å; T152-T154 PolarHBondContact O-N 3.4Å
153	P	36.9	Very low	43.6	Very low	128 Å²	128	120 Å²	120	83%	0.831	69%	0.687	S	S	*	*			trans	-75.4	108.1	173.4	29.8	-32.4	0	0	0	110.2	K155	P153-K155 PolarHBondContact O-N 2.85Å
154	T	34	Very low	41.6	Very low	140 Å²	140	120.7 Å²	120.7	86%	0.859	70%	0.7	S	S	*	*			trans	-67.8	126.6	171.7	42	0	0	0	0	110.2	T152	T152-T154 PolarHBondContact O-N 3.4Å
155	K	28.8	Very low	39.9	Very low	205 Å²	205	124.2 Å²	124.2	89%	0.891	73%	0.727	S	S	*	*			trans	-117.9	116.4	172.1	-166.8	178.3	-176.7	-176.3	0	109.2	P153	P153-K155 PolarHBondContact O-N 2.85Å
156	A	27.4	Very low	37.8	Very low	93 Å²	93	124.2 Å²	124.2	77%	0.769	74%	0.741	S	S	*	*			trans	-67.6	148.6	-177.9	0	0	0	0	0	112.4
157	P	37.9	Very low	35.7	Very low	127 Å²	127	125.7 Å²	125.7	83%	0.825	76%	0.757	S	S	*	*			trans	-95.6	138.2	179.6	35.9	-32.6	0	0	0	113.2
158	A	26	Very low	33.8	Very low	96 Å²	96	127.2 Å²	127.2	79%	0.793	77%	0.767	S	S	*	*			trans	-166.5	154.1	161.4	0	0	0	0	0	110.3
159	P	32.1	Very low	31.8	Very low	117 Å²	117	127 Å²	127	76%	0.76	79%	0.786	S	S	*	*			cis	-123.4	173.6	-42.1	38.3	-26.9	0	0	0	111.6
160	V	31	Very low	30.5	Very low	132 Å²	132	126.6 Å²	126.6	80%	0.8	80%	0.795	S	S	*	*			trans	-85.8	136.2	168.9	175.7	0	0	0	0	109.6
161	V	25.3	Very low	30.1	Very low	131 Å²	131	122.2 Å²	122.2	79%	0.794	79%	0.793	S	S	*	*			trans	-131.5	132.9	167.3	-179	0	0	0	0	108.9
162	L	27.6	Very low	29.3	Very low	165 Å²	165	125.7 Å²	125.7	86%	0.864	81%	0.806	S	S	*	*			trans	-97.7	147.3	178.8	-67.8	164	0	0	0	110.3
163	G	25.8	Very low	28.9	Very low	75 Å²	75	123.8 Å²	123.8	77%	0.773	81%	0.807	S	S	*	*			trans	168.3	121.6	171.3	0	0	0	0	0	115.5
164	S	29.8	Very low	28.3	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	81%	0.814	S	S	*	*			trans	-146	148.4	163	-63.4	0	0	0	0	106.8
165	P	38.4	Very low	27.8	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	81%	0.809	S	S	*	*				-132	154.7	86	11.3	12.8	0	0	0	112.3
166	V	24.2	Very low	27.6	Very low	131 Å²	131	127.6 Å²	127.6	79%	0.794	81%	0.812	S	S	*	*				59.9	112	67.4	-175.5	0	0	0	0	114.3
167	V	23.4	Very low	27.4	Very low	135 Å²	135	129.6 Å²	129.6	82%	0.818	81%	0.814	S	S	*	*				-167.8	143.8	129.7	139.4	0	0	0	0	112.2
168	L	23.7	Very low	26.7	Very low	170 Å²	170	128.3 Å²	128.3	89%	0.89	81%	0.814	S	S	*	*			trans	-27.1	148.4	174.7	-52.9	166	0	0	0	119.7
169	G	23.4	Very low	26.7	Very low	77 Å²	77	129.9 Å²	129.9	79%	0.794	81%	0.814	S	S	*	*			trans	175.5	111.8	163.6	0	0	0	0	0	117.4
170	S	25.3	Very low	26.3	Very low	119 Å²	119	132.5 Å²	132.5	83%	0.832	82%	0.816	S	S	*	*			trans	-154	156.1	163.2	-79.2	0	0	0	0	106.6
171	P	37	Very low	25.9	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	81%	0.813	S	S	*	*			cis	-147	-171.8	34.6	43.3	-22.8	0	0	0	116.7
172	V	24	Very low	25.9	Very low	147 Å²	147	132.1 Å²	132.1	89%	0.891	81%	0.807	S	S	*	*			trans	35.6	129.2	144.8	172.5	0	0	0	0	120.4
173	G	24.6	Very low	25.7	Very low	62 Å²	62	134 Å²	134	64%	0.639	80%	0.804	S	S	*	*			trans	159.6	103.2	141.1	0	0	0	0	0	120.2
174	Q	25.4	Very low	25.8	Very low	209 Å²	209	141.8 Å²	141.8	98%	0.977	81%	0.81	S	S	*	*			trans	61	-176	147.2	-55.6	-168.5	5.4	0	0	118.5
175	A	22.9	Very low	25.6	Very low	93 Å²	93	144.6 Å²	144.6	77%	0.769	81%	0.808	S	S	*	*			trans	-147.2	153.1	-167.1	0	0	0	0	0	111.7
176	R	24.2	Very low	25.1	Very low	251 Å²	251	143 Å²	143	95%	0.947	81%	0.805	S	S	*	*			trans	-163.9	161.1	134.9	-117	169.5	169.5	166.5	-5.4	112.5
177	V	24	Very low	25.3	Very low	135 Å²	135	143.6 Å²	143.6	82%	0.818	80%	0.799	S	S	*	*			trans	-86.1	132.9	169.7	174.6	0	0	0	0	108.7
178	A	21.7	Very low	25.6	Very low	100 Å²	100	146.6 Å²	146.6	83%	0.826	80%	0.804	S	S	*	*			trans	-144.8	149	154.3	0	0	0	0	0	108
179	V	26.7	Very low	25.8	Very low	130 Å²	130	142.3 Å²	142.3	79%	0.788	80%	0.802	S	S	*	*			trans	-118.2	142.2	-177.7	168.4	0	0	0	0	107.3
180	E	23.8	Very low	26	Very low	172 Å²	172	142.7 Å²	142.7	80%	0.804	81%	0.805	S	S	*	*			trans	-168.3	179.2	137.5	-118.2	-174.2	-171.7	0	0	116.4
181	H	23.8	Very low	26.2	Very low	159 Å²	159	146.8 Å²	146.8	74%	0.736	81%	0.811	S	S	*	*			trans	70	136.5	-175.7	-67.9	-90.5	0	0	0	117
182	S	23.8	Very low	25.8	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	82%	0.816	S	S	*	*			cis	-169.2	178	-13.6	64.2	0	0	0	0	108.3
183	Y	23.4	Very low	26	Very low	204 Å²	204	143.3 Å²	143.3	80%	0.8	82%	0.816	S	S	*	*			cis	-164	-174.2	4	-132	-32.9	0	0	0	109
184	R	28	Very low	26.1	Very low	238 Å²	238	145.3 Å²	145.3	90%	0.898	83%	0.826	S	S	*	*			trans	78.8	120.5	173.3	-55.1	-178.2	176.7	125.2	0.2	115.9
185	K	26.1	Very low	26.1	Very low	174 Å²	174	142 Å²	142	76%	0.757	82%	0.82	S	S	*	*			cis	111.8	104.1	4.6	-161.6	-148.6	-168.3	-147.2	0	115.5	E187	K185-E187 WeakPolarHBondContact CE-OE1 3.41Å; K185-E187 IonicContact NZ-OE1 2.6Å; K185-E187 PolarHBondContact NZ-OE1 3.33Å
186	A	27.2	Very low	27.3	Very low	86 Å²	86	143.2 Å²	143.2	71%	0.711	82%	0.82	S	S	*	*			trans	-156.7	135.7	143.5	0	0	0	0	0	104.7
187	E	29.3	Very low	27.3	Very low	144 Å²	144	137.2 Å²	137.2	67%	0.673	82%	0.816	S	S	*	*				65.5	118.4	53.4	-67.6	167.3	-159.8	0	0	110.8	K185	K185-E187 WeakPolarHBondContact CE-OE1 3.41Å; K185-E187 IonicContact NZ-OE1 2.6Å; K185-E187 PolarHBondContact NZ-OE1 3.33Å
188	E	29.7	Very low	27.5	Very low	197 Å²	197	135.5 Å²	135.5	92%	0.921	82%	0.816	S	S	*	*			cis	-133.8	172.7	1.5	-54.9	175.2	118.1	0	0	107.3
189	G	28.3	Very low	27.6	Very low	81 Å²	81	135.4 Å²	135.4	84%	0.835	82%	0.816	S	S	*	*			cis	141.4	154.7	29.3	0	0	0	0	0	107.4
190	G	27	Very low	27.6	Very low	84 Å²	84	134 Å²	134	87%	0.866	82%	0.818	S	S	*	*			trans	124.5	139.9	171.7	0	0	0	0	0	117
191	E	28.4	Very low	27.7	Very low	205 Å²	205	130.6 Å²	130.6	96%	0.958	82%	0.819	S	S	*	*			trans	-116.9	173.3	-177.5	-58.8	174.1	105.7	0	0	112
192	G	29.3	Very low	27.9	Very low	82 Å²	82	128.7 Å²	128.7	85%	0.845	82%	0.824	S	S	*	*			trans	108.3	133.3	153	0	0	0	0	0	116.3
193	A	28.9	Very low	28.3	Very low	108 Å²	108	130.4 Å²	130.4	89%	0.893	83%	0.83	S	S	*	*			trans	-112.8	132.8	175.4	0	0	0	0	0	111
194	A	25.3	Very low	28.6	Very low	103 Å²	103	129.8 Å²	129.8	85%	0.851	83%	0.834	S	S	*	*			trans	-154.8	154.6	169	0	0	0	0	0	111.7
195	V	26	Very low	28.7	Very low	140 Å²	140	124.8 Å²	124.8	85%	0.848	83%	0.83	S	S	*	*			trans	-151.7	155	-172.7	175.3	0	0	0	0	106.6
196	P	47.4	Very low	28.9	Very low	119 Å²	119	123.1 Å²	123.1	77%	0.773	83%	0.834	S	S	*	*			cis	-120.7	-178	-21.7	38.3	-24.1	0	0	0	112.6
197	S	25.1	Very low	29	Very low	125 Å²	125	122.6 Å²	122.6	87%	0.874	83%	0.83	S	S	*	*				-175.5	165.8	124.2	-163.4	0	0	0	0	110.4
198	A	27.6	Very low	29.2	Very low	98 Å²	98	125 Å²	125	81%	0.81	84%	0.841	S	S	*	*			trans	-126.9	144.4	-171.4	0	0	0	0	0	114
199	A	24.8	Very low	29.3	Very low	99 Å²	99	121.4 Å²	121.4	82%	0.818	83%	0.832	S	S	*	*			trans	-157.2	113.4	158.3	0	0	0	0	0	112.7
200	A	25.8	Very low	29.9	Very low	100 Å²	100	125.8 Å²	125.8	83%	0.826	83%	0.831	S	S	*	*			trans	45.6	127.5	148.1	0	0	0	0	0	123.4
201	A	26.3	Very low	30.5	Very low	100 Å²	100	128 Å²	128	83%	0.826	82%	0.822	S	S	*	*			trans	67.5	134.9	147.2	0	0	0	0	0	118.9
202	S	28.8	Very low	31.3	Very low	120 Å²	120	124.3 Å²	124.3	84%	0.839	81%	0.808	S	S	*	*			cis	-135	154.8	4.2	-73.9	0	0	0	0	111.7
203	T	31.5	Very low	32.2	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	79%	0.791	S	S	*	*			trans	-83	126.2	173.9	48.9	0	0	0	0	112.2
204	E	29.4	Very low	33.4	Very low	190 Å²	190	124 Å²	124	89%	0.888	77%	0.765	S	S	*	*			trans	-124.4	131.6	148.5	-72.1	-161.5	150.1	0	0	109.1
205	V	30.3	Very low	34.8	Very low	134 Å²	134	125.4 Å²	125.4	81%	0.812	75%	0.752	S	S	*	*			trans	-108.1	110.3	179.8	177.7	0	0	0	0	108
206	V	30.4	Very low	36.6	Very low	139 Å²	139	119 Å²	119	84%	0.842	71%	0.714	S	S	*	*			trans	-90	109.6	170	-176.9	0	0	0	0	107.9
207	A	30.2	Very low	36.8	Very low	74 Å²	74	118.4 Å²	118.4	61%	0.612	71%	0.712	S	S	*	*			trans	-74.2	144.1	-178.5	0	0	0	0	0	112.3	V209	A207-V209 PolarHBondContact O-N 3.3Å
208	E	32.9	Very low	38.1	Very low	196 Å²	196	118.6 Å²	118.6	92%	0.916	70%	0.7	S	S	*	*			trans	-68.6	124.8	165.5	-64.7	-174.2	119.9	0	0	109.5
209	V	32	Very low	39.6	Very low	120 Å²	120	116.4 Å²	116.4	73%	0.727	68%	0.678	S	S	*	*			trans	-95.2	99.4	179.6	-179.7	0	0	0	0	109.6	A207 L211	A207-V209 PolarHBondContact O-N 3.3Å; V209-L211 HydrophobicContact CG1-CD2 4.38Å; V209-L211 PolarHBondContact O-N 2.91Å
210	E	39.6	Very low	41.4	Very low	173 Å²	173	115.4 Å²	115.4	81%	0.808	67%	0.665	S	S	*	*			trans	-62.4	115.5	163.9	-71.6	-162.3	123.4	0	0	110	L212	E210-L212 PolarHBondContact O-N 3.45Å
211	L	40.3	Very low	43.1	Very low	132 Å²	132	114.9 Å²	114.9	69%	0.691	65%	0.645	S	S	*	*			trans	-76.8	86.8	177.7	-71.6	173.3	0	0	0	110.8	V209 L213	V209-L211 HydrophobicContact CG1-CD2 4.38Å; V209-L211 PolarHBondContact O-N 2.91Å; L211-L213 PolarHBondContact O-N 3.48Å; L211-L213 VanDerWaalsContact O-N 3.08Å
212	L	45.5	Very low	44.8	Very low	126 Å²	126	115.1 Å²	115.1	66%	0.66	63%	0.632	S	S	*	*			trans	-56.2	109	173.7	-72.1	170.5	0	0	0	111.6	E210 Y214	E210-L212 PolarHBondContact O-N 3.45Å; L212-Y214 WeakPolarHBondContact O-CE2 3.49Å
213	L	48.6	Very low	46.6	Very low	93 Å²	93	111.1 Å²	111.1	49%	0.487	60%	0.6	S	S	.	*			trans	-92.8	115.9	179.3	-77	165.7	0	0	0	111.4	L211 K215 L222 Q224	L211-L213 PolarHBondContact O-N 3.48Å; L211-L213 VanDerWaalsContact O-N 3.08Å; L213-K215 PolarHBondContact O-N 3.25Å; L213-L222 HydrophobicContact CB-CD2 4.47Å; L213-Q224 HydrophobicContact CD2-CB 4.45Å; L213-Q224 HydrophobicContact CD2-CG 3.47Å; L213-Q224 VanDerWaalsContact CD2-CG 3.47Å
214	Y	53.5	Low	48.1	Very low	90 Å²	90	111.6 Å²	111.6	35%	0.353	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.8	120.1	-179.9	-63.5	-91.8	0	0	0	110.6	L212 L222 F223 P226	L212-Y214 WeakPolarHBondContact O-CE2 3.49Å; Y214-L222 CarbonylContact O-C 3.54Å; Y214-L222 WeakPolarHBondContact O-CA 3.41Å; Y214-F223 PolarHBondContact N-O 3.38Å; Y214-F223 PolarHBondContact O-N 3.2Å; Y214-P226 HydrophobicContact CD2-CG 4.46Å; Y214-P226 HydrophobicContact CE1-CG 4.41Å; Y214-P226 HydrophobicContact CE2-CG 3.79Å
215	K	53.9	Low	49.8	Very low	133 Å²	133	107.1 Å²	107.1	58%	0.578	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.9	118.6	-175.2	-173.2	-179.4	176.2	-172	0	111.8	L213 S217 Q221 L222	L213-K215 PolarHBondContact O-N 3.25Å; K215-S217 PolarHBondContact O-N 3Å; K215-Q221 WeakPolarHBondContact CA-O 3.28Å; K215-L222 HydrophobicContact CB-CD2 3.6Å; K215-L222 HydrophobicContact CD-CD2 4.19Å; K215-L222 HydrophobicContact CG-CD2 3.73Å
216	C	63.9	Low	50.8	Low	5 Å²	5	103.6 Å²	103.6	3%	0.034	55%	0.554	C	S	.	*			trans	-69.8	122	175.3	179.3	0	0	0	0	110.8	E218 C219 S220 Q221 F223 F229	C216-E218 VanDerWaalsContact C-N 3.33Å; C216-E218 PolarHBondContact O-N 2.9Å; C216-C219 VanDerWaalsContact CB-SG 3.52Å; C216-C219 VanDerWaalsContact SG-SG 3.61Å; C216-S220 WeakPolarHBondContact O-CA 3.23Å; C216-S220 PolarHBondContact O-N 2.91Å; C216-Q221 PolarHBondContact N-O 3.42Å; C216-F223 HydrophobicContact CB-CE2 4.35Å; C216-F229 HydrophobicContact CB-CE2 4.31Å
217	S	51.6	Low	52.3	Low	107 Å²	107	100 Å²	100	75%	0.748	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.3	-178.6	52.6	0	0	0	0	113.7	K215	K215-S217 PolarHBondContact O-N 3Å
218	E	53.3	Low	54	Low	130 Å²	130	100 Å²	100	61%	0.607	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-29.6	-178.4	-60.1	-143.6	168	0	0	114.1	C216	C216-E218 VanDerWaalsContact C-N 3.33Å; C216-E218 PolarHBondContact O-N 2.9Å
219	C	59.8	Low	55.6	Low	51 Å²	51	92.6 Å²	92.6	35%	0.345	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-12.8	-174.8	81	0	0	0	0	115.1	C216 Q221 H232	C216-C219 VanDerWaalsContact CB-SG 3.52Å; C216-C219 VanDerWaalsContact SG-SG 3.61Å; C219-Q221 VanDerWaalsContact C-N 3.27Å; C219-Q221 PolarHBondContact O-N 3.48Å; C219-Q221 VanDerWaalsContact SG-CB 3.59Å; C219-Q221 PolarHBondContact SG-N 3.22Å; C219-H232 PolarHBondContact SG-NE2 2.83Å
220	S	62.5	Low	57.2	Low	78 Å²	78	91.9 Å²	91.9	55%	0.545	49%	0.485	S	S	.	.			trans	60.2	21.1	-174.5	-63.1	0	0	0	0	116.6	C216	C216-S220 WeakPolarHBondContact O-CA 3.23Å; C216-S220 PolarHBondContact O-N 2.91Å
221	Q	60.6	Low	58.6	Low	90 Å²	90	90.9 Å²	90.9	42%	0.421	48%	0.48	S	S	.	.			trans	-73	150.3	165.6	-69.3	-180	-36.5	0	0	111	K215 C216 C219 F223 H232	K215-Q221 WeakPolarHBondContact CA-O 3.28Å; C216-Q221 PolarHBondContact N-O 3.42Å; C219-Q221 VanDerWaalsContact C-N 3.27Å; C219-Q221 PolarHBondContact O-N 3.48Å; C219-Q221 VanDerWaalsContact SG-CB 3.59Å; C219-Q221 PolarHBondContact SG-N 3.22Å; Q221-F223 HydrophobicContact CB-CE2 3.64Å; Q221-F223 HydrophobicContact CB-CZ 3.84Å; Q221-H232 PolarHBondContact OE1-CE1 3.42Å
222	L	62.9	Low	60.1	Low	105 Å²	105	86 Å²	86	55%	0.55	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.6	-179.6	-64.8	171.6	0	0	0	109.7	L213 Y214 K215	L213-L222 HydrophobicContact CB-CD2 4.47Å; Y214-L222 CarbonylContact O-C 3.54Å; Y214-L222 WeakPolarHBondContact O-CA 3.41Å; K215-L222 HydrophobicContact CB-CD2 3.6Å; K215-L222 HydrophobicContact CD-CD2 4.19Å; K215-L222 HydrophobicContact CG-CD2 3.73Å
223	F	65.9	Low	60.9	Low	36 Å²	36	84.4 Å²	84.4	16%	0.158	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141	-177.3	-60.3	-90.4	0	0	0	110.1	Y214 C216 Q221 D228 F229 H232	Y214-F223 PolarHBondContact N-O 3.38Å; Y214-F223 PolarHBondContact O-N 3.2Å; C216-F223 HydrophobicContact CB-CE2 4.35Å; Q221-F223 HydrophobicContact CB-CE2 3.64Å; Q221-F223 HydrophobicContact CB-CZ 3.84Å; F223-D228 HydrophobicContact CD1-CB 3.84Å; F223-F229 HydrophobicContact CB-CB 4.09Å; F223-F229 HydrophobicContact CD2-CB 4.34Å; F223-F229 HydrophobicContact CD2-CD2 4.07Å; F223-F229 HydrophobicContact CG-CB 4.28Å; F223-H232 HydrophobicContact CE1-CB 4.11Å; F223-H232 HydrophobicContact CE2-CB 4.21Å; F223-H232 AromaticContact CE2-CG 3.9Å; F223-H232 HydrophobicContact CZ-CB 3.72Å; F223-H232 AromaticContact CZ-CD2 3.99Å; F223-H232 AromaticContact CZ-CG 3.44Å; F223-H232 VanDerWaalsContact CZ-CG 3.44Å; F223-H232 AromaticContact CZ-ND1 3.56Å
224	Q	63.6	Low	61.5	Low	141 Å²	141	82.8 Å²	82.8	66%	0.659	44%	0.443	S	S	*	.	S	Bend	trans	-87.7	-13.3	179.3	-74.5	175.7	-40.7	0	0	113.2	L213	L213-Q224 HydrophobicContact CD2-CB 4.45Å; L213-Q224 HydrophobicContact CD2-CG 3.47Å; L213-Q224 VanDerWaalsContact CD2-CG 3.47Å
225	L	64.8	Low	62.2	Low	97 Å²	97	82.3 Å²	82.3	51%	0.508	45%	0.45	S	S	.	.	S	Bend	trans	-126.3	139.6	-178.6	-62.5	175.1	0	0	0	110.8	A227 F229	L225-A227 VanDerWaalsContact C-N 3.25Å; L225-A227 PolarHBondContact O-N 3.47Å; L225-F229 PolarHBondContact O-N 2.85Å
226	P	49.8	Very low	62.6	Low	60 Å²	60	79.1 Å²	79.1	39%	0.39	44%	0.437	S	S	.	.	H	α-helix	trans	-61.3	-31.3	175.3	-22.5	31.7	0	0	0	113.7	Y214 F229 L230	Y214-P226 HydrophobicContact CD2-CG 4.46Å; Y214-P226 HydrophobicContact CE1-CG 4.41Å; Y214-P226 HydrophobicContact CE2-CG 3.79Å; P226-F229 WeakPolarHBondContact O-CB 3.31Å; P226-F229 PolarHBondContact O-N 3.48Å; P226-L230 WeakPolarHBondContact O-CB 3.48Å; P226-L230 WeakPolarHBondContact O-CG 3.22Å; P226-L230 PolarHBondContact O-N 3.47Å
227	A	62.9	Low	61.9	Low	64 Å²	64	86.1 Å²	86.1	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-53.2	-179.3	0	0	0	0	0	111.6	L225 F229 L230 E231	L225-A227 VanDerWaalsContact C-N 3.25Å; L225-A227 PolarHBondContact O-N 3.47Å; A227-F229 PolarHBondContact O-N 3.36Å; A227-L230 PolarHBondContact O-N 2.87Å; A227-L230 VanDerWaalsContact O-N 3.07Å; A227-E231 PolarHBondContact O-N 3.29Å
228	D	65.7	Low	61.3	Low	74 Å²	74	86.2 Å²	86.2	40%	0.396	47%	0.465	S	S	.	.	H	α-helix	trans	-56.6	-38.2	176.1	-52.5	-9.2	0	0	0	111.7	F223 H232	F223-D228 HydrophobicContact CD1-CB 3.84Å; D228-H232 WeakPolarHBondContact O-CB 3.41Å; D228-H232 PolarHBondContact O-N 2.88Å
229	F	67.1	Low	60.7	Low	40 Å²	40	84.6 Å²	84.6	18%	0.175	47%	0.474	C	S	.	.	H	α-helix	trans	-65.6	-42.9	176.4	172.2	-94.9	0	0	0	112.3	C216 F223 L225 P226 A227 H232 Q233	C216-F229 HydrophobicContact CB-CE2 4.31Å; F223-F229 HydrophobicContact CB-CB 4.09Å; F223-F229 HydrophobicContact CD2-CB 4.34Å; F223-F229 HydrophobicContact CD2-CD2 4.07Å; F223-F229 HydrophobicContact CG-CB 4.28Å; L225-F229 PolarHBondContact O-N 2.85Å; P226-F229 WeakPolarHBondContact O-CB 3.31Å; P226-F229 PolarHBondContact O-N 3.48Å; A227-F229 PolarHBondContact O-N 3.36Å; F229-H232 PolarHBondContact O-N 2.56Å; F229-Q233 WeakPolarHBondContact O-CB 3.5Å; F229-Q233 PolarHBondContact O-N 3.48Å
230	L	65.1	Low	59.4	Low	104 Å²	104	88.7 Å²	88.7	55%	0.545	50%	0.497	S	S	.	.	H	α-helix	trans	-70.4	-43.2	178.1	-76.5	164.4	0	0	0	112.3	P226 A227 H232 Q233 A234	P226-L230 WeakPolarHBondContact O-CB 3.48Å; P226-L230 WeakPolarHBondContact O-CG 3.22Å; P226-L230 PolarHBondContact O-N 3.47Å; A227-L230 PolarHBondContact O-N 2.87Å; A227-L230 VanDerWaalsContact O-N 3.07Å; L230-H232 VanDerWaalsContact C-N 3.32Å; L230-H232 PolarHBondContact O-N 3.21Å; L230-Q233 PolarHBondContact O-N 3.38Å; L230-A234 PolarHBondContact O-N 3.38Å
231	E	69.3	Low	58.1	Low	152 Å²	152	90.5 Å²	90.5	71%	0.71	51%	0.507	S	S	*	.	H	α-helix	trans	-58.9	-45.9	171	-75.5	-157.2	148.9	0	0	110.8	A227 Q233 A234 T235	A227-E231 PolarHBondContact O-N 3.29Å; E231-Q233 VanDerWaalsContact C-N 3.32Å; E231-Q233 PolarHBondContact O-N 3.05Å; E231-A234 WeakPolarHBondContact O-CB 3.25Å; E231-A234 PolarHBondContact O-N 3.08Å; E231-T235 WeakPolarHBondContact O-CG2 3.27Å; E231-T235 PolarHBondContact O-N 3.05Å
232	H	72	Confident	56.7	Low	31 Å²	31	95.4 Å²	95.4	14%	0.144	53%	0.53	C	S	.	.	H	α-helix	trans	-58.9	-43.6	175.7	-179.1	85.5	0	0	0	111.9	C219 Q221 F223 D228 F229 L230 A234 T235 H236	C219-H232 PolarHBondContact SG-NE2 2.83Å; Q221-H232 PolarHBondContact OE1-CE1 3.42Å; F223-H232 HydrophobicContact CE1-CB 4.11Å; F223-H232 HydrophobicContact CE2-CB 4.21Å; F223-H232 AromaticContact CE2-CG 3.9Å; F223-H232 HydrophobicContact CZ-CB 3.72Å; F223-H232 AromaticContact CZ-CD2 3.99Å; F223-H232 AromaticContact CZ-CG 3.44Å; F223-H232 VanDerWaalsContact CZ-CG 3.44Å; F223-H232 AromaticContact CZ-ND1 3.56Å; D228-H232 WeakPolarHBondContact O-CB 3.41Å; D228-H232 PolarHBondContact O-N 2.88Å; F229-H232 PolarHBondContact O-N 2.56Å; L230-H232 VanDerWaalsContact C-N 3.32Å; L230-H232 PolarHBondContact O-N 3.21Å; H232-A234 VanDerWaalsContact C-N 3.34Å; H232-A234 PolarHBondContact O-N 3.2Å; H232-T235 WeakPolarHBondContact O-CB 3.32Å; H232-T235 PolarHBondContact O-N 3.49Å; H232-T235 VanDerWaalsContact O-N 3.11Å; H232-T235 PolarHBondContact O-OG1 3.2Å; H232-H236 AromaticContact CD2-NE2 3.5Å; H232-H236 PolarHBondContact CD2-NE2 2.91Å; H232-H236 AromaticContact CE1-NE2 3.8Å; H232-H236 AromaticContact NE2-CE1 3.79Å; H232-H236 AromaticContact NE2-NE2 2.98Å; H232-H236 PolarHBondContact NE2-NE2 3.41Å; H232-H236 PolarHBondContact O-CD2 3.42Å
233	Q	61.2	Low	55.2	Low	92 Å²	92	95 Å²	95	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-61.6	-41.8	178.3	-168	172.1	15.2	0	0	111.7	F229 L230 E231 T235 H236	F229-Q233 WeakPolarHBondContact O-CB 3.5Å; F229-Q233 PolarHBondContact O-N 3.48Å; L230-Q233 PolarHBondContact O-N 3.38Å; E231-Q233 VanDerWaalsContact C-N 3.32Å; E231-Q233 PolarHBondContact O-N 3.05Å; Q233-T235 PolarHBondContact O-N 3.16Å; Q233-H236 PolarHBondContact O-N 2.99Å; Q233-H236 VanDerWaalsContact O-N 3.14Å
234	A	63.1	Low	53.5	Low	59 Å²	59	98.2 Å²	98.2	49%	0.488	58%	0.575	S	S	.	*	H	α-helix	trans	-60.7	-26.6	174.7	0	0	0	0	0	113.1	L230 E231 H232 H236 F237	L230-A234 PolarHBondContact O-N 3.38Å; E231-A234 WeakPolarHBondContact O-CB 3.25Å; E231-A234 PolarHBondContact O-N 3.08Å; H232-A234 VanDerWaalsContact C-N 3.34Å; H232-A234 PolarHBondContact O-N 3.2Å; A234-H236 PolarHBondContact O-N 3.27Å; A234-F237 CarbonylContact O-C 3.59Å; A234-F237 PolarHBondContact O-N 3.5Å
235	T	68.1	Low	51.9	Low	79 Å²	79	100.4 Å²	100.4	49%	0.485	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.8	-15.4	176.5	74.9	0	0	0	0	114.8	E231 H232 Q233	E231-T235 WeakPolarHBondContact O-CG2 3.27Å; E231-T235 PolarHBondContact O-N 3.05Å; H232-T235 WeakPolarHBondContact O-CB 3.32Å; H232-T235 PolarHBondContact O-N 3.49Å; H232-T235 VanDerWaalsContact O-N 3.11Å; H232-T235 PolarHBondContact O-OG1 3.2Å; Q233-T235 PolarHBondContact O-N 3.16Å
236	H	62.3	Low	50.5	Low	67 Å²	67	101.8 Å²	101.8	31%	0.31	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	-25.6	173.9	-56.9	-73.2	0	0	0	112.3	H232 Q233 A234	H232-H236 AromaticContact CD2-NE2 3.5Å; H232-H236 PolarHBondContact CD2-NE2 2.91Å; H232-H236 AromaticContact CE1-NE2 3.8Å; H232-H236 AromaticContact NE2-CE1 3.79Å; H232-H236 AromaticContact NE2-NE2 2.98Å; H232-H236 PolarHBondContact NE2-NE2 3.41Å; H232-H236 PolarHBondContact O-CD2 3.42Å; Q233-H236 PolarHBondContact O-N 2.99Å; Q233-H236 VanDerWaalsContact O-N 3.14Å; A234-H236 PolarHBondContact O-N 3.27Å
237	F	48.4	Very low	49.4	Very low	151 Å²	151	103.9 Å²	103.9	66%	0.662	62%	0.622	S	S	*	*	S	Bend	trans	-132.9	76.2	-179.6	-66.9	-85.5	0	0	0	111.3	A234 A239	A234-F237 CarbonylContact O-C 3.59Å; A234-F237 PolarHBondContact O-N 3.5Å; F237-A239 PolarHBondContact O-N 2.62Å
238	P	39.9	Very low	47.7	Very low	110 Å²	110	109.4 Å²	109.4	71%	0.714	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-65.5	126.1	175.4	27.5	-34	0	0	0	110.5
239	A	39.1	Very low	45.9	Very low	95 Å²	95	114.3 Å²	114.3	79%	0.785	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-62.3	149.1	174.2	0	0	0	0	0	111.6	F237	F237-A239 PolarHBondContact O-N 2.62Å
240	V	32.7	Very low	44.1	Very low	137 Å²	137	119.7 Å²	119.7	83%	0.83	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-75.5	127.8	167.6	-178.4	0	0	0	0	107.3	E242	V240-E242 PolarHBondContact O-N 3.37Å
241	P	35.9	Very low	42.4	Very low	116 Å²	116	122.1 Å²	122.1	75%	0.753	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.6	131.7	177.9	28.3	-33.7	0	0	0	110.5
242	E	32.1	Very low	40.4	Very low	193 Å²	193	120.5 Å²	120.5	90%	0.902	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.2	143.9	167	-69	174.2	108.6	0	0	110.3	V240	V240-E242 PolarHBondContact O-N 3.37Å
243	A	30.3	Very low	38.2	Very low	98 Å²	98	126.9 Å²	126.9	81%	0.81	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-81.3	119.7	174	0	0	0	0	0	109.3	E245	A243-E245 PolarHBondContact O-N 3.36Å
244	A	29.9	Very low	36.6	Very low	103 Å²	103	129.7 Å²	129.7	85%	0.851	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-71.8	122.9	174.6	0	0	0	0	0	110.8
245	E	31.4	Very low	35.5	Very low	186 Å²	186	132.4 Å²	132.4	87%	0.869	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-74.5	147.4	169	-67.5	-158.2	133.1	0	0	111.5	A243	A243-E245 PolarHBondContact O-N 3.36Å
246	P	33.9	Very low	33.5	Very low	127 Å²	127	133.5 Å²	133.5	83%	0.825	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-83.5	140.4	-177.9	33.2	-34.5	0	0	0	112.5
247	A	26.9	Very low	32.9	Very low	103 Å²	103	135.7 Å²	135.7	85%	0.851	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-73.7	137.3	179.8	0	0	0	0	0	113.5
248	L	26.9	Very low	31.8	Very low	180 Å²	180	133.5 Å²	133.5	94%	0.942	79%	0.788	S	S	*	*			trans	-119.1	160.7	162.4	-146.9	73	0	0	0	109.4
249	K	29.4	Very low	31.3	Very low	177 Å²	177	136.8 Å²	136.8	77%	0.77	79%	0.794	S	S	*	*			trans	-105.4	144	-166.5	-62.6	-177.4	177.7	-178.4	0	114
250	Q	28.8	Very low	30.7	Very low	154 Å²	154	138.7 Å²	138.7	72%	0.72	80%	0.795	S	S	*	*			trans	66.2	151.7	158.3	-68.3	158.4	-103.4	0	0	114.6
251	E	28.7	Very low	31	Very low	154 Å²	154	138 Å²	138	72%	0.72	79%	0.794	S	S	*	*			cis	-147.4	175.9	12.7	-143.8	138.2	-123	0	0	113.2
252	T	26.8	Very low	30.7	Very low	118 Å²	118	136.9 Å²	136.9	72%	0.724	79%	0.794	S	S	*	*			trans	-42.5	138	-174.2	53.1	0	0	0	0	120.3
253	L	26	Very low	30.4	Very low	165 Å²	165	133.6 Å²	133.6	86%	0.864	79%	0.793	S	S	*	*				-174.2	176.7	110.7	-129.5	69.3	0	0	0	114.5
254	I	27.8	Very low	30.5	Very low	151 Å²	151	136.6 Å²	136.6	77%	0.774	79%	0.794	S	S	*	*			trans	-133	153.5	-178	-80.2	171.9	0	0	0	106.3
255	P	39.9	Very low	30.6	Very low	116 Å²	116	137.5 Å²	137.5	75%	0.753	79%	0.791	S	S	*	*			cis	-136.3	-172.9	24.1	30	-4.9	0	0	0	117.6
256	S	26.7	Very low	30.5	Very low	103 Å²	103	137 Å²	137	72%	0.72	79%	0.789	S	S	*	*			trans	-71.8	-175.8	158.7	57.9	0	0	0	0	112.7
257	P	49.9	Very low	30.8	Very low	112 Å²	112	136.7 Å²	136.7	73%	0.727	79%	0.787	S	S	*	*			cis	-125.3	-141.6	6.6	28.7	-0.8	0	0	0	112.3
258	T	25.9	Very low	31.1	Very low	105 Å²	105	139.6 Å²	139.6	64%	0.644	79%	0.787	S	S	*	*			cis	-161.9	168.6	13.3	-21.8	0	0	0	0	113.2
259	E	28.2	Very low	31.3	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	78%	0.783	S	S	*	*			trans	82.5	139.7	146.3	-92	150	-125.2	0	0	124.3
260	V	25.9	Very low	31.2	Very low	134 Å²	134	133.1 Å²	133.1	81%	0.812	78%	0.782	S	S	*	*			trans	-110.1	179.2	172.5	-120.9	0	0	0	0	106.6
261	P	40.7	Very low	31.3	Very low	123 Å²	123	131.1 Å²	131.1	80%	0.799	79%	0.785	S	S	*	*			cis	-143.7	-176.4	26.8	42.9	-21.2	0	0	0	118.1
262	A	28.1	Very low	31.1	Very low	92 Å²	92	131.4 Å²	131.4	76%	0.76	79%	0.791	S	S	*	*			trans	-57.4	166.7	179.5	0	0	0	0	0	118.7
263	S	26.4	Very low	31.3	Very low	124 Å²	124	133.9 Å²	133.9	87%	0.867	79%	0.794	S	S	*	*			trans	-158.4	153.6	139.9	20.1	0	0	0	0	112.1
264	L	32.3	Very low	31.3	Very low	161 Å²	161	131.3 Å²	131.3	84%	0.843	79%	0.791	S	S	*	*			trans	-119.3	148.2	172.7	-101.8	162.4	0	0	0	107.8
265	P	33	Very low	31.3	Very low	122 Å²	122	134.4 Å²	134.4	79%	0.792	79%	0.794	S	S	*	*				-151.6	174.5	103.3	39.1	-21.6	0	0	0	116.3
266	E	28.7	Very low	30.5	Very low	177 Å²	177	136.9 Å²	136.9	83%	0.827	80%	0.795	S	S	*	*			trans	-83.8	-176.9	166.1	-48.4	-176.5	116.6	0	0	111
267	P	40.1	Very low	30.7	Very low	120 Å²	120	139.9 Å²	139.9	78%	0.779	80%	0.803	S	S	*	*			cis	-132.3	-169.6	-2.1	40	-20	0	0	0	115.4
268	L	32	Very low	29.5	Very low	163 Å²	163	145.5 Å²	145.5	85%	0.853	81%	0.809	S	S	*	*			trans	-72.5	160	-177.8	-58.8	171.7	0	0	0	114.2
269	P	31.3	Very low	29.7	Very low	130 Å²	130	147.6 Å²	147.6	84%	0.844	82%	0.816	S	S	*	*				-132.5	-176.3	98.4	39.5	-31.6	0	0	0	113.9
270	A	27.8	Very low	29.7	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	82%	0.817	S	S	*	*			trans	-113.2	147.9	-168.6	0	0	0	0	0	114.3
271	S	30.4	Very low	29.9	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	82%	0.822	S	S	*	*			trans	167.8	157	133.4	42.9	0	0	0	0	113.1
272	D	25.2	Very low	29.2	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	82%	0.823	S	S	*	*			trans	65.4	164.5	160.6	-69.8	3	0	0	0	122.3
273	H	32	Very low	29.2	Very low	170 Å²	170	145 Å²	145	79%	0.787	82%	0.824	S	S	*	*			trans	-112	138	-158.7	-78.4	-104.5	0	0	0	111.8
274	S	25.8	Very low	29.3	Very low	112 Å²	112	146 Å²	146	78%	0.783	83%	0.825	S	S	*	*			trans	-143.6	165.9	152.7	69.2	0	0	0	0	111.3
275	Y	26.3	Very low	29.1	Very low	216 Å²	216	141.8 Å²	141.8	85%	0.847	82%	0.82	S	S	*	*			trans	-128.9	136.7	172.8	50.4	-89.8	0	0	0	106.9
276	E	24.7	Very low	29	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	83%	0.827	S	S	*	*			trans	-131.3	124.9	168.4	-71.3	-156.3	156.4	0	0	110.7
277	L	29.9	Very low	29	Very low	167 Å²	167	146.3 Å²	146.3	87%	0.874	83%	0.825	S	S	*	*			trans	-103.1	93.2	165.7	-83.2	167.8	0	0	0	107.5	N279	L277-N279 PolarHBondContact O-N 3.25Å
278	R	25.8	Very low	28.6	Very low	230 Å²	230	150.8 Å²	150.8	87%	0.868	83%	0.827	S	S	*	*			trans	-86.6	88.2	-178.1	-165.4	172.8	-175.4	-176.8	1.5	111.2
279	N	30.1	Very low	28.6	Very low	148 Å²	148	154.9 Å²	154.9	79%	0.791	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-66.4	133.5	163.6	-71.6	-25.2	0	0	0	109.5	L277	L277-N279 PolarHBondContact O-N 3.25Å
280	G	27.2	Very low	28.4	Very low	82 Å²	82	152.3 Å²	152.3	85%	0.845	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-94.1	127	170.3	0	0	0	0	0	110.8
281	E	29.6	Very low	28.5	Very low	197 Å²	197	159.8 Å²	159.8	92%	0.921	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-90.1	153.4	-179.5	-59.4	178.9	114.7	0	0	112.6
282	A	26.8	Very low	28.6	Very low	101 Å²	101	164 Å²	164	84%	0.835	84%	0.84	S	S	*	*			trans	-147.6	127.1	153	0	0	0	0	0	109.7
283	A	28.1	Very low	29.1	Very low	94 Å²	94	162 Å²	162	78%	0.777	84%	0.837	S	S	*	*			trans	-76.2	170.9	171.1	0	0	0	0	0	109.8
284	V	28.4	Very low	28.7	Very low	146 Å²	146	165.1 Å²	165.1	89%	0.885	84%	0.841	S	S	*	*				-162.9	154.6	50.2	167	0	0	0	0	109.7
285	G	27.2	Very low	29	Very low	72 Å²	72	170.8 Å²	170.8	74%	0.742	85%	0.846	S	S	*	*			trans	129.9	127.7	151.8	0	0	0	0	0	116.2
286	R	31.7	Very low	29	Very low	246 Å²	246	167.3 Å²	167.3	93%	0.928	85%	0.847	S	S	*	*			trans	-99.4	147.2	165.8	-59.9	173	178.8	159.5	-0.6	108.3
287	D	27.7	Very low	29.1	Very low	149 Å²	149	167.3 Å²	167.3	80%	0.797	85%	0.852	S	S	*	*				-172.2	177.9	98.5	-132.9	-41.2	0	0	0	114.6
288	R	31.9	Very low	29	Very low	214 Å²	214	165.4 Å²	165.4	81%	0.808	85%	0.853	S	S	*	*			trans	-100	129.5	-171.6	-59.6	164.2	167.7	172.2	-5.2	113.6
289	R	32.6	Very low	29.1	Very low	248 Å²	248	158 Å²	158	94%	0.936	85%	0.848	S	S	*	*				178.1	158	123.9	-100	159.4	-79.8	-159	-1	110.8
290	G	27.9	Very low	29	Very low	76 Å²	76	160.4 Å²	160.4	78%	0.784	86%	0.855	S	S	*	*			trans	-126.4	157	-174.4	0	0	0	0	0	114.6
291	R	29.5	Very low	29.2	Very low	249 Å²	249	162.2 Å²	162.2	94%	0.94	85%	0.854	S	S	*	*			trans	-155.3	142.4	161.9	-105	-177.1	177.3	-152.8	-0.8	109.7
292	K	32.1	Very low	29.1	Very low	200 Å²	200	156.7 Å²	156.7	87%	0.87	85%	0.851	S	S	*	*			trans	-81.2	149.3	157.3	-66.2	177.9	176.1	175.2	0	107.4
293	P	35	Very low	29.2	Very low	119 Å²	119	155.6 Å²	155.6	77%	0.773	85%	0.849	S	S	*	*				-154.8	156.5	88.6	39.9	-20.9	0	0	0	118.5
294	R	24.9	Very low	29.3	Very low	234 Å²	234	157.7 Å²	157.7	88%	0.883	85%	0.852	S	S	*	*			trans	58.5	106.7	134.7	-163.4	178.3	-165.4	171.4	4	122
295	R	31.1	Very low	29.6	Very low	232 Å²	232	155.6 Å²	155.6	88%	0.875	85%	0.851	S	S	*	*			trans	11.2	130.4	143.4	-70.8	-175.3	173.4	-167.7	-1.3	120.3
296	T	25.8	Very low	29.9	Very low	143 Å²	143	156.6 Å²	156.6	88%	0.877	84%	0.842	S	S	*	*				-140.1	168.7	128.2	40.7	0	0	0	0	109.7
297	N	28.7	Very low	30.5	Very low	166 Å²	166	153.3 Å²	153.3	89%	0.888	84%	0.838	S	S	*	*			trans	-104	128.1	176.5	-83.1	4.5	0	0	0	111.3
298	S	26.8	Very low	31.3	Very low	128 Å²	128	151.4 Å²	151.4	90%	0.895	82%	0.824	S	S	*	*			trans	-150.3	152.3	143.3	50.8	0	0	0	0	106.9
299	G	28.5	Very low	32.3	Very low	74 Å²	74	144 Å²	144	76%	0.763	80%	0.8	S	S	*	*			trans	-117.7	143.2	-174.8	0	0	0	0	0	111.5
300	E	26.8	Very low	33.3	Very low	199 Å²	199	138.3 Å²	138.3	93%	0.93	78%	0.782	S	S	*	*			trans	-155.4	167.2	166.9	-131.3	158.8	-151.4	0	0	111.7
301	S	32.3	Very low	34.7	Very low	119 Å²	119	134.7 Å²	134.7	83%	0.832	75%	0.745	S	S	*	*			trans	-88.6	126.4	-169	50.7	0	0	0	0	113.5
302	G	27.1	Very low	35.5	Very low	82 Å²	82	127.8 Å²	127.8	85%	0.845	74%	0.735	S	S	*	*			trans	-102.8	105.9	166.7	0	0	0	0	0	111.7
303	G	28.1	Very low	36.3	Very low	78 Å²	78	121.5 Å²	121.5	80%	0.804	72%	0.72	S	S	*	*			trans	-78.9	132.8	171.4	0	0	0	0	0	111.4	A305	G303-A305 PolarHBondContact O-N 3.13Å
304	T	30.9	Very low	37.3	Very low	137 Å²	137	118.1 Å²	118.1	84%	0.84	70%	0.699	S	S	*	*			trans	-82.3	111	169.3	41.1	0	0	0	0	108.8	T306	T304-T306 PolarHBondContact O-N 2.84Å
305	A	34.2	Very low	38.5	Very low	103 Å²	103	112.7 Å²	112.7	85%	0.851	69%	0.687	S	S	*	*			trans	-63.1	122.4	176	0	0	0	0	0	110.1	G303 Q307	G303-A305 PolarHBondContact O-N 3.13Å; A305-Q307 PolarHBondContact O-N 2.93Å
306	T	35.3	Very low	39.5	Very low	93 Å²	93	107 Å²	107	57%	0.571	67%	0.67	S	S	*	*			trans	-78.8	112	171.8	43.8	0	0	0	0	109.3	T304 E308	T304-T306 PolarHBondContact O-N 2.84Å; T306-E308 PolarHBondContact O-N 3.27Å; T306-E308 VanDerWaalsContact O-N 3.17Å
307	Q	43.7	Very low	40.8	Very low	177 Å²	177	105 Å²	105	83%	0.827	65%	0.654	S	S	*	*			trans	-60.6	116.1	165.7	-97.4	178.1	-27.4	0	0	109.1	A305	A305-Q307 PolarHBondContact O-N 2.93Å
308	E	43.4	Very low	42.4	Very low	108 Å²	108	98.8 Å²	98.8	51%	0.505	62%	0.619	S	S	.	*			trans	-83	136.2	178.6	-53.4	-164.4	130.6	0	0	110.3	T306 L317	T306-E308 PolarHBondContact O-N 3.27Å; T306-E308 VanDerWaalsContact O-N 3.17Å; E308-L317 HydrophobicContact CB-CD2 3.83Å
309	L	53	Low	43.3	Very low	59 Å²	59	98.2 Å²	98.2	31%	0.309	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.2	109.3	-175.8	-62.4	168.7	0	0	0	108.7	F318 P321 L324	L309-F318 PolarHBondContact N-O 3.43Å; L309-F318 WeakPolarHBondContact O-CA 3.41Å; L309-F318 WeakPolarHBondContact O-CB 3.12Å; L309-F318 PolarHBondContact O-N 2.67Å; L309-P321 HydrophobicContact CD1-CB 4.28Å; L309-P321 HydrophobicContact CD1-CG 3.62Å; L309-L324 HydrophobicContact CB-CD2 4.1Å
310	F	53.2	Low	44.4	Very low	129 Å²	129	96.5 Å²	96.5	57%	0.566	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.5	158.9	-177.2	64.6	-82.9	0	0	0	113.5	Q316 L317	F310-Q316 CarbonylContact C-O 3.16Å; F310-Q316 VanDerWaalsContact CA-O 3.26Å; F310-Q316 WeakPolarHBondContact CA-O 3.38Å; F310-L317 HydrophobicContact CB-CD2 3.93Å
311	C	57.6	Low	45.5	Very low	0 Å²	0	91.5 Å²	91.5	0%	0	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.2	105.4	174.6	179.4	0	0	0	0	110.9	A313 C314 D315 Q316 F318 L324 H327 F328	C311-A313 PolarHBondContact O-N 2.93Å; C311-C314 PolarHBondContact O-N 2.87Å; C311-D315 WeakPolarHBondContact O-CA 3.49Å; C311-D315 PolarHBondContact O-N 2.77Å; C311-Q316 PolarHBondContact N-O 3.43Å; C311-F318 HydrophobicContact CB-CE2 4.05Å; C311-L324 HydrophobicContact CB-CD1 3.65Å; C311-H327 VanDerWaalsContact SG-CD2 3.57Å; C311-H327 PolarHBondContact SG-NE2 3.27Å; C311-H327 VanDerWaalsContact SG-NE2 3.36Å; C311-F328 VanDerWaalsContact SG-CE1 3.5Å
312	S	47.1	Very low	46.5	Very low	104 Å²	104	92 Å²	92	73%	0.727	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-0	-178	54.1	0	0	0	0	116.8
313	A	48.8	Very low	47.7	Very low	68 Å²	68	92.3 Å²	92.3	56%	0.562	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-3.9	172.4	0	0	0	0	0	114	C311	C311-A313 PolarHBondContact O-N 2.93Å
314	C	55.9	Low	49.1	Very low	48 Å²	48	89.8 Å²	89.8	32%	0.324	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-164.4	9.8	179.3	64.4	0	0	0	0	115.2	C311 Q316 H327	C311-C314 PolarHBondContact O-N 2.87Å; C314-Q316 PolarHBondContact O-N 2.94Å; C314-H327 VanDerWaalsContact SG-CE1 3.58Å; C314-H327 PolarHBondContact SG-NE2 3.03Å
315	D	50.8	Low	50.1	Low	119 Å²	119	89.3 Å²	89.3	64%	0.636	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	24.3	177.7	-53.1	-35.5	0	0	0	116.6	C311	C311-D315 WeakPolarHBondContact O-CA 3.49Å; C311-D315 PolarHBondContact O-N 2.77Å
316	Q	51.6	Low	51.1	Low	112 Å²	112	90.3 Å²	90.3	52%	0.523	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.1	171.6	-71	-69.5	-75.9	0	0	111	F310 C311 C314 F318	F310-Q316 CarbonylContact C-O 3.16Å; F310-Q316 VanDerWaalsContact CA-O 3.26Å; F310-Q316 WeakPolarHBondContact CA-O 3.38Å; C311-Q316 PolarHBondContact N-O 3.43Å; C314-Q316 PolarHBondContact O-N 2.94Å; Q316-F318 HydrophobicContact CB-CE2 3.61Å; Q316-F318 HydrophobicContact CB-CZ 3.72Å; Q316-F318 VanDerWaalsContact O-CD2 3.27Å; Q316-F318 WeakPolarHBondContact O-CD2 3.11Å; Q316-F318 VanDerWaalsContact O-CE2 3.24Å; Q316-F318 WeakPolarHBondContact O-CE2 3.41Å
317	L	52.9	Low	52.2	Low	103 Å²	103	87.6 Å²	87.6	54%	0.539	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	136.2	174.7	-70.4	159.3	0	0	0	111.5	E308 F310	E308-L317 HydrophobicContact CB-CD2 3.83Å; F310-L317 HydrophobicContact CB-CD2 3.93Å
318	F	61.9	Low	52.3	Low	34 Å²	34	83.8 Å²	83.8	15%	0.149	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.9	177.9	-60.6	-82	0	0	0	112.1	L309 C311 Q316 S320 Q323 L324 H327	L309-F318 PolarHBondContact N-O 3.43Å; L309-F318 WeakPolarHBondContact O-CA 3.41Å; L309-F318 WeakPolarHBondContact O-CB 3.12Å; L309-F318 PolarHBondContact O-N 2.67Å; C311-F318 HydrophobicContact CB-CE2 4.05Å; Q316-F318 HydrophobicContact CB-CE2 3.61Å; Q316-F318 HydrophobicContact CB-CZ 3.72Å; Q316-F318 VanDerWaalsContact O-CD2 3.27Å; Q316-F318 WeakPolarHBondContact O-CD2 3.11Å; Q316-F318 VanDerWaalsContact O-CE2 3.24Å; Q316-F318 WeakPolarHBondContact O-CE2 3.41Å; F318-S320 VanDerWaalsContact C-N 3.31Å; F318-S320 PolarHBondContact O-N 3.07Å; F318-Q323 HydrophobicContact CB-CB 4.15Å; F318-Q323 HydrophobicContact CD1-CB 3.87Å; F318-Q323 HydrophobicContact CG-CB 4.34Å; F318-L324 HydrophobicContact CB-CB 4.25Å; F318-L324 HydrophobicContact CD2-CB 4.11Å; F318-L324 HydrophobicContact CD2-CD1 3.75Å; F318-L324 HydrophobicContact CD2-CG 4.49Å; F318-L324 HydrophobicContact CE2-CD1 3.95Å; F318-L324 HydrophobicContact CG-CB 4.27Å; F318-H327 HydrophobicContact CE1-CB 4.06Å; F318-H327 HydrophobicContact CE2-CB 4.16Å; F318-H327 AromaticContact CE2-CD2 3.89Å; F318-H327 AromaticContact CE2-CG 3.9Å; F318-H327 HydrophobicContact CZ-CB 3.63Å; F318-H327 AromaticContact CZ-CD2 3.89Å; F318-H327 AromaticContact CZ-CG 3.44Å; F318-H327 VanDerWaalsContact CZ-CG 3.44Å; F318-H327 AromaticContact CZ-ND1 3.72Å
319	L	47	Very low	52.7	Low	116 Å²	116	86.6 Å²	86.6	61%	0.607	45%	0.446	S	S	*	.	S	Bend	trans	-89.1	8.6	-176.2	-61.4	170.4	0	0	0	113.3
320	S	51.7	Low	52.5	Low	38 Å²	38	87 Å²	87	27%	0.266	45%	0.453	S	S	.	.	S	Bend	trans	-163.9	148.2	174.1	59.1	0	0	0	0	112.8	F318 H322 Q323 L324	F318-S320 VanDerWaalsContact C-N 3.31Å; F318-S320 PolarHBondContact O-N 3.07Å; S320-H322 PolarHBondContact O-N 3.01Å; S320-Q323 PolarHBondContact O-N 3.08Å; S320-Q323 VanDerWaalsContact OG-CG 3.25Å; S320-Q323 WeakPolarHBondContact OG-CG 3.27Å; S320-Q323 PolarHBondContact OG-N 3.07Å; S320-Q323 PolarHBondContact OG-OE1 3.42Å; S320-L324 PolarHBondContact O-N 3.47Å
321	P	50.1	Low	52.5	Low	94 Å²	94	86 Å²	86	61%	0.61	45%	0.45	S	S	*	.	H	α-helix	trans	-56.7	-35	176.2	-25.3	32.5	0	0	0	113.6	L309 Q323 L324 Q325	L309-P321 HydrophobicContact CD1-CB 4.28Å; L309-P321 HydrophobicContact CD1-CG 3.62Å; P321-Q323 VanDerWaalsContact C-N 3.34Å; P321-Q323 PolarHBondContact O-N 2.94Å; P321-L324 PolarHBondContact O-N 3.39Å; P321-Q325 VanDerWaalsContact O-CB 3.29Å; P321-Q325 WeakPolarHBondContact O-CB 3.26Å; P321-Q325 PolarHBondContact O-N 2.76Å
322	H	52.4	Low	51.9	Low	130 Å²	130	95.9 Å²	95.9	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-66.7	-32.8	178.5	-175	-51.6	0	0	0	112.3	S320 Q326	S320-H322 PolarHBondContact O-N 3.01Å; H322-Q326 VanDerWaalsContact O-CB 3.28Å; H322-Q326 WeakPolarHBondContact O-CB 3.49Å; H322-Q326 PolarHBondContact O-N 2.87Å
323	Q	51.6	Low	51.6	Low	89 Å²	89	98.1 Å²	98.1	42%	0.416	49%	0.487	S	S	.	.	H	α-helix	trans	-69.1	-46.2	175.3	-76	166.1	-35.4	0	0	110.8	F318 S320 P321 Q326 H327	F318-Q323 HydrophobicContact CB-CB 4.15Å; F318-Q323 HydrophobicContact CD1-CB 3.87Å; F318-Q323 HydrophobicContact CG-CB 4.34Å; S320-Q323 PolarHBondContact O-N 3.08Å; S320-Q323 VanDerWaalsContact OG-CG 3.25Å; S320-Q323 WeakPolarHBondContact OG-CG 3.27Å; S320-Q323 PolarHBondContact OG-N 3.07Å; S320-Q323 PolarHBondContact OG-OE1 3.42Å; P321-Q323 VanDerWaalsContact C-N 3.34Å; P321-Q323 PolarHBondContact O-N 2.94Å; Q323-Q326 PolarHBondContact O-N 2.9Å; Q323-H327 WeakPolarHBondContact O-CB 3.49Å; Q323-H327 PolarHBondContact O-N 3.38Å
324	L	57.6	Low	51.6	Low	24 Å²	24	98.1 Å²	98.1	13%	0.126	49%	0.493	C	S	.	.	H	α-helix	trans	-61.5	-44.4	175.7	178.9	58.8	0	0	0	112	L309 C311 F318 S320 P321 Q326 H327 F328	L309-L324 HydrophobicContact CB-CD2 4.1Å; C311-L324 HydrophobicContact CB-CD1 3.65Å; F318-L324 HydrophobicContact CB-CB 4.25Å; F318-L324 HydrophobicContact CD2-CB 4.11Å; F318-L324 HydrophobicContact CD2-CD1 3.75Å; F318-L324 HydrophobicContact CD2-CG 4.49Å; F318-L324 HydrophobicContact CE2-CD1 3.95Å; F318-L324 HydrophobicContact CG-CB 4.27Å; S320-L324 PolarHBondContact O-N 3.47Å; P321-L324 PolarHBondContact O-N 3.39Å; L324-Q326 VanDerWaalsContact C-N 3.27Å; L324-Q326 PolarHBondContact O-N 3.2Å; L324-H327 WeakPolarHBondContact O-CB 3.41Å; L324-H327 PolarHBondContact O-N 3.47Å; L324-H327 VanDerWaalsContact O-N 3.12Å; L324-F328 HydrophobicContact CD1-CD2 4.12Å; L324-F328 HydrophobicContact CD1-CE2 3.58Å; L324-F328 HydrophobicContact CD1-CZ 3.85Å; L324-F328 HydrophobicContact CD2-CE2 4.11Å; L324-F328 HydrophobicContact CG-CD2 4.04Å; L324-F328 HydrophobicContact CG-CE2 3.55Å; L324-F328 HydrophobicContact CG-CZ 4.27Å; L324-F328 WeakPolarHBondContact O-CD2 3.13Å; L324-F328 PolarHBondContact O-N 3.25Å
325	Q	52.1	Low	51.5	Low	127 Å²	127	98.4 Å²	98.4	59%	0.593	49%	0.493	S	S	*	.	H	α-helix	trans	-68	-23.8	176.7	-161.5	-173.7	43.3	0	0	113.3	P321	P321-Q325 VanDerWaalsContact O-CB 3.29Å; P321-Q325 WeakPolarHBondContact O-CB 3.26Å; P321-Q325 PolarHBondContact O-N 2.76Å
326	Q	54.9	Low	51.5	Low	124 Å²	124	97 Å²	97	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-80.2	-34.7	170.3	-173.9	171.4	-6	0	0	111.6	H322 Q323 L324 R329	H322-Q326 VanDerWaalsContact O-CB 3.28Å; H322-Q326 WeakPolarHBondContact O-CB 3.49Å; H322-Q326 PolarHBondContact O-N 2.87Å; Q323-Q326 PolarHBondContact O-N 2.9Å; L324-Q326 VanDerWaalsContact C-N 3.27Å; L324-Q326 PolarHBondContact O-N 3.2Å; Q326-R329 WeakPolarHBondContact O-CB 3.5Å; Q326-R329 PolarHBondContact O-N 2.96Å
327	H	59.8	Low	51.3	Low	36 Å²	36	98.7 Å²	98.7	17%	0.167	49%	0.487	C	S	.	.	H	α-helix	trans	-65.9	-41.7	173.9	169.9	77.6	0	0	0	112.4	C311 C314 F318 Q323 L324 R329 S330 H331	C311-H327 VanDerWaalsContact SG-CD2 3.57Å; C311-H327 PolarHBondContact SG-NE2 3.27Å; C311-H327 VanDerWaalsContact SG-NE2 3.36Å; C314-H327 VanDerWaalsContact SG-CE1 3.58Å; C314-H327 PolarHBondContact SG-NE2 3.03Å; F318-H327 HydrophobicContact CE1-CB 4.06Å; F318-H327 HydrophobicContact CE2-CB 4.16Å; F318-H327 AromaticContact CE2-CD2 3.89Å; F318-H327 AromaticContact CE2-CG 3.9Å; F318-H327 HydrophobicContact CZ-CB 3.63Å; F318-H327 AromaticContact CZ-CD2 3.89Å; F318-H327 AromaticContact CZ-CG 3.44Å; F318-H327 VanDerWaalsContact CZ-CG 3.44Å; F318-H327 AromaticContact CZ-ND1 3.72Å; Q323-H327 WeakPolarHBondContact O-CB 3.49Å; Q323-H327 PolarHBondContact O-N 3.38Å; L324-H327 WeakPolarHBondContact O-CB 3.41Å; L324-H327 PolarHBondContact O-N 3.47Å; L324-H327 VanDerWaalsContact O-N 3.12Å; H327-R329 PolarHBondContact O-N 3.38Å; H327-S330 PolarHBondContact O-N 3.08Å; H327-S330 PolarHBondContact O-OG 3.21Å; H327-H331 AromaticContact CD2-NE2 3.13Å; H327-H331 PolarHBondContact CD2-NE2 2.83Å; H327-H331 AromaticContact CE1-NE2 2.68Å; H327-H331 PolarHBondContact CE1-NE2 3.49Å; H327-H331 AromaticContact CG-NE2 3.97Å; H327-H331 AromaticContact ND1-NE2 3.74Å; H327-H331 AromaticContact NE2-CD2 3.72Å; H327-H331 AromaticContact NE2-NE2 2.1Å; H327-H331 PolarHBondContact NE2-NE2 2.8Å
328	F	44.9	Very low	51.1	Low	97 Å²	97	93.8 Å²	93.8	43%	0.425	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-57.9	-20.7	176.1	-77.6	-54.5	0	0	0	114.2	C311 L324 H331	C311-F328 VanDerWaalsContact SG-CE1 3.5Å; L324-F328 HydrophobicContact CD1-CD2 4.12Å; L324-F328 HydrophobicContact CD1-CE2 3.58Å; L324-F328 HydrophobicContact CD1-CZ 3.85Å; L324-F328 HydrophobicContact CD2-CE2 4.11Å; L324-F328 HydrophobicContact CG-CD2 4.04Å; L324-F328 HydrophobicContact CG-CE2 3.55Å; L324-F328 HydrophobicContact CG-CZ 4.27Å; L324-F328 WeakPolarHBondContact O-CD2 3.13Å; L324-F328 PolarHBondContact O-N 3.25Å; F328-H331 PolarHBondContact O-N 3.32Å
329	R	51.9	Low	50.3	Low	168 Å²	168	97.4 Å²	97.4	63%	0.634	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-71.3	-28.1	174.8	-57.8	-178	-170.1	-159.2	-1.2	112.9	Q326 H327 H331 R332	Q326-R329 WeakPolarHBondContact O-CB 3.5Å; Q326-R329 PolarHBondContact O-N 2.96Å; H327-R329 PolarHBondContact O-N 3.38Å; R329-H331 PolarHBondContact O-N 3.25Å; R329-R332 PolarHBondContact O-N 3.47Å
330	S	48.7	Very low	50.2	Low	67 Å²	67	97.5 Å²	97.5	47%	0.469	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-74.2	-3.6	176.1	58.4	0	0	0	0	114.4	H327	H327-S330 PolarHBondContact O-N 3.08Å; H327-S330 PolarHBondContact O-OG 3.21Å
331	H	52.3	Low	50.2	Low	107 Å²	107	98 Å²	98	50%	0.495	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-101	-9.7	173.2	-65.6	-85.1	0	0	0	113.5	H327 F328 R329	H327-H331 AromaticContact CD2-NE2 3.13Å; H327-H331 PolarHBondContact CD2-NE2 2.83Å; H327-H331 AromaticContact CE1-NE2 2.68Å; H327-H331 PolarHBondContact CE1-NE2 3.49Å; H327-H331 AromaticContact CG-NE2 3.97Å; H327-H331 AromaticContact ND1-NE2 3.74Å; H327-H331 AromaticContact NE2-CD2 3.72Å; H327-H331 AromaticContact NE2-NE2 2.1Å; H327-H331 PolarHBondContact NE2-NE2 2.8Å; F328-H331 PolarHBondContact O-N 3.32Å; R329-H331 PolarHBondContact O-N 3.25Å
332	R	45.6	Very low	49.9	Very low	209 Å²	209	98.3 Å²	98.3	79%	0.789	50%	0.496	S	S	*	.	S	Bend	trans	-105.4	-4.1	-173	-85.6	-166.7	171.9	-166.5	-0.5	115.8	R329	R329-R332 PolarHBondContact O-N 3.47Å
333	E	41.9	Very low	49.3	Very low	151 Å²	151	99.5 Å²	99.5	71%	0.706	50%	0.495	S	S	*	.	S	Bend	trans	-124.8	128.4	174.6	-68.9	171.4	-167.4	0	0	107.7	V335	E333-V335 PolarHBondContact O-N 3.37Å
334	G	48.9	Very low	49	Very low	67 Å²	67	99 Å²	99	69%	0.691	50%	0.498	S	S	*	.			trans	-65.6	103	-170.4	0	0	0	0	0	112.8	F336	G334-F336 WeakPolarHBondContact O-CE2 3.29Å
335	V	51.8	Low	48.5	Very low	54 Å²	54	99.6 Å²	99.6	33%	0.327	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-103.5	124.5	-174.7	-93	0	0	0	0	113.7	E333 V344	E333-V335 PolarHBondContact O-N 3.37Å; V335-V344 HydrophobicContact CB-CG1 3.49Å; V335-V344 VanDerWaalsContact CB-CG1 3.49Å; V335-V344 HydrophobicContact CG1-CG1 3.68Å; V335-V344 HydrophobicContact CG2-CG1 3.76Å
336	F	52.8	Low	47.9	Very low	90 Å²	90	98.7 Å²	98.7	40%	0.395	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	121.9	-178.8	-60.6	-90.1	0	0	0	109.6	G334 F345 P348 L351	G334-F336 WeakPolarHBondContact O-CE2 3.29Å; F336-F345 PolarHBondContact N-O 3Å; F336-F345 PolarHBondContact O-N 3.45Å; F336-P348 HydrophobicContact CD1-CG 4.19Å; F336-P348 HydrophobicContact CD2-CG 4.3Å; F336-P348 HydrophobicContact CE1-CG 3.79Å; F336-P348 HydrophobicContact CE2-CG 3.92Å; F336-P348 HydrophobicContact CG-CG 4.44Å; F336-P348 HydrophobicContact CZ-CG 3.66Å; F336-L351 HydrophobicContact CB-CB 4.21Å; F336-L351 HydrophobicContact CB-CD2 3.85Å
337	K	46.7	Very low	47.6	Very low	147 Å²	147	94.9 Å²	94.9	64%	0.639	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	134.1	-175.1	-62.2	-179.2	-177	172.8	0	110.6	P339 R343 V344	K337-P339 WeakPolarHBondContact O-CD 3.34Å; K337-R343 CarbonylContact C-O 3.59Å; K337-R343 WeakPolarHBondContact CA-O 3.46Å; K337-V344 HydrophobicContact CG-CG2 4.49Å
338	C	47.8	Very low	47	Very low	0 Å²	0	96.1 Å²	96.1	0%	0	50%	0.503	C	S	.	.			trans	-77	114.6	174.1	178.2	0	0	0	0	110.6	L340 C341 S342 R343 F345 L351	C338-L340 PolarHBondContact O-N 2.83Å; C338-L340 VanDerWaalsContact O-N 3.15Å; C338-C341 PolarHBondContact O-N 2.8Å; C338-C341 VanDerWaalsContact SG-SG 3.66Å; C338-S342 VanDerWaalsContact O-CA 3.32Å; C338-S342 WeakPolarHBondContact O-CA 3.08Å; C338-S342 PolarHBondContact O-N 2.98Å; C338-R343 PolarHBondContact N-O 2.97Å; C338-F345 HydrophobicContact CB-CE2 4.02Å; C338-L351 HydrophobicContact CB-CD1 3.54Å
339	P	46.4	Very low	47.3	Very low	110 Å²	110	95.9 Å²	95.9	71%	0.714	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.6	-177.9	24.6	-34.3	0	0	0	113.6	K337	K337-P339 WeakPolarHBondContact O-CD 3.34Å
340	L	44.5	Very low	47.1	Very low	119 Å²	119	89.4 Å²	89.4	62%	0.623	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.8	-176.7	-57.9	177.2	0	0	0	115.1	C338 L355 H358	C338-L340 PolarHBondContact O-N 2.83Å; C338-L340 VanDerWaalsContact O-N 3.15Å; L340-L355 HydrophobicContact CD1-CD2 4.49Å; L340-H358 HydrophobicContact CD1-CB 3.55Å
341	C	50.3	Low	47.4	Very low	49 Å²	49	87.2 Å²	87.2	33%	0.331	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.9	12.2	179.7	72.1	0	0	0	0	115.3	C338 R343 H354	C338-C341 PolarHBondContact O-N 2.8Å; C338-C341 VanDerWaalsContact SG-SG 3.66Å; C341-R343 PolarHBondContact O-N 3.42Å; C341-H354 PolarHBondContact SG-NE2 2.94Å
342	S	45	Very low	47.3	Very low	99 Å²	99	86.8 Å²	86.8	69%	0.692	48%	0.478	S	S	*	.			trans	55.4	14	178.4	-56.3	0	0	0	0	116.3	C338	C338-S342 VanDerWaalsContact O-CA 3.32Å; C338-S342 WeakPolarHBondContact O-CA 3.08Å; C338-S342 PolarHBondContact O-N 2.98Å
343	R	40	Very low	47.8	Very low	156 Å²	156	83.1 Å²	83.1	59%	0.589	47%	0.47	S	S	*	.			trans	-69.9	150.4	173.9	-74.5	-177.5	-178.7	165.9	6	111.6	K337 C338 C341 F345	K337-R343 CarbonylContact C-O 3.59Å; K337-R343 WeakPolarHBondContact CA-O 3.46Å; C338-R343 PolarHBondContact N-O 2.97Å; C341-R343 PolarHBondContact O-N 3.42Å; R343-F345 HydrophobicContact CB-CD2 4.42Å; R343-F345 HydrophobicContact CB-CE2 3.45Å; R343-F345 VanDerWaalsContact CB-CE2 3.45Å; R343-F345 HydrophobicContact CB-CZ 3.81Å
344	V	45.7	Very low	48.4	Very low	79 Å²	79	76.6 Å²	76.6	48%	0.479	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.2	-161.1	-178.2	0	0	0	0	108.9	V335 K337	V335-V344 HydrophobicContact CB-CG1 3.49Å; V335-V344 VanDerWaalsContact CB-CG1 3.49Å; V335-V344 HydrophobicContact CG1-CG1 3.68Å; V335-V344 HydrophobicContact CG2-CG1 3.76Å; K337-V344 HydrophobicContact CG-CG2 4.49Å
345	F	46.3	Very low	48.7	Very low	36 Å²	36	76 Å²	76	16%	0.158	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.7	-167.5	-66.3	-87.1	0	0	0	112.8	F336 C338 R343 S347 S350 L351 H354	F336-F345 PolarHBondContact N-O 3Å; F336-F345 PolarHBondContact O-N 3.45Å; C338-F345 HydrophobicContact CB-CE2 4.02Å; R343-F345 HydrophobicContact CB-CD2 4.42Å; R343-F345 HydrophobicContact CB-CE2 3.45Å; R343-F345 VanDerWaalsContact CB-CE2 3.45Å; R343-F345 HydrophobicContact CB-CZ 3.81Å; F345-S347 VanDerWaalsContact C-N 3.28Å; F345-S347 PolarHBondContact O-N 3.15Å; F345-S350 VanDerWaalsContact CD1-O 3.27Å; F345-S350 WeakPolarHBondContact CD1-O 3.07Å; F345-L351 HydrophobicContact CB-CB 4.17Å; F345-L351 HydrophobicContact CD2-CB 4.35Å; F345-L351 HydrophobicContact CD2-CD1 3.89Å; F345-L351 HydrophobicContact CE2-CD1 4.22Å; F345-L351 HydrophobicContact CG-CB 4.34Å; F345-H354 HydrophobicContact CE1-CB 3.87Å; F345-H354 HydrophobicContact CE2-CB 4.19Å; F345-H354 AromaticContact CE2-CD2 3.4Å; F345-H354 VanDerWaalsContact CE2-CD2 3.4Å; F345-H354 WeakPolarHBondContact CE2-CD2 3.44Å; F345-H354 AromaticContact CE2-CG 3.98Å; F345-H354 HydrophobicContact CZ-CB 3.62Å; F345-H354 AromaticContact CZ-CD2 3.19Å; F345-H354 WeakPolarHBondContact CZ-CD2 3.4Å; F345-H354 AromaticContact CZ-CG 3.37Å; F345-H354 AromaticContact CZ-NE2 4Å
346	P	39.3	Very low	48.8	Very low	108 Å²	108	74.4 Å²	74.4	70%	0.701	42%	0.415	S	S	*	.	S	Bend	trans	-80.4	0.7	-173.4	34	-37.9	0	0	0	114.7
347	S	49.2	Very low	48.8	Very low	43 Å²	43	75.5 Å²	75.5	30%	0.301	43%	0.425	S	S	.	.	S	Bend	trans	-158.7	156.3	175.8	68.7	0	0	0	0	111.6	F345 S349 S350 L351	F345-S347 VanDerWaalsContact C-N 3.28Å; F345-S347 PolarHBondContact O-N 3.15Å; S347-S349 PolarHBondContact O-N 3.35Å; S347-S350 PolarHBondContact N-OG 3.39Å; S347-S350 PolarHBondContact O-N 3.48Å; S347-S350 PolarHBondContact O-OG 3.01Å; S347-S350 WeakPolarHBondContact OG-CB 3.39Å; S347-S350 PolarHBondContact OG-N 3.03Å; S347-S350 PolarHBondContact OG-OG 3.3Å; S347-L351 PolarHBondContact O-N 3.39Å
348	P	47.1	Very low	48.9	Very low	63 Å²	63	71.9 Å²	71.9	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-57.5	-47.8	176.5	-22.3	32.7	0	0	0	112	F336 S350 L351 D352	F336-P348 HydrophobicContact CD1-CG 4.19Å; F336-P348 HydrophobicContact CD2-CG 4.3Å; F336-P348 HydrophobicContact CE1-CG 3.79Å; F336-P348 HydrophobicContact CE2-CG 3.92Å; F336-P348 HydrophobicContact CG-CG 4.44Å; F336-P348 HydrophobicContact CZ-CG 3.66Å; P348-S350 PolarHBondContact O-N 3.31Å; P348-S350 VanDerWaalsContact O-N 3.15Å; P348-L351 CarbonylContact O-C 3.53Å; P348-L351 WeakPolarHBondContact O-CA 3.41Å; P348-L351 WeakPolarHBondContact O-CB 3.49Å; P348-L351 PolarHBondContact O-N 3Å; P348-D352 PolarHBondContact O-N 3.45Å
349	S	50.3	Low	48.9	Very low	92 Å²	92	74 Å²	74	64%	0.643	43%	0.425	S	S	*	.	H	α-helix	trans	-61.4	-29.5	-178.6	-43.2	0	0	0	0	113.3	S347 Q353	S347-S349 PolarHBondContact O-N 3.35Å; S349-Q353 WeakPolarHBondContact O-CB 3.42Å; S349-Q353 PolarHBondContact O-N 2.9Å; S349-Q353 VanDerWaalsContact O-N 3.15Å
350	S	49	Very low	48.8	Very low	32 Å²	32	75 Å²	75	22%	0.224	43%	0.434	C	S	.	.	H	α-helix	trans	-79	-20.5	172.7	60.3	0	0	0	0	114	F345 S347 P348	F345-S350 VanDerWaalsContact CD1-O 3.27Å; F345-S350 WeakPolarHBondContact CD1-O 3.07Å; S347-S350 PolarHBondContact N-OG 3.39Å; S347-S350 PolarHBondContact O-N 3.48Å; S347-S350 PolarHBondContact O-OG 3.01Å; S347-S350 WeakPolarHBondContact OG-CB 3.39Å; S347-S350 PolarHBondContact OG-N 3.03Å; S347-S350 PolarHBondContact OG-OG 3.3Å; P348-S350 PolarHBondContact O-N 3.31Å; P348-S350 VanDerWaalsContact O-N 3.15Å
351	L	53.6	Low	48.8	Very low	20 Å²	20	76.2 Å²	76.2	11%	0.105	44%	0.437	C	S	.	.	H	α-helix	trans	-78.5	-46.6	167.3	172.1	58.7	0	0	0	110.5	F336 C338 F345 S347 P348 Q353 H354 L355	F336-L351 HydrophobicContact CB-CB 4.21Å; F336-L351 HydrophobicContact CB-CD2 3.85Å; C338-L351 HydrophobicContact CB-CD1 3.54Å; F345-L351 HydrophobicContact CB-CB 4.17Å; F345-L351 HydrophobicContact CD2-CB 4.35Å; F345-L351 HydrophobicContact CD2-CD1 3.89Å; F345-L351 HydrophobicContact CE2-CD1 4.22Å; F345-L351 HydrophobicContact CG-CB 4.34Å; S347-L351 PolarHBondContact O-N 3.39Å; P348-L351 CarbonylContact O-C 3.53Å; P348-L351 WeakPolarHBondContact O-CA 3.41Å; P348-L351 WeakPolarHBondContact O-CB 3.49Å; P348-L351 PolarHBondContact O-N 3Å; L351-Q353 VanDerWaalsContact C-N 3.34Å; L351-Q353 PolarHBondContact O-N 2.77Å; L351-H354 CarbonylContact O-C 3.56Å; L351-H354 WeakPolarHBondContact O-CA 3.49Å; L351-H354 WeakPolarHBondContact O-CB 3.2Å; L351-H354 PolarHBondContact O-N 3.46Å; L351-L355 HydrophobicContact CD1-CD1 4.17Å; L351-L355 HydrophobicContact CD1-CD2 4.29Å; L351-L355 HydrophobicContact CD1-CG 3.92Å; L351-L355 HydrophobicContact CG-CD1 3.95Å; L351-L355 HydrophobicContact CG-CG 4.19Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.21Å
352	D	51.8	Low	48.5	Very low	99 Å²	99	75.9 Å²	75.9	53%	0.529	44%	0.435	S	S	.	.	H	α-helix	trans	-58.8	-44.7	179.5	-63.2	-34.3	0	0	0	111.9	P348 H354 L355 G356	P348-D352 PolarHBondContact O-N 3.45Å; D352-H354 PolarHBondContact O-N 2.73Å; D352-L355 PolarHBondContact O-N 3.27Å; D352-L355 VanDerWaalsContact O-N 3.12Å; D352-G356 PolarHBondContact O-N 2.87Å
353	Q	54.6	Low	49	Very low	132 Å²	132	76.4 Å²	76.4	62%	0.617	43%	0.426	S	S	*	.	H	α-helix	trans	-60.2	-26.6	173.7	178.9	163.5	78	0	0	112.9	S349 L351	S349-Q353 WeakPolarHBondContact O-CB 3.42Å; S349-Q353 PolarHBondContact O-N 2.9Å; S349-Q353 VanDerWaalsContact O-N 3.15Å; L351-Q353 VanDerWaalsContact C-N 3.34Å; L351-Q353 PolarHBondContact O-N 2.77Å
354	H	56.3	Low	49.6	Very low	13 Å²	13	72.6 Å²	72.6	6%	0.06	41%	0.414	C	S	.	.	H	α-helix	trans	-87.7	-30	173.9	-177.8	48.9	0	0	0	113.2	C341 F345 L351 D352 G356 D357 H358	C341-H354 PolarHBondContact SG-NE2 2.94Å; F345-H354 HydrophobicContact CE1-CB 3.87Å; F345-H354 HydrophobicContact CE2-CB 4.19Å; F345-H354 AromaticContact CE2-CD2 3.4Å; F345-H354 VanDerWaalsContact CE2-CD2 3.4Å; F345-H354 WeakPolarHBondContact CE2-CD2 3.44Å; F345-H354 AromaticContact CE2-CG 3.98Å; F345-H354 HydrophobicContact CZ-CB 3.62Å; F345-H354 AromaticContact CZ-CD2 3.19Å; F345-H354 WeakPolarHBondContact CZ-CD2 3.4Å; F345-H354 AromaticContact CZ-CG 3.37Å; F345-H354 AromaticContact CZ-NE2 4Å; L351-H354 CarbonylContact O-C 3.56Å; L351-H354 WeakPolarHBondContact O-CA 3.49Å; L351-H354 WeakPolarHBondContact O-CB 3.2Å; L351-H354 PolarHBondContact O-N 3.46Å; D352-H354 PolarHBondContact O-N 2.73Å; H354-G356 PolarHBondContact O-N 3.45Å; H354-D357 IonicContact CE1-OD2 3.61Å; H354-D357 IonicContact CG-OD2 3.82Å; H354-D357 IonicContact ND1-OD2 2.78Å; H354-D357 PolarHBondContact ND1-OD2 3.46Å; H354-D357 VanDerWaalsContact O-CB 3.27Å; H354-D357 WeakPolarHBondContact O-CB 3.44Å; H354-D357 PolarHBondContact O-N 3.48Å; H354-H358 AromaticContact CD2-NE2 3.7Å; H354-H358 AromaticContact CE1-NE2 3.34Å; H354-H358 PolarHBondContact CE1-NE2 3.03Å; H354-H358 VanDerWaalsContact CE1-NE2 3.34Å; H354-H358 AromaticContact NE2-CD2 3.92Å; H354-H358 AromaticContact NE2-CE1 3.95Å; H354-H358 AromaticContact NE2-NE2 3.01Å; H354-H358 PolarHBondContact NE2-NE2 3.25Å; H354-H358 PolarHBondContact O-CD2 3.16Å
355	L	54.3	Low	49.5	Very low	56 Å²	56	73.8 Å²	73.8	29%	0.293	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-32.8	170.9	-69.7	172	0	0	0	110.8	L340 L351 D352 D357 H358 S359	L340-L355 HydrophobicContact CD1-CD2 4.49Å; L351-L355 HydrophobicContact CD1-CD1 4.17Å; L351-L355 HydrophobicContact CD1-CD2 4.29Å; L351-L355 HydrophobicContact CD1-CG 3.92Å; L351-L355 HydrophobicContact CG-CD1 3.95Å; L351-L355 HydrophobicContact CG-CG 4.19Å; L351-L355 WeakPolarHBondContact O-CG 3.47Å; L351-L355 PolarHBondContact O-N 3.21Å; D352-L355 PolarHBondContact O-N 3.27Å; D352-L355 VanDerWaalsContact O-N 3.12Å; L355-D357 PolarHBondContact O-N 2.94Å; L355-H358 PolarHBondContact O-N 2.88Å; L355-S359 PolarHBondContact O-N 3.17Å
356	G	53.9	Low	49.8	Very low	20 Å²	20	72.1 Å²	72.1	21%	0.206	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.6	167	0	0	0	0	0	115.8	D352 H354 H358 S359	D352-G356 PolarHBondContact O-N 2.87Å; H354-G356 PolarHBondContact O-N 3.45Å; G356-H358 VanDerWaalsContact C-N 3.32Å; G356-S359 PolarHBondContact O-OG 3.16Å
357	D	52	Low	50.3	Low	113 Å²	113	73.4 Å²	73.4	60%	0.604	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.9	170.6	-66	-46.7	0	0	0	112.3	H354 L355	H354-D357 IonicContact CE1-OD2 3.61Å; H354-D357 IonicContact CG-OD2 3.82Å; H354-D357 IonicContact ND1-OD2 2.78Å; H354-D357 PolarHBondContact ND1-OD2 3.46Å; H354-D357 VanDerWaalsContact O-CB 3.27Å; H354-D357 WeakPolarHBondContact O-CB 3.44Å; H354-D357 PolarHBondContact O-N 3.48Å; L355-D357 PolarHBondContact O-N 2.94Å
358	H	49.1	Very low	50.1	Low	71 Å²	71	75.3 Å²	75.3	33%	0.329	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-28.9	-179.5	-62.6	-83.2	0	0	0	112.6	L340 H354 L355 G356 S360	L340-H358 HydrophobicContact CD1-CB 3.55Å; H354-H358 AromaticContact CD2-NE2 3.7Å; H354-H358 AromaticContact CE1-NE2 3.34Å; H354-H358 PolarHBondContact CE1-NE2 3.03Å; H354-H358 VanDerWaalsContact CE1-NE2 3.34Å; H354-H358 AromaticContact NE2-CD2 3.92Å; H354-H358 AromaticContact NE2-CE1 3.95Å; H354-H358 AromaticContact NE2-NE2 3.01Å; H354-H358 PolarHBondContact NE2-NE2 3.25Å; H354-H358 PolarHBondContact O-CD2 3.16Å; L355-H358 PolarHBondContact O-N 2.88Å; G356-H358 VanDerWaalsContact C-N 3.32Å; H358-S360 PolarHBondContact O-N 3.31Å
359	S	48.1	Very low	50.2	Low	45 Å²	45	75.1 Å²	75.1	32%	0.315	42%	0.422	S	S	.	.	S	Bend	trans	-66.6	122.9	168.2	60	0	0	0	0	110.1	L355 G356 E361 H363	L355-S359 PolarHBondContact O-N 3.17Å; G356-S359 PolarHBondContact O-OG 3.16Å; S359-E361 PolarHBondContact O-N 3.22Å; S359-E361 VanDerWaalsContact O-N 3.12Å; S359-H363 PolarHBondContact OG-NE2 3.46Å
360	S	43.5	Very low	50	Low	130 Å²	130	73.5 Å²	73.5	91%	0.909	42%	0.419	S	S	*	.	S	Bend	trans	-71.6	2.7	174.8	48.3	0	0	0	0	114.3	H358	H358-S360 PolarHBondContact O-N 3.31Å
361	E	44.9	Very low	49.8	Very low	144 Å²	144	76.3 Å²	76.3	67%	0.673	43%	0.432	S	S	*	.	S	Bend	trans	-90	127.6	178.2	-60.8	-169.1	147	0	0	111	S359 H363	S359-E361 PolarHBondContact O-N 3.22Å; S359-E361 VanDerWaalsContact O-N 3.12Å; E361-H363 PolarHBondContact O-CD2 3.45Å; E361-H363 VanDerWaalsContact O-CD2 3.26Å; E361-H363 PolarHBondContact O-N 3.29Å; E361-H363 PolarHBondContact O-NE2 3.46Å
362	S	45.3	Very low	49.4	Very low	42 Å²	42	78.1 Å²	78.1	29%	0.294	45%	0.449	S	S	.	.			trans	-90.2	91	-178.5	60.2	0	0	0	0	111.6	F364 A372	S362-F364 PolarHBondContact O-N 3.3Å; S362-A372 WeakPolarHBondContact OG-CB 3.05Å
363	H	54.9	Low	49.6	Very low	110 Å²	110	75 Å²	75	51%	0.509	43%	0.431	S	S	.	.	S	Bend	trans	-52	-22.1	-178.2	-60.4	-78	0	0	0	115.3	S359 E361	S359-H363 PolarHBondContact OG-NE2 3.46Å; E361-H363 PolarHBondContact O-CD2 3.45Å; E361-H363 VanDerWaalsContact O-CD2 3.26Å; E361-H363 PolarHBondContact O-N 3.29Å; E361-H363 PolarHBondContact O-NE2 3.46Å
364	F	51.5	Low	49.1	Very low	76 Å²	76	70.8 Å²	70.8	33%	0.333	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	97.6	-179.1	-59.5	-81.1	0	0	0	112.2	S362 F373 E376 L379	S362-F364 PolarHBondContact O-N 3.3Å; F364-F373 HydrophobicContact CB-CB 4.32Å; F364-F373 WeakPolarHBondContact CB-O 3.12Å; F364-F373 PolarHBondContact N-O 3.26Å; F364-F373 VanDerWaalsContact N-O 3.12Å; F364-F373 WeakPolarHBondContact O-CB 3.18Å; F364-F373 PolarHBondContact O-N 3.4Å; F364-E376 HydrophobicContact CD1-CB 3.98Å; F364-E376 HydrophobicContact CD1-CG 4.13Å; F364-E376 HydrophobicContact CE1-CB 3.75Å; F364-E376 HydrophobicContact CE1-CG 4.01Å; F364-E376 HydrophobicContact CE2-CB 4.34Å; F364-E376 HydrophobicContact CG-CB 4.37Å; F364-E376 HydrophobicContact CZ-CB 3.95Å; F364-L379 HydrophobicContact CB-CB 4.13Å; F364-L379 HydrophobicContact CB-CD2 3.88Å
365	L	45.3	Very low	49.1	Very low	105 Å²	105	71.7 Å²	71.7	55%	0.55	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	138.3	174	-69.3	170.9	0	0	0	112	V367 A372	L365-V367 PolarHBondContact O-N 3.1Å; L365-A372 HydrophobicContact CD2-CB 4.34Å
366	C	51.6	Low	48.9	Very low	1 Å²	1	74.3 Å²	74.3	1%	0.007	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	99.6	172.3	-171.5	0	0	0	0	110.8	D368 C369 G370 L371 F373 L379 H386	C366-D368 PolarHBondContact O-N 2.72Å; C366-C369 PolarHBondContact O-N 3.46Å; C366-G370 WeakPolarHBondContact O-CA 3.49Å; C366-G370 PolarHBondContact O-N 2.94Å; C366-L371 WeakPolarHBondContact CB-O 3.31Å; C366-L371 PolarHBondContact N-O 3.18Å; C366-F373 HydrophobicContact CB-CD2 4.42Å; C366-F373 HydrophobicContact CB-CE2 3.95Å; C366-L379 HydrophobicContact CB-CD1 3.49Å; C366-L379 VanDerWaalsContact CB-CD1 3.49Å; C366-H386 PolarHBondContact SG-CD2 3.44Å
367	V	50	Low	48.9	Very low	134 Å²	134	76.8 Å²	76.8	81%	0.812	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-35.7	177.4	-174.3	0	0	0	0	112.3	L365 C369	L365-V367 PolarHBondContact O-N 3.1Å; V367-C369 VanDerWaalsContact C-N 3.25Å; V367-C369 PolarHBondContact O-N 3.49Å
368	D	45.2	Very low	49	Very low	84 Å²	84	76.2 Å²	76.2	45%	0.449	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-15.8	-176.4	-43.7	-66.7	0	0	0	114	C366 R383 H386	C366-D368 PolarHBondContact O-N 2.72Å; D368-R383 IonicContact OD1-NH2 3.79Å; D368-R383 IonicContact OD2-CZ 3.79Å; D368-R383 IonicContact OD2-NE 3.76Å; D368-R383 PolarHBondContact OD2-NE 3.26Å; D368-R383 IonicContact OD2-NH2 2.7Å; D368-R383 PolarHBondContact OD2-NH2 2.82Å; D368-H386 HydrophobicContact CB-CB 3.89Å
369	C	49.4	Very low	49.4	Very low	58 Å²	58	73.8 Å²	73.8	39%	0.392	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.5	7.5	179.9	82.2	0	0	0	0	117	C366 V367 L371 H382 H386	C366-C369 PolarHBondContact O-N 3.46Å; V367-C369 VanDerWaalsContact C-N 3.25Å; V367-C369 PolarHBondContact O-N 3.49Å; C369-L371 VanDerWaalsContact C-N 3.29Å; C369-L371 PolarHBondContact O-N 3.19Å; C369-L371 VanDerWaalsContact SG-CB 3.59Å; C369-L371 VanDerWaalsContact SG-CG 3.57Å; C369-H382 PolarHBondContact SG-NE2 2.56Å; C369-H386 VanDerWaalsContact CB-CE1 3.46Å; C369-H386 WeakPolarHBondContact CB-CE1 3.24Å; C369-H386 VanDerWaalsContact SG-CE1 3.52Å; C369-H386 PolarHBondContact SG-NE2 3.33Å
370	G	44.9	Very low	49.9	Very low	58 Å²	58	75.2 Å²	75.2	60%	0.598	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	5.2	-177.7	0	0	0	0	0	116.8	C366	C366-G370 WeakPolarHBondContact O-CA 3.49Å; C366-G370 PolarHBondContact O-N 2.94Å
371	L	45.5	Very low	50.5	Low	92 Å²	92	71.6 Å²	71.6	48%	0.482	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	142.9	-176.6	-76.9	175.6	0	0	0	113.5	C366 C369 F373	C366-L371 WeakPolarHBondContact CB-O 3.31Å; C366-L371 PolarHBondContact N-O 3.18Å; C369-L371 VanDerWaalsContact C-N 3.29Å; C369-L371 PolarHBondContact O-N 3.19Å; C369-L371 VanDerWaalsContact SG-CB 3.59Å; C369-L371 VanDerWaalsContact SG-CG 3.57Å; L371-F373 HydrophobicContact CB-CE2 3.67Å; L371-F373 HydrophobicContact CB-CZ 3.89Å; L371-F373 WeakPolarHBondContact O-CD2 3.45Å; L371-F373 VanDerWaalsContact O-CE2 3.27Å; L371-F373 WeakPolarHBondContact O-CE2 3.32Å
372	A	44.8	Very low	51.2	Low	57 Å²	57	66.7 Å²	66.7	47%	0.471	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.7	-173.1	0	0	0	0	0	113.3	S362 L365	S362-A372 WeakPolarHBondContact OG-CB 3.05Å; L365-A372 HydrophobicContact CD2-CB 4.34Å
373	F	56	Low	51.5	Low	35 Å²	35	70 Å²	70	15%	0.154	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.4	177.3	-59.3	-83.3	0	0	0	111.9	F364 C366 L371 L378 L379 H382	F364-F373 HydrophobicContact CB-CB 4.32Å; F364-F373 WeakPolarHBondContact CB-O 3.12Å; F364-F373 PolarHBondContact N-O 3.26Å; F364-F373 VanDerWaalsContact N-O 3.12Å; F364-F373 WeakPolarHBondContact O-CB 3.18Å; F364-F373 PolarHBondContact O-N 3.4Å; C366-F373 HydrophobicContact CB-CD2 4.42Å; C366-F373 HydrophobicContact CB-CE2 3.95Å; L371-F373 HydrophobicContact CB-CE2 3.67Å; L371-F373 HydrophobicContact CB-CZ 3.89Å; L371-F373 WeakPolarHBondContact O-CD2 3.45Å; L371-F373 VanDerWaalsContact O-CE2 3.27Å; L371-F373 WeakPolarHBondContact O-CE2 3.32Å; F373-L378 HydrophobicContact CB-CB 4.47Å; F373-L378 HydrophobicContact CD1-CB 4.06Å; F373-L379 HydrophobicContact CB-CB 4.19Å; F373-L379 HydrophobicContact CD2-CB 4.24Å; F373-L379 HydrophobicContact CD2-CD1 3.85Å; F373-L379 HydrophobicContact CE2-CD1 4.27Å; F373-L379 HydrophobicContact CG-CB 4.28Å; F373-H382 HydrophobicContact CE1-CB 3.89Å; F373-H382 AromaticContact CE1-CG 3.92Å; F373-H382 HydrophobicContact CE2-CB 4.1Å; F373-H382 AromaticContact CE2-CD2 3.23Å; F373-H382 WeakPolarHBondContact CE2-CD2 3.46Å; F373-H382 AromaticContact CE2-CG 3.74Å; F373-H382 AromaticContact CE2-NE2 3.79Å; F373-H382 HydrophobicContact CZ-CB 3.64Å; F373-H382 AromaticContact CZ-CD2 3.15Å; F373-H382 WeakPolarHBondContact CZ-CD2 3.19Å; F373-H382 AromaticContact CZ-CE1 3.84Å; F373-H382 AromaticContact CZ-CG 3.22Å; F373-H382 AromaticContact CZ-ND1 3.68Å; F373-H382 AromaticContact CZ-NE2 3.54Å
374	G	44.3	Very low	51.6	Low	42 Å²	42	73.5 Å²	73.5	43%	0.433	42%	0.418	S	S	.	.	S	Bend	trans	-79.6	-10.9	177.4	0	0	0	0	0	114.8
375	T	56.5	Low	51.5	Low	33 Å²	33	73.5 Å²	73.5	20%	0.202	43%	0.432	C	S	.	.	S	Bend	trans	-143	143.3	174.3	54.9	0	0	0	0	112.1	A377 L378 L379	T375-A377 PolarHBondContact O-N 3.28Å; T375-L378 PolarHBondContact O-N 3.31Å; T375-L378 WeakPolarHBondContact OG1-CD1 3.38Å; T375-L378 WeakPolarHBondContact OG1-CG 3.17Å; T375-L379 PolarHBondContact O-N 3.39Å; T375-L379 VanDerWaalsContact O-N 3.12Å
376	E	49.3	Very low	51.5	Low	110 Å²	110	71.6 Å²	71.6	51%	0.514	42%	0.42	S	S	.	.	H	α-helix	trans	-55.4	-38	176.8	-162	-157.5	166.6	0	0	112.1	F364 L378 L379 L380	F364-E376 HydrophobicContact CD1-CB 3.98Å; F364-E376 HydrophobicContact CD1-CG 4.13Å; F364-E376 HydrophobicContact CE1-CB 3.75Å; F364-E376 HydrophobicContact CE1-CG 4.01Å; F364-E376 HydrophobicContact CE2-CB 4.34Å; F364-E376 HydrophobicContact CG-CB 4.37Å; F364-E376 HydrophobicContact CZ-CB 3.95Å; E376-L378 VanDerWaalsContact C-N 3.26Å; E376-L378 PolarHBondContact O-N 3.15Å; E376-L379 CarbonylContact O-C 3.58Å; E376-L379 PolarHBondContact O-N 2.83Å; E376-L379 VanDerWaalsContact O-N 3.15Å; E376-L380 HydrophobicContact CG-CD1 4.01Å; E376-L380 HydrophobicContact CG-CG 4.38Å; E376-L380 WeakPolarHBondContact O-CB 3.44Å; E376-L380 WeakPolarHBondContact O-CG 3.47Å; E376-L380 PolarHBondContact O-N 3.28Å
377	A	55.5	Low	51.3	Low	73 Å²	73	75.9 Å²	75.9	60%	0.603	45%	0.447	S	S	*	.	H	α-helix	trans	-61.9	-31.2	177.8	0	0	0	0	0	113.3	T375 A381	T375-A377 PolarHBondContact O-N 3.28Å; A377-A381 WeakPolarHBondContact O-CB 3.33Å; A377-A381 PolarHBondContact O-N 3.43Å; A377-A381 VanDerWaalsContact O-N 3.12Å
378	L	54.3	Low	50.7	Low	100 Å²	100	74.4 Å²	74.4	52%	0.524	44%	0.439	S	S	.	.	H	α-helix	trans	-78.6	-39	173	-70.3	175.3	0	0	0	111.7	F373 T375 E376 A381 H382	F373-L378 HydrophobicContact CB-CB 4.47Å; F373-L378 HydrophobicContact CD1-CB 4.06Å; T375-L378 PolarHBondContact O-N 3.31Å; T375-L378 WeakPolarHBondContact OG1-CD1 3.38Å; T375-L378 WeakPolarHBondContact OG1-CG 3.17Å; E376-L378 VanDerWaalsContact C-N 3.26Å; E376-L378 PolarHBondContact O-N 3.15Å; L378-A381 PolarHBondContact O-N 3.23Å; L378-H382 WeakPolarHBondContact O-CB 3.25Å; L378-H382 PolarHBondContact O-N 2.88Å
379	L	57.3	Low	50.5	Low	20 Å²	20	76.8 Å²	76.8	11%	0.105	45%	0.452	C	S	.	.	H	α-helix	trans	-59.1	-47.1	171	175.1	60.8	0	0	0	111	F364 C366 F373 T375 E376 A381 H382 R383	F364-L379 HydrophobicContact CB-CB 4.13Å; F364-L379 HydrophobicContact CB-CD2 3.88Å; C366-L379 HydrophobicContact CB-CD1 3.49Å; C366-L379 VanDerWaalsContact CB-CD1 3.49Å; F373-L379 HydrophobicContact CB-CB 4.19Å; F373-L379 HydrophobicContact CD2-CB 4.24Å; F373-L379 HydrophobicContact CD2-CD1 3.85Å; F373-L379 HydrophobicContact CE2-CD1 4.27Å; F373-L379 HydrophobicContact CG-CB 4.28Å; T375-L379 PolarHBondContact O-N 3.39Å; T375-L379 VanDerWaalsContact O-N 3.12Å; E376-L379 CarbonylContact O-C 3.58Å; E376-L379 PolarHBondContact O-N 2.83Å; E376-L379 VanDerWaalsContact O-N 3.15Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 3.4Å; L379-H382 CarbonylContact O-C 3.5Å; L379-H382 WeakPolarHBondContact O-CA 3.45Å; L379-H382 WeakPolarHBondContact O-CB 3.38Å; L379-H382 PolarHBondContact O-N 2.64Å; L379-R383 HydrophobicContact CD1-CG 3.77Å; L379-R383 HydrophobicContact CG-CG 4.22Å; L379-R383 WeakPolarHBondContact O-CG 3.38Å; L379-R383 PolarHBondContact O-N 2.87Å
380	L	57.6	Low	50.2	Low	76 Å²	76	77.5 Å²	77.5	40%	0.398	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-29.9	176.1	-75.5	166.1	0	0	0	112.9	E376 R384	E376-L380 HydrophobicContact CG-CD1 4.01Å; E376-L380 HydrophobicContact CG-CG 4.38Å; E376-L380 WeakPolarHBondContact O-CB 3.44Å; E376-L380 WeakPolarHBondContact O-CG 3.47Å; E376-L380 PolarHBondContact O-N 3.28Å; L380-R384 VanDerWaalsContact O-CD 3.27Å; L380-R384 WeakPolarHBondContact O-CD 3.44Å; L380-R384 VanDerWaalsContact O-CG 3.28Å; L380-R384 WeakPolarHBondContact O-CG 3.23Å; L380-R384 PolarHBondContact O-NE 2.78Å
381	A	56.9	Low	50.1	Low	54 Å²	54	79.8 Å²	79.8	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-73.5	-32.3	170.4	0	0	0	0	0	112.3	A377 L378 L379	A377-A381 WeakPolarHBondContact O-CB 3.33Å; A377-A381 PolarHBondContact O-N 3.43Å; A377-A381 VanDerWaalsContact O-N 3.12Å; L378-A381 PolarHBondContact O-N 3.23Å; L379-A381 VanDerWaalsContact C-N 3.28Å; L379-A381 PolarHBondContact O-N 3.4Å
382	H	58.9	Low	50.5	Low	41 Å²	41	77.2 Å²	77.2	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-79.9	-41.1	-179.7	-178.1	67	0	0	0	113.5	C369 F373 L378 L379 R384 A385 H386	C369-H382 PolarHBondContact SG-NE2 2.56Å; F373-H382 HydrophobicContact CE1-CB 3.89Å; F373-H382 AromaticContact CE1-CG 3.92Å; F373-H382 HydrophobicContact CE2-CB 4.1Å; F373-H382 AromaticContact CE2-CD2 3.23Å; F373-H382 WeakPolarHBondContact CE2-CD2 3.46Å; F373-H382 AromaticContact CE2-CG 3.74Å; F373-H382 AromaticContact CE2-NE2 3.79Å; F373-H382 HydrophobicContact CZ-CB 3.64Å; F373-H382 AromaticContact CZ-CD2 3.15Å; F373-H382 WeakPolarHBondContact CZ-CD2 3.19Å; F373-H382 AromaticContact CZ-CE1 3.84Å; F373-H382 AromaticContact CZ-CG 3.22Å; F373-H382 AromaticContact CZ-ND1 3.68Å; F373-H382 AromaticContact CZ-NE2 3.54Å; L378-H382 WeakPolarHBondContact O-CB 3.25Å; L378-H382 PolarHBondContact O-N 2.88Å; L379-H382 CarbonylContact O-C 3.5Å; L379-H382 WeakPolarHBondContact O-CA 3.45Å; L379-H382 WeakPolarHBondContact O-CB 3.38Å; L379-H382 PolarHBondContact O-N 2.64Å; H382-R384 PolarHBondContact O-N 2.96Å; H382-R384 VanDerWaalsContact O-N 3.15Å; H382-A385 WeakPolarHBondContact O-CA 3.46Å; H382-A385 VanDerWaalsContact O-CB 3.31Å; H382-A385 WeakPolarHBondContact O-CB 3.42Å; H382-A385 PolarHBondContact O-N 2.95Å; H382-H386 AromaticContact CD2-CD2 3.69Å; H382-H386 AromaticContact CD2-NE2 3.46Å; H382-H386 PolarHBondContact CD2-NE2 2.82Å; H382-H386 AromaticContact CE1-NE2 3.41Å; H382-H386 PolarHBondContact CE1-NE2 2.88Å; H382-H386 AromaticContact NE2-CD2 3.59Å; H382-H386 AromaticContact NE2-CE1 3.9Å; H382-H386 AromaticContact NE2-NE2 2.85Å; H382-H386 PolarHBondContact NE2-NE2 3.47Å; H382-H386 PolarHBondContact O-N 3.4Å
383	R	51.1	Low	50.6	Low	112 Å²	112	78.5 Å²	78.5	42%	0.423	45%	0.445	S	S	.	.	H	α-helix	trans	-61.3	-23.9	175.5	-65.8	-172.8	80.7	-166.4	2.4	112.7	D368 L379 A385 H386 T387	D368-R383 IonicContact OD1-NH2 3.79Å; D368-R383 IonicContact OD2-CZ 3.79Å; D368-R383 IonicContact OD2-NE 3.76Å; D368-R383 PolarHBondContact OD2-NE 3.26Å; D368-R383 IonicContact OD2-NH2 2.7Å; D368-R383 PolarHBondContact OD2-NH2 2.82Å; L379-R383 HydrophobicContact CD1-CG 3.77Å; L379-R383 HydrophobicContact CG-CG 4.22Å; L379-R383 WeakPolarHBondContact O-CG 3.38Å; L379-R383 PolarHBondContact O-N 2.87Å; R383-A385 PolarHBondContact O-N 3.44Å; R383-H386 CarbonylContact O-C 3.57Å; R383-H386 PolarHBondContact O-N 2.83Å; R383-T387 PolarHBondContact O-N 3.15Å
384	R	57.5	Low	50.4	Low	182 Å²	182	77.4 Å²	77.4	69%	0.687	44%	0.442	S	S	*	.	H	α-helix	trans	-69.7	-6.3	169.4	-65.7	167.3	-169.9	168.9	5.2	114.5	L380 H382 T387	L380-R384 VanDerWaalsContact O-CD 3.27Å; L380-R384 WeakPolarHBondContact O-CD 3.44Å; L380-R384 VanDerWaalsContact O-CG 3.28Å; L380-R384 WeakPolarHBondContact O-CG 3.23Å; L380-R384 PolarHBondContact O-NE 2.78Å; H382-R384 PolarHBondContact O-N 2.96Å; H382-R384 VanDerWaalsContact O-N 3.15Å; R384-T387 PolarHBondContact O-OG1 3.34Å
385	A	49.3	Very low	50.4	Low	77 Å²	77	82.1 Å²	82.1	64%	0.636	47%	0.465	S	S	*	.	H	α-helix	trans	-98.5	-22.7	166.3	0	0	0	0	0	112.3	H382 R383	H382-A385 WeakPolarHBondContact O-CA 3.46Å; H382-A385 VanDerWaalsContact O-CB 3.31Å; H382-A385 WeakPolarHBondContact O-CB 3.42Å; H382-A385 PolarHBondContact O-N 2.95Å; R383-A385 PolarHBondContact O-N 3.44Å
386	H	46	Very low	50.3	Low	64 Å²	64	83.7 Å²	83.7	30%	0.296	48%	0.476	S	S	.	.	H	α-helix	trans	-87.2	-7.7	173	-66.7	-52.9	0	0	0	114.4	C366 D368 C369 H382 R383 P388	C366-H386 PolarHBondContact SG-CD2 3.44Å; D368-H386 HydrophobicContact CB-CB 3.89Å; C369-H386 VanDerWaalsContact CB-CE1 3.46Å; C369-H386 WeakPolarHBondContact CB-CE1 3.24Å; C369-H386 VanDerWaalsContact SG-CE1 3.52Å; C369-H386 PolarHBondContact SG-NE2 3.33Å; H382-H386 AromaticContact CD2-CD2 3.69Å; H382-H386 AromaticContact CD2-NE2 3.46Å; H382-H386 PolarHBondContact CD2-NE2 2.82Å; H382-H386 AromaticContact CE1-NE2 3.41Å; H382-H386 PolarHBondContact CE1-NE2 2.88Å; H382-H386 AromaticContact NE2-CD2 3.59Å; H382-H386 AromaticContact NE2-CE1 3.9Å; H382-H386 AromaticContact NE2-NE2 2.85Å; H382-H386 PolarHBondContact NE2-NE2 3.47Å; H382-H386 PolarHBondContact O-N 3.4Å; R383-H386 CarbonylContact O-C 3.57Å; R383-H386 PolarHBondContact O-N 2.83Å; H386-P388 WeakPolarHBondContact O-CD 3.24Å
387	T	47.2	Very low	50.1	Low	92 Å²	92	81.7 Å²	81.7	56%	0.564	49%	0.485	S	S	*	.	S	Bend	trans	-74.2	99.4	157.3	51.2	0	0	0	0	108.6	R383 R384	R383-T387 PolarHBondContact O-N 3.15Å; R384-T387 PolarHBondContact O-OG1 3.34Å
388	P	37.8	Very low	49.8	Very low	102 Å²	102	84.1 Å²	84.1	66%	0.662	48%	0.482	S	S	*	.			trans	-57.8	146.2	159.8	29.6	-36	0	0	0	107.6	H386 P390	H386-P388 WeakPolarHBondContact O-CD 3.24Å; P388-P390 WeakPolarHBondContact O-CD 3.39Å
389	N	40.9	Very low	49.4	Very low	134 Å²	134	83.5 Å²	83.5	72%	0.717	48%	0.483	S	S	*	.			trans	-56.9	113.8	168.6	-84.3	-25	0	0	0	107.7	L391	N389-L391 PolarHBondContact O-N 2.77Å
390	P	42.3	Very low	49.2	Very low	73 Å²	73	84.7 Å²	84.7	47%	0.474	49%	0.487	S	S	.	.			trans	-65.9	134.1	177.5	-16.7	32.2	0	0	0	107.8	P388 H392	P388-P390 WeakPolarHBondContact O-CD 3.39Å; P390-H392 PolarHBondContact O-CD2 3.29Å; P390-H392 VanDerWaalsContact O-CD2 3.24Å; P390-H392 PolarHBondContact O-N 3.31Å
391	L	43.2	Very low	48.6	Very low	106 Å²	106	86 Å²	86	56%	0.555	50%	0.499	S	S	*	.			trans	-68.2	91.5	160.5	-70.6	177.7	0	0	0	106.4	N389 S393 V401	N389-L391 PolarHBondContact O-N 2.77Å; L391-S393 PolarHBondContact O-N 2.98Å; L391-V401 HydrophobicContact CD2-CB 4.22Å; L391-V401 HydrophobicContact CD2-CG1 4.17Å; L391-V401 HydrophobicContact CD2-CG2 3.81Å
392	H	54.8	Low	48.3	Very low	39 Å²	39	87.3 Å²	87.3	18%	0.181	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	106.4	-174.2	-60.9	-75.5	0	0	0	109	P390 T399 F400 F406	P390-H392 PolarHBondContact O-CD2 3.29Å; P390-H392 VanDerWaalsContact O-CD2 3.24Å; P390-H392 PolarHBondContact O-N 3.31Å; H392-T399 CarbonylContact O-C 3.58Å; H392-T399 WeakPolarHBondContact O-CA 3.46Å; H392-F400 PolarHBondContact N-O 2.96Å; H392-F400 WeakPolarHBondContact O-CD2 3.32Å; H392-F400 PolarHBondContact O-N 2.94Å; H392-F406 HydrophobicContact CB-CB 3.73Å; H392-F406 HydrophobicContact CB-CD1 3.75Å; H392-F406 HydrophobicContact CB-CD2 3.47Å; H392-F406 VanDerWaalsContact CB-CD2 3.47Å; H392-F406 HydrophobicContact CB-CE1 4.19Å; H392-F406 HydrophobicContact CB-CE2 3.94Å; H392-F406 HydrophobicContact CB-CG 3.35Å; H392-F406 HydrophobicContact CB-CZ 4.27Å; H392-F406 AromaticContact CG-CD1 3.95Å; H392-F406 AromaticContact CG-CG 3.94Å
393	S	46.8	Very low	47.8	Very low	83 Å²	83	89.5 Å²	89.5	58%	0.58	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	138.5	176.7	44.3	0	0	0	0	111	L391 K398 F406	L391-S393 PolarHBondContact O-N 2.98Å; S393-K398 WeakPolarHBondContact CA-O 3.27Å; S393-F406 WeakPolarHBondContact O-CE2 3.43Å
394	C	51.1	Low	47.8	Very low	13 Å²	13	89.2 Å²	89.2	9%	0.088	52%	0.521	C	S	.	.			trans	-101.4	146.2	166.7	-164.8	0	0	0	0	108.8	C396 G397 K398 F400 F406	C394-C396 PolarHBondContact O-N 3.32Å; C394-C396 VanDerWaalsContact SG-SG 3.62Å; C394-G397 PolarHBondContact O-N 3.19Å; C394-K398 PolarHBondContact N-O 2.98Å; C394-F400 HydrophobicContact CB-CE2 4.45Å; C394-F406 HydrophobicContact CB-CE2 4.47Å
395	P	45.2	Very low	47.6	Very low	141 Å²	141	87.4 Å²	87.4	92%	0.916	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19	178.6	-29.3	37.3	0	0	0	115.3	G397	P395-G397 PolarHBondContact O-N 3.12Å
396	C	52.8	Low	48	Very low	65 Å²	65	85.1 Å²	85.1	44%	0.439	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	19.6	170.2	67.2	0	0	0	0	114.5	C394 K398 H409	C394-C396 PolarHBondContact O-N 3.32Å; C394-C396 VanDerWaalsContact SG-SG 3.62Å; C396-K398 VanDerWaalsContact C-N 3.31Å; C396-K398 PolarHBondContact O-N 3.27Å; C396-H409 PolarHBondContact SG-NE2 3.02Å
397	G	46.6	Very low	48.5	Very low	69 Å²	69	86.3 Å²	86.3	71%	0.711	50%	0.502	S	S	*	.	S	Bend	trans	79.5	-3.9	175.3	0	0	0	0	0	116.4	C394 P395	C394-G397 PolarHBondContact O-N 3.19Å; P395-G397 PolarHBondContact O-N 3.12Å
398	K	47.6	Very low	49	Very low	123 Å²	123	90.1 Å²	90.1	54%	0.535	51%	0.508	S	S	.	.			trans	-90.5	130.7	-173.5	-66	175.4	-177	174	0	112.2	S393 C394 C396 F400	S393-K398 WeakPolarHBondContact CA-O 3.27Å; C394-K398 PolarHBondContact N-O 2.98Å; C396-K398 VanDerWaalsContact C-N 3.31Å; C396-K398 PolarHBondContact O-N 3.27Å; K398-F400 HydrophobicContact CB-CE2 3.63Å; K398-F400 HydrophobicContact CB-CZ 3.93Å
399	T	46.5	Very low	50.1	Low	88 Å²	88	86.7 Å²	86.7	54%	0.54	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.2	179	50.3	0	0	0	0	112.4	H392	H392-T399 CarbonylContact O-C 3.58Å; H392-T399 WeakPolarHBondContact O-CA 3.46Å
400	F	53.5	Low	50.7	Low	44 Å²	44	87.9 Å²	87.9	19%	0.193	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	118.5	-173.3	-63.1	-91.4	0	0	0	112.4	H392 C394 K398 N402 K405 F406 H409	H392-F400 PolarHBondContact N-O 2.96Å; H392-F400 WeakPolarHBondContact O-CD2 3.32Å; H392-F400 PolarHBondContact O-N 2.94Å; C394-F400 HydrophobicContact CB-CE2 4.45Å; K398-F400 HydrophobicContact CB-CE2 3.63Å; K398-F400 HydrophobicContact CB-CZ 3.93Å; F400-N402 PolarHBondContact O-N 3.3Å; F400-N402 VanDerWaalsContact O-N 3.16Å; F400-K405 HydrophobicContact CD1-CB 4.29Å; F400-F406 HydrophobicContact CB-CB 4.03Å; F400-F406 HydrophobicContact CD2-CD2 4.14Å; F400-F406 HydrophobicContact CG-CB 4.45Å; F400-H409 HydrophobicContact CE1-CB 4.44Å; F400-H409 HydrophobicContact CE2-CB 4.46Å; F400-H409 AromaticContact CE2-CD2 3.24Å; F400-H409 WeakPolarHBondContact CE2-CD2 3.14Å; F400-H409 AromaticContact CE2-NE2 3.88Å; F400-H409 HydrophobicContact CZ-CB 4.08Å; F400-H409 AromaticContact CZ-CD2 3.3Å; F400-H409 WeakPolarHBondContact CZ-CD2 3.37Å; F400-H409 AromaticContact CZ-CG 3.69Å; F400-H409 AromaticContact CZ-NE2 3.86Å
401	V	45.4	Very low	51.3	Low	105 Å²	105	94.6 Å²	94.6	64%	0.636	49%	0.493	S	S	*	.	S	Bend	trans	-71.2	-2.7	177.1	-151.4	0	0	0	0	113.6	L391	L391-V401 HydrophobicContact CD2-CB 4.22Å; L391-V401 HydrophobicContact CD2-CG1 4.17Å; L391-V401 HydrophobicContact CD2-CG2 3.81Å
402	N	48.8	Very low	51.8	Low	80 Å²	80	93.7 Å²	93.7	43%	0.428	49%	0.492	S	S	.	.			trans	-136.6	112.5	-172.4	-177.4	-38.1	0	0	0	110.2	F400 T404 K405 F406	F400-N402 PolarHBondContact O-N 3.3Å; F400-N402 VanDerWaalsContact O-N 3.16Å; N402-T404 PolarHBondContact O-N 3.12Å; N402-T404 VanDerWaalsContact OD1-CB 3.32Å; N402-T404 WeakPolarHBondContact OD1-CB 3.41Å; N402-T404 PolarHBondContact OD1-N 2.92Å; N402-T404 PolarHBondContact OD1-OG1 3.37Å; N402-K405 HydrophobicContact CB-CB 4.37Å; N402-K405 PolarHBondContact O-N 2.83Å; N402-K405 PolarHBondContact OD1-N 3.48Å; N402-F406 PolarHBondContact O-N 2.99Å
403	L	49.3	Very low	51.8	Low	88 Å²	88	97.5 Å²	97.5	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-51.8	-36.6	179.4	179.4	61.2	0	0	0	113.2	F406 L407	L403-F406 HydrophobicContact CD1-CD1 4.28Å; L403-F406 PolarHBondContact O-N 2.9Å; L403-L407 HydrophobicContact CD1-CD1 3.87Å; L403-L407 HydrophobicContact CD1-CD2 4.44Å; L403-L407 HydrophobicContact CD1-CG 3.87Å; L403-L407 HydrophobicContact CG-CD1 3.87Å; L403-L407 HydrophobicContact CG-CG 4.28Å; L403-L407 WeakPolarHBondContact O-CB 3.31Å; L403-L407 VanDerWaalsContact O-CG 3.28Å; L403-L407 WeakPolarHBondContact O-CG 3.25Å; L403-L407 PolarHBondContact O-N 3.43Å
404	T	51.3	Low	51.3	Low	106 Å²	106	96.3 Å²	96.3	65%	0.65	51%	0.51	S	S	*	.	H	α-helix	trans	-68.7	-38.2	178.9	-44.4	0	0	0	0	111.7	N402 Y408	N402-T404 PolarHBondContact O-N 3.12Å; N402-T404 VanDerWaalsContact OD1-CB 3.32Å; N402-T404 WeakPolarHBondContact OD1-CB 3.41Å; N402-T404 PolarHBondContact OD1-N 2.92Å; N402-T404 PolarHBondContact OD1-OG1 3.37Å; T404-Y408 WeakPolarHBondContact O-CB 3.29Å; T404-Y408 PolarHBondContact O-N 2.85Å; T404-Y408 VanDerWaalsContact O-N 3.07Å
405	K	54	Low	50.6	Low	144 Å²	144	100.9 Å²	100.9	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-70.1	-38.8	172.9	-75.6	-164.4	172.2	-169	0	111.7	F400 N402 Y408 H409	F400-K405 HydrophobicContact CD1-CB 4.29Å; N402-K405 HydrophobicContact CB-CB 4.37Å; N402-K405 PolarHBondContact O-N 2.83Å; N402-K405 PolarHBondContact OD1-N 3.48Å; K405-Y408 PolarHBondContact O-N 2.91Å; K405-H409 WeakPolarHBondContact O-CB 3.23Å; K405-H409 PolarHBondContact O-N 2.65Å
406	F	57.1	Low	49.9	Very low	29 Å²	29	98 Å²	98	13%	0.127	55%	0.545	C	S	.	.	H	α-helix	trans	-61.7	-48.7	174.4	175	-110.9	0	0	0	112.2	H392 S393 C394 F400 N402 L403 Y408 H409 R410	H392-F406 HydrophobicContact CB-CB 3.73Å; H392-F406 HydrophobicContact CB-CD1 3.75Å; H392-F406 HydrophobicContact CB-CD2 3.47Å; H392-F406 VanDerWaalsContact CB-CD2 3.47Å; H392-F406 HydrophobicContact CB-CE1 4.19Å; H392-F406 HydrophobicContact CB-CE2 3.94Å; H392-F406 HydrophobicContact CB-CG 3.35Å; H392-F406 HydrophobicContact CB-CZ 4.27Å; H392-F406 AromaticContact CG-CD1 3.95Å; H392-F406 AromaticContact CG-CG 3.94Å; S393-F406 WeakPolarHBondContact O-CE2 3.43Å; C394-F406 HydrophobicContact CB-CE2 4.47Å; F400-F406 HydrophobicContact CB-CB 4.03Å; F400-F406 HydrophobicContact CD2-CD2 4.14Å; F400-F406 HydrophobicContact CG-CB 4.45Å; N402-F406 PolarHBondContact O-N 2.99Å; L403-F406 HydrophobicContact CD1-CD1 4.28Å; L403-F406 PolarHBondContact O-N 2.9Å; F406-Y408 VanDerWaalsContact C-N 3.3Å; F406-Y408 PolarHBondContact O-N 2.88Å; F406-H409 PolarHBondContact O-N 3.49Å; F406-R410 WeakPolarHBondContact O-CB 3.48Å; F406-R410 PolarHBondContact O-N 2.74Å
407	L	56.2	Low	49	Very low	89 Å²	89	98.5 Å²	98.5	47%	0.466	56%	0.561	S	S	.	*	H	α-helix	trans	-66.1	-32.1	179.2	-70.1	173.6	0	0	0	112.4	L403 R411	L403-L407 HydrophobicContact CD1-CD1 3.87Å; L403-L407 HydrophobicContact CD1-CD2 4.44Å; L403-L407 HydrophobicContact CD1-CG 3.87Å; L403-L407 HydrophobicContact CG-CD1 3.87Å; L403-L407 HydrophobicContact CG-CG 4.28Å; L403-L407 WeakPolarHBondContact O-CB 3.31Å; L403-L407 VanDerWaalsContact O-CG 3.28Å; L403-L407 WeakPolarHBondContact O-CG 3.25Å; L403-L407 PolarHBondContact O-N 3.43Å; L407-R411 VanDerWaalsContact O-CB 3.24Å; L407-R411 WeakPolarHBondContact O-CB 3.43Å; L407-R411 PolarHBondContact O-N 3.09Å
408	Y	57.8	Low	48.1	Very low	172 Å²	172	102.3 Å²	102.3	68%	0.675	57%	0.57	S	S	*	*	H	α-helix	trans	-65.3	-51.5	170.4	-173	-94	0	0	0	111.2	T404 K405 F406 R410 R411 T412	T404-Y408 WeakPolarHBondContact O-CB 3.29Å; T404-Y408 PolarHBondContact O-N 2.85Å; T404-Y408 VanDerWaalsContact O-N 3.07Å; K405-Y408 PolarHBondContact O-N 2.91Å; F406-Y408 VanDerWaalsContact C-N 3.3Å; F406-Y408 PolarHBondContact O-N 2.88Å; Y408-R410 VanDerWaalsContact C-N 3.31Å; Y408-R410 PolarHBondContact O-N 2.97Å; Y408-R411 WeakPolarHBondContact O-CA 3.43Å; Y408-R411 WeakPolarHBondContact O-CB 3.44Å; Y408-R411 PolarHBondContact O-N 3.2Å; Y408-T412 HydrophobicContact CE1-CG2 4.25Å; Y408-T412 PolarHBondContact O-N 2.97Å; Y408-T412 PolarHBondContact O-OG1 2.84Å
409	H	61	Low	48	Very low	29 Å²	29	101.7 Å²	101.7	13%	0.134	58%	0.578	C	S	.	*	H	α-helix	trans	-61.1	-36.5	177.6	-179.9	50.3	0	0	0	113.1	C396 F400 K405 F406 T412 H413	C396-H409 PolarHBondContact SG-NE2 3.02Å; F400-H409 HydrophobicContact CE1-CB 4.44Å; F400-H409 HydrophobicContact CE2-CB 4.46Å; F400-H409 AromaticContact CE2-CD2 3.24Å; F400-H409 WeakPolarHBondContact CE2-CD2 3.14Å; F400-H409 AromaticContact CE2-NE2 3.88Å; F400-H409 HydrophobicContact CZ-CB 4.08Å; F400-H409 AromaticContact CZ-CD2 3.3Å; F400-H409 WeakPolarHBondContact CZ-CD2 3.37Å; F400-H409 AromaticContact CZ-CG 3.69Å; F400-H409 AromaticContact CZ-NE2 3.86Å; K405-H409 WeakPolarHBondContact O-CB 3.23Å; K405-H409 PolarHBondContact O-N 2.65Å; F406-H409 PolarHBondContact O-N 3.49Å; H409-T412 WeakPolarHBondContact CA-OG1 3.45Å; H409-T412 PolarHBondContact O-N 3.03Å; H409-T412 PolarHBondContact O-OG1 3.17Å; H409-H413 AromaticContact CE1-CD2 3.37Å; H409-H413 PolarHBondContact CE1-CD2 3.47Å; H409-H413 AromaticContact CE1-NE2 3.3Å; H409-H413 PolarHBondContact CE1-NE2 2.8Å; H409-H413 VanDerWaalsContact CE1-NE2 3.3Å; H409-H413 AromaticContact ND1-CD2 3.78Å; H409-H413 AromaticContact NE2-CD2 3.9Å; H409-H413 AromaticContact NE2-NE2 3.99Å; H409-H413 PolarHBondContact O-CD2 3.07Å; H409-H413 PolarHBondContact O-N 3.09Å
410	R	52.5	Low	47.2	Very low	160 Å²	160	105.5 Å²	105.5	60%	0.604	60%	0.595	S	S	*	*	H	α-helix	trans	-71.7	-31.1	174.2	-154.8	-177.8	93.6	151.2	6.9	112.2	F406 Y408 H413	F406-R410 WeakPolarHBondContact O-CB 3.48Å; F406-R410 PolarHBondContact O-N 2.74Å; Y408-R410 VanDerWaalsContact C-N 3.31Å; Y408-R410 PolarHBondContact O-N 2.97Å; R410-H413 CarbonylContact O-C 3.57Å; R410-H413 PolarHBondContact O-N 3.39Å
411	R	56.6	Low	46.6	Very low	214 Å²	214	108.8 Å²	108.8	81%	0.808	62%	0.62	S	S	*	*	H	α-helix	trans	-72.2	-31.1	173.3	177.3	172.5	-84	-176.7	-8.4	112.2	L407 Y408 H413 G414	L407-R411 VanDerWaalsContact O-CB 3.24Å; L407-R411 WeakPolarHBondContact O-CB 3.43Å; L407-R411 PolarHBondContact O-N 3.09Å; Y408-R411 WeakPolarHBondContact O-CA 3.43Å; Y408-R411 WeakPolarHBondContact O-CB 3.44Å; Y408-R411 PolarHBondContact O-N 3.2Å; R411-H413 PolarHBondContact O-N 3.22Å; R411-G414 PolarHBondContact O-N 2.91Å
412	T	54	Low	45.7	Very low	87 Å²	87	108.2 Å²	108.2	53%	0.534	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.2	-9.4	170.1	52.6	0	0	0	0	114	Y408 H409	Y408-T412 HydrophobicContact CE1-CG2 4.25Å; Y408-T412 PolarHBondContact O-N 2.97Å; Y408-T412 PolarHBondContact O-OG1 2.84Å; H409-T412 WeakPolarHBondContact CA-OG1 3.45Å; H409-T412 PolarHBondContact O-N 3.03Å; H409-T412 PolarHBondContact O-OG1 3.17Å
413	H	53	Low	44.7	Very low	119 Å²	119	109 Å²	109	55%	0.551	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	39.6	170.6	-79.8	-68.8	0	0	0	111.3	H409 R410 R411 A415	H409-H413 AromaticContact CE1-CD2 3.37Å; H409-H413 PolarHBondContact CE1-CD2 3.47Å; H409-H413 AromaticContact CE1-NE2 3.3Å; H409-H413 PolarHBondContact CE1-NE2 2.8Å; H409-H413 VanDerWaalsContact CE1-NE2 3.3Å; H409-H413 AromaticContact ND1-CD2 3.78Å; H409-H413 AromaticContact NE2-CD2 3.9Å; H409-H413 AromaticContact NE2-NE2 3.99Å; H409-H413 PolarHBondContact O-CD2 3.07Å; H409-H413 PolarHBondContact O-N 3.09Å; R410-H413 CarbonylContact O-C 3.57Å; R410-H413 PolarHBondContact O-N 3.39Å; R411-H413 PolarHBondContact O-N 3.22Å; H413-A415 PolarHBondContact O-N 2.82Å
414	G	36.4	Very low	44.2	Very low	58 Å²	58	110.2 Å²	110.2	60%	0.598	66%	0.657	S	S	*	*			trans	-77.1	118.3	-176	0	0	0	0	0	114	R411	R411-G414 PolarHBondContact O-N 2.91Å
415	A	36.6	Very low	43	Very low	108 Å²	108	111.5 Å²	111.5	89%	0.893	67%	0.665	S	S	*	*			trans	54.5	77	155.9	0	0	0	0	0	117.9	H413	H413-A415 PolarHBondContact O-N 2.82Å
416	G	31.7	Very low	42.8	Very low	81 Å²	81	109.9 Å²	109.9	84%	0.835	67%	0.669	S	S	*	*			trans	-110.1	114.5	152	0	0	0	0	0	109.9
417	G	32.2	Very low	42.6	Very low	75 Å²	75	113.7 Å²	113.7	77%	0.773	70%	0.697	S	S	*	*			trans	-79.7	156.7	170.8	0	0	0	0	0	111.8
418	V	28.7	Very low	41.4	Very low	149 Å²	149	118.1 Å²	118.1	90%	0.903	72%	0.715	S	S	*	*			trans	-75.4	141.8	174.3	176.3	0	0	0	0	109.3
419	P	46.5	Very low	39.9	Very low	110 Å²	110	118.7 Å²	118.7	71%	0.714	72%	0.724	S	S	*	*			trans	-108.4	176.8	-150.9	41.8	-37.1	0	0	0	115.2
420	L	27.7	Very low	39.3	Very low	169 Å²	169	123.2 Å²	123.2	89%	0.885	76%	0.756	S	S	*	*			trans	-166.3	167.5	150.8	-100.1	167.2	0	0	0	108.3
421	P	40.9	Very low	38.3	Very low	112 Å²	112	119.6 Å²	119.6	73%	0.727	76%	0.76	S	S	*	*				-133.9	167.2	-117.8	44	-29	0	0	0	120.4
422	A	28.3	Very low	36.9	Very low	94 Å²	94	116 Å²	116	78%	0.777	76%	0.762	S	S	*	*			trans	82	123.3	141.9	0	0	0	0	0	124.7
423	A	27.5	Very low	35.6	Very low	96 Å²	96	117 Å²	117	79%	0.793	77%	0.773	S	S	*	*			trans	71	160.2	144.3	0	0	0	0	0	121
424	P	38.3	Very low	34.5	Very low	113 Å²	113	119.3 Å²	119.3	73%	0.734	79%	0.788	S	S	*	*			cis	-137.4	144.4	-34.7	33.1	-14.4	0	0	0	117.2
425	V	27.1	Very low	34.9	Very low	134 Å²	134	122.4 Å²	122.4	81%	0.812	80%	0.797	S	S	*	*			trans	29.1	163	134.3	-143	0	0	0	0	122.1
426	P	49.3	Very low	34.6	Very low	109 Å²	109	125.8 Å²	125.8	71%	0.708	80%	0.795	S	S	*	*				-113.2	-143.6	-66.4	43.8	-26.8	0	0	0	110.8
427	P	53.1	Low	35.4	Very low	110 Å²	110	127 Å²	127	71%	0.714	79%	0.788	S	S	*	*			cis	-123.5	-148.4	-12.4	26.5	1.9	0	0	0	112.5
428	E	29.9	Very low	35.3	Very low	181 Å²	181	128 Å²	128	85%	0.846	79%	0.789	S	S	*	*			cis	-146.9	-168.9	13.1	-67.4	-175.5	88.6	0	0	112.8
429	E	27.4	Very low	36.5	Very low	185 Å²	185	126.8 Å²	126.8	86%	0.864	78%	0.784	S	S	*	*			trans	-122.5	-163.2	176.8	-53.2	-167.2	140.3	0	0	110.6
430	P	48.4	Very low	35.7	Very low	124 Å²	124	125.7 Å²	125.7	81%	0.805	78%	0.784	S	S	*	*			cis	-129.9	-115.3	-2.7	37	-14.3	0	0	0	118.5
431	A	30.2	Very low	36	Very low	83 Å²	83	126.2 Å²	126.2	69%	0.686	78%	0.782	S	S	*	*				-158	-159.3	-128.1	0	0	0	0	0	117.3
432	V	28	Very low	35.4	Very low	139 Å²	139	126 Å²	126	84%	0.842	78%	0.779	S	S	*	*			trans	69.2	149	175	-123.2	0	0	0	0	114.6
433	S	25.6	Very low	35.4	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	79%	0.785	S	S	*	*			cis	-153.4	170.3	19	-56.6	0	0	0	0	115.6
434	L	30.7	Very low	35.5	Very low	166 Å²	166	137.1 Å²	137.1	87%	0.869	79%	0.788	S	S	*	*			trans	-93.9	-176.1	163	-71	166.8	0	0	0	110.3
435	P	44.4	Very low	35.9	Very low	123 Å²	123	136.8 Å²	136.8	80%	0.799	79%	0.786	S	S	*	*			cis	-142.9	-145.8	14.7	45.1	-21.7	0	0	0	116.8
436	E	31.1	Very low	36.1	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	79%	0.79	S	S	*	*			trans	-86.5	-159.9	-171.5	-40.9	172	106.7	0	0	114.4
437	P	47.4	Very low	35.3	Very low	108 Å²	108	138.3 Å²	138.3	70%	0.701	79%	0.789	S	S	*	*			cis	-141.9	167.8	-12.7	40.9	-22.1	0	0	0	118.9
438	A	31.3	Very low	34.6	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	79%	0.792	S	S	*	*			trans	55.6	175.4	143.3	0	0	0	0	0	122.6
439	P	52.5	Low	34.5	Very low	124 Å²	124	138.1 Å²	138.1	81%	0.805	79%	0.789	S	S	*	*			cis	-131.2	-169.6	-30.3	32.5	-11.1	0	0	0	115.6
440	A	30.4	Very low	34.7	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	78%	0.777	S	S	*	*			trans	101.7	116.2	146.7	0	0	0	0	0	123.3
441	E	33.8	Very low	34.3	Very low	180 Å²	180	134.7 Å²	134.7	84%	0.841	78%	0.776	S	S	*	*			trans	59.8	147.8	131.1	-72.6	-173.7	-164	0	0	123.4
442	T	28.3	Very low	34.5	Very low	107 Å²	107	136.2 Å²	136.2	66%	0.656	78%	0.777	S	S	*	*			cis	-152.8	169	10.9	28	0	0	0	0	113.6
443	R	29.6	Very low	34.5	Very low	238 Å²	238	135 Å²	135	90%	0.898	77%	0.774	S	S	*	*			trans	95.5	145.3	151.9	-82.2	166.9	178.4	145.9	2.5	122
444	E	28.8	Very low	34.8	Very low	185 Å²	185	138.6 Å²	138.6	86%	0.864	78%	0.779	S	S	*	*			trans	-117.9	-168.6	-165.1	-55.8	-175.9	106.3	0	0	110.6
445	P	46.7	Very low	34.8	Very low	106 Å²	106	139.4 Å²	139.4	69%	0.688	78%	0.778	S	S	*	*			cis	-141.7	169.4	4.5	42.8	-23.4	0	0	0	119.3
446	E	31.6	Very low	34.2	Very low	191 Å²	191	141.3 Å²	141.3	89%	0.893	78%	0.782	S	S	*	*			trans	48.5	145.8	145.4	-71.2	-173.7	142.4	0	0	121.8
447	A	32.7	Very low	35.4	Very low	84 Å²	84	138.3 Å²	138.3	69%	0.694	78%	0.778	S	S	*	*			cis	-172.8	-174.9	-7.3	0	0	0	0	0	107.7
448	P	37.3	Very low	34.4	Very low	119 Å²	119	137.8 Å²	137.8	77%	0.773	78%	0.783	S	S	*	*			cis	-122.4	176.4	-17.3	40.5	-26.4	0	0	0	113.8
449	E	27.8	Very low	34.5	Very low	169 Å²	169	142.4 Å²	142.4	79%	0.79	79%	0.788	S	S	*	*			trans	-131.6	172.5	174.3	-84.4	-78.1	39.2	0	0	108.8
450	L	33.2	Very low	34	Very low	115 Å²	115	142.2 Å²	142.2	60%	0.602	79%	0.787	S	S	*	*			cis	-134.3	-132.4	7	-137.6	-178.8	0	0	0	107.7	T452	L450-T452 HydrophobicContact CD2-CG2 3.69Å
451	P	40	Very low	34.1	Very low	122 Å²	122	142.9 Å²	142.9	79%	0.792	79%	0.793	S	S	*	*			cis	-119.2	174.7	-2.2	43.5	-28.5	0	0	0	115.7
452	T	33.2	Very low	34.4	Very low	114 Å²	114	138.1 Å²	138.1	70%	0.699	78%	0.784	S	S	*	*			trans	-129.8	157.4	-174.8	40.5	0	0	0	0	112.9	L450	L450-T452 HydrophobicContact CD2-CG2 3.69Å
453	S	28.3	Very low	35.6	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	80%	0.795	S	S	*	*			trans	-174.2	146.7	145.6	35.6	0	0	0	0	110.1
454	E	32.3	Very low	37.1	Very low	185 Å²	185	130.6 Å²	130.6	86%	0.864	78%	0.776	S	S	*	*			cis	-156.8	-164	-23.9	-99.4	-142.7	113.9	0	0	107.5
455	E	29.6	Very low	38.6	Very low	183 Å²	183	125.7 Å²	125.7	86%	0.855	76%	0.759	S	S	*	*			trans	77.8	79	163.1	-53.7	-162.5	118	0	0	120.5
456	N	33.1	Very low	39.8	Very low	164 Å²	164	126 Å²	126	88%	0.877	75%	0.747	S	S	*	*				47.4	168.3	112.8	-96.4	-24.1	0	0	0	123
457	P	55.5	Low	41.6	Very low	116 Å²	116	123 Å²	123	75%	0.753	73%	0.728	S	S	*	*			trans	-124.7	164.4	-133.7	43.3	-30.4	0	0	0	117.2
458	A	26.8	Very low	43.7	Very low	97 Å²	97	119 Å²	119	80%	0.802	70%	0.695	S	S	*	*			trans	-159	107.3	162	0	0	0	0	0	114.2
459	E	33.5	Very low	45.3	Very low	192 Å²	192	120.5 Å²	120.5	90%	0.897	70%	0.696	S	S	*	*			trans	47.6	159.6	142.1	-78.5	-153.7	147	0	0	124.2
460	P	42.2	Very low	47.1	Very low	120 Å²	120	118.2 Å²	118.2	78%	0.779	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-85.8	144.4	-155.3	32.6	-36.1	0	0	0	116.2
461	A	32	Very low	48.9	Very low	101 Å²	101	115.4 Å²	115.4	84%	0.835	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-72.4	130.2	179.1	0	0	0	0	0	113.4
462	A	40.1	Very low	50.4	Low	79 Å²	79	113 Å²	113	65%	0.653	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-65.3	145.5	178.7	0	0	0	0	0	113.4	G464	A462-G464 PolarHBondContact O-N 2.83Å
463	P	54.2	Low	52.1	Low	139 Å²	139	115.1 Å²	115.1	90%	0.903	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	121.3	-172.3	28.9	-35.1	0	0	0	113.2
464	G	59.8	Low	54.4	Low	48 Å²	48	114.5 Å²	114.5	50%	0.495	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	147.7	-14.6	162.7	0	0	0	0	0	117.3	A462 Y466	A462-G464 PolarHBondContact O-N 2.83Å; G464-Y466 WeakPolarHBondContact O-CD2 3.44Å
465	T	61.7	Low	56.6	Low	83 Å²	83	107.5 Å²	107.5	51%	0.509	61%	0.61	S	S	.	*			trans	-91.7	112.1	-179.2	41.4	0	0	0	0	112.2	R467	T465-R467 PolarHBondContact O-N 3.45Å; T465-R467 VanDerWaalsContact O-N 3.16Å
466	Y	71.8	Confident	58.7	Low	112 Å²	112	104.2 Å²	104.2	44%	0.439	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.2	94.6	178.3	-67.7	-90.8	0	0	0	110	G464 F475 K477 A478	G464-Y466 WeakPolarHBondContact O-CD2 3.44Å; Y466-F475 WeakPolarHBondContact CB-O 3.48Å; Y466-F475 PolarHBondContact N-O 2.81Å; Y466-F475 WeakPolarHBondContact O-CB 3.41Å; Y466-F475 WeakPolarHBondContact O-CD2 3.35Å; Y466-F475 PolarHBondContact O-N 3.01Å; Y466-K477 VanDerWaalsContact CD2-C 3.4Å; Y466-A478 HydrophobicContact CD1-CB 3.9Å; Y466-A478 HydrophobicContact CE1-CB 3.55Å; Y466-A478 HydrophobicContact CE2-CB 4.26Å; Y466-A478 VanDerWaalsContact CE2-N 3.31Å; Y466-A478 HydrophobicContact CG-CB 4.39Å
467	R	68.8	Low	60.8	Low	128 Å²	128	102.9 Å²	102.9	48%	0.483	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.9	137.1	-178.7	-171.2	167.3	171.2	144.2	-20.9	112.9	T465 L469 R473 E474	T465-R467 PolarHBondContact O-N 3.45Å; T465-R467 VanDerWaalsContact O-N 3.16Å; R467-L469 PolarHBondContact O-N 3.12Å; R467-R473 CarbonylContact C-O 3.44Å; R467-E474 HydrophobicContact CB-CG 3.97Å; R467-E474 WeakPolarHBondContact CD-OE1 3.22Å; R467-E474 HydrophobicContact CG-CG 3.83Å; R467-E474 IonicContact CZ-OE1 2.74Å; R467-E474 IonicContact NE-OE1 3.21Å; R467-E474 IonicContact NH1-OE1 3.84Å; R467-E474 PolarHBondContact NH1-OE1 3.12Å
468	C	76.1	Confident	61.6	Low	0 Å²	0	99.3 Å²	99.3	0%	0	57%	0.568	C	S	.	*			trans	-87.4	106.2	173.4	-170	0	0	0	0	110.7	L470 C471 S472 R473 F475 L481 H484	C468-L470 PolarHBondContact O-N 3.31Å; C468-C471 PolarHBondContact O-N 3.4Å; C468-C471 VanDerWaalsContact O-N 3.16Å; C468-S472 VanDerWaalsContact O-CA 3.3Å; C468-S472 WeakPolarHBondContact O-CA 3.34Å; C468-S472 PolarHBondContact O-N 3.27Å; C468-R473 WeakPolarHBondContact CB-O 3.3Å; C468-R473 PolarHBondContact N-O 3.04Å; C468-F475 HydrophobicContact CB-CE2 4.23Å; C468-L481 HydrophobicContact CB-CD1 3.45Å; C468-L481 VanDerWaalsContact CB-CD1 3.45Å; C468-H484 WeakPolarHBondContact CB-NE2 3.28Å; C468-H484 VanDerWaalsContact SG-CD2 3.5Å; C468-H484 PolarHBondContact SG-NE2 3.36Å
469	L	71.3	Confident	63.7	Low	151 Å²	151	101.1 Å²	101.1	79%	0.791	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-9.4	179.5	-51.9	-178.9	0	0	0	114.5	R467	R467-L469 PolarHBondContact O-N 3.12Å
470	L	66.8	Low	65.4	Low	120 Å²	120	95.5 Å²	95.5	63%	0.628	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-3.3	-178.3	-58.8	174.9	0	0	0	114.5	C468 H489	C468-L470 PolarHBondContact O-N 3.31Å; L470-H489 HydrophobicContact CB-CB 4.47Å; L470-H489 WeakPolarHBondContact CB-ND1 3.49Å; L470-H489 HydrophobicContact CD1-CB 3.69Å; L470-H489 PolarHBondContact O-CE1 3.33Å
471	C	70.9	Confident	67.1	Low	57 Å²	57	90.7 Å²	90.7	39%	0.385	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.5	18.6	166.9	66.8	0	0	0	0	114.5	C468 R473 H484 H489	C468-C471 PolarHBondContact O-N 3.4Å; C468-C471 VanDerWaalsContact O-N 3.16Å; C471-R473 PolarHBondContact O-N 3.43Å; C471-H484 PolarHBondContact SG-CE1 3.48Å; C471-H484 PolarHBondContact SG-NE2 3.47Å; C471-H489 PolarHBondContact SG-NE2 3.22Å
472	S	70.4	Confident	68.7	Low	70 Å²	70	89 Å²	89	49%	0.49	49%	0.485	S	S	.	.			trans	52.4	15.8	-177.9	-61.3	0	0	0	0	116.6	C468	C468-S472 VanDerWaalsContact O-CA 3.3Å; C468-S472 WeakPolarHBondContact O-CA 3.34Å; C468-S472 PolarHBondContact O-N 3.27Å
473	R	69.6	Low	69.9	Low	160 Å²	160	92.4 Å²	92.4	60%	0.604	48%	0.481	S	S	*	.			trans	-75.8	134.3	175.4	-80.9	-174.4	163.7	163.3	-1.3	112.1	R467 C468 C471 F475	R467-R473 CarbonylContact C-O 3.44Å; C468-R473 WeakPolarHBondContact CB-O 3.3Å; C468-R473 PolarHBondContact N-O 3.04Å; C471-R473 PolarHBondContact O-N 3.43Å; R473-F475 HydrophobicContact CB-CE2 3.67Å; R473-F475 HydrophobicContact CB-CZ 3.84Å; R473-F475 WeakPolarHBondContact O-CD2 3.24Å; R473-F475 VanDerWaalsContact O-CE2 3.29Å; R473-F475 WeakPolarHBondContact O-CE2 3.43Å
474	E	76	Confident	70.8	Confident	100 Å²	100	86.6 Å²	86.6	47%	0.467	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	144.1	-177.3	-63.5	178.6	-178.8	0	0	111.7	R467	R467-E474 HydrophobicContact CB-CG 3.97Å; R467-E474 WeakPolarHBondContact CD-OE1 3.22Å; R467-E474 HydrophobicContact CG-CG 3.83Å; R467-E474 IonicContact CZ-OE1 2.74Å; R467-E474 IonicContact NE-OE1 3.21Å; R467-E474 IonicContact NH1-OE1 3.84Å; R467-E474 PolarHBondContact NH1-OE1 3.12Å
475	F	78.4	Confident	71.1	Confident	38 Å²	38	87.2 Å²	87.2	17%	0.167	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.2	-173.6	-63	-83	0	0	0	111.3	Y466 C468 R473 K477 Q480 L481 H484	Y466-F475 WeakPolarHBondContact CB-O 3.48Å; Y466-F475 PolarHBondContact N-O 2.81Å; Y466-F475 WeakPolarHBondContact O-CB 3.41Å; Y466-F475 WeakPolarHBondContact O-CD2 3.35Å; Y466-F475 PolarHBondContact O-N 3.01Å; C468-F475 HydrophobicContact CB-CE2 4.23Å; R473-F475 HydrophobicContact CB-CE2 3.67Å; R473-F475 HydrophobicContact CB-CZ 3.84Å; R473-F475 WeakPolarHBondContact O-CD2 3.24Å; R473-F475 VanDerWaalsContact O-CE2 3.29Å; R473-F475 WeakPolarHBondContact O-CE2 3.43Å; F475-K477 PolarHBondContact O-N 3.43Å; F475-Q480 HydrophobicContact CB-CB 3.93Å; F475-Q480 HydrophobicContact CD1-CB 3.91Å; F475-Q480 HydrophobicContact CG-CB 4.22Å; F475-L481 HydrophobicContact CB-CB 4.16Å; F475-L481 HydrophobicContact CD2-CB 4Å; F475-L481 HydrophobicContact CD2-CD1 3.85Å; F475-L481 HydrophobicContact CE2-CD1 4.17Å; F475-L481 HydrophobicContact CG-CB 4.28Å; F475-H484 HydrophobicContact CE1-CB 3.86Å; F475-H484 HydrophobicContact CE2-CB 3.85Å; F475-H484 AromaticContact CE2-CD2 3.25Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.29Å; F475-H484 AromaticContact CE2-CG 3.51Å; F475-H484 AromaticContact CE2-NE2 3.91Å; F475-H484 HydrophobicContact CZ-CB 3.44Å; F475-H484 VanDerWaalsContact CZ-CB 3.44Å; F475-H484 AromaticContact CZ-CD2 3.46Å; F475-H484 VanDerWaalsContact CZ-CD2 3.46Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.36Å; F475-H484 AromaticContact CZ-CG 3.2Å; F475-H484 AromaticContact CZ-ND1 3.69Å
476	V	74.3	Confident	71.2	Confident	113 Å²	113	89.5 Å²	89.5	69%	0.685	43%	0.431	S	S	*	.	S	Bend	trans	-76.9	-8.9	-174	-168.6	0	0	0	0	112.4
477	K	77.6	Confident	70.6	Confident	137 Å²	137	90.5 Å²	90.5	60%	0.596	44%	0.438	S	S	*	.	S	Bend	trans	-147.1	143.3	179.7	-61.4	-169.5	177.4	-168.1	0	111.5	Y466 F475 L479 Q480 L481	Y466-K477 VanDerWaalsContact CD2-C 3.4Å; F475-K477 PolarHBondContact O-N 3.43Å; K477-L479 VanDerWaalsContact C-N 3.31Å; K477-L479 PolarHBondContact O-N 3.47Å; K477-Q480 HydrophobicContact CB-CG 4.29Å; K477-Q480 WeakPolarHBondContact O-CA 3.46Å; K477-Q480 WeakPolarHBondContact O-CB 3.47Å; K477-Q480 PolarHBondContact O-N 3.3Å; K477-L481 PolarHBondContact O-N 3.43Å
478	A	71.6	Confident	70.1	Confident	40 Å²	40	87.2 Å²	87.2	33%	0.331	43%	0.432	S	S	.	.	H	α-helix	trans	-46.9	-51.7	174.9	0	0	0	0	0	112.3	Y466 Q480 L481 T482	Y466-A478 HydrophobicContact CD1-CB 3.9Å; Y466-A478 HydrophobicContact CE1-CB 3.55Å; Y466-A478 HydrophobicContact CE2-CB 4.26Å; Y466-A478 VanDerWaalsContact CE2-N 3.31Å; Y466-A478 HydrophobicContact CG-CB 4.39Å; A478-Q480 PolarHBondContact O-N 3.3Å; A478-Q480 VanDerWaalsContact O-N 3.12Å; A478-L481 CarbonylContact O-C 3.05Å; A478-L481 WeakPolarHBondContact O-CA 3.45Å; A478-L481 WeakPolarHBondContact O-CB 3.02Å; A478-L481 PolarHBondContact O-N 2.79Å; A478-T482 PolarHBondContact O-N 3.5Å; A478-T482 PolarHBondContact O-OG1 3.17Å
479	L	71.8	Confident	69.4	Low	136 Å²	136	89.8 Å²	89.8	71%	0.712	44%	0.444	S	S	*	.	H	α-helix	trans	-57.1	-30.2	179	-177	62.9	0	0	0	113.6	K477 R483	K477-L479 VanDerWaalsContact C-N 3.31Å; K477-L479 PolarHBondContact O-N 3.47Å; L479-R483 WeakPolarHBondContact O-CB 3.41Å; L479-R483 PolarHBondContact O-N 3.47Å
480	Q	68.8	Low	68.6	Low	73 Å²	73	91.9 Å²	91.9	34%	0.341	44%	0.441	S	S	.	.	H	α-helix	trans	-73.4	-42.8	174.6	-68.1	179.6	-11.9	0	0	111.3	F475 K477 A478 R483 H484	F475-Q480 HydrophobicContact CB-CB 3.93Å; F475-Q480 HydrophobicContact CD1-CB 3.91Å; F475-Q480 HydrophobicContact CG-CB 4.22Å; K477-Q480 HydrophobicContact CB-CG 4.29Å; K477-Q480 WeakPolarHBondContact O-CA 3.46Å; K477-Q480 WeakPolarHBondContact O-CB 3.47Å; K477-Q480 PolarHBondContact O-N 3.3Å; A478-Q480 PolarHBondContact O-N 3.3Å; A478-Q480 VanDerWaalsContact O-N 3.12Å; Q480-R483 PolarHBondContact O-N 2.77Å; Q480-H484 VanDerWaalsContact O-CB 3.29Å; Q480-H484 WeakPolarHBondContact O-CB 3.41Å; Q480-H484 PolarHBondContact O-N 3.4Å
481	L	76.8	Confident	67.9	Low	20 Å²	20	92.2 Å²	92.2	11%	0.105	44%	0.443	C	S	.	.	H	α-helix	trans	-60.6	-52.2	172.2	172.1	61.4	0	0	0	110.9	C468 F475 K477 A478 R483 H484 Q485	C468-L481 HydrophobicContact CB-CD1 3.45Å; C468-L481 VanDerWaalsContact CB-CD1 3.45Å; F475-L481 HydrophobicContact CB-CB 4.16Å; F475-L481 HydrophobicContact CD2-CB 4Å; F475-L481 HydrophobicContact CD2-CD1 3.85Å; F475-L481 HydrophobicContact CE2-CD1 4.17Å; F475-L481 HydrophobicContact CG-CB 4.28Å; K477-L481 PolarHBondContact O-N 3.43Å; A478-L481 CarbonylContact O-C 3.05Å; A478-L481 WeakPolarHBondContact O-CA 3.45Å; A478-L481 WeakPolarHBondContact O-CB 3.02Å; A478-L481 PolarHBondContact O-N 2.79Å; L481-R483 VanDerWaalsContact C-N 3.29Å; L481-R483 PolarHBondContact O-N 2.9Å; L481-H484 CarbonylContact O-C 3.52Å; L481-H484 WeakPolarHBondContact O-CA 3.31Å; L481-H484 WeakPolarHBondContact O-CB 3.44Å; L481-H484 PolarHBondContact O-N 2.95Å; L481-Q485 HydrophobicContact CD1-CG 3.84Å; L481-Q485 HydrophobicContact CG-CG 4.3Å; L481-Q485 WeakPolarHBondContact O-CB 3.31Å; L481-Q485 WeakPolarHBondContact O-CG 3.26Å; L481-Q485 PolarHBondContact O-N 2.92Å
482	T	66.5	Low	66.9	Low	66 Å²	66	94.3 Å²	94.3	41%	0.405	45%	0.447	S	S	.	.	H	α-helix	trans	-58.8	-41.4	179.4	-45.5	0	0	0	0	111.4	A478 R486	A478-T482 PolarHBondContact O-N 3.5Å; A478-T482 PolarHBondContact O-OG1 3.17Å; T482-R486 WeakPolarHBondContact O-CB 3.33Å; T482-R486 PolarHBondContact O-N 2.7Å
483	R	65.3	Low	66	Low	150 Å²	150	95.9 Å²	95.9	57%	0.566	44%	0.442	S	S	*	.	H	α-helix	trans	-66.9	-37.4	175.6	-173.9	175.1	72.4	171.4	3.2	112.2	L479 Q480 L481 F487	L479-R483 WeakPolarHBondContact O-CB 3.41Å; L479-R483 PolarHBondContact O-N 3.47Å; Q480-R483 PolarHBondContact O-N 2.77Å; L481-R483 VanDerWaalsContact C-N 3.29Å; L481-R483 PolarHBondContact O-N 2.9Å; R483-F487 HydrophobicContact CG-CD2 3.68Å; R483-F487 HydrophobicContact CG-CE2 3.55Å; R483-F487 WeakPolarHBondContact O-CB 3.25Å; R483-F487 WeakPolarHBondContact O-CD2 3.49Å; R483-F487 PolarHBondContact O-N 3.44Å; R483-F487 VanDerWaalsContact O-N 3.12Å
484	H	72.6	Confident	65.6	Low	17 Å²	17	98.4 Å²	98.4	8%	0.079	45%	0.452	C	S	.	.	H	α-helix	trans	-66.9	-50.3	174	159.6	70	0	0	0	111.4	C468 C471 F475 Q480 L481 R486 F487 V488 H489	C468-H484 WeakPolarHBondContact CB-NE2 3.28Å; C468-H484 VanDerWaalsContact SG-CD2 3.5Å; C468-H484 PolarHBondContact SG-NE2 3.36Å; C471-H484 PolarHBondContact SG-CE1 3.48Å; C471-H484 PolarHBondContact SG-NE2 3.47Å; F475-H484 HydrophobicContact CE1-CB 3.86Å; F475-H484 HydrophobicContact CE2-CB 3.85Å; F475-H484 AromaticContact CE2-CD2 3.25Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.29Å; F475-H484 AromaticContact CE2-CG 3.51Å; F475-H484 AromaticContact CE2-NE2 3.91Å; F475-H484 HydrophobicContact CZ-CB 3.44Å; F475-H484 VanDerWaalsContact CZ-CB 3.44Å; F475-H484 AromaticContact CZ-CD2 3.46Å; F475-H484 VanDerWaalsContact CZ-CD2 3.46Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.36Å; F475-H484 AromaticContact CZ-CG 3.2Å; F475-H484 AromaticContact CZ-ND1 3.69Å; Q480-H484 VanDerWaalsContact O-CB 3.29Å; Q480-H484 WeakPolarHBondContact O-CB 3.41Å; Q480-H484 PolarHBondContact O-N 3.4Å; L481-H484 CarbonylContact O-C 3.52Å; L481-H484 WeakPolarHBondContact O-CA 3.31Å; L481-H484 WeakPolarHBondContact O-CB 3.44Å; L481-H484 PolarHBondContact O-N 2.95Å; H484-R486 VanDerWaalsContact C-N 3.32Å; H484-R486 PolarHBondContact O-N 2.85Å; H484-F487 PolarHBondContact O-N 2.81Å; H484-V488 WeakPolarHBondContact ND1-CG2 3.46Å; H484-V488 WeakPolarHBondContact O-CB 3.47Å; H484-V488 WeakPolarHBondContact O-CG2 3.39Å; H484-V488 PolarHBondContact O-N 3.2Å; H484-H489 AromaticContact CE1-CD2 3.88Å; H484-H489 AromaticContact CE1-NE2 3.59Å; H484-H489 AromaticContact NE2-CD2 3.58Å; H484-H489 AromaticContact NE2-NE2 3.4Å; H484-H489 PolarHBondContact NE2-NE2 2.8Å
485	Q	66.1	Low	65.2	Low	61 Å²	61	95.7 Å²	95.7	29%	0.285	44%	0.439	S	S	.	.	I	π-helix	trans	-54.3	-46.9	174.2	-73.4	168.2	-28.6	0	0	111.1	L481 F487 H489 R490	L481-Q485 HydrophobicContact CD1-CG 3.84Å; L481-Q485 HydrophobicContact CG-CG 4.3Å; L481-Q485 WeakPolarHBondContact O-CB 3.31Å; L481-Q485 WeakPolarHBondContact O-CG 3.26Å; L481-Q485 PolarHBondContact O-N 2.92Å; Q485-F487 PolarHBondContact O-N 3.11Å; Q485-H489 CarbonylContact O-C 3.2Å; Q485-H489 WeakPolarHBondContact O-CA 3.15Å; Q485-H489 PolarHBondContact O-N 2.93Å; Q485-R490 PolarHBondContact O-N 3.11Å
486	R	64.3	Low	64.6	Low	131 Å²	131	101.3 Å²	101.3	49%	0.494	46%	0.463	S	S	.	.	I	π-helix	trans	-67.8	-23.3	179.3	179.5	175.6	-103.1	156.2	-5.9	115.2	T482 H484 E492	T482-R486 WeakPolarHBondContact O-CB 3.33Å; T482-R486 PolarHBondContact O-N 2.7Å; H484-R486 VanDerWaalsContact C-N 3.32Å; H484-R486 PolarHBondContact O-N 2.85Å; R486-E492 HydrophobicContact CG-CB 4.37Å; R486-E492 IonicContact CZ-OE2 3.48Å; R486-E492 IonicContact NE-OE2 2.71Å; R486-E492 PolarHBondContact NE-OE2 3.44Å; R486-E492 IonicContact NH2-OE2 3.35Å; R486-E492 PolarHBondContact NH2-OE2 3.24Å
487	F	58	Low	64.7	Low	132 Å²	132	96 Å²	96	58%	0.579	43%	0.431	S	S	*	.	I	π-helix	trans	-101.9	-28.8	177.2	-74.9	-49.1	0	0	0	114.4	R483 H484 Q485	R483-F487 HydrophobicContact CG-CD2 3.68Å; R483-F487 HydrophobicContact CG-CE2 3.55Å; R483-F487 WeakPolarHBondContact O-CB 3.25Å; R483-F487 WeakPolarHBondContact O-CD2 3.49Å; R483-F487 PolarHBondContact O-N 3.44Å; R483-F487 VanDerWaalsContact O-N 3.12Å; H484-F487 PolarHBondContact O-N 2.81Å; Q485-F487 PolarHBondContact O-N 3.11Å
488	V	59.3	Low	64.7	Low	60 Å²	60	94.1 Å²	94.1	36%	0.364	44%	0.436	S	S	.	.	I	π-helix	trans	-98.7	-46.5	-175.7	-177.1	0	0	0	0	111.4	H484 R493	H484-V488 WeakPolarHBondContact ND1-CG2 3.46Å; H484-V488 WeakPolarHBondContact O-CB 3.47Å; H484-V488 WeakPolarHBondContact O-CG2 3.39Å; H484-V488 PolarHBondContact O-N 3.2Å; V488-R493 PolarHBondContact O-NH2 3.24Å
489	H	61.7	Low	64.8	Low	53 Å²	53	97.1 Å²	97.1	25%	0.245	45%	0.445	C	S	.	.	I	π-helix	trans	-108.2	-58.6	-165.7	-63.3	-76.1	0	0	0	114.3	L470 C471 H484 Q485	L470-H489 HydrophobicContact CB-CB 4.47Å; L470-H489 WeakPolarHBondContact CB-ND1 3.49Å; L470-H489 HydrophobicContact CD1-CB 3.69Å; L470-H489 PolarHBondContact O-CE1 3.33Å; C471-H489 PolarHBondContact SG-NE2 3.22Å; H484-H489 AromaticContact CE1-CD2 3.88Å; H484-H489 AromaticContact CE1-NE2 3.59Å; H484-H489 AromaticContact NE2-CD2 3.58Å; H484-H489 AromaticContact NE2-NE2 3.4Å; H484-H489 PolarHBondContact NE2-NE2 2.8Å; Q485-H489 CarbonylContact O-C 3.2Å; Q485-H489 WeakPolarHBondContact O-CA 3.15Å; Q485-H489 PolarHBondContact O-N 2.93Å
490	R	54.6	Low	64.9	Low	196 Å²	196	93 Å²	93	74%	0.74	43%	0.427	S	S	*	.	S	Bend	trans	-70.1	132.5	170.6	-75.4	-170.6	175.5	-172	-0.5	109.1	Q485 E492	Q485-R490 PolarHBondContact O-N 3.11Å; R490-E492 PolarHBondContact O-N 3.16Å
491	L	51.7	Low	64.9	Low	127 Å²	127	91.8 Å²	91.8	67%	0.665	43%	0.434	S	S	*	.			trans	-81.9	35.7	-167.7	-77.2	168.5	0	0	0	115.2	R493	L491-R493 PolarHBondContact O-N 2.91Å
492	E	50.1	Low	64.4	Low	101 Å²	101	96.6 Å²	96.6	47%	0.472	45%	0.454	S	S	.	.			trans	-72.1	31.6	167.9	-67.6	-163.1	96.9	0	0	113	R486 R490 R494	R486-E492 HydrophobicContact CG-CB 4.37Å; R486-E492 IonicContact CZ-OE2 3.48Å; R486-E492 IonicContact NE-OE2 2.71Å; R486-E492 PolarHBondContact NE-OE2 3.44Å; R486-E492 IonicContact NH2-OE2 3.35Å; R486-E492 PolarHBondContact NH2-OE2 3.24Å; R490-E492 PolarHBondContact O-N 3.16Å; E492-R494 PolarHBondContact O-N 2.84Å
493	R	51.3	Low	64.4	Low	103 Å²	103	96.6 Å²	96.6	39%	0.389	45%	0.45	S	S	.	.			trans	-73.9	78.1	170.2	-63.9	179.8	-174	170.1	5.1	108.1	V488 L491 H495 M503	V488-R493 PolarHBondContact O-NH2 3.24Å; L491-R493 PolarHBondContact O-N 2.91Å; R493-H495 PolarHBondContact O-N 3.04Å; R493-M503 HydrophobicContact CB-CB 4.19Å; R493-M503 HydrophobicContact CB-CE 3.53Å; R493-M503 HydrophobicContact CG-CE 4.49Å; R493-M503 WeakPolarHBondContact O-CE 3.4Å
494	R	60.5	Low	64.5	Low	213 Å²	213	92 Å²	92	80%	0.804	43%	0.434	S	S	*	.	S	Bend	trans	-38.1	-25.4	-160.5	-62.4	-169.6	176.4	-150.6	-3.4	118.9	E492	E492-R494 PolarHBondContact O-N 2.84Å
495	H	67.1	Low	64.2	Low	42 Å²	42	100.6 Å²	100.6	19%	0.194	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	114.6	-179.4	-44.3	99.6	0	0	0	112.3	R493 F504 K507 V510	R493-H495 PolarHBondContact O-N 3.04Å; H495-F504 PolarHBondContact O-N 2.97Å; H495-K507 WeakPolarHBondContact CD2-CG 3.18Å; H495-K507 PolarHBondContact ND1-N 3.17Å; H495-K507 WeakPolarHBondContact NE2-CE 3.4Å; H495-K507 WeakPolarHBondContact NE2-CG 3.36Å; H495-V510 HydrophobicContact CB-CG2 3.43Å; H495-V510 VanDerWaalsContact CB-CG2 3.43Å
496	K	66.6	Low	64.5	Low	156 Å²	156	103.8 Å²	103.8	68%	0.678	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.3	173.4	67.1	-178.4	178.9	178.4	0	112	M503	K496-M503 HydrophobicContact CB-CE 3.77Å; K496-M503 HydrophobicContact CB-SD 3.41Å; K496-M503 WeakPolarHBondContact CB-SD 3.33Å
497	C	77.6	Confident	64.9	Low	2 Å²	2	104.8 Å²	104.8	1%	0.014	49%	0.492	C	S	.	.			trans	-76.1	126.9	161.2	-179.6	0	0	0	0	109.2	G501 K502 F504 H517	C497-G501 WeakPolarHBondContact O-CA 3.37Å; C497-G501 PolarHBondContact O-N 2.9Å; C497-G501 VanDerWaalsContact O-N 3.16Å; C497-K502 HydrophobicContact CB-CB 4.43Å; C497-K502 VanDerWaalsContact CB-O 3.27Å; C497-K502 WeakPolarHBondContact CB-O 3.44Å; C497-K502 PolarHBondContact N-O 3.05Å; C497-F504 HydrophobicContact CB-CE2 4.38Å; C497-H517 PolarHBondContact SG-NE2 3.49Å
498	S	76.3	Confident	65.7	Low	98 Å²	98	101 Å²	101	69%	0.685	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-40.1	176.5	42.3	0	0	0	0	113
499	I	73.5	Confident	66.4	Low	103 Å²	103	102.5 Å²	102.5	53%	0.528	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-34.1	-168.6	-62.4	168	0	0	0	113.2	L514 H517	I499-L514 HydrophobicContact CD1-CD2 4.24Å; I499-H517 HydrophobicContact CD1-CB 3.57Å; I499-H517 HydrophobicContact CG2-CB 4.2Å
500	C	74.8	Confident	67	Low	49 Å²	49	100.6 Å²	100.6	33%	0.331	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	16.2	-173.8	74.3	0	0	0	0	115.2	K502 H513 H517	C500-K502 PolarHBondContact O-N 2.91Å; C500-H513 PolarHBondContact SG-NE2 2.89Å; C500-H517 PolarHBondContact SG-CE1 3.01Å; C500-H517 PolarHBondContact SG-NE2 3.16Å
501	G	68.8	Low	68	Low	47 Å²	47	99 Å²	99	49%	0.485	47%	0.471	S	S	.	.			trans	65.4	-2.5	174.8	0	0	0	0	0	116.7	C497 M503	C497-G501 WeakPolarHBondContact O-CA 3.37Å; C497-G501 PolarHBondContact O-N 2.9Å; C497-G501 VanDerWaalsContact O-N 3.16Å; G501-M503 WeakPolarHBondContact O-CG 3.35Å; G501-M503 PolarHBondContact O-N 3.23Å
502	K	66.1	Low	69	Low	122 Å²	122	95 Å²	95	53%	0.53	45%	0.45	S	S	.	.			trans	-62.5	135.2	179.2	-70.3	174.8	-171.5	166	0	110.8	C497 C500 F504	C497-K502 HydrophobicContact CB-CB 4.43Å; C497-K502 VanDerWaalsContact CB-O 3.27Å; C497-K502 WeakPolarHBondContact CB-O 3.44Å; C497-K502 PolarHBondContact N-O 3.05Å; C500-K502 PolarHBondContact O-N 2.91Å; K502-F504 HydrophobicContact CB-CE2 3.59Å; K502-F504 HydrophobicContact CB-CZ 3.97Å; K502-F504 VanDerWaalsContact O-CD2 3.32Å; K502-F504 WeakPolarHBondContact O-CD2 3.35Å; K502-F504 VanDerWaalsContact O-CE2 3.26Å; K502-F504 WeakPolarHBondContact O-CE2 3.46Å
503	M	65.3	Low	70.3	Confident	66 Å²	66	91.3 Å²	91.3	33%	0.325	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.3	-168.6	-54	-60.3	-78	0	0	111.6	R493 K496 G501	R493-M503 HydrophobicContact CB-CB 4.19Å; R493-M503 HydrophobicContact CB-CE 3.53Å; R493-M503 HydrophobicContact CG-CE 4.49Å; R493-M503 WeakPolarHBondContact O-CE 3.4Å; K496-M503 HydrophobicContact CB-CE 3.77Å; K496-M503 HydrophobicContact CB-SD 3.41Å; K496-M503 WeakPolarHBondContact CB-SD 3.33Å; G501-M503 WeakPolarHBondContact O-CG 3.35Å; G501-M503 PolarHBondContact O-N 3.23Å
504	F	69.3	Low	71.5	Confident	53 Å²	53	88.8 Å²	88.8	23%	0.232	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	149.6	-171	-61.6	-97.9	0	0	0	113.9	H495 C497 K502 K506 H509 V510 H513	H495-F504 PolarHBondContact O-N 2.97Å; C497-F504 HydrophobicContact CB-CE2 4.38Å; K502-F504 HydrophobicContact CB-CE2 3.59Å; K502-F504 HydrophobicContact CB-CZ 3.97Å; K502-F504 VanDerWaalsContact O-CD2 3.32Å; K502-F504 WeakPolarHBondContact O-CD2 3.35Å; K502-F504 VanDerWaalsContact O-CE2 3.26Å; K502-F504 WeakPolarHBondContact O-CE2 3.46Å; F504-K506 VanDerWaalsContact C-N 3.35Å; F504-K506 PolarHBondContact O-N 3.46Å; F504-H509 HydrophobicContact CB-CB 4.04Å; F504-H509 HydrophobicContact CD1-CB 3.97Å; F504-H509 HydrophobicContact CG-CB 4.35Å; F504-V510 HydrophobicContact CB-CG2 3.68Å; F504-V510 HydrophobicContact CD2-CG2 3.81Å; F504-V510 HydrophobicContact CG-CG2 4.02Å; F504-H513 HydrophobicContact CE1-CB 3.98Å; F504-H513 HydrophobicContact CE2-CB 4.08Å; F504-H513 AromaticContact CE2-CD2 3.24Å; F504-H513 WeakPolarHBondContact CE2-CD2 3.44Å; F504-H513 AromaticContact CE2-CG 3.75Å; F504-H513 HydrophobicContact CZ-CB 3.59Å; F504-H513 AromaticContact CZ-CD2 3.27Å; F504-H513 WeakPolarHBondContact CZ-CD2 3.41Å; F504-H513 AromaticContact CZ-CG 3.3Å; F504-H513 AromaticContact CZ-NE2 3.99Å
505	K	65.4	Low	72.3	Confident	197 Å²	197	80.7 Å²	80.7	86%	0.857	40%	0.396	S	S	*	.	S	Bend	trans	-71.8	-18.6	-175.9	-59.4	-174.5	179.7	-176	0	114.9
506	K	72.6	Confident	72.3	Confident	128 Å²	128	82.6 Å²	82.6	56%	0.557	41%	0.411	S	S	*	.	S	Bend	trans	-144.8	148.4	-176.8	-66.7	-169.7	175.2	-170.5	0	111.3	F504 S508 H509 V510	F504-K506 VanDerWaalsContact C-N 3.35Å; F504-K506 PolarHBondContact O-N 3.46Å; K506-S508 VanDerWaalsContact C-N 3.28Å; K506-S508 PolarHBondContact O-N 3.23Å; K506-H509 WeakPolarHBondContact O-CB 3.32Å; K506-H509 PolarHBondContact O-N 2.9Å; K506-V510 PolarHBondContact O-N 3.36Å
507	K	71.6	Confident	72.8	Confident	153 Å²	153	78.5 Å²	78.5	67%	0.665	39%	0.394	S	S	*	.	H	α-helix	trans	-54.4	-42.4	174.4	-70.4	-171.2	177.6	-179.8	0	112.3	H495 H509 V510 R511	H495-K507 WeakPolarHBondContact CD2-CG 3.18Å; H495-K507 PolarHBondContact ND1-N 3.17Å; H495-K507 WeakPolarHBondContact NE2-CE 3.4Å; H495-K507 WeakPolarHBondContact NE2-CG 3.36Å; K507-H509 VanDerWaalsContact C-N 3.26Å; K507-H509 PolarHBondContact O-N 3.5Å; K507-V510 PolarHBondContact O-N 3.35Å; K507-V510 VanDerWaalsContact O-N 3.13Å; K507-R511 PolarHBondContact O-N 3.3Å
508	S	75.1	Confident	72.6	Confident	52 Å²	52	82.1 Å²	82.1	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-59.5	-32.9	176.7	53.5	0	0	0	0	113.5	K506 R511 N512	K506-S508 VanDerWaalsContact C-N 3.28Å; K506-S508 PolarHBondContact O-N 3.23Å; S508-R511 PolarHBondContact O-N 3.32Å; S508-N512 WeakPolarHBondContact O-CB 3.47Å; S508-N512 VanDerWaalsContact O-CG 3.23Å; S508-N512 PolarHBondContact O-N 3.07Å; S508-N512 PolarHBondContact O-ND2 3.06Å
509	H	74.1	Confident	72.3	Confident	92 Å²	92	79.7 Å²	79.7	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-75.8	-33.6	177.2	-63.2	-173.6	0	0	0	111.7	F504 K506 K507 H513	F504-H509 HydrophobicContact CB-CB 4.04Å; F504-H509 HydrophobicContact CD1-CB 3.97Å; F504-H509 HydrophobicContact CG-CB 4.35Å; K506-H509 WeakPolarHBondContact O-CB 3.32Å; K506-H509 PolarHBondContact O-N 2.9Å; K507-H509 VanDerWaalsContact C-N 3.26Å; K507-H509 PolarHBondContact O-N 3.5Å; H509-H513 WeakPolarHBondContact O-CB 3.39Å; H509-H513 PolarHBondContact O-N 3.27Å; H509-H513 VanDerWaalsContact O-N 3.17Å
510	V	75.3	Confident	72.2	Confident	13 Å²	13	79.5 Å²	79.5	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-64.8	-47.5	168.2	-177.1	0	0	0	0	110.3	H495 F504 K506 K507 N512 H513 L514	H495-V510 HydrophobicContact CB-CG2 3.43Å; H495-V510 VanDerWaalsContact CB-CG2 3.43Å; F504-V510 HydrophobicContact CB-CG2 3.68Å; F504-V510 HydrophobicContact CD2-CG2 3.81Å; F504-V510 HydrophobicContact CG-CG2 4.02Å; K506-V510 PolarHBondContact O-N 3.36Å; K507-V510 PolarHBondContact O-N 3.35Å; K507-V510 VanDerWaalsContact O-N 3.13Å; V510-N512 PolarHBondContact O-N 3.09Å; V510-H513 CarbonylContact O-C 3.58Å; V510-H513 WeakPolarHBondContact O-CA 3.45Å; V510-H513 WeakPolarHBondContact O-CB 3.02Å; V510-H513 PolarHBondContact O-N 3.01Å; V510-L514 HydrophobicContact CG1-CD1 3.87Å; V510-L514 HydrophobicContact CG1-CG 4Å; V510-L514 WeakPolarHBondContact O-CG 3.45Å; V510-L514 PolarHBondContact O-N 2.89Å
511	R	74.2	Confident	72.1	Confident	162 Å²	162	83.9 Å²	83.9	61%	0.611	41%	0.413	S	S	*	.	H	α-helix	trans	-56.8	-47.4	179.3	-166.3	-176.2	-69.1	160.4	-5.9	111.9	K507 S508 H513 L514 R515	K507-R511 PolarHBondContact O-N 3.3Å; S508-R511 PolarHBondContact O-N 3.32Å; R511-H513 PolarHBondContact O-N 3.45Å; R511-L514 PolarHBondContact O-N 2.69Å; R511-R515 PolarHBondContact O-N 3.4Å
512	N	73.9	Confident	72.5	Confident	43 Å²	43	84.7 Å²	84.7	23%	0.23	41%	0.41	C	S	.	.	H	α-helix	trans	-68.6	-15.5	176.3	-66.7	-10.8	0	0	0	113.9	S508 V510 R515 N533	S508-N512 WeakPolarHBondContact O-CB 3.47Å; S508-N512 VanDerWaalsContact O-CG 3.23Å; S508-N512 PolarHBondContact O-N 3.07Å; S508-N512 PolarHBondContact O-ND2 3.06Å; V510-N512 PolarHBondContact O-N 3.09Å; N512-R515 PolarHBondContact OD1-NH1 2.97Å; N512-N533 PolarHBondContact O-ND2 3.04Å; N512-N533 PolarHBondContact OD1-O 3.14Å
513	H	76.9	Confident	73.2	Confident	23 Å²	23	81.7 Å²	81.7	11%	0.106	40%	0.397	C	S	.	.	H	α-helix	trans	-94.1	-31.8	172.7	172.9	52.4	0	0	0	113.3	C500 F504 H509 V510 R511 R515 T516 H517	C500-H513 PolarHBondContact SG-NE2 2.89Å; F504-H513 HydrophobicContact CE1-CB 3.98Å; F504-H513 HydrophobicContact CE2-CB 4.08Å; F504-H513 AromaticContact CE2-CD2 3.24Å; F504-H513 WeakPolarHBondContact CE2-CD2 3.44Å; F504-H513 AromaticContact CE2-CG 3.75Å; F504-H513 HydrophobicContact CZ-CB 3.59Å; F504-H513 AromaticContact CZ-CD2 3.27Å; F504-H513 WeakPolarHBondContact CZ-CD2 3.41Å; F504-H513 AromaticContact CZ-CG 3.3Å; F504-H513 AromaticContact CZ-NE2 3.99Å; H509-H513 WeakPolarHBondContact O-CB 3.39Å; H509-H513 PolarHBondContact O-N 3.27Å; H509-H513 VanDerWaalsContact O-N 3.17Å; V510-H513 CarbonylContact O-C 3.58Å; V510-H513 WeakPolarHBondContact O-CA 3.45Å; V510-H513 WeakPolarHBondContact O-CB 3.02Å; V510-H513 PolarHBondContact O-N 3.01Å; R511-H513 PolarHBondContact O-N 3.45Å; H513-R515 PolarHBondContact O-N 3.28Å; H513-T516 PolarHBondContact CE1-OG1 3.2Å; H513-T516 VanDerWaalsContact CE1-OG1 3.27Å; H513-T516 PolarHBondContact ND1-OG1 3.31Å; H513-T516 WeakPolarHBondContact O-CA 3.13Å; H513-T516 WeakPolarHBondContact O-CB 3.47Å; H513-T516 PolarHBondContact O-N 3.36Å; H513-T516 PolarHBondContact O-OG1 2.92Å; H513-H517 AromaticContact CE1-CE1 3.95Å; H513-H517 AromaticContact CE1-NE2 3.31Å; H513-H517 PolarHBondContact CE1-NE2 3.04Å; H513-H517 VanDerWaalsContact CE1-NE2 3.31Å; H513-H517 AromaticContact NE2-NE2 3.14Å; H513-H517 PolarHBondContact NE2-NE2 3.09Å; H513-H517 VanDerWaalsContact NE2-NE2 3.14Å
514	L	75.7	Confident	74	Confident	50 Å²	50	82.1 Å²	82.1	26%	0.262	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-35.7	172.8	-73.5	169.6	0	0	0	111	I499 V510 R511 T516 H517 T518	I499-L514 HydrophobicContact CD1-CD2 4.24Å; V510-L514 HydrophobicContact CG1-CD1 3.87Å; V510-L514 HydrophobicContact CG1-CG 4Å; V510-L514 WeakPolarHBondContact O-CG 3.45Å; V510-L514 PolarHBondContact O-N 2.89Å; R511-L514 PolarHBondContact O-N 2.69Å; L514-T516 PolarHBondContact O-N 2.87Å; L514-H517 WeakPolarHBondContact O-CA 3.16Å; L514-H517 WeakPolarHBondContact O-CB 3.33Å; L514-H517 PolarHBondContact O-N 2.9Å; L514-T518 PolarHBondContact O-N 3.38Å
515	R	78.3	Confident	74.7	Confident	44 Å²	44	79.6 Å²	79.6	17%	0.166	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.7	166.2	-72	-175.4	177.3	151	-1.6	116.1	R511 N512 H513 G519 E520 N533	R511-R515 PolarHBondContact O-N 3.4Å; N512-R515 PolarHBondContact OD1-NH1 2.97Å; H513-R515 PolarHBondContact O-N 3.28Å; R515-G519 CarbonylContact O-C 3.54Å; R515-G519 WeakPolarHBondContact O-CA 3.47Å; R515-G519 PolarHBondContact O-N 3.11Å; R515-E520 HydrophobicContact CB-CB 4.48Å; R515-E520 WeakPolarHBondContact CB-O 3.23Å; R515-E520 HydrophobicContact CG-CB 4Å; R515-E520 IonicContact NE-OE2 3.92Å; R515-N533 HydrophobicContact CB-CB 4.23Å; R515-N533 PolarHBondContact NH1-O 2.88Å; R515-N533 VanDerWaalsContact NH1-O 3.13Å
516	T	67.7	Low	75.5	Confident	81 Å²	81	74.7 Å²	74.7	50%	0.497	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.1	172	67.2	0	0	0	0	113.5	H513 L514	H513-T516 PolarHBondContact CE1-OG1 3.2Å; H513-T516 VanDerWaalsContact CE1-OG1 3.27Å; H513-T516 PolarHBondContact ND1-OG1 3.31Å; H513-T516 WeakPolarHBondContact O-CA 3.13Å; H513-T516 WeakPolarHBondContact O-CB 3.47Å; H513-T516 PolarHBondContact O-N 3.36Å; H513-T516 PolarHBondContact O-OG1 2.92Å; L514-T516 PolarHBondContact O-N 2.87Å
517	H	76.4	Confident	75.8	Confident	70 Å²	70	72.5 Å²	72.5	32%	0.324	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-41.4	169.5	-54.5	-69.3	0	0	0	111.5	C497 I499 C500 H513 L514 G519	C497-H517 PolarHBondContact SG-NE2 3.49Å; I499-H517 HydrophobicContact CD1-CB 3.57Å; I499-H517 HydrophobicContact CG2-CB 4.2Å; C500-H517 PolarHBondContact SG-CE1 3.01Å; C500-H517 PolarHBondContact SG-NE2 3.16Å; H513-H517 AromaticContact CE1-CE1 3.95Å; H513-H517 AromaticContact CE1-NE2 3.31Å; H513-H517 PolarHBondContact CE1-NE2 3.04Å; H513-H517 VanDerWaalsContact CE1-NE2 3.31Å; H513-H517 AromaticContact NE2-NE2 3.14Å; H513-H517 PolarHBondContact NE2-NE2 3.09Å; H513-H517 VanDerWaalsContact NE2-NE2 3.14Å; L514-H517 WeakPolarHBondContact O-CA 3.16Å; L514-H517 WeakPolarHBondContact O-CB 3.33Å; L514-H517 PolarHBondContact O-N 2.9Å; H517-G519 VanDerWaalsContact C-N 3.3Å; H517-G519 PolarHBondContact O-N 2.89Å
518	T	73.3	Confident	76.3	Confident	78 Å²	78	67.2 Å²	67.2	48%	0.479	36%	0.358	S	S	.	.	S	Bend	trans	-79.2	-10.3	176.4	63.4	0	0	0	0	113.7	L514 E520	L514-T518 PolarHBondContact O-N 3.38Å; T518-E520 WeakPolarHBondContact CB-OE1 3.45Å; T518-E520 PolarHBondContact O-N 2.7Å; T518-E520 VanDerWaalsContact OG1-CD 3.27Å; T518-E520 PolarHBondContact OG1-OE1 3.08Å
519	G	69.3	Low	76.4	Confident	48 Å²	48	69.2 Å²	69.2	50%	0.495	37%	0.372	S	S	.	.			trans	75.7	-17.2	-179.3	0	0	0	0	0	115.3	R515 H517 R521	R515-G519 CarbonylContact O-C 3.54Å; R515-G519 WeakPolarHBondContact O-CA 3.47Å; R515-G519 PolarHBondContact O-N 3.11Å; H517-G519 VanDerWaalsContact C-N 3.3Å; H517-G519 PolarHBondContact O-N 2.89Å; G519-R521 WeakPolarHBondContact O-CG 3.35Å; G519-R521 PolarHBondContact O-N 3.12Å
520	E	71.7	Confident	76.6	Confident	98 Å²	98	69.8 Å²	69.8	46%	0.458	37%	0.374	S	S	.	.			trans	-46.4	130	177.6	-75.8	165.3	-114.7	0	0	113.7	R515 T518	R515-E520 HydrophobicContact CB-CB 4.48Å; R515-E520 WeakPolarHBondContact CB-O 3.23Å; R515-E520 HydrophobicContact CG-CB 4Å; R515-E520 IonicContact NE-OE2 3.92Å; T518-E520 WeakPolarHBondContact CB-OE1 3.45Å; T518-E520 PolarHBondContact O-N 2.7Å; T518-E520 VanDerWaalsContact OG1-CD 3.27Å; T518-E520 PolarHBondContact OG1-OE1 3.08Å
521	R	73.6	Confident	76.5	Confident	142 Å²	142	72 Å²	72	54%	0.536	39%	0.388	S	S	.	.			trans	-138.5	74	178.1	-73.8	159.1	172.7	-123.6	15.4	110.5	G519 F523 P531 F532	G519-R521 WeakPolarHBondContact O-CG 3.35Å; G519-R521 PolarHBondContact O-N 3.12Å; R521-F523 PolarHBondContact O-N 2.93Å; R521-P531 HydrophobicContact CB-CB 3.65Å; R521-P531 HydrophobicContact CB-CG 4.35Å; R521-P531 WeakPolarHBondContact CD-O 3.45Å; R521-P531 PolarHBondContact NH1-O 3.38Å; R521-F532 CarbonylContact C-O 3.53Å; R521-F532 VanDerWaalsContact CA-O 3.24Å; R521-F532 WeakPolarHBondContact CA-O 3.38Å
522	P	76.3	Confident	76.8	Confident	64 Å²	64	66.3 Å²	66.3	42%	0.416	37%	0.368	S	S	.	.			trans	-70.7	6	-166.5	-22.6	37.3	0	0	0	116.3	P524	P522-P524 WeakPolarHBondContact O-CD 3.39Å
523	F	81.9	Confident	77	Confident	58 Å²	58	66 Å²	66	25%	0.254	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	80.7	-178.7	-53.7	-72.5	0	0	0	109.8	R521 F532 P535 L538	R521-F523 PolarHBondContact O-N 2.93Å; F523-F532 HydrophobicContact CB-CB 4.37Å; F523-F532 PolarHBondContact N-O 3.4Å; F523-F532 VanDerWaalsContact N-O 3.15Å; F523-F532 WeakPolarHBondContact O-CB 3.24Å; F523-F532 PolarHBondContact O-N 2.79Å; F523-P535 HydrophobicContact CD1-CG 4.1Å; F523-P535 HydrophobicContact CD2-CG 4.48Å; F523-P535 HydrophobicContact CE1-CG 3.74Å; F523-P535 HydrophobicContact CE2-CG 4.13Å; F523-P535 HydrophobicContact CG-CG 4.46Å; F523-P535 HydrophobicContact CZ-CG 3.74Å; F523-L538 HydrophobicContact CB-CB 4.3Å; F523-L538 HydrophobicContact CB-CD2 4Å
524	P	80.7	Confident	77.1	Confident	75 Å²	75	65.6 Å²	65.6	49%	0.487	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	150.3	170.1	30.1	-34.5	0	0	0	111	P522 K530 L538	P522-P524 WeakPolarHBondContact O-CD 3.39Å; P524-K530 CarbonylContact C-O 3.58Å; P524-L538 WeakPolarHBondContact O-CD2 3.39Å
525	C	84.9	Confident	77.1	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.007	38%	0.377	C	S	.	.			trans	-82	127	169	-153	0	0	0	0	109.6	D527 C528 S529 K530 F532 L538 H541	C525-D527 PolarHBondContact O-N 3.15Å; C525-D527 PolarHBondContact SG-OD2 3.49Å; C525-C528 PolarHBondContact O-N 2.87Å; C525-S529 WeakPolarHBondContact O-CA 3.5Å; C525-S529 PolarHBondContact O-N 3.25Å; C525-K530 PolarHBondContact N-O 3.05Å; C525-F532 HydrophobicContact CB-CE2 4.36Å; C525-L538 VanDerWaalsContact CA-CD1 3.49Å; C525-L538 HydrophobicContact CB-CD1 3.71Å; C525-L538 VanDerWaalsContact SG-CD1 3.58Å; C525-H541 PolarHBondContact SG-CD2 3.21Å
526	P	81.4	Confident	77.1	Confident	94 Å²	94	68.2 Å²	68.2	61%	0.61	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-40	178.4	23.4	-32.2	0	0	0	111.3	C528	P526-C528 VanDerWaalsContact C-N 3.3Å; P526-C528 PolarHBondContact O-N 2.96Å
527	D	79.6	Confident	77.7	Confident	82 Å²	82	66.5 Å²	66.5	44%	0.439	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-11	-170.7	-20.8	-92	0	0	0	114.3	C525 H545	C525-D527 PolarHBondContact O-N 3.15Å; C525-D527 PolarHBondContact SG-OD2 3.49Å; D527-H545 HydrophobicContact CB-CB 4.35Å; D527-H545 IonicContact OD2-CD2 3.38Å; D527-H545 PolarHBondContact OD2-CD2 3.24Å; D527-H545 IonicContact OD2-NE2 3.87Å
528	C	81.7	Confident	78	Confident	41 Å²	41	64.5 Å²	64.5	28%	0.277	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-162.7	17.1	179.7	68.7	0	0	0	0	116.1	C525 P526 K530 H541 H545	C525-C528 PolarHBondContact O-N 2.87Å; P526-C528 VanDerWaalsContact C-N 3.3Å; P526-C528 PolarHBondContact O-N 2.96Å; C528-K530 PolarHBondContact O-N 2.92Å; C528-K530 VanDerWaalsContact SG-CG 3.6Å; C528-K530 PolarHBondContact SG-NZ 3.35Å; C528-H541 PolarHBondContact SG-NE2 2.87Å; C528-H541 VanDerWaalsContact SG-NE2 3.36Å; C528-H545 PolarHBondContact SG-CE1 3.3Å; C528-H545 PolarHBondContact SG-NE2 2.85Å
529	S	77.9	Confident	78.3	Confident	94 Å²	94	63.6 Å²	63.6	66%	0.657	38%	0.378	S	S	*	.			trans	52.8	10.7	179.2	-50.1	0	0	0	0	117.1	C525 P531	C525-S529 WeakPolarHBondContact O-CA 3.5Å; C525-S529 PolarHBondContact O-N 3.25Å; S529-P531 WeakPolarHBondContact O-CD 3.48Å
530	K	78.3	Confident	78.7	Confident	105 Å²	105	66.4 Å²	66.4	46%	0.457	37%	0.373	S	S	.	.			trans	-65.7	125.2	179.8	-71.8	-174.6	-166.9	91.2	0	109.9	P524 C525 C528 F532	P524-K530 CarbonylContact C-O 3.58Å; C525-K530 PolarHBondContact N-O 3.05Å; C528-K530 PolarHBondContact O-N 2.92Å; C528-K530 VanDerWaalsContact SG-CG 3.6Å; C528-K530 PolarHBondContact SG-NZ 3.35Å; K530-F532 HydrophobicContact CB-CE2 3.79Å; K530-F532 HydrophobicContact CB-CZ 4.17Å; K530-F532 WeakPolarHBondContact O-CD2 3.4Å; K530-F532 WeakPolarHBondContact O-CE2 3.48Å
531	P	73.4	Confident	79.1	Confident	59 Å²	59	63 Å²	63	38%	0.383	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133	-170.7	35.2	-34	0	0	0	113	R521 S529	R521-P531 HydrophobicContact CB-CB 3.65Å; R521-P531 HydrophobicContact CB-CG 4.35Å; R521-P531 WeakPolarHBondContact CD-O 3.45Å; R521-P531 PolarHBondContact NH1-O 3.38Å; S529-P531 WeakPolarHBondContact O-CD 3.48Å
532	F	80.8	Confident	79.4	Confident	43 Å²	43	61.3 Å²	61.3	19%	0.189	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.8	-177.1	-63.5	-88.6	0	0	0	113.3	R521 F523 C525 K530 N537 L538 H541	R521-F532 CarbonylContact C-O 3.53Å; R521-F532 VanDerWaalsContact CA-O 3.24Å; R521-F532 WeakPolarHBondContact CA-O 3.38Å; F523-F532 HydrophobicContact CB-CB 4.37Å; F523-F532 PolarHBondContact N-O 3.4Å; F523-F532 VanDerWaalsContact N-O 3.15Å; F523-F532 WeakPolarHBondContact O-CB 3.24Å; F523-F532 PolarHBondContact O-N 2.79Å; C525-F532 HydrophobicContact CB-CE2 4.36Å; K530-F532 HydrophobicContact CB-CE2 3.79Å; K530-F532 HydrophobicContact CB-CZ 4.17Å; K530-F532 WeakPolarHBondContact O-CD2 3.4Å; K530-F532 WeakPolarHBondContact O-CE2 3.48Å; F532-N537 HydrophobicContact CB-CB 4.29Å; F532-N537 HydrophobicContact CD1-CB 4.03Å; F532-N537 HydrophobicContact CG-CB 4.49Å; F532-L538 HydrophobicContact CB-CB 4.35Å; F532-L538 HydrophobicContact CD2-CB 4.32Å; F532-L538 HydrophobicContact CD2-CD1 4.21Å; F532-L538 HydrophobicContact CG-CB 4.44Å; F532-H541 HydrophobicContact CE1-CB 4.05Å; F532-H541 HydrophobicContact CE2-CB 4.02Å; F532-H541 AromaticContact CE2-CD2 3.17Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.4Å; F532-H541 AromaticContact CE2-CG 3.76Å; F532-H541 HydrophobicContact CZ-CB 3.61Å; F532-H541 AromaticContact CZ-CD2 3.22Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.43Å; F532-H541 AromaticContact CZ-CG 3.36Å; F532-H541 AromaticContact CZ-NE2 3.94Å
533	N	77.6	Confident	79.5	Confident	37 Å²	37	59.8 Å²	59.8	20%	0.198	34%	0.339	C	S	.	.	S	Bend	trans	-90.6	-6.2	-177.5	66.5	-22.9	0	0	0	114.8	N512 R515 N537	N512-N533 PolarHBondContact O-ND2 3.04Å; N512-N533 PolarHBondContact OD1-O 3.14Å; R515-N533 HydrophobicContact CB-CB 4.23Å; R515-N533 PolarHBondContact NH1-O 2.88Å; R515-N533 VanDerWaalsContact NH1-O 3.13Å; N533-N537 PolarHBondContact OD1-ND2 3.44Å
534	S	79.6	Confident	79	Confident	13 Å²	13	61 Å²	61	9%	0.091	35%	0.351	C	S	.	.	S	Bend	trans	-154.5	153.3	175.3	69.9	0	0	0	0	112.9	A536 N537 L538	S534-A536 PolarHBondContact O-N 3.06Å; S534-N537 WeakPolarHBondContact O-CB 3.28Å; S534-N537 PolarHBondContact O-N 2.84Å; S534-N537 VanDerWaalsContact O-N 3.08Å; S534-N537 PolarHBondContact OG-N 3.41Å; S534-N537 PolarHBondContact OG-ND2 3Å; S534-L538 PolarHBondContact O-N 2.97Å
535	P	75.8	Confident	78.8	Confident	76 Å²	76	61.1 Å²	61.1	49%	0.494	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-40.6	179.9	-23.9	34.5	0	0	0	113	F523 N537 L538 A539	F523-P535 HydrophobicContact CD1-CG 4.1Å; F523-P535 HydrophobicContact CD2-CG 4.48Å; F523-P535 HydrophobicContact CE1-CG 3.74Å; F523-P535 HydrophobicContact CE2-CG 4.13Å; F523-P535 HydrophobicContact CG-CG 4.46Å; F523-P535 HydrophobicContact CZ-CG 3.74Å; P535-N537 PolarHBondContact O-N 3.36Å; P535-L538 CarbonylContact O-C 3.47Å; P535-L538 WeakPolarHBondContact O-CA 3.38Å; P535-L538 WeakPolarHBondContact O-CB 3.44Å; P535-L538 PolarHBondContact O-N 3.43Å; P535-A539 PolarHBondContact O-N 3.07Å
536	A	77.9	Confident	78.3	Confident	73 Å²	73	65 Å²	65	60%	0.603	37%	0.369	S	S	*	.	H	α-helix	trans	-64.9	-19.8	177	0	0	0	0	0	113.8	S534 R540	S534-A536 PolarHBondContact O-N 3.06Å; A536-R540 VanDerWaalsContact O-CB 3.25Å; A536-R540 WeakPolarHBondContact O-CB 3.39Å
537	N	79.5	Confident	78	Confident	45 Å²	45	62.9 Å²	62.9	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-81.4	-36.7	169.8	-77.4	-21.8	0	0	0	111.8	F532 N533 S534 P535 R540 H541	F532-N537 HydrophobicContact CB-CB 4.29Å; F532-N537 HydrophobicContact CD1-CB 4.03Å; F532-N537 HydrophobicContact CG-CB 4.49Å; N533-N537 PolarHBondContact OD1-ND2 3.44Å; S534-N537 WeakPolarHBondContact O-CB 3.28Å; S534-N537 PolarHBondContact O-N 2.84Å; S534-N537 VanDerWaalsContact O-N 3.08Å; S534-N537 PolarHBondContact OG-N 3.41Å; S534-N537 PolarHBondContact OG-ND2 3Å; P535-N537 PolarHBondContact O-N 3.36Å; N537-R540 PolarHBondContact OD1-NH2 3.24Å; N537-H541 PolarHBondContact O-N 2.97Å
538	L	82.3	Confident	77.6	Confident	28 Å²	28	63.3 Å²	63.3	15%	0.147	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-51.8	174.1	169.1	57.4	0	0	0	112.1	F523 P524 C525 F532 S534 P535 R540 H541 R542	F523-L538 HydrophobicContact CB-CB 4.3Å; F523-L538 HydrophobicContact CB-CD2 4Å; P524-L538 WeakPolarHBondContact O-CD2 3.39Å; C525-L538 VanDerWaalsContact CA-CD1 3.49Å; C525-L538 HydrophobicContact CB-CD1 3.71Å; C525-L538 VanDerWaalsContact SG-CD1 3.58Å; F532-L538 HydrophobicContact CB-CB 4.35Å; F532-L538 HydrophobicContact CD2-CB 4.32Å; F532-L538 HydrophobicContact CD2-CD1 4.21Å; F532-L538 HydrophobicContact CG-CB 4.44Å; S534-L538 PolarHBondContact O-N 2.97Å; P535-L538 CarbonylContact O-C 3.47Å; P535-L538 WeakPolarHBondContact O-CA 3.38Å; P535-L538 WeakPolarHBondContact O-CB 3.44Å; P535-L538 PolarHBondContact O-N 3.43Å; L538-R540 VanDerWaalsContact C-N 3.27Å; L538-R540 PolarHBondContact O-N 3.24Å; L538-H541 CarbonylContact O-C 3.53Å; L538-H541 WeakPolarHBondContact O-CA 3.37Å; L538-H541 WeakPolarHBondContact O-CB 3.28Å; L538-H541 PolarHBondContact O-N 2.92Å; L538-R542 HydrophobicContact CD1-CG 4.14Å; L538-R542 PolarHBondContact O-N 2.91Å
539	A	80.3	Confident	77.2	Confident	60 Å²	60	67.9 Å²	67.9	50%	0.496	38%	0.375	S	S	.	.	H	α-helix	trans	-55.6	-43.9	178.3	0	0	0	0	0	111.7	P535 H541 R542 L543	P535-A539 PolarHBondContact O-N 3.07Å; A539-H541 PolarHBondContact O-N 3.42Å; A539-R542 PolarHBondContact O-N 3.17Å; A539-R542 VanDerWaalsContact O-N 3.16Å; A539-L543 PolarHBondContact O-N 3.45Å
540	R	77.5	Confident	77	Confident	107 Å²	107	67.5 Å²	67.5	40%	0.404	37%	0.37	S	S	.	.	H	α-helix	trans	-66.9	-17.1	174.5	-173.8	167.4	60.9	141.4	-4.8	114.1	A536 N537 L538 Q562	A536-R540 VanDerWaalsContact O-CB 3.25Å; A536-R540 WeakPolarHBondContact O-CB 3.39Å; N537-R540 PolarHBondContact OD1-NH2 3.24Å; L538-R540 VanDerWaalsContact C-N 3.27Å; L538-R540 PolarHBondContact O-N 3.24Å; R540-Q562 HydrophobicContact CG-CG 4.32Å
541	H	80.3	Confident	77	Confident	26 Å²	26	67.2 Å²	67.2	12%	0.12	37%	0.367	C	S	.	.	H	α-helix	trans	-88.7	-33.9	170.3	176.4	44.5	0	0	0	112.6	C525 C528 F532 N537 L538 A539 L543 T544 H545	C525-H541 PolarHBondContact SG-CD2 3.21Å; C528-H541 PolarHBondContact SG-NE2 2.87Å; C528-H541 VanDerWaalsContact SG-NE2 3.36Å; F532-H541 HydrophobicContact CE1-CB 4.05Å; F532-H541 HydrophobicContact CE2-CB 4.02Å; F532-H541 AromaticContact CE2-CD2 3.17Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.4Å; F532-H541 AromaticContact CE2-CG 3.76Å; F532-H541 HydrophobicContact CZ-CB 3.61Å; F532-H541 AromaticContact CZ-CD2 3.22Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.43Å; F532-H541 AromaticContact CZ-CG 3.36Å; F532-H541 AromaticContact CZ-NE2 3.94Å; N537-H541 PolarHBondContact O-N 2.97Å; L538-H541 CarbonylContact O-C 3.53Å; L538-H541 WeakPolarHBondContact O-CA 3.37Å; L538-H541 WeakPolarHBondContact O-CB 3.28Å; L538-H541 PolarHBondContact O-N 2.92Å; A539-H541 PolarHBondContact O-N 3.42Å; H541-L543 PolarHBondContact O-N 3.49Å; H541-T544 PolarHBondContact CE1-OG1 3.05Å; H541-T544 VanDerWaalsContact CE1-OG1 3.23Å; H541-T544 PolarHBondContact ND1-OG1 3.48Å; H541-T544 WeakPolarHBondContact O-CA 3.42Å; H541-T544 WeakPolarHBondContact O-CB 3.14Å; H541-T544 PolarHBondContact O-N 2.7Å; H541-T544 PolarHBondContact O-OG1 2.99Å; H541-H545 AromaticContact CD2-NE2 3.99Å; H541-H545 AromaticContact CE1-NE2 3.55Å; H541-H545 AromaticContact NE2-NE2 3.3Å; H541-H545 PolarHBondContact NE2-NE2 3.13Å
542	R	79.4	Confident	76.7	Confident	106 Å²	106	73.1 Å²	73.1	40%	0.4	38%	0.382	S	S	.	.	H	α-helix	trans	-57.2	-32	173.6	-67.7	-178.6	77.1	-164.3	1.2	112.2	L538 A539 T544 H545 T546	L538-R542 HydrophobicContact CD1-CG 4.14Å; L538-R542 PolarHBondContact O-N 2.91Å; A539-R542 PolarHBondContact O-N 3.17Å; A539-R542 VanDerWaalsContact O-N 3.16Å; R542-T544 PolarHBondContact O-N 2.79Å; R542-H545 WeakPolarHBondContact O-CA 3.45Å; R542-H545 PolarHBondContact O-N 2.94Å; R542-T546 PolarHBondContact O-N 2.91Å
543	L	79.2	Confident	76.5	Confident	32 Å²	32	71.2 Å²	71.2	17%	0.168	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-16.3	167.9	-60.1	177.8	0	0	0	115.2	A539 H541 T546 G547 E548 T561	A539-L543 PolarHBondContact O-N 3.45Å; H541-L543 PolarHBondContact O-N 3.49Å; L543-T546 WeakPolarHBondContact CA-OG1 3.32Å; L543-G547 WeakPolarHBondContact O-CA 3.31Å; L543-G547 PolarHBondContact O-N 3.26Å; L543-E548 HydrophobicContact CD2-CB 3.89Å; L543-T561 HydrophobicContact CB-CG2 4.29Å
544	T	70.9	Confident	76.3	Confident	84 Å²	84	72.6 Å²	72.6	52%	0.515	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.6	173.8	66.2	0	0	0	0	113.9	H541 R542	H541-T544 PolarHBondContact CE1-OG1 3.05Å; H541-T544 VanDerWaalsContact CE1-OG1 3.23Å; H541-T544 PolarHBondContact ND1-OG1 3.48Å; H541-T544 WeakPolarHBondContact O-CA 3.42Å; H541-T544 WeakPolarHBondContact O-CB 3.14Å; H541-T544 PolarHBondContact O-N 2.7Å; H541-T544 PolarHBondContact O-OG1 2.99Å; R542-T544 PolarHBondContact O-N 2.79Å
545	H	76.1	Confident	76	Confident	77 Å²	77	76.5 Å²	76.5	36%	0.356	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-47	170	-57.5	-57.4	0	0	0	110.8	D527 C528 H541 R542 G547	D527-H545 HydrophobicContact CB-CB 4.35Å; D527-H545 IonicContact OD2-CD2 3.38Å; D527-H545 PolarHBondContact OD2-CD2 3.24Å; D527-H545 IonicContact OD2-NE2 3.87Å; C528-H545 PolarHBondContact SG-CE1 3.3Å; C528-H545 PolarHBondContact SG-NE2 2.85Å; H541-H545 AromaticContact CD2-NE2 3.99Å; H541-H545 AromaticContact CE1-NE2 3.55Å; H541-H545 AromaticContact NE2-NE2 3.3Å; H541-H545 PolarHBondContact NE2-NE2 3.13Å; R542-H545 WeakPolarHBondContact O-CA 3.45Å; R542-H545 PolarHBondContact O-N 2.94Å; H545-G547 PolarHBondContact O-N 3.2Å
546	T	75.6	Confident	76	Confident	84 Å²	84	75.1 Å²	75.1	52%	0.515	41%	0.408	S	S	.	.	S	Bend	trans	-68	-20.2	174	65.7	0	0	0	0	112.8	R542 L543 E548	R542-T546 PolarHBondContact O-N 2.91Å; L543-T546 WeakPolarHBondContact CA-OG1 3.32Å; T546-E548 PolarHBondContact O-N 3.21Å; T546-E548 WeakPolarHBondContact OG1-CG 3.07Å; T546-E548 PolarHBondContact OG1-N 3.07Å; T546-E548 PolarHBondContact OG1-OE2 2.79Å
547	G	73.7	Confident	75.8	Confident	48 Å²	48	74 Å²	74	50%	0.495	40%	0.403	S	S	.	.			trans	72.9	0.8	-178.1	0	0	0	0	0	114.4	L543 H545 R549	L543-G547 WeakPolarHBondContact O-CA 3.31Å; L543-G547 PolarHBondContact O-N 3.26Å; H545-G547 PolarHBondContact O-N 3.2Å; G547-R549 WeakPolarHBondContact O-CG 3.44Å
548	E	71.7	Confident	75.5	Confident	91 Å²	91	77.5 Å²	77.5	43%	0.425	42%	0.416	S	S	.	.			trans	-62	134.8	-177.3	-70.4	171.3	135	0	0	112.5	L543 T546	L543-E548 HydrophobicContact CD2-CB 3.89Å; T546-E548 PolarHBondContact O-N 3.21Å; T546-E548 WeakPolarHBondContact OG1-CG 3.07Å; T546-E548 PolarHBondContact OG1-N 3.07Å; T546-E548 PolarHBondContact OG1-OE2 2.79Å
549	R	74.6	Confident	75	Confident	138 Å²	138	77 Å²	77	52%	0.521	42%	0.417	S	S	.	.			trans	-132.5	74.3	-176.2	-70.6	163.6	77.2	155.9	1.4	109.8	G547 Y551 A559 F560 T561	G547-R549 WeakPolarHBondContact O-CG 3.44Å; R549-Y551 PolarHBondContact O-N 3.35Å; R549-Y551 VanDerWaalsContact O-N 3.09Å; R549-A559 HydrophobicContact CB-CB 3.53Å; R549-A559 PolarHBondContact NE-O 3.41Å; R549-A559 PolarHBondContact NH2-O 3Å; R549-F560 CarbonylContact C-O 3.19Å; R549-F560 WeakPolarHBondContact CA-O 3.38Å; R549-T561 HydrophobicContact CG-CG2 3.95Å
550	P	72	Confident	74.8	Confident	86 Å²	86	76.1 Å²	76.1	56%	0.558	40%	0.402	S	S	*	.			trans	-60.7	-25.4	-169.2	-25.6	35.6	0	0	0	114.6	R552	P550-R552 PolarHBondContact O-N 3.04Å
551	Y	78.5	Confident	74.6	Confident	99 Å²	99	72.9 Å²	72.9	39%	0.388	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	93.4	-170.2	-58.2	-82	0	0	0	111.1	R549 A559 F560 Q562	R549-Y551 PolarHBondContact O-N 3.35Å; R549-Y551 VanDerWaalsContact O-N 3.09Å; Y551-A559 CarbonylContact O-C 3.6Å; Y551-F560 WeakPolarHBondContact CB-O 3.06Å; Y551-F560 PolarHBondContact N-O 2.91Å; Y551-F560 PolarHBondContact O-N 3.01Å; Y551-Q562 VanDerWaalsContact CD2-CA 3.46Å
552	R	67	Low	74.4	Confident	183 Å²	183	74.1 Å²	74.1	69%	0.691	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	145.5	178.7	-60.4	-170.4	-177.5	-142.6	5.8	113.6	P550 A559 L566	P550-R552 PolarHBondContact O-N 3.04Å; R552-A559 HydrophobicContact CG-CB 4Å; R552-L566 VanDerWaalsContact O-CD2 3.25Å; R552-L566 WeakPolarHBondContact O-CD2 3.4Å
553	C	76.6	Confident	74	Confident	2 Å²	2	72 Å²	72	1%	0.014	40%	0.401	C	S	.	.			trans	-88	126.1	168.9	-138	0	0	0	0	108.9	D555 G557 K558 L566 R570	C553-D555 PolarHBondContact SG-OD2 3.01Å; C553-G557 WeakPolarHBondContact O-CA 2.89Å; C553-G557 PolarHBondContact O-N 2.89Å; C553-K558 WeakPolarHBondContact CB-O 3.38Å; C553-K558 PolarHBondContact N-O 3.24Å; C553-L566 HydrophobicContact CB-CD1 3.64Å; C553-L566 VanDerWaalsContact SG-CD1 3.57Å; C553-R570 VanDerWaalsContact SG-CG 3.52Å
554	G	75.1	Confident	73.6	Confident	66 Å²	66	73.5 Å²	73.5	68%	0.68	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-64.6	-54.7	174.5	0	0	0	0	0	110.1	C556	G554-C556 PolarHBondContact O-N 3.28Å
555	D	71.4	Confident	73.7	Confident	96 Å²	96	71.6 Å²	71.6	51%	0.513	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-53.6	-12	-177.1	-1.5	-58.3	0	0	0	116.3	C553 H573	C553-D555 PolarHBondContact SG-OD2 3.01Å; D555-H573 HydrophobicContact CB-CB 4.43Å; D555-H573 IonicContact OD2-CD2 3.83Å; D555-H573 PolarHBondContact OD2-CD2 2.89Å; D555-H573 IonicContact OD2-CG 3.74Å; D555-H573 IonicContact OD2-NE2 3.99Å
556	C	76.4	Confident	73.6	Confident	46 Å²	46	68.6 Å²	68.6	31%	0.311	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-160.1	12.6	176.8	71.2	0	0	0	0	116	G554 K558 H569 H573	G554-C556 PolarHBondContact O-N 3.28Å; C556-K558 PolarHBondContact O-N 3.13Å; C556-H569 PolarHBondContact SG-NE2 3.39Å; C556-H573 VanDerWaalsContact SG-CE1 3.58Å; C556-H573 PolarHBondContact SG-NE2 3.29Å
557	G	74.6	Confident	73.3	Confident	49 Å²	49	73.8 Å²	73.8	51%	0.505	40%	0.399	S	S	.	.			trans	66.1	-11.7	-177.3	0	0	0	0	0	117.1	C553 A559	C553-G557 WeakPolarHBondContact O-CA 2.89Å; C553-G557 PolarHBondContact O-N 2.89Å; G557-A559 PolarHBondContact O-N 3.08Å
558	K	71.8	Confident	73	Confident	119 Å²	119	74.2 Å²	74.2	52%	0.517	39%	0.388	S	S	.	.			trans	-62.4	122.4	-172.8	-69.7	172.7	-172.1	164.6	0	111.5	C553 C556 F560	C553-K558 WeakPolarHBondContact CB-O 3.38Å; C553-K558 PolarHBondContact N-O 3.24Å; C556-K558 PolarHBondContact O-N 3.13Å; K558-F560 HydrophobicContact CB-CE2 3.83Å; K558-F560 HydrophobicContact CB-CZ 4.1Å; K558-F560 WeakPolarHBondContact O-CD2 3.32Å; K558-F560 WeakPolarHBondContact O-CE2 3.38Å
559	A	72.4	Confident	73.2	Confident	19 Å²	19	71.2 Å²	71.2	16%	0.157	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	149	-179.6	0	0	0	0	0	112.3	R549 Y551 R552 G557	R549-A559 HydrophobicContact CB-CB 3.53Å; R549-A559 PolarHBondContact NE-O 3.41Å; R549-A559 PolarHBondContact NH2-O 3Å; Y551-A559 CarbonylContact O-C 3.6Å; R552-A559 HydrophobicContact CG-CB 4Å; G557-A559 PolarHBondContact O-N 3.08Å
560	F	76.5	Confident	73.1	Confident	41 Å²	41	70.1 Å²	70.1	18%	0.18	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.8	-179.5	-62.9	-90.3	0	0	0	112.1	R549 Y551 K558 Q562 L566 H569	R549-F560 CarbonylContact C-O 3.19Å; R549-F560 WeakPolarHBondContact CA-O 3.38Å; Y551-F560 WeakPolarHBondContact CB-O 3.06Å; Y551-F560 PolarHBondContact N-O 2.91Å; Y551-F560 PolarHBondContact O-N 3.01Å; K558-F560 HydrophobicContact CB-CE2 3.83Å; K558-F560 HydrophobicContact CB-CZ 4.1Å; K558-F560 WeakPolarHBondContact O-CD2 3.32Å; K558-F560 WeakPolarHBondContact O-CE2 3.38Å; F560-Q562 VanDerWaalsContact C-N 3.26Å; F560-Q562 PolarHBondContact O-N 3.01Å; F560-L566 HydrophobicContact CB-CB 4.28Å; F560-L566 HydrophobicContact CD2-CB 4Å; F560-L566 HydrophobicContact CD2-CD1 3.89Å; F560-L566 HydrophobicContact CE2-CD1 4.15Å; F560-L566 HydrophobicContact CG-CB 4.29Å; F560-H569 HydrophobicContact CE1-CB 4.22Å; F560-H569 HydrophobicContact CE2-CB 4.03Å; F560-H569 AromaticContact CE2-CD2 3.38Å; F560-H569 WeakPolarHBondContact CE2-CD2 3.46Å; F560-H569 AromaticContact CE2-CG 3.9Å; F560-H569 HydrophobicContact CZ-CB 3.65Å; F560-H569 AromaticContact CZ-CD2 3.32Å; F560-H569 WeakPolarHBondContact CZ-CD2 3.37Å; F560-H569 AromaticContact CZ-CG 3.48Å; F560-H569 VanDerWaalsContact CZ-CG 3.48Å
561	T	72.5	Confident	72.9	Confident	39 Å²	39	68.2 Å²	68.2	24%	0.239	36%	0.355	C	S	.	.	S	Bend	trans	-77.1	-7.7	175.2	54.8	0	0	0	0	113.5	L543 R549	L543-T561 HydrophobicContact CB-CG2 4.29Å; R549-T561 HydrophobicContact CG-CG2 3.95Å
562	Q	76.1	Confident	72.4	Confident	51 Å²	51	66.8 Å²	66.8	24%	0.238	36%	0.357	C	S	.	.			trans	-145.9	140.9	-176.9	-53.5	-178.4	42.8	0	0	112.2	R540 Y551 F560 S564 T565 L566	R540-Q562 HydrophobicContact CG-CG 4.32Å; Y551-Q562 VanDerWaalsContact CD2-CA 3.46Å; F560-Q562 VanDerWaalsContact C-N 3.26Å; F560-Q562 PolarHBondContact O-N 3.01Å; Q562-S564 PolarHBondContact O-N 2.72Å; Q562-S564 PolarHBondContact OE1-OG 2.6Å; Q562-T565 HydrophobicContact CB-CG2 4.48Å; Q562-T565 PolarHBondContact O-N 3.33Å; Q562-T565 PolarHBondContact O-OG1 3.17Å; Q562-L566 PolarHBondContact O-N 2.72Å; Q562-L566 VanDerWaalsContact O-N 3.11Å
563	S	70.7	Confident	72.7	Confident	62 Å²	62	61.6 Å²	61.6	43%	0.434	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-32	172.8	54.1	0	0	0	0	113.1	R567	S563-R567 VanDerWaalsContact O-CB 3.31Å; S563-R567 WeakPolarHBondContact O-CB 3.47Å; S563-R567 PolarHBondContact O-N 3.33Å
564	S	70.7	Confident	72.1	Confident	63 Å²	63	65 Å²	65	44%	0.441	37%	0.368	S	S	.	.	H	α-helix	trans	-66.7	-41	177.6	56.7	0	0	0	0	112.6	Q562 Q568	Q562-S564 PolarHBondContact O-N 2.72Å; Q562-S564 PolarHBondContact OE1-OG 2.6Å; S564-Q568 VanDerWaalsContact O-CB 3.32Å; S564-Q568 WeakPolarHBondContact O-CB 3.46Å; S564-Q568 PolarHBondContact O-N 3.06Å; S564-Q568 VanDerWaalsContact O-N 3.13Å
565	T	74.1	Confident	71.4	Confident	45 Å²	45	69 Å²	69	28%	0.276	37%	0.369	S	S	.	.	H	α-helix	trans	-76.4	-34.7	178	53.7	0	0	0	0	111.6	Q562 H569	Q562-T565 HydrophobicContact CB-CG2 4.48Å; Q562-T565 PolarHBondContact O-N 3.33Å; Q562-T565 PolarHBondContact O-OG1 3.17Å; T565-H569 WeakPolarHBondContact O-CB 3.43Å; T565-H569 PolarHBondContact O-N 3.35Å
566	L	74.4	Confident	71	Confident	14 Å²	14	69 Å²	69	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-60.3	-52.8	168	171	62	0	0	0	111.9	R552 C553 F560 Q562 Q568 H569 R570	R552-L566 VanDerWaalsContact O-CD2 3.25Å; R552-L566 WeakPolarHBondContact O-CD2 3.4Å; C553-L566 HydrophobicContact CB-CD1 3.64Å; C553-L566 VanDerWaalsContact SG-CD1 3.57Å; F560-L566 HydrophobicContact CB-CB 4.28Å; F560-L566 HydrophobicContact CD2-CB 4Å; F560-L566 HydrophobicContact CD2-CD1 3.89Å; F560-L566 HydrophobicContact CE2-CD1 4.15Å; F560-L566 HydrophobicContact CG-CB 4.29Å; Q562-L566 PolarHBondContact O-N 2.72Å; Q562-L566 VanDerWaalsContact O-N 3.11Å; L566-Q568 PolarHBondContact O-N 3.42Å; L566-H569 WeakPolarHBondContact O-CA 3.2Å; L566-H569 WeakPolarHBondContact O-CB 3.34Å; L566-H569 PolarHBondContact O-N 3.16Å; L566-R570 HydrophobicContact CD1-CG 4.29Å; L566-R570 PolarHBondContact O-N 2.8Å
567	R	69.7	Low	70.6	Confident	192 Å²	192	69.8 Å²	69.8	73%	0.725	36%	0.364	S	S	*	.	H	α-helix	trans	-55.2	-41.8	179.6	-176.2	-176.2	-63.4	-174.5	-1	111.4	S563 H569 R570	S563-R567 VanDerWaalsContact O-CB 3.31Å; S563-R567 WeakPolarHBondContact O-CB 3.47Å; S563-R567 PolarHBondContact O-N 3.33Å; R567-H569 VanDerWaalsContact C-N 3.32Å; R567-R570 PolarHBondContact O-N 2.99Å
568	Q	66.3	Low	70.1	Confident	57 Å²	57	70.5 Å²	70.5	27%	0.266	36%	0.36	S	S	.	.	H	α-helix	trans	-81.3	-10.7	-180	-165	-110.1	-79.8	0	0	113.5	S564 L566 L571	S564-Q568 VanDerWaalsContact O-CB 3.32Å; S564-Q568 WeakPolarHBondContact O-CB 3.46Å; S564-Q568 PolarHBondContact O-N 3.06Å; S564-Q568 VanDerWaalsContact O-N 3.13Å; L566-Q568 PolarHBondContact O-N 3.42Å; Q568-L571 HydrophobicContact CG-CD1 4.18Å
569	H	76.3	Confident	70.1	Confident	28 Å²	28	69.3 Å²	69.3	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-80.9	-40.3	164.4	177.2	41.7	0	0	0	111.8	C556 F560 T565 L566 R567 L571 V572 H573	C556-H569 PolarHBondContact SG-NE2 3.39Å; F560-H569 HydrophobicContact CE1-CB 4.22Å; F560-H569 HydrophobicContact CE2-CB 4.03Å; F560-H569 AromaticContact CE2-CD2 3.38Å; F560-H569 WeakPolarHBondContact CE2-CD2 3.46Å; F560-H569 AromaticContact CE2-CG 3.9Å; F560-H569 HydrophobicContact CZ-CB 3.65Å; F560-H569 AromaticContact CZ-CD2 3.32Å; F560-H569 WeakPolarHBondContact CZ-CD2 3.37Å; F560-H569 AromaticContact CZ-CG 3.48Å; F560-H569 VanDerWaalsContact CZ-CG 3.48Å; T565-H569 WeakPolarHBondContact O-CB 3.43Å; T565-H569 PolarHBondContact O-N 3.35Å; L566-H569 WeakPolarHBondContact O-CA 3.2Å; L566-H569 WeakPolarHBondContact O-CB 3.34Å; L566-H569 PolarHBondContact O-N 3.16Å; R567-H569 VanDerWaalsContact C-N 3.32Å; H569-L571 PolarHBondContact O-N 2.98Å; H569-L571 VanDerWaalsContact O-N 3.13Å; H569-V572 VanDerWaalsContact O-CB 3.23Å; H569-V572 WeakPolarHBondContact O-CB 3.48Å; H569-V572 VanDerWaalsContact O-CG2 3.31Å; H569-V572 WeakPolarHBondContact O-CG2 3.48Å; H569-V572 PolarHBondContact O-N 3.19Å; H569-H573 AromaticContact CD2-NE2 3.96Å; H569-H573 AromaticContact CE1-NE2 3.67Å; H569-H573 AromaticContact NE2-CE1 3.94Å; H569-H573 AromaticContact NE2-NE2 3.31Å; H569-H573 PolarHBondContact NE2-NE2 3.06Å
570	R	71.1	Confident	70.1	Confident	115 Å²	115	76.6 Å²	76.6	43%	0.434	38%	0.376	S	S	.	.	H	α-helix	trans	-57.9	-26	176	-68.4	-171.9	-173.1	-172.5	0.4	113.5	C553 L566 R567 V572 H573 A574	C553-R570 VanDerWaalsContact SG-CG 3.52Å; L566-R570 HydrophobicContact CD1-CG 4.29Å; L566-R570 PolarHBondContact O-N 2.8Å; R567-R570 PolarHBondContact O-N 2.99Å; R570-V572 PolarHBondContact O-N 3.16Å; R570-H573 PolarHBondContact O-N 3.23Å; R570-H573 VanDerWaalsContact O-N 3.14Å; R570-A574 PolarHBondContact O-N 3.12Å
571	L	69.6	Low	70.3	Confident	47 Å²	47	74.7 Å²	74.7	25%	0.246	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-24.7	170.9	-62	-178.5	0	0	0	113.8	Q568 H569 Q575 H576 H589	Q568-L571 HydrophobicContact CG-CD1 4.18Å; H569-L571 PolarHBondContact O-N 2.98Å; H569-L571 VanDerWaalsContact O-N 3.13Å; L571-Q575 PolarHBondContact O-N 2.95Å; L571-H576 HydrophobicContact CD2-CB 4.11Å; L571-H576 PolarHBondContact O-N 3.39Å; L571-H589 PolarHBondContact O-CE1 3.42Å; L571-H589 PolarHBondContact O-ND1 3.11Å
572	V	68.2	Low	70.6	Confident	69 Å²	69	81.4 Å²	81.4	42%	0.418	40%	0.397	S	S	.	.	H	α-helix	trans	-70.8	-44.8	175	-175.4	0	0	0	0	110.4	H569 R570 Q575	H569-V572 VanDerWaalsContact O-CB 3.23Å; H569-V572 WeakPolarHBondContact O-CB 3.48Å; H569-V572 VanDerWaalsContact O-CG2 3.31Å; H569-V572 WeakPolarHBondContact O-CG2 3.48Å; H569-V572 PolarHBondContact O-N 3.19Å; R570-V572 PolarHBondContact O-N 3.16Å; V572-Q575 PolarHBondContact O-N 3.47Å
573	H	71.4	Confident	70.6	Confident	73 Å²	73	82.9 Å²	82.9	34%	0.338	40%	0.404	S	S	.	.	H	α-helix	trans	-69	-44.2	178.2	-57.2	-53.5	0	0	0	111.8	D555 C556 H569 R570 Q575	D555-H573 HydrophobicContact CB-CB 4.43Å; D555-H573 IonicContact OD2-CD2 3.83Å; D555-H573 PolarHBondContact OD2-CD2 2.89Å; D555-H573 IonicContact OD2-CG 3.74Å; D555-H573 IonicContact OD2-NE2 3.99Å; C556-H573 VanDerWaalsContact SG-CE1 3.58Å; C556-H573 PolarHBondContact SG-NE2 3.29Å; H569-H573 AromaticContact CD2-NE2 3.96Å; H569-H573 AromaticContact CE1-NE2 3.67Å; H569-H573 AromaticContact NE2-CE1 3.94Å; H569-H573 AromaticContact NE2-NE2 3.31Å; H569-H573 PolarHBondContact NE2-NE2 3.06Å; R570-H573 PolarHBondContact O-N 3.23Å; R570-H573 VanDerWaalsContact O-N 3.14Å; H573-Q575 PolarHBondContact O-N 3.34Å; H573-Q575 VanDerWaalsContact O-N 3.09Å
574	A	64.3	Low	71.1	Confident	73 Å²	73	82.9 Å²	82.9	60%	0.603	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	5	175.6	0	0	0	0	0	114.1	R570 H576	R570-A574 PolarHBondContact O-N 3.12Å; A574-H576 HydrophobicContact CB-CB 4.35Å; A574-H576 PolarHBondContact O-N 3.46Å
575	Q	61.4	Low	71.3	Confident	150 Å²	150	81 Å²	81	70%	0.701	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.9	32	-173.4	-57.5	-165.9	20.3	0	0	113.9	L571 V572 H573 F577	L571-Q575 PolarHBondContact O-N 2.95Å; V572-Q575 PolarHBondContact O-N 3.47Å; H573-Q575 PolarHBondContact O-N 3.34Å; H573-Q575 VanDerWaalsContact O-N 3.09Å; Q575-F577 HydrophobicContact CB-CE2 4.12Å; Q575-F577 WeakPolarHBondContact O-CD2 3.43Å; Q575-F577 WeakPolarHBondContact O-CE2 3.33Å; Q575-F577 PolarHBondContact O-N 3.04Å
576	H	61.7	Low	71.2	Confident	98 Å²	98	83.4 Å²	83.4	45%	0.454	40%	0.404	S	S	.	.			trans	-92.2	97.7	-170.7	-170.2	-101.3	0	0	0	109.5	L571 A574 P578 H589	L571-H576 HydrophobicContact CD2-CB 4.11Å; L571-H576 PolarHBondContact O-N 3.39Å; A574-H576 HydrophobicContact CB-CB 4.35Å; A574-H576 PolarHBondContact O-N 3.46Å; H576-P578 WeakPolarHBondContact O-CD 3.37Å; H576-H589 PolarHBondContact O-ND1 2.9Å
577	F	69.3	Low	70.8	Confident	61 Å²	61	89.3 Å²	89.3	27%	0.268	43%	0.425	S	S	.	.			trans	-107	87.5	178.6	-55.4	-93.6	0	0	0	110.5	Q575 Y579 R587 H589	Q575-F577 HydrophobicContact CB-CE2 4.12Å; Q575-F577 WeakPolarHBondContact O-CD2 3.43Å; Q575-F577 WeakPolarHBondContact O-CE2 3.33Å; Q575-F577 PolarHBondContact O-N 3.04Å; F577-Y579 VanDerWaalsContact C-N 3.31Å; F577-Y579 PolarHBondContact O-N 2.95Å; F577-R587 HydrophobicContact CB-CB 3.34Å; F577-R587 HydrophobicContact CD1-CB 4.47Å; F577-R587 VanDerWaalsContact CD1-O 3.32Å; F577-R587 WeakPolarHBondContact CD1-O 3.31Å; F577-R587 HydrophobicContact CG-CB 3.96Å; F577-R587 PolarHBondContact O-NE 2.82Å; F577-R587 VanDerWaalsContact O-NE 3.11Å; F577-R587 PolarHBondContact O-NH2 3.15Å; F577-H589 AromaticContact CD1-CD2 3.96Å; F577-H589 AromaticContact CD1-CE1 3.33Å; F577-H589 WeakPolarHBondContact CD1-CE1 3.38Å; F577-H589 AromaticContact CD1-CG 3.84Å; F577-H589 AromaticContact CD1-ND1 3.45Å; F577-H589 WeakPolarHBondContact CD1-ND1 3.02Å; F577-H589 AromaticContact CD1-NE2 3.67Å; F577-H589 AromaticContact CE1-CD2 3.71Å; F577-H589 AromaticContact CE1-CE1 3.16Å; F577-H589 WeakPolarHBondContact CE1-CE1 3.46Å; F577-H589 AromaticContact CE1-ND1 3.76Å; F577-H589 AromaticContact CE1-NE2 3.13Å; F577-H589 WeakPolarHBondContact CE1-NE2 3.19Å; F577-H589 AromaticContact CE2-CE1 3.93Å; F577-H589 AromaticContact CG-CE1 3.8Å; F577-H589 AromaticContact CG-ND1 3.87Å; F577-H589 AromaticContact CZ-CE1 3.47Å; F577-H589 VanDerWaalsContact CZ-CE1 3.47Å; F577-H589 WeakPolarHBondContact CZ-CE1 3.31Å; F577-H589 AromaticContact CZ-NE2 3.58Å
578	P	63.3	Low	70.9	Confident	65 Å²	65	82 Å²	82	42%	0.422	40%	0.399	S	S	.	.			trans	-78.2	-8.9	-176	29.6	-34.8	0	0	0	114.5	H576	H576-P578 WeakPolarHBondContact O-CD 3.37Å
579	Y	72.3	Confident	70.7	Confident	93 Å²	93	81 Å²	81	37%	0.365	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	100.5	179.5	-53.9	-76.7	0	0	0	109.6	F577 R587 F588 R590 P591	F577-Y579 VanDerWaalsContact C-N 3.31Å; F577-Y579 PolarHBondContact O-N 2.95Å; Y579-R587 CarbonylContact O-C 3.58Å; Y579-R587 WeakPolarHBondContact O-CA 3.47Å; Y579-F588 WeakPolarHBondContact CD2-O 3.32Å; Y579-F588 PolarHBondContact N-O 2.88Å; Y579-F588 PolarHBondContact O-N 2.91Å; Y579-R590 VanDerWaalsContact CD2-C 3.44Å; Y579-P591 HydrophobicContact CD1-CB 3.93Å; Y579-P591 HydrophobicContact CD1-CG 4.24Å; Y579-P591 HydrophobicContact CE1-CB 3.84Å; Y579-P591 HydrophobicContact CE1-CG 3.69Å; Y579-P591 VanDerWaalsContact CE2-CD 3.49Å; Y579-P591 HydrophobicContact CE2-CG 4.08Å; Y579-P591 HydrophobicContact CG-CB 4.39Å
580	R	72.8	Confident	70.2	Confident	172 Å²	172	85.1 Å²	85.1	65%	0.649	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	137.2	178.3	172.8	172.5	177.8	-172.9	1.9	110.8	R587 L594	R580-R587 HydrophobicContact CB-CG 4.34Å; R580-R587 HydrophobicContact CG-CG 4.46Å; R580-L594 WeakPolarHBondContact O-CD2 3.47Å
581	C	80.1	Confident	69.7	Low	1 Å²	1	83 Å²	83	1%	0.007	41%	0.41	C	S	.	.			trans	-73.7	130.7	164.9	172.3	0	0	0	0	109.4	E583 C584 G585 L586 F588 L594 H601	C581-E583 PolarHBondContact SG-N 3.13Å; C581-E583 VanDerWaalsContact SG-N 3.4Å; C581-E583 PolarHBondContact SG-OE2 3.41Å; C581-C584 PolarHBondContact SG-N 3.13Å; C581-G585 WeakPolarHBondContact O-CA 3.15Å; C581-G585 PolarHBondContact O-N 2.84Å; C581-L586 WeakPolarHBondContact CB-O 3.13Å; C581-L586 PolarHBondContact N-O 3.26Å; C581-F588 HydrophobicContact CB-CE2 4.41Å; C581-L594 VanDerWaalsContact CA-CD1 3.48Å; C581-L594 HydrophobicContact CB-CD1 3.58Å; C581-H601 PolarHBondContact SG-NE2 2.85Å; C581-H601 VanDerWaalsContact SG-NE2 3.43Å
582	Q	78.4	Confident	69.2	Low	180 Å²	180	85.5 Å²	85.5	84%	0.841	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-36.9	176.2	-72.3	169.7	-51.3	0	0	110.8
583	E	76.2	Confident	69.1	Low	83 Å²	83	89.2 Å²	89.2	39%	0.388	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-36.2	-176.8	-56.8	103.6	178	0	0	113.9	C581 R598 H601	C581-E583 PolarHBondContact SG-N 3.13Å; C581-E583 VanDerWaalsContact SG-N 3.4Å; C581-E583 PolarHBondContact SG-OE2 3.41Å; E583-R598 WeakPolarHBondContact OE1-CD 3.06Å; E583-R598 IonicContact OE1-CZ 3.72Å; E583-R598 IonicContact OE1-NE 3.92Å; E583-R598 IonicContact OE1-NH1 2.79Å; E583-R598 PolarHBondContact OE1-NH1 3.23Å; E583-H601 HydrophobicContact CB-CB 4.35Å; E583-H601 HydrophobicContact CG-CB 4.35Å; E583-H601 IonicContact OE2-CD2 3.63Å; E583-H601 PolarHBondContact OE2-CD2 3.14Å
584	C	80.7	Confident	69.1	Low	62 Å²	62	87.5 Å²	87.5	42%	0.419	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	13.4	180	79.1	0	0	0	0	115.7	C581 L586 H597 H601	C581-C584 PolarHBondContact SG-N 3.13Å; C584-L586 PolarHBondContact O-N 3.13Å; C584-H597 PolarHBondContact SG-NE2 3.48Å; C584-H601 PolarHBondContact SG-CE1 2.75Å; C584-H601 PolarHBondContact SG-NE2 3.22Å
585	G	76.4	Confident	69.2	Low	23 Å²	23	88 Å²	88	24%	0.237	41%	0.408	C	S	.	.			trans	74.3	-15.4	174.7	0	0	0	0	0	117.1	C581 R587	C581-G585 WeakPolarHBondContact O-CA 3.15Å; C581-G585 PolarHBondContact O-N 2.84Å; G585-R587 WeakPolarHBondContact O-CG 3.48Å; G585-R587 PolarHBondContact O-N 3.21Å
586	L	72.2	Confident	69.3	Low	95 Å²	95	81.9 Å²	81.9	50%	0.497	38%	0.38	S	S	.	.			trans	-54.2	137.6	-178.5	-84	172.9	0	0	0	112.7	C581 C584 F588	C581-L586 WeakPolarHBondContact CB-O 3.13Å; C581-L586 PolarHBondContact N-O 3.26Å; C584-L586 PolarHBondContact O-N 3.13Å; L586-F588 HydrophobicContact CB-CE2 3.87Å; L586-F588 HydrophobicContact CB-CZ 3.87Å; L586-F588 WeakPolarHBondContact O-CE2 3.18Å
587	R	65.9	Low	69.8	Low	138 Å²	138	78.6 Å²	78.6	52%	0.521	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	142.8	-172	-48.4	179	61.2	170.3	-0.9	112	F577 Y579 R580 G585	F577-R587 HydrophobicContact CB-CB 3.34Å; F577-R587 HydrophobicContact CD1-CB 4.47Å; F577-R587 VanDerWaalsContact CD1-O 3.32Å; F577-R587 WeakPolarHBondContact CD1-O 3.31Å; F577-R587 HydrophobicContact CG-CB 3.96Å; F577-R587 PolarHBondContact O-NE 2.82Å; F577-R587 VanDerWaalsContact O-NE 3.11Å; F577-R587 PolarHBondContact O-NH2 3.15Å; Y579-R587 CarbonylContact O-C 3.58Å; Y579-R587 WeakPolarHBondContact O-CA 3.47Å; R580-R587 HydrophobicContact CB-CG 4.34Å; R580-R587 HydrophobicContact CG-CG 4.46Å; G585-R587 WeakPolarHBondContact O-CG 3.48Å; G585-R587 PolarHBondContact O-N 3.21Å
588	F	71.5	Confident	69.6	Low	39 Å²	39	81.5 Å²	81.5	17%	0.171	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.2	-172.3	-56.6	-84.8	0	0	0	112.7	Y579 C581 L586 R593 L594 H597	Y579-F588 WeakPolarHBondContact CD2-O 3.32Å; Y579-F588 PolarHBondContact N-O 2.88Å; Y579-F588 PolarHBondContact O-N 2.91Å; C581-F588 HydrophobicContact CB-CE2 4.41Å; L586-F588 HydrophobicContact CB-CE2 3.87Å; L586-F588 HydrophobicContact CB-CZ 3.87Å; L586-F588 WeakPolarHBondContact O-CE2 3.18Å; F588-R593 HydrophobicContact CB-CB 4.04Å; F588-R593 HydrophobicContact CD1-CB 3.85Å; F588-R593 HydrophobicContact CG-CB 4.18Å; F588-L594 HydrophobicContact CB-CB 4.37Å; F588-L594 HydrophobicContact CD2-CB 3.76Å; F588-L594 HydrophobicContact CD2-CD1 3.93Å; F588-L594 HydrophobicContact CD2-CG 4.43Å; F588-L594 HydrophobicContact CE2-CB 4.46Å; F588-L594 HydrophobicContact CE2-CD1 3.97Å; F588-L594 HydrophobicContact CG-CB 4.25Å; F588-H597 HydrophobicContact CE1-CB 4.13Å; F588-H597 HydrophobicContact CE2-CB 4.07Å; F588-H597 AromaticContact CE2-CD2 3.4Å; F588-H597 WeakPolarHBondContact CE2-CD2 3.44Å; F588-H597 AromaticContact CE2-CG 3.85Å; F588-H597 HydrophobicContact CZ-CB 3.57Å; F588-H597 AromaticContact CZ-CD2 3.38Å; F588-H597 WeakPolarHBondContact CZ-CD2 3.23Å; F588-H597 AromaticContact CZ-CG 3.38Å
589	H	61	Low	69.9	Low	37 Å²	37	80.9 Å²	80.9	17%	0.171	36%	0.364	C	S	.	.	S	Bend	trans	-82.8	-4	174.7	-51.4	-66.4	0	0	0	114.5	L571 H576 F577	L571-H589 PolarHBondContact O-CE1 3.42Å; L571-H589 PolarHBondContact O-ND1 3.11Å; H576-H589 PolarHBondContact O-ND1 2.9Å; F577-H589 AromaticContact CD1-CD2 3.96Å; F577-H589 AromaticContact CD1-CE1 3.33Å; F577-H589 WeakPolarHBondContact CD1-CE1 3.38Å; F577-H589 AromaticContact CD1-CG 3.84Å; F577-H589 AromaticContact CD1-ND1 3.45Å; F577-H589 WeakPolarHBondContact CD1-ND1 3.02Å; F577-H589 AromaticContact CD1-NE2 3.67Å; F577-H589 AromaticContact CE1-CD2 3.71Å; F577-H589 AromaticContact CE1-CE1 3.16Å; F577-H589 WeakPolarHBondContact CE1-CE1 3.46Å; F577-H589 AromaticContact CE1-ND1 3.76Å; F577-H589 AromaticContact CE1-NE2 3.13Å; F577-H589 WeakPolarHBondContact CE1-NE2 3.19Å; F577-H589 AromaticContact CE2-CE1 3.93Å; F577-H589 AromaticContact CG-CE1 3.8Å; F577-H589 AromaticContact CG-ND1 3.87Å; F577-H589 AromaticContact CZ-CE1 3.47Å; F577-H589 VanDerWaalsContact CZ-CE1 3.47Å; F577-H589 WeakPolarHBondContact CZ-CE1 3.31Å; F577-H589 AromaticContact CZ-NE2 3.58Å
590	R	65.3	Low	69.4	Low	113 Å²	113	82.2 Å²	82.2	43%	0.426	37%	0.373	S	S	.	.	S	Bend	trans	-139.4	141.2	179.7	-76.3	-173.9	175.9	170.2	2.3	110.7	Y579 Y592 R593 L594	Y579-R590 VanDerWaalsContact CD2-C 3.44Å; R590-Y592 VanDerWaalsContact C-N 3.32Å; R590-Y592 PolarHBondContact O-N 3.46Å; R590-R593 HydrophobicContact CB-CB 4.29Å; R590-R593 HydrophobicContact CB-CG 4.24Å; R590-R593 PolarHBondContact O-N 2.91Å; R590-L594 PolarHBondContact O-N 2.88Å
591	P	62	Low	69.2	Low	71 Å²	71	77.9 Å²	77.9	46%	0.461	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-39.5	176.7	5.1	0.4	0	0	0	111.6	Y579 R593 L594 L595	Y579-P591 HydrophobicContact CD1-CB 3.93Å; Y579-P591 HydrophobicContact CD1-CG 4.24Å; Y579-P591 HydrophobicContact CE1-CB 3.84Å; Y579-P591 HydrophobicContact CE1-CG 3.69Å; Y579-P591 VanDerWaalsContact CE2-CD 3.49Å; Y579-P591 HydrophobicContact CE2-CG 4.08Å; Y579-P591 HydrophobicContact CG-CB 4.39Å; P591-R593 PolarHBondContact O-N 3.49Å; P591-L594 WeakPolarHBondContact O-CB 3.25Å; P591-L594 PolarHBondContact O-N 2.86Å; P591-L594 VanDerWaalsContact O-N 3.16Å; P591-L595 PolarHBondContact O-N 3.24Å
592	Y	58.7	Low	68.6	Low	100 Å²	100	80.6 Å²	80.6	39%	0.392	38%	0.376	S	S	.	.	H	α-helix	trans	-55.1	-35.5	172.6	151.3	-95.6	0	0	0	113.3	R590 L595 M596 L618	R590-Y592 VanDerWaalsContact C-N 3.32Å; R590-Y592 PolarHBondContact O-N 3.46Å; Y592-L595 PolarHBondContact O-N 3.2Å; Y592-M596 HydrophobicContact CD2-CE 4.47Å; Y592-M596 HydrophobicContact CD2-CG 3.79Å; Y592-M596 HydrophobicContact CD2-SD 4.43Å; Y592-M596 HydrophobicContact CE1-CG 4.37Å; Y592-M596 HydrophobicContact CE2-CE 4.17Å; Y592-M596 HydrophobicContact CE2-CG 3.31Å; Y592-M596 HydrophobicContact CE2-SD 3.66Å; Y592-M596 HydrophobicContact CG-CG 4.49Å; Y592-M596 WeakPolarHBondContact O-CB 3.4Å; Y592-M596 WeakPolarHBondContact O-CG 3.28Å; Y592-M596 PolarHBondContact O-N 3.28Å; Y592-L618 HydrophobicContact CE2-CD2 4.38Å
593	R	66.9	Low	67.7	Low	147 Å²	147	74.1 Å²	74.1	56%	0.555	36%	0.358	S	S	*	.	H	α-helix	trans	-72.5	-38.8	179.1	-80.6	-66.3	-160.6	173.3	5.7	111.6	F588 R590 P591 H597	F588-R593 HydrophobicContact CB-CB 4.04Å; F588-R593 HydrophobicContact CD1-CB 3.85Å; F588-R593 HydrophobicContact CG-CB 4.18Å; R590-R593 HydrophobicContact CB-CB 4.29Å; R590-R593 HydrophobicContact CB-CG 4.24Å; R590-R593 PolarHBondContact O-N 2.91Å; P591-R593 PolarHBondContact O-N 3.49Å; R593-H597 WeakPolarHBondContact O-CB 3.41Å; R593-H597 PolarHBondContact O-N 3.46Å; R593-H597 VanDerWaalsContact O-N 3.12Å
594	L	70.2	Confident	66.8	Low	36 Å²	36	76.7 Å²	76.7	19%	0.188	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-46.2	170.3	171.4	57.5	0	0	0	111.2	R580 C581 F588 R590 P591 M596 H597 R598	R580-L594 WeakPolarHBondContact O-CD2 3.47Å; C581-L594 VanDerWaalsContact CA-CD1 3.48Å; C581-L594 HydrophobicContact CB-CD1 3.58Å; F588-L594 HydrophobicContact CB-CB 4.37Å; F588-L594 HydrophobicContact CD2-CB 3.76Å; F588-L594 HydrophobicContact CD2-CD1 3.93Å; F588-L594 HydrophobicContact CD2-CG 4.43Å; F588-L594 HydrophobicContact CE2-CB 4.46Å; F588-L594 HydrophobicContact CE2-CD1 3.97Å; F588-L594 HydrophobicContact CG-CB 4.25Å; R590-L594 PolarHBondContact O-N 2.88Å; P591-L594 WeakPolarHBondContact O-CB 3.25Å; P591-L594 PolarHBondContact O-N 2.86Å; P591-L594 VanDerWaalsContact O-N 3.16Å; L594-M596 PolarHBondContact O-N 2.81Å; L594-H597 WeakPolarHBondContact O-CB 3.42Å; L594-H597 PolarHBondContact O-N 3.12Å; L594-R598 PolarHBondContact O-N 3.41Å
595	L	66.4	Low	66.1	Low	84 Å²	84	77 Å²	77	44%	0.44	36%	0.363	S	S	.	.	H	α-helix	trans	-60.7	-45.1	178	-177.8	62.5	0	0	0	112.3	P591 Y592 H597 R598 Y599	P591-L595 PolarHBondContact O-N 3.24Å; Y592-L595 PolarHBondContact O-N 3.2Å; L595-H597 PolarHBondContact O-N 2.85Å; L595-R598 PolarHBondContact O-N 3.38Å; L595-Y599 HydrophobicContact CD1-CE2 4.13Å; L595-Y599 HydrophobicContact CG-CE2 3.95Å; L595-Y599 WeakPolarHBondContact O-CD2 3.33Å
596	M	64.5	Low	65.6	Low	21 Å²	21	79 Å²	79	10%	0.103	37%	0.372	C	S	.	.	H	α-helix	trans	-60.9	-29.5	174.1	-69.2	-72.3	98.1	0	0	113.2	Y592 L594 Y599 L617 L618	Y592-M596 HydrophobicContact CD2-CE 4.47Å; Y592-M596 HydrophobicContact CD2-CG 3.79Å; Y592-M596 HydrophobicContact CD2-SD 4.43Å; Y592-M596 HydrophobicContact CE1-CG 4.37Å; Y592-M596 HydrophobicContact CE2-CE 4.17Å; Y592-M596 HydrophobicContact CE2-CG 3.31Å; Y592-M596 HydrophobicContact CE2-SD 3.66Å; Y592-M596 HydrophobicContact CG-CG 4.49Å; Y592-M596 WeakPolarHBondContact O-CB 3.4Å; Y592-M596 WeakPolarHBondContact O-CG 3.28Å; Y592-M596 PolarHBondContact O-N 3.28Å; L594-M596 PolarHBondContact O-N 2.81Å; M596-Y599 HydrophobicContact CE-CD2 4.11Å; M596-Y599 HydrophobicContact CE-CE2 3.89Å; M596-L617 HydrophobicContact CE-CB 4.49Å; M596-L617 WeakPolarHBondContact CE-O 3.49Å; M596-L617 HydrophobicContact SD-CB 3.93Å; M596-L618 HydrophobicContact CE-CD2 3.83Å; M596-L618 HydrophobicContact CE-CG 4.33Å; M596-L618 HydrophobicContact SD-CD1 4.2Å; M596-L618 HydrophobicContact SD-CD2 3.82Å; M596-L618 HydrophobicContact SD-CG 3.82Å
597	H	71.1	Confident	65.7	Low	30 Å²	30	78.9 Å²	78.9	14%	0.139	37%	0.365	C	S	.	.	H	α-helix	trans	-81.4	-39.4	179.1	165.5	62.5	0	0	0	112.6	C584 F588 R593 L594 L595 Y599 H600 H601	C584-H597 PolarHBondContact SG-NE2 3.48Å; F588-H597 HydrophobicContact CE1-CB 4.13Å; F588-H597 HydrophobicContact CE2-CB 4.07Å; F588-H597 AromaticContact CE2-CD2 3.4Å; F588-H597 WeakPolarHBondContact CE2-CD2 3.44Å; F588-H597 AromaticContact CE2-CG 3.85Å; F588-H597 HydrophobicContact CZ-CB 3.57Å; F588-H597 AromaticContact CZ-CD2 3.38Å; F588-H597 WeakPolarHBondContact CZ-CD2 3.23Å; F588-H597 AromaticContact CZ-CG 3.38Å; R593-H597 WeakPolarHBondContact O-CB 3.41Å; R593-H597 PolarHBondContact O-N 3.46Å; R593-H597 VanDerWaalsContact O-N 3.12Å; L594-H597 WeakPolarHBondContact O-CB 3.42Å; L594-H597 PolarHBondContact O-N 3.12Å; L595-H597 PolarHBondContact O-N 2.85Å; H597-Y599 PolarHBondContact O-N 3.42Å; H597-H600 WeakPolarHBondContact O-CB 3.26Å; H597-H600 PolarHBondContact O-N 2.8Å; H597-H601 AromaticContact CE1-CE1 3.81Å; H597-H601 AromaticContact CE1-NE2 3.33Å; H597-H601 PolarHBondContact CE1-NE2 3.17Å; H597-H601 VanDerWaalsContact CE1-NE2 3.33Å; H597-H601 AromaticContact NE2-CD2 3.98Å; H597-H601 AromaticContact NE2-CE1 3.99Å; H597-H601 AromaticContact NE2-NE2 3.12Å; H597-H601 PolarHBondContact NE2-NE2 3.43Å; H597-H601 VanDerWaalsContact NE2-NE2 3.12Å
598	R	66.8	Low	66.2	Low	122 Å²	122	79.1 Å²	79.1	46%	0.46	37%	0.37	S	S	.	.	H	α-helix	trans	-57.7	-31.4	176.8	176.3	169	145.4	110.1	-6.1	112.8	E583 L594 L595 H600 H601 T602	E583-R598 WeakPolarHBondContact OE1-CD 3.06Å; E583-R598 IonicContact OE1-CZ 3.72Å; E583-R598 IonicContact OE1-NE 3.92Å; E583-R598 IonicContact OE1-NH1 2.79Å; E583-R598 PolarHBondContact OE1-NH1 3.23Å; L594-R598 PolarHBondContact O-N 3.41Å; L595-R598 PolarHBondContact O-N 3.38Å; R598-H600 PolarHBondContact O-N 2.8Å; R598-H600 VanDerWaalsContact O-N 3.15Å; R598-H601 PolarHBondContact O-N 3.47Å; R598-T602 HydrophobicContact CG-CG2 4.19Å; R598-T602 PolarHBondContact O-N 2.91Å; R598-T602 VanDerWaalsContact O-N 3.08Å
599	Y	67.8	Low	66.5	Low	52 Å²	52	78 Å²	78	20%	0.204	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-8.6	171.8	-65	-54.5	0	0	0	115.1	L595 M596 H597 E604 P606 L617	L595-Y599 HydrophobicContact CD1-CE2 4.13Å; L595-Y599 HydrophobicContact CG-CE2 3.95Å; L595-Y599 WeakPolarHBondContact O-CD2 3.33Å; M596-Y599 HydrophobicContact CE-CD2 4.11Å; M596-Y599 HydrophobicContact CE-CE2 3.89Å; H597-Y599 PolarHBondContact O-N 3.42Å; Y599-E604 WeakPolarHBondContact CD1-O 3.15Å; Y599-P606 HydrophobicContact CD1-CG 4.32Å; Y599-P606 HydrophobicContact CE1-CG 3.57Å; Y599-P606 HydrophobicContact CE2-CG 4.17Å; Y599-P606 VanDerWaalsContact CZ-CG 3.49Å; Y599-P606 WeakPolarHBondContact OH-CG 3.25Å; Y599-L617 VanDerWaalsContact CB-CD2 3.43Å; Y599-L617 HydrophobicContact CD2-CD2 3.75Å; Y599-L617 HydrophobicContact CG-CD2 3.98Å
600	H	63.3	Low	67.4	Low	121 Å²	121	87.7 Å²	87.7	56%	0.56	40%	0.402	S	S	*	.	H	α-helix	trans	-82	-25.7	165.9	-76.8	26	0	0	0	112.6	H597 R598	H597-H600 WeakPolarHBondContact O-CB 3.26Å; H597-H600 PolarHBondContact O-N 2.8Å; R598-H600 PolarHBondContact O-N 2.8Å; R598-H600 VanDerWaalsContact O-N 3.15Å
601	H	68.5	Low	67.9	Low	80 Å²	80	87.4 Å²	87.4	37%	0.37	41%	0.405	S	S	.	.	H	α-helix	trans	-84.2	-40.7	176.8	-57.5	-49.6	0	0	0	111.6	C581 E583 C584 H597 R598	C581-H601 PolarHBondContact SG-NE2 2.85Å; C581-H601 VanDerWaalsContact SG-NE2 3.43Å; E583-H601 HydrophobicContact CB-CB 4.35Å; E583-H601 HydrophobicContact CG-CB 4.35Å; E583-H601 IonicContact OE2-CD2 3.63Å; E583-H601 PolarHBondContact OE2-CD2 3.14Å; C584-H601 PolarHBondContact SG-CE1 2.75Å; C584-H601 PolarHBondContact SG-NE2 3.22Å; H597-H601 AromaticContact CE1-CE1 3.81Å; H597-H601 AromaticContact CE1-NE2 3.33Å; H597-H601 PolarHBondContact CE1-NE2 3.17Å; H597-H601 VanDerWaalsContact CE1-NE2 3.33Å; H597-H601 AromaticContact NE2-CD2 3.98Å; H597-H601 AromaticContact NE2-CE1 3.99Å; H597-H601 AromaticContact NE2-NE2 3.12Å; H597-H601 PolarHBondContact NE2-NE2 3.43Å; H597-H601 VanDerWaalsContact NE2-NE2 3.12Å; R598-H601 PolarHBondContact O-N 3.47Å
602	T	66	Low	68.7	Low	58 Å²	58	86 Å²	86	36%	0.356	40%	0.397	S	S	.	.	S	Bend	trans	-80.5	-17.1	-179.2	65.2	0	0	0	0	113.9	R598 E604	R598-T602 HydrophobicContact CG-CG2 4.19Å; R598-T602 PolarHBondContact O-N 2.91Å; R598-T602 VanDerWaalsContact O-N 3.08Å; T602-E604 PolarHBondContact O-N 2.75Å
603	G	59.8	Low	69.4	Low	45 Å²	45	87.2 Å²	87.2	46%	0.464	42%	0.42	S	S	.	.			trans	65	-19.3	-172.2	0	0	0	0	0	115.5	Y605	G603-Y605 WeakPolarHBondContact O-CD2 3.29Å; G603-Y605 WeakPolarHBondContact O-CE2 3.45Å; G603-Y605 PolarHBondContact O-N 3.38Å
604	E	57.7	Low	69.6	Low	136 Å²	136	88.1 Å²	88.1	64%	0.636	42%	0.423	S	S	*	.			trans	-74.1	85.9	-179.1	-64.7	-150	116.3	0	0	113	Y599 T602 P606	Y599-E604 WeakPolarHBondContact CD1-O 3.15Å; T602-E604 PolarHBondContact O-N 2.75Å; E604-P606 WeakPolarHBondContact O-CD 3.49Å
605	Y	65.7	Low	69.8	Low	70 Å²	70	88.2 Å²	88.2	28%	0.275	43%	0.427	S	S	.	.			trans	-73.7	117.1	169.2	-63.5	-80.6	0	0	0	110.7	G603 Y607 L617	G603-Y605 WeakPolarHBondContact O-CD2 3.29Å; G603-Y605 WeakPolarHBondContact O-CE2 3.45Å; G603-Y605 PolarHBondContact O-N 3.38Å; Y605-Y607 PolarHBondContact O-N 2.83Å; Y605-L617 HydrophobicContact CD1-CD2 3.6Å; Y605-L617 HydrophobicContact CD1-CG 3.71Å; Y605-L617 HydrophobicContact CE1-CD2 3.55Å; Y605-L617 HydrophobicContact CE1-CG 3.68Å
606	P	66.6	Low	70	Confident	64 Å²	64	86 Å²	86	42%	0.416	41%	0.414	S	S	.	.	S	Bend	trans	-66	-15.6	-169.1	-24.2	34.2	0	0	0	116.1	Y599 E604	Y599-P606 HydrophobicContact CD1-CG 4.32Å; Y599-P606 HydrophobicContact CE1-CG 3.57Å; Y599-P606 HydrophobicContact CE2-CG 4.17Å; Y599-P606 VanDerWaalsContact CZ-CG 3.49Å; Y599-P606 WeakPolarHBondContact OH-CG 3.25Å; E604-P606 WeakPolarHBondContact O-CD 3.49Å
607	Y	73.4	Confident	69.9	Low	93 Å²	93	87 Å²	87	37%	0.365	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	80.8	-174.7	-55.6	-72	0	0	0	110.2	Y605 S615 F616 R619	Y605-Y607 PolarHBondContact O-N 2.83Å; Y607-S615 WeakPolarHBondContact O-CA 3.32Å; Y607-F616 WeakPolarHBondContact CB-O 3.38Å; Y607-F616 WeakPolarHBondContact CD2-O 3.25Å; Y607-F616 PolarHBondContact N-O 3.22Å; Y607-F616 PolarHBondContact O-N 3.19Å; Y607-R619 HydrophobicContact CD1-CB 3.83Å; Y607-R619 HydrophobicContact CD1-CG 4.29Å; Y607-R619 HydrophobicContact CD2-CB 4.41Å; Y607-R619 HydrophobicContact CE1-CB 3.72Å; Y607-R619 HydrophobicContact CE1-CG 4.32Å; Y607-R619 HydrophobicContact CE2-CB 4.28Å; Y607-R619 VanDerWaalsContact CE2-N 3.34Å; Y607-R619 HydrophobicContact CG-CB 4.18Å
608	K	76.4	Confident	69.4	Low	143 Å²	143	88.4 Å²	88.4	62%	0.622	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.4	174	-48.2	-165.6	178.4	179	0	110.1	S615 L622	K608-S615 WeakPolarHBondContact CG-OG 3.11Å; K608-L622 WeakPolarHBondContact O-CD2 3.23Å
609	C	79.3	Confident	69.6	Low	14 Å²	14	90.1 Å²	90.1	10%	0.095	43%	0.434	C	S	.	.			trans	-74.3	149	169.9	-172.6	0	0	0	0	110.2	E611 C612 R614 F616 L622	C609-E611 PolarHBondContact SG-N 3.28Å; C609-E611 VanDerWaalsContact SG-N 3.44Å; C609-C612 WeakPolarHBondContact CB-O 3.47Å; C609-R614 VanDerWaalsContact CB-O 3.31Å; C609-R614 WeakPolarHBondContact CB-O 3.35Å; C609-R614 PolarHBondContact N-O 3.08Å; C609-F616 HydrophobicContact CB-CE2 4.49Å; C609-L622 HydrophobicContact CB-CD1 3.51Å
610	R	78.6	Confident	69.2	Low	242 Å²	242	96.8 Å²	96.8	91%	0.913	46%	0.459	S	S	*	.	S	Bend	trans	-89	-17.5	177	-67.4	-177.7	174.4	-175.7	-4.8	112.9
611	E	76	Confident	69.1	Low	106 Å²	106	95 Å²	95	50%	0.495	45%	0.453	S	S	.	.	S	Bend	trans	-109.2	-9.9	-171.3	-62.8	147.4	-89.3	0	0	112.4	C609 Q626 H630	C609-E611 PolarHBondContact SG-N 3.28Å; C609-E611 VanDerWaalsContact SG-N 3.44Å; E611-Q626 PolarHBondContact OE1-NE2 3.14Å; E611-H630 VanDerWaalsContact C-CE1 3.48Å; E611-H630 VanDerWaalsContact CB-CE1 3.44Å; E611-H630 WeakPolarHBondContact CB-CE1 3.35Å; E611-H630 WeakPolarHBondContact CB-ND1 3.44Å; E611-H630 PolarHBondContact O-CE1 3.34Å; E611-H630 WeakPolarHBondContact OE2-CB 3.41Å; E611-H630 IonicContact OE2-CG 3.04Å
612	C	79.4	Confident	69.3	Low	42 Å²	42	92.1 Å²	92.1	28%	0.284	44%	0.44	S	S	.	.	S	Bend	trans	-156.9	164.3	160.9	70.9	0	0	0	0	110.8	C609 R614 H625 H630	C609-C612 WeakPolarHBondContact CB-O 3.47Å; C612-R614 PolarHBondContact O-N 2.97Å; C612-H625 PolarHBondContact SG-NE2 2.84Å; C612-H630 PolarHBondContact SG-NE2 3.36Å; C612-H630 VanDerWaalsContact SG-NE2 3.43Å
613	S	72.8	Confident	69.6	Low	126 Å²	126	92.8 Å²	92.8	88%	0.881	44%	0.439	S	S	*	.	S	Bend	trans	-67.6	7.5	-175.7	-36.4	0	0	0	0	115.7
614	R	71.4	Confident	69.8	Low	165 Å²	165	93.2 Å²	93.2	62%	0.623	43%	0.433	S	S	*	.			trans	-73.1	136.5	176.9	-80.6	-168.6	159.3	86	4.4	111.5	C609 C612 F616	C609-R614 VanDerWaalsContact CB-O 3.31Å; C609-R614 WeakPolarHBondContact CB-O 3.35Å; C609-R614 PolarHBondContact N-O 3.08Å; C612-R614 PolarHBondContact O-N 2.97Å; R614-F616 HydrophobicContact CB-CE2 3.69Å; R614-F616 HydrophobicContact CB-CZ 3.81Å
615	S	73.6	Confident	70.6	Confident	39 Å²	39	87.5 Å²	87.5	27%	0.273	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	146	-179.3	-53.2	0	0	0	0	110.9	Y607 K608	Y607-S615 WeakPolarHBondContact O-CA 3.32Å; K608-S615 WeakPolarHBondContact CG-OG 3.11Å
616	F	72	Confident	71	Confident	38 Å²	38	86.8 Å²	86.8	17%	0.167	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.8	-165.3	-61.8	-91.2	0	0	0	113.6	Y607 C609 R614 L618 L621 L622 H625	Y607-F616 WeakPolarHBondContact CB-O 3.38Å; Y607-F616 WeakPolarHBondContact CD2-O 3.25Å; Y607-F616 PolarHBondContact N-O 3.22Å; Y607-F616 PolarHBondContact O-N 3.19Å; C609-F616 HydrophobicContact CB-CE2 4.49Å; R614-F616 HydrophobicContact CB-CE2 3.69Å; R614-F616 HydrophobicContact CB-CZ 3.81Å; F616-L618 VanDerWaalsContact C-N 3.25Å; F616-L618 PolarHBondContact O-N 3.17Å; F616-L621 HydrophobicContact CB-CB 4.18Å; F616-L621 HydrophobicContact CD1-CB 3.94Å; F616-L621 HydrophobicContact CG-CB 4.35Å; F616-L622 HydrophobicContact CB-CB 4.23Å; F616-L622 HydrophobicContact CD2-CB 3.91Å; F616-L622 HydrophobicContact CD2-CD1 3.97Å; F616-L622 HydrophobicContact CE2-CD1 4.16Å; F616-L622 HydrophobicContact CG-CB 4.23Å; F616-H625 HydrophobicContact CE1-CB 3.94Å; F616-H625 HydrophobicContact CE2-CB 4.01Å; F616-H625 AromaticContact CE2-CD2 3.17Å; F616-H625 WeakPolarHBondContact CE2-CD2 3.4Å; F616-H625 AromaticContact CE2-CG 3.7Å; F616-H625 AromaticContact CE2-NE2 3.86Å; F616-H625 HydrophobicContact CZ-CB 3.52Å; F616-H625 AromaticContact CZ-CD2 3.24Å; F616-H625 WeakPolarHBondContact CZ-CD2 3.41Å; F616-H625 AromaticContact CZ-CG 3.28Å; F616-H625 AromaticContact CZ-ND1 3.95Å; F616-H625 AromaticContact CZ-NE2 3.85Å
617	L	61.4	Low	71.3	Confident	40 Å²	40	87.5 Å²	87.5	21%	0.209	41%	0.405	C	S	.	.	S	Bend	trans	-63.3	-27	176.4	-71.4	170.5	0	0	0	114.1	M596 Y599 Y605	M596-L617 HydrophobicContact CE-CB 4.49Å; M596-L617 WeakPolarHBondContact CE-O 3.49Å; M596-L617 HydrophobicContact SD-CB 3.93Å; Y599-L617 VanDerWaalsContact CB-CD2 3.43Å; Y599-L617 HydrophobicContact CD2-CD2 3.75Å; Y599-L617 HydrophobicContact CG-CD2 3.98Å; Y605-L617 HydrophobicContact CD1-CD2 3.6Å; Y605-L617 HydrophobicContact CD1-CG 3.71Å; Y605-L617 HydrophobicContact CE1-CD2 3.55Å; Y605-L617 HydrophobicContact CE1-CG 3.68Å
618	L	61.4	Low	70.9	Confident	60 Å²	60	84.4 Å²	84.4	31%	0.314	40%	0.396	S	S	.	.	S	Bend	trans	-141.8	136.2	-170.9	-69.2	172	0	0	0	110.3	Y592 M596 F616 R620 L621 L622	Y592-L618 HydrophobicContact CE2-CD2 4.38Å; M596-L618 HydrophobicContact CE-CD2 3.83Å; M596-L618 HydrophobicContact CE-CG 4.33Å; M596-L618 HydrophobicContact SD-CD1 4.2Å; M596-L618 HydrophobicContact SD-CD2 3.82Å; M596-L618 HydrophobicContact SD-CG 3.82Å; F616-L618 VanDerWaalsContact C-N 3.25Å; F616-L618 PolarHBondContact O-N 3.17Å; L618-R620 PolarHBondContact O-N 2.82Å; L618-R620 VanDerWaalsContact O-N 3.16Å; L618-L621 HydrophobicContact CB-CD1 4.12Å; L618-L621 HydrophobicContact CB-CG 4.12Å; L618-L621 HydrophobicContact CD1-CD1 4.32Å; L618-L621 WeakPolarHBondContact O-CA 3.46Å; L618-L621 WeakPolarHBondContact O-CB 3.41Å; L618-L621 PolarHBondContact O-N 3.31Å; L618-L622 PolarHBondContact O-N 3.42Å
619	R	70.1	Confident	70.4	Confident	159 Å²	159	81.7 Å²	81.7	60%	0.6	39%	0.391	S	S	*	.	H	α-helix	trans	-50.1	-42.1	176.5	-173.5	177.1	156.9	144.6	4.6	112.8	Y607 L621 L622 E623	Y607-R619 HydrophobicContact CD1-CB 3.83Å; Y607-R619 HydrophobicContact CD1-CG 4.29Å; Y607-R619 HydrophobicContact CD2-CB 4.41Å; Y607-R619 HydrophobicContact CE1-CB 3.72Å; Y607-R619 HydrophobicContact CE1-CG 4.32Å; Y607-R619 HydrophobicContact CE2-CB 4.28Å; Y607-R619 VanDerWaalsContact CE2-N 3.34Å; Y607-R619 HydrophobicContact CG-CB 4.18Å; R619-L621 VanDerWaalsContact C-N 3.29Å; R619-L621 PolarHBondContact O-N 3.13Å; R619-L622 WeakPolarHBondContact O-CB 3.31Å; R619-L622 PolarHBondContact O-N 3.38Å; R619-E623 HydrophobicContact CG-CG 4.3Å; R619-E623 IonicContact CZ-OE1 3.86Å; R619-E623 IonicContact NE-OE1 2.7Å; R619-E623 PolarHBondContact NE-OE1 3.35Å; R619-E623 IonicContact NH2-OE1 3.62Å; R619-E623 PolarHBondContact NH2-OE1 2.8Å; R619-E623 WeakPolarHBondContact O-CG 3.44Å; R619-E623 PolarHBondContact O-N 3.05Å
620	R	60	Low	70.2	Confident	192 Å²	192	84 Å²	84	73%	0.725	40%	0.401	S	S	*	.	H	α-helix	trans	-59.6	-34.1	175.3	179.9	178	-71	-169.4	-2.5	113.7	L618 E623 V624	L618-R620 PolarHBondContact O-N 2.82Å; L618-R620 VanDerWaalsContact O-N 3.16Å; R620-E623 WeakPolarHBondContact CA-OE2 3.48Å; R620-V624 HydrophobicContact CG-CG2 4.42Å; R620-V624 WeakPolarHBondContact O-CB 3.35Å; R620-V624 VanDerWaalsContact O-CG2 3.28Å; R620-V624 WeakPolarHBondContact O-CG2 3.49Å; R620-V624 PolarHBondContact O-N 2.92Å
621	L	61.5	Low	69.9	Low	84 Å²	84	75.3 Å²	75.3	44%	0.44	38%	0.38	S	S	.	.	H	α-helix	trans	-74.2	-35.8	178.5	-64.9	174.8	0	0	0	111.1	F616 L618 R619 H625	F616-L621 HydrophobicContact CB-CB 4.18Å; F616-L621 HydrophobicContact CD1-CB 3.94Å; F616-L621 HydrophobicContact CG-CB 4.35Å; L618-L621 HydrophobicContact CB-CD1 4.12Å; L618-L621 HydrophobicContact CB-CG 4.12Å; L618-L621 HydrophobicContact CD1-CD1 4.32Å; L618-L621 WeakPolarHBondContact O-CA 3.46Å; L618-L621 WeakPolarHBondContact O-CB 3.41Å; L618-L621 PolarHBondContact O-N 3.31Å; R619-L621 VanDerWaalsContact C-N 3.29Å; R619-L621 PolarHBondContact O-N 3.13Å; L621-H625 VanDerWaalsContact O-CB 3.23Å; L621-H625 WeakPolarHBondContact O-CB 3.24Å; L621-H625 PolarHBondContact O-N 3.27Å
622	L	72.8	Confident	69.2	Low	18 Å²	18	72.5 Å²	72.5	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-63.4	-48.8	168.3	170.8	60.2	0	0	0	111.3	K608 C609 F616 L618 R619 V624 H625 Q626	K608-L622 WeakPolarHBondContact O-CD2 3.23Å; C609-L622 HydrophobicContact CB-CD1 3.51Å; F616-L622 HydrophobicContact CB-CB 4.23Å; F616-L622 HydrophobicContact CD2-CB 3.91Å; F616-L622 HydrophobicContact CD2-CD1 3.97Å; F616-L622 HydrophobicContact CE2-CD1 4.16Å; F616-L622 HydrophobicContact CG-CB 4.23Å; L618-L622 PolarHBondContact O-N 3.42Å; R619-L622 WeakPolarHBondContact O-CB 3.31Å; R619-L622 PolarHBondContact O-N 3.38Å; L622-V624 PolarHBondContact O-N 3.13Å; L622-H625 CarbonylContact O-C 3.58Å; L622-H625 WeakPolarHBondContact O-CA 3.35Å; L622-H625 WeakPolarHBondContact O-CB 3.17Å; L622-H625 PolarHBondContact O-N 3.15Å; L622-H625 VanDerWaalsContact O-N 3.08Å; L622-Q626 HydrophobicContact CD1-CG 3.87Å; L622-Q626 WeakPolarHBondContact O-CG 3.45Å; L622-Q626 PolarHBondContact O-N 3.39Å
623	E	70.9	Confident	68.4	Low	72 Å²	72	79.3 Å²	79.3	34%	0.336	40%	0.4	S	S	.	.	H	α-helix	trans	-58.7	-44.2	178.8	-71.5	164.5	162.2	0	0	111.6	R619 R620 L627	R619-E623 HydrophobicContact CG-CG 4.3Å; R619-E623 IonicContact CZ-OE1 3.86Å; R619-E623 IonicContact NE-OE1 2.7Å; R619-E623 PolarHBondContact NE-OE1 3.35Å; R619-E623 IonicContact NH2-OE1 3.62Å; R619-E623 PolarHBondContact NH2-OE1 2.8Å; R619-E623 WeakPolarHBondContact O-CG 3.44Å; R619-E623 PolarHBondContact O-N 3.05Å; R620-E623 WeakPolarHBondContact CA-OE2 3.48Å; E623-L627 WeakPolarHBondContact O-CB 3.48Å; E623-L627 WeakPolarHBondContact O-CD1 3.42Å; E623-L627 VanDerWaalsContact O-CG 3.27Å; E623-L627 WeakPolarHBondContact O-CG 3.48Å; E623-L627 PolarHBondContact O-N 3.2Å
624	V	65.6	Low	68.1	Low	55 Å²	55	75.9 Å²	75.9	33%	0.333	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-40.2	173.6	169.5	0	0	0	0	111.5	R620 L622 L627 V628	R620-V624 HydrophobicContact CG-CG2 4.42Å; R620-V624 WeakPolarHBondContact O-CB 3.35Å; R620-V624 VanDerWaalsContact O-CG2 3.28Å; R620-V624 WeakPolarHBondContact O-CG2 3.49Å; R620-V624 PolarHBondContact O-N 2.92Å; L622-V624 PolarHBondContact O-N 3.13Å; V624-L627 PolarHBondContact O-N 3.17Å; V624-V628 HydrophobicContact CG1-CG2 4.1Å; V624-V628 WeakPolarHBondContact O-CB 3.3Å; V624-V628 WeakPolarHBondContact O-CG2 3.23Å; V624-V628 PolarHBondContact O-N 2.79Å
625	H	73.3	Confident	67.8	Low	16 Å²	16	71.4 Å²	71.4	7%	0.074	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-45	176.3	164.3	56.3	0	0	0	112.4	C612 F616 L621 L622 V628 V629 H630	C612-H625 PolarHBondContact SG-NE2 2.84Å; F616-H625 HydrophobicContact CE1-CB 3.94Å; F616-H625 HydrophobicContact CE2-CB 4.01Å; F616-H625 AromaticContact CE2-CD2 3.17Å; F616-H625 WeakPolarHBondContact CE2-CD2 3.4Å; F616-H625 AromaticContact CE2-CG 3.7Å; F616-H625 AromaticContact CE2-NE2 3.86Å; F616-H625 HydrophobicContact CZ-CB 3.52Å; F616-H625 AromaticContact CZ-CD2 3.24Å; F616-H625 WeakPolarHBondContact CZ-CD2 3.41Å; F616-H625 AromaticContact CZ-CG 3.28Å; F616-H625 AromaticContact CZ-ND1 3.95Å; F616-H625 AromaticContact CZ-NE2 3.85Å; L621-H625 VanDerWaalsContact O-CB 3.23Å; L621-H625 WeakPolarHBondContact O-CB 3.24Å; L621-H625 PolarHBondContact O-N 3.27Å; L622-H625 CarbonylContact O-C 3.58Å; L622-H625 WeakPolarHBondContact O-CA 3.35Å; L622-H625 WeakPolarHBondContact O-CB 3.17Å; L622-H625 PolarHBondContact O-N 3.15Å; L622-H625 VanDerWaalsContact O-N 3.08Å; H625-V628 PolarHBondContact O-N 3.16Å; H625-V629 VanDerWaalsContact ND1-CG2 3.32Å; H625-V629 WeakPolarHBondContact ND1-CG2 3.32Å; H625-V629 VanDerWaalsContact O-CB 3.3Å; H625-V629 WeakPolarHBondContact O-CB 3.48Å; H625-V629 PolarHBondContact O-N 3.05Å; H625-H630 AromaticContact CE1-CD2 4Å; H625-H630 AromaticContact CE1-NE2 3.64Å; H625-H630 AromaticContact NE2-CD2 3.9Å; H625-H630 AromaticContact NE2-NE2 3.47Å; H625-H630 PolarHBondContact NE2-NE2 3.12Å
626	Q	73.7	Confident	67.6	Low	55 Å²	55	72.8 Å²	72.8	26%	0.257	36%	0.364	S	S	.	.	I	π-helix	trans	-63.1	-45.7	176.6	-71.3	179.1	-73.6	0	0	111.5	E611 L622 V628 H630 A631	E611-Q626 PolarHBondContact OE1-NE2 3.14Å; L622-Q626 HydrophobicContact CD1-CG 3.87Å; L622-Q626 WeakPolarHBondContact O-CG 3.45Å; L622-Q626 PolarHBondContact O-N 3.39Å; Q626-V628 VanDerWaalsContact C-N 3.34Å; Q626-V628 PolarHBondContact O-N 2.81Å; Q626-H630 PolarHBondContact O-N 2.85Å; Q626-A631 PolarHBondContact O-N 3.43Å
627	L	73.3	Confident	67.7	Low	79 Å²	79	76.5 Å²	76.5	41%	0.414	38%	0.382	S	S	.	.	I	π-helix	trans	-58.5	-44.4	175.3	-73.6	167.3	0	0	0	112.6	E623 V624 A631 G632 R633	E623-L627 WeakPolarHBondContact O-CB 3.48Å; E623-L627 WeakPolarHBondContact O-CD1 3.42Å; E623-L627 VanDerWaalsContact O-CG 3.27Å; E623-L627 WeakPolarHBondContact O-CG 3.48Å; E623-L627 PolarHBondContact O-N 3.2Å; V624-L627 PolarHBondContact O-N 3.17Å; L627-A631 CarbonylContact O-C 3.33Å; L627-G632 CarbonylContact O-C 3.48Å; L627-G632 PolarHBondContact O-N 3.27Å; L627-R633 CarbonylContact C-O 3.45Å; L627-R633 PolarHBondContact O-N 3.19Å
628	V	66.6	Low	68.3	Low	28 Å²	28	74.7 Å²	74.7	17%	0.17	37%	0.372	C	S	.	.	I	π-helix	trans	-84.8	-40.2	-170.4	165.2	0	0	0	0	114	V624 H625 Q626 Q634 P646	V624-V628 HydrophobicContact CG1-CG2 4.1Å; V624-V628 WeakPolarHBondContact O-CB 3.3Å; V624-V628 WeakPolarHBondContact O-CG2 3.23Å; V624-V628 PolarHBondContact O-N 2.79Å; H625-V628 PolarHBondContact O-N 3.16Å; Q626-V628 VanDerWaalsContact C-N 3.34Å; Q626-V628 PolarHBondContact O-N 2.81Å; V628-Q634 PolarHBondContact O-NE2 2.86Å; V628-P646 HydrophobicContact CB-CB 4.13Å; V628-P646 HydrophobicContact CG1-CB 3.52Å; V628-P646 HydrophobicContact CG2-CB 3.43Å; V628-P646 VanDerWaalsContact CG2-CB 3.43Å
629	V	64.8	Low	68.5	Low	86 Å²	86	77.2 Å²	77.2	52%	0.521	39%	0.392	S	S	.	.	I	π-helix	trans	-99.4	-35.7	-170.3	-178.7	0	0	0	0	112	H625	H625-V629 VanDerWaalsContact ND1-CG2 3.32Å; H625-V629 WeakPolarHBondContact ND1-CG2 3.32Å; H625-V629 VanDerWaalsContact O-CB 3.3Å; H625-V629 WeakPolarHBondContact O-CB 3.48Å; H625-V629 PolarHBondContact O-N 3.05Å
630	H	75.7	Confident	68.3	Low	63 Å²	63	73.6 Å²	73.6	29%	0.292	39%	0.391	S	S	.	.	I	π-helix	trans	-100.8	-49.6	-176.8	-64.2	-72	0	0	0	112	E611 C612 H625 Q626 G632	E611-H630 VanDerWaalsContact C-CE1 3.48Å; E611-H630 VanDerWaalsContact CB-CE1 3.44Å; E611-H630 WeakPolarHBondContact CB-CE1 3.35Å; E611-H630 WeakPolarHBondContact CB-ND1 3.44Å; E611-H630 PolarHBondContact O-CE1 3.34Å; E611-H630 WeakPolarHBondContact OE2-CB 3.41Å; E611-H630 IonicContact OE2-CG 3.04Å; C612-H630 PolarHBondContact SG-NE2 3.36Å; C612-H630 VanDerWaalsContact SG-NE2 3.43Å; H625-H630 AromaticContact CE1-CD2 4Å; H625-H630 AromaticContact CE1-NE2 3.64Å; H625-H630 AromaticContact NE2-CD2 3.9Å; H625-H630 AromaticContact NE2-NE2 3.47Å; H625-H630 PolarHBondContact NE2-NE2 3.12Å; Q626-H630 PolarHBondContact O-N 2.85Å; H630-G632 VanDerWaalsContact C-N 3.31Å; H630-G632 PolarHBondContact O-N 2.88Å
631	A	71.1	Confident	68.9	Low	58 Å²	58	68 Å²	68	48%	0.479	38%	0.38	S	S	.	.	S	Bend	trans	-81.9	-5.2	176.3	0	0	0	0	0	114.1	Q626 L627 R633	Q626-A631 PolarHBondContact O-N 3.43Å; L627-A631 CarbonylContact O-C 3.33Å; A631-R633 HydrophobicContact CB-CG 4.39Å; A631-R633 WeakPolarHBondContact O-CG 3.27Å; A631-R633 PolarHBondContact O-N 3.43Å
632	G	62	Low	69.3	Low	48 Å²	48	66.6 Å²	66.6	50%	0.495	39%	0.386	S	S	.	.			trans	64.1	-1.8	-179.4	0	0	0	0	0	116.3	L627 H630 Q634	L627-G632 CarbonylContact O-C 3.48Å; L627-G632 PolarHBondContact O-N 3.27Å; H630-G632 VanDerWaalsContact C-N 3.31Å; H630-G632 PolarHBondContact O-N 2.88Å; G632-Q634 PolarHBondContact O-N 3.35Å; G632-Q634 PolarHBondContact O-NE2 3.32Å
633	R	62.3	Low	69.3	Low	185 Å²	185	67.5 Å²	67.5	70%	0.698	40%	0.397	S	S	*	.			trans	-76.5	118.7	-172.9	-63	-167.8	-179.1	-154.2	-1.9	110.7	L627 A631 P635	L627-R633 CarbonylContact C-O 3.45Å; L627-R633 PolarHBondContact O-N 3.19Å; A631-R633 HydrophobicContact CB-CG 4.39Å; A631-R633 WeakPolarHBondContact O-CG 3.27Å; A631-R633 PolarHBondContact O-N 3.43Å; R633-P635 WeakPolarHBondContact O-CD 3.28Å
634	Q	67.9	Low	69.2	Low	54 Å²	54	66.1 Å²	66.1	25%	0.252	40%	0.397	S	S	.	.			trans	-98.9	94.1	177.5	-57.1	-55.3	-39.2	0	0	109.6	V628 G632 H636 H637 A644 F645	V628-Q634 PolarHBondContact O-NE2 2.86Å; G632-Q634 PolarHBondContact O-N 3.35Å; G632-Q634 PolarHBondContact O-NE2 3.32Å; Q634-H636 PolarHBondContact O-N 3.47Å; Q634-H636 VanDerWaalsContact O-N 3.1Å; Q634-H637 PolarHBondContact O-CE1 3.26Å; Q634-A644 HydrophobicContact CB-CB 3.52Å; Q634-A644 HydrophobicContact CG-CB 4.22Å; Q634-F645 CarbonylContact C-O 3.55Å
635	P	63.3	Low	69.3	Low	70 Å²	70	65.3 Å²	65.3	46%	0.455	39%	0.389	S	S	.	.			trans	-71	-10.1	-166.3	27.5	-36	0	0	0	115	R633	R633-P635 WeakPolarHBondContact O-CD 3.28Å
636	H	70.4	Confident	68.7	Low	69 Å²	69	66.5 Å²	66.5	32%	0.319	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	90.9	-172	-68.3	-64.3	0	0	0	112.4	Q634 F645 S647 S648 L651	Q634-H636 PolarHBondContact O-N 3.47Å; Q634-H636 VanDerWaalsContact O-N 3.1Å; H636-F645 HydrophobicContact CB-CB 4.39Å; H636-F645 WeakPolarHBondContact CB-O 3.31Å; H636-F645 PolarHBondContact N-O 3.33Å; H636-F645 VanDerWaalsContact N-O 3.13Å; H636-F645 WeakPolarHBondContact O-CB 3.32Å; H636-F645 PolarHBondContact O-N 2.87Å; H636-S647 VanDerWaalsContact CD2-CA 3.48Å; H636-S647 WeakPolarHBondContact CD2-CA 3.48Å; H636-S648 PolarHBondContact CD2-N 3.28Å; H636-S648 PolarHBondContact NE2-N 3.31Å; H636-L651 HydrophobicContact CB-CB 4.12Å; H636-L651 HydrophobicContact CB-CD2 3.78Å
637	H	74.6	Confident	68.3	Low	116 Å²	116	65.8 Å²	65.8	54%	0.537	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	150.9	-179.9	-60.3	86.7	0	0	0	113.3	Q634 P639 A644 L651	Q634-H637 PolarHBondContact O-CE1 3.26Å; H637-P639 WeakPolarHBondContact O-CD 3.41Å; H637-A644 VanDerWaalsContact CD2-CB 3.42Å; H637-A644 WeakPolarHBondContact CD2-CB 3.23Å; H637-L651 WeakPolarHBondContact O-CD1 3.47Å; H637-L651 VanDerWaalsContact O-CD2 3.31Å; H637-L651 WeakPolarHBondContact O-CD2 3.27Å
638	C	73.4	Confident	67.7	Low	1 Å²	1	65.7 Å²	65.7	1%	0.007	41%	0.406	C	S	.	.			trans	-98.5	110.7	175.7	-164.4	0	0	0	0	111.6	S640 C641 G642 A643 F645 L651 H654	C638-S640 PolarHBondContact O-N 3.47Å; C638-S640 PolarHBondContact SG-OG 3.21Å; C638-C641 VanDerWaalsContact CB-SG 3.53Å; C638-C641 PolarHBondContact O-N 3.46Å; C638-G642 WeakPolarHBondContact O-CA 3.31Å; C638-G642 PolarHBondContact O-N 2.92Å; C638-A643 HydrophobicContact CB-CB 4.48Å; C638-A643 VanDerWaalsContact CB-O 3.31Å; C638-A643 WeakPolarHBondContact CB-O 3.5Å; C638-A643 PolarHBondContact N-O 3.01Å; C638-F645 HydrophobicContact CB-CE2 4.12Å; C638-L651 HydrophobicContact CB-CD1 3.62Å; C638-H654 VanDerWaalsContact SG-CD2 3.5Å
639	P	64.6	Low	67.1	Low	113 Å²	113	69.3 Å²	69.3	73%	0.734	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.5	-175.1	-26	34.6	0	0	0	114.8	H637	H637-P639 WeakPolarHBondContact O-CD 3.41Å
640	S	65.9	Low	67.1	Low	84 Å²	84	71.8 Å²	71.8	59%	0.587	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-3.6	-176.3	55.4	0	0	0	0	114.8	C638	C638-S640 PolarHBondContact O-N 3.47Å; C638-S640 PolarHBondContact SG-OG 3.21Å
641	C	73.2	Confident	66.7	Low	73 Å²	73	69.4 Å²	69.4	49%	0.493	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	6.5	-177.6	61.8	0	0	0	0	115.2	C638 A643 H654	C638-C641 VanDerWaalsContact CB-SG 3.53Å; C638-C641 PolarHBondContact O-N 3.46Å; C641-A643 PolarHBondContact O-N 3.14Å; C641-H654 PolarHBondContact SG-NE2 2.92Å
642	G	69.8	Low	66.2	Low	55 Å²	55	72.3 Å²	72.3	57%	0.567	41%	0.412	S	S	*	.			trans	72.3	-26.3	-178	0	0	0	0	0	115.6	C638 A644	C638-G642 WeakPolarHBondContact O-CA 3.31Å; C638-G642 PolarHBondContact O-N 2.92Å; G642-A644 PolarHBondContact O-N 3.43Å
643	A	72.6	Confident	66.2	Low	37 Å²	37	72.9 Å²	72.9	31%	0.306	40%	0.402	S	S	.	.			trans	-49	128.5	-173.3	0	0	0	0	0	113	C638 C641 F645	C638-A643 HydrophobicContact CB-CB 4.48Å; C638-A643 VanDerWaalsContact CB-O 3.31Å; C638-A643 WeakPolarHBondContact CB-O 3.5Å; C638-A643 PolarHBondContact N-O 3.01Å; C641-A643 PolarHBondContact O-N 3.14Å; A643-F645 HydrophobicContact CB-CE2 3.67Å; A643-F645 HydrophobicContact CB-CZ 3.9Å; A643-F645 VanDerWaalsContact O-CD2 3.32Å; A643-F645 WeakPolarHBondContact O-CD2 3.39Å; A643-F645 VanDerWaalsContact O-CE2 3.23Å; A643-F645 WeakPolarHBondContact O-CE2 3.37Å
644	A	69	Low	66.7	Low	43 Å²	43	66.6 Å²	66.6	36%	0.355	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.3	-171.2	0	0	0	0	0	111.2	Q634 H637 G642	Q634-A644 HydrophobicContact CB-CB 3.52Å; Q634-A644 HydrophobicContact CG-CB 4.22Å; H637-A644 VanDerWaalsContact CD2-CB 3.42Å; H637-A644 WeakPolarHBondContact CD2-CB 3.23Å; G642-A644 PolarHBondContact O-N 3.43Å
645	F	69.1	Low	66.8	Low	38 Å²	38	69.5 Å²	69.5	17%	0.167	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.6	-170.9	-65.4	-84.3	0	0	0	113.6	Q634 H636 C638 A643 S647 R650 L651 H654	Q634-F645 CarbonylContact C-O 3.55Å; H636-F645 HydrophobicContact CB-CB 4.39Å; H636-F645 WeakPolarHBondContact CB-O 3.31Å; H636-F645 PolarHBondContact N-O 3.33Å; H636-F645 VanDerWaalsContact N-O 3.13Å; H636-F645 WeakPolarHBondContact O-CB 3.32Å; H636-F645 PolarHBondContact O-N 2.87Å; C638-F645 HydrophobicContact CB-CE2 4.12Å; A643-F645 HydrophobicContact CB-CE2 3.67Å; A643-F645 HydrophobicContact CB-CZ 3.9Å; A643-F645 VanDerWaalsContact O-CD2 3.32Å; A643-F645 WeakPolarHBondContact O-CD2 3.39Å; A643-F645 VanDerWaalsContact O-CE2 3.23Å; A643-F645 WeakPolarHBondContact O-CE2 3.37Å; F645-S647 VanDerWaalsContact C-N 3.32Å; F645-S647 PolarHBondContact O-N 3.21Å; F645-R650 HydrophobicContact CB-CB 4.19Å; F645-R650 HydrophobicContact CD1-CB 4.02Å; F645-R650 HydrophobicContact CG-CB 4.45Å; F645-L651 HydrophobicContact CB-CB 4.08Å; F645-L651 HydrophobicContact CD2-CB 4.14Å; F645-L651 HydrophobicContact CD2-CD1 3.77Å; F645-L651 HydrophobicContact CE2-CD1 4.19Å; F645-L651 HydrophobicContact CG-CB 4.26Å; F645-H654 HydrophobicContact CE1-CB 3.79Å; F645-H654 HydrophobicContact CE2-CB 3.94Å; F645-H654 AromaticContact CE2-CD2 3.54Å; F645-H654 AromaticContact CE2-CG 3.64Å; F645-H654 HydrophobicContact CZ-CB 3.46Å; F645-H654 VanDerWaalsContact CZ-CB 3.46Å; F645-H654 AromaticContact CZ-CD2 3.57Å; F645-H654 AromaticContact CZ-CG 3.2Å; F645-H654 AromaticContact CZ-ND1 3.56Å
646	P	59.9	Low	66.5	Low	41 Å²	41	66.9 Å²	66.9	27%	0.266	37%	0.373	S	S	.	.	S	Bend	trans	-77.7	-16.4	-176.5	30.1	-37.4	0	0	0	113.7	V628 R650	V628-P646 HydrophobicContact CB-CB 4.13Å; V628-P646 HydrophobicContact CG1-CB 3.52Å; V628-P646 HydrophobicContact CG2-CB 3.43Å; V628-P646 VanDerWaalsContact CG2-CB 3.43Å; P646-R650 HydrophobicContact CG-CB 4.43Å; P646-R650 HydrophobicContact CG-CG 4.15Å
647	S	64.6	Low	65.9	Low	41 Å²	41	65.6 Å²	65.6	29%	0.287	37%	0.374	S	S	.	.	S	Bend	trans	-151.1	152.1	-179.2	73.4	0	0	0	0	111.2	H636 F645 L649 R650 L651	H636-S647 VanDerWaalsContact CD2-CA 3.48Å; H636-S647 WeakPolarHBondContact CD2-CA 3.48Å; F645-S647 VanDerWaalsContact C-N 3.32Å; F645-S647 PolarHBondContact O-N 3.21Å; S647-L649 PolarHBondContact O-N 3.01Å; S647-R650 PolarHBondContact O-N 3Å; S647-R650 VanDerWaalsContact O-N 3.13Å; S647-R650 PolarHBondContact OG-N 2.88Å; S647-R650 VanDerWaalsContact OG-N 3.14Å; S647-L651 PolarHBondContact O-N 3.35Å
648	S	60.4	Low	65.1	Low	76 Å²	76	61 Å²	61	53%	0.531	36%	0.356	S	S	.	.	H	α-helix	trans	-60	-25.8	173.8	55.1	0	0	0	0	112.6	H636 Y652	H636-S648 PolarHBondContact CD2-N 3.28Å; H636-S648 PolarHBondContact NE2-N 3.31Å; S648-Y652 VanDerWaalsContact O-CB 3.25Å; S648-Y652 WeakPolarHBondContact O-CB 3.36Å; S648-Y652 PolarHBondContact O-N 3.12Å
649	L	55.5	Low	64	Low	105 Å²	105	63.6 Å²	63.6	55%	0.55	38%	0.378	S	S	.	.	H	α-helix	trans	-70.1	-45.9	172.9	-178.5	61.9	0	0	0	111.9	S647 L651 Y652 E653	S647-L649 PolarHBondContact O-N 3.01Å; L649-L651 VanDerWaalsContact C-N 3.33Å; L649-L651 PolarHBondContact O-N 2.85Å; L649-Y652 WeakPolarHBondContact O-CB 3.37Å; L649-Y652 PolarHBondContact O-N 2.9Å; L649-Y652 VanDerWaalsContact O-N 3.13Å; L649-E653 WeakPolarHBondContact O-CG 3.47Å; L649-E653 PolarHBondContact O-N 2.77Å
650	R	63.9	Low	63	Low	137 Å²	137	61.8 Å²	61.8	52%	0.517	37%	0.372	S	S	.	.	H	α-helix	trans	-64.2	-38.9	175.2	-73.6	-51.7	-155.1	-178	5.5	112	F645 P646 S647 Y652 E653 H654	F645-R650 HydrophobicContact CB-CB 4.19Å; F645-R650 HydrophobicContact CD1-CB 4.02Å; F645-R650 HydrophobicContact CG-CB 4.45Å; P646-R650 HydrophobicContact CG-CB 4.43Å; P646-R650 HydrophobicContact CG-CG 4.15Å; S647-R650 PolarHBondContact O-N 3Å; S647-R650 VanDerWaalsContact O-N 3.13Å; S647-R650 PolarHBondContact OG-N 2.88Å; S647-R650 VanDerWaalsContact OG-N 3.14Å; R650-Y652 VanDerWaalsContact C-N 3.33Å; R650-E653 WeakPolarHBondContact CD-OE2 3.49Å; R650-E653 IonicContact CZ-OE2 2.77Å; R650-E653 IonicContact NE-OE2 3.6Å; R650-E653 IonicContact NH1-OE1 3.45Å; R650-E653 IonicContact NH1-OE2 3.24Å; R650-E653 PolarHBondContact NH1-OE2 3.06Å; R650-E653 PolarHBondContact O-N 3.44Å; R650-H654 WeakPolarHBondContact O-CB 3.21Å; R650-H654 PolarHBondContact O-N 3.49Å
651	L	68	Low	62	Low	14 Å²	14	63.1 Å²	63.1	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-39.1	171.4	174.8	60.4	0	0	0	112	H636 H637 C638 F645 S647 L649 R655	H636-L651 HydrophobicContact CB-CB 4.12Å; H636-L651 HydrophobicContact CB-CD2 3.78Å; H637-L651 WeakPolarHBondContact O-CD1 3.47Å; H637-L651 VanDerWaalsContact O-CD2 3.31Å; H637-L651 WeakPolarHBondContact O-CD2 3.27Å; C638-L651 HydrophobicContact CB-CD1 3.62Å; F645-L651 HydrophobicContact CB-CB 4.08Å; F645-L651 HydrophobicContact CD2-CB 4.14Å; F645-L651 HydrophobicContact CD2-CD1 3.77Å; F645-L651 HydrophobicContact CE2-CD1 4.19Å; F645-L651 HydrophobicContact CG-CB 4.26Å; S647-L651 PolarHBondContact O-N 3.35Å; L649-L651 VanDerWaalsContact C-N 3.33Å; L649-L651 PolarHBondContact O-N 2.85Å; L651-R655 HydrophobicContact CD1-CG 4.16Å; L651-R655 WeakPolarHBondContact O-CB 3.47Å; L651-R655 VanDerWaalsContact O-CG 3.28Å; L651-R655 WeakPolarHBondContact O-CG 3.35Å; L651-R655 PolarHBondContact O-N 3.2Å
652	Y	59.6	Low	60.6	Low	118 Å²	118	66.1 Å²	66.1	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-66.5	-48	176.2	-179.6	-94.6	0	0	0	111.8	S648 L649 R650 H654 R655 C656 R736	S648-Y652 VanDerWaalsContact O-CB 3.25Å; S648-Y652 WeakPolarHBondContact O-CB 3.36Å; S648-Y652 PolarHBondContact O-N 3.12Å; L649-Y652 WeakPolarHBondContact O-CB 3.37Å; L649-Y652 PolarHBondContact O-N 2.9Å; L649-Y652 VanDerWaalsContact O-N 3.13Å; R650-Y652 VanDerWaalsContact C-N 3.33Å; Y652-H654 VanDerWaalsContact C-N 3.33Å; Y652-H654 PolarHBondContact O-N 3.2Å; Y652-R655 PolarHBondContact O-N 3.12Å; Y652-C656 WeakPolarHBondContact O-CB 3.45Å; Y652-C656 PolarHBondContact O-N 3.15Å; Y652-C656 PolarHBondContact O-SG 3.09Å; Y652-R736 PolarHBondContact OH-NH1 3.02Å; Y652-R736 VanDerWaalsContact OH-NH1 3.17Å
653	E	62.1	Low	58.9	Low	60 Å²	60	67.1 Å²	67.1	28%	0.28	39%	0.387	S	S	.	.	H	α-helix	trans	-54.9	-47.6	173	-72.6	169.4	-176.6	0	0	111.3	L649 R650 C656 A657	L649-E653 WeakPolarHBondContact O-CG 3.47Å; L649-E653 PolarHBondContact O-N 2.77Å; R650-E653 WeakPolarHBondContact CD-OE2 3.49Å; R650-E653 IonicContact CZ-OE2 2.77Å; R650-E653 IonicContact NE-OE2 3.6Å; R650-E653 IonicContact NH1-OE1 3.45Å; R650-E653 IonicContact NH1-OE2 3.24Å; R650-E653 PolarHBondContact NH1-OE2 3.06Å; R650-E653 PolarHBondContact O-N 3.44Å; E653-C656 PolarHBondContact O-N 3.21Å; E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.44Å
654	H	73.6	Confident	57.5	Low	54 Å²	54	70 Å²	70	25%	0.25	40%	0.403	C	S	.	.	H	α-helix	trans	-62.7	-45	176.5	171.9	76.7	0	0	0	112.5	C638 C641 F645 R650 Y652 C656 A657 A658	C638-H654 VanDerWaalsContact SG-CD2 3.5Å; C641-H654 PolarHBondContact SG-NE2 2.92Å; F645-H654 HydrophobicContact CE1-CB 3.79Å; F645-H654 HydrophobicContact CE2-CB 3.94Å; F645-H654 AromaticContact CE2-CD2 3.54Å; F645-H654 AromaticContact CE2-CG 3.64Å; F645-H654 HydrophobicContact CZ-CB 3.46Å; F645-H654 VanDerWaalsContact CZ-CB 3.46Å; F645-H654 AromaticContact CZ-CD2 3.57Å; F645-H654 AromaticContact CZ-CG 3.2Å; F645-H654 AromaticContact CZ-ND1 3.56Å; R650-H654 WeakPolarHBondContact O-CB 3.21Å; R650-H654 PolarHBondContact O-N 3.49Å; Y652-H654 VanDerWaalsContact C-N 3.33Å; Y652-H654 PolarHBondContact O-N 3.2Å; H654-C656 VanDerWaalsContact C-N 3.31Å; H654-C656 PolarHBondContact O-N 3.07Å; H654-A657 PolarHBondContact O-N 2.84Å; H654-A658 VanDerWaalsContact O-CB 3.29Å; H654-A658 WeakPolarHBondContact O-CB 3.4Å; H654-A658 PolarHBondContact O-N 3.48Å
655	R	69.3	Low	56.5	Low	114 Å²	114	78.2 Å²	78.2	43%	0.43	42%	0.424	S	S	.	.	H	α-helix	trans	-62.6	-37.3	175.5	-74.5	177.2	-172.7	-166.3	7	112	L651 Y652 A659	L651-R655 HydrophobicContact CD1-CG 4.16Å; L651-R655 WeakPolarHBondContact O-CB 3.47Å; L651-R655 VanDerWaalsContact O-CG 3.28Å; L651-R655 WeakPolarHBondContact O-CG 3.35Å; L651-R655 PolarHBondContact O-N 3.2Å; Y652-R655 PolarHBondContact O-N 3.12Å; R655-A659 VanDerWaalsContact O-CB 3.26Å; R655-A659 WeakPolarHBondContact O-CB 3.24Å; R655-A659 PolarHBondContact O-N 2.96Å
656	C	56.5	Low	55.8	Low	16 Å²	16	85.3 Å²	85.3	11%	0.108	45%	0.45	C	S	.	.	H	α-helix	trans	-70.9	-34.3	175.6	-75.8	0	0	0	0	112.8	Y652 E653 H654 A660	Y652-C656 WeakPolarHBondContact O-CB 3.45Å; Y652-C656 PolarHBondContact O-N 3.15Å; Y652-C656 PolarHBondContact O-SG 3.09Å; E653-C656 PolarHBondContact O-N 3.21Å; H654-C656 VanDerWaalsContact C-N 3.31Å; H654-C656 PolarHBondContact O-N 3.07Å; C656-A660 WeakPolarHBondContact O-CB 3.3Å; C656-A660 PolarHBondContact O-N 3.27Å
657	A	58.3	Low	56	Low	42 Å²	42	87.1 Å²	87.1	35%	0.347	45%	0.454	S	S	.	.	H	α-helix	trans	-67.8	-48.2	169.8	0	0	0	0	0	111.4	E653 H654 A659 A660 T661	E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.44Å; H654-A657 PolarHBondContact O-N 2.84Å; A657-A659 VanDerWaalsContact C-N 3.31Å; A657-A659 PolarHBondContact O-N 3.08Å; A657-A660 CarbonylContact O-C 3.54Å; A657-A660 WeakPolarHBondContact O-CA 3.43Å; A657-A660 WeakPolarHBondContact O-CB 3.49Å; A657-A660 PolarHBondContact O-N 3.29Å; A657-T661 PolarHBondContact O-N 3.05Å; A657-T661 PolarHBondContact O-OG1 3.21Å
658	A	57.8	Low	56.1	Low	18 Å²	18	89.9 Å²	89.9	15%	0.149	46%	0.462	C	S	.	.	H	α-helix	trans	-59.9	-38.7	178.5	0	0	0	0	0	112.4	H654 T661 Q662	H654-A658 VanDerWaalsContact O-CB 3.29Å; H654-A658 WeakPolarHBondContact O-CB 3.4Å; H654-A658 PolarHBondContact O-N 3.48Å; A658-T661 WeakPolarHBondContact CA-OG1 3.43Å; A658-T661 PolarHBondContact O-N 2.88Å; A658-T661 PolarHBondContact O-OG1 2.9Å; A658-T661 VanDerWaalsContact O-OG1 3.07Å; A658-Q662 VanDerWaalsContact O-CG 3.32Å; A658-Q662 WeakPolarHBondContact O-CG 3.48Å; A658-Q662 PolarHBondContact O-N 3.22Å; A658-Q662 VanDerWaalsContact O-N 3.08Å
659	A	49.8	Very low	56.6	Low	57 Å²	57	86.3 Å²	86.3	47%	0.471	44%	0.437	S	S	.	.	H	α-helix	trans	-69	-30.6	173.7	0	0	0	0	0	113.1	R655 A657	R655-A659 VanDerWaalsContact O-CB 3.26Å; R655-A659 WeakPolarHBondContact O-CB 3.24Å; R655-A659 PolarHBondContact O-N 2.96Å; A657-A659 VanDerWaalsContact C-N 3.31Å; A657-A659 PolarHBondContact O-N 3.08Å
660	A	45.2	Very low	57.2	Low	75 Å²	75	84.9 Å²	84.9	62%	0.62	45%	0.447	S	S	*	.	H	α-helix	trans	-76.9	-28.7	173.9	0	0	0	0	0	112.7	C656 A657	C656-A660 WeakPolarHBondContact O-CB 3.3Å; C656-A660 PolarHBondContact O-N 3.27Å; A657-A660 CarbonylContact O-C 3.54Å; A657-A660 WeakPolarHBondContact O-CA 3.43Å; A657-A660 WeakPolarHBondContact O-CB 3.49Å; A657-A660 PolarHBondContact O-N 3.29Å
661	T	44.5	Very low	57.4	Low	111 Å²	111	83.1 Å²	83.1	68%	0.681	45%	0.452	S	S	*	.	H	α-helix	trans	-86.1	-6.3	174.2	55.1	0	0	0	0	113.9	A657 A658 A663	A657-T661 PolarHBondContact O-N 3.05Å; A657-T661 PolarHBondContact O-OG1 3.21Å; A658-T661 WeakPolarHBondContact CA-OG1 3.43Å; A658-T661 PolarHBondContact O-N 2.88Å; A658-T661 PolarHBondContact O-OG1 2.9Å; A658-T661 VanDerWaalsContact O-OG1 3.07Å; T661-A663 PolarHBondContact O-N 2.98Å
662	Q	42.3	Very low	57.7	Low	136 Å²	136	85 Å²	85	64%	0.636	47%	0.466	S	S	*	.			trans	-75.5	72.9	170.9	-82.9	172.8	39.4	0	0	110.8	A658	A658-Q662 VanDerWaalsContact O-CG 3.32Å; A658-Q662 WeakPolarHBondContact O-CG 3.48Å; A658-Q662 PolarHBondContact O-N 3.22Å; A658-Q662 VanDerWaalsContact O-N 3.08Å
663	A	35.7	Very low	58.2	Low	77 Å²	77	81.1 Å²	81.1	64%	0.636	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-51	143.8	146.9	0	0	0	0	0	108.5	T661 R665	T661-A663 PolarHBondContact O-N 2.98Å; A663-R665 PolarHBondContact O-N 3.49Å
664	P	42.3	Very low	58.5	Low	98 Å²	98	84.4 Å²	84.4	64%	0.636	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-57.1	126.9	-176.7	23.6	-33.5	0	0	0	109.5	R666	P664-R666 PolarHBondContact O-N 3.34Å
665	R	47.8	Very low	58.3	Low	214 Å²	214	87.6 Å²	87.6	81%	0.808	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-53.6	116.1	172	-73.1	-171.7	177	-141	1.4	107.1	A663 F667	A663-R665 PolarHBondContact O-N 3.49Å; R665-F667 HydrophobicContact CB-CE2 4.45Å; R665-F667 WeakPolarHBondContact O-CD2 3.46Å; R665-F667 VanDerWaalsContact O-CE2 3.23Å; R665-F667 WeakPolarHBondContact O-CE2 3.25Å; R665-F667 PolarHBondContact O-N 3.45Å
666	R	55.4	Low	58.4	Low	187 Å²	187	83.4 Å²	83.4	71%	0.706	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-75.4	116.8	171.1	-66.8	-168.9	-177	-163.9	2.1	107.1	P664 K675 V676	P664-R666 PolarHBondContact O-N 3.34Å; R666-K675 HydrophobicContact CB-CB 4.21Å; R666-V676 CarbonylContact C-O 3.55Å; R666-V676 WeakPolarHBondContact CA-O 3.44Å
667	F	63.5	Low	58.3	Low	79 Å²	79	84.7 Å²	84.7	35%	0.346	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	140.5	174	-64.3	-94.9	0	0	0	107.8	R665 K675 V676 S678 A679 L682	R665-F667 HydrophobicContact CB-CE2 4.45Å; R665-F667 WeakPolarHBondContact O-CD2 3.46Å; R665-F667 VanDerWaalsContact O-CE2 3.23Å; R665-F667 WeakPolarHBondContact O-CE2 3.25Å; R665-F667 PolarHBondContact O-N 3.45Å; F667-K675 CarbonylContact O-C 3.57Å; F667-K675 WeakPolarHBondContact O-CA 3.29Å; F667-V676 PolarHBondContact N-O 3.47Å; F667-V676 PolarHBondContact O-N 3.28Å; F667-S678 VanDerWaalsContact CD2-C 3.5Å; F667-A679 HydrophobicContact CD1-CB 4.25Å; F667-A679 HydrophobicContact CE1-CB 3.88Å; F667-A679 HydrophobicContact CE2-CB 4.34Å; F667-A679 HydrophobicContact CZ-CB 3.93Å; F667-L682 HydrophobicContact CB-CB 3.94Å; F667-L682 HydrophobicContact CB-CD1 4.13Å; F667-L682 HydrophobicContact CB-CD2 3.99Å; F667-L682 HydrophobicContact CB-CG 4.22Å
668	E	67.5	Low	58.7	Low	99 Å²	99	84.9 Å²	84.9	46%	0.463	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.9	-171.5	-175.6	156.5	-159.5	0	0	110.4	G670 K675	E668-G670 PolarHBondContact O-N 3.48Å; E668-K675 HydrophobicContact CB-CG 4.17Å; E668-K675 HydrophobicContact CG-CG 4.03Å; E668-K675 IonicContact OE1-NZ 3.68Å; E668-K675 PolarHBondContact OE1-NZ 3.27Å; E668-K675 WeakPolarHBondContact OE2-CE 3.43Å; E668-K675 IonicContact OE2-NZ 3.6Å; E668-K675 PolarHBondContact OE2-NZ 2.77Å
669	C	70.7	Confident	59.2	Low	2 Å²	2	86.3 Å²	86.3	1%	0.014	50%	0.502	C	S	.	.			trans	-64.7	117.7	-174	-165.6	0	0	0	0	111.2	T671 C672 G673 K674 L682 H685 E686 H689	C669-T671 PolarHBondContact O-N 2.93Å; C669-T671 PolarHBondContact SG-OG1 2.95Å; C669-T671 VanDerWaalsContact SG-OG1 3.39Å; C669-C672 PolarHBondContact O-N 2.8Å; C669-C672 VanDerWaalsContact SG-SG 3.67Å; C669-G673 PolarHBondContact O-N 3.16Å; C669-K674 HydrophobicContact CB-CB 4.34Å; C669-K674 PolarHBondContact N-O 3.23Å; C669-L682 HydrophobicContact CB-CD1 4.12Å; C669-H685 VanDerWaalsContact SG-CD2 3.57Å; C669-E686 WeakPolarHBondContact CA-OE1 3.47Å; C669-E686 VanDerWaalsContact SG-CG 3.56Å; C669-H689 VanDerWaalsContact SG-CD2 3.56Å; C669-H689 PolarHBondContact SG-NE2 3.46Å; C669-H689 VanDerWaalsContact SG-NE2 3.38Å
670	G	67.6	Low	60	Low	74 Å²	74	87 Å²	87	76%	0.763	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.2	-175.6	0	0	0	0	0	113.5	E668 E686	E668-G670 PolarHBondContact O-N 3.48Å; G670-E686 PolarHBondContact N-OE1 3.46Å
671	T	67.9	Low	61.2	Low	100 Å²	100	92 Å²	92	61%	0.613	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.1	-179.6	39.4	0	0	0	0	115.8	C669 H689	C669-T671 PolarHBondContact O-N 2.93Å; C669-T671 PolarHBondContact SG-OG1 2.95Å; C669-T671 VanDerWaalsContact SG-OG1 3.39Å; T671-H689 PolarHBondContact OG1-CD2 2.81Å; T671-H689 PolarHBondContact OG1-NE2 2.89Å
672	C	75.4	Confident	62.7	Low	53 Å²	53	87.9 Å²	87.9	36%	0.358	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.3	8.2	-175	78.8	0	0	0	0	117.3	C669 K674 H685 H689	C669-C672 PolarHBondContact O-N 2.8Å; C669-C672 VanDerWaalsContact SG-SG 3.67Å; C672-K674 PolarHBondContact O-N 2.98Å; C672-H685 PolarHBondContact SG-NE2 3.08Å; C672-H689 PolarHBondContact SG-NE2 3.38Å
673	G	69.3	Low	64.2	Low	37 Å²	37	88.1 Å²	88.1	38%	0.381	49%	0.485	S	S	.	.			trans	67.9	4	175.7	0	0	0	0	0	116.1	C669 K675	C669-G673 PolarHBondContact O-N 3.16Å; G673-K675 PolarHBondContact O-N 3.4Å
674	K	68.2	Low	66.1	Low	129 Å²	129	87.5 Å²	87.5	56%	0.561	48%	0.481	S	S	*	.			trans	-68.1	125.1	179.1	-75.1	178.3	-178.3	172	0	110.8	C669 C672 V676 H685	C669-K674 HydrophobicContact CB-CB 4.34Å; C669-K674 PolarHBondContact N-O 3.23Å; C672-K674 PolarHBondContact O-N 2.98Å; K674-V676 WeakPolarHBondContact O-CG2 3.43Å; K674-H685 WeakPolarHBondContact CD-NE2 3.38Å
675	K	68.6	Low	67.8	Low	121 Å²	121	85 Å²	85	53%	0.526	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	101.7	-174.2	-80.1	175.8	160.7	89.1	0	112.1	R666 F667 E668 G673	R666-K675 HydrophobicContact CB-CB 4.21Å; F667-K675 CarbonylContact O-C 3.57Å; F667-K675 WeakPolarHBondContact O-CA 3.29Å; E668-K675 HydrophobicContact CB-CG 4.17Å; E668-K675 HydrophobicContact CG-CG 4.03Å; E668-K675 IonicContact OE1-NZ 3.68Å; E668-K675 PolarHBondContact OE1-NZ 3.27Å; E668-K675 WeakPolarHBondContact OE2-CE 3.43Å; E668-K675 IonicContact OE2-NZ 3.6Å; E668-K675 PolarHBondContact OE2-NZ 2.77Å; G673-K675 PolarHBondContact O-N 3.4Å
676	V	72.5	Confident	69.1	Low	26 Å²	26	78 Å²	78	16%	0.158	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	144.4	-169.7	-144.5	0	0	0	0	112.3	R666 F667 K674 S678 R681 L682	R666-V676 CarbonylContact C-O 3.55Å; R666-V676 WeakPolarHBondContact CA-O 3.44Å; F667-V676 PolarHBondContact N-O 3.47Å; F667-V676 PolarHBondContact O-N 3.28Å; K674-V676 WeakPolarHBondContact O-CG2 3.43Å; V676-S678 PolarHBondContact O-N 3.45Å; V676-R681 HydrophobicContact CG1-CB 3.53Å; V676-L682 HydrophobicContact CG2-CD1 4Å
677	G	53	Low	70.1	Confident	43 Å²	43	71.7 Å²	71.7	44%	0.443	43%	0.425	S	S	.	.	S	Bend	trans	-78.5	-3.3	-169.4	0	0	0	0	0	117.5
678	S	67.2	Low	70.4	Confident	47 Å²	47	70.6 Å²	70.6	33%	0.329	43%	0.43	S	S	.	.	S	Bend	trans	-159.6	149.8	-179.6	58.3	0	0	0	0	111.8	F667 V676 A680 R681 L682	F667-S678 VanDerWaalsContact CD2-C 3.5Å; V676-S678 PolarHBondContact O-N 3.45Å; S678-A680 VanDerWaalsContact C-N 3.33Å; S678-A680 PolarHBondContact O-N 2.89Å; S678-R681 PolarHBondContact O-N 3.29Å; S678-R681 VanDerWaalsContact O-N 3.08Å; S678-L682 PolarHBondContact O-N 3.44Å
679	A	67.9	Low	70.7	Confident	48 Å²	48	68.8 Å²	68.8	40%	0.397	42%	0.422	S	S	.	.	H	α-helix	trans	-57	-42.8	179.4	0	0	0	0	0	112.6	F667 R681 L682 Q683	F667-A679 HydrophobicContact CD1-CB 4.25Å; F667-A679 HydrophobicContact CE1-CB 3.88Å; F667-A679 HydrophobicContact CE2-CB 4.34Å; F667-A679 HydrophobicContact CZ-CB 3.93Å; A679-R681 VanDerWaalsContact C-N 3.28Å; A679-R681 PolarHBondContact O-N 3.34Å; A679-L682 WeakPolarHBondContact O-CB 3.43Å; A679-L682 PolarHBondContact O-N 3.23Å; A679-L682 VanDerWaalsContact O-N 3.08Å; A679-Q683 WeakPolarHBondContact O-CB 3.44Å; A679-Q683 PolarHBondContact O-N 2.98Å
680	A	68.1	Low	70.3	Confident	72 Å²	72	72.9 Å²	72.9	60%	0.595	46%	0.456	S	S	*	.	H	α-helix	trans	-61.6	-32.7	177	0	0	0	0	0	113.4	S678 A684	S678-A680 VanDerWaalsContact C-N 3.33Å; S678-A680 PolarHBondContact O-N 2.89Å; A680-A684 WeakPolarHBondContact O-CB 3.46Å; A680-A684 PolarHBondContact O-N 2.87Å
681	R	70.7	Confident	69.8	Low	178 Å²	178	73.6 Å²	73.6	67%	0.672	45%	0.454	S	S	*	.	H	α-helix	trans	-80.2	-27.2	173.3	-79.4	-174.6	162.7	169.9	-5.4	113.1	V676 S678 A679 H685	V676-R681 HydrophobicContact CG1-CB 3.53Å; S678-R681 PolarHBondContact O-N 3.29Å; S678-R681 VanDerWaalsContact O-N 3.08Å; A679-R681 VanDerWaalsContact C-N 3.28Å; A679-R681 PolarHBondContact O-N 3.34Å; R681-H685 VanDerWaalsContact O-CB 3.25Å; R681-H685 WeakPolarHBondContact O-CB 3.29Å; R681-H685 PolarHBondContact O-N 3.25Å; R681-H685 VanDerWaalsContact O-N 3.13Å
682	L	75.7	Confident	69	Low	25 Å²	25	72.1 Å²	72.1	13%	0.131	45%	0.452	C	S	.	.	H	α-helix	trans	-62.8	-54.1	167.5	-176.8	78.6	0	0	0	109.2	F667 C669 V676 S678 A679 A684 H685 E686	F667-L682 HydrophobicContact CB-CB 3.94Å; F667-L682 HydrophobicContact CB-CD1 4.13Å; F667-L682 HydrophobicContact CB-CD2 3.99Å; F667-L682 HydrophobicContact CB-CG 4.22Å; C669-L682 HydrophobicContact CB-CD1 4.12Å; V676-L682 HydrophobicContact CG2-CD1 4Å; S678-L682 PolarHBondContact O-N 3.44Å; A679-L682 WeakPolarHBondContact O-CB 3.43Å; A679-L682 PolarHBondContact O-N 3.23Å; A679-L682 VanDerWaalsContact O-N 3.08Å; L682-A684 VanDerWaalsContact C-N 3.34Å; L682-A684 PolarHBondContact O-N 3.47Å; L682-H685 CarbonylContact O-C 3.6Å; L682-H685 WeakPolarHBondContact O-CA 3.48Å; L682-H685 WeakPolarHBondContact O-CB 3.43Å; L682-H685 PolarHBondContact O-N 3.17Å; L682-E686 HydrophobicContact CG-CG 4.36Å; L682-E686 WeakPolarHBondContact CG-OE2 3.45Å; L682-E686 PolarHBondContact O-N 2.83Å
683	Q	73.7	Confident	67.2	Low	141 Å²	141	72.4 Å²	72.4	66%	0.659	47%	0.465	S	S	*	.	H	α-helix	trans	-60.7	-40	-177.2	-164.7	172.1	12.3	0	0	112.4	A679 H685 A687	A679-Q683 WeakPolarHBondContact O-CB 3.44Å; A679-Q683 PolarHBondContact O-N 2.98Å; Q683-H685 VanDerWaalsContact C-N 3.34Å; Q683-A687 VanDerWaalsContact O-CB 3.24Å; Q683-A687 WeakPolarHBondContact O-CB 3.35Å; Q683-A687 PolarHBondContact O-N 3.24Å
684	A	75.4	Confident	65.9	Low	65 Å²	65	77.6 Å²	77.6	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-67.9	-30.7	171.9	0	0	0	0	0	113.3	A680 L682 A688	A680-A684 WeakPolarHBondContact O-CB 3.46Å; A680-A684 PolarHBondContact O-N 2.87Å; L682-A684 VanDerWaalsContact C-N 3.34Å; L682-A684 PolarHBondContact O-N 3.47Å; A684-A688 PolarHBondContact O-N 2.95Å; A684-A688 VanDerWaalsContact O-N 3.12Å
685	H	77.4	Confident	64.3	Low	46 Å²	46	74.8 Å²	74.8	21%	0.213	50%	0.499	C	S	.	.	H	α-helix	trans	-76.2	-38.5	175.9	-176.8	25.9	0	0	0	112.2	C669 C672 K674 R681 L682 Q683 A688 H689	C669-H685 VanDerWaalsContact SG-CD2 3.57Å; C672-H685 PolarHBondContact SG-NE2 3.08Å; K674-H685 WeakPolarHBondContact CD-NE2 3.38Å; R681-H685 VanDerWaalsContact O-CB 3.25Å; R681-H685 WeakPolarHBondContact O-CB 3.29Å; R681-H685 PolarHBondContact O-N 3.25Å; R681-H685 VanDerWaalsContact O-N 3.13Å; L682-H685 CarbonylContact O-C 3.6Å; L682-H685 WeakPolarHBondContact O-CA 3.48Å; L682-H685 WeakPolarHBondContact O-CB 3.43Å; L682-H685 PolarHBondContact O-N 3.17Å; Q683-H685 VanDerWaalsContact C-N 3.34Å; H685-A688 WeakPolarHBondContact O-CB 3.48Å; H685-A688 PolarHBondContact O-N 2.84Å; H685-H689 AromaticContact CE1-CD2 3.82Å; H685-H689 AromaticContact CE1-CE1 3.87Å; H685-H689 AromaticContact CE1-NE2 3.16Å; H685-H689 PolarHBondContact CE1-NE2 3.16Å; H685-H689 AromaticContact ND1-CD2 3.98Å; H685-H689 AromaticContact ND1-NE2 3.77Å; H685-H689 AromaticContact NE2-NE2 3.42Å; H685-H689 PolarHBondContact NE2-NE2 3.4Å; H685-H689 PolarHBondContact O-CD2 3.21Å; H685-H689 PolarHBondContact O-N 2.84Å; H685-H689 VanDerWaalsContact O-N 3.14Å
686	E	76.4	Confident	62.5	Low	65 Å²	65	78.8 Å²	78.8	30%	0.304	52%	0.52	S	S	.	.	H	α-helix	trans	-70	-36.6	174.7	-71.1	173.3	158.4	0	0	111.1	C669 G670 L682 A688 H689 A690	C669-E686 WeakPolarHBondContact CA-OE1 3.47Å; C669-E686 VanDerWaalsContact SG-CG 3.56Å; G670-E686 PolarHBondContact N-OE1 3.46Å; L682-E686 HydrophobicContact CG-CG 4.36Å; L682-E686 WeakPolarHBondContact CG-OE2 3.45Å; L682-E686 PolarHBondContact O-N 2.83Å; E686-A688 VanDerWaalsContact C-N 3.3Å; E686-A688 PolarHBondContact O-N 3.03Å; E686-H689 WeakPolarHBondContact O-CB 3.5Å; E686-H689 PolarHBondContact O-N 3.41Å; E686-A690 PolarHBondContact O-N 3.44Å
687	A	75.1	Confident	60.8	Low	55 Å²	55	84.3 Å²	84.3	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-62.1	-34.2	167.4	0	0	0	0	0	112.8	Q683 H689 A690 A691	Q683-A687 VanDerWaalsContact O-CB 3.24Å; Q683-A687 WeakPolarHBondContact O-CB 3.35Å; Q683-A687 PolarHBondContact O-N 3.24Å; A687-H689 VanDerWaalsContact C-N 3.34Å; A687-A690 PolarHBondContact O-N 3.19Å; A687-A691 WeakPolarHBondContact O-CB 3.42Å; A687-A691 PolarHBondContact O-N 3.3Å
688	A	70.5	Confident	59.8	Low	56 Å²	56	90.2 Å²	90.2	46%	0.463	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-29.7	174.1	0	0	0	0	0	112.9	A684 H685 E686 A692	A684-A688 PolarHBondContact O-N 2.95Å; A684-A688 VanDerWaalsContact O-N 3.12Å; H685-A688 WeakPolarHBondContact O-CB 3.48Å; H685-A688 PolarHBondContact O-N 2.84Å; E686-A688 VanDerWaalsContact C-N 3.3Å; E686-A688 PolarHBondContact O-N 3.03Å; A688-A692 PolarHBondContact O-N 2.83Å
689	H	73.1	Confident	58	Low	61 Å²	61	92.6 Å²	92.6	28%	0.282	60%	0.596	S	S	.	*	H	α-helix	trans	-71	-37	168	-68.1	-76.4	0	0	0	111.8	C669 T671 C672 H685 E686 A687 A691 A692	C669-H689 VanDerWaalsContact SG-CD2 3.56Å; C669-H689 PolarHBondContact SG-NE2 3.46Å; C669-H689 VanDerWaalsContact SG-NE2 3.38Å; T671-H689 PolarHBondContact OG1-CD2 2.81Å; T671-H689 PolarHBondContact OG1-NE2 2.89Å; C672-H689 PolarHBondContact SG-NE2 3.38Å; H685-H689 AromaticContact CE1-CD2 3.82Å; H685-H689 AromaticContact CE1-CE1 3.87Å; H685-H689 AromaticContact CE1-NE2 3.16Å; H685-H689 PolarHBondContact CE1-NE2 3.16Å; H685-H689 AromaticContact ND1-CD2 3.98Å; H685-H689 AromaticContact ND1-NE2 3.77Å; H685-H689 AromaticContact NE2-NE2 3.42Å; H685-H689 PolarHBondContact NE2-NE2 3.4Å; H685-H689 PolarHBondContact O-CD2 3.21Å; H685-H689 PolarHBondContact O-N 2.84Å; H685-H689 VanDerWaalsContact O-N 3.14Å; E686-H689 WeakPolarHBondContact O-CB 3.5Å; E686-H689 PolarHBondContact O-N 3.41Å; A687-H689 VanDerWaalsContact C-N 3.34Å; H689-A691 VanDerWaalsContact C-N 3.31Å; H689-A691 PolarHBondContact O-N 3.36Å; H689-A692 PolarHBondContact O-N 2.94Å
690	A	61.7	Low	56.3	Low	89 Å²	89	99.8 Å²	99.8	74%	0.736	62%	0.619	S	S	*	*	H	α-helix	trans	-69.8	-26.6	175.8	0	0	0	0	0	113.4	E686 A687	E686-A690 PolarHBondContact O-N 3.44Å; A687-A690 PolarHBondContact O-N 3.19Å
691	A	57.9	Low	54.3	Low	88 Å²	88	105.1 Å²	105.1	73%	0.727	63%	0.631	S	S	*	*	H	α-helix	trans	-82.5	-17.9	174.5	0	0	0	0	0	113.6	A687 H689 G693	A687-A691 WeakPolarHBondContact O-CB 3.42Å; A687-A691 PolarHBondContact O-N 3.3Å; H689-A691 VanDerWaalsContact C-N 3.31Å; H689-A691 PolarHBondContact O-N 3.36Å; A691-G693 PolarHBondContact O-N 3.38Å
692	A	51.4	Low	52.6	Low	69 Å²	69	101.2 Å²	101.2	57%	0.57	63%	0.629	S	S	*	*	S	Bend	trans	-91.9	94.8	175	0	0	0	0	0	109.9	A688 H689	A688-A692 PolarHBondContact O-N 2.83Å; H689-A692 PolarHBondContact O-N 2.94Å
693	G	37.5	Very low	50.5	Low	60 Å²	60	106.3 Å²	106.3	62%	0.619	66%	0.663	S	S	*	*			trans	-57.8	156.7	176.4	0	0	0	0	0	113.2	A691 G695	A691-G693 PolarHBondContact O-N 3.38Å; G693-G695 PolarHBondContact O-N 3.13Å
694	P	41.3	Very low	48.2	Very low	146 Å²	146	104 Å²	104	95%	0.948	67%	0.669	S	S	*	*			trans	-69.8	114.4	-170.4	28	-34.7	0	0	0	112.1
695	G	34.8	Very low	46.4	Very low	70 Å²	70	106.6 Å²	106.6	72%	0.722	68%	0.68	S	S	*	*			trans	-137.7	107.4	175	0	0	0	0	0	111.4	G693	G693-G695 PolarHBondContact O-N 3.13Å
696	E	30.3	Very low	44.2	Very low	204 Å²	204	116.3 Å²	116.3	95%	0.953	71%	0.714	S	S	*	*			trans	38	132.3	161.7	-61.1	-173.1	109.3	0	0	121.7
697	V	37	Very low	41.8	Very low	143 Å²	143	117.8 Å²	117.8	87%	0.867	74%	0.738	S	S	*	*			trans	-96.4	123	173.3	176.8	0	0	0	0	109.5
698	L	32.3	Very low	39.5	Very low	167 Å²	167	120.9 Å²	120.9	87%	0.874	76%	0.756	S	S	*	*			trans	-148.3	140.9	165.5	-145.9	73	0	0	0	114.2
699	A	29.4	Very low	37.9	Very low	96 Å²	96	129.4 Å²	129.4	79%	0.793	78%	0.777	S	S	*	*			trans	54.7	133.4	161.2	0	0	0	0	0	121
700	K	33.3	Very low	35.7	Very low	200 Å²	200	131.5 Å²	131.5	87%	0.87	80%	0.804	S	S	*	*			trans	-88.9	150.1	153.8	-61.1	166.4	176.4	169.5	0	108.5
701	E	26.5	Very low	34.1	Very low	183 Å²	183	132.7 Å²	132.7	86%	0.855	80%	0.803	S	S	*	*			trans	-161.7	162	146	-99.9	-62.3	84.7	0	0	108.5
702	P	34.4	Very low	32.8	Very low	97 Å²	97	140.2 Å²	140.2	63%	0.63	81%	0.812	S	S	*	*			trans	-99.1	153.5	-166.1	37.5	-35.6	0	0	0	115.3
703	P	31.5	Very low	31.6	Very low	132 Å²	132	142.9 Å²	142.9	86%	0.857	82%	0.822	S	S	*	*			trans	-87.1	116.2	173.1	32.5	-32	0	0	0	113.2
704	A	25.7	Very low	31.6	Very low	93 Å²	93	145.6 Å²	145.6	77%	0.769	83%	0.828	S	S	*	*			trans	-83.9	179.8	163.3	0	0	0	0	0	110.9
705	P	37.4	Very low	30.9	Very low	118 Å²	118	145.7 Å²	145.7	77%	0.766	83%	0.826	S	S	*	*			trans	-106.4	158	-141.5	39.1	-38.2	0	0	0	118.7
706	R	31.8	Very low	30.6	Very low	250 Å²	250	148.2 Å²	148.2	94%	0.943	83%	0.828	S	S	*	*			trans	52.3	111.2	147.9	-73	-176	171.6	-159.5	1.5	120.8
707	A	24.7	Very low	30.7	Very low	96 Å²	96	144.5 Å²	144.5	79%	0.793	82%	0.821	S	S	*	*			trans	-164.7	157.8	137.8	0	0	0	0	0	109
708	S	28.1	Very low	30.1	Very low	121 Å²	121	143.1 Å²	143.1	85%	0.846	82%	0.817	S	S	*	*			cis	-155.6	166.4	-28.2	-104.5	0	0	0	0	110.3
709	R	35	Very low	30.7	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.887	81%	0.814	S	S	*	*			trans	-65.2	133.3	-176.8	172.4	-168.7	-176.1	-171.5	4.3	113.2
710	A	26.8	Very low	30.9	Very low	104 Å²	104	142.7 Å²	142.7	86%	0.86	82%	0.817	S	S	*	*			trans	-140	134.5	163.2	0	0	0	0	0	111.8
711	T	28.9	Very low	30.7	Very low	115 Å²	115	137.5 Å²	137.5	71%	0.706	81%	0.811	S	S	*	*			trans	-98	141.2	-168.4	-43	0	0	0	0	111.8
712	R	31.4	Very low	30.9	Very low	245 Å²	245	137.3 Å²	137.3	93%	0.925	82%	0.815	S	S	*	*			trans	-177.2	141.6	132.2	-106.4	166.9	167.5	174.4	-5.2	115.5
713	T	25.4	Very low	30.6	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	82%	0.824	S	S	*	*			trans	-114.1	176.6	158.5	48	0	0	0	0	108.1
714	P	38.6	Very low	30.5	Very low	117 Å²	117	134.1 Å²	134.1	76%	0.76	82%	0.824	S	S	*	*			cis	-121.5	171.8	-46.5	37	-24.1	0	0	0	110.9
715	V	26.6	Very low	30.7	Very low	148 Å²	148	134.4 Å²	134.4	90%	0.897	83%	0.826	S	S	*	*			trans	-135.9	135.5	165.5	-176.8	0	0	0	0	109.8
716	T	28.2	Very low	30.5	Very low	123 Å²	123	134.6 Å²	134.6	76%	0.755	83%	0.827	S	S	*	*			trans	-82.3	152.4	179	43.1	0	0	0	0	112.5
717	P	31.9	Very low	30.2	Very low	126 Å²	126	128.5 Å²	128.5	82%	0.818	82%	0.823	S	S	*	*			trans	-82.4	143.8	-178.5	33.4	-34.7	0	0	0	113.2
718	S	25.4	Very low	30.4	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	83%	0.825	S	S	*	*			trans	-120.6	150.2	161.7	-67.1	0	0	0	0	109.6
719	P	44.4	Very low	30.4	Very low	125 Å²	125	126.9 Å²	126.9	81%	0.812	82%	0.817	S	S	*	*			trans	-92.5	160.6	-170.7	36.8	-36.4	0	0	0	113.8
720	P	33.6	Very low	30.2	Very low	130 Å²	130	121.9 Å²	121.9	84%	0.844	82%	0.815	S	S	*	*			trans	-113.6	160.8	146.7	36.4	-28.8	0	0	0	111.8
721	A	27.5	Very low	30.2	Very low	90 Å²	90	123.6 Å²	123.6	74%	0.744	82%	0.815	S	S	*	*			trans	-101	164.8	-174.9	0	0	0	0	0	114
722	L	31.7	Very low	30.2	Very low	180 Å²	180	122.1 Å²	122.1	94%	0.942	81%	0.814	S	S	*	*			trans	23.3	120.2	148.7	-61.5	170.8	0	0	0	119.4
723	G	28.8	Very low	30.1	Very low	80 Å²	80	116.5 Å²	116.5	83%	0.825	81%	0.81	S	S	*	*			trans	-179.6	116.1	159.8	0	0	0	0	0	114.4
724	G	28.9	Very low	30.3	Very low	82 Å²	82	114.9 Å²	114.9	85%	0.845	81%	0.809	S	S	*	*			trans	68.9	115.6	157.6	0	0	0	0	0	119.2
725	A	30	Very low	30.2	Very low	99 Å²	99	121.1 Å²	121.1	82%	0.818	82%	0.817	S	S	*	*			trans	-80.8	157.8	150.3	0	0	0	0	0	109.5
726	P	32.8	Very low	31	Very low	121 Å²	121	122.9 Å²	122.9	79%	0.786	81%	0.808	S	S	*	*				-147.2	163.4	102.2	38.9	-25	0	0	0	116.1
727	S	26.4	Very low	32.1	Very low	123 Å²	123	128.7 Å²	128.7	86%	0.86	82%	0.816	S	S	*	*			trans	63.8	126.5	157.9	-157.1	0	0	0	0	119.4	A729	S727-A729 PolarHBondContact O-N 3.1Å
728	A	28.4	Very low	33.4	Very low	101 Å²	101	124.3 Å²	124.3	84%	0.835	79%	0.794	S	S	*	*			trans	-89.4	105.7	-179.3	0	0	0	0	0	112.4
729	A	27.3	Very low	35.6	Very low	82 Å²	82	122.3 Å²	122.3	68%	0.678	77%	0.774	S	S	*	*			trans	-67.3	146.7	159.9	0	0	0	0	0	110.5	S727 T731	S727-A729 PolarHBondContact O-N 3.1Å; A729-T731 PolarHBondContact O-N 3.18Å
730	P	31	Very low	37.1	Very low	129 Å²	129	121.3 Å²	121.3	84%	0.838	76%	0.758	S	S	*	*			trans	-60.7	126.5	-175.5	23.5	-33.9	0	0	0	111.7	A732	P730-A732 PolarHBondContact O-N 3.24Å
731	T	28	Very low	39.3	Very low	140 Å²	140	115.1 Å²	115.1	86%	0.859	72%	0.718	S	S	*	*			trans	-61.1	112.6	-174	49.5	0	0	0	0	111.9	A729	A729-T731 PolarHBondContact O-N 3.18Å
732	A	28.5	Very low	41.7	Very low	84 Å²	84	115.3 Å²	115.3	69%	0.694	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-56.2	143.7	174.9	0	0	0	0	0	111.5	P730 A734	P730-A732 PolarHBondContact O-N 3.24Å; A732-A734 PolarHBondContact O-N 3.28Å
733	P	29.1	Very low	43.9	Very low	128 Å²	128	111.4 Å²	111.4	83%	0.831	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-59.9	125.8	-175.3	23.9	-34.1	0	0	0	111.1	R735	P733-R735 PolarHBondContact O-N 3.01Å
734	A	30.2	Very low	46.4	Very low	92 Å²	92	109.4 Å²	109.4	76%	0.76	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-48.8	125.9	-169.7	0	0	0	0	0	113.1	A732 R736	A732-A734 PolarHBondContact O-N 3.28Å; A734-R736 PolarHBondContact O-N 3.23Å
735	R	36.1	Very low	48.7	Very low	248 Å²	248	113 Å²	113	94%	0.936	66%	0.656	S	S	*	*			trans	-53.4	111.3	175.5	-80.5	-176.9	169.3	-129.3	2.2	109.8	P733 R737	P733-R735 PolarHBondContact O-N 3.01Å; R735-R737 PolarHBondContact O-N 2.91Å; R735-R737 VanDerWaalsContact O-N 3.13Å
736	R	43.4	Very low	50.8	Low	185 Å²	185	113.9 Å²	113.9	70%	0.698	64%	0.642	S	S	*	*			trans	-63.7	113.8	174.7	-67.5	178.1	-180	-98.7	-6.7	108.8	Y652 A734 G738	Y652-R736 PolarHBondContact OH-NH1 3.02Å; Y652-R736 VanDerWaalsContact OH-NH1 3.17Å; A734-R736 PolarHBondContact O-N 3.23Å; R736-G738 PolarHBondContact O-N 2.66Å
737	R	50.5	Low	52.7	Low	244 Å²	244	113.8 Å²	113.8	92%	0.921	63%	0.634	S	S	*	*			trans	-61.6	128.8	165.3	-68.4	-172	-178.2	-169.3	0.7	108.1	R735	R735-R737 PolarHBondContact O-N 2.91Å; R735-R737 VanDerWaalsContact O-N 3.13Å
738	G	58.9	Low	55.1	Low	34 Å²	34	109.9 Å²	109.9	35%	0.351	60%	0.601	S	S	.	*			trans	-67	157.8	162.3	0	0	0	0	0	109.8	R736 E740	R736-G738 PolarHBondContact O-N 2.66Å; G738-E740 PolarHBondContact O-N 3Å
739	L	71.3	Confident	56.9	Low	71 Å²	71	107.4 Å²	107.4	37%	0.372	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	111.9	175.3	-67.9	162.8	0	0	0	108.1	F748 E751 L754	L739-F748 PolarHBondContact N-O 3.12Å; L739-F748 PolarHBondContact O-N 2.81Å; L739-E751 HydrophobicContact CD1-CB 3.96Å; L739-E751 VanDerWaalsContact CD1-N 3.29Å; L739-L754 HydrophobicContact CB-CD2 3.95Å
740	E	77.1	Confident	59	Low	104 Å²	104	105 Å²	105	49%	0.486	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86	135.9	-174.5	-167.8	174.4	159.2	0	0	111.5	G738 S742 K745 L747	G738-E740 PolarHBondContact O-N 3Å; E740-S742 PolarHBondContact O-N 2.85Å; E740-K745 HydrophobicContact CG-CB 4.47Å; E740-K745 VanDerWaalsContact OE1-CB 3.29Å; E740-K745 WeakPolarHBondContact OE1-CB 3.5Å; E740-K745 VanDerWaalsContact OE1-CG 3.31Å; E740-K745 WeakPolarHBondContact OE1-CG 3.2Å; E740-L747 HydrophobicContact CB-CD2 3.81Å; E740-L747 HydrophobicContact CG-CD2 4.02Å
741	C	78.9	Confident	61	Low	0 Å²	0	103 Å²	103	0%	0	54%	0.535	C	S	.	.			trans	-76.7	116.2	166.9	178.9	0	0	0	0	110.2	E743 C744 K745 K746 F748 L754 H761	C741-E743 PolarHBondContact O-N 2.86Å; C741-E743 VanDerWaalsContact O-N 3.08Å; C741-C744 PolarHBondContact O-N 3.27Å; C741-K745 VanDerWaalsContact O-CA 3.25Å; C741-K745 WeakPolarHBondContact O-CA 3.44Å; C741-K745 PolarHBondContact O-N 3.3Å; C741-K746 PolarHBondContact N-O 2.85Å; C741-F748 HydrophobicContact CB-CE2 4.07Å; C741-L754 HydrophobicContact CB-CD1 3.62Å; C741-H761 PolarHBondContact SG-NE2 2.74Å
742	S	78.3	Confident	63.3	Low	95 Å²	95	101.2 Å²	101.2	66%	0.664	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-29.8	178.6	46.2	0	0	0	0	114.5	E740	E740-S742 PolarHBondContact O-N 2.85Å
743	E	78.2	Confident	65.6	Low	98 Å²	98	99 Å²	99	46%	0.458	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-28.9	-170.3	-63.4	165.2	-100.2	0	0	113.1	C741 R758 H761	C741-E743 PolarHBondContact O-N 2.86Å; C741-E743 VanDerWaalsContact O-N 3.08Å; E743-R758 IonicContact OE1-NE 3.56Å; E743-H761 IonicContact OE1-CD2 3.85Å; E743-H761 WeakPolarHBondContact OE2-CB 3.49Å; E743-H761 IonicContact OE2-CD2 3.79Å; E743-H761 IonicContact OE2-CG 2.58Å
744	C	80.3	Confident	68	Low	38 Å²	38	93.7 Å²	93.7	26%	0.257	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	15.3	-179.7	80.8	0	0	0	0	115.3	C741 K746 H757 H761	C741-C744 PolarHBondContact O-N 3.27Å; C744-K746 PolarHBondContact O-N 2.98Å; C744-H757 PolarHBondContact SG-NE2 2.78Å; C744-H761 WeakPolarHBondContact CB-CE1 3.38Å; C744-H761 PolarHBondContact SG-CE1 2.96Å; C744-H761 PolarHBondContact SG-NE2 3.17Å
745	K	78.7	Confident	70.4	Confident	157 Å²	157	93.3 Å²	93.3	68%	0.683	45%	0.45	S	S	*	.			trans	53.8	21.5	173	-53.2	-167	179	179.9	0	116	E740 C741	E740-K745 HydrophobicContact CG-CB 4.47Å; E740-K745 VanDerWaalsContact OE1-CB 3.29Å; E740-K745 WeakPolarHBondContact OE1-CB 3.5Å; E740-K745 VanDerWaalsContact OE1-CG 3.31Å; E740-K745 WeakPolarHBondContact OE1-CG 3.2Å; C741-K745 VanDerWaalsContact O-CA 3.25Å; C741-K745 WeakPolarHBondContact O-CA 3.44Å; C741-K745 PolarHBondContact O-N 3.3Å
746	K	73.3	Confident	72.5	Confident	118 Å²	118	83.8 Å²	83.8	51%	0.513	42%	0.419	S	S	.	.			trans	-78.2	133.8	175.3	-72.9	177.1	-171.2	171.7	0	109.6	C741 C744 F748	C741-K746 PolarHBondContact N-O 2.85Å; C744-K746 PolarHBondContact O-N 2.98Å; K746-F748 HydrophobicContact CB-CE2 3.6Å; K746-F748 HydrophobicContact CB-CZ 3.94Å; K746-F748 VanDerWaalsContact O-CD2 3.28Å; K746-F748 WeakPolarHBondContact O-CD2 3.41Å; K746-F748 VanDerWaalsContact O-CE2 3.31Å; K746-F748 WeakPolarHBondContact O-CE2 3.28Å
747	L	73.3	Confident	74.3	Confident	119 Å²	119	75.8 Å²	75.8	62%	0.623	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	132	179.7	-63.4	175.8	0	0	0	111.1	E740	E740-L747 HydrophobicContact CB-CD2 3.81Å; E740-L747 HydrophobicContact CG-CD2 4.02Å
748	F	76.5	Confident	75.8	Confident	40 Å²	40	68.5 Å²	68.5	18%	0.175	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.9	-179.7	-68	-84.5	0	0	0	111.4	L739 C741 K746 L754 H757	L739-F748 PolarHBondContact N-O 3.12Å; L739-F748 PolarHBondContact O-N 2.81Å; C741-F748 HydrophobicContact CB-CE2 4.07Å; K746-F748 HydrophobicContact CB-CE2 3.6Å; K746-F748 HydrophobicContact CB-CZ 3.94Å; K746-F748 VanDerWaalsContact O-CD2 3.28Å; K746-F748 WeakPolarHBondContact O-CD2 3.41Å; K746-F748 VanDerWaalsContact O-CE2 3.31Å; K746-F748 WeakPolarHBondContact O-CE2 3.28Å; F748-L754 HydrophobicContact CB-CB 4.03Å; F748-L754 HydrophobicContact CD2-CB 4.18Å; F748-L754 HydrophobicContact CD2-CD1 3.77Å; F748-L754 HydrophobicContact CE2-CD1 4.16Å; F748-L754 HydrophobicContact CG-CB 4.13Å; F748-H757 HydrophobicContact CE1-CB 3.76Å; F748-H757 AromaticContact CE1-CG 3.93Å; F748-H757 HydrophobicContact CE2-CB 4.09Å; F748-H757 AromaticContact CE2-CD2 3.24Å; F748-H757 WeakPolarHBondContact CE2-CD2 3.46Å; F748-H757 AromaticContact CE2-CG 3.7Å; F748-H757 AromaticContact CE2-NE2 3.91Å; F748-H757 HydrophobicContact CZ-CB 3.52Å; F748-H757 AromaticContact CZ-CD2 3.24Å; F748-H757 WeakPolarHBondContact CZ-CD2 3.46Å; F748-H757 AromaticContact CZ-CG 3.19Å; F748-H757 AromaticContact CZ-ND1 3.79Å; F748-H757 AromaticContact CZ-NE2 3.85Å
749	S	66.1	Low	77	Confident	49 Å²	49	69.3 Å²	69.3	34%	0.343	36%	0.355	S	S	.	.	S	Bend	trans	-81.8	-15.6	-179.3	58.7	0	0	0	0	113.5
750	T	70.5	Confident	77.4	Confident	32 Å²	32	70.2 Å²	70.2	20%	0.196	36%	0.359	C	S	.	.	S	Bend	trans	-145.5	147.3	179.9	63.4	0	0	0	0	112	T752 S753 L754	T750-T752 VanDerWaalsContact C-N 3.28Å; T750-T752 PolarHBondContact O-N 3.35Å; T750-T752 PolarHBondContact OG1-OG1 3.26Å; T750-S753 PolarHBondContact N-OG 3.37Å; T750-S753 PolarHBondContact O-N 3.44Å; T750-S753 VanDerWaalsContact O-N 3.11Å; T750-S753 PolarHBondContact O-OG 2.93Å; T750-S753 WeakPolarHBondContact OG1-CB 3.39Å; T750-S753 PolarHBondContact OG1-N 3.12Å; T750-S753 PolarHBondContact OG1-OG 3.47Å; T750-L754 PolarHBondContact O-N 2.86Å; T750-L754 VanDerWaalsContact O-N 3.09Å
751	E	74.7	Confident	77.4	Confident	87 Å²	87	69 Å²	69	41%	0.407	35%	0.353	S	S	.	.	H	α-helix	trans	-59.5	-38.7	177.2	-178	57.5	-152.7	0	0	112	L739 S753 L754 Q755	L739-E751 HydrophobicContact CD1-CB 3.96Å; L739-E751 VanDerWaalsContact CD1-N 3.29Å; E751-S753 VanDerWaalsContact C-N 3.32Å; E751-S753 PolarHBondContact O-N 3.27Å; E751-L754 PolarHBondContact O-N 2.87Å; E751-Q755 HydrophobicContact CG-CG 4.29Å; E751-Q755 WeakPolarHBondContact O-CB 3.33Å; E751-Q755 VanDerWaalsContact O-CG 3.29Å; E751-Q755 WeakPolarHBondContact O-CG 3.5Å; E751-Q755 PolarHBondContact O-N 3.08Å; E751-Q755 WeakPolarHBondContact OE1-CG 3.27Å; E751-Q755 PolarHBondContact OE1-NE2 2.95Å
752	T	75.1	Confident	77.3	Confident	103 Å²	103	71.9 Å²	71.9	63%	0.632	37%	0.371	S	S	*	.	H	α-helix	trans	-61.4	-38.9	175.7	46.6	0	0	0	0	112.3	T750 V756	T750-T752 VanDerWaalsContact C-N 3.28Å; T750-T752 PolarHBondContact O-N 3.35Å; T750-T752 PolarHBondContact OG1-OG1 3.26Å; T752-V756 WeakPolarHBondContact O-CB 3.45Å; T752-V756 VanDerWaalsContact O-CG2 3.31Å; T752-V756 WeakPolarHBondContact O-CG2 3.2Å; T752-V756 PolarHBondContact O-N 2.84Å
753	S	77.4	Confident	77.3	Confident	37 Å²	37	69.1 Å²	69.1	26%	0.259	36%	0.358	S	S	.	.	H	α-helix	trans	-69.8	-35.2	174.1	63.8	0	0	0	0	113.2	T750 E751 H757	T750-S753 PolarHBondContact N-OG 3.37Å; T750-S753 PolarHBondContact O-N 3.44Å; T750-S753 VanDerWaalsContact O-N 3.11Å; T750-S753 PolarHBondContact O-OG 2.93Å; T750-S753 WeakPolarHBondContact OG1-CB 3.39Å; T750-S753 PolarHBondContact OG1-N 3.12Å; T750-S753 PolarHBondContact OG1-OG 3.47Å; E751-S753 VanDerWaalsContact C-N 3.32Å; E751-S753 PolarHBondContact O-N 3.27Å; S753-H757 VanDerWaalsContact O-CB 3.27Å; S753-H757 WeakPolarHBondContact O-CB 3.21Å; S753-H757 PolarHBondContact O-N 3.32Å
754	L	79.3	Confident	77.4	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-46.9	173	173.3	58.2	0	0	0	111.6	L739 C741 F748 T750 E751 V756 H757 R758	L739-L754 HydrophobicContact CB-CD2 3.95Å; C741-L754 HydrophobicContact CB-CD1 3.62Å; F748-L754 HydrophobicContact CB-CB 4.03Å; F748-L754 HydrophobicContact CD2-CB 4.18Å; F748-L754 HydrophobicContact CD2-CD1 3.77Å; F748-L754 HydrophobicContact CE2-CD1 4.16Å; F748-L754 HydrophobicContact CG-CB 4.13Å; T750-L754 PolarHBondContact O-N 2.86Å; T750-L754 VanDerWaalsContact O-N 3.09Å; E751-L754 PolarHBondContact O-N 2.87Å; L754-V756 PolarHBondContact O-N 3Å; L754-H757 CarbonylContact O-C 3.5Å; L754-H757 WeakPolarHBondContact O-CA 3.19Å; L754-H757 WeakPolarHBondContact O-CB 3.49Å; L754-H757 PolarHBondContact O-N 3.02Å; L754-H757 VanDerWaalsContact O-N 3.09Å; L754-R758 HydrophobicContact CD1-CG 4.17Å; L754-R758 WeakPolarHBondContact O-CG 3.49Å; L754-R758 PolarHBondContact O-N 3.37Å
755	Q	79.7	Confident	77.6	Confident	85 Å²	85	74 Å²	74	40%	0.397	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-44.3	177.9	-69.1	-69.3	-20	0	0	112	E751 H757 R758 R759	E751-Q755 HydrophobicContact CG-CG 4.29Å; E751-Q755 WeakPolarHBondContact O-CB 3.33Å; E751-Q755 VanDerWaalsContact O-CG 3.29Å; E751-Q755 WeakPolarHBondContact O-CG 3.5Å; E751-Q755 PolarHBondContact O-N 3.08Å; E751-Q755 WeakPolarHBondContact OE1-CG 3.27Å; E751-Q755 PolarHBondContact OE1-NE2 2.95Å; Q755-H757 VanDerWaalsContact C-N 3.27Å; Q755-H757 PolarHBondContact O-N 2.96Å; Q755-R758 PolarHBondContact O-N 3.11Å; Q755-R759 PolarHBondContact O-N 3.18Å
756	V	80.5	Confident	77.7	Confident	47 Å²	47	69.3 Å²	69.3	29%	0.285	36%	0.356	S	S	.	.	H	α-helix	trans	-65.5	-30.7	174.3	169.4	0	0	0	0	112	T752 L754 Q778	T752-V756 WeakPolarHBondContact O-CB 3.45Å; T752-V756 VanDerWaalsContact O-CG2 3.31Å; T752-V756 WeakPolarHBondContact O-CG2 3.2Å; T752-V756 PolarHBondContact O-N 2.84Å; L754-V756 PolarHBondContact O-N 3Å; V756-Q778 HydrophobicContact CG1-CG 3.66Å; V756-Q778 VanDerWaalsContact CG1-NE2 3.29Å
757	H	81.6	Confident	78.4	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-71.6	-39.6	172.3	172	60.1	0	0	0	112.9	C744 F748 S753 L754 Q755 R759 I760 H761	C744-H757 PolarHBondContact SG-NE2 2.78Å; F748-H757 HydrophobicContact CE1-CB 3.76Å; F748-H757 AromaticContact CE1-CG 3.93Å; F748-H757 HydrophobicContact CE2-CB 4.09Å; F748-H757 AromaticContact CE2-CD2 3.24Å; F748-H757 WeakPolarHBondContact CE2-CD2 3.46Å; F748-H757 AromaticContact CE2-CG 3.7Å; F748-H757 AromaticContact CE2-NE2 3.91Å; F748-H757 HydrophobicContact CZ-CB 3.52Å; F748-H757 AromaticContact CZ-CD2 3.24Å; F748-H757 WeakPolarHBondContact CZ-CD2 3.46Å; F748-H757 AromaticContact CZ-CG 3.19Å; F748-H757 AromaticContact CZ-ND1 3.79Å; F748-H757 AromaticContact CZ-NE2 3.85Å; S753-H757 VanDerWaalsContact O-CB 3.27Å; S753-H757 WeakPolarHBondContact O-CB 3.21Å; S753-H757 PolarHBondContact O-N 3.32Å; L754-H757 CarbonylContact O-C 3.5Å; L754-H757 WeakPolarHBondContact O-CA 3.19Å; L754-H757 WeakPolarHBondContact O-CB 3.49Å; L754-H757 PolarHBondContact O-N 3.02Å; L754-H757 VanDerWaalsContact O-N 3.09Å; Q755-H757 VanDerWaalsContact C-N 3.27Å; Q755-H757 PolarHBondContact O-N 2.96Å; H757-R759 PolarHBondContact O-N 2.81Å; H757-I760 WeakPolarHBondContact O-CB 3.41Å; H757-I760 WeakPolarHBondContact O-CG1 3.42Å; H757-I760 PolarHBondContact O-N 3.24Å; H757-H761 AromaticContact CD2-NE2 3.43Å; H757-H761 PolarHBondContact CD2-NE2 2.82Å; H757-H761 AromaticContact CE1-NE2 3.28Å; H757-H761 PolarHBondContact CE1-NE2 3.12Å; H757-H761 VanDerWaalsContact CE1-NE2 3.28Å; H757-H761 AromaticContact NE2-NE2 2.56Å; H757-H761 PolarHBondContact NE2-NE2 3.25Å
758	R	81.3	Confident	79	Confident	90 Å²	90	65.4 Å²	65.4	34%	0.34	34%	0.34	S	S	.	.	H	α-helix	trans	-58.7	-30	178.5	-74.7	-175.7	70.3	-141.7	0.2	113.2	E743 L754 Q755 I760 H761 T762	E743-R758 IonicContact OE1-NE 3.56Å; L754-R758 HydrophobicContact CD1-CG 4.17Å; L754-R758 WeakPolarHBondContact O-CG 3.49Å; L754-R758 PolarHBondContact O-N 3.37Å; Q755-R758 PolarHBondContact O-N 3.11Å; R758-I760 PolarHBondContact O-N 2.74Å; R758-I760 VanDerWaalsContact O-N 3.08Å; R758-H761 WeakPolarHBondContact O-CA 3.49Å; R758-H761 PolarHBondContact O-N 2.75Å; R758-T762 PolarHBondContact O-N 2.84Å; R758-T762 PolarHBondContact O-OG1 3.44Å
759	R	85.1	Confident	79.5	Confident	52 Å²	52	63.6 Å²	63.6	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-16.2	170.6	-62.8	-176.4	178.7	167.1	0.3	114.7	Q755 H757 G763 E764 R777	Q755-R759 PolarHBondContact O-N 3.18Å; H757-R759 PolarHBondContact O-N 2.81Å; R759-G763 PolarHBondContact O-N 3.16Å; R759-E764 HydrophobicContact CB-CB 4.19Å; R759-E764 HydrophobicContact CG-CB 3.96Å; R759-E764 IonicContact NE-OE2 3.67Å; R759-R777 HydrophobicContact CB-CB 4.43Å; R759-R777 HydrophobicContact CB-CG 4.5Å; R759-R777 PolarHBondContact NH1-O 3.23Å; R759-R777 VanDerWaalsContact NH1-O 3.1Å; R759-R777 WeakPolarHBondContact O-CD 3.38Å; R759-R777 PolarHBondContact O-NE 3.06Å; R759-R777 PolarHBondContact O-NH2 2.88Å
760	I	79.6	Confident	80.2	Confident	90 Å²	90	66.1 Å²	66.1	46%	0.462	35%	0.348	S	S	.	.	H	α-helix	trans	-69.9	-43.2	170.2	-62.1	176.4	0	0	0	109.9	H757 R758 R777	H757-I760 WeakPolarHBondContact O-CB 3.41Å; H757-I760 WeakPolarHBondContact O-CG1 3.42Å; H757-I760 PolarHBondContact O-N 3.24Å; R758-I760 PolarHBondContact O-N 2.74Å; R758-I760 VanDerWaalsContact O-N 3.08Å; I760-R777 PolarHBondContact O-NH2 3.2Å
761	H	78.2	Confident	80.6	Confident	77 Å²	77	67.9 Å²	67.9	36%	0.356	36%	0.356	S	S	.	.	H	α-helix	trans	-77.8	-49.7	179.1	-52.9	-58.9	0	0	0	112.3	C741 E743 C744 H757 R758 G763	C741-H761 PolarHBondContact SG-NE2 2.74Å; E743-H761 IonicContact OE1-CD2 3.85Å; E743-H761 WeakPolarHBondContact OE2-CB 3.49Å; E743-H761 IonicContact OE2-CD2 3.79Å; E743-H761 IonicContact OE2-CG 2.58Å; C744-H761 WeakPolarHBondContact CB-CE1 3.38Å; C744-H761 PolarHBondContact SG-CE1 2.96Å; C744-H761 PolarHBondContact SG-NE2 3.17Å; H757-H761 AromaticContact CD2-NE2 3.43Å; H757-H761 PolarHBondContact CD2-NE2 2.82Å; H757-H761 AromaticContact CE1-NE2 3.28Å; H757-H761 PolarHBondContact CE1-NE2 3.12Å; H757-H761 VanDerWaalsContact CE1-NE2 3.28Å; H757-H761 AromaticContact NE2-NE2 2.56Å; H757-H761 PolarHBondContact NE2-NE2 3.25Å; R758-H761 WeakPolarHBondContact O-CA 3.49Å; R758-H761 PolarHBondContact O-N 2.75Å; H761-G763 PolarHBondContact O-N 2.89Å; H761-G763 VanDerWaalsContact O-N 3.07Å
762	T	75.6	Confident	81.1	Confident	62 Å²	62	65.8 Å²	65.8	38%	0.38	35%	0.351	S	S	.	.	S	Bend	trans	-72.1	-0.4	-179.2	64	0	0	0	0	114.3	R758 E764	R758-T762 PolarHBondContact O-N 2.84Å; R758-T762 PolarHBondContact O-OG1 3.44Å; T762-E764 WeakPolarHBondContact CB-OE1 3.41Å; T762-E764 PolarHBondContact O-N 3.27Å; T762-E764 VanDerWaalsContact OG1-CD 3.27Å; T762-E764 WeakPolarHBondContact OG1-CG 3.44Å; T762-E764 PolarHBondContact OG1-OE1 3.36Å
763	G	79.1	Confident	81.3	Confident	37 Å²	37	63.5 Å²	63.5	38%	0.381	35%	0.348	S	S	.	.			trans	70.8	-19.1	-178	0	0	0	0	0	115.6	R759 H761 R765	R759-G763 PolarHBondContact O-N 3.16Å; H761-G763 PolarHBondContact O-N 2.89Å; H761-G763 VanDerWaalsContact O-N 3.07Å; G763-R765 WeakPolarHBondContact O-CG 3.49Å; G763-R765 PolarHBondContact O-N 3.3Å
764	E	80.6	Confident	81.6	Confident	93 Å²	93	67.6 Å²	67.6	44%	0.435	36%	0.361	S	S	.	.			trans	-43.3	126	-174.8	-79.6	169.2	-119	0	0	114.7	R759 T762 P766 R777	R759-E764 HydrophobicContact CB-CB 4.19Å; R759-E764 HydrophobicContact CG-CB 3.96Å; R759-E764 IonicContact NE-OE2 3.67Å; T762-E764 WeakPolarHBondContact CB-OE1 3.41Å; T762-E764 PolarHBondContact O-N 3.27Å; T762-E764 VanDerWaalsContact OG1-CD 3.27Å; T762-E764 WeakPolarHBondContact OG1-CG 3.44Å; T762-E764 PolarHBondContact OG1-OE1 3.36Å; E764-P766 HydrophobicContact CB-CG 4.37Å; E764-R777 WeakPolarHBondContact O-CG 3.18Å
765	R	83.4	Confident	82	Confident	144 Å²	144	68 Å²	68	54%	0.543	37%	0.367	S	S	.	.			trans	-127.3	72.2	176.3	-69.3	159.6	86.4	156.3	3.1	110.5	G763 Y767 A775 F776 R777	G763-R765 WeakPolarHBondContact O-CG 3.49Å; G763-R765 PolarHBondContact O-N 3.3Å; R765-Y767 PolarHBondContact O-N 3.38Å; R765-A775 HydrophobicContact CB-CB 3.62Å; R765-A775 VanDerWaalsContact CZ-O 3.29Å; R765-A775 PolarHBondContact NE-O 2.81Å; R765-A775 PolarHBondContact NH2-O 3.32Å; R765-F776 CarbonylContact C-O 3.6Å; R765-F776 WeakPolarHBondContact CA-O 3.45Å; R765-R777 HydrophobicContact CG-CG 3.88Å
766	P	81.6	Confident	82.2	Confident	59 Å²	59	66 Å²	66	38%	0.383	36%	0.357	S	S	.	.			trans	-72.7	8.9	-166.7	-19.9	35.9	0	0	0	116.2	E764	E764-P766 HydrophobicContact CB-CG 4.37Å
767	Y	87.7	Confident	82.3	Confident	76 Å²	76	67.9 Å²	67.9	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	79.1	-176.6	-53.4	-69.2	0	0	0	109.6	R765 A775 F776 S779	R765-Y767 PolarHBondContact O-N 3.38Å; Y767-A775 WeakPolarHBondContact O-CA 3.15Å; Y767-F776 WeakPolarHBondContact CD2-O 3.38Å; Y767-F776 PolarHBondContact N-O 3.22Å; Y767-F776 PolarHBondContact O-N 3.18Å; Y767-S779 VanDerWaalsContact CD2-N 3.27Å
768	P	85.8	Confident	82.3	Confident	79 Å²	79	70.2 Å²	70.2	51%	0.513	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	147.5	170.7	28.4	-34.6	0	0	0	111.2	L782	P768-L782 WeakPolarHBondContact O-CD2 3.18Å
769	C	86.6	Confident	82.4	Confident	2 Å²	2	69 Å²	69	1%	0.014	38%	0.375	C	S	.	.			trans	-83.7	121.4	168	-164.2	0	0	0	0	108.9	D771 G773 K774 L782 H785	C769-D771 PolarHBondContact O-N 3.38Å; C769-D771 PolarHBondContact SG-OD2 3.18Å; C769-G773 VanDerWaalsContact O-CA 3.27Å; C769-G773 WeakPolarHBondContact O-CA 3.46Å; C769-G773 PolarHBondContact O-N 3.28Å; C769-K774 VanDerWaalsContact CB-O 3.26Å; C769-K774 WeakPolarHBondContact CB-O 3.42Å; C769-K774 PolarHBondContact N-O 3.26Å; C769-L782 HydrophobicContact CB-CD1 3.7Å; C769-H785 VanDerWaalsContact SG-CD2 3.55Å
770	P	80.1	Confident	82.2	Confident	103 Å²	103	70 Å²	70	67%	0.669	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-33.2	177	27	-32.7	0	0	0	110.8	C772	P770-C772 VanDerWaalsContact C-N 3.32Å; P770-C772 PolarHBondContact O-N 3.21Å
771	D	80.8	Confident	82.3	Confident	68 Å²	68	70.2 Å²	70.2	36%	0.364	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.1	-171.4	-24.2	-81.2	0	0	0	113.6	C769 R786 H789	C769-D771 PolarHBondContact O-N 3.38Å; C769-D771 PolarHBondContact SG-OD2 3.18Å; D771-R786 IonicContact OD1-CZ 3.28Å; D771-R786 IonicContact OD1-NE 3.58Å; D771-R786 IonicContact OD1-NH2 3.92Å; D771-R786 PolarHBondContact OD1-NH2 2.93Å; D771-R786 WeakPolarHBondContact OD2-CG 3.48Å; D771-R786 IonicContact OD2-CZ 3.55Å; D771-R786 IonicContact OD2-NE 3.97Å; D771-R786 PolarHBondContact OD2-NE 3.4Å; D771-R786 IonicContact OD2-NH2 3.77Å; D771-R786 PolarHBondContact OD2-NH2 2.83Å; D771-H789 HydrophobicContact CB-CB 4.37Å; D771-H789 IonicContact OD2-CD2 3.47Å
772	C	84.7	Confident	82.7	Confident	43 Å²	43	67.8 Å²	67.8	29%	0.291	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-165.6	18.8	176.6	70	0	0	0	0	116.5	P770 K774 H785 H789	P770-C772 VanDerWaalsContact C-N 3.32Å; P770-C772 PolarHBondContact O-N 3.21Å; C772-K774 PolarHBondContact O-N 2.92Å; C772-H785 PolarHBondContact SG-NE2 3.03Å; C772-H789 WeakPolarHBondContact CB-NE2 3.47Å; C772-H789 PolarHBondContact SG-NE2 2.78Å
773	G	79.4	Confident	83	Confident	55 Å²	55	71.4 Å²	71.4	57%	0.567	39%	0.386	S	S	*	.			trans	68.5	-23.1	-179.2	0	0	0	0	0	116.8	C769 A775	C769-G773 VanDerWaalsContact O-CA 3.27Å; C769-G773 WeakPolarHBondContact O-CA 3.46Å; C769-G773 PolarHBondContact O-N 3.28Å; G773-A775 PolarHBondContact O-N 3.19Å; G773-A775 VanDerWaalsContact O-N 3.13Å
774	K	83.9	Confident	83.1	Confident	123 Å²	123	71.9 Å²	71.9	54%	0.535	38%	0.38	S	S	.	.			trans	-57.2	117.6	-171.7	-72.7	170.5	-174	140.9	0	112.1	C769 C772 F776	C769-K774 VanDerWaalsContact CB-O 3.26Å; C769-K774 WeakPolarHBondContact CB-O 3.42Å; C769-K774 PolarHBondContact N-O 3.26Å; C772-K774 PolarHBondContact O-N 2.92Å; K774-F776 HydrophobicContact CB-CE2 4.15Å; K774-F776 HydrophobicContact CB-CZ 4.39Å; K774-F776 VanDerWaalsContact O-CD2 3.29Å; K774-F776 WeakPolarHBondContact O-CD2 3.33Å; K774-F776 WeakPolarHBondContact O-CE2 3.48Å
775	A	86.4	Confident	83.2	Confident	26 Å²	26	68.7 Å²	68.7	22%	0.215	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	145.8	-174.2	0	0	0	0	0	114	R765 Y767 G773	R765-A775 HydrophobicContact CB-CB 3.62Å; R765-A775 VanDerWaalsContact CZ-O 3.29Å; R765-A775 PolarHBondContact NE-O 2.81Å; R765-A775 PolarHBondContact NH2-O 3.32Å; Y767-A775 WeakPolarHBondContact O-CA 3.15Å; G773-A775 PolarHBondContact O-N 3.19Å; G773-A775 VanDerWaalsContact O-N 3.13Å
776	F	85.4	Confident	83.1	Confident	42 Å²	42	66.6 Å²	66.6	18%	0.184	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.3	-176.4	-62.6	-89	0	0	0	112.8	R765 Y767 K774 Q778 H781 L782 H785	R765-F776 CarbonylContact C-O 3.6Å; R765-F776 WeakPolarHBondContact CA-O 3.45Å; Y767-F776 WeakPolarHBondContact CD2-O 3.38Å; Y767-F776 PolarHBondContact N-O 3.22Å; Y767-F776 PolarHBondContact O-N 3.18Å; K774-F776 HydrophobicContact CB-CE2 4.15Å; K774-F776 HydrophobicContact CB-CZ 4.39Å; K774-F776 VanDerWaalsContact O-CD2 3.29Å; K774-F776 WeakPolarHBondContact O-CD2 3.33Å; K774-F776 WeakPolarHBondContact O-CE2 3.48Å; F776-Q778 VanDerWaalsContact C-N 3.3Å; F776-Q778 PolarHBondContact O-N 2.99Å; F776-H781 HydrophobicContact CB-CB 4.25Å; F776-H781 HydrophobicContact CD1-CB 3.78Å; F776-H781 HydrophobicContact CG-CB 4.25Å; F776-L782 HydrophobicContact CB-CB 4.35Å; F776-L782 HydrophobicContact CD2-CB 4Å; F776-L782 HydrophobicContact CD2-CD1 4.08Å; F776-L782 HydrophobicContact CE2-CD1 4.32Å; F776-L782 HydrophobicContact CG-CB 4.36Å; F776-H785 HydrophobicContact CE1-CB 4.19Å; F776-H785 HydrophobicContact CE2-CB 3.93Å; F776-H785 AromaticContact CE2-CD2 3.25Å; F776-H785 WeakPolarHBondContact CE2-CD2 3.25Å; F776-H785 AromaticContact CE2-CG 3.69Å; F776-H785 HydrophobicContact CZ-CB 3.59Å; F776-H785 AromaticContact CZ-CD2 3.38Å; F776-H785 WeakPolarHBondContact CZ-CD2 3.34Å; F776-H785 AromaticContact CZ-CG 3.37Å
777	R	81.6	Confident	83.2	Confident	86 Å²	86	65.3 Å²	65.3	33%	0.325	34%	0.344	S	S	.	.	S	Bend	trans	-73.5	-20.6	176.8	-59.7	-173.6	158.9	126	-11.3	113.4	R759 I760 E764 R765	R759-R777 HydrophobicContact CB-CB 4.43Å; R759-R777 HydrophobicContact CB-CG 4.5Å; R759-R777 PolarHBondContact NH1-O 3.23Å; R759-R777 VanDerWaalsContact NH1-O 3.1Å; R759-R777 WeakPolarHBondContact O-CD 3.38Å; R759-R777 PolarHBondContact O-NE 3.06Å; R759-R777 PolarHBondContact O-NH2 2.88Å; I760-R777 PolarHBondContact O-NH2 3.2Å; E764-R777 WeakPolarHBondContact O-CG 3.18Å; R765-R777 HydrophobicContact CG-CG 3.88Å
778	Q	82.1	Confident	82.6	Confident	68 Å²	68	67.3 Å²	67.3	32%	0.318	36%	0.36	S	S	.	.	S	Bend	trans	-137	143	-177.7	-58.5	-177.7	22.1	0	0	110.9	V756 F776 T780 H781 L782	V756-Q778 HydrophobicContact CG1-CG 3.66Å; V756-Q778 VanDerWaalsContact CG1-NE2 3.29Å; F776-Q778 VanDerWaalsContact C-N 3.3Å; F776-Q778 PolarHBondContact O-N 2.99Å; Q778-T780 VanDerWaalsContact C-N 3.31Å; Q778-T780 WeakPolarHBondContact CB-OG1 3.05Å; Q778-T780 PolarHBondContact O-N 3.31Å; Q778-T780 PolarHBondContact OE1-OG1 3.43Å; Q778-H781 PolarHBondContact O-N 3.01Å; Q778-L782 PolarHBondContact O-N 3.25Å
779	S	83	Confident	82.2	Confident	64 Å²	64	68.2 Å²	68.2	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-71.4	-23.7	179.6	51.3	0	0	0	0	113.5	Y767 L782 K783	Y767-S779 VanDerWaalsContact CD2-N 3.27Å; S779-L782 PolarHBondContact O-N 3.34Å; S779-K783 PolarHBondContact O-N 3.41Å
780	T	79.8	Confident	81.7	Confident	74 Å²	74	71.6 Å²	71.6	45%	0.454	38%	0.378	S	S	.	.	H	α-helix	trans	-58.5	-50.7	168.3	40.5	0	0	0	0	111.3	Q778 L782 K783 D784	Q778-T780 VanDerWaalsContact C-N 3.31Å; Q778-T780 WeakPolarHBondContact CB-OG1 3.05Å; Q778-T780 PolarHBondContact O-N 3.31Å; Q778-T780 PolarHBondContact OE1-OG1 3.43Å; T780-L782 VanDerWaalsContact C-N 3.33Å; T780-L782 PolarHBondContact O-N 3.34Å; T780-K783 PolarHBondContact O-N 2.99Å; T780-K783 VanDerWaalsContact O-N 3.12Å; T780-D784 PolarHBondContact O-N 3.12Å
781	H	83	Confident	81.5	Confident	93 Å²	93	69.1 Å²	69.1	43%	0.431	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-35.8	179.2	-58.8	162.9	0	0	0	112.1	F776 Q778 H785	F776-H781 HydrophobicContact CB-CB 4.25Å; F776-H781 HydrophobicContact CD1-CB 3.78Å; F776-H781 HydrophobicContact CG-CB 4.25Å; Q778-H781 PolarHBondContact O-N 3.01Å; H781-H785 WeakPolarHBondContact O-CB 3.5Å; H781-H785 PolarHBondContact O-N 2.97Å
782	L	85.3	Confident	81.2	Confident	27 Å²	27	70.5 Å²	70.5	14%	0.141	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-47.9	169.5	171.5	59.9	0	0	0	111.1	P768 C769 F776 Q778 S779 T780 D784 H785 R786	P768-L782 WeakPolarHBondContact O-CD2 3.18Å; C769-L782 HydrophobicContact CB-CD1 3.7Å; F776-L782 HydrophobicContact CB-CB 4.35Å; F776-L782 HydrophobicContact CD2-CB 4Å; F776-L782 HydrophobicContact CD2-CD1 4.08Å; F776-L782 HydrophobicContact CE2-CD1 4.32Å; F776-L782 HydrophobicContact CG-CB 4.36Å; Q778-L782 PolarHBondContact O-N 3.25Å; S779-L782 PolarHBondContact O-N 3.34Å; T780-L782 VanDerWaalsContact C-N 3.33Å; T780-L782 PolarHBondContact O-N 3.34Å; L782-D784 PolarHBondContact O-N 2.81Å; L782-H785 WeakPolarHBondContact O-CB 3.43Å; L782-H785 PolarHBondContact O-N 3.38Å; L782-H785 VanDerWaalsContact O-N 3.16Å; L782-R786 HydrophobicContact CD1-CG 3.9Å; L782-R786 HydrophobicContact CG-CG 4.45Å; L782-R786 WeakPolarHBondContact O-CG 3.33Å; L782-R786 PolarHBondContact O-N 2.83Å
783	K	82.6	Confident	80.9	Confident	137 Å²	137	76.2 Å²	76.2	60%	0.596	39%	0.391	S	S	*	.	H	α-helix	trans	-63.1	-42.3	-179.7	-175.7	167.7	-176.5	169.4	0	112.7	S779 T780 H785 R786	S779-K783 PolarHBondContact O-N 3.41Å; T780-K783 PolarHBondContact O-N 2.99Å; T780-K783 VanDerWaalsContact O-N 3.12Å; K783-H785 VanDerWaalsContact C-N 3.28Å; K783-H785 PolarHBondContact O-N 2.88Å; K783-R786 PolarHBondContact O-N 3.46Å
784	D	81	Confident	80.8	Confident	47 Å²	47	77.2 Å²	77.2	25%	0.251	39%	0.387	S	S	.	.	H	α-helix	trans	-68.9	-27.9	175.9	-71.2	-26	0	0	0	112.2	T780 L782 R787 I806	T780-D784 PolarHBondContact O-N 3.12Å; L782-D784 PolarHBondContact O-N 2.81Å; D784-R787 IonicContact OD1-CZ 3.54Å; D784-R787 IonicContact OD1-NH1 3.74Å; D784-R787 PolarHBondContact OD1-NH1 3Å; D784-R787 IonicContact OD1-NH2 3.73Å; D784-I806 HydrophobicContact CB-CD1 4.03Å; D784-I806 HydrophobicContact CB-CG1 4.15Å
785	H	83.4	Confident	80.7	Confident	27 Å²	27	74.2 Å²	74.2	13%	0.125	37%	0.374	C	S	.	.	H	α-helix	trans	-73.3	-42.2	172.4	172.6	55.4	0	0	0	113	C769 C772 F776 H781 L782 K783 R787 L788	C769-H785 VanDerWaalsContact SG-CD2 3.55Å; C772-H785 PolarHBondContact SG-NE2 3.03Å; F776-H785 HydrophobicContact CE1-CB 4.19Å; F776-H785 HydrophobicContact CE2-CB 3.93Å; F776-H785 AromaticContact CE2-CD2 3.25Å; F776-H785 WeakPolarHBondContact CE2-CD2 3.25Å; F776-H785 AromaticContact CE2-CG 3.69Å; F776-H785 HydrophobicContact CZ-CB 3.59Å; F776-H785 AromaticContact CZ-CD2 3.38Å; F776-H785 WeakPolarHBondContact CZ-CD2 3.34Å; F776-H785 AromaticContact CZ-CG 3.37Å; H781-H785 WeakPolarHBondContact O-CB 3.5Å; H781-H785 PolarHBondContact O-N 2.97Å; L782-H785 WeakPolarHBondContact O-CB 3.43Å; L782-H785 PolarHBondContact O-N 3.38Å; L782-H785 VanDerWaalsContact O-N 3.16Å; K783-H785 VanDerWaalsContact C-N 3.28Å; K783-H785 PolarHBondContact O-N 2.88Å; H785-R787 PolarHBondContact O-N 3.22Å; H785-L788 VanDerWaalsContact O-CB 3.23Å; H785-L788 WeakPolarHBondContact O-CB 3.27Å; H785-L788 WeakPolarHBondContact O-CG 3.17Å; H785-L788 PolarHBondContact O-N 3.07Å
786	R	81.3	Confident	80.6	Confident	99 Å²	99	75.8 Å²	75.8	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-59.8	-28	179.6	-71.1	-166.3	76.5	-136.8	-0.5	113.4	D771 L782 K783 L788 H789 T790	D771-R786 IonicContact OD1-CZ 3.28Å; D771-R786 IonicContact OD1-NE 3.58Å; D771-R786 IonicContact OD1-NH2 3.92Å; D771-R786 PolarHBondContact OD1-NH2 2.93Å; D771-R786 WeakPolarHBondContact OD2-CG 3.48Å; D771-R786 IonicContact OD2-CZ 3.55Å; D771-R786 IonicContact OD2-NE 3.97Å; D771-R786 PolarHBondContact OD2-NE 3.4Å; D771-R786 IonicContact OD2-NH2 3.77Å; D771-R786 PolarHBondContact OD2-NH2 2.83Å; L782-R786 HydrophobicContact CD1-CG 3.9Å; L782-R786 HydrophobicContact CG-CG 4.45Å; L782-R786 WeakPolarHBondContact O-CG 3.33Å; L782-R786 PolarHBondContact O-N 2.83Å; K783-R786 PolarHBondContact O-N 3.46Å; R786-L788 PolarHBondContact O-N 3.08Å; R786-L788 VanDerWaalsContact O-N 3.16Å; R786-H789 WeakPolarHBondContact O-CB 3.5Å; R786-H789 PolarHBondContact O-N 3.18Å; R786-T790 PolarHBondContact O-N 3.22Å
787	R	82.5	Confident	80.5	Confident	33 Å²	33	73.9 Å²	73.9	13%	0.125	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.9	171	-67	-161.1	-166.9	102.8	11.3	114.7	D784 H785 H789 G791 E792 A805	D784-R787 IonicContact OD1-CZ 3.54Å; D784-R787 IonicContact OD1-NH1 3.74Å; D784-R787 PolarHBondContact OD1-NH1 3Å; D784-R787 IonicContact OD1-NH2 3.73Å; H785-R787 PolarHBondContact O-N 3.22Å; R787-H789 VanDerWaalsContact C-N 3.34Å; R787-G791 CarbonylContact O-C 3.16Å; R787-G791 PolarHBondContact O-N 3.31Å; R787-E792 HydrophobicContact CB-CB 4.01Å; R787-E792 HydrophobicContact CG-CB 3.83Å; R787-E792 IonicContact NE-OE2 2.81Å; R787-E792 PolarHBondContact O-N 2.78Å; R787-A805 HydrophobicContact CB-CB 3.95Å; R787-A805 WeakPolarHBondContact CD-O 3.19Å; R787-A805 PolarHBondContact NH1-O 3.34Å
788	L	76.8	Confident	80.4	Confident	118 Å²	118	78 Å²	78	62%	0.618	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-24.1	172.5	-54.5	179.7	0	0	0	111.9	H785 R786 A805	H785-L788 VanDerWaalsContact O-CB 3.23Å; H785-L788 WeakPolarHBondContact O-CB 3.27Å; H785-L788 WeakPolarHBondContact O-CG 3.17Å; H785-L788 PolarHBondContact O-N 3.07Å; R786-L788 PolarHBondContact O-N 3.08Å; R786-L788 VanDerWaalsContact O-N 3.16Å; L788-A805 HydrophobicContact CD2-CB 4.23Å
789	H	77.4	Confident	80.3	Confident	97 Å²	97	79.3 Å²	79.3	45%	0.449	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-45.2	173.6	-60.2	-60	0	0	0	111.6	D771 C772 R786 R787 G791	D771-H789 HydrophobicContact CB-CB 4.37Å; D771-H789 IonicContact OD2-CD2 3.47Å; C772-H789 WeakPolarHBondContact CB-NE2 3.47Å; C772-H789 PolarHBondContact SG-NE2 2.78Å; R786-H789 WeakPolarHBondContact O-CB 3.5Å; R786-H789 PolarHBondContact O-N 3.18Å; R787-H789 VanDerWaalsContact C-N 3.34Å; H789-G791 PolarHBondContact O-N 2.85Å
790	T	75	Confident	80.2	Confident	74 Å²	74	78.7 Å²	78.7	45%	0.454	41%	0.409	S	S	.	.	S	Bend	trans	-78.2	0.1	-179.9	63.8	0	0	0	0	114.1	R786 E792	R786-T790 PolarHBondContact O-N 3.22Å; T790-E792 PolarHBondContact O-N 3.42Å; T790-E792 WeakPolarHBondContact OG1-CG 3.4Å; T790-E792 PolarHBondContact OG1-OE1 3.25Å; T790-E792 VanDerWaalsContact OG1-OE1 3.12Å
791	G	76.3	Confident	80.1	Confident	51 Å²	51	78 Å²	78	53%	0.526	42%	0.416	S	S	.	.			trans	66.9	-5.4	-175.7	0	0	0	0	0	115.3	R787 H789 R793	R787-G791 CarbonylContact O-C 3.16Å; R787-G791 PolarHBondContact O-N 3.31Å; H789-G791 PolarHBondContact O-N 2.85Å; G791-R793 WeakPolarHBondContact O-CG 3.46Å; G791-R793 PolarHBondContact O-N 3.15Å
792	E	74.6	Confident	80	Confident	96 Å²	96	80 Å²	80	45%	0.449	42%	0.424	S	S	.	.			trans	-51.3	118.3	-176.2	-86.3	177.1	-124.6	0	0	112.6	R787 T790 P794 A805	R787-E792 HydrophobicContact CB-CB 4.01Å; R787-E792 HydrophobicContact CG-CB 3.83Å; R787-E792 IonicContact NE-OE2 2.81Å; R787-E792 PolarHBondContact O-N 2.78Å; T790-E792 PolarHBondContact O-N 3.42Å; T790-E792 WeakPolarHBondContact OG1-CG 3.4Å; T790-E792 PolarHBondContact OG1-OE1 3.25Å; T790-E792 VanDerWaalsContact OG1-OE1 3.12Å; E792-P794 WeakPolarHBondContact O-CD 3.26Å; E792-A805 WeakPolarHBondContact O-CA 3.24Å; E792-A805 WeakPolarHBondContact O-CB 3.27Å
793	R	78.6	Confident	79.9	Confident	164 Å²	164	80 Å²	80	62%	0.619	43%	0.428	S	S	*	.			trans	-122.9	70.2	174.3	-72.4	166.5	173.4	-136.8	15.5	111.8	G791 F795 A803 F804	G791-R793 WeakPolarHBondContact O-CG 3.46Å; G791-R793 PolarHBondContact O-N 3.15Å; R793-F795 PolarHBondContact O-N 3.04Å; R793-A803 HydrophobicContact CB-CB 3.69Å; R793-A803 WeakPolarHBondContact CD-O 3.44Å; R793-A803 PolarHBondContact NH1-O 3.38Å; R793-F804 CarbonylContact C-O 3.47Å; R793-F804 WeakPolarHBondContact CA-O 3.49Å
794	P	77.8	Confident	79.8	Confident	76 Å²	76	75.8 Å²	75.8	49%	0.494	41%	0.409	S	S	.	.			trans	-69.1	-6	-172.8	-18.4	33.4	0	0	0	115	E792	E792-P794 WeakPolarHBondContact O-CD 3.26Å
795	F	81.3	Confident	79.4	Confident	60 Å²	60	74.2 Å²	74.2	26%	0.263	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	80.5	-173.4	-54.5	-72.9	0	0	0	110.2	R793 F804 S807 L810	R793-F795 PolarHBondContact O-N 3.04Å; F795-F804 HydrophobicContact CB-CB 4.49Å; F795-F804 WeakPolarHBondContact CB-O 3.47Å; F795-F804 WeakPolarHBondContact CD2-O 3.47Å; F795-F804 PolarHBondContact N-O 2.98Å; F795-F804 PolarHBondContact O-N 3.43Å; F795-S807 VanDerWaalsContact CD2-N 3.28Å; F795-L810 HydrophobicContact CB-CB 4.07Å; F795-L810 HydrophobicContact CB-CD2 3.85Å
796	A	83.8	Confident	79.1	Confident	58 Å²	58	75.6 Å²	75.6	48%	0.479	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.6	174.2	0	0	0	0	0	112.5	A803 L810	A796-A803 HydrophobicContact CB-CB 4.34Å; A796-L810 VanDerWaalsContact O-CD2 3.28Å; A796-L810 WeakPolarHBondContact O-CD2 3.22Å
797	C	83.3	Confident	79	Confident	3 Å²	3	74 Å²	74	2%	0.02	42%	0.415	C	S	.	.			trans	-96.6	109.6	170.5	-173	0	0	0	0	110.8	V799 C800 G801 K802 L810 H813 H817	C797-V799 PolarHBondContact O-N 3.38Å; C797-C800 PolarHBondContact O-N 3.19Å; C797-G801 WeakPolarHBondContact O-CA 3.09Å; C797-G801 PolarHBondContact O-N 3.25Å; C797-K802 WeakPolarHBondContact CB-O 3.17Å; C797-K802 PolarHBondContact N-O 3.22Å; C797-L810 HydrophobicContact CB-CD1 3.56Å; C797-H813 VanDerWaalsContact SG-CD2 3.57Å; C797-H817 PolarHBondContact SG-NE2 2.9Å
798	E	80.1	Confident	78.7	Confident	171 Å²	171	79.1 Å²	79.1	80%	0.799	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-33.2	178	-65.2	148.7	-176	0	0	113.6
799	V	79.4	Confident	78.8	Confident	97 Å²	97	79.9 Å²	79.9	59%	0.588	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-20.1	-175.5	-174.5	0	0	0	0	113.5	C797 H817	C797-V799 PolarHBondContact O-N 3.38Å; V799-H817 HydrophobicContact CG1-CB 4.21Å
800	C	81.7	Confident	79	Confident	51 Å²	51	76.5 Å²	76.5	35%	0.345	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.3	16.2	-174.2	70	0	0	0	0	115.9	C797 K802 H813 H817	C797-C800 PolarHBondContact O-N 3.19Å; C800-K802 PolarHBondContact O-N 3.34Å; C800-H813 PolarHBondContact SG-NE2 3.12Å; C800-H817 VanDerWaalsContact SG-CE1 3.6Å; C800-H817 PolarHBondContact SG-NE2 2.78Å; C800-H817 VanDerWaalsContact SG-NE2 3.36Å
801	G	77.9	Confident	79.1	Confident	58 Å²	58	75.4 Å²	75.4	60%	0.598	42%	0.42	S	S	*	.			trans	69	-22.5	-179.4	0	0	0	0	0	116.1	C797 A803	C797-G801 WeakPolarHBondContact O-CA 3.09Å; C797-G801 PolarHBondContact O-N 3.25Å; G801-A803 PolarHBondContact O-N 3.01Å; G801-A803 VanDerWaalsContact O-N 3.12Å
802	K	80.1	Confident	79.2	Confident	135 Å²	135	75.4 Å²	75.4	59%	0.587	41%	0.406	S	S	*	.			trans	-58.3	117.7	-170.6	-68.2	-177.6	-178.8	-178.8	0	112	C797 C800 F804	C797-K802 WeakPolarHBondContact CB-O 3.17Å; C797-K802 PolarHBondContact N-O 3.22Å; C800-K802 PolarHBondContact O-N 3.34Å; K802-F804 HydrophobicContact CB-CE2 4.17Å; K802-F804 HydrophobicContact CB-CZ 4.29Å; K802-F804 WeakPolarHBondContact O-CD2 3.37Å; K802-F804 WeakPolarHBondContact O-CE2 3.15Å
803	A	82.8	Confident	79.6	Confident	27 Å²	27	71.9 Å²	71.9	22%	0.223	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.2	-174.2	0	0	0	0	0	113.3	R793 A796 G801	R793-A803 HydrophobicContact CB-CB 3.69Å; R793-A803 WeakPolarHBondContact CD-O 3.44Å; R793-A803 PolarHBondContact NH1-O 3.38Å; A796-A803 HydrophobicContact CB-CB 4.34Å; G801-A803 PolarHBondContact O-N 3.01Å; G801-A803 VanDerWaalsContact O-N 3.12Å
804	F	80.1	Confident	79.6	Confident	49 Å²	49	70.1 Å²	70.1	22%	0.215	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147	-173.4	-58.8	-88.3	0	0	0	111.9	R793 F795 K802 I806 R809 L810 H813	R793-F804 CarbonylContact C-O 3.47Å; R793-F804 WeakPolarHBondContact CA-O 3.49Å; F795-F804 HydrophobicContact CB-CB 4.49Å; F795-F804 WeakPolarHBondContact CB-O 3.47Å; F795-F804 WeakPolarHBondContact CD2-O 3.47Å; F795-F804 PolarHBondContact N-O 2.98Å; F795-F804 PolarHBondContact O-N 3.43Å; K802-F804 HydrophobicContact CB-CE2 4.17Å; K802-F804 HydrophobicContact CB-CZ 4.29Å; K802-F804 WeakPolarHBondContact O-CD2 3.37Å; K802-F804 WeakPolarHBondContact O-CE2 3.15Å; F804-I806 VanDerWaalsContact C-N 3.31Å; F804-I806 PolarHBondContact O-N 3.5Å; F804-R809 HydrophobicContact CB-CB 4.25Å; F804-R809 HydrophobicContact CD1-CB 3.92Å; F804-R809 HydrophobicContact CG-CB 4.26Å; F804-L810 HydrophobicContact CD2-CB 4.01Å; F804-L810 HydrophobicContact CD2-CD1 4.06Å; F804-L810 HydrophobicContact CE2-CD1 4.22Å; F804-H813 HydrophobicContact CE1-CB 4.3Å; F804-H813 HydrophobicContact CE2-CB 3.81Å; F804-H813 AromaticContact CE2-CD2 3.55Å; F804-H813 AromaticContact CE2-CG 3.6Å; F804-H813 HydrophobicContact CZ-CB 3.57Å; F804-H813 AromaticContact CZ-CD2 3.78Å; F804-H813 AromaticContact CZ-CG 3.38Å; F804-H813 AromaticContact CZ-ND1 3.75Å
805	A	74.3	Confident	79.8	Confident	14 Å²	14	69.4 Å²	69.4	12%	0.116	37%	0.371	C	S	.	.	S	Bend	trans	-73.9	-16.8	176.1	0	0	0	0	0	114	R787 L788 E792	R787-A805 HydrophobicContact CB-CB 3.95Å; R787-A805 WeakPolarHBondContact CD-O 3.19Å; R787-A805 PolarHBondContact NH1-O 3.34Å; L788-A805 HydrophobicContact CD2-CB 4.23Å; E792-A805 WeakPolarHBondContact O-CA 3.24Å; E792-A805 WeakPolarHBondContact O-CB 3.27Å
806	I	77.1	Confident	79.7	Confident	57 Å²	57	70.5 Å²	70.5	29%	0.292	38%	0.379	S	S	.	.	S	Bend	trans	-137.9	126.6	-174.3	-51.6	178.3	0	0	0	110.2	D784 F804 M808 R809 L810	D784-I806 HydrophobicContact CB-CD1 4.03Å; D784-I806 HydrophobicContact CB-CG1 4.15Å; F804-I806 VanDerWaalsContact C-N 3.31Å; F804-I806 PolarHBondContact O-N 3.5Å; I806-M808 VanDerWaalsContact C-N 3.26Å; I806-M808 HydrophobicContact CG2-CB 4.29Å; I806-M808 PolarHBondContact O-N 3.14Å; I806-M808 VanDerWaalsContact O-N 3.16Å; I806-R809 WeakPolarHBondContact O-CB 3.49Å; I806-R809 PolarHBondContact O-N 3.22Å; I806-L810 PolarHBondContact O-N 2.71Å
807	S	77.5	Confident	79.4	Confident	66 Å²	66	71.5 Å²	71.5	46%	0.462	37%	0.373	S	S	.	.	H	α-helix	trans	-51	-39.1	-179.3	175.7	0	0	0	0	113.9	F795 R809 L810 A811	F795-S807 VanDerWaalsContact CD2-N 3.28Å; S807-R809 PolarHBondContact O-N 3.22Å; S807-L810 WeakPolarHBondContact O-CB 3.4Å; S807-L810 PolarHBondContact O-N 2.86Å; S807-L810 VanDerWaalsContact O-N 3.11Å; S807-A811 PolarHBondContact O-N 3.41Å
808	M	77.2	Confident	78.9	Confident	139 Å²	139	75.1 Å²	75.1	69%	0.685	40%	0.395	S	S	*	.	H	α-helix	trans	-59.4	-32.3	176.7	-174.1	177	68.5	0	0	113.2	I806 A811 E812	I806-M808 VanDerWaalsContact C-N 3.26Å; I806-M808 HydrophobicContact CG2-CB 4.29Å; I806-M808 PolarHBondContact O-N 3.14Å; I806-M808 VanDerWaalsContact O-N 3.16Å; M808-A811 PolarHBondContact O-N 3.48Å; M808-E812 PolarHBondContact O-N 3.11Å
809	R	78.9	Confident	78.7	Confident	135 Å²	135	69 Å²	69	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-75.2	-35.8	176	-67.5	-58.8	-159.2	164.5	10.4	112.1	F804 I806 S807 A811 E812 H813	F804-R809 HydrophobicContact CB-CB 4.25Å; F804-R809 HydrophobicContact CD1-CB 3.92Å; F804-R809 HydrophobicContact CG-CB 4.26Å; I806-R809 WeakPolarHBondContact O-CB 3.49Å; I806-R809 PolarHBondContact O-N 3.22Å; S807-R809 PolarHBondContact O-N 3.22Å; R809-A811 VanDerWaalsContact C-N 3.33Å; R809-E812 WeakPolarHBondContact CD-OE2 3.36Å; R809-E812 IonicContact CZ-OE2 3.01Å; R809-E812 IonicContact NH1-OE1 3.46Å; R809-E812 IonicContact NH1-OE2 2.77Å; R809-E812 PolarHBondContact NH1-OE2 2.93Å; R809-E812 PolarHBondContact O-N 3.48Å; R809-H813 WeakPolarHBondContact O-CB 3.41Å; R809-H813 PolarHBondContact O-N 3.46Å
810	L	82	Confident	78.5	Confident	25 Å²	25	69 Å²	69	13%	0.131	37%	0.372	C	S	.	.	H	α-helix	trans	-62.1	-42	169.2	174.2	62.1	0	0	0	111	F795 A796 C797 F804 I806 S807 H813 R814	F795-L810 HydrophobicContact CB-CB 4.07Å; F795-L810 HydrophobicContact CB-CD2 3.85Å; A796-L810 VanDerWaalsContact O-CD2 3.28Å; A796-L810 WeakPolarHBondContact O-CD2 3.22Å; C797-L810 HydrophobicContact CB-CD1 3.56Å; F804-L810 HydrophobicContact CD2-CB 4.01Å; F804-L810 HydrophobicContact CD2-CD1 4.06Å; F804-L810 HydrophobicContact CE2-CD1 4.22Å; I806-L810 PolarHBondContact O-N 2.71Å; S807-L810 WeakPolarHBondContact O-CB 3.4Å; S807-L810 PolarHBondContact O-N 2.86Å; S807-L810 VanDerWaalsContact O-N 3.11Å; L810-H813 PolarHBondContact O-N 3.25Å; L810-R814 HydrophobicContact CD1-CG 4.26Å; L810-R814 WeakPolarHBondContact O-CG 3.47Å; L810-R814 PolarHBondContact O-N 3.24Å
811	A	77.1	Confident	78.1	Confident	52 Å²	52	73.2 Å²	73.2	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-64.9	-41.1	176.4	0	0	0	0	0	112.9	S807 M808 R809 H813	S807-A811 PolarHBondContact O-N 3.41Å; M808-A811 PolarHBondContact O-N 3.48Å; R809-A811 VanDerWaalsContact C-N 3.33Å; A811-H813 VanDerWaalsContact C-N 3.33Å
812	E	78.1	Confident	77.9	Confident	50 Å²	50	73.8 Å²	73.8	23%	0.234	37%	0.374	C	S	.	.	H	α-helix	trans	-62.1	-40.5	171.1	-178.6	175.7	-152.7	0	0	111.7	M808 R809 R815 S834	M808-E812 PolarHBondContact O-N 3.11Å; R809-E812 WeakPolarHBondContact CD-OE2 3.36Å; R809-E812 IonicContact CZ-OE2 3.01Å; R809-E812 IonicContact NH1-OE1 3.46Å; R809-E812 IonicContact NH1-OE2 2.77Å; R809-E812 PolarHBondContact NH1-OE2 2.93Å; R809-E812 PolarHBondContact O-N 3.48Å; E812-R815 PolarHBondContact O-N 3.26Å; E812-S834 WeakPolarHBondContact OE1-CB 3.37Å; E812-S834 PolarHBondContact OE1-OG 2.89Å
813	H	82.3	Confident	77.5	Confident	22 Å²	22	71.1 Å²	71.1	10%	0.102	36%	0.361	C	S	.	.	H	α-helix	trans	-69.4	-37.1	178.9	174.2	71.3	0	0	0	113.4	C797 C800 F804 R809 L810 A811 R815 I816 H817	C797-H813 VanDerWaalsContact SG-CD2 3.57Å; C800-H813 PolarHBondContact SG-NE2 3.12Å; F804-H813 HydrophobicContact CE1-CB 4.3Å; F804-H813 HydrophobicContact CE2-CB 3.81Å; F804-H813 AromaticContact CE2-CD2 3.55Å; F804-H813 AromaticContact CE2-CG 3.6Å; F804-H813 HydrophobicContact CZ-CB 3.57Å; F804-H813 AromaticContact CZ-CD2 3.78Å; F804-H813 AromaticContact CZ-CG 3.38Å; F804-H813 AromaticContact CZ-ND1 3.75Å; R809-H813 WeakPolarHBondContact O-CB 3.41Å; R809-H813 PolarHBondContact O-N 3.46Å; L810-H813 PolarHBondContact O-N 3.25Å; A811-H813 VanDerWaalsContact C-N 3.33Å; H813-R815 PolarHBondContact O-N 3.35Å; H813-R815 VanDerWaalsContact O-N 3.17Å; H813-I816 VanDerWaalsContact O-CB 3.25Å; H813-I816 WeakPolarHBondContact O-CB 3.41Å; H813-I816 WeakPolarHBondContact O-CG1 3.5Å; H813-I816 PolarHBondContact O-N 2.88Å; H813-H817 AromaticContact CD2-NE2 3.82Å; H813-H817 AromaticContact CE1-NE2 3.63Å; H813-H817 AromaticContact NE2-CD2 3.92Å; H813-H817 AromaticContact NE2-CE1 3.94Å; H813-H817 AromaticContact NE2-NE2 3.04Å; H813-H817 PolarHBondContact NE2-NE2 3.07Å
814	R	80	Confident	77.1	Confident	127 Å²	127	73.2 Å²	73.2	48%	0.479	37%	0.374	S	S	.	.	H	α-helix	trans	-58.9	-28.5	177.1	-78.6	-177	69.2	165.6	4.3	113.1	L810 I816 H817 T818	L810-R814 HydrophobicContact CD1-CG 4.26Å; L810-R814 WeakPolarHBondContact O-CG 3.47Å; L810-R814 PolarHBondContact O-N 3.24Å; R814-I816 PolarHBondContact O-N 3.16Å; R814-H817 PolarHBondContact O-N 2.95Å; R814-T818 PolarHBondContact O-N 2.71Å
815	R	81.5	Confident	77	Confident	62 Å²	62	71 Å²	71	23%	0.234	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-7.6	173.2	-62.1	-177.2	177.4	153.4	4.3	114.7	E812 H813 G819 E820 R833	E812-R815 PolarHBondContact O-N 3.26Å; H813-R815 PolarHBondContact O-N 3.35Å; H813-R815 VanDerWaalsContact O-N 3.17Å; R815-G819 PolarHBondContact O-N 2.82Å; R815-E820 HydrophobicContact CB-CB 4.17Å; R815-E820 HydrophobicContact CG-CB 4.02Å; R815-E820 IonicContact NE-OE2 2.72Å; R815-E820 PolarHBondContact O-N 3.47Å; R815-R833 HydrophobicContact CB-CB 4.44Å; R815-R833 WeakPolarHBondContact CD-O 3.4Å; R815-R833 PolarHBondContact NH1-O 3.32Å
816	I	78.5	Confident	76.9	Confident	83 Å²	83	75.2 Å²	75.2	43%	0.426	39%	0.391	S	S	.	.	H	α-helix	trans	-74.9	-42.3	167.6	-55	-177.5	0	0	0	109.1	H813 R814	H813-I816 VanDerWaalsContact O-CB 3.25Å; H813-I816 WeakPolarHBondContact O-CB 3.41Å; H813-I816 WeakPolarHBondContact O-CG1 3.5Å; H813-I816 PolarHBondContact O-N 2.88Å; R814-I816 PolarHBondContact O-N 3.16Å
817	H	77.9	Confident	76.9	Confident	78 Å²	78	76.5 Å²	76.5	36%	0.361	40%	0.398	S	S	.	.	H	α-helix	trans	-75.8	-39.8	179.8	-54.8	-56.3	0	0	0	112.9	C797 V799 C800 H813 R814 G819	C797-H817 PolarHBondContact SG-NE2 2.9Å; V799-H817 HydrophobicContact CG1-CB 4.21Å; C800-H817 VanDerWaalsContact SG-CE1 3.6Å; C800-H817 PolarHBondContact SG-NE2 2.78Å; C800-H817 VanDerWaalsContact SG-NE2 3.36Å; H813-H817 AromaticContact CD2-NE2 3.82Å; H813-H817 AromaticContact CE1-NE2 3.63Å; H813-H817 AromaticContact NE2-CD2 3.92Å; H813-H817 AromaticContact NE2-CE1 3.94Å; H813-H817 AromaticContact NE2-NE2 3.04Å; H813-H817 PolarHBondContact NE2-NE2 3.07Å; R814-H817 PolarHBondContact O-N 2.95Å; H817-G819 VanDerWaalsContact C-N 3.3Å; H817-G819 PolarHBondContact O-N 3.25Å
818	T	71.9	Confident	77.3	Confident	79 Å²	79	75.5 Å²	75.5	49%	0.485	39%	0.391	S	S	.	.	S	Bend	trans	-82.7	-3.7	176.8	65.6	0	0	0	0	114	R814 E820	R814-T818 PolarHBondContact O-N 2.71Å; T818-E820 WeakPolarHBondContact CB-OE1 3.34Å; T818-E820 PolarHBondContact O-N 3.36Å; T818-E820 VanDerWaalsContact OG1-CD 3.26Å; T818-E820 WeakPolarHBondContact OG1-CG 3.46Å; T818-E820 PolarHBondContact OG1-OE1 2.89Å
819	G	75.6	Confident	77.2	Confident	44 Å²	44	71.4 Å²	71.4	45%	0.454	38%	0.384	S	S	.	.			trans	67.3	-4.1	-177.3	0	0	0	0	0	115.8	R815 H817 R821	R815-G819 PolarHBondContact O-N 2.82Å; H817-G819 VanDerWaalsContact C-N 3.3Å; H817-G819 PolarHBondContact O-N 3.25Å; G819-R821 WeakPolarHBondContact O-CG 3.4Å; G819-R821 PolarHBondContact O-N 3.27Å
820	E	75.3	Confident	77.2	Confident	96 Å²	96	70.8 Å²	70.8	45%	0.449	39%	0.385	S	S	.	.			trans	-54.3	129.7	-175	-80.4	168.1	-127	0	0	113.8	R815 T818 P822	R815-E820 HydrophobicContact CB-CB 4.17Å; R815-E820 HydrophobicContact CG-CB 4.02Å; R815-E820 IonicContact NE-OE2 2.72Å; R815-E820 PolarHBondContact O-N 3.47Å; T818-E820 WeakPolarHBondContact CB-OE1 3.34Å; T818-E820 PolarHBondContact O-N 3.36Å; T818-E820 VanDerWaalsContact OG1-CD 3.26Å; T818-E820 WeakPolarHBondContact OG1-CG 3.46Å; T818-E820 PolarHBondContact OG1-OE1 2.89Å; E820-P822 HydrophobicContact CB-CG 4.38Å
821	R	74.7	Confident	77.1	Confident	139 Å²	139	71.6 Å²	71.6	53%	0.525	39%	0.393	S	S	.	.			trans	-128	70.2	177.5	-66.2	165.6	83.6	148	3	110.9	G819 Y823 S831 Y832 R833	G819-R821 WeakPolarHBondContact O-CG 3.4Å; G819-R821 PolarHBondContact O-N 3.27Å; R821-Y823 PolarHBondContact O-N 2.85Å; R821-Y823 VanDerWaalsContact O-N 3.07Å; R821-S831 VanDerWaalsContact CZ-O 3.26Å; R821-S831 PolarHBondContact NE-O 3.49Å; R821-S831 PolarHBondContact NH2-O 2.71Å; R821-Y832 CarbonylContact C-O 3.54Å; R821-Y832 WeakPolarHBondContact CA-O 3.27Å; R821-R833 HydrophobicContact CG-CG 3.95Å
822	P	72.8	Confident	77.1	Confident	71 Å²	71	71.3 Å²	71.3	46%	0.461	38%	0.381	S	S	.	.			trans	-72	-3.1	-165.9	-19.3	34.5	0	0	0	116	E820	E820-P822 HydrophobicContact CB-CG 4.38Å
823	Y	71.4	Confident	76.7	Confident	78 Å²	78	73.8 Å²	73.8	31%	0.306	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	96.5	-175	-53.1	-76.9	0	0	0	110.3	R821 S831 Y832 F835	R821-Y823 PolarHBondContact O-N 2.85Å; R821-Y823 VanDerWaalsContact O-N 3.07Å; Y823-S831 CarbonylContact O-C 3.59Å; Y823-S831 WeakPolarHBondContact O-CA 3.41Å; Y823-Y832 PolarHBondContact N-O 3.28Å; Y823-Y832 PolarHBondContact O-N 2.9Å; Y823-F835 HydrophobicContact CD1-CB 4.32Å; Y823-F835 HydrophobicContact CD1-CD2 4.31Å; Y823-F835 HydrophobicContact CE1-CB 4.22Å
824	S	74.8	Confident	76.2	Confident	72 Å²	72	73.2 Å²	73.2	50%	0.503	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	148.1	173.6	50	0	0	0	0	112.2	K830 L838	S824-K830 CarbonylContact C-O 3.6Å; S824-L838 WeakPolarHBondContact O-CD2 3.4Å
825	C	78.1	Confident	75.9	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.014	39%	0.388	C	S	.	.			trans	-83.1	122.8	169.6	-165.4	0	0	0	0	109.3	D827 G829 K830 L838 H845	C825-D827 PolarHBondContact O-N 3.27Å; C825-G829 VanDerWaalsContact O-CA 3.23Å; C825-G829 WeakPolarHBondContact O-CA 3.32Å; C825-G829 PolarHBondContact O-N 2.91Å; C825-K830 WeakPolarHBondContact CB-O 3.46Å; C825-K830 PolarHBondContact N-O 3.14Å; C825-L838 HydrophobicContact CB-CD1 3.69Å; C825-H845 VanDerWaalsContact SG-CD2 3.55Å
826	P	72.3	Confident	75.5	Confident	103 Å²	103	73.5 Å²	73.5	67%	0.669	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.9	176.7	28.1	-33.3	0	0	0	111.4	C828	P826-C828 VanDerWaalsContact C-N 3.35Å; P826-C828 PolarHBondContact O-N 3.31Å
827	D	77.6	Confident	75.4	Confident	83 Å²	83	73 Å²	73	44%	0.444	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-16.9	-170.6	-43	-59.7	0	0	0	112.8	C825 R842 H845	C825-D827 PolarHBondContact O-N 3.27Å; D827-R842 IonicContact OD2-NE 2.62Å; D827-R842 PolarHBondContact OD2-NE 3.13Å; D827-H845 HydrophobicContact CB-CB 4.46Å; D827-H845 IonicContact OD2-CD2 2.56Å
828	C	85	Confident	75.5	Confident	46 Å²	46	70.2 Å²	70.2	31%	0.311	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.8	16	177.4	83.5	0	0	0	0	116.1	P826 K830 H841 H845	P826-C828 VanDerWaalsContact C-N 3.35Å; P826-C828 PolarHBondContact O-N 3.31Å; C828-K830 PolarHBondContact O-N 3.48Å; C828-K830 VanDerWaalsContact SG-CD 3.6Å; C828-K830 VanDerWaalsContact SG-CG 3.55Å; C828-H841 PolarHBondContact SG-NE2 3.34Å; C828-H845 WeakPolarHBondContact CB-NE2 3.46Å; C828-H845 PolarHBondContact SG-NE2 3.15Å
829	G	76.1	Confident	75.7	Confident	52 Å²	52	72.8 Å²	72.8	54%	0.536	39%	0.39	S	S	.	.			trans	70.5	-13.2	177.5	0	0	0	0	0	117.4	C825 S831	C825-G829 VanDerWaalsContact O-CA 3.23Å; C825-G829 WeakPolarHBondContact O-CA 3.32Å; C825-G829 PolarHBondContact O-N 2.91Å; G829-S831 PolarHBondContact O-N 3.44Å
830	K	79.3	Confident	75.9	Confident	122 Å²	122	78 Å²	78	53%	0.53	40%	0.399	S	S	.	.			trans	-62.6	130.2	-174.2	-70.5	176.6	-173	176.8	0	111.9	S824 C825 C828 Y832	S824-K830 CarbonylContact C-O 3.6Å; C825-K830 WeakPolarHBondContact CB-O 3.46Å; C825-K830 PolarHBondContact N-O 3.14Å; C828-K830 PolarHBondContact O-N 3.48Å; C828-K830 VanDerWaalsContact SG-CD 3.6Å; C828-K830 VanDerWaalsContact SG-CG 3.55Å; K830-Y832 HydrophobicContact CB-CE2 3.84Å; K830-Y832 WeakPolarHBondContact O-CD2 3.47Å; K830-Y832 WeakPolarHBondContact O-CE2 3.47Å
831	S	79	Confident	76.2	Confident	42 Å²	42	74.4 Å²	74.4	29%	0.294	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	144	-175.6	-61	0	0	0	0	114.2	R821 Y823 G829	R821-S831 VanDerWaalsContact CZ-O 3.26Å; R821-S831 PolarHBondContact NE-O 3.49Å; R821-S831 PolarHBondContact NH2-O 2.71Å; Y823-S831 CarbonylContact O-C 3.59Å; Y823-S831 WeakPolarHBondContact O-CA 3.41Å; G829-S831 PolarHBondContact O-N 3.44Å
832	Y	76.4	Confident	76.3	Confident	47 Å²	47	73.8 Å²	73.8	18%	0.184	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.5	-172	-61.2	-86.4	0	0	0	112.3	R821 Y823 K830 S834 N837 L838 H841	R821-Y832 CarbonylContact C-O 3.54Å; R821-Y832 WeakPolarHBondContact CA-O 3.27Å; Y823-Y832 PolarHBondContact N-O 3.28Å; Y823-Y832 PolarHBondContact O-N 2.9Å; K830-Y832 HydrophobicContact CB-CE2 3.84Å; K830-Y832 WeakPolarHBondContact O-CD2 3.47Å; K830-Y832 WeakPolarHBondContact O-CE2 3.47Å; Y832-S834 VanDerWaalsContact C-N 3.34Å; Y832-N837 HydrophobicContact CD1-CB 4.02Å; Y832-N837 HydrophobicContact CG-CB 4.45Å; Y832-L838 HydrophobicContact CD2-CB 4.03Å; Y832-L838 HydrophobicContact CD2-CD1 4.05Å; Y832-L838 HydrophobicContact CE2-CD1 4.3Å; Y832-L838 HydrophobicContact CG-CB 4.34Å; Y832-H841 HydrophobicContact CE1-CB 4.42Å; Y832-H841 HydrophobicContact CE2-CB 4.23Å; Y832-H841 AromaticContact CE2-CD2 3.32Å; Y832-H841 WeakPolarHBondContact CE2-CD2 3.34Å; Y832-H841 AromaticContact CZ-CD2 3.41Å; Y832-H841 VanDerWaalsContact CZ-CD2 3.41Å; Y832-H841 AromaticContact CZ-CG 3.72Å; Y832-H841 PolarHBondContact OH-CD2 3.13Å; Y832-H841 PolarHBondContact OH-NE2 3.03Å
833	R	70.9	Confident	76.7	Confident	102 Å²	102	75.6 Å²	75.6	39%	0.385	38%	0.381	S	S	.	.	S	Bend	trans	-71.2	-26.2	180	-55.8	-175.5	-173	132.7	1.3	113.3	R815 R821	R815-R833 HydrophobicContact CB-CB 4.44Å; R815-R833 WeakPolarHBondContact CD-O 3.4Å; R815-R833 PolarHBondContact NH1-O 3.32Å; R821-R833 HydrophobicContact CG-CG 3.95Å
834	S	71.8	Confident	77.3	Confident	10 Å²	10	74.6 Å²	74.6	7%	0.07	38%	0.383	C	S	.	.	S	Bend	trans	-143.6	149.4	179.7	60.7	0	0	0	0	113.6	E812 Y832 S836 N837 L838	E812-S834 WeakPolarHBondContact OE1-CB 3.37Å; E812-S834 PolarHBondContact OE1-OG 2.89Å; Y832-S834 VanDerWaalsContact C-N 3.34Å; S834-S836 VanDerWaalsContact C-N 3.3Å; S834-S836 PolarHBondContact O-N 2.95Å; S834-N837 PolarHBondContact O-N 3.24Å; S834-N837 VanDerWaalsContact O-N 3.15Å; S834-L838 PolarHBondContact O-N 2.75Å
835	F	72.6	Confident	77.7	Confident	118 Å²	118	73.8 Å²	73.8	52%	0.518	37%	0.371	S	S	.	.	H	α-helix	trans	-60.2	-35	-174.7	-178.3	-95.6	0	0	0	113.3	Y823 N837 L838 W839	Y823-F835 HydrophobicContact CD1-CB 4.32Å; Y823-F835 HydrophobicContact CD1-CD2 4.31Å; Y823-F835 HydrophobicContact CE1-CB 4.22Å; F835-N837 PolarHBondContact O-N 3.39Å; F835-L838 PolarHBondContact O-N 3.31Å; F835-W839 HydrophobicContact CE1-CB 4.4Å; F835-W839 HydrophobicContact CZ-CE3 4.38Å; F835-W839 WeakPolarHBondContact O-CB 3.46Å; F835-W839 PolarHBondContact O-N 2.63Å
836	S	73.2	Confident	77.6	Confident	76 Å²	76	79 Å²	79	53%	0.531	40%	0.395	S	S	.	.	H	α-helix	trans	-59.2	-34.6	177.4	-53.3	0	0	0	0	112.9	S834 K840	S834-S836 VanDerWaalsContact C-N 3.3Å; S834-S836 PolarHBondContact O-N 2.95Å; S836-K840 WeakPolarHBondContact O-CG 3.47Å; S836-K840 PolarHBondContact O-N 3.17Å; S836-K840 VanDerWaalsContact O-N 3.07Å
837	N	77.4	Confident	78.2	Confident	73 Å²	73	79.9 Å²	79.9	39%	0.39	39%	0.391	S	S	.	.	H	α-helix	trans	-78.6	-38.2	179	-67.3	-15.6	0	0	0	111.3	Y832 S834 F835 W839 K840 H841	Y832-N837 HydrophobicContact CD1-CB 4.02Å; Y832-N837 HydrophobicContact CG-CB 4.45Å; S834-N837 PolarHBondContact O-N 3.24Å; S834-N837 VanDerWaalsContact O-N 3.15Å; F835-N837 PolarHBondContact O-N 3.39Å; N837-W839 VanDerWaalsContact C-N 3.33Å; N837-W839 PolarHBondContact O-N 2.83Å; N837-K840 PolarHBondContact O-N 3.38Å; N837-H841 WeakPolarHBondContact O-CB 3.43Å; N837-H841 PolarHBondContact O-N 3.47Å
838	L	78.8	Confident	78.4	Confident	19 Å²	19	81.4 Å²	81.4	10%	0.099	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-43	168.4	172.3	60.2	0	0	0	111.4	S824 C825 Y832 S834 F835 H841 R842	S824-L838 WeakPolarHBondContact O-CD2 3.4Å; C825-L838 HydrophobicContact CB-CD1 3.69Å; Y832-L838 HydrophobicContact CD2-CB 4.03Å; Y832-L838 HydrophobicContact CD2-CD1 4.05Å; Y832-L838 HydrophobicContact CE2-CD1 4.3Å; Y832-L838 HydrophobicContact CG-CB 4.34Å; S834-L838 PolarHBondContact O-N 2.75Å; F835-L838 PolarHBondContact O-N 3.31Å; L838-H841 PolarHBondContact O-N 2.98Å; L838-R842 WeakPolarHBondContact O-CB 3.48Å; L838-R842 PolarHBondContact O-N 2.85Å
839	W	77.6	Confident	78.1	Confident	134 Å²	134	85.4 Å²	85.4	51%	0.508	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-42.9	179.7	-177	-102.9	0	0	0	112.7	F835 N837 H841 R842 K843	F835-W839 HydrophobicContact CE1-CB 4.4Å; F835-W839 HydrophobicContact CZ-CE3 4.38Å; F835-W839 WeakPolarHBondContact O-CB 3.46Å; F835-W839 PolarHBondContact O-N 2.63Å; N837-W839 VanDerWaalsContact C-N 3.33Å; N837-W839 PolarHBondContact O-N 2.83Å; W839-H841 VanDerWaalsContact C-N 3.32Å; W839-H841 PolarHBondContact O-N 3.06Å; W839-R842 PolarHBondContact O-N 3.22Å; W839-K843 PolarHBondContact O-N 3.31Å
840	K	79.8	Confident	78.1	Confident	152 Å²	152	87.5 Å²	87.5	66%	0.661	41%	0.405	S	S	*	.	H	α-helix	trans	-57.4	-45.3	171.5	-77.9	-177.4	175.3	-169.5	0	111.5	S836 N837 K843	S836-K840 WeakPolarHBondContact O-CG 3.47Å; S836-K840 PolarHBondContact O-N 3.17Å; S836-K840 VanDerWaalsContact O-N 3.07Å; N837-K840 PolarHBondContact O-N 3.38Å; K840-K843 WeakPolarHBondContact O-CB 3.35Å; K840-K843 PolarHBondContact O-N 3.29Å
841	H	81.2	Confident	78.3	Confident	22 Å²	22	84.4 Å²	84.4	10%	0.102	40%	0.402	C	S	.	.	H	α-helix	trans	-67.5	-41.2	178.2	172.2	44.7	0	0	0	113.1	C828 Y832 N837 L838 W839 K843 T844 H845	C828-H841 PolarHBondContact SG-NE2 3.34Å; Y832-H841 HydrophobicContact CE1-CB 4.42Å; Y832-H841 HydrophobicContact CE2-CB 4.23Å; Y832-H841 AromaticContact CE2-CD2 3.32Å; Y832-H841 WeakPolarHBondContact CE2-CD2 3.34Å; Y832-H841 AromaticContact CZ-CD2 3.41Å; Y832-H841 VanDerWaalsContact CZ-CD2 3.41Å; Y832-H841 AromaticContact CZ-CG 3.72Å; Y832-H841 PolarHBondContact OH-CD2 3.13Å; Y832-H841 PolarHBondContact OH-NE2 3.03Å; N837-H841 WeakPolarHBondContact O-CB 3.43Å; N837-H841 PolarHBondContact O-N 3.47Å; L838-H841 PolarHBondContact O-N 2.98Å; W839-H841 VanDerWaalsContact C-N 3.32Å; W839-H841 PolarHBondContact O-N 3.06Å; H841-K843 PolarHBondContact O-N 3.46Å; H841-T844 PolarHBondContact ND1-OG1 2.73Å; H841-T844 PolarHBondContact O-N 2.93Å; H841-T844 PolarHBondContact O-OG1 3.31Å; H841-H845 AromaticContact CE1-CD2 3.81Å; H841-H845 AromaticContact CE1-NE2 3.94Å; H841-H845 AromaticContact NE2-CD2 3.97Å; H841-H845 PolarHBondContact O-N 3.17Å
842	R	76.9	Confident	78.4	Confident	125 Å²	125	84.6 Å²	84.6	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-29	178.1	-166.3	172.4	-172.9	-142.1	-5.8	112.4	D827 L838 W839 T844 H845 Q846	D827-R842 IonicContact OD2-NE 2.62Å; D827-R842 PolarHBondContact OD2-NE 3.13Å; L838-R842 WeakPolarHBondContact O-CB 3.48Å; L838-R842 PolarHBondContact O-N 2.85Å; W839-R842 PolarHBondContact O-N 3.22Å; R842-T844 VanDerWaalsContact C-N 3.32Å; R842-T844 PolarHBondContact O-N 2.86Å; R842-H845 PolarHBondContact O-N 3.24Å; R842-Q846 PolarHBondContact O-N 3.45Å; R842-Q846 VanDerWaalsContact O-N 3.08Å
843	K	80.2	Confident	78.7	Confident	110 Å²	110	85.8 Å²	85.8	48%	0.478	42%	0.418	S	S	.	.	H	α-helix	trans	-63.1	-32.5	169.3	-78.9	-163.5	168.2	-161.6	0	113.5	W839 K840 H841 Q846 Q847	W839-K843 PolarHBondContact O-N 3.31Å; K840-K843 WeakPolarHBondContact O-CB 3.35Å; K840-K843 PolarHBondContact O-N 3.29Å; H841-K843 PolarHBondContact O-N 3.46Å; K843-Q846 PolarHBondContact O-N 3.15Å; K843-Q847 WeakPolarHBondContact O-CB 3.24Å; K843-Q847 VanDerWaalsContact O-CG 3.31Å; K843-Q847 WeakPolarHBondContact O-CG 3.36Å; K843-Q847 PolarHBondContact O-N 3.2Å; K843-Q847 PolarHBondContact O-OE1 2.83Å
844	T	85.6	Confident	79.4	Confident	57 Å²	57	89.6 Å²	89.6	35%	0.35	43%	0.432	S	S	.	.	H	α-helix	trans	-67.4	-39.9	176.9	73.1	0	0	0	0	110.9	H841 R842 Q847 Q848	H841-T844 PolarHBondContact ND1-OG1 2.73Å; H841-T844 PolarHBondContact O-N 2.93Å; H841-T844 PolarHBondContact O-OG1 3.31Å; R842-T844 VanDerWaalsContact C-N 3.32Å; R842-T844 PolarHBondContact O-N 2.86Å; T844-Q847 PolarHBondContact O-N 3.46Å; T844-Q848 WeakPolarHBondContact O-CB 3.38Å; T844-Q848 VanDerWaalsContact O-CG 3.22Å; T844-Q848 WeakPolarHBondContact O-CG 3.39Å; T844-Q848 PolarHBondContact O-N 2.94Å; T844-Q848 PolarHBondContact O-OE1 2.81Å
845	H	81.7	Confident	80.1	Confident	54 Å²	54	94.8 Å²	94.8	25%	0.25	46%	0.456	C	S	.	.	H	α-helix	trans	-62.3	-42.3	171.9	-66.9	-52.2	0	0	0	112.6	C825 D827 C828 H841 R842 Q847 Q848 H849	C825-H845 VanDerWaalsContact SG-CD2 3.55Å; D827-H845 HydrophobicContact CB-CB 4.46Å; D827-H845 IonicContact OD2-CD2 2.56Å; C828-H845 WeakPolarHBondContact CB-NE2 3.46Å; C828-H845 PolarHBondContact SG-NE2 3.15Å; H841-H845 AromaticContact CE1-CD2 3.81Å; H841-H845 AromaticContact CE1-NE2 3.94Å; H841-H845 AromaticContact NE2-CD2 3.97Å; H841-H845 PolarHBondContact O-N 3.17Å; R842-H845 PolarHBondContact O-N 3.24Å; H845-Q847 VanDerWaalsContact C-N 3.33Å; H845-Q847 PolarHBondContact O-N 2.85Å; H845-Q848 PolarHBondContact CE1-OE1 2.83Å; H845-Q848 PolarHBondContact O-N 3.18Å; H845-H849 WeakPolarHBondContact O-CB 3.27Å; H845-H849 PolarHBondContact O-N 3.32Å
846	Q	77.3	Confident	80.6	Confident	111 Å²	111	95.2 Å²	95.2	52%	0.519	46%	0.459	S	S	.	.	H	α-helix	trans	-61.1	-41.8	175.7	-173	176.6	6.2	0	0	111.8	R842 K843 Q850	R842-Q846 PolarHBondContact O-N 3.45Å; R842-Q846 VanDerWaalsContact O-N 3.08Å; K843-Q846 PolarHBondContact O-N 3.15Å; Q846-Q850 WeakPolarHBondContact O-CB 3.19Å; Q846-Q850 VanDerWaalsContact O-CG 3.25Å; Q846-Q850 WeakPolarHBondContact O-CG 3.34Å; Q846-Q850 PolarHBondContact O-N 3.15Å
847	Q	83.4	Confident	81.3	Confident	122 Å²	122	96.2 Å²	96.2	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-67.9	-41	176.3	-72.6	169.5	-44.9	0	0	112.2	K843 T844 H845 Q850 A851	K843-Q847 WeakPolarHBondContact O-CB 3.24Å; K843-Q847 VanDerWaalsContact O-CG 3.31Å; K843-Q847 WeakPolarHBondContact O-CG 3.36Å; K843-Q847 PolarHBondContact O-N 3.2Å; K843-Q847 PolarHBondContact O-OE1 2.83Å; T844-Q847 PolarHBondContact O-N 3.46Å; H845-Q847 VanDerWaalsContact C-N 3.33Å; H845-Q847 PolarHBondContact O-N 2.85Å; Q847-Q850 PolarHBondContact O-N 2.96Å; Q847-A851 WeakPolarHBondContact O-CB 3.34Å; Q847-A851 PolarHBondContact O-N 3Å
848	Q	82.5	Confident	81.5	Confident	116 Å²	116	95.2 Å²	95.2	54%	0.542	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-43.4	176.2	-74.5	168.5	-39.3	0	0	111.8	T844 H845 Q850 A851 A852	T844-Q848 WeakPolarHBondContact O-CB 3.38Å; T844-Q848 VanDerWaalsContact O-CG 3.22Å; T844-Q848 WeakPolarHBondContact O-CG 3.39Å; T844-Q848 PolarHBondContact O-N 2.94Å; T844-Q848 PolarHBondContact O-OE1 2.81Å; H845-Q848 PolarHBondContact CE1-OE1 2.83Å; H845-Q848 PolarHBondContact O-N 3.18Å; Q848-Q850 VanDerWaalsContact C-N 3.34Å; Q848-Q850 PolarHBondContact O-N 3.49Å; Q848-A851 PolarHBondContact O-N 3.06Å; Q848-A852 WeakPolarHBondContact O-CB 3.39Å; Q848-A852 PolarHBondContact O-N 2.83Å
849	H	78.4	Confident	81.9	Confident	130 Å²	130	99.2 Å²	99.2	60%	0.602	48%	0.478	S	S	*	.	H	α-helix	trans	-64.7	-37	173.6	-172.2	-46.8	0	0	0	111.9	H845 V853	H845-H849 WeakPolarHBondContact O-CB 3.27Å; H845-H849 PolarHBondContact O-N 3.32Å; H849-V853 WeakPolarHBondContact O-CG2 3.32Å; H849-V853 PolarHBondContact O-N 3.34Å; H849-V853 VanDerWaalsContact O-N 3.08Å
850	Q	76.3	Confident	82	Confident	96 Å²	96	95.3 Å²	95.3	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-69.8	-31.6	175.3	-76.7	174.6	-23.4	0	0	112.8	Q846 Q847 Q848 R854	Q846-Q850 WeakPolarHBondContact O-CB 3.19Å; Q846-Q850 VanDerWaalsContact O-CG 3.25Å; Q846-Q850 WeakPolarHBondContact O-CG 3.34Å; Q846-Q850 PolarHBondContact O-N 3.15Å; Q847-Q850 PolarHBondContact O-N 2.96Å; Q848-Q850 VanDerWaalsContact C-N 3.34Å; Q848-Q850 PolarHBondContact O-N 3.49Å; Q850-R854 WeakPolarHBondContact O-CD 3.22Å; Q850-R854 VanDerWaalsContact O-CG 3.31Å; Q850-R854 WeakPolarHBondContact O-CG 3.4Å; Q850-R854 PolarHBondContact O-N 2.63Å
851	A	82.6	Confident	82.1	Confident	56 Å²	56	93.8 Å²	93.8	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-70.1	-48.7	172.4	0	0	0	0	0	111.4	Q847 Q848 V853 R854 Q855	Q847-A851 WeakPolarHBondContact O-CB 3.34Å; Q847-A851 PolarHBondContact O-N 3Å; Q848-A851 PolarHBondContact O-N 3.06Å; A851-V853 PolarHBondContact O-N 3.31Å; A851-R854 WeakPolarHBondContact O-CB 3.48Å; A851-R854 PolarHBondContact O-N 2.88Å; A851-R854 VanDerWaalsContact O-N 3.11Å; A851-Q855 PolarHBondContact O-N 2.84Å
852	A	81.9	Confident	82	Confident	47 Å²	47	95.6 Å²	95.6	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-42.9	179	0	0	0	0	0	112.7	Q848 R854 Q855 Q856	Q848-A852 WeakPolarHBondContact O-CB 3.39Å; Q848-A852 PolarHBondContact O-N 2.83Å; A852-R854 VanDerWaalsContact C-N 3.33Å; A852-R854 PolarHBondContact O-N 3.48Å; A852-Q855 PolarHBondContact O-N 3.38Å; A852-Q856 WeakPolarHBondContact O-CG 3.4Å; A852-Q856 PolarHBondContact O-N 3.19Å
853	V	82.4	Confident	82	Confident	71 Å²	71	92.3 Å²	92.3	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-34	176.4	169.9	0	0	0	0	112.3	H849 A851 L857	H849-V853 WeakPolarHBondContact O-CG2 3.32Å; H849-V853 PolarHBondContact O-N 3.34Å; H849-V853 VanDerWaalsContact O-N 3.08Å; A851-V853 PolarHBondContact O-N 3.31Å; V853-L857 WeakPolarHBondContact O-CB 3.36Å; V853-L857 PolarHBondContact O-N 3Å
854	R	85.1	Confident	81.9	Confident	183 Å²	183	91.6 Å²	91.6	69%	0.691	49%	0.493	S	S	*	.	H	α-helix	trans	-70.1	-39.7	174.6	-77.9	171.3	173.8	164.5	-4	112.4	Q850 A851 A852 L857 A858	Q850-R854 WeakPolarHBondContact O-CD 3.22Å; Q850-R854 VanDerWaalsContact O-CG 3.31Å; Q850-R854 WeakPolarHBondContact O-CG 3.4Å; Q850-R854 PolarHBondContact O-N 2.63Å; A851-R854 WeakPolarHBondContact O-CB 3.48Å; A851-R854 PolarHBondContact O-N 2.88Å; A851-R854 VanDerWaalsContact O-N 3.11Å; A852-R854 VanDerWaalsContact C-N 3.33Å; A852-R854 PolarHBondContact O-N 3.48Å; R854-L857 PolarHBondContact O-N 2.99Å; R854-A858 PolarHBondContact O-N 3.4Å
855	Q	87.1	Confident	81	Confident	119 Å²	119	90.5 Å²	90.5	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-48.5	174.9	177.9	173.5	-10.5	0	0	110.7	A851 A852 L857 A858 E859	A851-Q855 PolarHBondContact O-N 2.84Å; A852-Q855 PolarHBondContact O-N 3.38Å; Q855-L857 VanDerWaalsContact C-N 3.26Å; Q855-L857 PolarHBondContact O-N 3.12Å; Q855-A858 PolarHBondContact O-N 2.94Å; Q855-E859 HydrophobicContact CG-CG 4.35Å; Q855-E859 WeakPolarHBondContact CG-OE1 3.44Å; Q855-E859 PolarHBondContact NE2-OE1 3.36Å; Q855-E859 WeakPolarHBondContact O-CB 3.26Å; Q855-E859 VanDerWaalsContact O-CG 3.31Å; Q855-E859 WeakPolarHBondContact O-CG 3.2Å; Q855-E859 PolarHBondContact O-N 2.87Å
856	Q	84.3	Confident	80.4	Confident	127 Å²	127	93.4 Å²	93.4	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-33.3	176.3	-73.1	178	-24.8	0	0	113.2	A852 A860	A852-Q856 WeakPolarHBondContact O-CG 3.4Å; A852-Q856 PolarHBondContact O-N 3.19Å; Q856-A860 WeakPolarHBondContact O-CB 3.49Å; Q856-A860 PolarHBondContact O-N 2.1Å; Q856-A860 VanDerWaalsContact O-N 3.08Å
857	L	86.1	Confident	79.7	Confident	96 Å²	96	90.4 Å²	90.4	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-68.9	-47.4	174	-178.4	62	0	0	0	111.4	V853 R854 Q855 E859 A860 E861	V853-L857 WeakPolarHBondContact O-CB 3.36Å; V853-L857 PolarHBondContact O-N 3Å; R854-L857 PolarHBondContact O-N 2.99Å; Q855-L857 VanDerWaalsContact C-N 3.26Å; Q855-L857 PolarHBondContact O-N 3.12Å; L857-E859 VanDerWaalsContact C-N 3.34Å; L857-E859 PolarHBondContact O-N 3.29Å; L857-A860 PolarHBondContact O-N 3.24Å; L857-E861 HydrophobicContact CD1-CG 4.29Å; L857-E861 HydrophobicContact CG-CG 4.42Å; L857-E861 WeakPolarHBondContact CG-OE1 3.28Å; L857-E861 WeakPolarHBondContact O-CB 3.48Å; L857-E861 WeakPolarHBondContact O-CG 3.29Å; L857-E861 PolarHBondContact O-N 3.3Å
858	A	83.5	Confident	78.9	Confident	53 Å²	53	88.8 Å²	88.8	44%	0.438	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-37.1	177.9	0	0	0	0	0	112.7	R854 Q855 E861 A862	R854-A858 PolarHBondContact O-N 3.4Å; Q855-A858 PolarHBondContact O-N 2.94Å; A858-E861 PolarHBondContact O-N 2.68Å; A858-A862 WeakPolarHBondContact O-CB 3.25Å; A858-A862 PolarHBondContact O-N 3.45Å
859	E	87.3	Confident	77.8	Confident	103 Å²	103	89.6 Å²	89.6	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-39.7	173	-72.9	166.1	177.3	0	0	111.4	Q855 L857 A863	Q855-E859 HydrophobicContact CG-CG 4.35Å; Q855-E859 WeakPolarHBondContact CG-OE1 3.44Å; Q855-E859 PolarHBondContact NE2-OE1 3.36Å; Q855-E859 WeakPolarHBondContact O-CB 3.26Å; Q855-E859 VanDerWaalsContact O-CG 3.31Å; Q855-E859 WeakPolarHBondContact O-CG 3.2Å; Q855-E859 PolarHBondContact O-N 2.87Å; L857-E859 VanDerWaalsContact C-N 3.34Å; L857-E859 PolarHBondContact O-N 3.29Å; E859-A863 WeakPolarHBondContact O-CB 3.4Å; E859-A863 PolarHBondContact O-N 2.83Å
860	A	78.6	Confident	76.9	Confident	51 Å²	51	89.9 Å²	89.9	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-70.8	-40.3	175	0	0	0	0	0	112.9	Q856 L857 A863 V864	Q856-A860 WeakPolarHBondContact O-CB 3.49Å; Q856-A860 PolarHBondContact O-N 2.1Å; Q856-A860 VanDerWaalsContact O-N 3.08Å; L857-A860 PolarHBondContact O-N 3.24Å; A860-A863 PolarHBondContact O-N 3.03Å; A860-V864 WeakPolarHBondContact O-CG2 3.43Å; A860-V864 PolarHBondContact O-N 3.21Å
861	E	82.9	Confident	76	Confident	120 Å²	120	89.7 Å²	89.7	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-63.2	-41.5	175.5	-74.1	167.9	173	0	0	111.1	L857 A858 V864 G865	L857-E861 HydrophobicContact CD1-CG 4.29Å; L857-E861 HydrophobicContact CG-CG 4.42Å; L857-E861 WeakPolarHBondContact CG-OE1 3.28Å; L857-E861 WeakPolarHBondContact O-CB 3.48Å; L857-E861 WeakPolarHBondContact O-CG 3.29Å; L857-E861 PolarHBondContact O-N 3.3Å; A858-E861 PolarHBondContact O-N 2.68Å; E861-V864 PolarHBondContact O-N 2.94Å; E861-G865 PolarHBondContact O-N 3.42Å
862	A	79.1	Confident	74.7	Confident	60 Å²	60	89.5 Å²	89.5	50%	0.496	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-41.4	173.6	0	0	0	0	0	112.7	A858 G865 L866	A858-A862 WeakPolarHBondContact O-CB 3.25Å; A858-A862 PolarHBondContact O-N 3.45Å; A862-G865 PolarHBondContact O-N 3.06Å; A862-L866 PolarHBondContact O-N 3.48Å
863	A	76	Confident	73.4	Confident	57 Å²	57	92.8 Å²	92.8	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-38.7	176.6	0	0	0	0	0	112.6	E859 A860 L866 A867	E859-A863 WeakPolarHBondContact O-CB 3.4Å; E859-A863 PolarHBondContact O-N 2.83Å; A860-A863 PolarHBondContact O-N 3.03Å; A863-L866 PolarHBondContact O-N 2.91Å; A863-A867 PolarHBondContact O-N 3.13Å; A863-A867 VanDerWaalsContact O-N 3.08Å
864	V	77.4	Confident	72	Confident	94 Å²	94	97.6 Å²	97.6	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-65.7	-41.1	172.3	170.3	0	0	0	0	110.9	A860 E861 L866 A867 V868	A860-V864 WeakPolarHBondContact O-CG2 3.43Å; A860-V864 PolarHBondContact O-N 3.21Å; E861-V864 PolarHBondContact O-N 2.94Å; V864-L866 PolarHBondContact O-N 3.33Å; V864-A867 PolarHBondContact O-N 3.02Å; V864-V868 HydrophobicContact CG1-CG2 4.32Å; V864-V868 WeakPolarHBondContact O-CG2 3.34Å; V864-V868 PolarHBondContact O-N 3.39Å
865	G	68.1	Low	70.4	Confident	35 Å²	35	92.4 Å²	92.4	36%	0.361	54%	0.542	S	S	.	.	H	α-helix	trans	-57.8	-44.8	174.6	0	0	0	0	0	112.9	E861 A862 V868 M869	E861-G865 PolarHBondContact O-N 3.42Å; A862-G865 PolarHBondContact O-N 3.06Å; G865-V868 PolarHBondContact O-N 2.84Å; G865-M869 VanDerWaalsContact O-CG 3.3Å; G865-M869 WeakPolarHBondContact O-CG 3.24Å; G865-M869 PolarHBondContact O-N 2.88Å; G865-M869 VanDerWaalsContact O-N 3.08Å
866	L	67.5	Low	68.5	Low	114 Å²	114	93.9 Å²	93.9	60%	0.597	55%	0.553	S	S	*	*	H	α-helix	trans	-61.6	-49.3	174.9	-77.7	161.1	0	0	0	112.2	A862 A863 V864 V868 M869 E870	A862-L866 PolarHBondContact O-N 3.48Å; A863-L866 PolarHBondContact O-N 2.91Å; V864-L866 PolarHBondContact O-N 3.33Å; L866-V868 VanDerWaalsContact C-N 3.3Å; L866-V868 PolarHBondContact O-N 3.34Å; L866-M869 PolarHBondContact O-N 3.44Å; L866-M869 VanDerWaalsContact O-N 3.07Å; L866-E870 PolarHBondContact O-N 3Å
867	A	63	Low	66.8	Low	48 Å²	48	92.9 Å²	92.9	40%	0.397	56%	0.558	S	S	.	*	H	α-helix	trans	-63.5	-32.9	179.7	0	0	0	0	0	113.4	A863 V864 T871	A863-A867 PolarHBondContact O-N 3.13Å; A863-A867 VanDerWaalsContact O-N 3.08Å; V864-A867 PolarHBondContact O-N 3.02Å; A867-T871 WeakPolarHBondContact O-CB 3.39Å; A867-T871 WeakPolarHBondContact O-CG2 3.49Å; A867-T871 PolarHBondContact O-N 2.95Å; A867-T871 PolarHBondContact O-OG1 2.86Å
868	V	66.1	Low	65	Low	88 Å²	88	96 Å²	96	53%	0.533	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-36.8	173.1	170	0	0	0	0	111.4	V864 G865 L866 T871 A872	V864-V868 HydrophobicContact CG1-CG2 4.32Å; V864-V868 WeakPolarHBondContact O-CG2 3.34Å; V864-V868 PolarHBondContact O-N 3.39Å; G865-V868 PolarHBondContact O-N 2.84Å; L866-V868 VanDerWaalsContact C-N 3.3Å; L866-V868 PolarHBondContact O-N 3.34Å; V868-T871 WeakPolarHBondContact CA-OG1 3.27Å; V868-T871 PolarHBondContact O-OG1 2.83Å; V868-A872 VanDerWaalsContact O-CB 3.28Å; V868-A872 WeakPolarHBondContact O-CB 3.26Å; V868-A872 PolarHBondContact O-N 2.82Å
869	M	60.2	Low	62.9	Low	133 Å²	133	100.2 Å²	100.2	66%	0.655	59%	0.594	S	S	*	*	H	α-helix	trans	-69.3	-41.2	175.2	-68.5	-67.5	-67.9	0	0	112.2	G865 L866 A872 V873	G865-M869 VanDerWaalsContact O-CG 3.3Å; G865-M869 WeakPolarHBondContact O-CG 3.24Å; G865-M869 PolarHBondContact O-N 2.88Å; G865-M869 VanDerWaalsContact O-N 3.08Å; L866-M869 PolarHBondContact O-N 3.44Å; L866-M869 VanDerWaalsContact O-N 3.07Å; M869-A872 PolarHBondContact O-N 3.28Å; M869-V873 WeakPolarHBondContact O-CG2 3.49Å; M869-V873 PolarHBondContact O-N 3.17Å
870	E	59.4	Low	60.9	Low	136 Å²	136	104.1 Å²	104.1	64%	0.636	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-46.4	176.4	-70.7	177.4	152.8	0	0	111.4	L866 A872 V873	L866-E870 PolarHBondContact O-N 3Å; E870-A872 VanDerWaalsContact C-N 3.32Å; E870-A872 PolarHBondContact O-N 3.44Å; E870-V873 PolarHBondContact O-N 3.41Å
871	T	58.5	Low	59.3	Low	92 Å²	92	106 Å²	106	56%	0.564	63%	0.628	S	S	*	*	H	α-helix	trans	-69.6	-24.8	177.7	49.4	0	0	0	0	114	A867 V868 V873	A867-T871 WeakPolarHBondContact O-CB 3.39Å; A867-T871 WeakPolarHBondContact O-CG2 3.49Å; A867-T871 PolarHBondContact O-N 2.95Å; A867-T871 PolarHBondContact O-OG1 2.86Å; V868-T871 WeakPolarHBondContact CA-OG1 3.27Å; V868-T871 PolarHBondContact O-OG1 2.83Å; T871-V873 VanDerWaalsContact C-N 3.34Å
872	A	53.6	Low	57.2	Low	53 Å²	53	108.7 Å²	108.7	44%	0.438	65%	0.645	S	S	.	*	H	α-helix	trans	-71.3	-27.1	172.1	0	0	0	0	0	113.2	V868 M869 E870	V868-A872 VanDerWaalsContact O-CB 3.28Å; V868-A872 WeakPolarHBondContact O-CB 3.26Å; V868-A872 PolarHBondContact O-N 2.82Å; M869-A872 PolarHBondContact O-N 3.28Å; E870-A872 VanDerWaalsContact C-N 3.32Å; E870-A872 PolarHBondContact O-N 3.44Å
873	V	55.4	Low	55.3	Low	115 Å²	115	114 Å²	114	70%	0.697	66%	0.659	S	S	*	*	H	α-helix	trans	-75.4	-33.2	178.7	171.2	0	0	0	0	112.1	M869 E870 T871 A875	M869-V873 WeakPolarHBondContact O-CG2 3.49Å; M869-V873 PolarHBondContact O-N 3.17Å; E870-V873 PolarHBondContact O-N 3.41Å; T871-V873 VanDerWaalsContact C-N 3.34Å; V873-A875 VanDerWaalsContact C-N 3.27Å; V873-A875 PolarHBondContact O-N 3.2Å
874	E	52.4	Low	53.4	Low	172 Å²	172	117.5 Å²	117.5	80%	0.804	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-10.3	176.1	-63.2	-165.6	142	0	0	113.9
875	A	51.5	Low	51.2	Low	75 Å²	75	123.2 Å²	123.2	62%	0.62	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	3.5	-171.3	0	0	0	0	0	115.5	V873	V873-A875 VanDerWaalsContact C-N 3.27Å; V873-A875 PolarHBondContact O-N 3.2Å
876	L	48.5	Very low	50.9	Low	150 Å²	150	126.2 Å²	126.2	79%	0.785	69%	0.694	S	S	*	*			trans	-115.2	108.4	-176.2	-75.7	171.5	0	0	0	113.1
877	P	47.5	Very low	49.2	Very low	106 Å²	106	128.7 Å²	128.7	69%	0.688	71%	0.708	S	S	*	*			trans	-133.8	153.6	131	37.3	-28.1	0	0	0	113.2
878	L	48	Very low	47.8	Very low	160 Å²	160	130.1 Å²	130.1	84%	0.838	72%	0.719	S	S	*	*			trans	60.8	96	168.1	-66.8	137.4	0	0	0	117.7
879	V	40.9	Very low	46.5	Very low	143 Å²	143	135 Å²	135	87%	0.867	74%	0.737	S	S	*	*				-143.2	124.3	109.6	-176.8	0	0	0	0	108.2
880	E	45.2	Very low	45.4	Very low	184 Å²	184	133.7 Å²	133.7	86%	0.86	75%	0.746	S	S	*	*			trans	-97.5	152.5	163.5	-71.6	-173	125.8	0	0	110.2
881	A	45.2	Very low	44.5	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	76%	0.761	S	S	*	*			trans	58.6	114.6	166.6	0	0	0	0	0	118.9
882	I	38.3	Very low	43.4	Very low	176 Å²	176	135.8 Å²	135.8	90%	0.903	77%	0.769	S	S	*	*				-160.1	148.3	124.7	-100.4	153.7	0	0	0	108.2
883	E	39.2	Very low	42.6	Very low	170 Å²	170	140 Å²	140	79%	0.794	79%	0.789	S	S	*	*			trans	-105.2	149.6	-167.7	-74.2	-170	124.7	0	0	114.7
884	I	35.5	Very low	41.9	Very low	131 Å²	131	143.3 Å²	143.3	67%	0.672	80%	0.796	S	S	*	*			trans	72.5	110	135.6	-71.7	169.1	0	0	0	120.5
885	Y	31.8	Very low	41.1	Very low	214 Å²	214	143.3 Å²	143.3	84%	0.839	80%	0.8	S	S	*	*			trans	81.8	162.4	138.2	-89.4	-109.1	0	0	0	119.9
886	P	61.6	Low	40.5	Very low	98 Å²	98	145.2 Å²	145.2	64%	0.636	81%	0.809	S	S	*	*				-133.1	-137.4	-113.1	43.4	-21.5	0	0	0	113.1
887	L	31.1	Very low	39.9	Very low	167 Å²	167	145.5 Å²	145.5	87%	0.874	85%	0.848	S	S	*	*			trans	80.7	150	-172.9	-54.7	162.9	0	0	0	112.9
888	A	34.5	Very low	39.5	Very low	78 Å²	78	147.5 Å²	147.5	65%	0.645	86%	0.856	S	S	*	*			cis	-161.9	178.3	-22.4	0	0	0	0	0	108.6
889	E	39.2	Very low	39	Very low	191 Å²	191	146.8 Å²	146.8	89%	0.893	86%	0.857	S	S	*	*			trans	20.5	118.5	153.7	-64.9	173.7	-174.1	0	0	120.2
890	A	35.3	Very low	38.9	Very low	104 Å²	104	147 Å²	147	86%	0.86	86%	0.856	S	S	*	*				-173.2	148.8	115.7	0	0	0	0	0	111.9
891	E	40.7	Very low	38.6	Very low	203 Å²	203	144.8 Å²	144.8	95%	0.949	86%	0.856	S	S	*	*			trans	-82.8	152.3	166.6	-56.4	-176.9	124.3	0	0	111.2
892	G	36.6	Very low	38.2	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	86%	0.862	S	S	*	*			trans	141.4	158.1	146.9	0	0	0	0	0	118.9
893	V	35.7	Very low	38.1	Very low	141 Å²	141	146.3 Å²	146.3	86%	0.855	86%	0.859	S	S	*	*			trans	67.3	85.3	160.2	-162.8	0	0	0	0	117.7
894	Q	41.7	Very low	38.1	Very low	185 Å²	185	144.6 Å²	144.6	86%	0.864	86%	0.864	S	S	*	*			trans	-6.3	131.9	140.7	-59.8	172.4	-29	0	0	118.1
895	I	34.9	Very low	38.3	Very low	171 Å²	171	145.6 Å²	145.6	88%	0.877	88%	0.879	S	S	*	*			trans	-128.1	140.2	136.8	-58.7	-177.6	0	0	0	107.7
896	S	38.2	Very low	38.8	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	88%	0.882	S	S	*	*			trans	-90.5	148.6	-168.1	56.3	0	0	0	0	115
897	G	36.2	Very low	36.7	Very low	155 Å²	155	143.7 Å²	143.7	100%	1.598	90%	0.904	S	S	*	*			trans	-127.2	0	157.2	0	0	0	0	0	110.6

Retrieved 897 of 897 residues in 117.7 ms (Link to these results)

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