A0A087YAU0_POEFO Loading...

Collagen alpha-2(VI) chain

Collagen VI acts as a cell-binding protein.

AlphaFold DB , UniProt , Accession A0A087YAU0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,014 aa.

						>A0A087YAU0_POEFO|A0A087YAU0
MMLALETVVLCLLLGALTHAEKADCNQRRECPIHLYFTIDTSETIALQESPPGALVKSIRSFTEQFVRRLKDEEIRNAVPITWAIGGLHFSQTQEVFSPIQGKDPFLSSLVRIEKYLGKGTYIDCALRRMSEEMLLGPASSVTPLRFAVVITDGHVTGNPCGGIKVSAEDARDKGIRVFAVAASTNIEETGLKEIANSPASVFRDDFMAVDLSKGRPTIHTATIDRIIKTMRHMAFVDCYNVSCLETKGQPGPKGHRGQKGAKGDNGEAGLKGERGRPGDPGIEGPIGQPGIKGEPGSKGEKGEIGTQGKKGVAGIPGRNGTDGQKGKLGRIGAPGCKGDPGDRGPDGHPGDVGERGPPGTDGEKGDPGRPGRAGPPGPPGEDGSQGERGSNGSPGVPGTKGASGIPGSPGKRGEEGRRGDYGPKGEPGPDGTKGEKGEMGPEGLRGVPGEPGSKGAKGDTGLPGPRGPPGASGEPGKNGTRGDPGDMGPRGESGQPGPKGDPGRPGFSYPGPRGDPGERGDPGKRGPPGSRGDCGQKGDPGNKGTPGEPGEPGPTGEPGLRGPRGGPGRDGDPGPEGDPGLTECDVMNYIRETCGCCDCEKRCGALDIVFVIDSSESVGLTNFTLEKNFVINTINRLGSFAKDPQSETGTRVGVVQYSHNGTFQAINLNDSNINSLTAFKEAVKRLEWIAGGTWTPSALKFAYDHLIRDSRRAKANVTVVVITDGRFDPRDDDRLLPYLCNHPGVDVSAIGIGDMFEQVEENESLQSIACQKEGRVMGMRRFADLVAEEFIDKIETVLCPDPVIICPDLPCKSEPAVASCVQRPVDVIFMLDGSERMGLENHLRAKEFIENVARRLTLANGPTDDTKARLALVQFGSAGDHKEEFPLTHNLTVIVDSLAAVNYLDSSSALGNAIIYAVNNLVIRQNQRLSRRNAELAFVFITDGITSTDQLDEGVQAMKRVEGVPTVIALGGDTDEEVLRQVSMGDSSAIFRGDDFFVLGKSAFFERFIRWIC
					

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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	47.8	Very low	49.6	Very low	217 Å²	217	115.8 Å²	115.8	100%	1.069	64%	0.638	S	S	*	*				0	-58	0	-80.4	176	72.3	0	0	112.9	L3 A4 L5	M1-L3 PolarHBondContact O-N 3.14Å; M1-A4 WeakPolarHBondContact O-CB 3.46Å; M1-A4 PolarHBondContact O-N 3.36Å; M1-L5 PolarHBondContact O-N 3.44Å
2	M	44.3	Very low	49.4	Very low	157 Å²	157	116.2 Å²	116.2	77%	0.773	64%	0.637	S	S	*	*	H	α-helix	trans	-51.8	-49.9	-171.5	-67.4	176.8	84.5	0	0	115.2	A4 L5 E6	M2-A4 PolarHBondContact O-N 3.29Å; M2-A4 VanDerWaalsContact O-N 3.13Å; M2-L5 WeakPolarHBondContact O-CA 3.47Å; M2-L5 WeakPolarHBondContact O-CB 3.35Å; M2-L5 PolarHBondContact O-N 3.46Å; M2-E6 PolarHBondContact O-N 2.99Å; M2-E6 VanDerWaalsContact O-N 3.11Å
3	L	44.7	Very low	49	Very low	147 Å²	147	115.3 Å²	115.3	77%	0.77	63%	0.63	S	S	*	*	H	α-helix	trans	-57	-28.7	177.3	-81	131.5	0	0	0	114.7	M1 T7	M1-L3 PolarHBondContact O-N 3.14Å; L3-T7 PolarHBondContact O-N 3.13Å; L3-T7 PolarHBondContact O-OG1 3.47Å; L3-T7 VanDerWaalsContact O-OG1 3.1Å
4	A	47.6	Very low	48.7	Very low	64 Å²	64	114.6 Å²	114.6	53%	0.529	63%	0.625	S	S	.	*	H	α-helix	trans	-79.6	-21	175.9	0	0	0	0	0	112.6	M1 M2 T7 V8	M1-A4 WeakPolarHBondContact O-CB 3.46Å; M1-A4 PolarHBondContact O-N 3.36Å; M2-A4 PolarHBondContact O-N 3.29Å; M2-A4 VanDerWaalsContact O-N 3.13Å; A4-T7 WeakPolarHBondContact CA-OG1 3.25Å; A4-T7 PolarHBondContact O-OG1 2.87Å; A4-T7 VanDerWaalsContact O-OG1 3.14Å; A4-V8 VanDerWaalsContact O-CG2 3.25Å; A4-V8 WeakPolarHBondContact O-CG2 3.43Å; A4-V8 PolarHBondContact O-N 3.11Å
5	L	48.3	Very low	47.8	Very low	122 Å²	122	109.3 Å²	109.3	64%	0.639	61%	0.607	S	S	*	*	H	α-helix	trans	-82.1	-41.9	177.7	-156.7	72.8	0	0	0	110.8	M1 M2 T7 V8 V9	M1-L5 PolarHBondContact O-N 3.44Å; M2-L5 WeakPolarHBondContact O-CA 3.47Å; M2-L5 WeakPolarHBondContact O-CB 3.35Å; M2-L5 PolarHBondContact O-N 3.46Å; L5-T7 PolarHBondContact O-N 3.33Å; L5-V8 PolarHBondContact O-N 3.39Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.5Å
6	E	48.2	Very low	47.1	Very low	130 Å²	130	106.8 Å²	106.8	61%	0.607	61%	0.605	S	S	*	*	H	α-helix	trans	-62	-42.6	175.9	-68.2	178.1	135.5	0	0	111.9	M2 V8 V9 L10	M2-E6 PolarHBondContact O-N 2.99Å; M2-E6 VanDerWaalsContact O-N 3.11Å; E6-V8 PolarHBondContact O-N 2.89Å; E6-V9 PolarHBondContact O-N 2.89Å; E6-L10 WeakPolarHBondContact O-CB 3.38Å; E6-L10 PolarHBondContact O-N 3.24Å
7	T	52.7	Low	46.4	Very low	83 Å²	83	109.2 Å²	109.2	51%	0.509	62%	0.615	S	S	.	*	H	α-helix	trans	-63.8	-37.9	174.7	46.8	0	0	0	0	112.9	L3 A4 L5 C11	L3-T7 PolarHBondContact O-N 3.13Å; L3-T7 PolarHBondContact O-OG1 3.47Å; L3-T7 VanDerWaalsContact O-OG1 3.1Å; A4-T7 WeakPolarHBondContact CA-OG1 3.25Å; A4-T7 PolarHBondContact O-OG1 2.87Å; A4-T7 VanDerWaalsContact O-OG1 3.14Å; L5-T7 PolarHBondContact O-N 3.33Å; T7-C11 WeakPolarHBondContact O-CB 3.34Å; T7-C11 PolarHBondContact O-N 2.99Å; T7-C11 PolarHBondContact O-SG 3.1Å; T7-C11 VanDerWaalsContact O-SG 3.33Å
8	V	57.4	Low	45.9	Very low	80 Å²	80	109.1 Å²	109.1	49%	0.485	62%	0.617	S	S	.	*	H	α-helix	trans	-70.8	-40.2	177.2	168.1	0	0	0	0	111.3	A4 L5 E6 C11 L12	A4-V8 VanDerWaalsContact O-CG2 3.25Å; A4-V8 WeakPolarHBondContact O-CG2 3.43Å; A4-V8 PolarHBondContact O-N 3.11Å; L5-V8 PolarHBondContact O-N 3.39Å; E6-V8 PolarHBondContact O-N 2.89Å; V8-C11 PolarHBondContact O-N 2.89Å; V8-L12 HydrophobicContact CG1-CD1 3.93Å; V8-L12 WeakPolarHBondContact O-CB 3.41Å; V8-L12 WeakPolarHBondContact O-CG 3.44Å; V8-L12 PolarHBondContact O-N 3.42Å
9	V	54.9	Low	45.3	Very low	76 Å²	76	112.3 Å²	112.3	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-65.4	-40.8	175.3	170.1	0	0	0	0	111.4	L5 E6 L12 L13	L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.5Å; E6-V9 PolarHBondContact O-N 2.89Å; V9-L12 PolarHBondContact O-N 3.05Å; V9-L13 HydrophobicContact CG1-CD1 4.04Å; V9-L13 WeakPolarHBondContact O-CG 3.35Å; V9-L13 PolarHBondContact O-N 2.89Å
10	L	50.8	Low	44.8	Very low	108 Å²	108	111 Å²	111	57%	0.565	63%	0.63	S	S	*	*	H	α-helix	trans	-65.7	-42.1	176.3	-161.9	71.7	0	0	0	111.6	E6 L12 L13 L14	E6-L10 WeakPolarHBondContact O-CB 3.38Å; E6-L10 PolarHBondContact O-N 3.24Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.33Å; L10-L13 PolarHBondContact O-N 3.46Å; L10-L14 HydrophobicContact CG-CD1 4.26Å; L10-L14 WeakPolarHBondContact O-CB 3.36Å; L10-L14 WeakPolarHBondContact O-CG 3.43Å; L10-L14 PolarHBondContact O-N 3.41Å
11	C	48.8	Very low	44.4	Very low	90 Å²	90	114.7 Å²	114.7	61%	0.608	64%	0.642	S	S	*	*	H	α-helix	trans	-65.5	-32.5	173.3	-74.6	0	0	0	0	113.3	T7 V8 G15	T7-C11 WeakPolarHBondContact O-CB 3.34Å; T7-C11 PolarHBondContact O-N 2.99Å; T7-C11 PolarHBondContact O-SG 3.1Å; T7-C11 VanDerWaalsContact O-SG 3.33Å; V8-C11 PolarHBondContact O-N 2.89Å; C11-G15 PolarHBondContact O-N 2.83Å
12	L	48	Very low	43.7	Very low	120 Å²	120	114.3 Å²	114.3	63%	0.628	64%	0.635	S	S	*	*	H	α-helix	trans	-72.1	-37	174.3	-77.9	166.3	0	0	0	112.3	V8 V9 L10 G15 A16	V8-L12 HydrophobicContact CG1-CD1 3.93Å; V8-L12 WeakPolarHBondContact O-CB 3.41Å; V8-L12 WeakPolarHBondContact O-CG 3.44Å; V8-L12 PolarHBondContact O-N 3.42Å; V9-L12 PolarHBondContact O-N 3.05Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.33Å; L12-G15 PolarHBondContact O-N 2.95Å; L12-A16 WeakPolarHBondContact O-CB 3.36Å; L12-A16 PolarHBondContact O-N 3.48Å
13	L	43.8	Very low	43.5	Very low	105 Å²	105	110.6 Å²	110.6	55%	0.55	63%	0.629	S	S	.	*	H	α-helix	trans	-67.9	-40.7	173.6	-75.7	163.8	0	0	0	112	V9 L10 A16 L17	V9-L13 HydrophobicContact CG1-CD1 4.04Å; V9-L13 WeakPolarHBondContact O-CG 3.35Å; V9-L13 PolarHBondContact O-N 2.89Å; L10-L13 PolarHBondContact O-N 3.46Å; L13-A16 PolarHBondContact O-N 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.48Å; L13-L17 PolarHBondContact O-N 3.43Å; L13-L17 VanDerWaalsContact O-N 3.15Å
14	L	44.4	Very low	43.3	Very low	105 Å²	105	108.2 Å²	108.2	55%	0.55	62%	0.617	S	S	.	*	H	α-helix	trans	-68.8	-34	172.8	-71.5	164.6	0	0	0	112.4	L10 T18	L10-L14 HydrophobicContact CG-CD1 4.26Å; L10-L14 WeakPolarHBondContact O-CB 3.36Å; L10-L14 WeakPolarHBondContact O-CG 3.43Å; L10-L14 PolarHBondContact O-N 3.41Å; L14-T18 PolarHBondContact O-N 2.92Å; L14-T18 PolarHBondContact O-OG1 3.27Å
15	G	36.1	Very low	43	Very low	35 Å²	35	109.7 Å²	109.7	36%	0.361	62%	0.622	S	S	.	*	H	α-helix	trans	-67.2	-38.9	172.9	0	0	0	0	0	113.3	C11 L12 T18	C11-G15 PolarHBondContact O-N 2.83Å; L12-G15 PolarHBondContact O-N 2.95Å; G15-T18 WeakPolarHBondContact CA-OG1 3.49Å; G15-T18 PolarHBondContact O-N 3.36Å; G15-T18 PolarHBondContact O-OG1 2.95Å; G15-T18 VanDerWaalsContact O-OG1 3.05Å
16	A	36.1	Very low	42.9	Very low	70 Å²	70	110.5 Å²	110.5	58%	0.579	63%	0.627	S	S	*	*	H	α-helix	trans	-67.5	-37.5	175.5	0	0	0	0	0	112.2	L12 L13 T18 H19	L12-A16 WeakPolarHBondContact O-CB 3.36Å; L12-A16 PolarHBondContact O-N 3.48Å; L13-A16 PolarHBondContact O-N 3.28Å; A16-T18 PolarHBondContact O-N 3Å; A16-H19 PolarHBondContact O-N 3.15Å
17	L	35.2	Very low	43	Very low	147 Å²	147	111.7 Å²	111.7	77%	0.77	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-5.2	176.7	-72.7	169.1	0	0	0	114.3	L13	L13-L17 WeakPolarHBondContact O-CG 3.48Å; L13-L17 PolarHBondContact O-N 3.43Å; L13-L17 VanDerWaalsContact O-N 3.15Å
18	T	36.6	Very low	43.1	Very low	107 Å²	107	115 Å²	115	66%	0.656	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	12.1	173.5	42.5	0	0	0	0	113.5	L14 G15 A16 A20	L14-T18 PolarHBondContact O-N 2.92Å; L14-T18 PolarHBondContact O-OG1 3.27Å; G15-T18 WeakPolarHBondContact CA-OG1 3.49Å; G15-T18 PolarHBondContact O-N 3.36Å; G15-T18 PolarHBondContact O-OG1 2.95Å; G15-T18 VanDerWaalsContact O-OG1 3.05Å; A16-T18 PolarHBondContact O-N 3Å; T18-A20 PolarHBondContact O-N 3.37Å
19	H	35	Very low	43.4	Very low	170 Å²	170	117.8 Å²	117.8	79%	0.787	64%	0.638	S	S	*	*			trans	-74.7	66.2	148.1	-78.7	34.1	0	0	0	110	A16 E21	A16-H19 PolarHBondContact O-N 3.15Å; H19-E21 PolarHBondContact O-N 3.46Å
20	A	35.7	Very low	44.1	Very low	86 Å²	86	120.3 Å²	120.3	71%	0.711	65%	0.645	S	S	*	*			trans	-56.5	128.8	149.7	0	0	0	0	0	106.7	T18 K22	T18-A20 PolarHBondContact O-N 3.37Å; A20-K22 PolarHBondContact O-N 2.78Å
21	E	36.3	Very low	45.7	Very low	189 Å²	189	115.1 Å²	115.1	88%	0.883	62%	0.618	S	S	*	*			trans	-53.3	135.7	175.5	-65.6	177.5	119	0	0	108.7	H19 A23	H19-E21 PolarHBondContact O-N 3.46Å; E21-A23 PolarHBondContact O-N 3.33Å
22	K	33.2	Very low	47.5	Very low	209 Å²	209	111.7 Å²	111.7	91%	0.909	59%	0.594	S	S	*	*			trans	-65.3	89.7	160.1	-83.4	-173	174.3	-177.5	0	106.5	A20 D24	A20-K22 PolarHBondContact O-N 2.78Å; K22-D24 PolarHBondContact O-N 2.98Å
23	A	39.9	Very low	49.6	Very low	80 Å²	80	106 Å²	106	66%	0.661	56%	0.564	S	S	*	*			trans	-53.1	111.4	170.4	0	0	0	0	0	107	E21 C25	E21-A23 PolarHBondContact O-N 3.33Å; A23-C25 PolarHBondContact O-N 3.44Å; A23-C25 PolarHBondContact O-SG 2.66Å
24	D	39.5	Very low	52	Low	97 Å²	97	101.5 Å²	101.5	52%	0.519	54%	0.541	S	S	.	.			trans	-77.4	89.5	-166.4	-174	9.9	0	0	0	109.7	K22 N26 Q27	K22-D24 PolarHBondContact O-N 2.98Å; D24-N26 PolarHBondContact O-N 2.85Å; D24-N26 PolarHBondContact OD1-N 3.37Å; D24-Q27 HydrophobicContact CB-CG 4.27Å; D24-Q27 PolarHBondContact O-N 3.02Å
25	C	43.3	Very low	54.4	Low	94 Å²	94	96.5 Å²	96.5	64%	0.635	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	4.5	-178.1	-63.6	0	0	0	0	114.5	A23	A23-C25 PolarHBondContact O-N 3.44Å; A23-C25 PolarHBondContact O-SG 2.66Å
26	N	44.3	Very low	57.4	Low	139 Å²	139	94.8 Å²	94.8	74%	0.743	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	4.6	172	-72.6	-47.8	0	0	0	114.3	D24 R28	D24-N26 PolarHBondContact O-N 2.85Å; D24-N26 PolarHBondContact OD1-N 3.37Å; N26-R28 PolarHBondContact O-N 2.88Å
27	Q	50.9	Low	60.3	Low	155 Å²	155	91.5 Å²	91.5	72%	0.724	47%	0.47	S	S	*	.			trans	-66.6	95.2	172.1	-72	-169.9	4.9	0	0	110.9	D24 R29	D24-Q27 HydrophobicContact CB-CG 4.27Å; D24-Q27 PolarHBondContact O-N 3.02Å; Q27-R29 PolarHBondContact O-N 3.13Å; Q27-R29 VanDerWaalsContact O-N 3.14Å
28	R	54.8	Low	63.3	Low	152 Å²	152	84.5 Å²	84.5	57%	0.574	43%	0.433	S	S	*	.			trans	-56.4	115	171.4	-57	-175.5	-171.2	-176.4	-1.6	108.5	N26 E30 E74	N26-R28 PolarHBondContact O-N 2.88Å; R28-E30 PolarHBondContact O-N 2.85Å; R28-E74 VanDerWaalsContact CD-OE1 3.29Å; R28-E74 WeakPolarHBondContact CD-OE1 3.48Å; R28-E74 IonicContact CZ-OE1 3.55Å; R28-E74 IonicContact CZ-OE2 3.95Å; R28-E74 IonicContact NE-OE1 3.79Å; R28-E74 IonicContact NH1-OE1 2.66Å; R28-E74 PolarHBondContact NH1-OE1 2.89Å; R28-E74 IonicContact NH1-OE2 2.85Å; R28-E74 PolarHBondContact NH1-OE2 3.26Å
29	R	63.3	Low	66.1	Low	140 Å²	140	79.6 Å²	79.6	53%	0.528	40%	0.403	S	S	.	.			trans	-71.9	120.2	175.7	-70.6	-172.1	177	-152.2	0.5	109.1	Q27 S243	Q27-R29 PolarHBondContact O-N 3.13Å; Q27-R29 VanDerWaalsContact O-N 3.14Å; R29-S243 PolarHBondContact NE-OG 2.66Å; R29-S243 PolarHBondContact NH2-OG 3.3Å
30	E	70.7	Confident	68.9	Low	128 Å²	128	71.5 Å²	71.5	60%	0.598	37%	0.365	S	S	*	.			trans	-61.5	137.2	165.1	-67.1	-175.2	173.6	0	0	109.6	R28 P32 P80	R28-E30 PolarHBondContact O-N 2.85Å; E30-P32 VanDerWaalsContact C-CD 3.42Å; E30-P32 WeakPolarHBondContact O-CD 3.44Å; E30-P80 HydrophobicContact CG-CG 4.15Å
31	C	83	Confident	71.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	79.4	-176.6	-169.9	0	0	0	0	108.9	I33 V79 P80 I81 T82 C239	C31-I33 PolarHBondContact O-N 3.1Å; C31-V79 HydrophobicContact CB-CG1 3.53Å; C31-P80 PolarHBondContact N-O 3.47Å; C31-I81 HydrophobicContact CB-CG1 4.01Å; C31-T82 PolarHBondContact O-N 2.65Å; C31-C239 HydrophobicContact CB-CB 3.55Å; C31-C239 WeakPolarHBondContact CB-SG 3.42Å; C31-C239 WeakPolarHBondContact SG-CB 3.46Å; C31-C239 CovalentContact SG-SG 2.04Å; C31-C239 PolarHBondContact SG-SG 3.35Å
32	P	88.2	Confident	74.4	Confident	18 Å²	18	58.4 Å²	58.4	12%	0.117	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	125.7	178.6	26.3	-31.4	0	0	0	109.9	E30 V142 P144 L145	E30-P32 VanDerWaalsContact C-CD 3.42Å; E30-P32 WeakPolarHBondContact O-CD 3.44Å; P32-V142 HydrophobicContact CG-CB 4.37Å; P32-V142 HydrophobicContact CG-CG1 4.38Å; P32-P144 HydrophobicContact CB-CB 4.21Å; P32-P144 HydrophobicContact CG-CB 4.15Å; P32-P144 CarbonylContact O-C 3.51Å; P32-P144 WeakPolarHBondContact O-CA 3.29Å; P32-P144 VanDerWaalsContact O-CB 3.28Å; P32-P144 WeakPolarHBondContact O-CB 2.95Å; P32-L145 PolarHBondContact O-N 2.92Å
33	I	91.4	Very high	77	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123	177.3	-58.8	-177.6	0	0	0	109.1	C31 I81 T82 W83 A84 L145 F147 A235	C31-I33 PolarHBondContact O-N 3.1Å; I33-I81 HydrophobicContact CD1-CD1 4.15Å; I33-I81 HydrophobicContact CD1-CG1 4.42Å; I33-I81 HydrophobicContact CD1-CG2 3.51Å; I33-I81 HydrophobicContact CG1-CG2 3.96Å; I33-T82 PolarHBondContact N-O 2.89Å; I33-W83 HydrophobicContact CB-CD2 4.33Å; I33-W83 HydrophobicContact CB-CE3 4Å; I33-W83 HydrophobicContact CB-CZ3 4.27Å; I33-W83 HydrophobicContact CD1-CH2 3.95Å; I33-W83 HydrophobicContact CD1-CZ2 3.97Å; I33-W83 HydrophobicContact CD1-CZ3 4.23Å; I33-W83 HydrophobicContact CG2-CD2 4.48Å; I33-W83 HydrophobicContact CG2-CE3 3.68Å; I33-W83 HydrophobicContact CG2-CH2 4.31Å; I33-W83 HydrophobicContact CG2-CZ3 3.59Å; I33-A84 PolarHBondContact O-N 3.33Å; I33-L145 HydrophobicContact CG1-CB 4.46Å; I33-F147 HydrophobicContact CD1-CE2 4.41Å; I33-F147 HydrophobicContact CG2-CD2 3.56Å; I33-F147 HydrophobicContact CG2-CE2 3.84Å; I33-A235 HydrophobicContact CD1-CB 3.62Å; I33-A235 HydrophobicContact CG1-CB 4.44Å
34	H	93.6	Very high	79.3	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.046	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	109.6	169.9	-76	-160.2	0	0	0	108.7	A84 I100 M134 P144 L145 F147	H34-A84 WeakPolarHBondContact CA-O 3.36Å; H34-I100 HydrophobicContact CB-CD1 4.32Å; H34-M134 WeakPolarHBondContact O-CE 3.03Å; H34-P144 HydrophobicContact CB-CB 4.4Å; H34-L145 PolarHBondContact N-O 2.93Å; H34-F147 PolarHBondContact O-N 3.12Å
35	L	96.2	Very high	81.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.7	174.6	179.3	61.2	0	0	0	109.9	F37 F66 L70 W83 A84 I85 G86 F147 V149 M231	L35-F37 HydrophobicContact CD2-CE2 3.61Å; L35-F37 HydrophobicContact CD2-CZ 3.74Å; L35-F37 HydrophobicContact CG-CD2 4.47Å; L35-F37 HydrophobicContact CG-CE2 3.9Å; L35-F37 HydrophobicContact CG-CZ 4.28Å; L35-F66 HydrophobicContact CD2-CD1 4.4Å; L35-F66 HydrophobicContact CD2-CE1 3.95Å; L35-L70 HydrophobicContact CD2-CD1 3.49Å; L35-L70 VanDerWaalsContact CD2-CD1 3.49Å; L35-W83 HydrophobicContact CB-CE3 4.31Å; L35-W83 HydrophobicContact CB-CZ3 4.49Å; L35-W83 HydrophobicContact CD2-CE3 4.44Å; L35-W83 HydrophobicContact CD2-CZ3 4.36Å; L35-A84 PolarHBondContact N-O 3.14Å; L35-I85 VanDerWaalsContact O-CA 3.29Å; L35-I85 WeakPolarHBondContact O-CA 3.13Å; L35-G86 PolarHBondContact O-N 2.93Å; L35-F147 CarbonylContact C-O 3.58Å; L35-F147 WeakPolarHBondContact CA-O 3.34Å; L35-F147 HydrophobicContact CD1-CB 4.1Å; L35-V149 HydrophobicContact CD1-CG2 3.97Å; L35-M231 HydrophobicContact CD1-CE 3.48Å; L35-M231 VanDerWaalsContact CD1-CE 3.48Å; L35-M231 HydrophobicContact CD1-SD 4.21Å
36	Y	97.4	Very high	83.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.3	177.6	-152.3	-84.3	0	0	0	112	G86 L88 I100 M130 E133 M134 F147 A148 V149	Y36-G86 WeakPolarHBondContact CA-O 3.48Å; Y36-L88 HydrophobicContact CE1-CB 4.12Å; Y36-L88 HydrophobicContact CE1-CD2 3.98Å; Y36-L88 HydrophobicContact CE1-CG 3.95Å; Y36-I100 HydrophobicContact CD2-CD1 4.12Å; Y36-I100 HydrophobicContact CD2-CG1 3.93Å; Y36-I100 HydrophobicContact CE2-CG1 4.19Å; Y36-M130 HydrophobicContact CD1-CB 4.23Å; Y36-M130 HydrophobicContact CD1-CG 3.68Å; Y36-M130 HydrophobicContact CE1-CB 4.29Å; Y36-M130 HydrophobicContact CE1-CG 4.23Å; Y36-M130 HydrophobicContact CG-CG 4.21Å; Y36-E133 HydrophobicContact CE2-CB 3.72Å; Y36-M134 WeakPolarHBondContact CB-SD 3.46Å; Y36-M134 HydrophobicContact CD2-CG 3.73Å; Y36-M134 HydrophobicContact CG-CG 3.82Å; Y36-M134 HydrophobicContact CG-SD 4.2Å; Y36-F147 PolarHBondContact N-O 3.27Å; Y36-A148 CarbonylContact O-C 3.28Å; Y36-A148 WeakPolarHBondContact O-CA 3.24Å; Y36-V149 PolarHBondContact O-N 2.89Å
37	F	97.9	Very high	85.9	Confident	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.9	175.3	-71.5	-84.2	0	0	0	111.2	L35 I39 T63 F66 V67 I85 G86 G87 L88 F106 V149	L35-F37 HydrophobicContact CD2-CE2 3.61Å; L35-F37 HydrophobicContact CD2-CZ 3.74Å; L35-F37 HydrophobicContact CG-CD2 4.47Å; L35-F37 HydrophobicContact CG-CE2 3.9Å; L35-F37 HydrophobicContact CG-CZ 4.28Å; F37-I39 HydrophobicContact CB-CD1 4.43Å; F37-I39 HydrophobicContact CB-CG1 4.23Å; F37-T63 HydrophobicContact CB-CG2 4.43Å; F37-T63 HydrophobicContact CD1-CG2 3.76Å; F37-T63 HydrophobicContact CD2-CG2 4.06Å; F37-T63 HydrophobicContact CE1-CG2 3.94Å; F37-T63 HydrophobicContact CE2-CG2 4.22Å; F37-T63 HydrophobicContact CG-CG2 3.81Å; F37-T63 HydrophobicContact CZ-CG2 4.17Å; F37-F66 HydrophobicContact CE1-CB 4.44Å; F37-F66 HydrophobicContact CE1-CD1 4.32Å; F37-F66 HydrophobicContact CE1-CD2 4.23Å; F37-F66 HydrophobicContact CE1-CG 4.09Å; F37-F66 HydrophobicContact CZ-CB 4.17Å; F37-F66 AromaticContact CZ-CD1 3.68Å; F37-F66 HydrophobicContact CZ-CD1 3.68Å; F37-F66 HydrophobicContact CZ-CD2 4.39Å; F37-F66 HydrophobicContact CZ-CE1 4.12Å; F37-F66 AromaticContact CZ-CG 3.84Å; F37-F66 HydrophobicContact CZ-CG 3.84Å; F37-V67 HydrophobicContact CE2-CG2 3.6Å; F37-V67 HydrophobicContact CZ-CG2 4.03Å; F37-I85 HydrophobicContact CD2-CG2 3.87Å; F37-I85 HydrophobicContact CE2-CG2 3.81Å; F37-G86 PolarHBondContact N-O 3.1Å; F37-G87 CarbonylContact O-C 3.58Å; F37-G87 WeakPolarHBondContact O-CA 3.33Å; F37-L88 PolarHBondContact O-N 3.49Å; F37-L88 VanDerWaalsContact O-O 3.12Å; F37-F106 HydrophobicContact CB-CZ 4.4Å; F37-F106 HydrophobicContact CD2-CE1 4.31Å; F37-F106 HydrophobicContact CD2-CE2 4.14Å; F37-F106 AromaticContact CD2-CZ 3.59Å; F37-F106 HydrophobicContact CD2-CZ 3.59Å; F37-F106 HydrophobicContact CE2-CZ 4.24Å; F37-F106 HydrophobicContact CG-CZ 4.27Å; F37-V149 WeakPolarHBondContact CA-O 3.29Å; F37-V149 HydrophobicContact CD1-CB 3.85Å; F37-V149 HydrophobicContact CD1-CG1 4.03Å; F37-V149 HydrophobicContact CE1-CB 3.88Å; F37-V149 HydrophobicContact CE1-CG1 3.96Å; F37-V149 HydrophobicContact CE1-CG2 4.3Å
38	T	97.1	Very high	87.7	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	98.3	177.6	-62.9	0	0	0	0	107.5	L88 F90 A126 M130 V149 V150 I151	T38-L88 WeakPolarHBondContact CA-O 3.24Å; T38-L88 HydrophobicContact CG2-CD1 4.03Å; T38-L88 HydrophobicContact CG2-CG 4.44Å; T38-F90 HydrophobicContact CG2-CD1 3.84Å; T38-F90 HydrophobicContact CG2-CE1 3.75Å; T38-A126 HydrophobicContact CG2-CB 3.89Å; T38-M130 WeakPolarHBondContact OG1-CG 3.3Å; T38-M130 PolarHBondContact OG1-SD 3.25Å; T38-V149 PolarHBondContact N-O 3.5Å; T38-V150 HydrophobicContact CG2-CG1 4.23Å; T38-V150 HydrophobicContact CG2-CG2 4.45Å; T38-V150 WeakPolarHBondContact O-CA 3.28Å; T38-I151 PolarHBondContact O-N 2.96Å
39	I	96.1	Very high	89.1	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.7	-166.3	-53.8	178.5	0	0	0	110.6	F37 T41 I59 T63 L88 H89 F90 F97 L110 I113	F37-I39 HydrophobicContact CB-CD1 4.43Å; F37-I39 HydrophobicContact CB-CG1 4.23Å; I39-T41 HydrophobicContact CG2-CG2 4.26Å; I39-T41 PolarHBondContact O-N 3.14Å; I39-I59 HydrophobicContact CG2-CG2 3.79Å; I39-T63 HydrophobicContact CD1-CG2 4.29Å; I39-L88 PolarHBondContact N-O 3.06Å; I39-H89 HydrophobicContact CB-CB 4.12Å; I39-H89 CarbonylContact O-C 3.48Å; I39-H89 WeakPolarHBondContact O-CA 3.44Å; I39-H89 WeakPolarHBondContact O-CB 3.29Å; I39-F90 VanDerWaalsContact O-CD1 3.28Å; I39-F90 WeakPolarHBondContact O-CD1 3.48Å; I39-F90 PolarHBondContact O-N 2.86Å; I39-F97 HydrophobicContact CD1-CE1 4.02Å; I39-F97 HydrophobicContact CD1-CZ 4.03Å; I39-L110 HydrophobicContact CD1-CD1 3.99Å; I39-I113 HydrophobicContact CD1-CD1 4.37Å
40	D	94.7	Very high	89.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.1	174.4	-163.8	-29.9	0	0	0	111.1	S42 I45 F90 T121 I151 T152	D40-S42 WeakPolarHBondContact OD1-CB 3.35Å; D40-S42 PolarHBondContact OD1-N 2.86Å; D40-S42 PolarHBondContact OD1-OG 3.4Å; D40-I45 HydrophobicContact CB-CG1 3.9Å; D40-F90 HydrophobicContact CB-CE1 3.82Å; D40-F90 HydrophobicContact CB-CE2 4.33Å; D40-F90 HydrophobicContact CB-CZ 3.65Å; D40-T121 WeakPolarHBondContact OD2-CG2 3.37Å; D40-I151 WeakPolarHBondContact CB-O 3.47Å; D40-I151 PolarHBondContact N-O 2.89Å; D40-T152 WeakPolarHBondContact OD2-CB 3.08Å; D40-T152 PolarHBondContact OD2-OG1 3.21Å
41	T	93.3	Very high	90.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.			trans	-135.1	33.7	176.8	61.4	0	0	0	0	110.7	I39 V56 H89 F90 I113 Y116 L117	I39-T41 HydrophobicContact CG2-CG2 4.26Å; I39-T41 PolarHBondContact O-N 3.14Å; T41-V56 HydrophobicContact CG2-CG1 3.84Å; T41-V56 HydrophobicContact CG2-CG2 4.47Å; T41-H89 HydrophobicContact CG2-CB 3.89Å; T41-H89 PolarHBondContact OG1-ND1 3.24Å; T41-F90 CarbonylContact C-O 3.55Å; T41-F90 VanDerWaalsContact C-O 3.24Å; T41-F90 VanDerWaalsContact CA-O 3.32Å; T41-F90 WeakPolarHBondContact CA-O 3.44Å; T41-F90 PolarHBondContact N-O 3.33Å; T41-F90 PolarHBondContact OG1-O 3.23Å; T41-I113 HydrophobicContact CG2-CG2 4.34Å; T41-Y116 WeakPolarHBondContact O-CB 3.36Å; T41-L117 PolarHBondContact O-N 2.81Å
42	S	92.5	Very high	90.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-67.4	169.9	168.6	63.5	0	0	0	0	112.7	D40 T44 I45 A46 F90 G118 G120 T121	D40-S42 WeakPolarHBondContact OD1-CB 3.35Å; D40-S42 PolarHBondContact OD1-N 2.86Å; D40-S42 PolarHBondContact OD1-OG 3.4Å; S42-T44 VanDerWaalsContact C-N 3.25Å; S42-T44 PolarHBondContact O-N 3.22Å; S42-T44 PolarHBondContact OG-N 3.22Å; S42-T44 PolarHBondContact OG-OG1 2.94Å; S42-I45 PolarHBondContact O-N 2.91Å; S42-I45 PolarHBondContact OG-N 3.13Å; S42-A46 VanDerWaalsContact O-CB 3.24Å; S42-A46 WeakPolarHBondContact O-CB 3.39Å; S42-A46 PolarHBondContact O-N 3.47Å; S42-F90 PolarHBondContact N-O 2.95Å; S42-G118 CarbonylContact C-O 3.59Å; S42-G118 WeakPolarHBondContact CA-O 3.37Å; S42-G120 VanDerWaalsContact CB-O 3.28Å; S42-G120 WeakPolarHBondContact CB-O 3.32Å; S42-T121 WeakPolarHBondContact CB-OG1 3.47Å; S42-T121 PolarHBondContact OG-OG1 3.43Å
43	E	88.4	Confident	90.6	Very high	55 Å²	55	27.4 Å²	27.4	26%	0.257	16%	0.163	S	C	.	.	H	α-helix	trans	-62.3	-29.7	170.2	-169.2	167.8	-142.2	0	0	112.4	A46 L47 G118 K119	E43-A46 PolarHBondContact O-N 2.9Å; E43-L47 HydrophobicContact CG-CD1 3.51Å; E43-L47 HydrophobicContact CG-CG 3.9Å; E43-L47 WeakPolarHBondContact O-CB 3.27Å; E43-L47 WeakPolarHBondContact O-CG 3.26Å; E43-L47 PolarHBondContact O-N 3.25Å; E43-L47 VanDerWaalsContact O-N 3.13Å; E43-G118 PolarHBondContact N-O 3.03Å; E43-K119 IonicContact OE1-NZ 3.82Å; E43-K119 PolarHBondContact OE1-NZ 3.43Å; E43-K119 VanDerWaalsContact OE2-CG 3.28Å; E43-K119 WeakPolarHBondContact OE2-CG 3.49Å; E43-K119 IonicContact OE2-NZ 2.8Å; E43-K119 PolarHBondContact OE2-NZ 3.44Å
44	T	88.4	Confident	90.4	Very high	44 Å²	44	28.2 Å²	28.2	27%	0.27	17%	0.17	S	C	.	.	H	α-helix	trans	-72.6	-28.2	-179.7	63.3	0	0	0	0	113.1	S42 Q48 T121 D153	S42-T44 VanDerWaalsContact C-N 3.25Å; S42-T44 PolarHBondContact O-N 3.22Å; S42-T44 PolarHBondContact OG-N 3.22Å; S42-T44 PolarHBondContact OG-OG1 2.94Å; T44-Q48 WeakPolarHBondContact O-CG 3.02Å; T44-Q48 PolarHBondContact O-NE2 3.02Å; T44-T121 PolarHBondContact OG1-OG1 2.99Å; T44-D153 WeakPolarHBondContact CB-OD2 3.37Å; T44-D153 PolarHBondContact OG1-OD2 2.84Å
45	I	90.3	Very high	90.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-81.9	-45.5	167.2	-62.1	-53.9	0	0	0	111.8	D40 S42 L47 Q48 L55 V56 I59 D153 A183	D40-I45 HydrophobicContact CB-CG1 3.9Å; S42-I45 PolarHBondContact O-N 2.91Å; S42-I45 PolarHBondContact OG-N 3.13Å; I45-L47 VanDerWaalsContact C-N 3.28Å; I45-L47 PolarHBondContact O-N 3.35Å; I45-Q48 PolarHBondContact O-N 2.68Å; I45-L55 HydrophobicContact CG2-CD2 4Å; I45-L55 HydrophobicContact CG2-CG 4.17Å; I45-V56 HydrophobicContact CG2-CG2 3.84Å; I45-I59 HydrophobicContact CG2-CD1 3.76Å; I45-D153 HydrophobicContact CD1-CB 3.62Å; I45-D153 WeakPolarHBondContact CD1-OD2 3.33Å; I45-A183 HydrophobicContact CD1-CB 3.44Å; I45-A183 VanDerWaalsContact CD1-CB 3.44Å; I45-A183 HydrophobicContact CG1-CB 4.48Å
46	A	88.8	Confident	90	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.7	-25.4	-170	0	0	0	0	0	114.1	S42 E43 P52 G53 V56 Y116	S42-A46 VanDerWaalsContact O-CB 3.24Å; S42-A46 WeakPolarHBondContact O-CB 3.39Å; S42-A46 PolarHBondContact O-N 3.47Å; E43-A46 PolarHBondContact O-N 2.9Å; A46-P52 CarbonylContact O-C 3.57Å; A46-P52 WeakPolarHBondContact O-CA 3.26Å; A46-G53 PolarHBondContact O-N 3.07Å; A46-V56 HydrophobicContact CB-CG2 4.42Å; A46-Y116 HydrophobicContact CB-CD1 3.68Å; A46-Y116 HydrophobicContact CB-CD2 3.35Å; A46-Y116 HydrophobicContact CB-CE1 3.98Å; A46-Y116 HydrophobicContact CB-CE2 3.67Å; A46-Y116 HydrophobicContact CB-CG 3.36Å
47	L	87.5	Confident	89.6	Confident	92 Å²	92	33.3 Å²	33.3	48%	0.482	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-5.1	-178.9	-62.4	-175.1	0	0	0	115	E43 I45 E49 P52	E43-L47 HydrophobicContact CG-CD1 3.51Å; E43-L47 HydrophobicContact CG-CG 3.9Å; E43-L47 WeakPolarHBondContact O-CB 3.27Å; E43-L47 WeakPolarHBondContact O-CG 3.26Å; E43-L47 PolarHBondContact O-N 3.25Å; E43-L47 VanDerWaalsContact O-N 3.13Å; I45-L47 VanDerWaalsContact C-N 3.28Å; I45-L47 PolarHBondContact O-N 3.35Å; L47-E49 VanDerWaalsContact C-N 3.33Å; L47-E49 PolarHBondContact O-N 2.78Å; L47-P52 HydrophobicContact CD2-CB 4.09Å; L47-P52 HydrophobicContact CD2-CG 4.1Å
48	Q	87.5	Confident	89.4	Confident	50 Å²	50	34.1 Å²	34.1	23%	0.234	20%	0.198	C	C	.	.	S	Bend	trans	-70.1	-26.8	-175.6	-52.9	-168.1	-2.2	0	0	113.8	T44 I45 L55 S184	T44-Q48 WeakPolarHBondContact O-CG 3.02Å; T44-Q48 PolarHBondContact O-NE2 3.02Å; I45-Q48 PolarHBondContact O-N 2.68Å; Q48-L55 HydrophobicContact CB-CD2 3.87Å; Q48-L55 HydrophobicContact CG-CD2 4.12Å; Q48-L55 VanDerWaalsContact OE1-CD2 3.31Å; Q48-S184 PolarHBondContact OE1-OG 3.31Å
49	E	84.6	Confident	89.2	Confident	32 Å²	32	34.1 Å²	34.1	15%	0.15	20%	0.198	C	C	.	.	S	Bend	trans	-119.9	145.4	175.8	-75.3	-161.1	112	0	0	111.5	L47 P51 A54 L55 L212 P217	L47-E49 VanDerWaalsContact C-N 3.33Å; L47-E49 PolarHBondContact O-N 2.78Å; E49-P51 CarbonylContact O-C 3.56Å; E49-P51 VanDerWaalsContact O-C 3.28Å; E49-A54 HydrophobicContact CB-CB 3.71Å; E49-L55 HydrophobicContact CB-CB 4.28Å; E49-L55 HydrophobicContact CG-CB 4.13Å; E49-L55 VanDerWaalsContact OE2-CA 3.29Å; E49-L55 WeakPolarHBondContact OE2-CA 3.42Å; E49-L55 PolarHBondContact OE2-N 2.83Å; E49-L212 HydrophobicContact CG-CD1 4.3Å; E49-L212 HydrophobicContact CG-CD2 4.07Å; E49-P217 WeakPolarHBondContact OE1-CB 3.32Å; E49-P217 VanDerWaalsContact OE1-CD 3.28Å; E49-P217 WeakPolarHBondContact OE1-CD 3.5Å; E49-P217 VanDerWaalsContact OE1-CG 3.29Å; E49-P217 WeakPolarHBondContact OE1-CG 3.49Å
50	S	79.3	Confident	89	Confident	116 Å²	116	36.9 Å²	36.9	81%	0.811	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	132.9	171.4	-74.3	0	0	0	0	111.2
51	P	86.4	Confident	89	Confident	93 Å²	93	38.7 Å²	38.7	60%	0.604	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	cis	-74.7	154.7	-2.9	32.3	-36.2	0	0	0	112.5	E49 G53 A54	E49-P51 CarbonylContact O-C 3.56Å; E49-P51 VanDerWaalsContact O-C 3.28Å; P51-G53 PolarHBondContact O-N 2.83Å; P51-A54 WeakPolarHBondContact O-CB 3.28Å; P51-A54 PolarHBondContact O-N 3.47Å
52	P	84.9	Confident	89.1	Confident	72 Å²	72	38.7 Å²	38.7	47%	0.468	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	136.1	-179.8	-33	37.5	0	0	0	114.6	A46 L47 A54	A46-P52 CarbonylContact O-C 3.57Å; A46-P52 WeakPolarHBondContact O-CA 3.26Å; L47-P52 HydrophobicContact CD2-CB 4.09Å; L47-P52 HydrophobicContact CD2-CG 4.1Å; P52-A54 VanDerWaalsContact C-N 3.33Å
53	G	85.3	Confident	89.3	Confident	7 Å²	7	38.7 Å²	38.7	7%	0.072	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	7.7	-172.4	0	0	0	0	0	114.7	A46 P51 K57	A46-G53 PolarHBondContact O-N 3.07Å; P51-G53 PolarHBondContact O-N 2.83Å; G53-K57 WeakPolarHBondContact O-CG 3.3Å; G53-K57 PolarHBondContact O-N 3.31Å
54	A	88.4	Confident	89.6	Confident	18 Å²	18	38.8 Å²	38.8	15%	0.149	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-50	169.9	0	0	0	0	0	111.6	E49 P51 P52 V56 K57 S58	E49-A54 HydrophobicContact CB-CB 3.71Å; P51-A54 WeakPolarHBondContact O-CB 3.28Å; P51-A54 PolarHBondContact O-N 3.47Å; P52-A54 VanDerWaalsContact C-N 3.33Å; A54-V56 VanDerWaalsContact C-N 3.29Å; A54-V56 PolarHBondContact O-N 2.86Å; A54-K57 WeakPolarHBondContact O-CA 3.17Å; A54-K57 WeakPolarHBondContact O-CB 3.47Å; A54-K57 PolarHBondContact O-N 3.49Å; A54-S58 PolarHBondContact O-N 2.82Å; A54-S58 PolarHBondContact O-OG 3.32Å
55	L	89.5	Confident	89.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-39.3	177.9	-178.5	58.4	0	0	0	112.3	I45 Q48 E49 K57 S58 I59 V210	I45-L55 HydrophobicContact CG2-CD2 4Å; I45-L55 HydrophobicContact CG2-CG 4.17Å; Q48-L55 HydrophobicContact CB-CD2 3.87Å; Q48-L55 HydrophobicContact CG-CD2 4.12Å; Q48-L55 VanDerWaalsContact OE1-CD2 3.31Å; E49-L55 HydrophobicContact CB-CB 4.28Å; E49-L55 HydrophobicContact CG-CB 4.13Å; E49-L55 VanDerWaalsContact OE2-CA 3.29Å; E49-L55 WeakPolarHBondContact OE2-CA 3.42Å; E49-L55 PolarHBondContact OE2-N 2.83Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 2.71Å; L55-S58 CarbonylContact O-C 2.85Å; L55-S58 WeakPolarHBondContact O-CA 3.49Å; L55-S58 WeakPolarHBondContact O-CB 3.38Å; L55-S58 PolarHBondContact O-N 3.46Å; L55-S58 VanDerWaalsContact O-N 3.09Å; L55-I59 HydrophobicContact CD1-CD1 4.33Å; L55-I59 HydrophobicContact CD1-CG1 4.34Å; L55-I59 HydrophobicContact CG-CD1 3.95Å; L55-I59 HydrophobicContact CG-CG1 4.44Å; L55-I59 WeakPolarHBondContact O-CG1 3.49Å; L55-I59 PolarHBondContact O-N 3.01Å; L55-V210 HydrophobicContact CD1-CB 3.86Å; L55-V210 HydrophobicContact CD1-CG1 4.13Å; L55-V210 HydrophobicContact CD1-CG2 3.94Å
56	V	91.2	Very high	90.2	Very high	10 Å²	10	39.5 Å²	39.5	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-37.2	175	176.7	0	0	0	0	111.7	T41 I45 A46 A54 R60 I113	T41-V56 HydrophobicContact CG2-CG1 3.84Å; T41-V56 HydrophobicContact CG2-CG2 4.47Å; I45-V56 HydrophobicContact CG2-CG2 3.84Å; A46-V56 HydrophobicContact CB-CG2 4.42Å; A54-V56 VanDerWaalsContact C-N 3.29Å; A54-V56 PolarHBondContact O-N 2.86Å; V56-R60 VanDerWaalsContact O-CB 3.31Å; V56-R60 WeakPolarHBondContact O-CB 3.35Å; V56-R60 PolarHBondContact O-N 2.68Å; V56-I113 HydrophobicContact CG1-CG2 4.39Å
57	K	90.6	Very high	90.6	Very high	106 Å²	106	39.6 Å²	39.6	46%	0.461	22%	0.222	S	C	.	.	H	α-helix	trans	-70.1	-36.1	174.4	-66	160.5	-173.9	165.1	0	111.8	G53 A54 L55 R60 S61	G53-K57 WeakPolarHBondContact O-CG 3.3Å; G53-K57 PolarHBondContact O-N 3.31Å; A54-K57 WeakPolarHBondContact O-CA 3.17Å; A54-K57 WeakPolarHBondContact O-CB 3.47Å; A54-K57 PolarHBondContact O-N 3.49Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 2.71Å; K57-R60 PolarHBondContact O-N 3.08Å; K57-S61 PolarHBondContact O-N 3.04Å
58	S	91.8	Very high	90.9	Very high	18 Å²	18	42.6 Å²	42.6	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-45.5	174	-56.9	0	0	0	0	111.4	A54 L55 S61 F62	A54-S58 PolarHBondContact O-N 2.82Å; A54-S58 PolarHBondContact O-OG 3.32Å; L55-S58 CarbonylContact O-C 2.85Å; L55-S58 WeakPolarHBondContact O-CA 3.49Å; L55-S58 WeakPolarHBondContact O-CB 3.38Å; L55-S58 PolarHBondContact O-N 3.46Å; L55-S58 VanDerWaalsContact O-N 3.09Å; S58-S61 PolarHBondContact O-N 2.92Å; S58-F62 PolarHBondContact O-N 2.72Å
59	I	93.4	Very high	91.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-43.4	173.3	-66.8	163.4	0	0	0	111.2	I39 I45 L55 S61 F62 T63 I151 A183 A209 V210	I39-I59 HydrophobicContact CG2-CG2 3.79Å; I45-I59 HydrophobicContact CG2-CD1 3.76Å; L55-I59 HydrophobicContact CD1-CD1 4.33Å; L55-I59 HydrophobicContact CD1-CG1 4.34Å; L55-I59 HydrophobicContact CG-CD1 3.95Å; L55-I59 HydrophobicContact CG-CG1 4.44Å; L55-I59 WeakPolarHBondContact O-CG1 3.49Å; L55-I59 PolarHBondContact O-N 3.01Å; I59-S61 PolarHBondContact O-N 3.01Å; I59-F62 WeakPolarHBondContact O-CB 3.17Å; I59-F62 PolarHBondContact O-N 2.04Å; I59-F62 VanDerWaalsContact O-N 3.1Å; I59-T63 PolarHBondContact O-N 3.31Å; I59-T63 PolarHBondContact O-OG1 3.47Å; I59-I151 HydrophobicContact CG1-CG2 4.45Å; I59-I151 HydrophobicContact CG2-CB 4.35Å; I59-I151 HydrophobicContact CG2-CD1 4Å; I59-I151 HydrophobicContact CG2-CG2 3.85Å; I59-A183 HydrophobicContact CD1-CB 3.84Å; I59-A209 HydrophobicContact CG1-CB 4.48Å; I59-V210 HydrophobicContact CG1-CG2 4.11Å
60	R	93.3	Very high	91.6	Very high	62 Å²	62	43.4 Å²	43.4	23%	0.234	23%	0.227	C	C	.	.	H	α-helix	trans	-56.9	-39.5	174.5	-169.3	-176.7	72.8	171.2	11	111.8	V56 K57 T63 E64 L110 V111 I113	V56-R60 VanDerWaalsContact O-CB 3.31Å; V56-R60 WeakPolarHBondContact O-CB 3.35Å; V56-R60 PolarHBondContact O-N 2.68Å; K57-R60 PolarHBondContact O-N 3.08Å; R60-T63 PolarHBondContact O-N 2.84Å; R60-E64 WeakPolarHBondContact O-CB 3.38Å; R60-E64 PolarHBondContact O-N 3.16Å; R60-L110 WeakPolarHBondContact CD-O 3.44Å; R60-L110 HydrophobicContact CG-CD1 4.16Å; R60-L110 HydrophobicContact CG-CG 3.92Å; R60-V111 PolarHBondContact NH1-O 3.25Å; R60-I113 PolarHBondContact NH1-O 3.31Å
61	S	93.7	Very high	92	Very high	37 Å²	37	44.5 Å²	44.5	26%	0.259	22%	0.217	S	C	.	.	H	α-helix	trans	-75.4	-30.5	175.9	-171.5	0	0	0	0	113.4	K57 S58 I59 E64 Q65 I219	K57-S61 PolarHBondContact O-N 3.04Å; S58-S61 PolarHBondContact O-N 2.92Å; I59-S61 PolarHBondContact O-N 3.01Å; S61-E64 PolarHBondContact O-N 3.03Å; S61-Q65 WeakPolarHBondContact O-CB 3.36Å; S61-Q65 WeakPolarHBondContact O-CG 3.34Å; S61-Q65 PolarHBondContact O-N 2.97Å; S61-I219 WeakPolarHBondContact OG-CD1 3.48Å
62	F	95.6	Very high	91.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-50.7	166.6	170.7	-86.8	0	0	0	110.6	S58 I59 E64 Q65 F66 I151 V181 A209 I219 T223 I224	S58-F62 PolarHBondContact O-N 2.72Å; I59-F62 WeakPolarHBondContact O-CB 3.17Å; I59-F62 PolarHBondContact O-N 2.04Å; I59-F62 VanDerWaalsContact O-N 3.1Å; F62-E64 VanDerWaalsContact C-N 3.33Å; F62-E64 PolarHBondContact O-N 3.09Å; F62-Q65 PolarHBondContact O-N 2.9Å; F62-F66 HydrophobicContact CE1-CD2 4.07Å; F62-F66 HydrophobicContact CZ-CD2 4.24Å; F62-F66 WeakPolarHBondContact O-CB 3.26Å; F62-F66 PolarHBondContact O-N 3.25Å; F62-I151 HydrophobicContact CD1-CD1 3.82Å; F62-I151 HydrophobicContact CE1-CD1 3.87Å; F62-V181 HydrophobicContact CE1-CG1 4.43Å; F62-V181 HydrophobicContact CZ-CG1 4.14Å; F62-A209 HydrophobicContact CB-CB 4.38Å; F62-A209 HydrophobicContact CD1-CB 4.05Å; F62-A209 HydrophobicContact CD2-CB 3.95Å; F62-A209 WeakPolarHBondContact CD2-O 3.35Å; F62-A209 HydrophobicContact CE1-CB 4.29Å; F62-A209 HydrophobicContact CE2-CB 4.19Å; F62-A209 HydrophobicContact CG-CB 3.88Å; F62-A209 HydrophobicContact CZ-CB 4.35Å; F62-I219 HydrophobicContact CB-CG2 3.93Å; F62-I219 HydrophobicContact CD2-CG2 3.95Å; F62-I219 HydrophobicContact CG-CG2 4.42Å; F62-T223 HydrophobicContact CE2-CG2 4.2Å; F62-T223 HydrophobicContact CZ-CG2 3.99Å; F62-I224 HydrophobicContact CD2-CD1 3.86Å; F62-I224 HydrophobicContact CD2-CG1 3.89Å; F62-I224 HydrophobicContact CE1-CG1 4.48Å; F62-I224 HydrophobicContact CE2-CD1 3.9Å; F62-I224 HydrophobicContact CE2-CG1 3.37Å; F62-I224 HydrophobicContact CG-CD1 4.41Å; F62-I224 HydrophobicContact CZ-CD1 4.48Å; F62-I224 HydrophobicContact CZ-CG1 3.72Å
63	T	96.3	Very high	91.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-38.4	177.3	-58.1	0	0	0	0	112.1	F37 I39 I59 R60 F66 V67 F106 L110	F37-T63 HydrophobicContact CB-CG2 4.43Å; F37-T63 HydrophobicContact CD1-CG2 3.76Å; F37-T63 HydrophobicContact CD2-CG2 4.06Å; F37-T63 HydrophobicContact CE1-CG2 3.94Å; F37-T63 HydrophobicContact CE2-CG2 4.22Å; F37-T63 HydrophobicContact CG-CG2 3.81Å; F37-T63 HydrophobicContact CZ-CG2 4.17Å; I39-T63 HydrophobicContact CD1-CG2 4.29Å; I59-T63 PolarHBondContact O-N 3.31Å; I59-T63 PolarHBondContact O-OG1 3.47Å; R60-T63 PolarHBondContact O-N 2.84Å; T63-F66 WeakPolarHBondContact O-CB 3.43Å; T63-F66 PolarHBondContact O-N 2.71Å; T63-V67 PolarHBondContact O-N 2.89Å; T63-F106 HydrophobicContact CG2-CE1 4.11Å; T63-F106 HydrophobicContact CG2-CZ 4.05Å; T63-L110 HydrophobicContact CG2-CD1 3.94Å; T63-L110 HydrophobicContact CG2-CD2 3.88Å
64	E	95.3	Very high	91.3	Very high	58 Å²	58	46.7 Å²	46.7	27%	0.271	21%	0.214	S	C	.	.	H	α-helix	trans	-61.2	-47	174	-160.2	-159.4	153.1	0	0	111.7	R60 S61 F62 F66 V67 R68 L107 L110	R60-E64 WeakPolarHBondContact O-CB 3.38Å; R60-E64 PolarHBondContact O-N 3.16Å; S61-E64 PolarHBondContact O-N 3.03Å; F62-E64 VanDerWaalsContact C-N 3.33Å; F62-E64 PolarHBondContact O-N 3.09Å; E64-F66 VanDerWaalsContact C-N 3.32Å; E64-F66 PolarHBondContact O-N 2.97Å; E64-V67 PolarHBondContact O-N 2.84Å; E64-R68 WeakPolarHBondContact O-CB 3.36Å; E64-R68 VanDerWaalsContact O-CG 3.27Å; E64-R68 WeakPolarHBondContact O-CG 3.44Å; E64-R68 PolarHBondContact O-N 3.28Å; E64-R68 IonicContact OE1-CZ 2.68Å; E64-R68 IonicContact OE1-NE 3.65Å; E64-R68 PolarHBondContact OE1-NE 3.38Å; E64-R68 IonicContact OE1-NH2 3.63Å; E64-R68 PolarHBondContact OE1-NH2 2.8Å; E64-L107 HydrophobicContact CB-CD2 4.47Å; E64-L107 HydrophobicContact CG-CD2 3.74Å; E64-L110 HydrophobicContact CB-CD2 4.12Å
65	Q	95.2	Very high	90.4	Very high	59 Å²	59	46.6 Å²	46.6	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-32.2	176.4	-73.9	-176.4	61.9	0	0	112.8	S61 F62 R69 I219 I224	S61-Q65 WeakPolarHBondContact O-CB 3.36Å; S61-Q65 WeakPolarHBondContact O-CG 3.34Å; S61-Q65 PolarHBondContact O-N 2.97Å; F62-Q65 PolarHBondContact O-N 2.9Å; Q65-R69 WeakPolarHBondContact O-CD 3.28Å; Q65-R69 WeakPolarHBondContact O-CG 3.27Å; Q65-R69 PolarHBondContact O-N 3.17Å; Q65-I219 VanDerWaalsContact NE2-CD1 3.34Å; Q65-I224 HydrophobicContact CB-CD1 4.02Å
66	F	96.6	Very high	89.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-56.5	173	-160.7	-58.3	0	0	0	109.9	L35 F37 F62 T63 E64 R68 R69 L70 V149 I224 I227 I228 M231	L35-F66 HydrophobicContact CD2-CD1 4.4Å; L35-F66 HydrophobicContact CD2-CE1 3.95Å; F37-F66 HydrophobicContact CE1-CB 4.44Å; F37-F66 HydrophobicContact CE1-CD1 4.32Å; F37-F66 HydrophobicContact CE1-CD2 4.23Å; F37-F66 HydrophobicContact CE1-CG 4.09Å; F37-F66 HydrophobicContact CZ-CB 4.17Å; F37-F66 AromaticContact CZ-CD1 3.68Å; F37-F66 HydrophobicContact CZ-CD1 3.68Å; F37-F66 HydrophobicContact CZ-CD2 4.39Å; F37-F66 HydrophobicContact CZ-CE1 4.12Å; F37-F66 AromaticContact CZ-CG 3.84Å; F37-F66 HydrophobicContact CZ-CG 3.84Å; F62-F66 HydrophobicContact CE1-CD2 4.07Å; F62-F66 HydrophobicContact CZ-CD2 4.24Å; F62-F66 WeakPolarHBondContact O-CB 3.26Å; F62-F66 PolarHBondContact O-N 3.25Å; T63-F66 WeakPolarHBondContact O-CB 3.43Å; T63-F66 PolarHBondContact O-N 2.71Å; E64-F66 VanDerWaalsContact C-N 3.32Å; E64-F66 PolarHBondContact O-N 2.97Å; F66-R68 VanDerWaalsContact C-N 3.33Å; F66-R68 PolarHBondContact O-N 3.11Å; F66-R69 PolarHBondContact O-N 2.96Å; F66-L70 HydrophobicContact CD1-CD1 4.27Å; F66-L70 HydrophobicContact CD1-CD2 4.45Å; F66-L70 HydrophobicContact CD1-CG 4.34Å; F66-L70 HydrophobicContact CE1-CD1 4.43Å; F66-L70 HydrophobicContact CE1-CD2 4.17Å; F66-L70 PolarHBondContact O-N 2.73Å; F66-V149 HydrophobicContact CE2-CG2 4.35Å; F66-V149 HydrophobicContact CZ-CG2 4.17Å; F66-I224 HydrophobicContact CB-CD1 4.36Å; F66-I224 HydrophobicContact CB-CG1 4.46Å; F66-I224 HydrophobicContact CB-CG2 4.04Å; F66-I224 HydrophobicContact CD1-CG2 4.39Å; F66-I224 HydrophobicContact CD2-CB 4.2Å; F66-I224 HydrophobicContact CD2-CG1 4Å; F66-I224 HydrophobicContact CD2-CG2 3.79Å; F66-I224 HydrophobicContact CE2-CG2 4.34Å; F66-I224 HydrophobicContact CG-CG2 3.81Å; F66-I227 HydrophobicContact CE2-CB 4.15Å; F66-I227 HydrophobicContact CE2-CD1 4.34Å; F66-I227 HydrophobicContact CE2-CG2 4.03Å; F66-I227 HydrophobicContact CZ-CB 4.14Å; F66-I227 HydrophobicContact CZ-CG2 3.68Å; F66-I228 HydrophobicContact CD1-CD1 4.07Å; F66-I228 HydrophobicContact CD1-CG1 4.21Å; F66-I228 HydrophobicContact CE1-CD1 4Å; F66-I228 HydrophobicContact CE1-CG1 3.62Å; F66-I228 HydrophobicContact CZ-CG1 3.89Å; F66-M231 HydrophobicContact CZ-CE 4.15Å; F66-M231 HydrophobicContact CZ-SD 4.36Å
67	V	95.6	Very high	88	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-37.1	-177.6	171.1	0	0	0	0	112.4	F37 T63 E64 R69 L70 I85 K103 F106 L107	F37-V67 HydrophobicContact CE2-CG2 3.6Å; F37-V67 HydrophobicContact CZ-CG2 4.03Å; T63-V67 PolarHBondContact O-N 2.89Å; E64-V67 PolarHBondContact O-N 2.84Å; V67-R69 PolarHBondContact O-N 2.87Å; V67-L70 HydrophobicContact CG2-CD1 4.49Å; V67-L70 PolarHBondContact O-N 2.99Å; V67-L70 VanDerWaalsContact O-N 3.16Å; V67-I85 HydrophobicContact CB-CD1 4.26Å; V67-I85 HydrophobicContact CG1-CD1 3.6Å; V67-I85 HydrophobicContact CG2-CD1 3.83Å; V67-I85 HydrophobicContact CG2-CG2 4.3Å; V67-K103 HydrophobicContact CG1-CB 4.22Å; V67-K103 HydrophobicContact CG1-CG 4.26Å; V67-F106 HydrophobicContact CB-CE1 4.48Å; V67-F106 HydrophobicContact CG1-CD1 4.26Å; V67-F106 HydrophobicContact CG2-CD1 3.93Å; V67-F106 HydrophobicContact CG2-CE1 3.59Å; V67-F106 HydrophobicContact CG2-CZ 4.45Å; V67-L107 HydrophobicContact CB-CD2 4.05Å; V67-L107 HydrophobicContact CG1-CD1 4.22Å; V67-L107 HydrophobicContact CG1-CD2 3.94Å; V67-L107 HydrophobicContact CG1-CG 3.95Å
68	R	94.5	Very high	86.9	Confident	154 Å²	154	57.7 Å²	57.7	58%	0.581	27%	0.265	S	S	*	.	H	α-helix	trans	-65.7	-17.5	174.8	-72.2	-178.8	-173.2	-67.2	1.9	114.4	E64 F66 L107	E64-R68 WeakPolarHBondContact O-CB 3.36Å; E64-R68 VanDerWaalsContact O-CG 3.27Å; E64-R68 WeakPolarHBondContact O-CG 3.44Å; E64-R68 PolarHBondContact O-N 3.28Å; E64-R68 IonicContact OE1-CZ 2.68Å; E64-R68 IonicContact OE1-NE 3.65Å; E64-R68 PolarHBondContact OE1-NE 3.38Å; E64-R68 IonicContact OE1-NH2 3.63Å; E64-R68 PolarHBondContact OE1-NH2 2.8Å; F66-R68 VanDerWaalsContact C-N 3.33Å; F66-R68 PolarHBondContact O-N 3.11Å; R68-L107 HydrophobicContact CG-CD1 4.33Å
69	R	93.9	Very high	86.1	Confident	92 Å²	92	57 Å²	57	35%	0.347	26%	0.26	S	S	.	.	H	α-helix	trans	-89.1	-15.5	174.7	-74	169.2	-178	-115.4	8	113.3	Q65 F66 V67 K71 D225 I228	Q65-R69 WeakPolarHBondContact O-CD 3.28Å; Q65-R69 WeakPolarHBondContact O-CG 3.27Å; Q65-R69 PolarHBondContact O-N 3.17Å; F66-R69 PolarHBondContact O-N 2.96Å; V67-R69 PolarHBondContact O-N 2.87Å; R69-K71 PolarHBondContact O-N 3.5Å; R69-D225 IonicContact CZ-OD1 2.68Å; R69-D225 IonicContact CZ-OD2 3.87Å; R69-D225 IonicContact NH1-OD1 3.58Å; R69-D225 PolarHBondContact NH1-OD1 3.03Å; R69-D225 IonicContact NH1-OD2 3.18Å; R69-D225 PolarHBondContact NH1-OD2 3.41Å; R69-I228 HydrophobicContact CB-CD1 3.75Å
70	L	92.6	Very high	85.6	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.042	27%	0.27	C	S	.	.			trans	-75.3	110.5	178.6	-62.3	173.7	0	0	0	111.5	L35 F66 V67 W83 I85 K103 I228	L35-L70 HydrophobicContact CD2-CD1 3.49Å; L35-L70 VanDerWaalsContact CD2-CD1 3.49Å; F66-L70 HydrophobicContact CD1-CD1 4.27Å; F66-L70 HydrophobicContact CD1-CD2 4.45Å; F66-L70 HydrophobicContact CD1-CG 4.34Å; F66-L70 HydrophobicContact CE1-CD1 4.43Å; F66-L70 HydrophobicContact CE1-CD2 4.17Å; F66-L70 PolarHBondContact O-N 2.73Å; V67-L70 HydrophobicContact CG2-CD1 4.49Å; V67-L70 PolarHBondContact O-N 2.99Å; V67-L70 VanDerWaalsContact O-N 3.16Å; L70-W83 HydrophobicContact CB-CD2 4.29Å; L70-W83 HydrophobicContact CB-CG 4.28Å; L70-W83 HydrophobicContact CD1-CD2 4.32Å; L70-W83 HydrophobicContact CD1-CE3 4.04Å; L70-W83 HydrophobicContact CD1-CZ3 4.47Å; L70-W83 HydrophobicContact CD2-CD2 3.99Å; L70-W83 HydrophobicContact CD2-CE3 3.92Å; L70-W83 HydrophobicContact CD2-CH2 3.72Å; L70-W83 HydrophobicContact CD2-CZ2 3.78Å; L70-W83 HydrophobicContact CD2-CZ3 3.78Å; L70-W83 HydrophobicContact CG-CD2 4.43Å; L70-W83 HydrophobicContact CG-CE3 4.47Å; L70-I85 HydrophobicContact CD1-CD1 3.68Å; L70-K103 WeakPolarHBondContact O-CE 3.21Å; L70-K103 PolarHBondContact O-NZ 3.22Å; L70-I228 HydrophobicContact CD2-CD1 3.79Å; L70-I228 HydrophobicContact CD2-CG1 3.81Å; L70-I228 HydrophobicContact CD2-CG2 4.33Å; L70-I228 HydrophobicContact CG-CD1 4.38Å
71	K	87.1	Confident	85.2	Confident	139 Å²	139	55.8 Å²	55.8	60%	0.604	26%	0.26	S	S	*	.			trans	-104.5	142.1	176.9	-65.4	177.7	-177	177.4	0	110.6	R69 W83	R69-K71 PolarHBondContact O-N 3.5Å; K71-W83 VanDerWaalsContact O-CD1 3.28Å; K71-W83 PolarHBondContact O-NE1 3.1Å
72	D	83.9	Confident	85	Confident	92 Å²	92	56.9 Å²	56.9	49%	0.492	27%	0.266	S	S	.	.			trans	-83.5	115.8	167.6	-46.9	-59.4	0	0	0	105.9	I81 W83 K103	D72-I81 WeakPolarHBondContact CA-O 3.31Å; D72-W83 PolarHBondContact OD1-N 2.93Å; D72-K103 IonicContact OD1-NZ 3.4Å; D72-K103 PolarHBondContact OD1-NZ 3.44Å; D72-K103 IonicContact OD2-NZ 3.09Å; D72-K103 PolarHBondContact OD2-NZ 2.85Å
73	E	81.6	Confident	84.8	Confident	65 Å²	65	57.7 Å²	57.7	30%	0.304	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	156.6	-167.1	64.4	-174.9	115.1	0	0	111.4	I81 R232	E73-I81 PolarHBondContact N-O 3.2Å; E73-I81 PolarHBondContact O-N 2.87Å; E73-R232 IonicContact OE1-CZ 2.68Å; E73-R232 IonicContact OE1-NH1 2.78Å; E73-R232 PolarHBondContact OE1-NH1 3.33Å; E73-R232 IonicContact OE1-NH2 3.17Å; E73-R232 IonicContact OE2-CZ 3.08Å; E73-R232 IonicContact OE2-NH1 2.95Å; E73-R232 PolarHBondContact OE2-NH1 2.72Å; E73-R232 IonicContact OE2-NH2 2.94Å; E73-R232 PolarHBondContact OE2-NH2 3.32Å
74	E	77.4	Confident	84.6	Confident	61 Å²	61	58.7 Å²	58.7	29%	0.285	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	109.3	178.1	-171	168.5	-124.4	0	0	110.7	R28 R76 N77 V79	R28-E74 VanDerWaalsContact CD-OE1 3.29Å; R28-E74 WeakPolarHBondContact CD-OE1 3.48Å; R28-E74 IonicContact CZ-OE1 3.55Å; R28-E74 IonicContact CZ-OE2 3.95Å; R28-E74 IonicContact NE-OE1 3.79Å; R28-E74 IonicContact NH1-OE1 2.66Å; R28-E74 PolarHBondContact NH1-OE1 2.89Å; R28-E74 IonicContact NH1-OE2 2.85Å; R28-E74 PolarHBondContact NH1-OE2 3.26Å; E74-R76 PolarHBondContact O-N 3.21Å; E74-N77 VanDerWaalsContact CD-C 3.49Å; E74-N77 WeakPolarHBondContact OE2-CA 3.46Å; E74-V79 CarbonylContact C-O 3.45Å; E74-V79 WeakPolarHBondContact CA-O 3.43Å
75	I	69.5	Low	84.6	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	122.2	176.4	-61.1	-166.1	0	0	0	109.1	N77 A78 V79 I81 R232 F236	I75-N77 PolarHBondContact O-N 3.28Å; I75-N77 VanDerWaalsContact O-N 3.13Å; I75-A78 PolarHBondContact O-N 2.76Å; I75-A78 VanDerWaalsContact O-N 3.1Å; I75-V79 PolarHBondContact N-O 3.41Å; I75-V79 PolarHBondContact O-N 2.73Å; I75-I81 HydrophobicContact CD1-CD1 3.37Å; I75-I81 HydrophobicContact CG1-CD1 3.74Å; I75-R232 HydrophobicContact CD1-CB 3.89Å; I75-R232 HydrophobicContact CD1-CG 4.21Å; I75-R232 WeakPolarHBondContact CD1-O 3.43Å; I75-F236 HydrophobicContact CB-CD2 4.14Å; I75-F236 HydrophobicContact CD1-CB 4.43Å; I75-F236 HydrophobicContact CG2-CB 4.11Å; I75-F236 HydrophobicContact CG2-CD2 3.46Å; I75-F236 VanDerWaalsContact CG2-CD2 3.46Å; I75-F236 HydrophobicContact CG2-CE2 4.21Å; I75-F236 HydrophobicContact CG2-CG 3.99Å
76	R	66.2	Low	84.6	Confident	188 Å²	188	53.1 Å²	53.1	71%	0.709	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	31	174.4	-65.4	172.1	170.1	-177.5	-5.4	113.7	E74 A78 F236	E74-R76 PolarHBondContact O-N 3.21Å; R76-A78 PolarHBondContact O-N 2.94Å; R76-F236 HydrophobicContact CB-CE2 4.2Å; R76-F236 HydrophobicContact CG-CE2 4.46Å; R76-F236 VanDerWaalsContact NH1-CE1 3.3Å
77	N	64.6	Low	84.6	Confident	131 Å²	131	53.1 Å²	53.1	70%	0.701	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	25.8	-178.4	-52.2	-16.6	0	0	0	114.1	E74 I75	E74-N77 VanDerWaalsContact CD-C 3.49Å; E74-N77 WeakPolarHBondContact OE2-CA 3.46Å; I75-N77 PolarHBondContact O-N 3.28Å; I75-N77 VanDerWaalsContact O-N 3.13Å
78	A	66.6	Low	84.6	Confident	30 Å²	30	53 Å²	53	25%	0.248	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-36.8	-174	0	0	0	0	0	114.6	I75 R76 Y240	I75-A78 PolarHBondContact O-N 2.76Å; I75-A78 VanDerWaalsContact O-N 3.1Å; R76-A78 PolarHBondContact O-N 2.94Å; A78-Y240 HydrophobicContact CB-CD2 4.01Å; A78-Y240 HydrophobicContact CB-CE2 3.85Å
79	V	75.2	Confident	84.6	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	103.1	-175.4	-178.1	0	0	0	0	110.2	C31 E74 I75 I81 F236 C239 Y240	C31-V79 HydrophobicContact CB-CG1 3.53Å; E74-V79 CarbonylContact C-O 3.45Å; E74-V79 WeakPolarHBondContact CA-O 3.43Å; I75-V79 PolarHBondContact N-O 3.41Å; I75-V79 PolarHBondContact O-N 2.73Å; V79-I81 HydrophobicContact CG1-CG1 4.39Å; V79-F236 HydrophobicContact CG2-CD2 4.28Å; V79-F236 HydrophobicContact CG2-CE2 4.46Å; V79-C239 HydrophobicContact CG1-CB 3.64Å; V79-Y240 HydrophobicContact CG2-CD2 4.1Å
80	P	81.9	Confident	84.6	Confident	33 Å²	33	41.8 Å²	41.8	21%	0.214	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	124.8	171.7	26.4	-28.9	0	0	0	110.9	E30 C31	E30-P80 HydrophobicContact CG-CG 4.15Å; C31-P80 PolarHBondContact N-O 3.47Å
81	I	86.4	Confident	84.6	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.1	178.2	-70.6	175	0	0	0	110.3	C31 I33 D72 E73 I75 V79 W83 A235	C31-I81 HydrophobicContact CB-CG1 4.01Å; I33-I81 HydrophobicContact CD1-CD1 4.15Å; I33-I81 HydrophobicContact CD1-CG1 4.42Å; I33-I81 HydrophobicContact CD1-CG2 3.51Å; I33-I81 HydrophobicContact CG1-CG2 3.96Å; D72-I81 WeakPolarHBondContact CA-O 3.31Å; E73-I81 PolarHBondContact N-O 3.2Å; E73-I81 PolarHBondContact O-N 2.87Å; I75-I81 HydrophobicContact CD1-CD1 3.37Å; I75-I81 HydrophobicContact CG1-CD1 3.74Å; V79-I81 HydrophobicContact CG1-CG1 4.39Å; I81-W83 HydrophobicContact CG2-CZ2 4.4Å; I81-A235 HydrophobicContact CD1-CB 3.9Å
82	T	89.3	Confident	84.8	Confident	61 Å²	61	39 Å²	39	37%	0.374	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.4	171.4	54	0	0	0	0	109.9	C31 I33	C31-T82 PolarHBondContact O-N 2.65Å; I33-T82 PolarHBondContact N-O 2.89Å
83	W	91.3	Very high	85.1	Confident	16 Å²	16	38.1 Å²	38.1	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	118	-177.9	-62.2	83.5	0	0	0	112.3	I33 L35 L70 K71 D72 I81 M231 R232	I33-W83 HydrophobicContact CB-CD2 4.33Å; I33-W83 HydrophobicContact CB-CE3 4Å; I33-W83 HydrophobicContact CB-CZ3 4.27Å; I33-W83 HydrophobicContact CD1-CH2 3.95Å; I33-W83 HydrophobicContact CD1-CZ2 3.97Å; I33-W83 HydrophobicContact CD1-CZ3 4.23Å; I33-W83 HydrophobicContact CG2-CD2 4.48Å; I33-W83 HydrophobicContact CG2-CE3 3.68Å; I33-W83 HydrophobicContact CG2-CH2 4.31Å; I33-W83 HydrophobicContact CG2-CZ3 3.59Å; L35-W83 HydrophobicContact CB-CE3 4.31Å; L35-W83 HydrophobicContact CB-CZ3 4.49Å; L35-W83 HydrophobicContact CD2-CE3 4.44Å; L35-W83 HydrophobicContact CD2-CZ3 4.36Å; L70-W83 HydrophobicContact CB-CD2 4.29Å; L70-W83 HydrophobicContact CB-CG 4.28Å; L70-W83 HydrophobicContact CD1-CD2 4.32Å; L70-W83 HydrophobicContact CD1-CE3 4.04Å; L70-W83 HydrophobicContact CD1-CZ3 4.47Å; L70-W83 HydrophobicContact CD2-CD2 3.99Å; L70-W83 HydrophobicContact CD2-CE3 3.92Å; L70-W83 HydrophobicContact CD2-CH2 3.72Å; L70-W83 HydrophobicContact CD2-CZ2 3.78Å; L70-W83 HydrophobicContact CD2-CZ3 3.78Å; L70-W83 HydrophobicContact CG-CD2 4.43Å; L70-W83 HydrophobicContact CG-CE3 4.47Å; K71-W83 VanDerWaalsContact O-CD1 3.28Å; K71-W83 PolarHBondContact O-NE1 3.1Å; D72-W83 PolarHBondContact OD1-N 2.93Å; I81-W83 HydrophobicContact CG2-CZ2 4.4Å; W83-M231 HydrophobicContact CH2-CB 3.97Å; W83-M231 HydrophobicContact CH2-SD 4.03Å; W83-M231 HydrophobicContact CZ3-SD 4Å; W83-R232 HydrophobicContact CZ2-CG 4.45Å
84	A	92.3	Very high	85.6	Confident	21 Å²	21	37.9 Å²	37.9	17%	0.174	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.9	164.7	0	0	0	0	0	109.6	I33 H34 L35 I100 Q101	I33-A84 PolarHBondContact O-N 3.33Å; H34-A84 WeakPolarHBondContact CA-O 3.36Å; L35-A84 PolarHBondContact N-O 3.14Å; A84-I100 HydrophobicContact CB-CG2 3.58Å; A84-Q101 CarbonylContact C-O 3.53Å; A84-Q101 WeakPolarHBondContact CA-O 3.45Å
85	I	95.2	Very high	86.3	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.3	-166.8	-45.7	-177	0	0	0	110.4	L35 F37 V67 L70 Q101 K103 F106	L35-I85 VanDerWaalsContact O-CA 3.29Å; L35-I85 WeakPolarHBondContact O-CA 3.13Å; F37-I85 HydrophobicContact CD2-CG2 3.87Å; F37-I85 HydrophobicContact CE2-CG2 3.81Å; V67-I85 HydrophobicContact CB-CD1 4.26Å; V67-I85 HydrophobicContact CG1-CD1 3.6Å; V67-I85 HydrophobicContact CG2-CD1 3.83Å; V67-I85 HydrophobicContact CG2-CG2 4.3Å; L70-I85 HydrophobicContact CD1-CD1 3.68Å; I85-Q101 PolarHBondContact N-O 2.7Å; I85-Q101 PolarHBondContact O-N 2.75Å; I85-K103 HydrophobicContact CD1-CG 3.83Å; I85-F106 HydrophobicContact CB-CB 4.35Å; I85-F106 HydrophobicContact CB-CD2 4.14Å; I85-F106 HydrophobicContact CB-CG 4.11Å; I85-F106 HydrophobicContact CG2-CD1 4.06Å; I85-F106 HydrophobicContact CG2-CD2 3.61Å; I85-F106 HydrophobicContact CG2-CE1 4.15Å; I85-F106 HydrophobicContact CG2-CE2 3.71Å; I85-F106 HydrophobicContact CG2-CG 3.8Å; I85-F106 HydrophobicContact CG2-CZ 3.98Å
86	G	95.1	Very high	87.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	172.2	171.2	0	0	0	0	0	111.7	L35 Y36 F37 S98 P99 F106	L35-G86 PolarHBondContact O-N 2.93Å; Y36-G86 WeakPolarHBondContact CA-O 3.48Å; F37-G86 PolarHBondContact N-O 3.1Å; G86-S98 WeakPolarHBondContact CA-O 3.49Å; G86-P99 WeakPolarHBondContact CA-O 3.42Å; G86-F106 WeakPolarHBondContact O-CE2 3.21Å
87	G	95.9	Very high	88.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	149	174	0	0	0	0	0	115.2	F37 F97 S98	F37-G87 CarbonylContact O-C 3.58Å; F37-G87 WeakPolarHBondContact O-CA 3.33Å; G87-F97 WeakPolarHBondContact O-CD1 3.49Å; G87-F97 PolarHBondContact O-N 3.42Å; G87-F97 VanDerWaalsContact O-N 3.12Å; G87-S98 PolarHBondContact N-O 3.26Å; G87-S98 PolarHBondContact O-N 2.66Å
88	L	95.9	Very high	90.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155.4	169.1	75.3	83.9	0	0	0	110.1	Y36 F37 T38 I39 F90 Q94 E95 V96 A126 R129 M130	Y36-L88 HydrophobicContact CE1-CB 4.12Å; Y36-L88 HydrophobicContact CE1-CD2 3.98Å; Y36-L88 HydrophobicContact CE1-CG 3.95Å; F37-L88 PolarHBondContact O-N 3.49Å; F37-L88 VanDerWaalsContact O-O 3.12Å; T38-L88 WeakPolarHBondContact CA-O 3.24Å; T38-L88 HydrophobicContact CG2-CD1 4.03Å; T38-L88 HydrophobicContact CG2-CG 4.44Å; I39-L88 PolarHBondContact N-O 3.06Å; L88-F90 HydrophobicContact CD1-CB 3.97Å; L88-F90 HydrophobicContact CD1-CD1 4.15Å; L88-F90 HydrophobicContact CD1-CG 4.48Å; L88-Q94 HydrophobicContact CD1-CB 4.31Å; L88-E95 CarbonylContact C-O 3.58Å; L88-E95 WeakPolarHBondContact CA-O 3.27Å; L88-E95 WeakPolarHBondContact CB-O 3.42Å; L88-V96 HydrophobicContact CB-CB 4.48Å; L88-V96 HydrophobicContact CB-CG2 4.04Å; L88-A126 HydrophobicContact CD1-CB 4.3Å; L88-R129 HydrophobicContact CD2-CB 4.05Å; L88-R129 HydrophobicContact CD2-CG 4.06Å; L88-M130 HydrophobicContact CD2-CB 4.2Å
89	H	94.9	Very high	91.4	Very high	10 Å²	10	29.5 Å²	29.5	5%	0.046	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	152.6	164.7	72.6	113.5	0	0	0	110.3	I39 T41 E95 F97 I113 L117	I39-H89 HydrophobicContact CB-CB 4.12Å; I39-H89 CarbonylContact O-C 3.48Å; I39-H89 WeakPolarHBondContact O-CA 3.44Å; I39-H89 WeakPolarHBondContact O-CB 3.29Å; T41-H89 HydrophobicContact CG2-CB 3.89Å; T41-H89 PolarHBondContact OG1-ND1 3.24Å; H89-E95 PolarHBondContact N-O 3.29Å; H89-E95 PolarHBondContact O-N 3.37Å; H89-F97 HydrophobicContact CB-CD1 4.41Å; H89-I113 HydrophobicContact CB-CD1 4.3Å; H89-L117 VanDerWaalsContact CE1-CG 3.46Å; H89-L117 WeakPolarHBondContact CE1-CG 3.36Å; H89-L117 WeakPolarHBondContact ND1-CD1 3.42Å; H89-L117 WeakPolarHBondContact O-CD1 3.35Å
90	F	94.4	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	167.5	-169	72.6	-82.6	0	0	0	114.7	T38 I39 D40 T41 S42 L88 T93 Q94 T121 I123 A126	T38-F90 HydrophobicContact CG2-CD1 3.84Å; T38-F90 HydrophobicContact CG2-CE1 3.75Å; I39-F90 VanDerWaalsContact O-CD1 3.28Å; I39-F90 WeakPolarHBondContact O-CD1 3.48Å; I39-F90 PolarHBondContact O-N 2.86Å; D40-F90 HydrophobicContact CB-CE1 3.82Å; D40-F90 HydrophobicContact CB-CE2 4.33Å; D40-F90 HydrophobicContact CB-CZ 3.65Å; T41-F90 CarbonylContact C-O 3.55Å; T41-F90 VanDerWaalsContact C-O 3.24Å; T41-F90 VanDerWaalsContact CA-O 3.32Å; T41-F90 WeakPolarHBondContact CA-O 3.44Å; T41-F90 PolarHBondContact N-O 3.33Å; T41-F90 PolarHBondContact OG1-O 3.23Å; S42-F90 PolarHBondContact N-O 2.95Å; L88-F90 HydrophobicContact CD1-CB 3.97Å; L88-F90 HydrophobicContact CD1-CD1 4.15Å; L88-F90 HydrophobicContact CD1-CG 4.48Å; F90-T93 CarbonylContact C-O 3.56Å; F90-T93 WeakPolarHBondContact CA-O 3.43Å; F90-Q94 HydrophobicContact CB-CB 4.46Å; F90-Q94 HydrophobicContact CB-CG 4.05Å; F90-T121 HydrophobicContact CE2-CG2 3.92Å; F90-I123 HydrophobicContact CE2-CB 4.4Å; F90-I123 HydrophobicContact CE2-CG1 3.75Å; F90-I123 HydrophobicContact CZ-CG1 4.02Å; F90-A126 HydrophobicContact CB-CB 3.94Å; F90-A126 HydrophobicContact CD1-CB 3.68Å; F90-A126 HydrophobicContact CD2-CB 3.76Å; F90-A126 HydrophobicContact CE1-CB 4.11Å; F90-A126 HydrophobicContact CE2-CB 4.18Å; F90-A126 HydrophobicContact CG-CB 3.5Å; F90-A126 HydrophobicContact CZ-CB 4.34Å
91	S	92.9	Very high	92.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-150.5	-124.1	165.1	62.6	0	0	0	0	106.4	T93 L117 G120 Y122	S91-T93 PolarHBondContact N-O 2.99Å; S91-T93 PolarHBondContact O-N 3.49Å; S91-T93 PolarHBondContact OG-N 3.11Å; S91-L117 WeakPolarHBondContact OG-CB 3.4Å; S91-G120 CarbonylContact C-O 3.59Å; S91-G120 VanDerWaalsContact CA-O 3.24Å; S91-G120 WeakPolarHBondContact CA-O 3.29Å; S91-G120 VanDerWaalsContact CB-O 3.28Å; S91-G120 WeakPolarHBondContact CB-O 3.4Å; S91-Y122 PolarHBondContact O-N 3.08Å
92	Q	90.5	Very high	92.8	Very high	88 Å²	88	33.1 Å²	33.1	41%	0.411	19%	0.187	S	C	.	.	S	Bend	trans	-62.8	-21.3	155.7	62.4	-175.8	-13	0	0	113.7	Q94 K119 G120 Y122	Q92-Q94 PolarHBondContact O-NE2 3.48Å; Q92-K119 WeakPolarHBondContact CB-O 3.16Å; Q92-K119 WeakPolarHBondContact CG-O 3.45Å; Q92-G120 PolarHBondContact N-O 3.3Å; Q92-G120 VanDerWaalsContact N-O 3.1Å; Q92-Y122 VanDerWaalsContact CA-CD2 3.44Å; Q92-Y122 HydrophobicContact CB-CD2 3.85Å; Q92-Y122 HydrophobicContact CB-CE2 3.62Å; Q92-Y122 HydrophobicContact CB-CG 4.43Å; Q92-Y122 WeakPolarHBondContact O-CD2 3.46Å
93	T	89.9	Confident	92.9	Very high	74 Å²	74	31.8 Å²	31.8	45%	0.454	18%	0.176	S	C	.	.	S	Bend	trans	-121.5	153	178.2	47.1	0	0	0	0	111.2	F90 S91	F90-T93 CarbonylContact C-O 3.56Å; F90-T93 WeakPolarHBondContact CA-O 3.43Å; S91-T93 PolarHBondContact N-O 2.99Å; S91-T93 PolarHBondContact O-N 3.49Å; S91-T93 PolarHBondContact OG-N 3.11Å
94	Q	92	Very high	92.9	Very high	61 Å²	61	36.5 Å²	36.5	29%	0.285	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	121.4	-177.1	-55.7	68.4	39.2	0	0	110.1	L88 F90 Q92 C125 A126	L88-Q94 HydrophobicContact CD1-CB 4.31Å; F90-Q94 HydrophobicContact CB-CB 4.46Å; F90-Q94 HydrophobicContact CB-CG 4.05Å; Q92-Q94 PolarHBondContact O-NE2 3.48Å; Q94-C125 HydrophobicContact CG-CB 4.36Å; Q94-C125 VanDerWaalsContact NE2-CB 3.3Å; Q94-A126 HydrophobicContact CG-CB 4.21Å
95	E	92.9	Very high	92.9	Very high	106 Å²	106	38.3 Å²	38.3	50%	0.495	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.8	177.9	-173.2	172.4	161.3	0	0	111.1	L88 H89 F97 L117	L88-E95 CarbonylContact C-O 3.58Å; L88-E95 WeakPolarHBondContact CA-O 3.27Å; L88-E95 WeakPolarHBondContact CB-O 3.42Å; H89-E95 PolarHBondContact N-O 3.29Å; H89-E95 PolarHBondContact O-N 3.37Å; E95-F97 PolarHBondContact O-N 2.98Å; E95-L117 HydrophobicContact CB-CD1 4.17Å
96	V	94.2	Very high	92.9	Very high	48 Å²	48	38.3 Å²	38.3	29%	0.291	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	96.8	178.4	-179.7	0	0	0	0	109.4	L88 S98 E133	L88-V96 HydrophobicContact CB-CB 4.48Å; L88-V96 HydrophobicContact CB-CG2 4.04Å; V96-S98 VanDerWaalsContact C-N 3.35Å; V96-E133 HydrophobicContact CG2-CG 3.99Å
97	F	93.8	Very high	92.8	Very high	23 Å²	23	39.1 Å²	39.1	10%	0.101	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-24.1	179.8	68.6	-95.5	0	0	0	112.8	I39 G87 H89 E95 F106 S109 L110 I113	I39-F97 HydrophobicContact CD1-CE1 4.02Å; I39-F97 HydrophobicContact CD1-CZ 4.03Å; G87-F97 WeakPolarHBondContact O-CD1 3.49Å; G87-F97 PolarHBondContact O-N 3.42Å; G87-F97 VanDerWaalsContact O-N 3.12Å; H89-F97 HydrophobicContact CB-CD1 4.41Å; E95-F97 PolarHBondContact O-N 2.98Å; F97-F106 HydrophobicContact CE2-CD2 4.17Å; F97-F106 AromaticContact CE2-CE2 3.48Å; F97-F106 HydrophobicContact CE2-CE2 3.48Å; F97-F106 VanDerWaalsContact CE2-CE2 3.48Å; F97-F106 AromaticContact CE2-CZ 3.72Å; F97-F106 HydrophobicContact CE2-CZ 3.72Å; F97-F106 AromaticContact CZ-CE2 3.71Å; F97-F106 HydrophobicContact CZ-CE2 3.71Å; F97-F106 AromaticContact CZ-CZ 3.8Å; F97-F106 HydrophobicContact CZ-CZ 3.8Å; F97-S109 WeakPolarHBondContact O-CB 3.37Å; F97-S109 PolarHBondContact O-OG 2.98Å; F97-L110 HydrophobicContact CE2-CB 4.15Å; F97-L110 HydrophobicContact CE2-CD1 3.79Å; F97-L110 HydrophobicContact CZ-CD1 3.84Å; F97-I113 HydrophobicContact CB-CD1 4.49Å; F97-I113 HydrophobicContact CB-CG1 4.4Å; F97-I113 HydrophobicContact CD1-CD1 3.66Å; F97-I113 HydrophobicContact CD1-CG1 4.43Å; F97-I113 HydrophobicContact CD2-CD1 4.25Å; F97-I113 HydrophobicContact CE1-CD1 3.81Å; F97-I113 HydrophobicContact CE2-CD1 4.4Å; F97-I113 HydrophobicContact CG-CD1 3.89Å; F97-I113 HydrophobicContact CG-CG1 4.29Å; F97-I113 HydrophobicContact CZ-CD1 4.19Å
98	S	94	Very high	92.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	125.6	174.5	-175.7	0	0	0	0	111.4	G86 G87 V96 Q101	G86-S98 WeakPolarHBondContact CA-O 3.49Å; G87-S98 PolarHBondContact N-O 3.26Å; G87-S98 PolarHBondContact O-N 2.66Å; V96-S98 VanDerWaalsContact C-N 3.35Å; S98-Q101 PolarHBondContact OG-NE2 3.09Å
99	P	92	Very high	92.5	Very high	72 Å²	72	43.8 Å²	43.8	47%	0.468	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	172.1	160.8	32.3	-36	0	0	0	109.9	G86 Q101	G86-P99 WeakPolarHBondContact CA-O 3.42Å; P99-Q101 WeakPolarHBondContact O-CG 3.48Å; P99-Q101 PolarHBondContact O-N 2.68Å
100	I	91.7	Very high	92.3	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.087	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	111.1	175.5	-66.1	176.4	0	0	0	109.9	H34 Y36 A84 M134	H34-I100 HydrophobicContact CB-CD1 4.32Å; Y36-I100 HydrophobicContact CD2-CD1 4.12Å; Y36-I100 HydrophobicContact CD2-CG1 3.93Å; Y36-I100 HydrophobicContact CE2-CG1 4.19Å; A84-I100 HydrophobicContact CB-CG2 3.58Å; I100-M134 HydrophobicContact CD1-CG 4.31Å
101	Q	90.5	Very high	92	Very high	59 Å²	59	47.1 Å²	47.1	28%	0.276	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	-171.5	-174.9	63.8	-176.5	-22.2	0	0	112.3	A84 I85 S98 P99 P105	A84-Q101 CarbonylContact C-O 3.53Å; A84-Q101 WeakPolarHBondContact CA-O 3.45Å; I85-Q101 PolarHBondContact N-O 2.7Å; I85-Q101 PolarHBondContact O-N 2.75Å; S98-Q101 PolarHBondContact OG-NE2 3.09Å; P99-Q101 WeakPolarHBondContact O-CG 3.48Å; P99-Q101 PolarHBondContact O-N 2.68Å; Q101-P105 HydrophobicContact CG-CB 3.94Å; Q101-P105 VanDerWaalsContact OE1-CB 3.31Å
102	G	89.6	Confident	91.6	Very high	40 Å²	40	56.4 Å²	56.4	41%	0.412	31%	0.305	S	S	.	.			trans	-67.1	164.2	176.9	0	0	0	0	0	114.1	P105 F106	G102-P105 WeakPolarHBondContact O-CD 3.11Å; G102-F106 PolarHBondContact O-N 3.42Å; G102-F106 VanDerWaalsContact O-N 3.11Å
103	K	91.8	Very high	91.2	Very high	32 Å²	32	52.6 Å²	52.6	14%	0.139	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-49.3	-174.4	-65.9	167.1	-169.2	168.7	0	113.5	V67 L70 D72 I85 F106 L107	V67-K103 HydrophobicContact CG1-CB 4.22Å; V67-K103 HydrophobicContact CG1-CG 4.26Å; L70-K103 WeakPolarHBondContact O-CE 3.21Å; L70-K103 PolarHBondContact O-NZ 3.22Å; D72-K103 IonicContact OD1-NZ 3.4Å; D72-K103 PolarHBondContact OD1-NZ 3.44Å; D72-K103 IonicContact OD2-NZ 3.09Å; D72-K103 PolarHBondContact OD2-NZ 2.85Å; I85-K103 HydrophobicContact CD1-CG 3.83Å; K103-F106 PolarHBondContact O-N 3.19Å; K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 VanDerWaalsContact O-CG 3.3Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.97Å
104	D	91.5	Very high	90.1	Very high	116 Å²	116	56.2 Å²	56.2	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-69	-40.7	-175.6	-51.8	-63.7	0	0	0	113.4	L107 S108	D104-L107 PolarHBondContact O-N 3.35Å; D104-S108 WeakPolarHBondContact O-CB 3.29Å; D104-S108 PolarHBondContact O-N 2.9Å; D104-S108 PolarHBondContact O-OG 3.24Å
105	P	92.2	Very high	89	Confident	59 Å²	59	61.5 Å²	61.5	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-44.6	167.2	-28.7	36.8	0	0	0	113.7	Q101 G102 L107 S108 S109	Q101-P105 HydrophobicContact CG-CB 3.94Å; Q101-P105 VanDerWaalsContact OE1-CB 3.31Å; G102-P105 WeakPolarHBondContact O-CD 3.11Å; P105-L107 PolarHBondContact O-N 3.5Å; P105-S108 WeakPolarHBondContact O-CB 3.22Å; P105-S108 PolarHBondContact O-N 2.9Å; P105-S109 PolarHBondContact O-N 3.05Å
106	F	94.6	Very high	88.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-48.7	175.9	173.1	-86.9	0	0	0	111.6	F37 T63 V67 I85 G86 F97 G102 K103 S108 S109 L110	F37-F106 HydrophobicContact CB-CZ 4.4Å; F37-F106 HydrophobicContact CD2-CE1 4.31Å; F37-F106 HydrophobicContact CD2-CE2 4.14Å; F37-F106 AromaticContact CD2-CZ 3.59Å; F37-F106 HydrophobicContact CD2-CZ 3.59Å; F37-F106 HydrophobicContact CE2-CZ 4.24Å; F37-F106 HydrophobicContact CG-CZ 4.27Å; T63-F106 HydrophobicContact CG2-CE1 4.11Å; T63-F106 HydrophobicContact CG2-CZ 4.05Å; V67-F106 HydrophobicContact CB-CE1 4.48Å; V67-F106 HydrophobicContact CG1-CD1 4.26Å; V67-F106 HydrophobicContact CG2-CD1 3.93Å; V67-F106 HydrophobicContact CG2-CE1 3.59Å; V67-F106 HydrophobicContact CG2-CZ 4.45Å; I85-F106 HydrophobicContact CB-CB 4.35Å; I85-F106 HydrophobicContact CB-CD2 4.14Å; I85-F106 HydrophobicContact CB-CG 4.11Å; I85-F106 HydrophobicContact CG2-CD1 4.06Å; I85-F106 HydrophobicContact CG2-CD2 3.61Å; I85-F106 HydrophobicContact CG2-CE1 4.15Å; I85-F106 HydrophobicContact CG2-CE2 3.71Å; I85-F106 HydrophobicContact CG2-CG 3.8Å; I85-F106 HydrophobicContact CG2-CZ 3.98Å; G86-F106 WeakPolarHBondContact O-CE2 3.21Å; F97-F106 HydrophobicContact CE2-CD2 4.17Å; F97-F106 AromaticContact CE2-CE2 3.48Å; F97-F106 HydrophobicContact CE2-CE2 3.48Å; F97-F106 VanDerWaalsContact CE2-CE2 3.48Å; F97-F106 AromaticContact CE2-CZ 3.72Å; F97-F106 HydrophobicContact CE2-CZ 3.72Å; F97-F106 AromaticContact CZ-CE2 3.71Å; F97-F106 HydrophobicContact CZ-CE2 3.71Å; F97-F106 AromaticContact CZ-CZ 3.8Å; F97-F106 HydrophobicContact CZ-CZ 3.8Å; G102-F106 PolarHBondContact O-N 3.42Å; G102-F106 VanDerWaalsContact O-N 3.11Å; K103-F106 PolarHBondContact O-N 3.19Å; F106-S108 VanDerWaalsContact C-N 3.29Å; F106-S108 PolarHBondContact O-N 3.04Å; F106-S109 WeakPolarHBondContact O-CB 3.12Å; F106-S109 PolarHBondContact O-N 2.83Å; F106-S109 VanDerWaalsContact O-N 3.14Å; F106-L110 HydrophobicContact CE1-CB 4.35Å; F106-L110 HydrophobicContact CE1-CD2 4.08Å; F106-L110 HydrophobicContact CZ-CD1 4.4Å; F106-L110 WeakPolarHBondContact O-CB 3.43Å; F106-L110 PolarHBondContact O-N 3.37Å
107	L	94.2	Very high	87.6	Confident	17 Å²	17	60.3 Å²	60.3	9%	0.089	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-38.3	176.9	-70.8	170.9	0	0	0	111.9	E64 V67 R68 K103 D104 P105 S109 L110 V111	E64-L107 HydrophobicContact CB-CD2 4.47Å; E64-L107 HydrophobicContact CG-CD2 3.74Å; V67-L107 HydrophobicContact CB-CD2 4.05Å; V67-L107 HydrophobicContact CG1-CD1 4.22Å; V67-L107 HydrophobicContact CG1-CD2 3.94Å; V67-L107 HydrophobicContact CG1-CG 3.95Å; R68-L107 HydrophobicContact CG-CD1 4.33Å; K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 VanDerWaalsContact O-CG 3.3Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.97Å; D104-L107 PolarHBondContact O-N 3.35Å; P105-L107 PolarHBondContact O-N 3.5Å; L107-S109 VanDerWaalsContact C-N 3.31Å; L107-S109 PolarHBondContact O-N 2.66Å; L107-L110 HydrophobicContact CD2-CD2 4.4Å; L107-L110 PolarHBondContact O-N 2.94Å; L107-V111 WeakPolarHBondContact O-CG2 3.29Å; L107-V111 PolarHBondContact O-N 3.31Å
108	S	92.5	Very high	86.4	Confident	76 Å²	76	60 Å²	60	53%	0.531	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-27.9	177.1	-58.1	0	0	0	0	113.5	D104 P105 F106	D104-S108 WeakPolarHBondContact O-CB 3.29Å; D104-S108 PolarHBondContact O-N 2.9Å; D104-S108 PolarHBondContact O-OG 3.24Å; P105-S108 WeakPolarHBondContact O-CB 3.22Å; P105-S108 PolarHBondContact O-N 2.9Å; F106-S108 VanDerWaalsContact C-N 3.29Å; F106-S108 PolarHBondContact O-N 3.04Å
109	S	92.4	Very high	85.2	Confident	21 Å²	21	66 Å²	66	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-79	-44.1	170.4	-96.5	0	0	0	0	112.1	F97 P105 F106 L107 V111 R112	F97-S109 WeakPolarHBondContact O-CB 3.37Å; F97-S109 PolarHBondContact O-OG 2.98Å; P105-S109 PolarHBondContact O-N 3.05Å; F106-S109 WeakPolarHBondContact O-CB 3.12Å; F106-S109 PolarHBondContact O-N 2.83Å; F106-S109 VanDerWaalsContact O-N 3.14Å; L107-S109 VanDerWaalsContact C-N 3.31Å; L107-S109 PolarHBondContact O-N 2.66Å; S109-V111 VanDerWaalsContact C-N 3.25Å; S109-V111 PolarHBondContact O-N 2.99Å; S109-R112 VanDerWaalsContact O-CB 3.25Å; S109-R112 WeakPolarHBondContact O-CB 3.46Å; S109-R112 WeakPolarHBondContact O-CG 3.3Å; S109-R112 PolarHBondContact O-N 2.96Å
110	L	91.7	Very high	84.7	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-54.6	-38.4	-177.1	-178.2	69.1	0	0	0	112.7	I39 R60 T63 E64 F97 F106 L107 R112 I113	I39-L110 HydrophobicContact CD1-CD1 3.99Å; R60-L110 WeakPolarHBondContact CD-O 3.44Å; R60-L110 HydrophobicContact CG-CD1 4.16Å; R60-L110 HydrophobicContact CG-CG 3.92Å; T63-L110 HydrophobicContact CG2-CD1 3.94Å; T63-L110 HydrophobicContact CG2-CD2 3.88Å; E64-L110 HydrophobicContact CB-CD2 4.12Å; F97-L110 HydrophobicContact CE2-CB 4.15Å; F97-L110 HydrophobicContact CE2-CD1 3.79Å; F97-L110 HydrophobicContact CZ-CD1 3.84Å; F106-L110 HydrophobicContact CE1-CB 4.35Å; F106-L110 HydrophobicContact CE1-CD2 4.08Å; F106-L110 HydrophobicContact CZ-CD1 4.4Å; F106-L110 WeakPolarHBondContact O-CB 3.43Å; F106-L110 PolarHBondContact O-N 3.37Å; L107-L110 HydrophobicContact CD2-CD2 4.4Å; L107-L110 PolarHBondContact O-N 2.94Å; L110-R112 PolarHBondContact O-N 3.47Å; L110-I113 HydrophobicContact CD1-CD1 4.06Å; L110-I113 WeakPolarHBondContact O-CG1 3.4Å; L110-I113 PolarHBondContact O-N 3.43Å
111	V	87.4	Confident	84.5	Confident	79 Å²	79	62.3 Å²	62.3	48%	0.479	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.6	177.2	172.8	0	0	0	0	112.9	R60 L107 S109 I113	R60-V111 PolarHBondContact NH1-O 3.25Å; L107-V111 WeakPolarHBondContact O-CG2 3.29Å; L107-V111 PolarHBondContact O-N 3.31Å; S109-V111 VanDerWaalsContact C-N 3.25Å; S109-V111 PolarHBondContact O-N 2.99Å; V111-I113 PolarHBondContact O-N 2.91Å
112	R	83.5	Confident	84.7	Confident	194 Å²	194	62.6 Å²	62.6	73%	0.732	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-11.5	-176.9	-54.6	179.6	-176.7	-161.3	-2.5	113.8	S109 L110 E114	S109-R112 VanDerWaalsContact O-CB 3.25Å; S109-R112 WeakPolarHBondContact O-CB 3.46Å; S109-R112 WeakPolarHBondContact O-CG 3.3Å; S109-R112 PolarHBondContact O-N 2.96Å; L110-R112 PolarHBondContact O-N 3.47Å; R112-E114 PolarHBondContact O-N 3Å
113	I	83.6	Confident	84.9	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.041	30%	0.299	C	S	.	.			trans	-71.6	83.2	169.9	-48.9	175.8	0	0	0	107.8	I39 T41 V56 R60 H89 F97 L110 V111	I39-I113 HydrophobicContact CD1-CD1 4.37Å; T41-I113 HydrophobicContact CG2-CG2 4.34Å; V56-I113 HydrophobicContact CG1-CG2 4.39Å; R60-I113 PolarHBondContact NH1-O 3.31Å; H89-I113 HydrophobicContact CB-CD1 4.3Å; F97-I113 HydrophobicContact CB-CD1 4.49Å; F97-I113 HydrophobicContact CB-CG1 4.4Å; F97-I113 HydrophobicContact CD1-CD1 3.66Å; F97-I113 HydrophobicContact CD1-CG1 4.43Å; F97-I113 HydrophobicContact CD2-CD1 4.25Å; F97-I113 HydrophobicContact CE1-CD1 3.81Å; F97-I113 HydrophobicContact CE2-CD1 4.4Å; F97-I113 HydrophobicContact CG-CD1 3.89Å; F97-I113 HydrophobicContact CG-CG1 4.29Å; F97-I113 HydrophobicContact CZ-CD1 4.19Å; L110-I113 HydrophobicContact CD1-CD1 4.06Å; L110-I113 WeakPolarHBondContact O-CG1 3.4Å; L110-I113 PolarHBondContact O-N 3.43Å; V111-I113 PolarHBondContact O-N 2.91Å
114	E	65.8	Low	85	Confident	150 Å²	150	59.1 Å²	59.1	70%	0.701	29%	0.293	S	S	*	.			trans	-104.1	-18.9	177	-64	-162.1	142	0	0	113.1	R112	R112-E114 PolarHBondContact O-N 3Å
115	K	69.2	Low	85.2	Confident	173 Å²	173	54.1 Å²	54.1	75%	0.752	27%	0.266	S	S	*	.	S	Bend	trans	-125.5	141.2	179.5	-64.6	-179.2	-177.5	175.9	0	109.8
116	Y	81.1	Confident	85.3	Confident	85 Å²	85	51.3 Å²	51.3	33%	0.333	25%	0.248	S	C	.	.			trans	-84.4	148.9	172.3	65.8	-88	0	0	0	109.6	T41 A46 G118	T41-Y116 WeakPolarHBondContact O-CB 3.36Å; A46-Y116 HydrophobicContact CB-CD1 3.68Å; A46-Y116 HydrophobicContact CB-CD2 3.35Å; A46-Y116 HydrophobicContact CB-CE1 3.98Å; A46-Y116 HydrophobicContact CB-CE2 3.67Å; A46-Y116 HydrophobicContact CB-CG 3.36Å; Y116-G118 VanDerWaalsContact C-N 3.35Å; Y116-G118 PolarHBondContact O-N 2.78Å
117	L	76.9	Confident	85.4	Confident	43 Å²	43	51.3 Å²	51.3	23%	0.225	25%	0.248	C	C	.	.			trans	-80.3	-12.3	-164.6	-72.3	171.8	0	0	0	114.4	T41 H89 S91 E95	T41-L117 PolarHBondContact O-N 2.81Å; H89-L117 VanDerWaalsContact CE1-CG 3.46Å; H89-L117 WeakPolarHBondContact CE1-CG 3.36Å; H89-L117 WeakPolarHBondContact ND1-CD1 3.42Å; H89-L117 WeakPolarHBondContact O-CD1 3.35Å; S91-L117 WeakPolarHBondContact OG-CB 3.4Å; E95-L117 HydrophobicContact CB-CD1 4.17Å
118	G	67.6	Low	85.4	Confident	18 Å²	18	56.3 Å²	56.3	19%	0.186	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	115.9	-147.7	168.5	0	0	0	0	0	114.2	S42 E43 Y116	S42-G118 CarbonylContact C-O 3.59Å; S42-G118 WeakPolarHBondContact CA-O 3.37Å; E43-G118 PolarHBondContact N-O 3.03Å; Y116-G118 VanDerWaalsContact C-N 3.35Å; Y116-G118 PolarHBondContact O-N 2.78Å
119	K	69.9	Low	85.5	Confident	125 Å²	125	57.3 Å²	57.3	54%	0.543	26%	0.258	S	S	.	.	S	Bend	trans	-69.7	143.3	-168.2	-55.1	-156	161.4	-85.7	0	112.3	E43 Q92	E43-K119 IonicContact OE1-NZ 3.82Å; E43-K119 PolarHBondContact OE1-NZ 3.43Å; E43-K119 VanDerWaalsContact OE2-CG 3.28Å; E43-K119 WeakPolarHBondContact OE2-CG 3.49Å; E43-K119 IonicContact OE2-NZ 2.8Å; E43-K119 PolarHBondContact OE2-NZ 3.44Å; Q92-K119 WeakPolarHBondContact CB-O 3.16Å; Q92-K119 WeakPolarHBondContact CG-O 3.45Å
120	G	80.6	Confident	85.7	Confident	12 Å²	12	56.3 Å²	56.3	12%	0.124	25%	0.251	C	S	.	.			trans	78.4	163.7	173.3	0	0	0	0	0	115.6	S42 S91 Q92 T157	S42-G120 VanDerWaalsContact CB-O 3.28Å; S42-G120 WeakPolarHBondContact CB-O 3.32Å; S91-G120 CarbonylContact C-O 3.59Å; S91-G120 VanDerWaalsContact CA-O 3.24Å; S91-G120 WeakPolarHBondContact CA-O 3.29Å; S91-G120 VanDerWaalsContact CB-O 3.28Å; S91-G120 WeakPolarHBondContact CB-O 3.4Å; Q92-G120 PolarHBondContact N-O 3.3Å; Q92-G120 VanDerWaalsContact N-O 3.1Å; G120-T157 WeakPolarHBondContact CA-OG1 3.04Å
121	T	88.8	Confident	85.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	25%	0.251	C	S	.	.			trans	-141.7	97.3	-169.4	-41.9	0	0	0	0	108.4	D40 S42 T44 F90 I123 H155 T157	D40-T121 WeakPolarHBondContact OD2-CG2 3.37Å; S42-T121 WeakPolarHBondContact CB-OG1 3.47Å; S42-T121 PolarHBondContact OG-OG1 3.43Å; T44-T121 PolarHBondContact OG1-OG1 2.99Å; F90-T121 HydrophobicContact CE2-CG2 3.92Å; T121-I123 HydrophobicContact CG2-CD1 4.34Å; T121-I123 HydrophobicContact CG2-CG1 3.98Å; T121-H155 WeakPolarHBondContact CB-O 3.34Å; T121-H155 VanDerWaalsContact CG2-O 3.25Å; T121-H155 WeakPolarHBondContact CG2-O 3.2Å; T121-T157 PolarHBondContact N-OG1 3.35Å; T121-T157 PolarHBondContact O-N 3.07Å
122	Y	93.8	Very high	86	Confident	64 Å²	64	55.6 Å²	55.6	25%	0.251	24%	0.243	S	C	.	.			trans	-106.5	78.2	179.7	-62.3	-15.9	0	0	0	109.7	S91 Q92 D124 A126 G158 P160	S91-Y122 PolarHBondContact O-N 3.08Å; Q92-Y122 VanDerWaalsContact CA-CD2 3.44Å; Q92-Y122 HydrophobicContact CB-CD2 3.85Å; Q92-Y122 HydrophobicContact CB-CE2 3.62Å; Q92-Y122 HydrophobicContact CB-CG 4.43Å; Q92-Y122 WeakPolarHBondContact O-CD2 3.46Å; Y122-D124 VanDerWaalsContact C-N 3.29Å; Y122-D124 PolarHBondContact O-N 2.84Å; Y122-A126 PolarHBondContact O-N 3.37Å; Y122-G158 VanDerWaalsContact CD1-O 3.3Å; Y122-G158 WeakPolarHBondContact CD1-O 3.45Å; Y122-P160 HydrophobicContact CD1-CG 4.33Å; Y122-P160 HydrophobicContact CD2-CG 3.49Å; Y122-P160 VanDerWaalsContact CD2-CG 3.49Å; Y122-P160 HydrophobicContact CE1-CG 4.48Å; Y122-P160 HydrophobicContact CE2-CG 3.69Å; Y122-P160 HydrophobicContact CG-CG 3.87Å
123	I	93.9	Very high	86.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-35	-177.8	-59	175.9	0	0	0	110.9	F90 T121 C125 A126 L127 T152 H155 I164 I195	F90-I123 HydrophobicContact CE2-CB 4.4Å; F90-I123 HydrophobicContact CE2-CG1 3.75Å; F90-I123 HydrophobicContact CZ-CG1 4.02Å; T121-I123 HydrophobicContact CG2-CD1 4.34Å; T121-I123 HydrophobicContact CG2-CG1 3.98Å; I123-C125 PolarHBondContact O-N 3.38Å; I123-A126 WeakPolarHBondContact O-CB 3.49Å; I123-A126 PolarHBondContact O-N 3.46Å; I123-A126 VanDerWaalsContact O-N 3.1Å; I123-L127 HydrophobicContact CG2-CD1 4.09Å; I123-L127 HydrophobicContact CG2-CG 4.19Å; I123-L127 WeakPolarHBondContact O-CG 3.37Å; I123-L127 PolarHBondContact O-N 2.79Å; I123-T152 HydrophobicContact CD1-CG2 4.29Å; I123-H155 WeakPolarHBondContact CD1-O 3.4Å; I123-I164 HydrophobicContact CB-CD1 3.67Å; I123-I164 HydrophobicContact CB-CG1 3.93Å; I123-I164 HydrophobicContact CD1-CD1 3.84Å; I123-I164 HydrophobicContact CG1-CD1 4.2Å; I123-I164 HydrophobicContact CG2-CD1 4.01Å; I123-I164 HydrophobicContact CG2-CG1 4.16Å; I123-I164 HydrophobicContact CG2-CG2 4.34Å; I123-I195 HydrophobicContact CD1-CD1 4.21Å; I123-I195 HydrophobicContact CG2-CD1 3.75Å; I123-I195 HydrophobicContact CG2-CG1 4Å
124	D	94.4	Very high	86.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-47.7	179.6	69.9	-26.3	0	0	0	112.2	Y122 A126 L127 R128 N159 C161 G162 G163 I164 S167	Y122-D124 VanDerWaalsContact C-N 3.29Å; Y122-D124 PolarHBondContact O-N 2.84Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.14Å; D124-L127 PolarHBondContact O-N 2.63Å; D124-R128 WeakPolarHBondContact O-CB 3.31Å; D124-R128 PolarHBondContact O-N 2.81Å; D124-N159 WeakPolarHBondContact OD2-CA 3.38Å; D124-C161 HydrophobicContact CB-CB 4.44Å; D124-C161 VanDerWaalsContact OD2-CA 3.32Å; D124-C161 WeakPolarHBondContact OD2-CA 3.35Å; D124-C161 PolarHBondContact OD2-N 3.07Å; D124-G162 PolarHBondContact OD2-N 3.27Å; D124-G163 WeakPolarHBondContact CB-O 3.21Å; D124-G163 PolarHBondContact OD2-N 2.96Å; D124-I164 HydrophobicContact CB-CG1 4.37Å; D124-S167 WeakPolarHBondContact O-CB 3.27Å; D124-S167 PolarHBondContact O-OG 3.37Å
125	C	94.4	Very high	87.6	Confident	10 Å²	10	44.4 Å²	44.4	7%	0.068	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-34.4	172.6	-64.2	0	0	0	0	112.8	Q94 I123 R129 C161	Q94-C125 HydrophobicContact CG-CB 4.36Å; Q94-C125 VanDerWaalsContact NE2-CB 3.3Å; I123-C125 PolarHBondContact O-N 3.38Å; C125-R129 WeakPolarHBondContact O-CB 3.3Å; C125-R129 PolarHBondContact O-N 2.91Å; C125-C161 WeakPolarHBondContact CA-SG 3.35Å; C125-C161 HydrophobicContact CB-CB 3.9Å; C125-C161 WeakPolarHBondContact CB-SG 3.31Å; C125-C161 WeakPolarHBondContact SG-CB 3.25Å; C125-C161 CovalentContact SG-SG 2.03Å; C125-C161 PolarHBondContact SG-SG 3.29Å
126	A	95.1	Very high	88.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-44.5	176.4	0	0	0	0	0	112.2	T38 L88 F90 Q94 Y122 I123 D124 R129 M130	T38-A126 HydrophobicContact CG2-CB 3.89Å; L88-A126 HydrophobicContact CD1-CB 4.3Å; F90-A126 HydrophobicContact CB-CB 3.94Å; F90-A126 HydrophobicContact CD1-CB 3.68Å; F90-A126 HydrophobicContact CD2-CB 3.76Å; F90-A126 HydrophobicContact CE1-CB 4.11Å; F90-A126 HydrophobicContact CE2-CB 4.18Å; F90-A126 HydrophobicContact CG-CB 3.5Å; F90-A126 HydrophobicContact CZ-CB 4.34Å; Q94-A126 HydrophobicContact CG-CB 4.21Å; Y122-A126 PolarHBondContact O-N 3.37Å; I123-A126 WeakPolarHBondContact O-CB 3.49Å; I123-A126 PolarHBondContact O-N 3.46Å; I123-A126 VanDerWaalsContact O-N 3.1Å; D124-A126 VanDerWaalsContact C-N 3.3Å; D124-A126 PolarHBondContact O-N 3.14Å; A126-R129 PolarHBondContact O-N 2.95Å; A126-M130 WeakPolarHBondContact O-CB 3.38Å; A126-M130 PolarHBondContact O-N 2.85Å
127	L	96.1	Very high	87.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-43	174.8	-70.4	173.5	0	0	0	112.1	I123 D124 M130 S131 V150 I164 A168 I195	I123-L127 HydrophobicContact CG2-CD1 4.09Å; I123-L127 HydrophobicContact CG2-CG 4.19Å; I123-L127 WeakPolarHBondContact O-CG 3.37Å; I123-L127 PolarHBondContact O-N 2.79Å; D124-L127 PolarHBondContact O-N 2.63Å; L127-M130 HydrophobicContact CD2-CE 3.79Å; L127-M130 HydrophobicContact CD2-SD 4.31Å; L127-S131 WeakPolarHBondContact O-CB 3.4Å; L127-S131 PolarHBondContact O-N 2.83Å; L127-S131 PolarHBondContact O-OG 3.46Å; L127-V150 HydrophobicContact CD2-CG2 3.85Å; L127-I164 HydrophobicContact CD1-CG2 4.1Å; L127-A168 HydrophobicContact CD1-CB 4.04Å; L127-I195 HydrophobicContact CD1-CG1 4.39Å; L127-I195 HydrophobicContact CD2-CG2 4.25Å
128	R	94.2	Very high	86.7	Confident	122 Å²	122	41 Å²	41	46%	0.46	21%	0.206	S	C	.	.	H	α-helix	trans	-60.5	-49.2	175.1	-174.9	176.9	-177.7	133	5.2	111.2	D124 S131 E132	D124-R128 WeakPolarHBondContact O-CB 3.31Å; D124-R128 PolarHBondContact O-N 2.81Å; R128-S131 WeakPolarHBondContact O-CB 3.37Å; R128-S131 PolarHBondContact O-N 3.09Å; R128-E132 IonicContact NE-OE1 2.7Å; R128-E132 PolarHBondContact O-N 2.98Å
129	R	94.9	Very high	86	Confident	97 Å²	97	45.5 Å²	45.5	37%	0.366	24%	0.241	S	C	.	.	H	α-helix	trans	-68.9	-39.9	-178.1	-173.7	55.9	-175.5	-159.5	-5.3	112.9	L88 C125 A126 S131 E132 E133	L88-R129 HydrophobicContact CD2-CB 4.05Å; L88-R129 HydrophobicContact CD2-CG 4.06Å; C125-R129 WeakPolarHBondContact O-CB 3.3Å; C125-R129 PolarHBondContact O-N 2.91Å; A126-R129 PolarHBondContact O-N 2.95Å; R129-S131 VanDerWaalsContact C-N 3.26Å; R129-S131 PolarHBondContact O-N 3.38Å; R129-E132 VanDerWaalsContact CD-OE2 3.25Å; R129-E132 WeakPolarHBondContact CD-OE2 3.34Å; R129-E132 IonicContact CZ-OE2 3.61Å; R129-E132 IonicContact NE-OE2 2.78Å; R129-E132 IonicContact NH1-OE2 3.59Å; R129-E132 PolarHBondContact NH1-OE2 2.71Å; R129-E132 PolarHBondContact O-N 2.86Å; R129-E133 HydrophobicContact CG-CG 4.47Å; R129-E133 IonicContact CZ-OE1 3.25Å; R129-E133 IonicContact NE-OE1 3.41Å; R129-E133 PolarHBondContact NE-OE1 2.76Å; R129-E133 IonicContact NH2-OE1 2.95Å; R129-E133 PolarHBondContact NH2-OE1 2.86Å; R129-E133 WeakPolarHBondContact O-CG 3.38Å; R129-E133 PolarHBondContact O-N 2.76Å
130	M	95.8	Very high	85.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-51.4	-47.8	169	170.3	-165.9	82.8	0	0	110.9	Y36 T38 L88 A126 L127 E132 E133 M134 A148 V150 A171 I176 V178	Y36-M130 HydrophobicContact CD1-CB 4.23Å; Y36-M130 HydrophobicContact CD1-CG 3.68Å; Y36-M130 HydrophobicContact CE1-CB 4.29Å; Y36-M130 HydrophobicContact CE1-CG 4.23Å; Y36-M130 HydrophobicContact CG-CG 4.21Å; T38-M130 WeakPolarHBondContact OG1-CG 3.3Å; T38-M130 PolarHBondContact OG1-SD 3.25Å; L88-M130 HydrophobicContact CD2-CB 4.2Å; A126-M130 WeakPolarHBondContact O-CB 3.38Å; A126-M130 PolarHBondContact O-N 2.85Å; L127-M130 HydrophobicContact CD2-CE 3.79Å; L127-M130 HydrophobicContact CD2-SD 4.31Å; M130-E132 PolarHBondContact O-N 2.73Å; M130-E133 PolarHBondContact O-N 3.24Å; M130-M134 HydrophobicContact CG-CG 4.48Å; M130-M134 HydrophobicContact CG-SD 4.1Å; M130-M134 WeakPolarHBondContact O-CB 3.37Å; M130-M134 VanDerWaalsContact O-CG 3.27Å; M130-M134 WeakPolarHBondContact O-CG 3.46Å; M130-M134 PolarHBondContact O-N 2.85Å; M130-A148 HydrophobicContact CE-CB 3.98Å; M130-A148 HydrophobicContact CG-CB 4.46Å; M130-A148 HydrophobicContact SD-CB 3.41Å; M130-A148 WeakPolarHBondContact SD-CB 3.49Å; M130-V150 HydrophobicContact SD-CG2 4.27Å; M130-A171 HydrophobicContact CE-CB 4.15Å; M130-I176 HydrophobicContact CE-CG2 4.47Å; M130-V178 HydrophobicContact CE-CG2 4.26Å
131	S	93.8	Very high	84.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67	-33.4	-178.4	-57.1	0	0	0	0	113.3	L127 R128 R129 L135 A171	L127-S131 WeakPolarHBondContact O-CB 3.4Å; L127-S131 PolarHBondContact O-N 2.83Å; L127-S131 PolarHBondContact O-OG 3.46Å; R128-S131 WeakPolarHBondContact O-CB 3.37Å; R128-S131 PolarHBondContact O-N 3.09Å; R129-S131 VanDerWaalsContact C-N 3.26Å; R129-S131 PolarHBondContact O-N 3.38Å; S131-L135 WeakPolarHBondContact O-CG 3.44Å; S131-L135 PolarHBondContact O-N 2.97Å; S131-A171 VanDerWaalsContact OG-CB 3.32Å; S131-A171 WeakPolarHBondContact OG-CB 3.04Å
132	E	92.3	Very high	83.4	Confident	67 Å²	67	50.9 Å²	50.9	31%	0.313	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-52.9	170.7	-69	170	-173.6	0	0	111.4	R128 R129 M130 M134 L135 L136	R128-E132 IonicContact NE-OE1 2.7Å; R128-E132 PolarHBondContact O-N 2.98Å; R129-E132 VanDerWaalsContact CD-OE2 3.25Å; R129-E132 WeakPolarHBondContact CD-OE2 3.34Å; R129-E132 IonicContact CZ-OE2 3.61Å; R129-E132 IonicContact NE-OE2 2.78Å; R129-E132 IonicContact NH1-OE2 3.59Å; R129-E132 PolarHBondContact NH1-OE2 2.71Å; R129-E132 PolarHBondContact O-N 2.86Å; M130-E132 PolarHBondContact O-N 2.73Å; E132-M134 VanDerWaalsContact C-N 3.31Å; E132-M134 PolarHBondContact O-N 3.44Å; E132-L135 PolarHBondContact O-N 2.97Å; E132-L135 VanDerWaalsContact O-N 3.08Å; E132-L136 WeakPolarHBondContact O-CG 3.41Å; E132-L136 PolarHBondContact O-N 3.01Å; E132-L136 VanDerWaalsContact O-N 3.07Å
133	E	91.6	Very high	82.7	Confident	31 Å²	31	53.7 Å²	53.7	15%	0.145	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-34.7	-179.3	-62.3	-68.5	166.3	0	0	112.3	Y36 V96 R129 M130 L135 L136 G137	Y36-E133 HydrophobicContact CE2-CB 3.72Å; V96-E133 HydrophobicContact CG2-CG 3.99Å; R129-E133 HydrophobicContact CG-CG 4.47Å; R129-E133 IonicContact CZ-OE1 3.25Å; R129-E133 IonicContact NE-OE1 3.41Å; R129-E133 PolarHBondContact NE-OE1 2.76Å; R129-E133 IonicContact NH2-OE1 2.95Å; R129-E133 PolarHBondContact NH2-OE1 2.86Å; R129-E133 WeakPolarHBondContact O-CG 3.38Å; R129-E133 PolarHBondContact O-N 2.76Å; M130-E133 PolarHBondContact O-N 3.24Å; E133-L135 VanDerWaalsContact C-N 3.25Å; E133-L135 PolarHBondContact O-N 2.92Å; E133-L136 PolarHBondContact O-N 3.04Å; E133-G137 PolarHBondContact O-N 3.19Å
134	M	90	Very high	82.3	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.1	175.7	-71.5	-169.2	86.1	0	0	114.8	H34 Y36 I100 M130 E132 R146 F147 A148 I176	H34-M134 WeakPolarHBondContact O-CE 3.03Å; Y36-M134 WeakPolarHBondContact CB-SD 3.46Å; Y36-M134 HydrophobicContact CD2-CG 3.73Å; Y36-M134 HydrophobicContact CG-CG 3.82Å; Y36-M134 HydrophobicContact CG-SD 4.2Å; I100-M134 HydrophobicContact CD1-CG 4.31Å; M130-M134 HydrophobicContact CG-CG 4.48Å; M130-M134 HydrophobicContact CG-SD 4.1Å; M130-M134 WeakPolarHBondContact O-CB 3.37Å; M130-M134 VanDerWaalsContact O-CG 3.27Å; M130-M134 WeakPolarHBondContact O-CG 3.46Å; M130-M134 PolarHBondContact O-N 2.85Å; E132-M134 VanDerWaalsContact C-N 3.31Å; E132-M134 PolarHBondContact O-N 3.44Å; M134-R146 HydrophobicContact CE-CB 3.64Å; M134-R146 HydrophobicContact CE-CG 4.12Å; M134-R146 PolarHBondContact O-NE 3.21Å; M134-F147 WeakPolarHBondContact CE-O 3.5Å; M134-A148 HydrophobicContact SD-CB 4.32Å; M134-I176 HydrophobicContact CB-CD1 4.14Å; M134-I176 HydrophobicContact CE-CG2 4.15Å; M134-I176 HydrophobicContact SD-CD1 4Å; M134-I176 HydrophobicContact SD-CG1 4.24Å; M134-I176 HydrophobicContact SD-CG2 3.7Å
135	L	86.3	Confident	82.1	Confident	85 Å²	85	56.1 Å²	56.1	45%	0.445	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-25.8	171.4	-67.9	176.6	0	0	0	112.6	S131 E132 E133 G137 K174	S131-L135 WeakPolarHBondContact O-CG 3.44Å; S131-L135 PolarHBondContact O-N 2.97Å; E132-L135 PolarHBondContact O-N 2.97Å; E132-L135 VanDerWaalsContact O-N 3.08Å; E133-L135 VanDerWaalsContact C-N 3.25Å; E133-L135 PolarHBondContact O-N 2.92Å; L135-G137 VanDerWaalsContact C-N 3.28Å; L135-G137 PolarHBondContact O-N 2.92Å; L135-K174 HydrophobicContact CD1-CD 3.84Å; L135-K174 HydrophobicContact CD1-CG 4.1Å
136	L	80.8	Confident	82	Confident	128 Å²	128	58.3 Å²	58.3	67%	0.67	33%	0.334	S	S	*	.	S	Bend	trans	-82.2	2.8	177.4	-67.7	170.3	0	0	0	114.4	E132 E133	E132-L136 WeakPolarHBondContact O-CG 3.41Å; E132-L136 PolarHBondContact O-N 3.01Å; E132-L136 VanDerWaalsContact O-N 3.07Å; E133-L136 PolarHBondContact O-N 3.04Å
137	G	65.1	Low	82.1	Confident	21 Å²	21	58.3 Å²	58.3	22%	0.216	33%	0.334	C	S	.	.	S	Bend	trans	-59.1	164.4	178.2	0	0	0	0	0	114.5	E133 L135 A139	E133-G137 PolarHBondContact O-N 3.19Å; L135-G137 VanDerWaalsContact C-N 3.28Å; L135-G137 PolarHBondContact O-N 2.92Å; G137-A139 PolarHBondContact O-N 2.04Å
138	P	61.3	Low	82.2	Confident	81 Å²	81	58.3 Å²	58.3	53%	0.526	33%	0.334	S	S	.	.			trans	-57.3	138.3	-173	22.9	-34	0	0	0	113	S140	P138-S140 PolarHBondContact O-N 3.42Å
139	A	53.5	Low	82.4	Confident	112 Å²	112	52.5 Å²	52.5	93%	0.926	31%	0.312	S	S	*	.			trans	-70	86.6	-174.7	0	0	0	0	0	112.5	G137	G137-A139 PolarHBondContact O-N 2.04Å
140	S	57.6	Low	82.5	Confident	63 Å²	63	47.9 Å²	47.9	44%	0.441	30%	0.295	S	S	.	.			trans	-75.2	151.7	170.7	177	0	0	0	0	111.8	P138 V142	P138-S140 PolarHBondContact O-N 3.42Å; S140-V142 VanDerWaalsContact CB-O 3.24Å; S140-V142 WeakPolarHBondContact CB-O 3.32Å; S140-V142 PolarHBondContact O-N 2.76Å; S140-V142 PolarHBondContact OG-N 2.91Å; S140-V142 VanDerWaalsContact OG-N 3.07Å; S140-V142 PolarHBondContact OG-O 2.78Å
141	S	57.1	Low	82.6	Confident	129 Å²	129	47.9 Å²	47.9	90%	0.902	30%	0.295	S	S	*	.	S	Bend	trans	-71.5	-16.1	168.8	53.2	0	0	0	0	113.4
142	V	68.7	Low	82.7	Confident	58 Å²	58	47.9 Å²	47.9	35%	0.352	30%	0.295	S	S	.	.	S	Bend	trans	-119.4	129.6	177	-178.9	0	0	0	0	108.9	P32 S140 P144	P32-V142 HydrophobicContact CG-CB 4.37Å; P32-V142 HydrophobicContact CG-CG1 4.38Å; S140-V142 VanDerWaalsContact CB-O 3.24Å; S140-V142 WeakPolarHBondContact CB-O 3.32Å; S140-V142 PolarHBondContact O-N 2.76Å; S140-V142 PolarHBondContact OG-N 2.91Å; S140-V142 VanDerWaalsContact OG-N 3.07Å; S140-V142 PolarHBondContact OG-O 2.78Å; V142-P144 WeakPolarHBondContact O-CD 3.2Å
143	T	79.4	Confident	82.6	Confident	123 Å²	123	44.9 Å²	44.9	76%	0.755	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-61.7	119.7	175.3	44.1	0	0	0	0	110.8
144	P	85.4	Confident	82.4	Confident	18 Å²	18	43.4 Å²	43.4	12%	0.117	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-77.2	149.7	-176	31.4	-35.4	0	0	0	112.4	P32 H34 V142	P32-P144 HydrophobicContact CB-CB 4.21Å; P32-P144 HydrophobicContact CG-CB 4.15Å; P32-P144 CarbonylContact O-C 3.51Å; P32-P144 WeakPolarHBondContact O-CA 3.29Å; P32-P144 VanDerWaalsContact O-CB 3.28Å; P32-P144 WeakPolarHBondContact O-CB 2.95Å; H34-P144 HydrophobicContact CB-CB 4.4Å; V142-P144 WeakPolarHBondContact O-CD 3.2Å
145	L	90.3	Very high	82.4	Confident	32 Å²	32	46.8 Å²	46.8	17%	0.168	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	130.5	168.9	-65.3	178.8	0	0	0	109.5	P32 I33 H34 F147 A235 D238	P32-L145 PolarHBondContact O-N 2.92Å; I33-L145 HydrophobicContact CG1-CB 4.46Å; H34-L145 PolarHBondContact N-O 2.93Å; L145-F147 HydrophobicContact CB-CE2 4.11Å; L145-A235 HydrophobicContact CD1-CB 3.71Å; L145-D238 HydrophobicContact CD1-CB 4.11Å; L145-D238 HydrophobicContact CD2-CB 3.94Å; L145-D238 WeakPolarHBondContact CD2-OD2 3.46Å
146	R	93.8	Very high	82.4	Confident	56 Å²	56	44.5 Å²	44.5	21%	0.211	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118.3	-175.4	-66.2	-174.2	-174.5	89.8	8.1	110.8	M134 I176 R177	M134-R146 HydrophobicContact CE-CB 3.64Å; M134-R146 HydrophobicContact CE-CG 4.12Å; M134-R146 PolarHBondContact O-NE 3.21Å; R146-I176 HydrophobicContact CB-CB 4.39Å; R146-I176 HydrophobicContact CB-CG1 4.04Å; R146-I176 HydrophobicContact CB-CG2 4.47Å; R146-R177 PolarHBondContact O-N 3.19Å
147	F	96.8	Very high	82.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.3	168.4	-57.5	-88.7	0	0	0	110.6	I33 H34 L35 Y36 M134 L145 R177 F179 M231 M234	I33-F147 HydrophobicContact CD1-CE2 4.41Å; I33-F147 HydrophobicContact CG2-CD2 3.56Å; I33-F147 HydrophobicContact CG2-CE2 3.84Å; H34-F147 PolarHBondContact O-N 3.12Å; L35-F147 CarbonylContact C-O 3.58Å; L35-F147 WeakPolarHBondContact CA-O 3.34Å; L35-F147 HydrophobicContact CD1-CB 4.1Å; Y36-F147 PolarHBondContact N-O 3.27Å; M134-F147 WeakPolarHBondContact CE-O 3.5Å; L145-F147 HydrophobicContact CB-CE2 4.11Å; F147-R177 CarbonylContact C-O 3.46Å; F147-R177 VanDerWaalsContact CA-O 3.3Å; F147-R177 WeakPolarHBondContact CA-O 3.09Å; F147-R177 HydrophobicContact CD1-CB 3.57Å; F147-R177 HydrophobicContact CD1-CG 4.44Å; F147-R177 HydrophobicContact CE1-CB 4.01Å; F147-R177 HydrophobicContact CE1-CG 4.45Å; F147-R177 HydrophobicContact CG-CB 4.45Å; F147-F179 AromaticContact CD1-CE2 3.83Å; F147-F179 HydrophobicContact CD1-CE2 3.83Å; F147-F179 HydrophobicContact CE1-CE2 4.49Å; F147-M231 HydrophobicContact CB-CE 3.89Å; F147-M231 HydrophobicContact CB-CG 4.49Å; F147-M231 HydrophobicContact CD1-CG 3.89Å; F147-M231 HydrophobicContact CD2-CG 4.28Å; F147-M231 HydrophobicContact CE1-CB 4.33Å; F147-M231 HydrophobicContact CE1-CG 4.08Å; F147-M231 HydrophobicContact CE2-CB 4.31Å; F147-M231 HydrophobicContact CE2-CG 4.46Å; F147-M231 HydrophobicContact CG-CE 4.39Å; F147-M231 HydrophobicContact CG-CG 3.99Å; F147-M231 HydrophobicContact CZ-CB 4.19Å; F147-M231 HydrophobicContact CZ-CG 4.36Å; F147-M234 HydrophobicContact CE1-CB 4.26Å; F147-M234 HydrophobicContact CE1-SD 3.89Å; F147-M234 HydrophobicContact CZ-CB 4.06Å
148	A	97.6	Very high	83.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	147	171.7	0	0	0	0	0	110.4	Y36 M130 M134 I176 R177 V178 F179	Y36-A148 CarbonylContact O-C 3.28Å; Y36-A148 WeakPolarHBondContact O-CA 3.24Å; M130-A148 HydrophobicContact CE-CB 3.98Å; M130-A148 HydrophobicContact CG-CB 4.46Å; M130-A148 HydrophobicContact SD-CB 3.41Å; M130-A148 WeakPolarHBondContact SD-CB 3.49Å; M134-A148 HydrophobicContact SD-CB 4.32Å; A148-I176 HydrophobicContact CB-CG2 3.87Å; A148-R177 PolarHBondContact N-O 2.97Å; A148-V178 HydrophobicContact CB-CB 4.5Å; A148-V178 HydrophobicContact CB-CG1 4.3Å; A148-V178 HydrophobicContact CB-CG2 4.27Å; A148-F179 PolarHBondContact O-N 2.91Å
149	V	97.9	Very high	84.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	106.5	170.3	175.5	0	0	0	0	107.1	L35 Y36 F37 T38 F66 I151 F179 V181 I227 M231	L35-V149 HydrophobicContact CD1-CG2 3.97Å; Y36-V149 PolarHBondContact O-N 2.89Å; F37-V149 WeakPolarHBondContact CA-O 3.29Å; F37-V149 HydrophobicContact CD1-CB 3.85Å; F37-V149 HydrophobicContact CD1-CG1 4.03Å; F37-V149 HydrophobicContact CE1-CB 3.88Å; F37-V149 HydrophobicContact CE1-CG1 3.96Å; F37-V149 HydrophobicContact CE1-CG2 4.3Å; T38-V149 PolarHBondContact N-O 3.5Å; F66-V149 HydrophobicContact CE2-CG2 4.35Å; F66-V149 HydrophobicContact CZ-CG2 4.17Å; V149-I151 HydrophobicContact CG1-CD1 4.44Å; V149-I151 HydrophobicContact CG1-CG1 4.01Å; V149-F179 HydrophobicContact CG2-CB 4.32Å; V149-V181 HydrophobicContact CG1-CG2 3.84Å; V149-I227 HydrophobicContact CG2-CG2 4.44Å; V149-M231 HydrophobicContact CG2-CE 3.65Å
150	V	97.9	Very high	86.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.3	178.3	-175.1	0	0	0	0	107.5	T38 L127 M130 T152 V178 F179 V181 I195	T38-V150 HydrophobicContact CG2-CG1 4.23Å; T38-V150 HydrophobicContact CG2-CG2 4.45Å; T38-V150 WeakPolarHBondContact O-CA 3.28Å; L127-V150 HydrophobicContact CD2-CG2 3.85Å; M130-V150 HydrophobicContact SD-CG2 4.27Å; V150-T152 HydrophobicContact CG1-CG2 4.05Å; V150-V178 HydrophobicContact CG2-CG1 3.58Å; V150-F179 PolarHBondContact N-O 2.95Å; V150-V181 PolarHBondContact O-N 2.92Å; V150-I195 HydrophobicContact CB-CG2 3.84Å; V150-I195 HydrophobicContact CG1-CD1 4.44Å; V150-I195 HydrophobicContact CG1-CG2 4.04Å; V150-I195 HydrophobicContact CG2-CG2 3.84Å
151	I	97.3	Very high	87.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.9	-179.7	-46.5	177	0	0	0	108	T38 D40 I59 F62 V149 V181 A183 A209	T38-I151 PolarHBondContact O-N 2.96Å; D40-I151 WeakPolarHBondContact CB-O 3.47Å; D40-I151 PolarHBondContact N-O 2.89Å; I59-I151 HydrophobicContact CG1-CG2 4.45Å; I59-I151 HydrophobicContact CG2-CB 4.35Å; I59-I151 HydrophobicContact CG2-CD1 4Å; I59-I151 HydrophobicContact CG2-CG2 3.85Å; F62-I151 HydrophobicContact CD1-CD1 3.82Å; F62-I151 HydrophobicContact CE1-CD1 3.87Å; V149-I151 HydrophobicContact CG1-CD1 4.44Å; V149-I151 HydrophobicContact CG1-CG1 4.01Å; I151-V181 WeakPolarHBondContact CA-O 3.36Å; I151-V181 HydrophobicContact CG1-CB 4.27Å; I151-V181 HydrophobicContact CG2-CG1 4.5Å; I151-A183 HydrophobicContact CG2-CB 4.4Å; I151-A209 HydrophobicContact CG2-CB 4Å
152	T	95.2	Very high	88.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	166.7	-173.7	177.9	0	0	0	0	110.2	D40 I123 V150 G154 V181 A182 A183 L192 I195	D40-T152 WeakPolarHBondContact OD2-CB 3.08Å; D40-T152 PolarHBondContact OD2-OG1 3.21Å; I123-T152 HydrophobicContact CD1-CG2 4.29Å; V150-T152 HydrophobicContact CG1-CG2 4.05Å; T152-G154 PolarHBondContact OG1-N 2.86Å; T152-V181 PolarHBondContact N-O 3.03Å; T152-V181 VanDerWaalsContact N-O 3.15Å; T152-A182 CarbonylContact O-C 3.59Å; T152-A182 WeakPolarHBondContact O-CA 3.5Å; T152-A183 PolarHBondContact O-N 3.27Å; T152-L192 HydrophobicContact CG2-CD2 3.73Å; T152-I195 HydrophobicContact CG2-CD1 3.8Å
153	D	91.4	Very high	89.7	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	21%	0.209	C	C	.	.			trans	-78.7	-14	164.6	52.2	19	0	0	0	111.2	T44 I45 H155 N186 I187 E188	T44-D153 WeakPolarHBondContact CB-OD2 3.37Å; T44-D153 PolarHBondContact OG1-OD2 2.84Å; I45-D153 HydrophobicContact CD1-CB 3.62Å; I45-D153 WeakPolarHBondContact CD1-OD2 3.33Å; D153-H155 VanDerWaalsContact C-N 3.31Å; D153-H155 VanDerWaalsContact OD1-CB 3.28Å; D153-H155 WeakPolarHBondContact OD1-CB 3.41Å; D153-H155 PolarHBondContact OD1-N 2.78Å; D153-N186 WeakPolarHBondContact CB-O 3.4Å; D153-I187 CarbonylContact O-C 3.47Å; D153-I187 VanDerWaalsContact O-CA 3.24Å; D153-I187 WeakPolarHBondContact O-CA 3.27Å; D153-I187 WeakPolarHBondContact O-CB 3.37Å; D153-E188 PolarHBondContact O-N 3.18Å
154	G	87.8	Confident	90.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.175	C	C	.	.			trans	87.5	-0.5	-175.8	0	0	0	0	0	113.3	T152 V156	T152-G154 PolarHBondContact OG1-N 2.86Å; G154-V156 WeakPolarHBondContact O-CG2 3.5Å
155	H	89.1	Confident	90.1	Very high	72 Å²	72	32.3 Å²	32.3	33%	0.333	19%	0.192	S	C	.	.			trans	-77.6	145.5	-174.3	-172.3	60.4	0	0	0	112.5	T121 I123 D153 E188	T121-H155 WeakPolarHBondContact CB-O 3.34Å; T121-H155 VanDerWaalsContact CG2-O 3.25Å; T121-H155 WeakPolarHBondContact CG2-O 3.2Å; I123-H155 WeakPolarHBondContact CD1-O 3.4Å; D153-H155 VanDerWaalsContact C-N 3.31Å; D153-H155 VanDerWaalsContact OD1-CB 3.28Å; D153-H155 WeakPolarHBondContact OD1-CB 3.41Å; D153-H155 PolarHBondContact OD1-N 2.78Å; H155-E188 WeakPolarHBondContact CA-OE2 3.46Å; H155-E188 IonicContact CE1-OE2 3.18Å; H155-E188 IonicContact CG-OE2 2.69Å; H155-E188 IonicContact ND1-OE2 2.7Å; H155-E188 PolarHBondContact ND1-OE2 3.49Å
156	V	86.6	Confident	90	Very high	38 Å²	38	35 Å²	35	23%	0.23	21%	0.209	C	C	.	.			trans	-128.6	109.6	-168.6	-156.3	0	0	0	0	111	G154 I164	G154-V156 WeakPolarHBondContact O-CG2 3.5Å; V156-I164 HydrophobicContact CB-CD1 4.26Å; V156-I164 HydrophobicContact CG1-CD1 3.86Å; V156-I164 HydrophobicContact CG1-CG1 4.41Å; V156-I164 HydrophobicContact CG2-CD1 3.37Å
157	T	82.3	Confident	89.8	Confident	64 Å²	64	32.6 Å²	32.6	39%	0.393	20%	0.202	S	C	.	.	S	Bend	trans	-95.2	4	177.1	77.2	0	0	0	0	113.3	G120 T121	G120-T157 WeakPolarHBondContact CA-OG1 3.04Å; T121-T157 PolarHBondContact N-OG1 3.35Å; T121-T157 PolarHBondContact O-N 3.07Å
158	G	83.3	Confident	89.5	Confident	24 Å²	24	32.6 Å²	32.6	25%	0.247	20%	0.202	C	C	.	.			trans	162.9	156.8	179.2	0	0	0	0	0	112.2	Y122 P160	Y122-G158 VanDerWaalsContact CD1-O 3.3Å; Y122-G158 WeakPolarHBondContact CD1-O 3.45Å; G158-P160 VanDerWaalsContact C-CD 3.48Å
159	N	86.8	Confident	89	Confident	82 Å²	82	36.3 Å²	36.3	44%	0.439	22%	0.219	S	C	.	.			trans	-128.4	61	-177.3	-75.6	-60.5	0	0	0	112.2	D124 C161 G163	D124-N159 WeakPolarHBondContact OD2-CA 3.38Å; N159-C161 VanDerWaalsContact C-N 3.29Å; N159-C161 PolarHBondContact O-N 2.96Å; N159-G163 WeakPolarHBondContact OD1-CA 3.35Å
160	P	87.9	Confident	88.6	Confident	84 Å²	84	39 Å²	39	55%	0.545	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.6	-173.8	31.9	-34.1	0	0	0	114.8	Y122 G158	Y122-P160 HydrophobicContact CD1-CG 4.33Å; Y122-P160 HydrophobicContact CD2-CG 3.49Å; Y122-P160 VanDerWaalsContact CD2-CG 3.49Å; Y122-P160 HydrophobicContact CE1-CG 4.48Å; Y122-P160 HydrophobicContact CE2-CG 3.69Å; Y122-P160 HydrophobicContact CG-CG 3.87Å; G158-P160 VanDerWaalsContact C-CD 3.48Å
161	C	86.8	Confident	88.2	Confident	43 Å²	43	39 Å²	39	29%	0.291	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-3.2	177.5	-72.2	0	0	0	0	114.3	D124 C125 N159	D124-C161 HydrophobicContact CB-CB 4.44Å; D124-C161 VanDerWaalsContact OD2-CA 3.32Å; D124-C161 WeakPolarHBondContact OD2-CA 3.35Å; D124-C161 PolarHBondContact OD2-N 3.07Å; C125-C161 WeakPolarHBondContact CA-SG 3.35Å; C125-C161 HydrophobicContact CB-CB 3.9Å; C125-C161 WeakPolarHBondContact CB-SG 3.31Å; C125-C161 WeakPolarHBondContact SG-CB 3.25Å; C125-C161 CovalentContact SG-SG 2.03Å; C125-C161 PolarHBondContact SG-SG 3.29Å; N159-C161 VanDerWaalsContact C-N 3.29Å; N159-C161 PolarHBondContact O-N 2.96Å
162	G	82.1	Confident	87.8	Confident	48 Å²	48	41.8 Å²	41.8	50%	0.495	24%	0.244	S	C	.	.	S	Bend	trans	127.3	1.7	172.8	0	0	0	0	0	115.5	D124	D124-G162 PolarHBondContact OD2-N 3.27Å
163	G	88.1	Confident	87.3	Confident	14 Å²	14	48.8 Å²	48.8	14%	0.144	28%	0.281	C	S	.	.			trans	101.2	148.5	-179.2	0	0	0	0	0	114	D124 N159 S167	D124-G163 WeakPolarHBondContact CB-O 3.21Å; D124-G163 PolarHBondContact OD2-N 2.96Å; N159-G163 WeakPolarHBondContact OD1-CA 3.35Å; G163-S167 WeakPolarHBondContact O-CB 2.96Å; G163-S167 PolarHBondContact O-N 3.39Å; G163-S167 PolarHBondContact O-OG 3.21Å
164	I	88.4	Confident	87.1	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-58	-176.5	-63.8	-177.7	0	0	0	110.6	I123 D124 L127 V156 V166 S167 A168 E194 I195	I123-I164 HydrophobicContact CB-CD1 3.67Å; I123-I164 HydrophobicContact CB-CG1 3.93Å; I123-I164 HydrophobicContact CD1-CD1 3.84Å; I123-I164 HydrophobicContact CG1-CD1 4.2Å; I123-I164 HydrophobicContact CG2-CD1 4.01Å; I123-I164 HydrophobicContact CG2-CG1 4.16Å; I123-I164 HydrophobicContact CG2-CG2 4.34Å; D124-I164 HydrophobicContact CB-CG1 4.37Å; L127-I164 HydrophobicContact CD1-CG2 4.1Å; V156-I164 HydrophobicContact CB-CD1 4.26Å; V156-I164 HydrophobicContact CG1-CD1 3.86Å; V156-I164 HydrophobicContact CG1-CG1 4.41Å; V156-I164 HydrophobicContact CG2-CD1 3.37Å; I164-V166 VanDerWaalsContact C-N 3.33Å; I164-V166 PolarHBondContact O-N 2.91Å; I164-S167 CarbonylContact O-C 3.48Å; I164-S167 PolarHBondContact O-N 3.47Å; I164-A168 WeakPolarHBondContact O-CB 3.41Å; I164-A168 PolarHBondContact O-N 2.92Å; I164-E194 HydrophobicContact CG2-CB 3.99Å; I164-I195 HydrophobicContact CG2-CG1 3.62Å
165	K	85.6	Confident	87.1	Confident	112 Å²	112	53.9 Å²	53.9	49%	0.487	32%	0.316	S	S	.	.	H	α-helix	trans	-45.8	-53	176.2	-178	170.2	178.3	176	0	113.2	S167 A168 E169 E194	K165-S167 VanDerWaalsContact C-N 3.34Å; K165-S167 PolarHBondContact O-N 2.94Å; K165-A168 PolarHBondContact O-N 3.32Å; K165-E169 WeakPolarHBondContact CE-OE1 3.15Å; K165-E169 HydrophobicContact CG-CG 4.47Å; K165-E169 WeakPolarHBondContact CG-OE1 3.36Å; K165-E169 WeakPolarHBondContact O-CB 3.2Å; K165-E169 VanDerWaalsContact O-CG 3.26Å; K165-E169 WeakPolarHBondContact O-CG 3.4Å; K165-E169 PolarHBondContact O-N 2.94Å; K165-E194 PolarHBondContact N-OE2 3.2Å
166	V	87.2	Confident	87.3	Confident	87 Å²	87	50.4 Å²	50.4	53%	0.527	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-40.7	-179.5	-178.8	0	0	0	0	111.7	I164 E169 D170	I164-V166 VanDerWaalsContact C-N 3.33Å; I164-V166 PolarHBondContact O-N 2.91Å; V166-E169 PolarHBondContact O-N 3.24Å; V166-D170 WeakPolarHBondContact O-CB 3.37Å; V166-D170 PolarHBondContact O-N 3.31Å
167	S	90.4	Very high	87.7	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.049	30%	0.3	C	S	.	.	H	α-helix	trans	-74.3	-27.3	179.7	-53.9	0	0	0	0	112.9	D124 G163 I164 K165 A171	D124-S167 WeakPolarHBondContact O-CB 3.27Å; D124-S167 PolarHBondContact O-OG 3.37Å; G163-S167 WeakPolarHBondContact O-CB 2.96Å; G163-S167 PolarHBondContact O-N 3.39Å; G163-S167 PolarHBondContact O-OG 3.21Å; I164-S167 CarbonylContact O-C 3.48Å; I164-S167 PolarHBondContact O-N 3.47Å; K165-S167 VanDerWaalsContact C-N 3.34Å; K165-S167 PolarHBondContact O-N 2.94Å; S167-A171 WeakPolarHBondContact O-CB 3.04Å; S167-A171 PolarHBondContact O-N 3.36Å
168	A	90.5	Very high	88.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-76.5	-37.9	171.4	0	0	0	0	0	111.4	L127 I164 K165 A171 R172 E194	L127-A168 HydrophobicContact CD1-CB 4.04Å; I164-A168 WeakPolarHBondContact O-CB 3.41Å; I164-A168 PolarHBondContact O-N 2.92Å; K165-A168 PolarHBondContact O-N 3.32Å; A168-A171 WeakPolarHBondContact O-CB 3.03Å; A168-A171 PolarHBondContact O-N 3.01Å; A168-R172 WeakPolarHBondContact O-CD 3.47Å; A168-R172 WeakPolarHBondContact O-CG 2.91Å; A168-R172 PolarHBondContact O-N 3.19Å; A168-E194 VanDerWaalsContact CB-O 3.3Å; A168-E194 WeakPolarHBondContact CB-O 3.48Å
169	E	87.1	Confident	89	Confident	77 Å²	77	47.2 Å²	47.2	36%	0.36	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-47.5	173.1	-72.1	168.6	174.7	0	0	111.2	K165 V166 A171 R172 D173	K165-E169 WeakPolarHBondContact CE-OE1 3.15Å; K165-E169 HydrophobicContact CG-CG 4.47Å; K165-E169 WeakPolarHBondContact CG-OE1 3.36Å; K165-E169 WeakPolarHBondContact O-CB 3.2Å; K165-E169 VanDerWaalsContact O-CG 3.26Å; K165-E169 WeakPolarHBondContact O-CG 3.4Å; K165-E169 PolarHBondContact O-N 2.94Å; V166-E169 PolarHBondContact O-N 3.24Å; E169-A171 VanDerWaalsContact C-N 3.28Å; E169-A171 PolarHBondContact O-N 3.42Å; E169-R172 VanDerWaalsContact CG-NH1 3.31Å; E169-R172 WeakPolarHBondContact O-CB 3.07Å; E169-R172 PolarHBondContact O-N 3.11Å; E169-R172 VanDerWaalsContact O-N 3.09Å; E169-D173 PolarHBondContact O-N 3.45Å
170	D	88.1	Confident	89.5	Confident	57 Å²	57	43.3 Å²	43.3	31%	0.305	25%	0.249	S	C	.	.	H	α-helix	trans	-57.6	-36.3	172.1	170	79.2	0	0	0	113.1	V166 K174	V166-D170 WeakPolarHBondContact O-CB 3.37Å; V166-D170 PolarHBondContact O-N 3.31Å; D170-K174 VanDerWaalsContact O-CD 3.29Å; D170-K174 WeakPolarHBondContact O-CD 3.23Å; D170-K174 VanDerWaalsContact O-CG 3.28Å; D170-K174 WeakPolarHBondContact O-CG 3.5Å; D170-K174 PolarHBondContact O-N 3.37Å; D170-K174 WeakPolarHBondContact OD1-CE 3.45Å; D170-K174 IonicContact OD1-NZ 3.89Å; D170-K174 PolarHBondContact OD1-NZ 3.47Å; D170-K174 IonicContact OD2-NZ 2.76Å; D170-K174 PolarHBondContact OD2-NZ 3.37Å
171	A	90.3	Very high	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-42.8	173.6	0	0	0	0	0	112.3	M130 S131 S167 A168 E169 K174 I176 V178	M130-A171 HydrophobicContact CE-CB 4.15Å; S131-A171 VanDerWaalsContact OG-CB 3.32Å; S131-A171 WeakPolarHBondContact OG-CB 3.04Å; S167-A171 WeakPolarHBondContact O-CB 3.04Å; S167-A171 PolarHBondContact O-N 3.36Å; A168-A171 WeakPolarHBondContact O-CB 3.03Å; A168-A171 PolarHBondContact O-N 3.01Å; E169-A171 VanDerWaalsContact C-N 3.28Å; E169-A171 PolarHBondContact O-N 3.42Å; A171-K174 PolarHBondContact O-N 3Å; A171-I176 HydrophobicContact CB-CB 4.44Å; A171-I176 HydrophobicContact CB-CD1 4.34Å; A171-I176 VanDerWaalsContact O-CB 3.24Å; A171-I176 WeakPolarHBondContact O-CB 3.46Å; A171-I176 WeakPolarHBondContact O-CG1 3.46Å; A171-I176 PolarHBondContact O-N 3.43Å; A171-V178 HydrophobicContact CB-CG2 4.31Å
172	R	89.1	Confident	90.4	Very high	58 Å²	58	37.3 Å²	37.3	22%	0.219	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-44.2	176.9	-68.5	162.5	-165.8	141.3	3.6	111.3	A168 E169 K174 G175 E194 A196	A168-R172 WeakPolarHBondContact O-CD 3.47Å; A168-R172 WeakPolarHBondContact O-CG 2.91Å; A168-R172 PolarHBondContact O-N 3.19Å; E169-R172 VanDerWaalsContact CG-NH1 3.31Å; E169-R172 WeakPolarHBondContact O-CB 3.07Å; E169-R172 PolarHBondContact O-N 3.11Å; E169-R172 VanDerWaalsContact O-N 3.09Å; R172-K174 PolarHBondContact O-N 2.95Å; R172-G175 WeakPolarHBondContact O-CA 3.43Å; R172-G175 PolarHBondContact O-N 3.01Å; R172-E194 PolarHBondContact NH2-O 3.3Å; R172-A196 PolarHBondContact NH2-O 2.91Å
173	D	84.9	Confident	90.9	Very high	147 Å²	147	35 Å²	35	79%	0.786	19%	0.186	S	C	*	.	H	α-helix	trans	-63	-29.3	177.2	-77.4	-6.8	0	0	0	112.6	E169 G175	E169-D173 PolarHBondContact O-N 3.45Å; D173-G175 PolarHBondContact O-N 3.47Å
174	K	86.8	Confident	91	Very high	64 Å²	64	34.3 Å²	34.3	28%	0.278	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	6.1	171.3	-70.3	163.3	-173.4	168.5	0	113.7	L135 D170 A171 R172 I176	L135-K174 HydrophobicContact CD1-CD 3.84Å; L135-K174 HydrophobicContact CD1-CG 4.1Å; D170-K174 VanDerWaalsContact O-CD 3.29Å; D170-K174 WeakPolarHBondContact O-CD 3.23Å; D170-K174 VanDerWaalsContact O-CG 3.28Å; D170-K174 WeakPolarHBondContact O-CG 3.5Å; D170-K174 PolarHBondContact O-N 3.37Å; D170-K174 WeakPolarHBondContact OD1-CE 3.45Å; D170-K174 IonicContact OD1-NZ 3.89Å; D170-K174 PolarHBondContact OD1-NZ 3.47Å; D170-K174 IonicContact OD2-NZ 2.76Å; D170-K174 PolarHBondContact OD2-NZ 3.37Å; A171-K174 PolarHBondContact O-N 3Å; R172-K174 PolarHBondContact O-N 2.95Å; K174-I176 VanDerWaalsContact C-N 3.34Å; K174-I176 HydrophobicContact CB-CD1 4.26Å; K174-I176 HydrophobicContact CB-CG1 4.31Å
175	G	87.4	Confident	90.9	Very high	47 Å²	47	37.6 Å²	37.6	49%	0.485	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	23.7	-179.3	0	0	0	0	0	113.6	R172 D173	R172-G175 WeakPolarHBondContact O-CA 3.43Å; R172-G175 PolarHBondContact O-N 3.01Å; D173-G175 PolarHBondContact O-N 3.47Å
176	I	93.5	Very high	90.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.2	176.9	-53.1	169.2	0	0	0	108.9	M130 M134 R146 A148 A171 K174 V178 N197	M130-I176 HydrophobicContact CE-CG2 4.47Å; M134-I176 HydrophobicContact CB-CD1 4.14Å; M134-I176 HydrophobicContact CE-CG2 4.15Å; M134-I176 HydrophobicContact SD-CD1 4Å; M134-I176 HydrophobicContact SD-CG1 4.24Å; M134-I176 HydrophobicContact SD-CG2 3.7Å; R146-I176 HydrophobicContact CB-CB 4.39Å; R146-I176 HydrophobicContact CB-CG1 4.04Å; R146-I176 HydrophobicContact CB-CG2 4.47Å; A148-I176 HydrophobicContact CB-CG2 3.87Å; A171-I176 HydrophobicContact CB-CB 4.44Å; A171-I176 HydrophobicContact CB-CD1 4.34Å; A171-I176 VanDerWaalsContact O-CB 3.24Å; A171-I176 WeakPolarHBondContact O-CB 3.46Å; A171-I176 WeakPolarHBondContact O-CG1 3.46Å; A171-I176 PolarHBondContact O-N 3.43Å; K174-I176 VanDerWaalsContact C-N 3.34Å; K174-I176 HydrophobicContact CB-CD1 4.26Å; K174-I176 HydrophobicContact CB-CG1 4.31Å; I176-V178 HydrophobicContact CG2-CG2 4.11Å; I176-N197 PolarHBondContact O-ND2 2.92Å; I176-N197 PolarHBondContact O-OD1 3.35Å
177	R	95	Very high	90.8	Very high	58 Å²	58	35.9 Å²	35.9	22%	0.219	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	100.6	176	-69.7	179.7	-177.8	143.3	-8.3	110.1	R146 F147 A148 F203 D238	R146-R177 PolarHBondContact O-N 3.19Å; F147-R177 CarbonylContact C-O 3.46Å; F147-R177 VanDerWaalsContact CA-O 3.3Å; F147-R177 WeakPolarHBondContact CA-O 3.09Å; F147-R177 HydrophobicContact CD1-CB 3.57Å; F147-R177 HydrophobicContact CD1-CG 4.44Å; F147-R177 HydrophobicContact CE1-CB 4.01Å; F147-R177 HydrophobicContact CE1-CG 4.45Å; F147-R177 HydrophobicContact CG-CB 4.45Å; A148-R177 PolarHBondContact N-O 2.97Å; R177-F203 HydrophobicContact CB-CE1 3.97Å; R177-F203 HydrophobicContact CB-CZ 4.37Å; R177-F203 HydrophobicContact CG-CZ 4.5Å; R177-D238 IonicContact CZ-OD1 2.76Å; R177-D238 IonicContact CZ-OD2 3.22Å; R177-D238 VanDerWaalsContact CZ-OD2 3.31Å; R177-D238 IonicContact NH1-OD1 3.74Å; R177-D238 IonicContact NH1-OD2 3.84Å; R177-D238 PolarHBondContact NH1-OD2 3.17Å; R177-D238 IonicContact NH2-OD1 2.75Å; R177-D238 PolarHBondContact NH2-OD1 3.25Å; R177-D238 IonicContact NH2-OD2 3.58Å; R177-D238 PolarHBondContact NH2-OD2 3.41Å
178	V	96.8	Very high	90.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	122	-173.1	-168.7	0	0	0	0	111	M130 A148 V150 A171 I176 I195 N197 F203	M130-V178 HydrophobicContact CE-CG2 4.26Å; A148-V178 HydrophobicContact CB-CB 4.5Å; A148-V178 HydrophobicContact CB-CG1 4.3Å; A148-V178 HydrophobicContact CB-CG2 4.27Å; V150-V178 HydrophobicContact CG2-CG1 3.58Å; A171-V178 HydrophobicContact CB-CG2 4.31Å; I176-V178 HydrophobicContact CG2-CG2 4.11Å; V178-I195 HydrophobicContact CG1-CG2 3.76Å; V178-I195 WeakPolarHBondContact CG1-O 2.89Å; V178-N197 WeakPolarHBondContact CB-OD1 3.34Å; V178-N197 PolarHBondContact N-OD1 3.33Å; V178-N197 PolarHBondContact O-N 3.02Å; V178-F203 WeakPolarHBondContact O-CB 3.48Å; V178-F203 WeakPolarHBondContact O-CD1 3.15Å
179	F	97.4	Very high	90.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.5	166.1	-68.2	-91.4	0	0	0	109.7	F147 A148 V149 V150 V202 F203 F207 I227 T230 M231	F147-F179 AromaticContact CD1-CE2 3.83Å; F147-F179 HydrophobicContact CD1-CE2 3.83Å; F147-F179 HydrophobicContact CE1-CE2 4.49Å; A148-F179 PolarHBondContact O-N 2.91Å; V149-F179 HydrophobicContact CG2-CB 4.32Å; V150-F179 PolarHBondContact N-O 2.95Å; F179-V202 WeakPolarHBondContact CE1-O 3.48Å; F179-F203 WeakPolarHBondContact CA-O 3.49Å; F179-F203 HydrophobicContact CD1-CB 4.34Å; F179-F203 AromaticContact CD1-CD1 3.74Å; F179-F203 HydrophobicContact CD1-CD1 3.74Å; F179-F203 HydrophobicContact CD1-CG 4.45Å; F179-F203 HydrophobicContact CD2-CD1 4.1Å; F179-F203 HydrophobicContact CD2-CE1 4.47Å; F179-F203 AromaticContact CE1-CD1 3.59Å; F179-F203 HydrophobicContact CE1-CD1 3.59Å; F179-F203 HydrophobicContact CE1-CE1 4.08Å; F179-F203 HydrophobicContact CE1-CG 4.4Å; F179-F203 AromaticContact CE2-CD1 3.98Å; F179-F203 HydrophobicContact CE2-CD1 3.98Å; F179-F203 AromaticContact CE2-CE1 3.98Å; F179-F203 HydrophobicContact CE2-CE1 3.98Å; F179-F203 AromaticContact CG-CD1 3.99Å; F179-F203 HydrophobicContact CG-CD1 3.99Å; F179-F203 AromaticContact CZ-CD1 3.72Å; F179-F203 HydrophobicContact CZ-CD1 3.72Å; F179-F203 AromaticContact CZ-CE1 3.76Å; F179-F203 HydrophobicContact CZ-CE1 3.76Å; F179-F207 HydrophobicContact CD1-CD2 4.41Å; F179-F207 AromaticContact CD1-CE2 3.79Å; F179-F207 HydrophobicContact CD1-CE2 3.79Å; F179-F207 HydrophobicContact CE1-CE2 4.3Å; F179-I227 HydrophobicContact CD1-CB 4.48Å; F179-I227 HydrophobicContact CD1-CD1 4.48Å; F179-I227 HydrophobicContact CD1-CG1 4.02Å; F179-I227 HydrophobicContact CD1-CG2 3.86Å; F179-I227 HydrophobicContact CD2-CG2 3.99Å; F179-I227 HydrophobicContact CE1-CG1 4.4Å; F179-I227 HydrophobicContact CE1-CG2 3.98Å; F179-I227 HydrophobicContact CE2-CG2 4.07Å; F179-I227 HydrophobicContact CG-CG2 3.88Å; F179-I227 HydrophobicContact CZ-CG2 4.08Å; F179-T230 HydrophobicContact CE1-CG2 3.99Å; F179-T230 HydrophobicContact CZ-CG2 3.79Å; F179-M231 HydrophobicContact CD2-CE 3.68Å; F179-M231 HydrophobicContact CE2-CE 3.63Å; F179-M231 HydrophobicContact CE2-CG 3.76Å; F179-M231 HydrophobicContact CZ-CG 4.11Å
180	A	97	Very high	90.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.9	174	0	0	0	0	0	110.2	L192 I195 A196 F203	A180-L192 HydrophobicContact CB-CB 4.4Å; A180-L192 HydrophobicContact CB-CD2 4.22Å; A180-L192 WeakPolarHBondContact CB-O 3.21Å; A180-I195 HydrophobicContact CB-CB 4.18Å; A180-I195 HydrophobicContact CB-CG2 4.05Å; A180-A196 HydrophobicContact CB-CB 3.86Å; A180-F203 PolarHBondContact N-O 2.94Å
181	V	97.4	Very high	90.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119	-176.9	-175.7	0	0	0	0	109.4	F62 V149 V150 I151 T152 A183 F207 A209 T223 I227	F62-V181 HydrophobicContact CE1-CG1 4.43Å; F62-V181 HydrophobicContact CZ-CG1 4.14Å; V149-V181 HydrophobicContact CG1-CG2 3.84Å; V150-V181 PolarHBondContact O-N 2.92Å; I151-V181 WeakPolarHBondContact CA-O 3.36Å; I151-V181 HydrophobicContact CG1-CB 4.27Å; I151-V181 HydrophobicContact CG2-CG1 4.5Å; T152-V181 PolarHBondContact N-O 3.03Å; T152-V181 VanDerWaalsContact N-O 3.15Å; V181-A183 PolarHBondContact O-N 2.84Å; V181-F207 CarbonylContact C-O 3.5Å; V181-F207 WeakPolarHBondContact CA-O 3.49Å; V181-F207 HydrophobicContact CB-CB 4.48Å; V181-F207 HydrophobicContact CG1-CB 4.38Å; V181-F207 HydrophobicContact CG2-CB 4.12Å; V181-A209 HydrophobicContact CG1-CB 4.04Å; V181-T223 HydrophobicContact CG1-CG2 4.23Å; V181-I227 HydrophobicContact CG2-CD1 3.75Å
182	A	95.9	Very high	90.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	122.4	171.8	0	0	0	0	0	110.4	T152 S184 I187 L192 F207 M208 A209	T152-A182 CarbonylContact O-C 3.59Å; T152-A182 WeakPolarHBondContact O-CA 3.5Å; A182-S184 VanDerWaalsContact C-N 3.29Å; A182-S184 PolarHBondContact O-N 2.88Å; A182-I187 HydrophobicContact CB-CD1 4.12Å; A182-I187 HydrophobicContact CB-CG2 3.66Å; A182-L192 HydrophobicContact CB-CD1 4.02Å; A182-F207 WeakPolarHBondContact CB-O 3.29Å; A182-F207 PolarHBondContact N-O 3.31Å; A182-M208 HydrophobicContact CB-CB 4.36Å; A182-M208 HydrophobicContact CB-CG 4.31Å; A182-M208 CarbonylContact O-C 3.55Å; A182-M208 WeakPolarHBondContact O-CA 3.43Å; A182-A209 PolarHBondContact O-N 3.22Å
183	A	92.7	Very high	90.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-61.2	-38.2	178	0	0	0	0	0	112.4	I45 I59 I151 T152 V181 V210	I45-A183 HydrophobicContact CD1-CB 3.44Å; I45-A183 VanDerWaalsContact CD1-CB 3.44Å; I45-A183 HydrophobicContact CG1-CB 4.48Å; I59-A183 HydrophobicContact CD1-CB 3.84Å; I151-A183 HydrophobicContact CG2-CB 4.4Å; T152-A183 PolarHBondContact O-N 3.27Å; V181-A183 PolarHBondContact O-N 2.84Å; A183-V210 PolarHBondContact O-N 3.26Å
184	S	90.6	Very high	90.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-149.7	-161.8	-179.6	77.7	0	0	0	0	111.3	Q48 A182 N186 V210	Q48-S184 PolarHBondContact OE1-OG 3.31Å; A182-S184 VanDerWaalsContact C-N 3.29Å; A182-S184 PolarHBondContact O-N 2.88Å; S184-N186 VanDerWaalsContact C-N 3.33Å; S184-N186 PolarHBondContact OG-N 3.22Å; S184-V210 WeakPolarHBondContact CA-O 3.41Å
185	T	84.7	Confident	91	Very high	75 Å²	75	36.7 Å²	36.7	46%	0.46	20%	0.198	S	C	.	.	S	Bend	trans	-78.1	-8.5	169.6	54.5	0	0	0	0	114.5	M208	T185-M208 HydrophobicContact CG2-CE 3.93Å; T185-M208 HydrophobicContact CG2-SD 3.9Å
186	N	83.3	Confident	91.2	Very high	104 Å²	104	34.6 Å²	34.6	56%	0.556	18%	0.176	S	C	*	.			trans	-106	104	-179.9	-179.8	61.4	0	0	0	109.6	D153 S184	D153-N186 WeakPolarHBondContact CB-O 3.4Å; S184-N186 VanDerWaalsContact C-N 3.33Å; S184-N186 PolarHBondContact OG-N 3.22Å
187	I	89	Confident	91.1	Very high	59 Å²	59	35.6 Å²	35.6	30%	0.303	18%	0.181	S	C	.	.			trans	-143.8	154.9	-167.5	60.2	-179.8	0	0	0	114.1	D153 A182 L192	D153-I187 CarbonylContact O-C 3.47Å; D153-I187 VanDerWaalsContact O-CA 3.24Å; D153-I187 WeakPolarHBondContact O-CA 3.27Å; D153-I187 WeakPolarHBondContact O-CB 3.37Å; A182-I187 HydrophobicContact CB-CD1 4.12Å; A182-I187 HydrophobicContact CB-CG2 3.66Å; I187-L192 HydrophobicContact CB-CD1 3.91Å; I187-L192 HydrophobicContact CD1-CD1 3.98Å; I187-L192 HydrophobicContact CG1-CD1 4.45Å; I187-L192 HydrophobicContact CG2-CD1 4.04Å
188	E	88.9	Confident	90.3	Very high	74 Å²	74	37.6 Å²	37.6	35%	0.346	20%	0.204	S	C	.	.			trans	-105.1	89.8	169.6	-172.5	165.8	165.2	0	0	108.5	D153 H155 T190 G191 L192	D153-E188 PolarHBondContact O-N 3.18Å; H155-E188 WeakPolarHBondContact CA-OE2 3.46Å; H155-E188 IonicContact CE1-OE2 3.18Å; H155-E188 IonicContact CG-OE2 2.69Å; H155-E188 IonicContact ND1-OE2 2.7Å; H155-E188 PolarHBondContact ND1-OE2 3.49Å; E188-T190 WeakPolarHBondContact CG-OG1 3.37Å; E188-T190 PolarHBondContact O-N 2.95Å; E188-G191 PolarHBondContact O-N 2.91Å; E188-L192 PolarHBondContact O-N 3.1Å
189	E	87.8	Confident	89.6	Confident	46 Å²	46	40.7 Å²	40.7	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-29.3	-168.8	-175.3	55	-150.2	0	0	113.8	L192 K193 R204	E189-L192 PolarHBondContact O-N 2.91Å; E189-K193 HydrophobicContact CG-CD 4.06Å; E189-K193 HydrophobicContact CG-CG 4.47Å; E189-K193 WeakPolarHBondContact O-CB 3.26Å; E189-K193 WeakPolarHBondContact O-CG 3.49Å; E189-K193 PolarHBondContact O-N 2.84Å; E189-K193 VanDerWaalsContact OE1-CE 3.22Å; E189-K193 WeakPolarHBondContact OE1-CE 3.28Å; E189-R204 WeakPolarHBondContact OE1-CG 3.37Å; E189-R204 IonicContact OE1-CZ 2.72Å; E189-R204 IonicContact OE1-NE 2.72Å; E189-R204 PolarHBondContact OE1-NE 3.42Å; E189-R204 IonicContact OE1-NH2 2.6Å; E189-R204 PolarHBondContact OE1-NH2 3.12Å; E189-R204 IonicContact OE2-CZ 2.73Å; E189-R204 IonicContact OE2-NE 3.63Å; E189-R204 PolarHBondContact OE2-NE 3.21Å; E189-R204 VanDerWaalsContact OE2-NE 3.08Å; E189-R204 IonicContact OE2-NH2 2.84Å; E189-R204 PolarHBondContact OE2-NH2 2.72Å
190	T	85	Confident	88.5	Confident	97 Å²	97	42.7 Å²	42.7	60%	0.595	24%	0.241	S	C	*	.	H	α-helix	trans	-58.2	-50.1	171.8	40.1	0	0	0	0	111.4	E188 L192 K193 E194	E188-T190 WeakPolarHBondContact CG-OG1 3.37Å; E188-T190 PolarHBondContact O-N 2.95Å; T190-L192 PolarHBondContact O-N 3.44Å; T190-K193 PolarHBondContact O-N 2.93Å; T190-E194 PolarHBondContact O-N 3.24Å
191	G	85.6	Confident	87.5	Confident	5 Å²	5	47.2 Å²	47.2	5%	0.052	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-42.5	176.6	0	0	0	0	0	112.3	E188 K193 E194 I195	E188-G191 PolarHBondContact O-N 2.91Å; G191-K193 VanDerWaalsContact C-N 3.34Å; G191-K193 PolarHBondContact O-N 3.26Å; G191-E194 PolarHBondContact O-N 2.94Å; G191-I195 VanDerWaalsContact O-CD1 3.31Å; G191-I195 WeakPolarHBondContact O-CD1 3.24Å; G191-I195 WeakPolarHBondContact O-CG1 3.32Å; G191-I195 PolarHBondContact O-N 3.04Å; G191-I195 VanDerWaalsContact O-N 3.13Å
192	L	91.3	Very high	86.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-38.5	175.5	-70.3	173.9	0	0	0	112.8	T152 A180 A182 I187 E188 E189 T190 I195 A196	T152-L192 HydrophobicContact CG2-CD2 3.73Å; A180-L192 HydrophobicContact CB-CB 4.4Å; A180-L192 HydrophobicContact CB-CD2 4.22Å; A180-L192 WeakPolarHBondContact CB-O 3.21Å; A182-L192 HydrophobicContact CB-CD1 4.02Å; I187-L192 HydrophobicContact CB-CD1 3.91Å; I187-L192 HydrophobicContact CD1-CD1 3.98Å; I187-L192 HydrophobicContact CG1-CD1 4.45Å; I187-L192 HydrophobicContact CG2-CD1 4.04Å; E188-L192 PolarHBondContact O-N 3.1Å; E189-L192 PolarHBondContact O-N 2.91Å; T190-L192 PolarHBondContact O-N 3.44Å; L192-I195 PolarHBondContact O-N 3.29Å; L192-A196 PolarHBondContact O-N 2.98Å
193	K	87.9	Confident	86.5	Confident	119 Å²	119	49.5 Å²	49.5	52%	0.517	29%	0.285	S	S	.	.	H	α-helix	trans	-70.4	-36.3	174.8	-75	170.7	177.8	168.5	0	112.7	E189 T190 G191 I195 R204	E189-K193 HydrophobicContact CG-CD 4.06Å; E189-K193 HydrophobicContact CG-CG 4.47Å; E189-K193 WeakPolarHBondContact O-CB 3.26Å; E189-K193 WeakPolarHBondContact O-CG 3.49Å; E189-K193 PolarHBondContact O-N 2.84Å; E189-K193 VanDerWaalsContact OE1-CE 3.22Å; E189-K193 WeakPolarHBondContact OE1-CE 3.28Å; T190-K193 PolarHBondContact O-N 2.93Å; G191-K193 VanDerWaalsContact C-N 3.34Å; G191-K193 PolarHBondContact O-N 3.26Å; K193-I195 VanDerWaalsContact C-N 3.28Å; K193-I195 PolarHBondContact O-N 2.85Å; K193-R204 HydrophobicContact CG-CG 4.28Å
194	E	90.1	Very high	86.3	Confident	86 Å²	86	50.1 Å²	50.1	40%	0.402	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-31.5	173.5	-75.1	-155.7	162.6	0	0	113.2	I164 K165 A168 R172 T190 G191	I164-E194 HydrophobicContact CG2-CB 3.99Å; K165-E194 PolarHBondContact N-OE2 3.2Å; A168-E194 VanDerWaalsContact CB-O 3.3Å; A168-E194 WeakPolarHBondContact CB-O 3.48Å; R172-E194 PolarHBondContact NH2-O 3.3Å; T190-E194 PolarHBondContact O-N 3.24Å; G191-E194 PolarHBondContact O-N 2.94Å
195	I	93.8	Very high	86.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-75.1	-43.8	179.1	-66.7	160.7	0	0	0	112	I123 L127 V150 T152 I164 V178 A180 G191 L192 K193	I123-I195 HydrophobicContact CD1-CD1 4.21Å; I123-I195 HydrophobicContact CG2-CD1 3.75Å; I123-I195 HydrophobicContact CG2-CG1 4Å; L127-I195 HydrophobicContact CD1-CG1 4.39Å; L127-I195 HydrophobicContact CD2-CG2 4.25Å; V150-I195 HydrophobicContact CB-CG2 3.84Å; V150-I195 HydrophobicContact CG1-CD1 4.44Å; V150-I195 HydrophobicContact CG1-CG2 4.04Å; V150-I195 HydrophobicContact CG2-CG2 3.84Å; T152-I195 HydrophobicContact CG2-CD1 3.8Å; I164-I195 HydrophobicContact CG2-CG1 3.62Å; V178-I195 HydrophobicContact CG1-CG2 3.76Å; V178-I195 WeakPolarHBondContact CG1-O 2.89Å; A180-I195 HydrophobicContact CB-CB 4.18Å; A180-I195 HydrophobicContact CB-CG2 4.05Å; G191-I195 VanDerWaalsContact O-CD1 3.31Å; G191-I195 WeakPolarHBondContact O-CD1 3.24Å; G191-I195 WeakPolarHBondContact O-CG1 3.32Å; G191-I195 PolarHBondContact O-N 3.04Å; G191-I195 VanDerWaalsContact O-N 3.13Å; L192-I195 PolarHBondContact O-N 3.29Å; K193-I195 VanDerWaalsContact C-N 3.28Å; K193-I195 PolarHBondContact O-N 2.85Å
196	A	91.8	Very high	86.1	Confident	2 Å²	2	55 Å²	55	2%	0.017	31%	0.311	C	S	.	.	S	Bend	trans	-65.8	150.6	-172.2	0	0	0	0	0	113.2	R172 A180 L192 F203 R204	R172-A196 PolarHBondContact NH2-O 2.91Å; A180-A196 HydrophobicContact CB-CB 3.86Å; L192-A196 PolarHBondContact O-N 2.98Å; A196-F203 HydrophobicContact CB-CB 3.99Å; A196-R204 HydrophobicContact CB-CB 3.8Å
197	N	90.3	Very high	86.6	Confident	21 Å²	21	50.1 Å²	50.1	11%	0.112	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-67.7	152.1	167.9	-84.4	47.1	0	0	0	111.6	I176 V178 P199 F203	I176-N197 PolarHBondContact O-ND2 2.92Å; I176-N197 PolarHBondContact O-OD1 3.35Å; V178-N197 WeakPolarHBondContact CB-OD1 3.34Å; V178-N197 PolarHBondContact N-OD1 3.33Å; V178-N197 PolarHBondContact O-N 3.02Å; N197-P199 CarbonylContact O-C 3.53Å; N197-F203 HydrophobicContact CB-CB 4.33Å; N197-F203 HydrophobicContact CB-CD1 3.95Å; N197-F203 HydrophobicContact CB-CD2 3.48Å; N197-F203 VanDerWaalsContact CB-CD2 3.48Å; N197-F203 HydrophobicContact CB-CE1 4.08Å; N197-F203 HydrophobicContact CB-CE2 3.59Å; N197-F203 HydrophobicContact CB-CG 3.65Å; N197-F203 HydrophobicContact CB-CZ 3.88Å; N197-F203 WeakPolarHBondContact O-CB 3.43Å; N197-F203 WeakPolarHBondContact O-CD2 3.45Å
198	S	80.3	Confident	86.8	Confident	101 Å²	101	49.3 Å²	49.3	71%	0.706	28%	0.28	S	S	*	.	S	Bend	trans	-75.4	142.6	167.8	-56.7	0	0	0	0	110.7
199	P	80.8	Confident	87	Confident	65 Å²	65	45.8 Å²	45.8	42%	0.422	26%	0.264	S	S	.	.	S	Bend	cis	-78.1	142.6	-6.3	32.6	-34.5	0	0	0	112.3	N197 S201 V202 F203	N197-P199 CarbonylContact O-C 3.53Å; P199-S201 PolarHBondContact O-N 3.06Å; P199-S201 VanDerWaalsContact O-N 3.15Å; P199-V202 HydrophobicContact CG-CB 4.23Å; P199-V202 HydrophobicContact CG-CG2 3.87Å; P199-V202 PolarHBondContact O-N 3.24Å; P199-F203 PolarHBondContact O-N 3.45Å
200	A	75.4	Confident	87.2	Confident	42 Å²	42	43.6 Å²	43.6	35%	0.347	25%	0.253	S	S	.	.	H	α-helix	trans	-57.5	-31.8	-179.3	0	0	0	0	0	112.9	V202 F203 R204	A200-V202 PolarHBondContact O-N 3.19Å; A200-F203 PolarHBondContact O-N 2.98Å; A200-R204 CarbonylContact O-C 3.55Å; A200-R204 VanDerWaalsContact O-CA 3.27Å; A200-R204 WeakPolarHBondContact O-CA 3.5Å; A200-R204 PolarHBondContact O-N 3.29Å
201	S	75.8	Confident	87.3	Confident	94 Å²	94	40 Å²	40	66%	0.657	23%	0.23	S	C	*	.	H	α-helix	trans	-63.1	-4.4	174.5	54.6	0	0	0	0	115.5	P199	P199-S201 PolarHBondContact O-N 3.06Å; P199-S201 VanDerWaalsContact O-N 3.15Å
202	V	82.6	Confident	87.2	Confident	41 Å²	41	41.4 Å²	41.4	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-114.5	-31.8	174.7	175.4	0	0	0	0	112.1	F179 P199 A200 F207 T230 M234	F179-V202 WeakPolarHBondContact CE1-O 3.48Å; P199-V202 HydrophobicContact CG-CB 4.23Å; P199-V202 HydrophobicContact CG-CG2 3.87Å; P199-V202 PolarHBondContact O-N 3.24Å; A200-V202 PolarHBondContact O-N 3.19Å; V202-F207 WeakPolarHBondContact O-CE2 3.45Å; V202-T230 HydrophobicContact CG1-CG2 3.6Å; V202-M234 HydrophobicContact CG1-CE 3.62Å
203	F	88.5	Confident	86.5	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-108.5	-9.1	-174	-65.3	-80	0	0	0	114.8	R177 V178 F179 A180 A196 N197 P199 A200 F207 M234	R177-F203 HydrophobicContact CB-CE1 3.97Å; R177-F203 HydrophobicContact CB-CZ 4.37Å; R177-F203 HydrophobicContact CG-CZ 4.5Å; V178-F203 WeakPolarHBondContact O-CB 3.48Å; V178-F203 WeakPolarHBondContact O-CD1 3.15Å; F179-F203 WeakPolarHBondContact CA-O 3.49Å; F179-F203 HydrophobicContact CD1-CB 4.34Å; F179-F203 AromaticContact CD1-CD1 3.74Å; F179-F203 HydrophobicContact CD1-CD1 3.74Å; F179-F203 HydrophobicContact CD1-CG 4.45Å; F179-F203 HydrophobicContact CD2-CD1 4.1Å; F179-F203 HydrophobicContact CD2-CE1 4.47Å; F179-F203 AromaticContact CE1-CD1 3.59Å; F179-F203 HydrophobicContact CE1-CD1 3.59Å; F179-F203 HydrophobicContact CE1-CE1 4.08Å; F179-F203 HydrophobicContact CE1-CG 4.4Å; F179-F203 AromaticContact CE2-CD1 3.98Å; F179-F203 HydrophobicContact CE2-CD1 3.98Å; F179-F203 AromaticContact CE2-CE1 3.98Å; F179-F203 HydrophobicContact CE2-CE1 3.98Å; F179-F203 AromaticContact CG-CD1 3.99Å; F179-F203 HydrophobicContact CG-CD1 3.99Å; F179-F203 AromaticContact CZ-CD1 3.72Å; F179-F203 HydrophobicContact CZ-CD1 3.72Å; F179-F203 AromaticContact CZ-CE1 3.76Å; F179-F203 HydrophobicContact CZ-CE1 3.76Å; A180-F203 PolarHBondContact N-O 2.94Å; A196-F203 HydrophobicContact CB-CB 3.99Å; N197-F203 HydrophobicContact CB-CB 4.33Å; N197-F203 HydrophobicContact CB-CD1 3.95Å; N197-F203 HydrophobicContact CB-CD2 3.48Å; N197-F203 VanDerWaalsContact CB-CD2 3.48Å; N197-F203 HydrophobicContact CB-CE1 4.08Å; N197-F203 HydrophobicContact CB-CE2 3.59Å; N197-F203 HydrophobicContact CB-CG 3.65Å; N197-F203 HydrophobicContact CB-CZ 3.88Å; N197-F203 WeakPolarHBondContact O-CB 3.43Å; N197-F203 WeakPolarHBondContact O-CD2 3.45Å; P199-F203 PolarHBondContact O-N 3.45Å; A200-F203 PolarHBondContact O-N 2.98Å; F203-F207 VanDerWaalsContact C-CE2 3.48Å; F203-F207 WeakPolarHBondContact O-CD2 3.2Å; F203-M234 HydrophobicContact CE1-CE 4.03Å; F203-M234 HydrophobicContact CE1-SD 4.23Å; F203-M234 HydrophobicContact CE2-CE 4.08Å; F203-M234 HydrophobicContact CZ-CE 3.45Å; F203-M234 VanDerWaalsContact CZ-CE 3.45Å; F203-M234 HydrophobicContact CZ-SD 4.01Å
204	R	90.1	Very high	85.8	Confident	13 Å²	13	46.7 Å²	46.7	5%	0.049	27%	0.271	C	S	.	.			trans	-147.1	48.7	178.7	179.5	51.2	-156.8	130.3	19.5	110	E189 K193 A196 A200 D206 F207	E189-R204 WeakPolarHBondContact OE1-CG 3.37Å; E189-R204 IonicContact OE1-CZ 2.72Å; E189-R204 IonicContact OE1-NE 2.72Å; E189-R204 PolarHBondContact OE1-NE 3.42Å; E189-R204 IonicContact OE1-NH2 2.6Å; E189-R204 PolarHBondContact OE1-NH2 3.12Å; E189-R204 IonicContact OE2-CZ 2.73Å; E189-R204 IonicContact OE2-NE 3.63Å; E189-R204 PolarHBondContact OE2-NE 3.21Å; E189-R204 VanDerWaalsContact OE2-NE 3.08Å; E189-R204 IonicContact OE2-NH2 2.84Å; E189-R204 PolarHBondContact OE2-NH2 2.72Å; K193-R204 HydrophobicContact CG-CG 4.28Å; A196-R204 HydrophobicContact CB-CB 3.8Å; A200-R204 CarbonylContact O-C 3.55Å; A200-R204 VanDerWaalsContact O-CA 3.27Å; A200-R204 WeakPolarHBondContact O-CA 3.5Å; A200-R204 PolarHBondContact O-N 3.29Å; R204-D206 IonicContact CZ-OD1 3.15Å; R204-D206 IonicContact NH2-OD1 2.72Å; R204-D206 PolarHBondContact NH2-OD1 3.41Å; R204-D206 VanDerWaalsContact NH2-OD1 3.08Å; R204-D206 PolarHBondContact O-N 2.9Å; R204-F207 VanDerWaalsContact NH1-N 3.16Å; R204-F207 PolarHBondContact NH1-O 2.85Å
205	D	86.3	Confident	84.7	Confident	58 Å²	58	46.1 Å²	46.1	31%	0.31	29%	0.287	S	S	.	.	S	Bend	trans	-79.2	66.5	175.1	159.8	50.5	0	0	0	110.3	F207 R226	D205-F207 HydrophobicContact CB-CD1 4.32Å; D205-F207 HydrophobicContact CB-CE1 3.71Å; D205-F207 HydrophobicContact CB-CE2 4.23Å; D205-F207 HydrophobicContact CB-CZ 3.67Å; D205-F207 VanDerWaalsContact O-CD1 3.24Å; D205-F207 WeakPolarHBondContact O-CD1 3.42Å; D205-F207 PolarHBondContact O-N 2.92Å; D205-F207 WeakPolarHBondContact OD2-CE1 3.26Å; D205-R226 IonicContact OD1-NH1 3.21Å; D205-R226 PolarHBondContact OD1-NH1 3.42Å; D205-R226 WeakPolarHBondContact OD2-CD 3.31Å; D205-R226 IonicContact OD2-CZ 2.73Å; D205-R226 IonicContact OD2-NE 2.71Å; D205-R226 IonicContact OD2-NH1 3.24Å; D205-R226 PolarHBondContact OD2-NH1 2.97Å
206	D	84.9	Confident	83.8	Confident	119 Å²	119	55.7 Å²	55.7	64%	0.636	32%	0.324	S	S	*	.	S	Bend	trans	45.1	27.1	-174.1	-74.8	-43.3	0	0	0	115.9	R204 M208	R204-D206 IonicContact CZ-OD1 3.15Å; R204-D206 IonicContact NH2-OD1 2.72Å; R204-D206 PolarHBondContact NH2-OD1 3.41Å; R204-D206 VanDerWaalsContact NH2-OD1 3.08Å; R204-D206 PolarHBondContact O-N 2.9Å; D206-M208 PolarHBondContact O-N 3.03Å
207	F	92.6	Very high	83.3	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.009	34%	0.34	C	S	.	.			trans	-54.2	111.9	179.7	-63	-33	0	0	0	111.8	F179 V181 A182 V202 F203 R204 D205 T223 R226 I227	F179-F207 HydrophobicContact CD1-CD2 4.41Å; F179-F207 AromaticContact CD1-CE2 3.79Å; F179-F207 HydrophobicContact CD1-CE2 3.79Å; F179-F207 HydrophobicContact CE1-CE2 4.3Å; V181-F207 CarbonylContact C-O 3.5Å; V181-F207 WeakPolarHBondContact CA-O 3.49Å; V181-F207 HydrophobicContact CB-CB 4.48Å; V181-F207 HydrophobicContact CG1-CB 4.38Å; V181-F207 HydrophobicContact CG2-CB 4.12Å; A182-F207 WeakPolarHBondContact CB-O 3.29Å; A182-F207 PolarHBondContact N-O 3.31Å; V202-F207 WeakPolarHBondContact O-CE2 3.45Å; F203-F207 VanDerWaalsContact C-CE2 3.48Å; F203-F207 WeakPolarHBondContact O-CD2 3.2Å; R204-F207 VanDerWaalsContact NH1-N 3.16Å; R204-F207 PolarHBondContact NH1-O 2.85Å; D205-F207 HydrophobicContact CB-CD1 4.32Å; D205-F207 HydrophobicContact CB-CE1 3.71Å; D205-F207 HydrophobicContact CB-CE2 4.23Å; D205-F207 HydrophobicContact CB-CZ 3.67Å; D205-F207 VanDerWaalsContact O-CD1 3.24Å; D205-F207 WeakPolarHBondContact O-CD1 3.42Å; D205-F207 PolarHBondContact O-N 2.92Å; D205-F207 WeakPolarHBondContact OD2-CE1 3.26Å; F207-T223 HydrophobicContact CB-CG2 3.6Å; F207-T223 HydrophobicContact CD1-CG2 3.94Å; F207-T223 HydrophobicContact CG-CG2 4.01Å; F207-R226 HydrophobicContact CE1-CB 3.87Å; F207-I227 HydrophobicContact CB-CD1 4.34Å; F207-I227 HydrophobicContact CD1-CD1 4.31Å; F207-I227 HydrophobicContact CD1-CG1 4.12Å; F207-I227 HydrophobicContact CD2-CD1 3.92Å; F207-I227 HydrophobicContact CD2-CG1 3.97Å; F207-I227 HydrophobicContact CE1-CG1 3.97Å; F207-I227 HydrophobicContact CE2-CD1 4.28Å; F207-I227 HydrophobicContact CE2-CG1 3.82Å; F207-I227 HydrophobicContact CG-CD1 3.93Å; F207-I227 HydrophobicContact CG-CG1 4.12Å; F207-I227 HydrophobicContact CZ-CG1 3.81Å
208	M	93.5	Very high	83.2	Confident	41 Å²	41	60 Å²	60	20%	0.202	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-116.7	145.2	176.3	-169.4	179.7	-67.6	0	0	110.4	A182 T185 D206 D211 H220 T223	A182-M208 HydrophobicContact CB-CB 4.36Å; A182-M208 HydrophobicContact CB-CG 4.31Å; A182-M208 CarbonylContact O-C 3.55Å; A182-M208 WeakPolarHBondContact O-CA 3.43Å; T185-M208 HydrophobicContact CG2-CE 3.93Å; T185-M208 HydrophobicContact CG2-SD 3.9Å; D206-M208 PolarHBondContact O-N 3.03Å; M208-D211 HydrophobicContact SD-CB 4.38Å; M208-H220 WeakPolarHBondContact O-CB 3.48Å; M208-T223 PolarHBondContact N-OG1 2.72Å; M208-T223 VanDerWaalsContact O-CB 3.29Å; M208-T223 WeakPolarHBondContact O-CB 3.34Å; M208-T223 PolarHBondContact O-OG1 2.84Å
209	A	93.1	Very high	83.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.328	C	S	.	.	S	Bend	trans	-86.9	-47.5	176.4	0	0	0	0	0	112	I59 F62 I151 V181 A182 H220	I59-A209 HydrophobicContact CG1-CB 4.48Å; F62-A209 HydrophobicContact CB-CB 4.38Å; F62-A209 HydrophobicContact CD1-CB 4.05Å; F62-A209 HydrophobicContact CD2-CB 3.95Å; F62-A209 WeakPolarHBondContact CD2-O 3.35Å; F62-A209 HydrophobicContact CE1-CB 4.29Å; F62-A209 HydrophobicContact CE2-CB 4.19Å; F62-A209 HydrophobicContact CG-CB 3.88Å; F62-A209 HydrophobicContact CZ-CB 4.35Å; I151-A209 HydrophobicContact CG2-CB 4Å; V181-A209 HydrophobicContact CG1-CB 4.04Å; A182-A209 PolarHBondContact O-N 3.22Å; A209-H220 PolarHBondContact O-N 2.83Å
210	V	91.3	Very high	84.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	115.9	-173.4	-169.3	0	0	0	0	110.7	L55 I59 A183 S184 L212 P217 T218	L55-V210 HydrophobicContact CD1-CB 3.86Å; L55-V210 HydrophobicContact CD1-CG1 4.13Å; L55-V210 HydrophobicContact CD1-CG2 3.94Å; I59-V210 HydrophobicContact CG1-CG2 4.11Å; A183-V210 PolarHBondContact O-N 3.26Å; S184-V210 WeakPolarHBondContact CA-O 3.41Å; V210-L212 HydrophobicContact CG1-CD2 3.85Å; V210-P217 HydrophobicContact CG1-CB 3.48Å; V210-P217 VanDerWaalsContact CG1-CB 3.48Å; V210-T218 CarbonylContact C-O 3.54Å; V210-T218 WeakPolarHBondContact CA-O 3.48Å
211	D	88	Confident	84.9	Confident	21 Å²	21	58 Å²	58	11%	0.112	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.6	171	167.5	24.2	0	0	0	110	M208 S213 K214 T218	M208-D211 HydrophobicContact SD-CB 4.38Å; D211-S213 VanDerWaalsContact CG-OG 3.29Å; D211-S213 WeakPolarHBondContact OD1-CB 3.5Å; D211-S213 PolarHBondContact OD1-N 2.95Å; D211-S213 PolarHBondContact OD1-OG 3.34Å; D211-S213 PolarHBondContact OD2-OG 3.43Å; D211-K214 IonicContact OD2-NZ 2.72Å; D211-K214 PolarHBondContact OD2-NZ 2.96Å; D211-T218 PolarHBondContact N-O 3.34Å; D211-T218 PolarHBondContact O-N 3.18Å; D211-T218 PolarHBondContact O-OG1 2.81Å
212	L	82.8	Confident	85.6	Confident	36 Å²	36	55.6 Å²	55.6	19%	0.188	31%	0.308	C	S	.	.			trans	-98.5	-9.7	-180	-57.6	-175.8	0	0	0	113.5	E49 V210 K214 G215 P217	E49-L212 HydrophobicContact CG-CD1 4.3Å; E49-L212 HydrophobicContact CG-CD2 4.07Å; V210-L212 HydrophobicContact CG1-CD2 3.85Å; L212-K214 PolarHBondContact O-N 2.79Å; L212-G215 PolarHBondContact O-N 3.29Å; L212-P217 HydrophobicContact CD2-CB 3.92Å
213	S	77.7	Confident	86.1	Confident	85 Å²	85	53.7 Å²	53.7	59%	0.594	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.3	-170.2	62.4	0	0	0	0	114.7	D211	D211-S213 VanDerWaalsContact CG-OG 3.29Å; D211-S213 WeakPolarHBondContact OD1-CB 3.5Å; D211-S213 PolarHBondContact OD1-N 2.95Å; D211-S213 PolarHBondContact OD1-OG 3.34Å; D211-S213 PolarHBondContact OD2-OG 3.43Å
214	K	72.8	Confident	86.4	Confident	145 Å²	145	53.3 Å²	53.3	63%	0.63	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	13.6	-173.4	-62.9	169.8	-172.7	66.9	0	113.5	D211 L212 R216	D211-K214 IonicContact OD2-NZ 2.72Å; D211-K214 PolarHBondContact OD2-NZ 2.96Å; L212-K214 PolarHBondContact O-N 2.79Å; K214-R216 PolarHBondContact O-N 2.94Å
215	G	66.7	Low	86.5	Confident	73 Å²	73	56.3 Å²	56.3	75%	0.753	31%	0.312	S	S	*	.	S	Bend	trans	70.2	10.1	177.7	0	0	0	0	0	115	L212	L212-G215 PolarHBondContact O-N 3.29Å
216	R	74.6	Confident	86.7	Confident	202 Å²	202	59.3 Å²	59.3	76%	0.762	32%	0.319	S	S	*	.	S	Bend	trans	-145.3	141.6	167.2	-66.7	-174.3	179.3	178.6	0.3	107.7	K214 T218	K214-R216 PolarHBondContact O-N 2.94Å; R216-T218 PolarHBondContact O-N 3.01Å
217	P	80.8	Confident	87.1	Confident	54 Å²	54	53.6 Å²	53.6	35%	0.351	29%	0.288	S	S	.	.			trans	-65.3	122.4	177.9	24.7	-31.7	0	0	0	110.3	E49 V210 L212	E49-P217 WeakPolarHBondContact OE1-CB 3.32Å; E49-P217 VanDerWaalsContact OE1-CD 3.28Å; E49-P217 WeakPolarHBondContact OE1-CD 3.5Å; E49-P217 VanDerWaalsContact OE1-CG 3.29Å; E49-P217 WeakPolarHBondContact OE1-CG 3.49Å; V210-P217 HydrophobicContact CG1-CB 3.48Å; V210-P217 VanDerWaalsContact CG1-CB 3.48Å; L212-P217 HydrophobicContact CD2-CB 3.92Å
218	T	88.1	Confident	87.2	Confident	59 Å²	59	54.3 Å²	54.3	36%	0.362	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124	178.7	52.9	0	0	0	0	110.8	V210 D211 R216 H220	V210-T218 CarbonylContact C-O 3.54Å; V210-T218 WeakPolarHBondContact CA-O 3.48Å; D211-T218 PolarHBondContact N-O 3.34Å; D211-T218 PolarHBondContact O-N 3.18Å; D211-T218 PolarHBondContact O-OG1 2.81Å; R216-T218 PolarHBondContact O-N 3.01Å; T218-H220 PolarHBondContact O-N 2.84Å
219	I	91.3	Very high	87	Confident	43 Å²	43	60 Å²	60	22%	0.221	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	119.1	-173	-68.1	167.5	0	0	0	109.3	S61 F62 Q65 T221	S61-I219 WeakPolarHBondContact OG-CD1 3.48Å; F62-I219 HydrophobicContact CB-CG2 3.93Å; F62-I219 HydrophobicContact CD2-CG2 3.95Å; F62-I219 HydrophobicContact CG-CG2 4.42Å; Q65-I219 VanDerWaalsContact NE2-CD1 3.34Å; I219-T221 VanDerWaalsContact C-N 3.32Å; I219-T221 HydrophobicContact CG2-CG2 4.38Å; I219-T221 PolarHBondContact O-N 3.5Å
220	H	90.6	Very high	86.9	Confident	76 Å²	76	61.5 Å²	61.5	35%	0.352	33%	0.325	S	S	.	.			trans	-82.1	76	-170.2	-163.6	-111.2	0	0	0	111.9	M208 A209 T218 A222 T223	M208-H220 WeakPolarHBondContact O-CB 3.48Å; A209-H220 PolarHBondContact O-N 2.83Å; T218-H220 PolarHBondContact O-N 2.84Å; H220-A222 PolarHBondContact O-N 2.8Å; H220-A222 VanDerWaalsContact O-N 3.09Å; H220-T223 PolarHBondContact ND1-OG1 2.04Å; H220-T223 VanDerWaalsContact O-CB 3.26Å; H220-T223 WeakPolarHBondContact O-CB 3.17Å; H220-T223 PolarHBondContact O-N 3Å; H220-T223 PolarHBondContact O-OG1 3.3Å
221	T	91.3	Very high	86.9	Confident	48 Å²	48	61.5 Å²	61.5	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-59	-22.7	-175.5	55	0	0	0	0	114.8	I219 T223 I224 D225	I219-T221 VanDerWaalsContact C-N 3.32Å; I219-T221 HydrophobicContact CG2-CG2 4.38Å; I219-T221 PolarHBondContact O-N 3.5Å; T221-T223 VanDerWaalsContact C-N 3.3Å; T221-T223 PolarHBondContact O-N 2.03Å; T221-I224 HydrophobicContact CG2-CD1 4.46Å; T221-I224 WeakPolarHBondContact O-CB 3.49Å; T221-I224 PolarHBondContact O-N 2.81Å; T221-D225 PolarHBondContact O-N 2.84Å; T221-D225 VanDerWaalsContact O-N 3.11Å
222	A	89.9	Confident	87	Confident	42 Å²	42	64.1 Å²	64.1	35%	0.347	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-33.6	172.9	0	0	0	0	0	112.7	H220 I224 D225 R226	H220-A222 PolarHBondContact O-N 2.8Å; H220-A222 VanDerWaalsContact O-N 3.09Å; A222-I224 VanDerWaalsContact C-N 3.33Å; A222-I224 PolarHBondContact O-N 2.84Å; A222-D225 PolarHBondContact O-N 2.9Å; A222-R226 WeakPolarHBondContact O-CG 3.41Å; A222-R226 PolarHBondContact O-N 3.47Å
223	T	93.1	Very high	87.1	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.012	35%	0.347	C	S	.	.	H	α-helix	trans	-58.4	-47.4	171.8	-59	0	0	0	0	110.8	F62 V181 F207 M208 H220 T221 D225 R226 I227	F62-T223 HydrophobicContact CE2-CG2 4.2Å; F62-T223 HydrophobicContact CZ-CG2 3.99Å; V181-T223 HydrophobicContact CG1-CG2 4.23Å; F207-T223 HydrophobicContact CB-CG2 3.6Å; F207-T223 HydrophobicContact CD1-CG2 3.94Å; F207-T223 HydrophobicContact CG-CG2 4.01Å; M208-T223 PolarHBondContact N-OG1 2.72Å; M208-T223 VanDerWaalsContact O-CB 3.29Å; M208-T223 WeakPolarHBondContact O-CB 3.34Å; M208-T223 PolarHBondContact O-OG1 2.84Å; H220-T223 PolarHBondContact ND1-OG1 2.04Å; H220-T223 VanDerWaalsContact O-CB 3.26Å; H220-T223 WeakPolarHBondContact O-CB 3.17Å; H220-T223 PolarHBondContact O-N 3Å; H220-T223 PolarHBondContact O-OG1 3.3Å; T221-T223 VanDerWaalsContact C-N 3.3Å; T221-T223 PolarHBondContact O-N 2.03Å; T223-D225 PolarHBondContact O-N 2.86Å; T223-R226 PolarHBondContact O-N 2.92Å; T223-I227 HydrophobicContact CG2-CD1 3.73Å; T223-I227 HydrophobicContact CG2-CG1 4.48Å; T223-I227 WeakPolarHBondContact O-CG1 3.4Å; T223-I227 PolarHBondContact O-N 3.33Å
224	I	95.1	Very high	87.5	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.3	-49.5	-179.6	-56.6	177.2	0	0	0	110.1	F62 Q65 F66 T221 A222 R226 I227 I228	F62-I224 HydrophobicContact CD2-CD1 3.86Å; F62-I224 HydrophobicContact CD2-CG1 3.89Å; F62-I224 HydrophobicContact CE1-CG1 4.48Å; F62-I224 HydrophobicContact CE2-CD1 3.9Å; F62-I224 HydrophobicContact CE2-CG1 3.37Å; F62-I224 HydrophobicContact CG-CD1 4.41Å; F62-I224 HydrophobicContact CZ-CD1 4.48Å; F62-I224 HydrophobicContact CZ-CG1 3.72Å; Q65-I224 HydrophobicContact CB-CD1 4.02Å; F66-I224 HydrophobicContact CB-CD1 4.36Å; F66-I224 HydrophobicContact CB-CG1 4.46Å; F66-I224 HydrophobicContact CB-CG2 4.04Å; F66-I224 HydrophobicContact CD1-CG2 4.39Å; F66-I224 HydrophobicContact CD2-CB 4.2Å; F66-I224 HydrophobicContact CD2-CG1 4Å; F66-I224 HydrophobicContact CD2-CG2 3.79Å; F66-I224 HydrophobicContact CE2-CG2 4.34Å; F66-I224 HydrophobicContact CG-CG2 3.81Å; T221-I224 HydrophobicContact CG2-CD1 4.46Å; T221-I224 WeakPolarHBondContact O-CB 3.49Å; T221-I224 PolarHBondContact O-N 2.81Å; A222-I224 VanDerWaalsContact C-N 3.33Å; A222-I224 PolarHBondContact O-N 2.84Å; I224-R226 PolarHBondContact O-N 3.15Å; I224-I227 PolarHBondContact O-N 3.47Å; I224-I228 HydrophobicContact CG2-CD1 3.63Å; I224-I228 HydrophobicContact CG2-CG1 4.35Å; I224-I228 WeakPolarHBondContact O-CB 3.33Å; I224-I228 VanDerWaalsContact O-CG1 3.3Å; I224-I228 WeakPolarHBondContact O-CG1 3.1Å; I224-I228 PolarHBondContact O-N 2.9Å
225	D	92.6	Very high	88	Confident	76 Å²	76	58.1 Å²	58.1	41%	0.406	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-33.6	-177.1	-67.9	-31.3	0	0	0	112.6	R69 T221 A222 T223 K229	R69-D225 IonicContact CZ-OD1 2.68Å; R69-D225 IonicContact CZ-OD2 3.87Å; R69-D225 IonicContact NH1-OD1 3.58Å; R69-D225 PolarHBondContact NH1-OD1 3.03Å; R69-D225 IonicContact NH1-OD2 3.18Å; R69-D225 PolarHBondContact NH1-OD2 3.41Å; T221-D225 PolarHBondContact O-N 2.84Å; T221-D225 VanDerWaalsContact O-N 3.11Å; A222-D225 PolarHBondContact O-N 2.9Å; T223-D225 PolarHBondContact O-N 2.86Å; D225-K229 WeakPolarHBondContact O-CB 3.1Å; D225-K229 PolarHBondContact O-N 2.7Å; D225-K229 VanDerWaalsContact O-N 3.09Å
226	R	90.3	Very high	88.7	Confident	121 Å²	121	55.8 Å²	55.8	46%	0.457	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-53.2	170.9	-72.4	-173.6	-167	-171.6	6.6	111.3	D205 F207 A222 T223 I224 I228 K229 T230	D205-R226 IonicContact OD1-NH1 3.21Å; D205-R226 PolarHBondContact OD1-NH1 3.42Å; D205-R226 WeakPolarHBondContact OD2-CD 3.31Å; D205-R226 IonicContact OD2-CZ 2.73Å; D205-R226 IonicContact OD2-NE 2.71Å; D205-R226 IonicContact OD2-NH1 3.24Å; D205-R226 PolarHBondContact OD2-NH1 2.97Å; F207-R226 HydrophobicContact CE1-CB 3.87Å; A222-R226 WeakPolarHBondContact O-CG 3.41Å; A222-R226 PolarHBondContact O-N 3.47Å; T223-R226 PolarHBondContact O-N 2.92Å; I224-R226 PolarHBondContact O-N 3.15Å; R226-I228 PolarHBondContact O-N 2.6Å; R226-K229 WeakPolarHBondContact O-CB 3.38Å; R226-K229 PolarHBondContact O-N 3Å; R226-T230 PolarHBondContact O-N 3Å; R226-T230 PolarHBondContact O-OG1 2.88Å
227	I	93.9	Very high	88.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-44.8	-176.9	-64.5	171.7	0	0	0	111.1	F66 V149 F179 V181 F207 T223 I224 K229 T230 M231	F66-I227 HydrophobicContact CE2-CB 4.15Å; F66-I227 HydrophobicContact CE2-CD1 4.34Å; F66-I227 HydrophobicContact CE2-CG2 4.03Å; F66-I227 HydrophobicContact CZ-CB 4.14Å; F66-I227 HydrophobicContact CZ-CG2 3.68Å; V149-I227 HydrophobicContact CG2-CG2 4.44Å; F179-I227 HydrophobicContact CD1-CB 4.48Å; F179-I227 HydrophobicContact CD1-CD1 4.48Å; F179-I227 HydrophobicContact CD1-CG1 4.02Å; F179-I227 HydrophobicContact CD1-CG2 3.86Å; F179-I227 HydrophobicContact CD2-CG2 3.99Å; F179-I227 HydrophobicContact CE1-CG1 4.4Å; F179-I227 HydrophobicContact CE1-CG2 3.98Å; F179-I227 HydrophobicContact CE2-CG2 4.07Å; F179-I227 HydrophobicContact CG-CG2 3.88Å; F179-I227 HydrophobicContact CZ-CG2 4.08Å; V181-I227 HydrophobicContact CG2-CD1 3.75Å; F207-I227 HydrophobicContact CB-CD1 4.34Å; F207-I227 HydrophobicContact CD1-CD1 4.31Å; F207-I227 HydrophobicContact CD1-CG1 4.12Å; F207-I227 HydrophobicContact CD2-CD1 3.92Å; F207-I227 HydrophobicContact CD2-CG1 3.97Å; F207-I227 HydrophobicContact CE1-CG1 3.97Å; F207-I227 HydrophobicContact CE2-CD1 4.28Å; F207-I227 HydrophobicContact CE2-CG1 3.82Å; F207-I227 HydrophobicContact CG-CD1 3.93Å; F207-I227 HydrophobicContact CG-CG1 4.12Å; F207-I227 HydrophobicContact CZ-CG1 3.81Å; T223-I227 HydrophobicContact CG2-CD1 3.73Å; T223-I227 HydrophobicContact CG2-CG1 4.48Å; T223-I227 WeakPolarHBondContact O-CG1 3.4Å; T223-I227 PolarHBondContact O-N 3.33Å; I224-I227 PolarHBondContact O-N 3.47Å; I227-K229 VanDerWaalsContact C-N 3.33Å; I227-K229 PolarHBondContact O-N 2.98Å; I227-T230 PolarHBondContact O-N 3.49Å; I227-M231 HydrophobicContact CG2-CE 3.45Å; I227-M231 VanDerWaalsContact CG2-CE 3.45Å; I227-M231 HydrophobicContact CG2-CG 4.39Å; I227-M231 HydrophobicContact CG2-SD 4.06Å; I227-M231 WeakPolarHBondContact O-CG 3.4Å; I227-M231 PolarHBondContact O-N 3.28Å
228	I	93.1	Very high	88.8	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-40.3	176.7	-67.2	175.4	0	0	0	111.1	F66 R69 L70 I224 R226 T230 R232	F66-I228 HydrophobicContact CD1-CD1 4.07Å; F66-I228 HydrophobicContact CD1-CG1 4.21Å; F66-I228 HydrophobicContact CE1-CD1 4Å; F66-I228 HydrophobicContact CE1-CG1 3.62Å; F66-I228 HydrophobicContact CZ-CG1 3.89Å; R69-I228 HydrophobicContact CB-CD1 3.75Å; L70-I228 HydrophobicContact CD2-CD1 3.79Å; L70-I228 HydrophobicContact CD2-CG1 3.81Å; L70-I228 HydrophobicContact CD2-CG2 4.33Å; L70-I228 HydrophobicContact CG-CD1 4.38Å; I224-I228 HydrophobicContact CG2-CD1 3.63Å; I224-I228 HydrophobicContact CG2-CG1 4.35Å; I224-I228 WeakPolarHBondContact O-CB 3.33Å; I224-I228 VanDerWaalsContact O-CG1 3.3Å; I224-I228 WeakPolarHBondContact O-CG1 3.1Å; I224-I228 PolarHBondContact O-N 2.9Å; R226-I228 PolarHBondContact O-N 2.6Å; I228-T230 PolarHBondContact O-N 2.73Å; I228-R232 HydrophobicContact CG2-CG 4.39Å; I228-R232 WeakPolarHBondContact O-CB 3.46Å; I228-R232 VanDerWaalsContact O-CG 3.26Å; I228-R232 WeakPolarHBondContact O-CG 3.46Å; I228-R232 PolarHBondContact O-N 3.39Å
229	K	90.4	Very high	88.2	Confident	161 Å²	161	48.9 Å²	48.9	70%	0.7	24%	0.244	S	C	*	.	H	α-helix	trans	-61.1	-43	174.9	-179.2	-171.5	175.5	-166.8	0	111.5	D225 R226 I227 H233	D225-K229 WeakPolarHBondContact O-CB 3.1Å; D225-K229 PolarHBondContact O-N 2.7Å; D225-K229 VanDerWaalsContact O-N 3.09Å; R226-K229 WeakPolarHBondContact O-CB 3.38Å; R226-K229 PolarHBondContact O-N 3Å; I227-K229 VanDerWaalsContact C-N 3.33Å; I227-K229 PolarHBondContact O-N 2.98Å; K229-H233 WeakPolarHBondContact O-CB 3.25Å; K229-H233 PolarHBondContact O-N 3.01Å
230	T	90.2	Very high	87.2	Confident	32 Å²	32	52.8 Å²	52.8	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-49.8	177.1	-59.3	0	0	0	0	111.8	F179 V202 R226 I227 I228 R232 H233 M234	F179-T230 HydrophobicContact CE1-CG2 3.99Å; F179-T230 HydrophobicContact CZ-CG2 3.79Å; V202-T230 HydrophobicContact CG1-CG2 3.6Å; R226-T230 PolarHBondContact O-N 3Å; R226-T230 PolarHBondContact O-OG1 2.88Å; I227-T230 PolarHBondContact O-N 3.49Å; I228-T230 PolarHBondContact O-N 2.73Å; T230-R232 VanDerWaalsContact C-N 3.32Å; T230-R232 PolarHBondContact O-N 2.99Å; T230-H233 PolarHBondContact O-N 3.49Å; T230-H233 VanDerWaalsContact O-N 3.11Å; T230-M234 HydrophobicContact CG2-CE 3.57Å; T230-M234 HydrophobicContact CG2-SD 3.98Å; T230-M234 WeakPolarHBondContact O-CG 3.4Å; T230-M234 PolarHBondContact O-N 3.28Å
231	M	92.1	Very high	85.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-45.3	175.8	-69.5	171.2	175.8	0	0	111.8	L35 F66 W83 F147 V149 F179 I227 H233 M234 A235	L35-M231 HydrophobicContact CD1-CE 3.48Å; L35-M231 VanDerWaalsContact CD1-CE 3.48Å; L35-M231 HydrophobicContact CD1-SD 4.21Å; F66-M231 HydrophobicContact CZ-CE 4.15Å; F66-M231 HydrophobicContact CZ-SD 4.36Å; W83-M231 HydrophobicContact CH2-CB 3.97Å; W83-M231 HydrophobicContact CH2-SD 4.03Å; W83-M231 HydrophobicContact CZ3-SD 4Å; F147-M231 HydrophobicContact CB-CE 3.89Å; F147-M231 HydrophobicContact CB-CG 4.49Å; F147-M231 HydrophobicContact CD1-CG 3.89Å; F147-M231 HydrophobicContact CD2-CG 4.28Å; F147-M231 HydrophobicContact CE1-CB 4.33Å; F147-M231 HydrophobicContact CE1-CG 4.08Å; F147-M231 HydrophobicContact CE2-CB 4.31Å; F147-M231 HydrophobicContact CE2-CG 4.46Å; F147-M231 HydrophobicContact CG-CE 4.39Å; F147-M231 HydrophobicContact CG-CG 3.99Å; F147-M231 HydrophobicContact CZ-CB 4.19Å; F147-M231 HydrophobicContact CZ-CG 4.36Å; V149-M231 HydrophobicContact CG2-CE 3.65Å; F179-M231 HydrophobicContact CD2-CE 3.68Å; F179-M231 HydrophobicContact CE2-CE 3.63Å; F179-M231 HydrophobicContact CE2-CG 3.76Å; F179-M231 HydrophobicContact CZ-CG 4.11Å; I227-M231 HydrophobicContact CG2-CE 3.45Å; I227-M231 VanDerWaalsContact CG2-CE 3.45Å; I227-M231 HydrophobicContact CG2-CG 4.39Å; I227-M231 HydrophobicContact CG2-SD 4.06Å; I227-M231 WeakPolarHBondContact O-CG 3.4Å; I227-M231 PolarHBondContact O-N 3.28Å; M231-H233 PolarHBondContact O-N 2.77Å; M231-M234 PolarHBondContact O-N 2.92Å; M231-A235 VanDerWaalsContact O-CB 3.27Å; M231-A235 WeakPolarHBondContact O-CB 3.5Å; M231-A235 PolarHBondContact O-N 3.11Å
232	R	88.8	Confident	83.3	Confident	75 Å²	75	57.1 Å²	57.1	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-64.2	-36.7	176.7	-76	179.7	64	149	13.1	113.3	E73 I75 W83 I228 T230 F236	E73-R232 IonicContact OE1-CZ 2.68Å; E73-R232 IonicContact OE1-NH1 2.78Å; E73-R232 PolarHBondContact OE1-NH1 3.33Å; E73-R232 IonicContact OE1-NH2 3.17Å; E73-R232 IonicContact OE2-CZ 3.08Å; E73-R232 IonicContact OE2-NH1 2.95Å; E73-R232 PolarHBondContact OE2-NH1 2.72Å; E73-R232 IonicContact OE2-NH2 2.94Å; E73-R232 PolarHBondContact OE2-NH2 3.32Å; I75-R232 HydrophobicContact CD1-CB 3.89Å; I75-R232 HydrophobicContact CD1-CG 4.21Å; I75-R232 WeakPolarHBondContact CD1-O 3.43Å; W83-R232 HydrophobicContact CZ2-CG 4.45Å; I228-R232 HydrophobicContact CG2-CG 4.39Å; I228-R232 WeakPolarHBondContact O-CB 3.46Å; I228-R232 VanDerWaalsContact O-CG 3.26Å; I228-R232 WeakPolarHBondContact O-CG 3.46Å; I228-R232 PolarHBondContact O-N 3.39Å; T230-R232 VanDerWaalsContact C-N 3.32Å; T230-R232 PolarHBondContact O-N 2.99Å; R232-F236 WeakPolarHBondContact O-CB 3.4Å; R232-F236 PolarHBondContact O-N 3.39Å; R232-F236 VanDerWaalsContact O-N 3.08Å
233	H	85.4	Confident	81.3	Confident	105 Å²	105	57.8 Å²	57.8	49%	0.486	29%	0.286	S	S	.	.	H	α-helix	trans	-67.6	-48.9	177.3	-177	63.2	0	0	0	111.1	K229 T230 M231 F236 V237	K229-H233 WeakPolarHBondContact O-CB 3.25Å; K229-H233 PolarHBondContact O-N 3.01Å; T230-H233 PolarHBondContact O-N 3.49Å; T230-H233 VanDerWaalsContact O-N 3.11Å; M231-H233 PolarHBondContact O-N 2.77Å; H233-F236 PolarHBondContact O-N 2.97Å; H233-V237 WeakPolarHBondContact O-CG2 3.33Å; H233-V237 PolarHBondContact O-N 3.09Å
234	M	86.2	Confident	79.1	Confident	35 Å²	35	61.1 Å²	61.1	17%	0.172	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-47.5	176.4	-69.2	171.6	176.3	0	0	111.4	F147 V202 F203 T230 M231 F236 V237 D238	F147-M234 HydrophobicContact CE1-CB 4.26Å; F147-M234 HydrophobicContact CE1-SD 3.89Å; F147-M234 HydrophobicContact CZ-CB 4.06Å; V202-M234 HydrophobicContact CG1-CE 3.62Å; F203-M234 HydrophobicContact CE1-CE 4.03Å; F203-M234 HydrophobicContact CE1-SD 4.23Å; F203-M234 HydrophobicContact CE2-CE 4.08Å; F203-M234 HydrophobicContact CZ-CE 3.45Å; F203-M234 VanDerWaalsContact CZ-CE 3.45Å; F203-M234 HydrophobicContact CZ-SD 4.01Å; T230-M234 HydrophobicContact CG2-CE 3.57Å; T230-M234 HydrophobicContact CG2-SD 3.98Å; T230-M234 WeakPolarHBondContact O-CG 3.4Å; T230-M234 PolarHBondContact O-N 3.28Å; M231-M234 PolarHBondContact O-N 2.92Å; M234-F236 VanDerWaalsContact C-N 3.29Å; M234-F236 PolarHBondContact O-N 3.5Å; M234-V237 PolarHBondContact O-N 2.85Å; M234-D238 PolarHBondContact O-N 3.01Å; M234-D238 VanDerWaalsContact O-OD2 3.13Å
235	A	84.1	Confident	76.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-35.6	177.8	0	0	0	0	0	113.4	I33 I81 L145 M231 C239	I33-A235 HydrophobicContact CD1-CB 3.62Å; I33-A235 HydrophobicContact CG1-CB 4.44Å; I81-A235 HydrophobicContact CD1-CB 3.9Å; L145-A235 HydrophobicContact CD1-CB 3.71Å; M231-A235 VanDerWaalsContact O-CB 3.27Å; M231-A235 WeakPolarHBondContact O-CB 3.5Å; M231-A235 PolarHBondContact O-N 3.11Å; A235-C239 VanDerWaalsContact O-CB 3.26Å; A235-C239 WeakPolarHBondContact O-CB 3.48Å; A235-C239 PolarHBondContact O-N 2.94Å; A235-C239 VanDerWaalsContact O-N 3.09Å
236	F	81.1	Confident	74.2	Confident	24 Å²	24	72.9 Å²	72.9	11%	0.105	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-44.6	170.8	-179.8	-98.9	0	0	0	111.7	I75 R76 V79 R232 H233 M234 Y240	I75-F236 HydrophobicContact CB-CD2 4.14Å; I75-F236 HydrophobicContact CD1-CB 4.43Å; I75-F236 HydrophobicContact CG2-CB 4.11Å; I75-F236 HydrophobicContact CG2-CD2 3.46Å; I75-F236 VanDerWaalsContact CG2-CD2 3.46Å; I75-F236 HydrophobicContact CG2-CE2 4.21Å; I75-F236 HydrophobicContact CG2-CG 3.99Å; R76-F236 HydrophobicContact CB-CE2 4.2Å; R76-F236 HydrophobicContact CG-CE2 4.46Å; R76-F236 VanDerWaalsContact NH1-CE1 3.3Å; V79-F236 HydrophobicContact CG2-CD2 4.28Å; V79-F236 HydrophobicContact CG2-CE2 4.46Å; R232-F236 WeakPolarHBondContact O-CB 3.4Å; R232-F236 PolarHBondContact O-N 3.39Å; R232-F236 VanDerWaalsContact O-N 3.08Å; H233-F236 PolarHBondContact O-N 2.97Å; M234-F236 VanDerWaalsContact C-N 3.29Å; M234-F236 PolarHBondContact O-N 3.5Å; F236-Y240 HydrophobicContact CE1-CD1 4.28Å; F236-Y240 HydrophobicContact CE1-CG 4.27Å; F236-Y240 AromaticContact CE2-CD2 3.72Å; F236-Y240 HydrophobicContact CE2-CD2 3.72Å; F236-Y240 HydrophobicContact CE2-CE2 4.3Å; F236-Y240 AromaticContact CE2-CG 3.87Å; F236-Y240 HydrophobicContact CE2-CG 3.87Å; F236-Y240 AromaticContact CZ-CD1 3.91Å; F236-Y240 HydrophobicContact CZ-CD1 3.91Å; F236-Y240 AromaticContact CZ-CD2 3.79Å; F236-Y240 HydrophobicContact CZ-CD2 3.79Å; F236-Y240 HydrophobicContact CZ-CE1 4.28Å; F236-Y240 HydrophobicContact CZ-CE2 4.16Å; F236-Y240 AromaticContact CZ-CG 3.66Å; F236-Y240 HydrophobicContact CZ-CG 3.66Å; F236-Y240 WeakPolarHBondContact O-CB 3.45Å; F236-Y240 PolarHBondContact O-N 3.01Å
237	V	79.3	Confident	71.9	Confident	83 Å²	83	73.7 Å²	73.7	50%	0.503	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-47.2	-180	172	0	0	0	0	111.8	H233 M234	H233-V237 WeakPolarHBondContact O-CG2 3.33Å; H233-V237 PolarHBondContact O-N 3.09Å; M234-V237 PolarHBondContact O-N 2.85Å
238	D	77.4	Confident	69.3	Low	57 Å²	57	83.6 Å²	83.6	31%	0.305	43%	0.427	S	S	.	.	H	α-helix	trans	-68.9	-50.1	-177.7	-54.9	-46.4	0	0	0	111.9	L145 R177 M234	L145-D238 HydrophobicContact CD1-CB 4.11Å; L145-D238 HydrophobicContact CD2-CB 3.94Å; L145-D238 WeakPolarHBondContact CD2-OD2 3.46Å; R177-D238 IonicContact CZ-OD1 2.76Å; R177-D238 IonicContact CZ-OD2 3.22Å; R177-D238 VanDerWaalsContact CZ-OD2 3.31Å; R177-D238 IonicContact NH1-OD1 3.74Å; R177-D238 IonicContact NH1-OD2 3.84Å; R177-D238 PolarHBondContact NH1-OD2 3.17Å; R177-D238 IonicContact NH2-OD1 2.75Å; R177-D238 PolarHBondContact NH2-OD1 3.25Å; R177-D238 IonicContact NH2-OD2 3.58Å; R177-D238 PolarHBondContact NH2-OD2 3.41Å; M234-D238 PolarHBondContact O-N 3.01Å; M234-D238 VanDerWaalsContact O-OD2 3.13Å
239	C	76.4	Confident	67	Low	31 Å²	31	85.8 Å²	85.8	21%	0.209	45%	0.454	C	S	.	.	H	α-helix	trans	-84.8	-15.6	-170.7	-66.7	0	0	0	0	114.4	C31 V79 A235 N241	C31-C239 HydrophobicContact CB-CB 3.55Å; C31-C239 WeakPolarHBondContact CB-SG 3.42Å; C31-C239 WeakPolarHBondContact SG-CB 3.46Å; C31-C239 CovalentContact SG-SG 2.04Å; C31-C239 PolarHBondContact SG-SG 3.35Å; V79-C239 HydrophobicContact CG1-CB 3.64Å; A235-C239 VanDerWaalsContact O-CB 3.26Å; A235-C239 WeakPolarHBondContact O-CB 3.48Å; A235-C239 PolarHBondContact O-N 2.94Å; A235-C239 VanDerWaalsContact O-N 3.09Å; C239-N241 VanDerWaalsContact C-N 3.28Å
240	Y	70.2	Confident	64.5	Low	124 Å²	124	87.1 Å²	87.1	49%	0.486	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-5.3	172.7	-172.5	-105.1	0	0	0	112.8	A78 V79 F236 V242	A78-Y240 HydrophobicContact CB-CD2 4.01Å; A78-Y240 HydrophobicContact CB-CE2 3.85Å; V79-Y240 HydrophobicContact CG2-CD2 4.1Å; F236-Y240 HydrophobicContact CE1-CD1 4.28Å; F236-Y240 HydrophobicContact CE1-CG 4.27Å; F236-Y240 AromaticContact CE2-CD2 3.72Å; F236-Y240 HydrophobicContact CE2-CD2 3.72Å; F236-Y240 HydrophobicContact CE2-CE2 4.3Å; F236-Y240 AromaticContact CE2-CG 3.87Å; F236-Y240 HydrophobicContact CE2-CG 3.87Å; F236-Y240 AromaticContact CZ-CD1 3.91Å; F236-Y240 HydrophobicContact CZ-CD1 3.91Å; F236-Y240 AromaticContact CZ-CD2 3.79Å; F236-Y240 HydrophobicContact CZ-CD2 3.79Å; F236-Y240 HydrophobicContact CZ-CE1 4.28Å; F236-Y240 HydrophobicContact CZ-CE2 4.16Å; F236-Y240 AromaticContact CZ-CG 3.66Å; F236-Y240 HydrophobicContact CZ-CG 3.66Å; F236-Y240 WeakPolarHBondContact O-CB 3.45Å; F236-Y240 PolarHBondContact O-N 3.01Å; Y240-V242 PolarHBondContact O-N 3.44Å
241	N	54.8	Low	62.5	Low	129 Å²	129	91.7 Å²	91.7	69%	0.69	49%	0.493	S	S	*	.			trans	-65.6	132	-176.1	-161.8	6.5	0	0	0	111.9	C239 S243	C239-N241 VanDerWaalsContact C-N 3.28Å; N241-S243 PolarHBondContact O-N 3.38Å
242	V	44.8	Very low	60.3	Low	86 Å²	86	94.6 Å²	94.6	52%	0.521	52%	0.523	S	S	.	.			trans	-88.2	98.4	-156.9	-178.4	0	0	0	0	110.9	Y240 C244	Y240-V242 PolarHBondContact O-N 3.44Å; V242-C244 HydrophobicContact CG1-CB 3.86Å; V242-C244 PolarHBondContact O-N 2.89Å
243	S	47.4	Very low	58.3	Low	57 Å²	57	97.2 Å²	97.2	40%	0.399	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	35.6	-179.9	76.7	0	0	0	0	114.9	R29 N241	R29-S243 PolarHBondContact NE-OG 2.66Å; R29-S243 PolarHBondContact NH2-OG 3.3Å; N241-S243 PolarHBondContact O-N 3.38Å
244	C	47.8	Very low	56.6	Low	72 Å²	72	102.1 Å²	102.1	49%	0.486	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-2.3	176.5	-60.4	0	0	0	0	113.2	V242	V242-C244 HydrophobicContact CG1-CB 3.86Å; V242-C244 PolarHBondContact O-N 2.89Å
245	L	44.1	Very low	54.4	Low	161 Å²	161	103.6 Å²	103.6	84%	0.843	59%	0.594	S	S	*	*	S	Bend	trans	-116.1	-7.6	-176.8	-67.9	173.5	0	0	0	114.2	T247	L245-T247 PolarHBondContact O-N 3Å
246	E	41.5	Very low	52.5	Low	162 Å²	162	112.8 Å²	112.8	76%	0.757	64%	0.636	S	S	*	*			trans	-89.3	84.1	178.8	-66.4	-171.9	148.9	0	0	111.4	K248	E246-K248 PolarHBondContact O-N 3.39Å
247	T	41.4	Very low	50.9	Low	137 Å²	137	123.4 Å²	123.4	84%	0.84	68%	0.675	S	S	*	*			trans	-64.4	108.2	165	49.1	0	0	0	0	109.4	L245 G249	L245-T247 PolarHBondContact O-N 3Å; T247-G249 PolarHBondContact O-N 2.91Å
248	K	39.3	Very low	49	Very low	209 Å²	209	122.6 Å²	122.6	91%	0.909	68%	0.684	S	S	*	*			trans	-56	111.3	179.2	-164.5	173.2	-170.6	172.7	0	110.2	E246	E246-K248 PolarHBondContact O-N 3.39Å
249	G	44.8	Very low	47.4	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-56.2	149.9	-179.2	0	0	0	0	0	112.1	T247	T247-G249 PolarHBondContact O-N 2.91Å
250	Q	38.3	Very low	46.2	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-56	139.2	175.7	-69.4	-174.3	-4.7	0	0	109.8	G252	Q250-G252 PolarHBondContact O-N 2.84Å; Q250-G252 VanDerWaalsContact O-N 3.13Å
251	P	48.4	Very low	44.8	Very low	128 Å²	128	134.7 Å²	134.7	83%	0.831	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-53.5	122.6	176.8	-26	34.6	0	0	0	110.4
252	G	44.6	Very low	44.2	Very low	62 Å²	62	133 Å²	133	64%	0.639	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-54.1	145.8	-177.5	0	0	0	0	0	111.6	Q250 K254	Q250-G252 PolarHBondContact O-N 2.84Å; Q250-G252 VanDerWaalsContact O-N 3.13Å; G252-K254 PolarHBondContact O-N 2.92Å
253	P	47.3	Very low	44.6	Very low	129 Å²	129	137.7 Å²	137.7	84%	0.838	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-54	130.6	-177.5	23	-33.6	0	0	0	109.8	G255	P253-G255 PolarHBondContact O-N 2.83Å
254	K	49.2	Very low	44.5	Very low	208 Å²	208	137.9 Å²	137.9	90%	0.904	78%	0.782	S	S	*	*			trans	-56.4	107.5	-170.2	-167.6	174	-171.5	172.8	0	109.7	G252	G252-K254 PolarHBondContact O-N 2.92Å
255	G	39.9	Very low	44.3	Very low	66 Å²	66	141.7 Å²	141.7	68%	0.68	80%	0.798	S	S	*	*			trans	-48.7	138.2	-166.3	0	0	0	0	0	112.9	P253 R257	P253-G255 PolarHBondContact O-N 2.83Å; G255-R257 PolarHBondContact O-N 3.48Å
256	H	44.3	Very low	44.6	Very low	193 Å²	193	141.1 Å²	141.1	89%	0.894	80%	0.796	S	S	*	*			trans	-50	129.8	-177.9	-66.1	-78.9	0	0	0	110	G258	H256-G258 PolarHBondContact O-N 2.9Å
257	R	47.3	Very low	44.6	Very low	247 Å²	247	136.9 Å²	136.9	93%	0.932	80%	0.796	S	S	*	*			trans	-54.6	107.5	-178.7	-178.7	-177.2	-173.8	174.1	3.9	108.5	G255 Q259	G255-R257 PolarHBondContact O-N 3.48Å; R257-Q259 PolarHBondContact O-N 3.3Å
258	G	40.4	Very low	44.9	Very low	66 Å²	66	139.6 Å²	139.6	68%	0.68	80%	0.799	S	S	*	*			trans	-48.2	136	-174.4	0	0	0	0	0	111	H256 K260	H256-G258 PolarHBondContact O-N 2.9Å; G258-K260 PolarHBondContact O-N 2.95Å
259	Q	43.4	Very low	45.4	Very low	195 Å²	195	134.3 Å²	134.3	91%	0.911	79%	0.794	S	S	*	*			trans	-54.5	133.1	-178.8	-66	-166.3	18.3	0	0	108.9	R257 G261	R257-Q259 PolarHBondContact O-N 3.3Å; Q259-G261 PolarHBondContact O-N 3.31Å
260	K	50.4	Low	45.4	Very low	207 Å²	207	134.9 Å²	134.9	90%	0.9	80%	0.8	S	S	*	*			trans	-59.8	111.5	179.3	-176.3	-175.5	-179.6	-173.6	0	107.1	G258 A262	G258-K260 PolarHBondContact O-N 2.95Å; K260-A262 PolarHBondContact O-N 2.91Å
261	G	40.9	Very low	45.8	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	80%	0.803	S	S	*	*			trans	-46	134.5	-169.2	0	0	0	0	0	112.1	Q259 K263	Q259-G261 PolarHBondContact O-N 3.31Å; G261-K263 PolarHBondContact O-N 3.09Å
262	A	42.3	Very low	46.1	Very low	95 Å²	95	137.9 Å²	137.9	79%	0.785	81%	0.805	S	S	*	*			trans	-51.3	129.3	-178.5	0	0	0	0	0	109.4	K260 G264	K260-A262 PolarHBondContact O-N 2.91Å; A262-G264 PolarHBondContact O-N 2.95Å
263	K	54	Low	46.1	Very low	184 Å²	184	138.6 Å²	138.6	80%	0.8	81%	0.812	S	S	*	*			trans	-66.6	107.9	172.7	179.1	-163.8	172.7	-164.2	0	105.8	G261 D265	G261-K263 PolarHBondContact O-N 3.09Å; K263-D265 PolarHBondContact O-N 3.32Å
264	G	44.5	Very low	46.1	Very low	60 Å²	60	141 Å²	141	62%	0.619	81%	0.812	S	S	*	*			trans	-45.5	130.4	-173.1	0	0	0	0	0	112.3	A262 N266	A262-G264 PolarHBondContact O-N 2.95Å; G264-N266 PolarHBondContact O-N 3.3Å
265	D	44.3	Very low	45.9	Very low	153 Å²	153	142.1 Å²	142.1	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64.7	131.9	-171.3	-62.7	-69.1	0	0	0	111.1	K263 G267	K263-D265 PolarHBondContact O-N 3.32Å; D265-G267 PolarHBondContact O-N 3.03Å
266	N	49.2	Very low	46	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-65.6	118.6	165.9	-81.1	1.4	0	0	0	107.1	G264 E268	G264-N266 PolarHBondContact O-N 3.3Å; N266-E268 PolarHBondContact O-N 3.24Å
267	G	41.9	Very low	46.1	Very low	74 Å²	74	143.8 Å²	143.8	76%	0.763	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-51.3	139	-179.2	0	0	0	0	0	112.7	D265	D265-G267 PolarHBondContact O-N 3.03Å
268	E	47.2	Very low	46.1	Very low	193 Å²	193	137.9 Å²	137.9	90%	0.902	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-59.2	138.8	-173.5	-63.6	-168.3	124.6	0	0	112.5	N266 G270	N266-E268 PolarHBondContact O-N 3.24Å; E268-G270 PolarHBondContact O-N 3.09Å
269	A	51.3	Low	46.1	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.4	117.8	172.7	0	0	0	0	0	109.5	L271	A269-L271 PolarHBondContact O-N 3.45Å
270	G	44.6	Very low	45.8	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-51.8	133.3	-174.3	0	0	0	0	0	113.7	E268 K272	E268-G270 PolarHBondContact O-N 3.09Å; G270-K272 PolarHBondContact O-N 2.83Å
271	L	45.4	Very low	45.8	Very low	178 Å²	178	132.5 Å²	132.5	93%	0.932	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.1	128	-173.4	-69.1	172.9	0	0	0	112.3	A269 G273	A269-L271 PolarHBondContact O-N 3.45Å; L271-G273 PolarHBondContact O-N 2.9Å
272	K	54.8	Low	46	Very low	201 Å²	201	133.2 Å²	133.2	87%	0.874	81%	0.809	S	S	*	*			trans	-76.1	114.5	177.3	-173.2	178	-176	177.5	0	109.4	G270 E274	G270-K272 PolarHBondContact O-N 2.83Å; K272-E274 PolarHBondContact O-N 2.93Å
273	G	44.9	Very low	45.6	Very low	77 Å²	77	136.9 Å²	136.9	79%	0.794	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-53.7	131.6	-174.9	0	0	0	0	0	113.9	L271	L271-G273 PolarHBondContact O-N 2.9Å
274	E	47	Very low	45	Very low	179 Å²	179	137.3 Å²	137.3	84%	0.836	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.6	152.5	-179.4	-67.4	-151.4	124.2	0	0	113	K272	K272-E274 PolarHBondContact O-N 2.93Å
275	R	46.3	Very low	45	Very low	232 Å²	232	137.5 Å²	137.5	88%	0.875	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.3	127.3	174.4	-176.7	-177.5	-65.7	172.7	-1.5	109.4
276	G	41.8	Very low	44.9	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-55.3	141	178.8	0	0	0	0	0	113.3
277	R	45.5	Very low	44.5	Very low	223 Å²	223	137.6 Å²	137.6	84%	0.842	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-94.1	140.3	178.3	-60.5	-174	-174.5	-165	3.4	110.8
278	P	47.8	Very low	44.3	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-58.5	155.8	160.8	-21.3	34.2	0	0	0	111.3
279	G	40.6	Very low	44	Very low	79 Å²	79	137.2 Å²	137.2	81%	0.814	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-90	144.3	-176	0	0	0	0	0	114.3
280	D	38.1	Very low	44	Very low	154 Å²	154	138.6 Å²	138.6	82%	0.824	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-96.8	145.5	178.2	-65.8	-56.9	0	0	0	112.4
281	P	49.3	Very low	43.9	Very low	123 Å²	123	138.8 Å²	138.8	80%	0.799	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-68.3	150.5	172.8	-20.3	33.8	0	0	0	113.9
282	G	45.6	Very low	44	Very low	79 Å²	79	138.7 Å²	138.7	81%	0.814	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-81.2	161	-173.7	0	0	0	0	0	116.3
283	I	34.1	Very low	43.6	Very low	172 Å²	172	139 Å²	139	88%	0.882	83%	0.825	S	S	*	*			trans	-135.3	159	176.9	-62.3	-179.6	0	0	0	109
284	E	40.3	Very low	43.7	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-64.7	163.1	-170.9	-63.8	171.6	106.6	0	0	116
285	G	44.2	Very low	43.6	Very low	64 Å²	64	139 Å²	139	66%	0.66	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-83	167.2	-170.3	0	0	0	0	0	116.4
286	P	42.8	Very low	43.9	Very low	134 Å²	134	134.3 Å²	134.3	87%	0.87	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-76.5	135.9	-173.1	30.3	-35.2	0	0	0	114
287	I	42.1	Very low	44.2	Very low	169 Å²	169	134.4 Å²	134.4	87%	0.867	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71	150.2	167.8	-67.2	168.6	0	0	0	109.9
288	G	37.8	Very low	44.2	Very low	66 Å²	66	129.7 Å²	129.7	68%	0.68	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-60.9	151.8	-174.8	0	0	0	0	0	115.3
289	Q	39.8	Very low	44.2	Very low	193 Å²	193	134 Å²	134	90%	0.902	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-69.6	130.6	-179.5	-67.2	179.6	-7.7	0	0	112.1
290	P	50.6	Low	44.6	Very low	128 Å²	128	133.6 Å²	133.6	83%	0.831	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-62.7	138.3	165.7	-21.7	34.1	0	0	0	111.4
291	G	43.8	Very low	44.5	Very low	77 Å²	77	136.2 Å²	136.2	79%	0.794	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-67.5	152.6	-174.8	0	0	0	0	0	114.7
292	I	47	Very low	44.1	Very low	177 Å²	177	138.8 Å²	138.8	91%	0.908	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-60.3	135.6	174.6	51.5	173.2	0	0	0	111.8	G294	I292-G294 PolarHBondContact O-N 3.27Å
293	K	47.4	Very low	43.8	Very low	208 Å²	208	138.5 Å²	138.5	90%	0.904	83%	0.828	S	S	*	*			trans	-78.4	112.8	-179.7	-176.6	180	178.3	-177.1	0	109.6
294	G	45.2	Very low	43.8	Very low	67 Å²	67	136.6 Å²	136.6	69%	0.691	82%	0.816	S	S	*	*			trans	-65.6	157.5	-173.5	0	0	0	0	0	115.4	I292	I292-G294 PolarHBondContact O-N 3.27Å
295	E	45.2	Very low	43.5	Very low	187 Å²	187	134.8 Å²	134.8	87%	0.874	81%	0.811	S	S	*	*			trans	-73.3	150.9	176.9	-60.7	-167.5	128	0	0	112.4	G297	E295-G297 PolarHBondContact O-N 2.78Å
296	P	53.9	Low	43.4	Very low	134 Å²	134	134.7 Å²	134.7	87%	0.87	81%	0.81	S	S	*	*			trans	-66.7	115	178.2	-20.3	33.7	0	0	0	112.5
297	G	47.3	Very low	43	Very low	75 Å²	75	134.3 Å²	134.3	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.8	144.3	-178.5	0	0	0	0	0	114.5	E295	E295-G297 PolarHBondContact O-N 2.78Å
298	S	46.3	Very low	42.7	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67	135.7	172.7	51.4	0	0	0	0	112.1	G300	S298-G300 PolarHBondContact O-N 3.18Å
299	K	47.5	Very low	42.9	Very low	214 Å²	214	134.5 Å²	134.5	93%	0.93	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.5	121.1	-177.8	-173.1	-178.9	-179.6	-174.8	0	111.3
300	G	48.3	Very low	42.6	Very low	69 Å²	69	134 Å²	134	71%	0.711	80%	0.797	S	S	*	*			trans	-100.3	-175.1	-176.3	0	0	0	0	0	115.6	S298	S298-G300 PolarHBondContact O-N 3.18Å
301	E	37.2	Very low	41.8	Very low	210 Å²	210	137.6 Å²	137.6	98%	0.981	80%	0.799	S	S	*	*			trans	-122.1	170.6	174.8	-65.7	-161.4	126.6	0	0	112.7
302	K	39.4	Very low	41.5	Very low	177 Å²	177	137.1 Å²	137.1	77%	0.77	80%	0.795	S	S	*	*			trans	-120.5	153.3	-164.5	175.2	-170.9	-175.7	-112.7	0	109.3	E304	K302-E304 WeakPolarHBondContact CE-OE1 3.33Å; K302-E304 IonicContact NZ-OE1 3.12Å; K302-E304 PolarHBondContact NZ-OE1 3Å
303	G	40.4	Very low	40.8	Very low	72 Å²	72	135.2 Å²	135.2	74%	0.742	79%	0.791	S	S	*	*			cis	-151.6	-135.7	-1.5	0	0	0	0	0	107.4
304	E	33	Very low	40.2	Very low	133 Å²	133	130.4 Å²	130.4	62%	0.621	79%	0.79	S	S	*	*			cis	-171	141.8	-8.1	-132.9	174.2	-137.5	0	0	107.1	K302	K302-E304 WeakPolarHBondContact CE-OE1 3.33Å; K302-E304 IonicContact NZ-OE1 3.12Å; K302-E304 PolarHBondContact NZ-OE1 3Å
305	I	34.5	Very low	39.9	Very low	153 Å²	153	130.1 Å²	130.1	79%	0.785	79%	0.787	S	S	*	*			trans	61.3	133.8	158.1	-57.9	160.1	0	0	0	118.4
306	G	41.3	Very low	39.7	Very low	63 Å²	63	129.6 Å²	129.6	65%	0.649	79%	0.789	S	S	*	*			cis	166	-171.2	-4.7	0	0	0	0	0	115.7
307	T	35.4	Very low	39.3	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	79%	0.786	S	S	*	*			trans	52.7	96.5	148.9	57.9	0	0	0	0	122
308	Q	35.9	Very low	39.3	Very low	175 Å²	175	129.4 Å²	129.4	82%	0.818	79%	0.788	S	S	*	*				51	119.6	113	-173.6	-174	64.9	0	0	120.8
309	G	40.5	Very low	38.9	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	79%	0.79	S	S	*	*				154.2	106.6	127.8	0	0	0	0	0	122.5
310	K	33.5	Very low	38.3	Very low	183 Å²	183	132.1 Å²	132.1	80%	0.796	79%	0.785	S	S	*	*				62.6	121.6	127.8	-60.8	168.8	-178	170	0	122
311	K	35.4	Very low	38.2	Very low	202 Å²	202	132.2 Å²	132.2	88%	0.878	79%	0.786	S	S	*	*				62.6	129.2	122.2	-157.8	-177.5	-170	-175.4	0	118.7
312	G	37.3	Very low	38.3	Very low	67 Å²	67	129 Å²	129	69%	0.691	78%	0.781	S	S	*	*			cis	150.1	-174.3	-1.5	0	0	0	0	0	112.3
313	V	32	Very low	38.2	Very low	138 Å²	138	128.7 Å²	128.7	84%	0.836	79%	0.788	S	S	*	*			trans	85.2	142.8	161	-166.2	0	0	0	0	119.5
314	A	34.2	Very low	38.3	Very low	106 Å²	106	128.7 Å²	128.7	88%	0.876	79%	0.788	S	S	*	*			trans	75.5	157.7	164.8	0	0	0	0	0	120.2
315	G	39.1	Very low	38.4	Very low	62 Å²	62	132.3 Å²	132.3	64%	0.639	81%	0.805	S	S	*	*			trans	-177.3	-165.5	-177.1	0	0	0	0	0	112.9
316	I	41.6	Very low	38.9	Very low	176 Å²	176	135.2 Å²	135.2	90%	0.903	81%	0.812	S	S	*	*			trans	57.6	159.2	-173.9	22.3	-177.1	0	0	0	114.8
317	P	46.2	Very low	38.8	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	82%	0.816	S	S	*	*			cis	-118.8	-179.2	2	40.8	-25.2	0	0	0	115.2
318	G	47	Very low	38.8	Very low	78 Å²	78	139.8 Å²	139.8	80%	0.804	82%	0.823	S	S	*	*			trans	-100.8	-166.9	-174	0	0	0	0	0	116.4
319	R	36.5	Very low	38.7	Very low	238 Å²	238	139.7 Å²	139.7	90%	0.898	83%	0.827	S	S	*	*			trans	-149.9	130.9	176.6	-152.1	173.7	-170.6	179.7	2	113.4
320	N	36.5	Very low	38.6	Very low	156 Å²	156	139.6 Å²	139.6	83%	0.834	83%	0.826	S	S	*	*			trans	-0.5	139.1	168.7	-51.9	10.4	0	0	0	120.5
321	G	45.3	Very low	38.9	Very low	72 Å²	72	142.9 Å²	142.9	74%	0.742	83%	0.834	S	S	*	*			trans	-95.4	-174.5	158.5	0	0	0	0	0	113.5
322	T	39.3	Very low	38.9	Very low	143 Å²	143	141 Å²	141	88%	0.877	83%	0.832	S	S	*	*			trans	-148.7	147.1	171.9	44.3	0	0	0	0	110.2
323	D	38.4	Very low	39	Very low	170 Å²	170	140.9 Å²	140.9	91%	0.909	83%	0.831	S	S	*	*			trans	-83.7	152.8	-165.6	-58.1	-77.5	0	0	0	116.8
324	G	42.2	Very low	39.3	Very low	72 Å²	72	138.9 Å²	138.9	74%	0.742	83%	0.828	S	S	*	*				97.6	103.5	118	0	0	0	0	0	119.5
325	Q	34.2	Very low	40	Very low	208 Å²	208	139.7 Å²	139.7	97%	0.972	83%	0.825	S	S	*	*			trans	-149.4	157.8	138.8	-118.9	172.5	79	0	0	111.1
326	K	46.1	Very low	40	Very low	215 Å²	215	140.4 Å²	140.4	94%	0.935	83%	0.833	S	S	*	*			trans	-126.8	119.8	-157	-177.2	-178.2	-179.8	-179.6	0	112.9
327	G	38.8	Very low	39.7	Very low	71 Å²	71	138.4 Å²	138.4	73%	0.732	83%	0.832	S	S	*	*			trans	161.9	153.4	171.2	0	0	0	0	0	111.5
328	K	35.8	Very low	39.6	Very low	213 Å²	213	141.4 Å²	141.4	93%	0.926	83%	0.833	S	S	*	*			cis	-127.9	165.6	4.8	-76.2	-179	176.7	176.2	0	112.1
329	L	33.6	Very low	39.4	Very low	173 Å²	173	140.7 Å²	140.7	91%	0.906	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-60.8	133	176.1	-175.1	69.6	0	0	0	112
330	G	38.6	Very low	39.5	Very low	62 Å²	62	136.5 Å²	136.5	64%	0.639	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-75.7	145.3	169.1	0	0	0	0	0	111.8
331	R	39.3	Very low	40.2	Very low	252 Å²	252	134.5 Å²	134.5	95%	0.951	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77.2	146.2	173.1	-89.1	-174	169	-172.1	-3.7	111.2
332	I	35.4	Very low	40.1	Very low	162 Å²	162	134.7 Å²	134.7	83%	0.831	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76	128.5	171.8	-66.9	165.8	0	0	0	108.7
333	G	38.4	Very low	40.2	Very low	65 Å²	65	135.8 Å²	135.8	67%	0.67	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-82.2	148	159.7	0	0	0	0	0	110.1
334	A	38.3	Very low	40.7	Very low	96 Å²	96	137.2 Å²	137.2	79%	0.793	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.1	144.6	-172.2	0	0	0	0	0	112.9
335	P	49.1	Very low	40.9	Very low	123 Å²	123	136.2 Å²	136.2	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-58.9	140.3	165.2	-21.1	33.3	0	0	0	111
336	G	39.4	Very low	41.6	Very low	78 Å²	78	132.6 Å²	132.6	80%	0.804	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.8	145	179.1	0	0	0	0	0	112.7
337	C	35.5	Very low	41.7	Very low	133 Å²	133	128 Å²	128	90%	0.899	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.9	142.7	175.6	-69.9	0	0	0	0	111	G339	C337-G339 PolarHBondContact O-N 3.38Å
338	K	43.4	Very low	41.6	Very low	190 Å²	190	128.2 Å²	128.2	83%	0.826	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.9	121.2	174.6	175.3	-166.8	171.7	-162.3	0	108.5
339	G	43.8	Very low	41.8	Very low	62 Å²	62	126.8 Å²	126.8	64%	0.639	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-61.3	145.9	174.7	0	0	0	0	0	112.5	C337	C337-G339 PolarHBondContact O-N 3.38Å
340	D	39	Very low	42.4	Very low	150 Å²	150	124.9 Å²	124.9	80%	0.802	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.3	156.7	-176.4	-68.5	-69.3	0	0	0	113.3	G342	D340-G342 PolarHBondContact O-N 2.89Å
341	P	49.6	Very low	42.4	Very low	115 Å²	115	125.4 Å²	125.4	75%	0.747	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.9	121.4	174.4	-15.5	30.6	0	0	0	110.1
342	G	44.9	Very low	42.3	Very low	76 Å²	76	121.5 Å²	121.5	78%	0.784	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60	144.6	-179.6	0	0	0	0	0	113.2	D340	D340-G342 PolarHBondContact O-N 2.89Å
343	D	41.1	Very low	42.4	Very low	165 Å²	165	120.8 Å²	120.8	88%	0.882	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.1	146.3	-172.6	-75.9	-66.4	0	0	0	114.5	G345	D343-G345 PolarHBondContact O-N 3.41Å; D343-G345 VanDerWaalsContact O-N 3.14Å
344	R	47.6	Very low	42.5	Very low	200 Å²	200	121 Å²	121	76%	0.755	79%	0.786	S	S	*	*			trans	-69	110.2	175.9	177.1	177.8	166.7	-171.3	-9.7	109.5	D347	R344-D347 IonicContact CZ-OD1 3.86Å; R344-D347 IonicContact NE-OD1 2.67Å; R344-D347 IonicContact NH2-OD1 3.57Å; R344-D347 PolarHBondContact NH2-OD1 2.62Å; R344-D347 IonicContact NH2-OD2 3.47Å; R344-D347 PolarHBondContact NH2-OD2 2.7Å
345	G	47.3	Very low	42.3	Very low	52 Å²	52	126 Å²	126	54%	0.536	79%	0.793	S	S	.	*	P	Polyproline II helix	trans	-54.2	147.5	174.5	0	0	0	0	0	112.9	D343	D343-G345 PolarHBondContact O-N 3.41Å; D343-G345 VanDerWaalsContact O-N 3.14Å
346	P	49.2	Very low	41.8	Very low	131 Å²	131	131.8 Å²	131.8	85%	0.851	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64	143.4	-173.8	26	-34.9	0	0	0	112.4
347	D	47.1	Very low	41.8	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63.7	136.3	-176.2	-65.6	-43.6	0	0	0	111.6	R344	R344-D347 IonicContact CZ-OD1 3.86Å; R344-D347 IonicContact NE-OD1 2.67Å; R344-D347 IonicContact NH2-OD1 3.57Å; R344-D347 PolarHBondContact NH2-OD1 2.62Å; R344-D347 IonicContact NH2-OD2 3.47Å; R344-D347 PolarHBondContact NH2-OD2 2.7Å
348	G	38	Very low	42	Very low	75 Å²	75	130.3 Å²	130.3	77%	0.773	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-68.4	143.2	-171.1	0	0	0	0	0	114.3
349	H	39.1	Very low	42.1	Very low	182 Å²	182	127.3 Å²	127.3	84%	0.843	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69	143.7	175.5	-69.9	26.4	0	0	0	111.4	G351	H349-G351 PolarHBondContact O-N 3.26Å
350	P	46.3	Very low	41.9	Very low	134 Å²	134	128 Å²	128	87%	0.87	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.9	131	174.8	-23.6	34.3	0	0	0	111.8
351	G	39.5	Very low	41.9	Very low	73 Å²	73	127.5 Å²	127.5	75%	0.753	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-83.3	143.9	-176.1	0	0	0	0	0	114	H349	H349-G351 PolarHBondContact O-N 3.26Å
352	D	37.3	Very low	41.3	Very low	170 Å²	170	130.1 Å²	130.1	91%	0.909	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-66.5	147.8	169.7	-85.8	-52.8	0	0	0	112.3	G354	D352-G354 PolarHBondContact O-N 2.84Å
353	V	37	Very low	41.5	Very low	146 Å²	146	130.1 Å²	130.1	89%	0.885	80%	0.802	S	S	*	*			trans	-77.2	113.7	-176.9	178.5	0	0	0	0	110.1
354	G	40.5	Very low	41.3	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73.7	152.8	-174.4	0	0	0	0	0	115.4	D352	D352-G354 PolarHBondContact O-N 2.84Å
355	E	33.5	Very low	40.8	Very low	202 Å²	202	130.2 Å²	130.2	94%	0.944	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.1	155.6	166.7	-71.3	-149.3	121	0	0	112.5
356	R	39.7	Very low	41	Very low	244 Å²	244	131.4 Å²	131.4	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-86	120.3	-165.8	-177	177.9	-66	164.2	0.2	111.5
357	G	38.9	Very low	40.2	Very low	56 Å²	56	130.9 Å²	130.9	58%	0.577	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-64.4	159.3	178.3	0	0	0	0	0	114.5
358	P	40.3	Very low	39.9	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.3	146.6	172.1	29.2	-34.7	0	0	0	111
359	P	43.7	Very low	40.4	Very low	127 Å²	127	130.2 Å²	130.2	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.9	143.2	174.9	-22.5	33.9	0	0	0	112.3
360	G	40.8	Very low	40.2	Very low	78 Å²	78	133.3 Å²	133.3	80%	0.804	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-73.2	151.8	173.8	0	0	0	0	0	112.8
361	T	38.1	Very low	40.2	Very low	139 Å²	139	132.7 Å²	132.7	85%	0.853	81%	0.808	S	S	*	*			trans	-118.8	133.1	159.9	51.8	0	0	0	0	107.8
362	D	38.3	Very low	40.5	Very low	169 Å²	169	132.7 Å²	132.7	90%	0.904	81%	0.807	S	S	*	*			trans	-61.3	150.4	-174.3	-65.7	-66.5	0	0	0	113.4
363	G	47.8	Very low	40.5	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	81%	0.809	S	S	*	*			trans	-82.6	140.2	-166.5	0	0	0	0	0	114.9
364	E	36.6	Very low	40.5	Very low	196 Å²	196	134.3 Å²	134.3	92%	0.916	81%	0.806	S	S	*	*			trans	-85.1	112.8	165.9	-69.2	-159.2	115.1	0	0	111.7
365	K	37.3	Very low	40.8	Very low	170 Å²	170	133.8 Å²	133.8	74%	0.739	80%	0.801	S	S	*	*			trans	46.5	109.7	140.4	-162.2	-175.1	-177.4	-125.6	0	118.6	D367	K365-D367 IonicContact NZ-OD2 3.9Å; K365-D367 PolarHBondContact NZ-OD2 2.88Å
366	G	51.7	Low	41.4	Very low	78 Å²	78	130.2 Å²	130.2	80%	0.804	80%	0.795	S	S	*	*			trans	-69.3	133.2	166.7	0	0	0	0	0	113.7
367	D	32.5	Very low	42.2	Very low	119 Å²	119	124.6 Å²	124.6	64%	0.636	79%	0.79	S	S	*	*			trans	-156.2	149.5	168.5	-98.8	-51.1	0	0	0	107.3	K365	K365-D367 IonicContact NZ-OD2 3.9Å; K365-D367 PolarHBondContact NZ-OD2 2.88Å
368	P	41.8	Very low	42.3	Very low	109 Å²	109	125 Å²	125	71%	0.708	79%	0.794	S	S	*	*			cis	-123.2	170.3	-43.8	32.6	-17	0	0	0	111.5	R370	P368-R370 PolarHBondContact O-N 2.95Å
369	G	46.9	Very low	42.7	Very low	73 Å²	73	125 Å²	125	75%	0.753	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-60.6	124.3	173.6	0	0	0	0	0	111.7	P371	G369-P371 WeakPolarHBondContact O-CD 3.45Å
370	R	35.2	Very low	43.2	Very low	246 Å²	246	125.2 Å²	125.2	93%	0.928	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.8	179.4	-76.6	-171.5	173	-167.2	-1.7	110.2	P368	P368-R370 PolarHBondContact O-N 2.95Å
371	P	45.9	Very low	43.5	Very low	122 Å²	122	125.2 Å²	125.2	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-61.3	147.3	-179.4	-25.1	35	0	0	0	112.9	G369	G369-P371 WeakPolarHBondContact O-CD 3.45Å
372	G	45.8	Very low	43.7	Very low	72 Å²	72	128.2 Å²	128.2	74%	0.742	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.8	144.3	165.1	0	0	0	0	0	110.7	A374	G372-A374 PolarHBondContact O-N 2.8Å
373	R	38	Very low	43.5	Very low	252 Å²	252	128.3 Å²	128.3	95%	0.951	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.1	123.5	174.8	-74.5	-175.5	171.7	-169.8	-2.5	109.2
374	A	38.1	Very low	43.1	Very low	99 Å²	99	128.1 Å²	128.1	82%	0.818	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-61.1	140.1	174.1	0	0	0	0	0	110.5	G372	G372-A374 PolarHBondContact O-N 2.8Å
375	G	45.4	Very low	42.8	Very low	58 Å²	58	124.7 Å²	124.7	60%	0.598	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.6	159	171.1	0	0	0	0	0	111.8
376	P	46.1	Very low	42.7	Very low	126 Å²	126	125.5 Å²	125.5	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-61.8	132.4	172.6	27	-33.6	0	0	0	110.2
377	P	56.3	Low	42.8	Very low	127 Å²	127	124.9 Å²	124.9	83%	0.825	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-58.6	146	171.2	-24.7	35.2	0	0	0	111.9
378	G	41.1	Very low	42.7	Very low	65 Å²	65	125.9 Å²	125.9	67%	0.67	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68	160.4	178.7	0	0	0	0	0	113.4
379	P	49.6	Very low	42.4	Very low	124 Å²	124	130.4 Å²	130.4	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.4	153.4	174.8	28.2	-35	0	0	0	111.7
380	P	54.7	Low	42	Very low	130 Å²	130	130.1 Å²	130.1	84%	0.844	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-59.4	151	173.4	-22	33.9	0	0	0	112.4
381	G	45.8	Very low	41.9	Very low	79 Å²	79	123.6 Å²	123.6	81%	0.814	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-81.1	143.2	174.9	0	0	0	0	0	112.6
382	E	42.7	Very low	41.3	Very low	202 Å²	202	125.9 Å²	125.9	94%	0.944	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.8	159.7	164.3	-69	-168.3	130.3	0	0	111.3
383	D	35.1	Very low	40.7	Very low	170 Å²	170	125.7 Å²	125.7	91%	0.909	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-77.4	152.1	-168.8	-83.2	-53.4	0	0	0	115.4
384	G	38.1	Very low	41.4	Very low	73 Å²	73	119.6 Å²	119.6	75%	0.753	79%	0.789	S	S	*	*				84.4	92.1	124.2	0	0	0	0	0	119.2
385	S	30.7	Very low	41.6	Very low	124 Å²	124	121.1 Å²	121.1	87%	0.867	79%	0.791	S	S	*	*			trans	-128.5	77.1	131	70.3	0	0	0	0	110.3	G387	S385-G387 PolarHBondContact O-N 3Å
386	Q	36	Very low	41	Very low	187 Å²	187	121.9 Å²	121.9	87%	0.874	80%	0.799	S	S	*	*			trans	-60.3	129.6	169.3	-178.5	179.3	-55.6	0	0	109.3
387	G	53.3	Low	41.1	Very low	66 Å²	66	122.7 Å²	122.7	68%	0.68	80%	0.801	S	S	*	*			trans	-77.8	152.6	-173.6	0	0	0	0	0	114.8	S385	S385-G387 PolarHBondContact O-N 3Å
388	E	30.5	Very low	40.7	Very low	139 Å²	139	122.9 Å²	122.9	65%	0.65	80%	0.802	S	S	*	*			trans	-120.9	116.1	166.4	-74.7	-97.3	96.9	0	0	106.6
389	R	35.3	Very low	41	Very low	204 Å²	204	122.5 Å²	122.5	77%	0.77	80%	0.799	S	S	*	*				96.6	114.6	75.7	-173.6	-162.2	-63.3	-166.8	3.1	110.1
390	G	39.1	Very low	40.8	Very low	68 Å²	68	123.7 Å²	123.7	70%	0.701	80%	0.804	S	S	*	*			cis	160.7	-160.6	-3.5	0	0	0	0	0	112.6
391	S	31.7	Very low	39.9	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	81%	0.805	S	S	*	*			trans	69.4	94.4	154.4	-52.4	0	0	0	0	120.1
392	N	34.7	Very low	40.1	Very low	170 Å²	170	127 Å²	127	91%	0.909	80%	0.804	S	S	*	*				138.6	143.5	126.1	-74.9	1	0	0	0	113.3
393	G	33.2	Very low	40.4	Very low	67 Å²	67	122 Å²	122	69%	0.691	80%	0.798	S	S	*	*			cis	170.1	129.6	-6.7	0	0	0	0	0	111.8
394	S	51.3	Low	40.4	Very low	125 Å²	125	120 Å²	120	87%	0.874	80%	0.797	S	S	*	*			trans	-81.8	132.8	-180	45.1	0	0	0	0	112.4
395	P	43.6	Very low	40.3	Very low	130 Å²	130	119.9 Å²	119.9	84%	0.844	80%	0.795	S	S	*	*				-142.7	161.1	121.6	37.2	-24.4	0	0	0	112.4
396	G	31.8	Very low	40.7	Very low	75 Å²	75	122 Å²	122	77%	0.773	80%	0.796	S	S	*	*			cis	176.3	141.7	-5.7	0	0	0	0	0	110.2
397	V	48.4	Very low	41.2	Very low	143 Å²	143	119 Å²	119	87%	0.867	79%	0.792	S	S	*	*			trans	-74.5	149.6	175.4	-110.2	0	0	0	0	110.7
398	P	48.6	Very low	41	Very low	130 Å²	130	119.3 Å²	119.3	84%	0.844	80%	0.795	S	S	*	*				-156.1	171.7	65.2	41.4	-21.1	0	0	0	119.2
399	G	47.2	Very low	41.4	Very low	58 Å²	58	118.2 Å²	118.2	60%	0.598	80%	0.803	S	S	*	*			trans	123.5	82	130.9	0	0	0	0	0	122.5
400	T	44.8	Very low	42.1	Very low	148 Å²	148	113.9 Å²	113.9	91%	0.908	80%	0.801	S	S	*	*			trans	70.8	160.4	157.3	81.3	0	0	0	0	117
401	K	36.1	Very low	42.6	Very low	202 Å²	202	114.2 Å²	114.2	88%	0.878	81%	0.805	S	S	*	*			cis	-157	148.4	13.6	-174	-178.6	179.1	-178.8	0	111.6
402	G	50.8	Low	42.9	Very low	76 Å²	76	118.1 Å²	118.1	78%	0.784	81%	0.808	S	S	*	*			trans	111	112.2	150.2	0	0	0	0	0	117.6
403	A	48.3	Very low	43	Very low	99 Å²	99	119 Å²	119	82%	0.818	80%	0.799	S	S	*	*			trans	-72.9	159.5	-172.8	0	0	0	0	0	117
404	S	35.9	Very low	44.1	Very low	127 Å²	127	119.1 Å²	119.1	89%	0.888	80%	0.8	S	S	*	*				-154.9	136.4	123.1	-77.4	0	0	0	0	110.8
405	G	35.8	Very low	43.2	Very low	70 Å²	70	120.2 Å²	120.2	72%	0.722	79%	0.791	S	S	*	*			trans	-102.8	-164.5	165.9	0	0	0	0	0	109.8
406	I	37.5	Very low	42.9	Very low	170 Å²	170	122.9 Å²	122.9	87%	0.872	79%	0.793	S	S	*	*			cis	-162.2	-175.3	0.4	5.3	172.6	0	0	0	105
407	P	47.5	Very low	43.7	Very low	123 Å²	123	122.5 Å²	122.5	80%	0.799	79%	0.789	S	S	*	*			cis	-124.1	176.9	-23.4	34.3	-16.8	0	0	0	112.7
408	G	48.8	Very low	43	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	79%	0.789	S	S	*	*			trans	-140.3	163	161.8	0	0	0	0	0	110.9
409	S	38.6	Very low	42.4	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	79%	0.79	S	S	*	*			trans	-172.4	168.1	174.1	60.5	0	0	0	0	110.6
410	P	50.7	Low	42.1	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	79%	0.79	S	S	*	*			cis	-136.1	163.7	-43.8	35.7	-21.3	0	0	0	113.7
411	G	49.6	Very low	41.5	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	79%	0.785	S	S	*	*			trans	-115.4	116	152.6	0	0	0	0	0	110.5
412	K	36.9	Very low	41.4	Very low	190 Å²	190	132.6 Å²	132.6	83%	0.826	79%	0.785	S	S	*	*			trans	-159.4	151.9	175.5	-70.1	-165	-178.8	177.8	0	107.5
413	R	36.7	Very low	41.1	Very low	189 Å²	189	132.4 Å²	132.4	71%	0.713	78%	0.784	S	S	*	*			cis	-152.9	155.9	-2.4	164.5	-170.8	-62.1	171.6	-2	106.8	E415	R413-E415 WeakPolarHBondContact CD-OE2 3.39Å; R413-E415 IonicContact NH1-OE2 3.22Å; R413-E415 PolarHBondContact NH1-OE2 3.35Å
414	G	57.8	Low	40.8	Very low	70 Å²	70	133.9 Å²	133.9	72%	0.722	79%	0.785	S	S	*	*			trans	-107.2	141.6	161.8	0	0	0	0	0	112.7
415	E	31.8	Very low	40.8	Very low	148 Å²	148	136.1 Å²	136.1	69%	0.692	78%	0.779	S	S	*	*			trans	-158.3	110.2	166.5	-100.8	149.5	-175	0	0	103.7	R413	R413-E415 WeakPolarHBondContact CD-OE2 3.39Å; R413-E415 IonicContact NH1-OE2 3.22Å; R413-E415 PolarHBondContact NH1-OE2 3.35Å
416	E	37.3	Very low	41.2	Very low	186 Å²	186	135.9 Å²	135.9	87%	0.869	78%	0.776	S	S	*	*				62.9	127.6	98.4	-165.3	169.9	-154.5	0	0	114.2
417	G	49.1	Very low	41.1	Very low	67 Å²	67	135.4 Å²	135.4	69%	0.691	77%	0.77	S	S	*	*			trans	-147.6	-176.8	-172.9	0	0	0	0	0	113.6
418	R	33.5	Very low	41.1	Very low	229 Å²	229	135.4 Å²	135.4	86%	0.864	77%	0.77	S	S	*	*			trans	-165.5	143.2	176.4	-107.4	161.3	-164.6	-157.5	4.3	113.3
419	R	36.2	Very low	41	Very low	230 Å²	230	135.4 Å²	135.4	87%	0.868	77%	0.769	S	S	*	*			trans	44.7	130.3	139.9	-176.8	-168.9	-66.9	-180	-3.5	119.8
420	G	40.9	Very low	41.1	Very low	59 Å²	59	136.2 Å²	136.2	61%	0.608	77%	0.772	S	S	*	*			trans	148.7	99.9	137.8	0	0	0	0	0	117.6
421	D	31.9	Very low	40.7	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	78%	0.78	S	S	*	*			trans	59.4	144.7	130.9	-49.1	-40.6	0	0	0	123.4
422	Y	33.6	Very low	40.5	Very low	226 Å²	226	138.3 Å²	138.3	89%	0.886	77%	0.774	S	S	*	*			trans	-12.2	129.7	170.1	-64.2	-95.1	0	0	0	119.7
423	G	44.9	Very low	40.6	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	78%	0.781	S	S	*	*			trans	-91.5	171.1	169.8	0	0	0	0	0	114.7
424	P	41.5	Very low	41.3	Very low	130 Å²	130	137.8 Å²	137.8	84%	0.844	79%	0.791	S	S	*	*			trans	-110.6	160.4	171.8	38.6	-30.6	0	0	0	114.7
425	K	36.2	Very low	40.5	Very low	174 Å²	174	137.7 Å²	137.7	76%	0.757	79%	0.789	S	S	*	*			trans	-45.5	138.8	169.4	-171.9	-164.7	-177.3	-142.5	0	113.9	E427	K425-E427 IonicContact NZ-OE1 2.72Å; K425-E427 PolarHBondContact NZ-OE1 3.45Å
426	G	43.8	Very low	40.8	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	80%	0.801	S	S	*	*			trans	-97.6	-178	168.9	0	0	0	0	0	113.7
427	E	35.2	Very low	41	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	80%	0.802	S	S	*	*			trans	-159.5	171.8	172.1	-107.3	171.3	-135.1	0	0	109.9	K425	K425-E427 IonicContact NZ-OE1 2.72Å; K425-E427 PolarHBondContact NZ-OE1 3.45Å
428	P	48.4	Very low	40.7	Very low	123 Å²	123	141.5 Å²	141.5	80%	0.799	81%	0.806	S	S	*	*			trans	-131.1	170.3	-132.4	40.9	-23.8	0	0	0	118.3
429	G	46.2	Very low	40.6	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	81%	0.81	S	S	*	*			trans	82.1	175.2	166.4	0	0	0	0	0	115.7
430	P	40.1	Very low	40.7	Very low	133 Å²	133	138.4 Å²	138.4	86%	0.864	81%	0.814	S	S	*	*			cis	-118.6	-176	4.9	42.5	-30.9	0	0	0	114.3
431	D	43.2	Very low	40.9	Very low	167 Å²	167	139 Å²	139	89%	0.893	82%	0.819	S	S	*	*			trans	-72.9	141.6	172.3	-90.4	-51.6	0	0	0	114.3
432	G	45.4	Very low	41.2	Very low	65 Å²	65	138.3 Å²	138.3	67%	0.67	82%	0.823	S	S	*	*			trans	86	135.3	134.5	0	0	0	0	0	120.1
433	T	38.4	Very low	41.7	Very low	157 Å²	157	136.6 Å²	136.6	96%	0.963	82%	0.823	S	S	*	*				-161.1	153.8	126.6	6.6	0	0	0	0	110.4
434	K	52.3	Low	41.4	Very low	212 Å²	212	136.4 Å²	136.4	92%	0.922	82%	0.821	S	S	*	*			trans	-118	113.7	-177.6	175.2	-177.4	174.6	179.5	0	110
435	G	41.7	Very low	41.7	Very low	67 Å²	67	138.7 Å²	138.7	69%	0.691	83%	0.825	S	S	*	*			trans	-176.6	153.6	173.2	0	0	0	0	0	109.8
436	E	36.4	Very low	41.7	Very low	202 Å²	202	142 Å²	142	94%	0.944	83%	0.833	S	S	*	*			cis	-130.9	-175.6	4.3	-68.3	-165.3	105.8	0	0	112.6
437	K	42	Very low	41.4	Very low	204 Å²	204	141.9 Å²	141.9	89%	0.887	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-90.5	135.1	-175.9	-178.2	-177.5	177	-173.4	0	109.8
438	G	43.3	Very low	41.3	Very low	75 Å²	75	140.7 Å²	140.7	77%	0.773	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75	166.1	-172.9	0	0	0	0	0	116.1
439	E	31.8	Very low	41.8	Very low	202 Å²	202	140.5 Å²	140.5	94%	0.944	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-103.7	155.9	174.7	-61	-173.4	124.1	0	0	111.8
440	M	37.7	Very low	41.3	Very low	193 Å²	193	140.8 Å²	140.8	95%	0.951	84%	0.837	S	S	*	*			trans	-149.9	133.6	173.3	-178.6	176.8	68.9	0	0	111.7
441	G	45.4	Very low	41.4	Very low	70 Å²	70	143 Å²	143	72%	0.722	84%	0.836	S	S	*	*			trans	95.7	160.1	174.6	0	0	0	0	0	114.2
442	P	38.8	Very low	42.3	Very low	134 Å²	134	140.9 Å²	140.9	87%	0.87	83%	0.831	S	S	*	*			cis	-114.8	-168	11.3	42.1	-32	0	0	0	114.4
443	E	42.8	Very low	42.4	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	84%	0.835	S	S	*	*			trans	-74.7	166.3	179.3	-58.2	171.4	89.4	0	0	115
444	G	39.4	Very low	42.2	Very low	69 Å²	69	139.3 Å²	139.3	71%	0.711	83%	0.828	S	S	*	*				101	90.4	122.4	0	0	0	0	0	119.9
445	L	46.9	Very low	41.7	Very low	178 Å²	178	139.3 Å²	139.3	93%	0.932	83%	0.828	S	S	*	*			trans	32.5	136.7	137.7	-60.8	172.6	0	0	0	121.3
446	R	37.3	Very low	41.9	Very low	243 Å²	243	139.6 Å²	139.6	92%	0.917	83%	0.831	S	S	*	*				168.3	143.7	106	-179.8	171.2	-169.6	180	3.3	114.3
447	G	36.1	Very low	42.4	Very low	62 Å²	62	134.6 Å²	134.6	64%	0.639	82%	0.824	S	S	*	*			trans	155	143.6	151.6	0	0	0	0	0	115.5
448	V	34.3	Very low	42.4	Very low	137 Å²	137	133 Å²	133	83%	0.83	82%	0.817	S	S	*	*			cis	-147.5	-163.7	-16.5	-139	0	0	0	0	108.7
449	P	58.5	Low	42.9	Very low	119 Å²	119	132.4 Å²	132.4	77%	0.773	81%	0.812	S	S	*	*			trans	-123.9	-176.5	-131.6	44.5	-26.2	0	0	0	117.4
450	G	35.4	Very low	43.3	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	80%	0.796	S	S	*	*			trans	-167.4	121.3	160	0	0	0	0	0	112
451	E	41.4	Very low	43.6	Very low	179 Å²	179	125.9 Å²	125.9	84%	0.836	79%	0.792	S	S	*	*			trans	-115.2	-156.9	-177.8	-52.3	-175.2	116	0	0	111.1
452	P	63	Low	44.1	Very low	123 Å²	123	125.4 Å²	125.4	80%	0.799	79%	0.788	S	S	*	*				-115.7	-175.7	-62.3	21.4	-0.4	0	0	0	110.9
453	G	47.6	Very low	44	Very low	73 Å²	73	127.5 Å²	127.5	75%	0.753	79%	0.791	S	S	*	*			cis	142.1	156.1	-3.1	0	0	0	0	0	113.1
454	S	33.3	Very low	44.9	Very low	116 Å²	116	124.6 Å²	124.6	81%	0.811	79%	0.788	S	S	*	*			trans	-168.8	119.1	164.2	38.9	0	0	0	0	108.7
455	K	43	Very low	45.8	Very low	212 Å²	212	124.8 Å²	124.8	92%	0.922	79%	0.791	S	S	*	*				70.5	120.8	67.4	-165.8	-178.1	-171.6	-179.2	0	112
456	G	46.2	Very low	45.8	Very low	74 Å²	74	123 Å²	123	76%	0.763	79%	0.79	S	S	*	*			cis	168.2	-175.3	0	0	0	0	0	0	109.9
457	A	45.3	Very low	46.4	Very low	96 Å²	96	123.5 Å²	123.5	79%	0.793	79%	0.791	S	S	*	*			cis	-163.4	-160	-2.3	0	0	0	0	0	108.6
458	K	42.1	Very low	47.1	Very low	170 Å²	170	123.6 Å²	123.6	74%	0.739	79%	0.792	S	S	*	*			trans	79	147.5	176.9	-159.1	-179.3	-177.8	-177.4	0	114	D460	K458-D460 WeakPolarHBondContact CE-OD1 3.48Å; K458-D460 WeakPolarHBondContact CE-OD2 3.37Å; K458-D460 IonicContact NZ-OD1 2.84Å; K458-D460 IonicContact NZ-OD2 3.34Å; K458-D460 PolarHBondContact NZ-OD2 2.69Å
459	G	54.2	Low	47.6	Very low	64 Å²	64	123.5 Å²	123.5	66%	0.66	80%	0.795	S	S	*	*			cis	118	158.2	2.1	0	0	0	0	0	112.1
460	D	41.5	Very low	47.8	Very low	116 Å²	116	124.2 Å²	124.2	62%	0.62	80%	0.799	S	S	*	*			cis	-139.1	-178.5	6.2	-41	-47.5	0	0	0	107.7	K458	K458-D460 WeakPolarHBondContact CE-OD1 3.48Å; K458-D460 WeakPolarHBondContact CE-OD2 3.37Å; K458-D460 IonicContact NZ-OD1 2.84Å; K458-D460 IonicContact NZ-OD2 3.34Å; K458-D460 PolarHBondContact NZ-OD2 2.69Å
461	T	43.4	Very low	48.4	Very low	141 Å²	141	124.4 Å²	124.4	87%	0.865	80%	0.801	S	S	*	*			cis	-155.6	177.7	2	-20.9	0	0	0	0	109.1
462	G	56.4	Low	48.2	Very low	61 Å²	61	121.2 Å²	121.2	63%	0.629	81%	0.805	S	S	*	*			trans	-163	175.8	163.9	0	0	0	0	0	110.9
463	L	35.3	Very low	47.2	Very low	178 Å²	178	121.5 Å²	121.5	93%	0.932	81%	0.81	S	S	*	*			trans	-145.3	159	177.8	-75.3	-179.5	0	0	0	115.1
464	P	61.4	Low	46.9	Very low	128 Å²	128	121.3 Å²	121.3	83%	0.831	81%	0.808	S	S	*	*			trans	-125.4	-173.6	-165.6	39.3	-20.6	0	0	0	116.5
465	G	59.5	Low	47	Very low	74 Å²	74	125 Å²	125	76%	0.763	81%	0.813	S	S	*	*			trans	-124.6	-161.2	-175.4	0	0	0	0	0	117.8
466	P	47.3	Very low	48	Very low	141 Å²	141	120.6 Å²	120.6	92%	0.916	81%	0.806	S	S	*	*			trans	-122.5	-172.8	-168.4	38.1	-22.4	0	0	0	118.8
467	R	49.5	Very low	47.5	Very low	252 Å²	252	120.4 Å²	120.4	95%	0.951	80%	0.804	S	S	*	*			trans	-154	166.3	-161.5	169.3	-177.2	171.1	-142.6	-0.7	111.5
468	G	50.7	Low	47	Very low	64 Å²	64	126 Å²	126	66%	0.66	81%	0.811	S	S	*	*			cis	-136.5	-128.5	6.2	0	0	0	0	0	112.2
469	P	45.4	Very low	47	Very low	135 Å²	135	126.1 Å²	126.1	88%	0.877	82%	0.819	S	S	*	*			cis	-135	-162.5	5.4	44.7	-24.3	0	0	0	115.4
470	P	61.4	Low	46.1	Very low	134 Å²	134	126.2 Å²	126.2	87%	0.87	82%	0.821	S	S	*	*			trans	-135.4	174	-169.4	44.6	-30.3	0	0	0	120.9
471	G	48.4	Very low	45.9	Very low	81 Å²	81	127.5 Å²	127.5	84%	0.835	83%	0.833	S	S	*	*			trans	142.3	151.5	165.2	0	0	0	0	0	114.2
472	A	37.3	Very low	45.9	Very low	112 Å²	112	131.9 Å²	131.9	93%	0.926	83%	0.833	S	S	*	*			cis	-147.5	-153.4	8.2	0	0	0	0	0	113.2
473	S	42.9	Very low	44.9	Very low	129 Å²	129	132.6 Å²	132.6	90%	0.902	84%	0.84	S	S	*	*			trans	-149.6	161.7	-161.1	-168.6	0	0	0	0	118.3
474	G	39.8	Very low	45.1	Very low	69 Å²	69	130.7 Å²	130.7	71%	0.711	83%	0.831	S	S	*	*			trans	90.7	156.5	168.3	0	0	0	0	0	116.9
475	E	36.8	Very low	45	Very low	195 Å²	195	131 Å²	131	91%	0.911	83%	0.833	S	S	*	*			cis	-158.8	172.1	-14.4	-115.1	-149.4	135.3	0	0	109.9
476	P	63.1	Low	43.8	Very low	118 Å²	118	131.4 Å²	131.4	77%	0.766	84%	0.837	S	S	*	*			trans	-104	164	-161.7	39.1	-37.3	0	0	0	118.4
477	G	36.2	Very low	43.7	Very low	71 Å²	71	132.3 Å²	132.3	73%	0.732	84%	0.835	S	S	*	*			trans	178.5	116.9	164.4	0	0	0	0	0	122.1
478	K	34.1	Very low	43.2	Very low	213 Å²	213	128.6 Å²	128.6	93%	0.926	83%	0.83	S	S	*	*			trans	75	154.7	142.2	-65.3	-179	178.4	175.6	0	123.1
479	N	43.3	Very low	42.9	Very low	172 Å²	172	128.9 Å²	128.9	92%	0.92	83%	0.833	S	S	*	*			trans	-75.4	154.1	-178.5	-58.4	-11.2	0	0	0	114.1
480	G	35.1	Very low	42.9	Very low	67 Å²	67	129 Å²	129	69%	0.691	83%	0.834	S	S	*	*			trans	-179.4	95.4	165.3	0	0	0	0	0	117.6
481	T	36.2	Very low	42.5	Very low	142 Å²	142	132.4 Å²	132.4	87%	0.871	83%	0.829	S	S	*	*			trans	33.2	119.7	145.5	54.7	0	0	0	0	123
482	R	43.6	Very low	42.1	Very low	234 Å²	234	131.9 Å²	131.9	88%	0.883	82%	0.824	S	S	*	*			trans	36.3	123.4	132.3	-173.7	-177.9	-175.8	170.3	3.9	120.2
483	G	35.1	Very low	42.3	Very low	75 Å²	75	134 Å²	134	77%	0.773	82%	0.815	S	S	*	*			trans	-174.8	125.9	154.5	0	0	0	0	0	114.3
484	D	39.2	Very low	42.5	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	81%	0.812	S	S	*	*			trans	-84	174.6	163.2	-37.4	-98.5	0	0	0	110.1
485	P	59.5	Low	42.5	Very low	135 Å²	135	134 Å²	134	88%	0.877	82%	0.816	S	S	*	*			cis	-122.7	-170.2	-32.8	37.5	-21.4	0	0	0	111.2
486	G	35	Very low	43	Very low	82 Å²	82	133.7 Å²	133.7	85%	0.845	82%	0.815	S	S	*	*			trans	-163.8	139.6	170.6	0	0	0	0	0	113.4
487	D	44.4	Very low	43	Very low	161 Å²	161	134 Å²	134	86%	0.861	82%	0.817	S	S	*	*			trans	-134	158	-166.7	-147.3	-20.9	0	0	0	113.3
488	M	40	Very low	43.4	Very low	173 Å²	173	133.9 Å²	133.9	85%	0.852	82%	0.816	S	S	*	*			trans	56.8	113.3	166.4	-79.7	-173.8	53.8	0	0	123.5
489	G	44.2	Very low	44.3	Very low	70 Å²	70	130.3 Å²	130.3	72%	0.722	81%	0.814	S	S	*	*				89.6	173.2	124.4	0	0	0	0	0	119.7
490	P	45.1	Very low	44.8	Very low	139 Å²	139	131.7 Å²	131.7	90%	0.903	81%	0.812	S	S	*	*			cis	-118.5	-166.6	-0	42	-29	0	0	0	114.6
491	R	53.4	Low	45.4	Very low	204 Å²	204	131.5 Å²	131.5	77%	0.77	81%	0.81	S	S	*	*			trans	-94.1	149.2	-169.1	162.4	179.2	164.1	168.9	-5.5	114.5	E493	R491-E493 IonicContact CZ-OE1 3.46Å; R491-E493 IonicContact NE-OE1 3.45Å; R491-E493 PolarHBondContact NE-OE1 2.82Å; R491-E493 IonicContact NH2-OE1 2.68Å; R491-E493 PolarHBondContact NH2-OE1 2.88Å
492	G	39.6	Very low	45.9	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	81%	0.808	S	S	*	*			trans	-130.1	158.3	158	0	0	0	0	0	110
493	E	42.8	Very low	46.5	Very low	155 Å²	155	126.7 Å²	126.7	72%	0.724	80%	0.803	S	S	*	*			trans	-107	159.4	-162.9	-53	-160.7	118.2	0	0	115.3	R491	R491-E493 IonicContact CZ-OE1 3.46Å; R491-E493 IonicContact NE-OE1 3.45Å; R491-E493 PolarHBondContact NE-OE1 2.82Å; R491-E493 IonicContact NH2-OE1 2.68Å; R491-E493 PolarHBondContact NH2-OE1 2.88Å
494	S	46.1	Very low	46.8	Very low	121 Å²	121	127 Å²	127	85%	0.846	81%	0.806	S	S	*	*			trans	-122.1	141.9	171	-65.8	0	0	0	0	110.3
495	G	40.4	Very low	47	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.4	158.9	-178.7	0	0	0	0	0	114.5
496	Q	47.2	Very low	46.7	Very low	190 Å²	190	131.8 Å²	131.8	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81.8	138.3	-172.1	-65.5	176.1	-14.4	0	0	113.4
497	P	62.8	Low	46.9	Very low	125 Å²	125	131.2 Å²	131.2	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.7	156.1	158	-20.2	33.8	0	0	0	112.4
498	G	44.8	Very low	46.3	Very low	68 Å²	68	133.7 Å²	133.7	70%	0.701	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.8	169.2	-177.5	0	0	0	0	0	115.6
499	P	51.8	Low	46.2	Very low	137 Å²	137	130.3 Å²	130.3	89%	0.89	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.7	151.7	-167.3	29.2	-36	0	0	0	114.6
500	K	55.3	Low	45.8	Very low	202 Å²	202	138.2 Å²	138.2	88%	0.878	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-85.2	135.7	171.3	179.5	-177.4	176.6	-177.7	0	109.9
501	G	46.1	Very low	46.1	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.5	152.4	177.8	0	0	0	0	0	114.4
502	D	47.3	Very low	45.7	Very low	157 Å²	157	131.1 Å²	131.1	84%	0.84	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75	152.9	-168	-73	-68.3	0	0	0	115.6
503	P	55.4	Low	45.8	Very low	118 Å²	118	134.4 Å²	134.4	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.1	167.7	-10.9	27.6	0	0	0	112.1
504	G	43.4	Very low	46.4	Very low	81 Å²	81	138.3 Å²	138.3	84%	0.835	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-61.1	136.1	173.6	0	0	0	0	0	113.1
505	R	41.3	Very low	46	Very low	245 Å²	245	135.5 Å²	135.5	93%	0.925	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-81.8	148	178.3	-77.6	-175.9	168.7	-157.4	-0.8	112.6
506	P	54.1	Low	45.8	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.8	148.6	-180	36	-34.6	0	0	0	115.2
507	G	38.3	Very low	46.5	Very low	70 Å²	70	135.6 Å²	135.6	72%	0.722	81%	0.809	S	S	*	*			trans	104.1	134.3	143	0	0	0	0	0	118.4
508	F	33.5	Very low	45.2	Very low	214 Å²	214	132.9 Å²	132.9	94%	0.939	80%	0.804	S	S	*	*				-164.1	165.8	115.8	-119	-89.4	0	0	0	111
509	S	37.6	Very low	44.9	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	82%	0.816	S	S	*	*			trans	-145.6	161	-172.3	-52.1	0	0	0	0	113.1
510	Y	36.4	Very low	44.7	Very low	235 Å²	235	144.4 Å²	144.4	92%	0.922	82%	0.817	S	S	*	*			trans	-121.7	134.3	165.1	-95.3	-82.7	0	0	0	111.1
511	P	51.3	Low	44.2	Very low	121 Å²	121	137.9 Å²	137.9	79%	0.786	81%	0.808	S	S	*	*			trans	-120.9	153.1	-174.3	40.4	-31	0	0	0	116.7
512	G	43.3	Very low	43.9	Very low	74 Å²	74	142.2 Å²	142.2	76%	0.763	82%	0.816	S	S	*	*			trans	91.9	161.4	162.3	0	0	0	0	0	115.9
513	P	43.2	Very low	44.5	Very low	140 Å²	140	140.2 Å²	140.2	91%	0.909	81%	0.811	S	S	*	*			cis	-101.9	-174.6	16	39.6	-36.1	0	0	0	115.4
514	R	55.8	Low	43.7	Very low	237 Å²	237	138 Å²	138	89%	0.894	81%	0.809	S	S	*	*			trans	-139.5	145.5	-174.8	169.8	-175.5	174.7	178.9	1.4	111.5
515	G	37.6	Very low	43.4	Very low	62 Å²	62	144.4 Å²	144.4	64%	0.639	81%	0.814	S	S	*	*			trans	166.5	149.4	162.4	0	0	0	0	0	110.6
516	D	35.3	Very low	43.6	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	82%	0.816	S	S	*	*			cis	-150.3	166.9	-15.9	-112.9	-14.4	0	0	0	109.9
517	P	61	Low	43.1	Very low	116 Å²	116	142 Å²	142	75%	0.753	81%	0.81	S	S	*	*			trans	-98.6	154.7	-154.2	36.9	-37.7	0	0	0	117.3
518	G	36.4	Very low	43.4	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	82%	0.815	S	S	*	*			trans	178.3	153	161	0	0	0	0	0	111
519	E	38.4	Very low	44.2	Very low	205 Å²	205	140.8 Å²	140.8	96%	0.958	81%	0.811	S	S	*	*			cis	-143.1	-176.2	-16.2	-80	-153.6	122	0	0	109.3
520	R	48.5	Very low	44.9	Very low	241 Å²	241	139.8 Å²	139.8	91%	0.909	82%	0.816	S	S	*	*			trans	-116.6	137.4	-170.1	178.3	-163.4	-67.9	-179.8	-1	113.5
521	G	44.2	Very low	44.8	Very low	66 Å²	66	134.8 Å²	134.8	68%	0.68	82%	0.816	S	S	*	*			trans	149.4	146.1	152.2	0	0	0	0	0	113.3
522	D	38.9	Very low	44.3	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	82%	0.823	S	S	*	*			cis	-157	159.6	-12.4	-114.3	-19.5	0	0	0	110.7
523	P	60.7	Low	44.4	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	82%	0.816	S	S	*	*			trans	-105.3	160.2	-170.4	38.9	-34.7	0	0	0	115.9
524	G	38.5	Very low	43.9	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	82%	0.816	S	S	*	*			trans	-179.5	168	162.8	0	0	0	0	0	114.1
525	K	37.8	Very low	43.1	Very low	217 Å²	217	136.9 Å²	136.9	94%	0.943	82%	0.818	S	S	*	*			cis	-156.3	171.3	-14.4	-113.5	169.2	-172.4	173.3	0	108.7
526	R	44.9	Very low	43.1	Very low	255 Å²	255	137.4 Å²	137.4	96%	0.962	82%	0.823	S	S	*	*			trans	-128.7	147	-157.4	-174.2	-172.6	-170.8	-167.9	6.2	115.2
527	G	44.5	Very low	43.2	Very low	68 Å²	68	139.8 Å²	139.8	70%	0.701	83%	0.83	S	S	*	*			trans	115	166.5	159.5	0	0	0	0	0	115
528	P	43.9	Very low	42.1	Very low	126 Å²	126	142.3 Å²	142.3	82%	0.818	83%	0.829	S	S	*	*			cis	-125.6	-178.1	10	41.9	-27.4	0	0	0	115.4
529	P	50.3	Low	42.3	Very low	132 Å²	132	142.6 Å²	142.6	86%	0.857	83%	0.831	S	S	*	*			trans	-97.9	172.9	176.7	14.9	5.6	0	0	0	114.7
530	G	51.7	Low	42.1	Very low	80 Å²	80	138.7 Å²	138.7	83%	0.825	82%	0.817	S	S	*	*			trans	-100.6	-159.9	-172	0	0	0	0	0	117.8
531	S	35	Very low	42.6	Very low	131 Å²	131	133.2 Å²	133.2	92%	0.916	81%	0.813	S	S	*	*			trans	-142.8	176.3	-169.8	61	0	0	0	0	114.2
532	R	41	Very low	42.4	Very low	249 Å²	249	133 Å²	133	94%	0.94	81%	0.811	S	S	*	*			trans	-148.1	137.2	-169.5	169.5	-174.8	173.9	178.6	0.2	113.2
533	G	45.4	Very low	42.3	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	82%	0.817	S	S	*	*			trans	101.7	127.7	150	0	0	0	0	0	118.1
534	D	33	Very low	41.8	Very low	169 Å²	169	138.6 Å²	138.6	90%	0.904	82%	0.824	S	S	*	*				176	176.3	110.2	-88.2	-7.5	0	0	0	112.2
535	C	37.7	Very low	41.8	Very low	137 Å²	137	138.9 Å²	138.9	93%	0.926	83%	0.827	S	S	*	*			trans	-131.4	153.5	-159.3	-63.7	0	0	0	0	116
536	G	38.6	Very low	41.9	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	82%	0.823	S	S	*	*			trans	112.8	157.7	164.8	0	0	0	0	0	115
537	Q	36.6	Very low	42.4	Very low	202 Å²	202	129.6 Å²	129.6	94%	0.944	82%	0.819	S	S	*	*			cis	-144.5	179.3	1.7	-70.3	-165.4	14.2	0	0	113.1
538	K	39	Very low	42.3	Very low	169 Å²	169	129.9 Å²	129.9	74%	0.735	82%	0.822	S	S	*	*			trans	-62.5	154.7	-176.8	-171	-167.2	-171.8	-142.9	0	116.1	D540	K538-D540 WeakPolarHBondContact CE-OD1 3.29Å; K538-D540 WeakPolarHBondContact CE-OD2 3.37Å; K538-D540 IonicContact NZ-OD1 2.62Å; K538-D540 PolarHBondContact NZ-OD1 3.26Å; K538-D540 IonicContact NZ-OD2 3.42Å; K538-D540 PolarHBondContact NZ-OD2 2.91Å
539	G	38.7	Very low	42.2	Very low	74 Å²	74	132.8 Å²	132.8	76%	0.763	83%	0.825	S	S	*	*			trans	-151.6	139.9	159.9	0	0	0	0	0	112.3
540	D	34.4	Very low	42.5	Very low	124 Å²	124	133 Å²	133	66%	0.663	83%	0.827	S	S	*	*			trans	-105	169.5	-168.9	-75.3	-56.3	0	0	0	113.9	K538	K538-D540 WeakPolarHBondContact CE-OD1 3.29Å; K538-D540 WeakPolarHBondContact CE-OD2 3.37Å; K538-D540 IonicContact NZ-OD1 2.62Å; K538-D540 PolarHBondContact NZ-OD1 3.26Å; K538-D540 IonicContact NZ-OD2 3.42Å; K538-D540 PolarHBondContact NZ-OD2 2.91Å
541	P	58.9	Low	41.8	Very low	125 Å²	125	132.7 Å²	132.7	81%	0.812	82%	0.824	S	S	*	*			trans	-112.7	163.1	-150.1	40.7	-36	0	0	0	118.5
542	G	41.6	Very low	42.1	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	82%	0.822	S	S	*	*			trans	115	134.5	130.8	0	0	0	0	0	119.2
543	N	36.9	Very low	42.8	Very low	175 Å²	175	129.9 Å²	129.9	94%	0.936	82%	0.818	S	S	*	*				-175.3	169.8	116.6	-100.5	-63.9	0	0	0	113.6
544	K	49.8	Very low	42.6	Very low	211 Å²	211	130.2 Å²	130.2	92%	0.917	82%	0.821	S	S	*	*			trans	-81.7	153.8	-174.4	-73.3	-179.7	174.8	178.2	0	114.6
545	G	37.3	Very low	43.2	Very low	75 Å²	75	128.3 Å²	128.3	77%	0.773	82%	0.818	S	S	*	*			trans	-138.4	166.5	159.7	0	0	0	0	0	110.9
546	T	40.6	Very low	43.5	Very low	140 Å²	140	128.7 Å²	128.7	86%	0.859	82%	0.817	S	S	*	*			trans	-112.5	165.9	-169	45.1	0	0	0	0	114.5
547	P	55.8	Low	43.6	Very low	137 Å²	137	128.2 Å²	128.2	89%	0.89	81%	0.811	S	S	*	*			trans	-75.8	153.7	-173.5	-16.4	32.3	0	0	0	116.4
548	G	42.3	Very low	44	Very low	74 Å²	74	127.5 Å²	127.5	76%	0.763	81%	0.808	S	S	*	*			trans	152.8	149.9	176.9	0	0	0	0	0	108.5
549	E	40.6	Very low	44.6	Very low	188 Å²	188	125.6 Å²	125.6	88%	0.879	81%	0.813	S	S	*	*			cis	-142.5	168.8	0.4	-75.1	-167.7	122.6	0	0	109.6
550	P	56.8	Low	44.9	Very low	136 Å²	136	125.6 Å²	125.6	88%	0.883	81%	0.813	S	S	*	*			trans	-89.1	124.8	-178.9	33.1	-33.5	0	0	0	115.3
551	G	38.4	Very low	45.3	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	83%	0.826	S	S	*	*			trans	167	154.3	172.6	0	0	0	0	0	109.4
552	E	40.4	Very low	44.7	Very low	187 Å²	187	134 Å²	134	87%	0.874	83%	0.831	S	S	*	*			cis	-130.8	168.5	4.9	-59	-179.6	122.3	0	0	110.7	G554	E552-G554 PolarHBondContact O-N 2.95Å
553	P	55.2	Low	45.1	Very low	134 Å²	134	133.6 Å²	133.6	87%	0.87	83%	0.828	S	S	*	*			trans	-72.1	112.9	174.5	-15.6	31.3	0	0	0	112.9
554	G	41.7	Very low	45.6	Very low	66 Å²	66	131.5 Å²	131.5	68%	0.68	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.4	152.8	173.4	0	0	0	0	0	113.7	E552	E552-G554 PolarHBondContact O-N 2.95Å
555	P	45.7	Very low	45.7	Very low	130 Å²	130	133 Å²	133	84%	0.844	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72	159	-175.3	29.9	-36	0	0	0	113.9	G557	P555-G557 PolarHBondContact O-N 2.87Å
556	T	43.3	Very low	46.1	Very low	145 Å²	145	132.6 Å²	132.6	89%	0.89	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-57.6	121.6	-179.2	-49.2	0	0	0	0	112.5
557	G	41.3	Very low	47	Very low	63 Å²	63	129.1 Å²	129.1	65%	0.649	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-71.8	144.3	171.5	0	0	0	0	0	112.8	P555	P555-G557 PolarHBondContact O-N 2.87Å
558	E	44.2	Very low	47.1	Very low	187 Å²	187	128.9 Å²	128.9	87%	0.874	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-68.7	144	177.6	-61	-176	127.7	0	0	111.6	G560	E558-G560 PolarHBondContact O-N 3.37Å
559	P	52.8	Low	47.4	Very low	130 Å²	130	128.4 Å²	128.4	84%	0.844	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-61.3	125.9	173.1	-22.9	34.3	0	0	0	111.7
560	G	44.5	Very low	47.7	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-59.9	147.4	-179.2	0	0	0	0	0	113.5	E558 R562	E558-G560 PolarHBondContact O-N 3.37Å; G560-R562 PolarHBondContact O-N 2.88Å
561	L	42.1	Very low	47.6	Very low	178 Å²	178	132.3 Å²	132.3	93%	0.932	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-56.1	131	-179.9	-69.6	172.2	0	0	0	111.5	G563	L561-G563 PolarHBondContact O-N 3.47Å
562	R	47.9	Very low	47.9	Very low	246 Å²	246	132.2 Å²	132.2	93%	0.928	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.8	176.7	-172.2	178.8	-172.4	169.1	3.5	109.6	G560	G560-R562 PolarHBondContact O-N 2.88Å
563	G	48.4	Very low	48	Very low	56 Å²	56	130.9 Å²	130.9	58%	0.577	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-56.1	150.3	175.6	0	0	0	0	0	112.2	L561	L561-G563 PolarHBondContact O-N 3.47Å
564	P	47.6	Very low	47.9	Very low	130 Å²	130	130.4 Å²	130.4	84%	0.844	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-59.2	145	-177.4	25.1	-34.1	0	0	0	111.3	G566	P564-G566 PolarHBondContact O-N 2.97Å
565	R	53.1	Low	47.9	Very low	243 Å²	243	130.2 Å²	130.2	92%	0.917	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-57.4	127.9	174.1	-175.5	-179.6	-179.6	172.1	0.5	108.6	G567	R565-G567 PolarHBondContact O-N 3.26Å
566	G	46.3	Very low	47.6	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-53.7	138.8	171	0	0	0	0	0	110.1	P564	P564-G566 PolarHBondContact O-N 2.97Å
567	G	57.8	Low	47.5	Very low	66 Å²	66	132.8 Å²	132.8	68%	0.68	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60	160.7	177.9	0	0	0	0	0	111.6	R565	R565-G567 PolarHBondContact O-N 3.26Å
568	P	59.6	Low	47.3	Very low	133 Å²	133	132.8 Å²	132.8	86%	0.864	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-50.2	150.7	165.9	-23.6	34.4	0	0	0	110.9
569	G	47.9	Very low	47.1	Very low	64 Å²	64	131.5 Å²	131.5	66%	0.66	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-57	152.7	163.8	0	0	0	0	0	109.6	D571	G569-D571 PolarHBondContact O-N 3.46Å
570	R	46.5	Very low	46.7	Very low	250 Å²	250	131.2 Å²	131.2	94%	0.943	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-59.8	138.2	167.8	-76.7	-178	168.9	-173.7	-5.5	108.5
571	D	55.6	Low	46.6	Very low	156 Å²	156	130.8 Å²	130.8	83%	0.834	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-56	145.1	167.2	-50.9	-69.8	0	0	0	109.2	G569	G569-D571 PolarHBondContact O-N 3.46Å
572	G	44.3	Very low	46.8	Very low	72 Å²	72	128.3 Å²	128.3	74%	0.742	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.3	147.8	176.2	0	0	0	0	0	110.9
573	D	42.7	Very low	46.7	Very low	159 Å²	159	120.2 Å²	120.2	85%	0.85	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-56.3	139.9	171.9	-61.8	-69.1	0	0	0	109.7	G575	D573-G575 PolarHBondContact O-N 3.22Å
574	P	52	Low	46.5	Very low	124 Å²	124	125.6 Å²	125.6	81%	0.805	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-54	134.8	179	-26.9	35	0	0	0	111.7
575	G	41.4	Very low	46.4	Very low	61 Å²	61	122.9 Å²	122.9	63%	0.629	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-57.6	153.1	172.5	0	0	0	0	0	111.2	D573 E577	D573-G575 PolarHBondContact O-N 3.22Å; G575-E577 PolarHBondContact O-N 3.09Å
576	P	40.4	Very low	46	Very low	132 Å²	132	114.8 Å²	114.8	86%	0.857	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.2	139.1	178.2	25.1	-34.2	0	0	0	110.5	G578	P576-G578 PolarHBondContact O-N 3.13Å
577	E	40.7	Very low	46.4	Very low	197 Å²	197	115 Å²	115	92%	0.921	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-58.8	121.4	177.6	-169.4	167.4	-156.6	0	0	109.2	G575	G575-E577 PolarHBondContact O-N 3.09Å
578	G	37.6	Very low	45.9	Very low	63 Å²	63	116.1 Å²	116.1	65%	0.649	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-66.8	149.8	-174.3	0	0	0	0	0	112.2	P576	P576-G578 PolarHBondContact O-N 3.13Å
579	D	40.4	Very low	45.3	Very low	160 Å²	160	111.9 Å²	111.9	86%	0.856	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-49.8	137	176.5	-79.9	-46	0	0	0	111	G581	D579-G581 PolarHBondContact O-N 2.98Å
580	P	44.7	Very low	45.2	Very low	124 Å²	124	114.8 Å²	114.8	81%	0.805	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-52.8	124.4	-179.4	-28.4	35.3	0	0	0	112
581	G	42.2	Very low	45.3	Very low	65 Å²	65	106 Å²	106	67%	0.67	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-56.4	151	175.2	0	0	0	0	0	111.6	D579 T583	D579-G581 PolarHBondContact O-N 2.98Å; G581-T583 PolarHBondContact O-N 2.9Å
582	L	45.1	Very low	45	Very low	127 Å²	127	104.4 Å²	104.4	67%	0.665	62%	0.618	S	S	*	*			trans	-43.3	128	179.3	-75.1	169.9	0	0	0	110.9	D586 V587	L582-D586 HydrophobicContact CB-CB 4.28Å; L582-D586 HydrophobicContact CD2-CB 4.04Å; L582-V587 HydrophobicContact CB-CG2 4.34Å
583	T	46.2	Very low	44.9	Very low	76 Å²	76	109 Å²	109	47%	0.466	62%	0.62	S	S	.	*			trans	-67.2	158.8	-174	71.7	0	0	0	0	110.2	G581 C585 D586 V587	G581-T583 PolarHBondContact O-N 2.9Å; T583-C585 PolarHBondContact O-N 2.92Å; T583-C585 VanDerWaalsContact O-N 3.09Å; T583-C585 PolarHBondContact OG1-N 2.71Å; T583-D586 WeakPolarHBondContact CB-OD2 3.45Å; T583-D586 PolarHBondContact N-OD2 2.88Å; T583-D586 PolarHBondContact O-N 2.86Å; T583-D586 VanDerWaalsContact OG1-CG 3.29Å; T583-D586 PolarHBondContact OG1-N 2.84Å; T583-D586 PolarHBondContact OG1-OD2 3.48Å; T583-V587 PolarHBondContact O-N 3.15Å; T583-V587 VanDerWaalsContact O-N 3.07Å
584	E	45.3	Very low	44.8	Very low	169 Å²	169	105.3 Å²	105.3	79%	0.79	60%	0.604	S	S	*	*	H	α-helix	trans	-56.4	-29.8	176.3	-156.9	164	-151.6	0	0	111.4	M588	E584-M588 VanDerWaalsContact O-CB 3.26Å; E584-M588 WeakPolarHBondContact O-CB 3.4Å; E584-M588 WeakPolarHBondContact O-CG 3.44Å; E584-M588 PolarHBondContact O-N 2.77Å
585	C	43.9	Very low	44.5	Very low	73 Å²	73	102.6 Å²	102.6	49%	0.493	59%	0.587	S	S	.	*	H	α-helix	trans	-65.7	-39.1	170.9	-73.1	0	0	0	0	114	T583 N589	T583-C585 PolarHBondContact O-N 2.92Å; T583-C585 VanDerWaalsContact O-N 3.09Å; T583-C585 PolarHBondContact OG1-N 2.71Å; C585-N589 WeakPolarHBondContact O-CB 3.49Å; C585-N589 PolarHBondContact O-N 3.18Å; C585-N589 PolarHBondContact O-ND2 2.81Å
586	D	46.2	Very low	44.5	Very low	73 Å²	73	103.5 Å²	103.5	39%	0.39	60%	0.596	S	S	.	*	H	α-helix	trans	-71.2	-42.4	179.5	-58.3	-55.7	0	0	0	110.9	L582 T583 N589 Y590	L582-D586 HydrophobicContact CB-CB 4.28Å; L582-D586 HydrophobicContact CD2-CB 4.04Å; T583-D586 WeakPolarHBondContact CB-OD2 3.45Å; T583-D586 PolarHBondContact N-OD2 2.88Å; T583-D586 PolarHBondContact O-N 2.86Å; T583-D586 VanDerWaalsContact OG1-CG 3.29Å; T583-D586 PolarHBondContact OG1-N 2.84Å; T583-D586 PolarHBondContact OG1-OD2 3.48Å; D586-N589 PolarHBondContact O-N 3.42Å; D586-Y590 PolarHBondContact O-N 2.91Å
587	V	54.1	Low	44.4	Very low	70 Å²	70	100 Å²	100	42%	0.424	58%	0.575	S	S	.	*	H	α-helix	trans	-60.5	-45.3	172.8	179.1	0	0	0	0	110.7	L582 T583 N589 Y590 I591	L582-V587 HydrophobicContact CB-CG2 4.34Å; T583-V587 PolarHBondContact O-N 3.15Å; T583-V587 VanDerWaalsContact O-N 3.07Å; V587-N589 PolarHBondContact O-N 2.86Å; V587-Y590 PolarHBondContact O-N 2.91Å; V587-I591 HydrophobicContact CG1-CD1 3.97Å; V587-I591 VanDerWaalsContact O-CG1 3.31Å; V587-I591 WeakPolarHBondContact O-CG1 3.41Å; V587-I591 PolarHBondContact O-N 3.17Å
588	M	46.6	Very low	44.7	Very low	91 Å²	91	93 Å²	93	45%	0.448	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-33.8	178	-73.8	-67.7	-74.1	0	0	113.3	E584 I591 R592	E584-M588 VanDerWaalsContact O-CB 3.26Å; E584-M588 WeakPolarHBondContact O-CB 3.4Å; E584-M588 WeakPolarHBondContact O-CG 3.44Å; E584-M588 PolarHBondContact O-N 2.77Å; M588-I591 HydrophobicContact SD-CD1 4.41Å; M588-R592 WeakPolarHBondContact O-CG 3.43Å; M588-R592 PolarHBondContact O-N 3.05Å
589	N	47	Very low	45	Very low	44 Å²	44	94.8 Å²	94.8	24%	0.235	54%	0.541	C	S	.	.	H	α-helix	trans	-69.1	-41.1	172.9	-71.8	-33.5	0	0	0	111.6	C585 D586 V587 I591 R592 E593	C585-N589 WeakPolarHBondContact O-CB 3.49Å; C585-N589 PolarHBondContact O-N 3.18Å; C585-N589 PolarHBondContact O-ND2 2.81Å; D586-N589 PolarHBondContact O-N 3.42Å; V587-N589 PolarHBondContact O-N 2.86Å; N589-I591 VanDerWaalsContact C-N 3.32Å; N589-I591 PolarHBondContact O-N 2.8Å; N589-R592 PolarHBondContact O-N 2.82Å; N589-R592 PolarHBondContact OD1-NH1 2.9Å; N589-E593 PolarHBondContact O-N 2.99Å
590	Y	46.6	Very low	45.6	Very low	125 Å²	125	89.1 Å²	89.1	49%	0.49	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-41.8	173.9	-172.9	-107.8	0	0	0	111.9	D586 V587 E593 T594	D586-Y590 PolarHBondContact O-N 2.91Å; V587-Y590 PolarHBondContact O-N 2.91Å; Y590-E593 PolarHBondContact O-N 3.15Å; Y590-T594 HydrophobicContact CD2-CG2 4.06Å; Y590-T594 HydrophobicContact CE1-CG2 4.3Å; Y590-T594 HydrophobicContact CE2-CG2 3.7Å; Y590-T594 HydrophobicContact CG-CG2 4.5Å; Y590-T594 WeakPolarHBondContact O-CB 3.43Å; Y590-T594 PolarHBondContact O-N 3.11Å; Y590-T594 PolarHBondContact O-OG1 2.87Å
591	I	48	Very low	46.1	Very low	64 Å²	64	86.3 Å²	86.3	33%	0.328	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-43.6	174.5	-69.5	166.2	0	0	0	111.2	V587 M588 N589 E593 C595	V587-I591 HydrophobicContact CG1-CD1 3.97Å; V587-I591 VanDerWaalsContact O-CG1 3.31Å; V587-I591 WeakPolarHBondContact O-CG1 3.41Å; V587-I591 PolarHBondContact O-N 3.17Å; M588-I591 HydrophobicContact SD-CD1 4.41Å; N589-I591 VanDerWaalsContact C-N 3.32Å; N589-I591 PolarHBondContact O-N 2.8Å; I591-E593 VanDerWaalsContact C-N 3.33Å; I591-E593 PolarHBondContact O-N 3.45Å; I591-C595 HydrophobicContact CG2-CB 4.36Å; I591-C595 WeakPolarHBondContact O-CA 3.32Å; I591-C595 VanDerWaalsContact O-CB 3.29Å; I591-C595 WeakPolarHBondContact O-CB 3.26Å; I591-C595 PolarHBondContact O-N 3.22Å
592	R	48.8	Very low	47	Very low	123 Å²	123	87.1 Å²	87.1	46%	0.464	48%	0.475	S	S	.	.	H	α-helix	trans	-61.5	-36.6	176	-77.1	175.1	-178.5	132.5	2.7	113.8	M588 N589 D599	M588-R592 WeakPolarHBondContact O-CG 3.43Å; M588-R592 PolarHBondContact O-N 3.05Å; N589-R592 PolarHBondContact O-N 2.82Å; N589-R592 PolarHBondContact OD1-NH1 2.9Å; R592-D599 IonicContact NE-OD2 3.22Å
593	E	42.5	Very low	47.9	Very low	168 Å²	168	86.6 Å²	86.6	79%	0.785	46%	0.464	S	S	*	.	H	α-helix	trans	-87.5	-24.5	-175.3	-69.4	-174.6	179.5	0	0	113.4	N589 Y590 I591	N589-E593 PolarHBondContact O-N 2.99Å; Y590-E593 PolarHBondContact O-N 3.15Å; I591-E593 VanDerWaalsContact C-N 3.33Å; I591-E593 PolarHBondContact O-N 3.45Å
594	T	42.1	Very low	48.9	Very low	82 Å²	82	83.6 Å²	83.6	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-107.1	-34.9	-177.6	60.6	0	0	0	0	114.6	Y590	Y590-T594 HydrophobicContact CD2-CG2 4.06Å; Y590-T594 HydrophobicContact CE1-CG2 4.3Å; Y590-T594 HydrophobicContact CE2-CG2 3.7Å; Y590-T594 HydrophobicContact CG-CG2 4.5Å; Y590-T594 WeakPolarHBondContact O-CB 3.43Å; Y590-T594 PolarHBondContact O-N 3.11Å; Y590-T594 PolarHBondContact O-OG1 2.87Å
595	C	44	Very low	49.9	Very low	68 Å²	68	78 Å²	78	46%	0.459	43%	0.433	S	S	.	.	S	Bend	trans	-89.2	132.2	172.3	-65.3	0	0	0	0	109.9	I591 C597	I591-C595 HydrophobicContact CG2-CB 4.36Å; I591-C595 WeakPolarHBondContact O-CA 3.32Å; I591-C595 VanDerWaalsContact O-CB 3.29Å; I591-C595 WeakPolarHBondContact O-CB 3.26Å; I591-C595 PolarHBondContact O-N 3.22Å; C595-C597 PolarHBondContact O-N 2.87Å
596	G	41.2	Very low	51.3	Low	80 Å²	80	75.7 Å²	75.7	83%	0.825	42%	0.42	S	S	*	.			trans	-71.3	57.5	168.7	0	0	0	0	0	112.2
597	C	40.2	Very low	52.8	Low	59 Å²	59	73.2 Å²	73.2	40%	0.399	41%	0.407	S	S	.	.			trans	-61	145	178.2	-77	0	0	0	0	110.7	C595 D599	C595-C597 PolarHBondContact O-N 2.87Å; C597-D599 PolarHBondContact O-N 3.37Å
598	C	45.3	Very low	54.4	Low	49 Å²	49	70 Å²	70	33%	0.331	39%	0.387	S	S	.	.			trans	-78.8	45.8	172.8	-55.5	0	0	0	0	111.5	C600 C812	C598-C600 PolarHBondContact O-N 3.04Å; C598-C812 HydrophobicContact CB-CB 3.9Å; C598-C812 WeakPolarHBondContact CB-SG 3.49Å; C598-C812 WeakPolarHBondContact SG-CB 3.49Å; C598-C812 CovalentContact SG-SG 2.03Å; C598-C812 PolarHBondContact SG-SG 2.85Å
599	D	45.2	Very low	56.4	Low	100 Å²	100	65.6 Å²	65.6	54%	0.535	37%	0.365	S	S	.	.			trans	-64.2	100.1	167.2	-91.1	16.4	0	0	0	106.8	R592 C597 E601	R592-D599 IonicContact NE-OD2 3.22Å; C597-D599 PolarHBondContact O-N 3.37Å; D599-E601 PolarHBondContact O-N 3.14Å; D599-E601 VanDerWaalsContact O-N 3.09Å
600	C	51.9	Low	58.6	Low	42 Å²	42	63.5 Å²	63.5	28%	0.284	35%	0.354	S	S	.	.			trans	-66.9	111.4	177.1	-55.8	0	0	0	0	108.8	C598 K602 I805 I806 C807	C598-C600 PolarHBondContact O-N 3.04Å; C600-K602 PolarHBondContact O-N 3.26Å; C600-K602 VanDerWaalsContact O-N 3.13Å; C600-I805 HydrophobicContact CB-CG2 3.32Å; C600-I806 CarbonylContact C-O 3.55Å; C600-I806 WeakPolarHBondContact CA-O 3.48Å; C600-C807 HydrophobicContact CB-CB 3.9Å; C600-C807 WeakPolarHBondContact CB-SG 3.49Å; C600-C807 VanDerWaalsContact SG-CA 3.51Å; C600-C807 WeakPolarHBondContact SG-CB 3.48Å; C600-C807 CovalentContact SG-SG 2.04Å; C600-C807 PolarHBondContact SG-SG 2.95Å
601	E	56.3	Low	60.8	Low	65 Å²	65	57.6 Å²	57.6	30%	0.304	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	116.8	-170.3	-165.6	-170.5	148.7	0	0	109.8	D599 R603 I806	D599-E601 PolarHBondContact O-N 3.14Å; D599-E601 VanDerWaalsContact O-N 3.09Å; E601-R603 VanDerWaalsContact C-N 3.28Å; E601-R603 HydrophobicContact CB-CG 4.33Å; E601-R603 HydrophobicContact CG-CG 3.99Å; E601-R603 PolarHBondContact O-N 3.1Å; E601-R603 IonicContact OE1-CZ 2.84Å; E601-R603 IonicContact OE1-NE 3.7Å; E601-R603 PolarHBondContact OE1-NE 2.78Å; E601-R603 IonicContact OE1-NH2 2.86Å; E601-R603 IonicContact OE2-CZ 3.24Å; E601-R603 VanDerWaalsContact OE2-CZ 3.26Å; E601-R603 IonicContact OE2-NE 3.55Å; E601-R603 PolarHBondContact OE2-NE 2.6Å; E601-R603 IonicContact OE2-NH2 2.78Å; E601-R603 PolarHBondContact OE2-NH2 2.87Å; E601-I806 PolarHBondContact N-O 2.72Å; E601-I806 PolarHBondContact O-N 3.01Å
602	K	61.4	Low	63.1	Low	82 Å²	82	54.5 Å²	54.5	36%	0.357	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	84.1	173.4	-71.5	-180	179.6	173.9	0	109.1	C600 C604 E796 P803	C600-K602 PolarHBondContact O-N 3.26Å; C600-K602 VanDerWaalsContact O-N 3.13Å; K602-C604 PolarHBondContact O-N 3.04Å; K602-E796 WeakPolarHBondContact CD-OE1 3.44Å; K602-E796 WeakPolarHBondContact CE-OE1 3.48Å; K602-E796 IonicContact NZ-OE1 2.72Å; K602-E796 PolarHBondContact NZ-OE1 3.49Å; K602-E796 IonicContact NZ-OE2 3.6Å; K602-P803 HydrophobicContact CB-CB 4.35Å
603	R	64	Low	65.2	Low	116 Å²	116	48.7 Å²	48.7	44%	0.438	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	96.9	176.4	-66.6	-147.3	178.6	154	7.6	110.4	E601 V804 I806	E601-R603 VanDerWaalsContact C-N 3.28Å; E601-R603 HydrophobicContact CB-CG 4.33Å; E601-R603 HydrophobicContact CG-CG 3.99Å; E601-R603 PolarHBondContact O-N 3.1Å; E601-R603 IonicContact OE1-CZ 2.84Å; E601-R603 IonicContact OE1-NE 3.7Å; E601-R603 PolarHBondContact OE1-NE 2.78Å; E601-R603 IonicContact OE1-NH2 2.86Å; E601-R603 IonicContact OE2-CZ 3.24Å; E601-R603 VanDerWaalsContact OE2-CZ 3.26Å; E601-R603 IonicContact OE2-NE 3.55Å; E601-R603 PolarHBondContact OE2-NE 2.6Å; E601-R603 IonicContact OE2-NH2 2.78Å; E601-R603 PolarHBondContact OE2-NH2 2.87Å; R603-V804 WeakPolarHBondContact CB-O 3.37Å; R603-V804 PolarHBondContact N-O 3.07Å; R603-V804 WeakPolarHBondContact O-CA 3.21Å; R603-V804 WeakPolarHBondContact O-CB 3.09Å; R603-V804 PolarHBondContact O-N 2.82Å; R603-I806 HydrophobicContact CB-CD1 4.35Å; R603-I806 HydrophobicContact CB-CG1 4.5Å; R603-I806 HydrophobicContact CG-CD1 4.1Å; R603-I806 HydrophobicContact CG-CG1 4.33Å
604	C	66.5	Low	67.6	Low	13 Å²	13	40.7 Å²	40.7	9%	0.088	26%	0.256	C	S	.	.			trans	-65.9	166.4	164.1	-55.7	0	0	0	0	110.8	K602 L607 C800	K602-C604 PolarHBondContact O-N 3.04Å; C604-L607 HydrophobicContact CB-CD1 3.43Å; C604-L607 VanDerWaalsContact CB-CD1 3.43Å; C604-L607 HydrophobicContact CB-CG 3.84Å; C604-C800 HydrophobicContact CB-CB 4.13Å; C604-C800 WeakPolarHBondContact CB-SG 3.44Å; C604-C800 WeakPolarHBondContact SG-CB 3.49Å; C604-C800 CovalentContact SG-SG 2.03Å; C604-C800 PolarHBondContact SG-SG 2.95Å
605	G	65.9	Low	70	Confident	50 Å²	50	36.8 Å²	36.8	52%	0.515	23%	0.232	S	C	.	.	S	Bend	trans	-68.5	-159.8	172.7	0	0	0	0	0	113.3	L607	G605-L607 VanDerWaalsContact C-N 3.3Å; G605-L607 PolarHBondContact O-N 2.75Å
606	A	72.9	Confident	72.2	Confident	26 Å²	26	33.5 Å²	33.5	22%	0.215	21%	0.21	C	C	.	.	S	Bend	trans	-69.4	85.9	170.6	0	0	0	0	0	110.5	A716	A606-A716 HydrophobicContact CB-CB 4.09Å; A606-A716 WeakPolarHBondContact O-CB 2.97Å
607	L	78.4	Confident	74.4	Confident	21 Å²	21	36.3 Å²	36.3	11%	0.11	20%	0.201	C	C	.	.			trans	-89.1	123.2	176.4	-65.7	-174.5	0	0	0	111.4	C604 G605 I609 T651 R652 R713 L799 C800	C604-L607 HydrophobicContact CB-CD1 3.43Å; C604-L607 VanDerWaalsContact CB-CD1 3.43Å; C604-L607 HydrophobicContact CB-CG 3.84Å; G605-L607 VanDerWaalsContact C-N 3.3Å; G605-L607 PolarHBondContact O-N 2.75Å; L607-I609 HydrophobicContact CB-CG1 4.38Å; L607-I609 HydrophobicContact CD1-CD1 4.44Å; L607-T651 HydrophobicContact CB-CG2 4.24Å; L607-T651 CarbonylContact O-C 3.49Å; L607-T651 WeakPolarHBondContact O-CA 3.27Å; L607-R652 PolarHBondContact O-N 3Å; L607-R713 VanDerWaalsContact C-NH2 3.33Å; L607-R713 PolarHBondContact O-NH2 3.43Å; L607-L799 WeakPolarHBondContact CD1-O 3.38Å; L607-C800 HydrophobicContact CD1-CB 4.16Å
608	D	86.9	Confident	76.5	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.4	164.4	-71.7	-12.1	0	0	0	107.2	R652 L669 R713 V718 T719	D608-R652 IonicContact OD1-CZ 3.26Å; D608-R652 IonicContact OD1-NE 3.51Å; D608-R652 PolarHBondContact OD1-NE 2.68Å; D608-R652 IonicContact OD1-NH2 3.18Å; D608-R652 PolarHBondContact OD1-NH2 2.79Å; D608-R652 IonicContact OD2-CZ 3.9Å; D608-R652 IonicContact OD2-NE 2.74Å; D608-R652 IonicContact OD2-NH2 3.93Å; D608-R652 PolarHBondContact OD2-NH2 3.01Å; D608-L669 HydrophobicContact CB-CD2 4.27Å; D608-R713 IonicContact OD1-CZ 3.86Å; D608-R713 VanDerWaalsContact OD1-CZ 3.25Å; D608-R713 IonicContact OD1-NE 3.57Å; D608-R713 PolarHBondContact OD1-NE 3.45Å; D608-R713 IonicContact OD1-NH2 2.69Å; D608-R713 PolarHBondContact OD1-NH2 2.95Å; D608-R713 PolarHBondContact OD2-N 3.02Å; D608-R713 IonicContact OD2-NE 3.95Å; D608-V718 HydrophobicContact CB-CB 4.39Å; D608-V718 HydrophobicContact CB-CG1 4.29Å; D608-V718 HydrophobicContact CB-CG2 3.94Å; D608-V718 CarbonylContact O-C 3.13Å; D608-V718 VanDerWaalsContact O-CA 3.28Å; D608-V718 WeakPolarHBondContact O-CA 3.41Å; D608-T719 PolarHBondContact O-N 2.98Å
609	I	89.4	Confident	78.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.2	-176.3	-56.9	175.8	0	0	0	109.3	L607 F611 I635 L638 T651 R652 V653 G654 T719 L799	L607-I609 HydrophobicContact CB-CG1 4.38Å; L607-I609 HydrophobicContact CD1-CD1 4.44Å; I609-F611 HydrophobicContact CG2-CD2 4.17Å; I609-F611 HydrophobicContact CG2-CE2 3.69Å; I609-F611 HydrophobicContact CG2-CZ 4.04Å; I609-I635 HydrophobicContact CD1-CD1 4.06Å; I609-L638 HydrophobicContact CD1-CD1 3.63Å; I609-T651 HydrophobicContact CD1-CG2 3.82Å; I609-T651 HydrophobicContact CG1-CG2 4.29Å; I609-R652 PolarHBondContact N-O 2.87Å; I609-V653 CarbonylContact O-C 3.55Å; I609-V653 WeakPolarHBondContact O-CA 3.47Å; I609-G654 PolarHBondContact O-N 3.03Å; I609-T719 WeakPolarHBondContact CA-O 3.21Å; I609-L799 HydrophobicContact CD1-CD2 4.33Å; I609-L799 HydrophobicContact CG2-CD2 4.24Å
610	V	92.4	Very high	80.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.3	173.8	-178.7	0	0	0	0	109.6	V612 G654 V656 L669 L707 I708 V718 T719 V720 V721	V610-V612 HydrophobicContact CG1-CG2 4.36Å; V610-G654 WeakPolarHBondContact CA-O 3.38Å; V610-V656 HydrophobicContact CG1-CG2 4.38Å; V610-L669 HydrophobicContact CG2-CD1 3.79Å; V610-L669 HydrophobicContact CG2-CD2 4.16Å; V610-L669 HydrophobicContact CG2-CG 4.07Å; V610-L707 HydrophobicContact CG1-CD2 4.15Å; V610-I708 HydrophobicContact CG2-CG1 4.15Å; V610-V718 HydrophobicContact CG2-CG1 3.99Å; V610-T719 PolarHBondContact N-O 2.9Å; V610-V720 HydrophobicContact CB-CG2 4.44Å; V610-V720 CarbonylContact O-C 3.18Å; V610-V720 VanDerWaalsContact O-CA 3.29Å; V610-V720 WeakPolarHBondContact O-CA 3.25Å; V610-V721 PolarHBondContact O-N 3.23Å
611	F	94.4	Very high	82	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	134.3	168.1	-64.7	-88.3	0	0	0	109.6	I609 I613 F630 V631 T634 I635 V653 G654 V655 V656 V721	I609-F611 HydrophobicContact CG2-CD2 4.17Å; I609-F611 HydrophobicContact CG2-CE2 3.69Å; I609-F611 HydrophobicContact CG2-CZ 4.04Å; F611-I613 HydrophobicContact CB-CG2 4.06Å; F611-F630 HydrophobicContact CE1-CE1 4.19Å; F611-V631 HydrophobicContact CB-CG2 4.02Å; F611-V631 HydrophobicContact CD1-CG2 3.79Å; F611-V631 HydrophobicContact CD2-CG1 3.8Å; F611-V631 HydrophobicContact CD2-CG2 4.26Å; F611-V631 HydrophobicContact CE1-CG2 4.3Å; F611-V631 HydrophobicContact CE2-CG1 4.06Å; F611-V631 HydrophobicContact CG-CG1 4.15Å; F611-V631 HydrophobicContact CG-CG2 3.76Å; F611-T634 HydrophobicContact CZ-CG2 4.05Å; F611-I635 HydrophobicContact CE2-CD1 3.86Å; F611-I635 HydrophobicContact CE2-CG1 3.82Å; F611-I635 HydrophobicContact CZ-CD1 4.2Å; F611-I635 HydrophobicContact CZ-CG1 4.25Å; F611-V653 HydrophobicContact CD2-CG1 3.89Å; F611-V653 HydrophobicContact CE2-CG1 3.85Å; F611-G654 PolarHBondContact N-O 3.06Å; F611-V655 HydrophobicContact CB-CG1 4.45Å; F611-V655 HydrophobicContact CB-CG2 4.47Å; F611-V655 CarbonylContact O-C 3.42Å; F611-V655 WeakPolarHBondContact O-CA 3.28Å; F611-V656 PolarHBondContact O-N 3.05Å; F611-V721 CarbonylContact C-O 3.56Å; F611-V721 WeakPolarHBondContact CA-O 3.44Å; F611-V721 HydrophobicContact CD1-CB 3.76Å; F611-V721 HydrophobicContact CD1-CG1 4.01Å; F611-V721 HydrophobicContact CD1-CG2 4.43Å; F611-V721 HydrophobicContact CE1-CB 3.99Å; F611-V721 HydrophobicContact CE1-CG1 4.14Å; F611-V721 HydrophobicContact CE1-CG2 4.2Å
612	V	94.6	Very high	83.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	113.9	169.5	-175	0	0	0	0	106.2	V610 V656 Y658 A699 L700 A703 V720 V721 V722 I723	V610-V612 HydrophobicContact CG1-CG2 4.36Å; V612-V656 CarbonylContact C-O 3.51Å; V612-V656 WeakPolarHBondContact CA-O 3.29Å; V612-V656 HydrophobicContact CG2-CB 4.44Å; V612-Y658 HydrophobicContact CG1-CD1 3.85Å; V612-Y658 HydrophobicContact CG1-CE1 3.79Å; V612-A699 HydrophobicContact CG1-CB 4.32Å; V612-L700 HydrophobicContact CG1-CD2 4.46Å; V612-A703 HydrophobicContact CG2-CB 4.01Å; V612-V720 HydrophobicContact CG2-CG1 3.82Å; V612-V721 PolarHBondContact N-O 3.27Å; V612-V722 HydrophobicContact CB-CG1 4.39Å; V612-V722 HydrophobicContact CB-CG2 4.3Å; V612-V722 WeakPolarHBondContact O-CA 3.37Å; V612-I723 PolarHBondContact O-N 3.1Å
613	I	94.4	Very high	84.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.9	-166.8	67.5	174.3	0	0	0	111.5	F611 F624 E627 V631 V655 V656 Q657 Y658 L687 I723	F611-I613 HydrophobicContact CB-CG2 4.06Å; I613-F624 HydrophobicContact CD1-CE2 3.8Å; I613-F624 HydrophobicContact CD1-CZ 4.48Å; I613-F624 HydrophobicContact CG1-CE2 4.3Å; I613-E627 WeakPolarHBondContact CB-OE2 3.44Å; I613-V631 HydrophobicContact CG2-CG2 4.08Å; I613-V655 HydrophobicContact CD1-CG1 3.73Å; I613-V655 HydrophobicContact CG1-CG1 4.05Å; I613-V656 PolarHBondContact N-O 3.31Å; I613-Q657 HydrophobicContact CD1-CB 4.29Å; I613-Q657 HydrophobicContact CG1-CB 3.93Å; I613-Q657 HydrophobicContact CG1-CG 4.3Å; I613-Q657 WeakPolarHBondContact O-CA 3.36Å; I613-Y658 WeakPolarHBondContact O-CD1 3.31Å; I613-Y658 WeakPolarHBondContact O-CE1 3.42Å; I613-Y658 PolarHBondContact O-N 3.15Å; I613-L687 HydrophobicContact CD1-CD1 4.08Å; I613-I723 HydrophobicContact CG2-CD1 4.02Å; I613-I723 HydrophobicContact CG2-CG1 4.39Å
614	D	91.9	Very high	86	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112.4	-164.6	-164.8	-31.7	0	0	0	110.3	S616 V619 E627 Y658 T694 I723 T724	D614-S616 WeakPolarHBondContact OD1-CB 3.45Å; D614-S616 PolarHBondContact OD1-N 3.45Å; D614-S616 VanDerWaalsContact OD1-N 3.09Å; D614-S616 PolarHBondContact OD1-OG 2.88Å; D614-V619 HydrophobicContact CB-CG2 3.94Å; D614-E627 PolarHBondContact N-OE2 3.21Å; D614-E627 VanDerWaalsContact N-OE2 3.14Å; D614-Y658 HydrophobicContact CB-CE1 4.09Å; D614-Y658 HydrophobicContact CB-CE2 4.43Å; D614-Y658 WeakPolarHBondContact CB-OH 3.4Å; D614-Y658 VanDerWaalsContact CG-OH 3.23Å; D614-Y658 PolarHBondContact OD2-OH 3.09Å; D614-T694 WeakPolarHBondContact OD2-CG2 3.37Å; D614-I723 WeakPolarHBondContact CB-O 3.49Å; D614-T724 WeakPolarHBondContact OD2-CB 3.22Å; D614-T724 PolarHBondContact OD2-OG1 2.94Å
615	S	93	Very high	87.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.181	C	C	.	.			trans	-110.4	25.1	-179.8	72.1	0	0	0	0	113	Q657 Y658 W689 A691	S615-Q657 VanDerWaalsContact OG-CG 3.29Å; S615-Q657 WeakPolarHBondContact OG-CG 3.37Å; S615-Q657 PolarHBondContact OG-NE2 3.22Å; S615-Y658 WeakPolarHBondContact CA-O 3.1Å; S615-Y658 WeakPolarHBondContact CB-O 3.4Å; S615-Y658 PolarHBondContact N-O 2.92Å; S615-Y658 PolarHBondContact OG-O 3.19Å; S615-W689 PolarHBondContact O-NE1 3.19Å; S615-A691 VanDerWaalsContact O-CA 3.25Å; S615-A691 WeakPolarHBondContact O-CA 3.49Å; S615-A691 PolarHBondContact O-N 3.08Å
616	S	90.4	Very high	88.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-63.6	172.8	173.1	61.8	0	0	0	0	113.3	D614 S618 G620 W689 G692 G693 T694	D614-S616 WeakPolarHBondContact OD1-CB 3.45Å; D614-S616 PolarHBondContact OD1-N 3.45Å; D614-S616 VanDerWaalsContact OD1-N 3.09Å; D614-S616 PolarHBondContact OD1-OG 2.88Å; S616-S618 PolarHBondContact OG-OG 2.96Å; S616-G620 PolarHBondContact O-N 3.5Å; S616-W689 PolarHBondContact O-NE1 3.44Å; S616-G692 CarbonylContact C-O 3.24Å; S616-G692 WeakPolarHBondContact CA-O 3.31Å; S616-G692 WeakPolarHBondContact CB-O 3.47Å; S616-G693 WeakPolarHBondContact CB-O 3.49Å; S616-T694 WeakPolarHBondContact CB-OG1 3.43Å; S616-T694 PolarHBondContact OG-OG1 2.96Å
617	E	86.6	Confident	89.1	Confident	138 Å²	138	27.9 Å²	27.9	65%	0.645	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-28.3	178.9	-167.4	170.4	177.2	0	0	112.8	G692	E617-G692 WeakPolarHBondContact CB-O 3.4Å; E617-G692 PolarHBondContact N-O 3.41Å
618	S	83.8	Confident	89.7	Confident	59 Å²	59	28.2 Å²	28.2	41%	0.413	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-34.6	176.7	53.5	0	0	0	0	112.8	S616 D725	S616-S618 PolarHBondContact OG-OG 2.96Å; S618-D725 WeakPolarHBondContact CB-OD2 3.36Å; S618-D725 PolarHBondContact OG-OD2 3.33Å
619	V	86.1	Confident	89.8	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.018	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-56.6	171.6	177.4	0	0	0	0	110.3	D614 N623 F624 F783	D614-V619 HydrophobicContact CB-CG2 3.94Å; V619-N623 HydrophobicContact CG1-CB 3.67Å; V619-N623 VanDerWaalsContact O-CB 3.29Å; V619-N623 WeakPolarHBondContact O-CB 3.42Å; V619-N623 PolarHBondContact O-ND2 2.83Å; V619-F624 HydrophobicContact CG1-CB 4.41Å; V619-F783 HydrophobicContact CB-CZ 4.43Å; V619-F783 HydrophobicContact CG1-CE1 3.84Å; V619-F783 HydrophobicContact CG1-CZ 4Å; V619-F783 HydrophobicContact CG2-CE1 4.4Å; V619-F783 HydrophobicContact CG2-CZ 4.08Å
620	G	86.1	Confident	89.9	Confident	14 Å²	14	31.5 Å²	31.5	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	79.4	158.2	179.4	0	0	0	0	0	115.4	S616 T622 N623 F624	S616-G620 PolarHBondContact O-N 3.5Å; G620-T622 VanDerWaalsContact C-N 3.35Å; G620-T622 PolarHBondContact O-N 2.99Å; G620-N623 PolarHBondContact O-N 3.03Å; G620-F624 WeakPolarHBondContact O-CB 3.48Å; G620-F624 PolarHBondContact O-N 3.25Å
621	L	86.3	Confident	89.8	Confident	96 Å²	96	31.5 Å²	31.5	50%	0.503	18%	0.176	S	C	.	.	H	α-helix	trans	-55.4	-38.8	-169.7	179	62.7	0	0	0	115.2	T625 W689	L621-T625 PolarHBondContact O-N 2.9Å; L621-T625 VanDerWaalsContact O-N 3.11Å; L621-T625 PolarHBondContact O-OG1 2.85Å; L621-W689 HydrophobicContact CB-CD2 4.04Å; L621-W689 HydrophobicContact CB-CE3 3.96Å; L621-W689 HydrophobicContact CB-CG 4.4Å; L621-W689 HydrophobicContact CB-CZ3 4.39Å; L621-W689 HydrophobicContact CD1-CB 3.67Å; L621-W689 HydrophobicContact CD1-CD2 4.49Å; L621-W689 HydrophobicContact CD1-CE3 4.46Å; L621-W689 HydrophobicContact CD1-CG 4.21Å
622	T	86.3	Confident	89.6	Confident	106 Å²	106	32.1 Å²	32.1	65%	0.65	18%	0.179	S	C	*	.	H	α-helix	trans	-68.5	-45.5	-179.6	46	0	0	0	0	111.5	G620 T625 L626	G620-T622 VanDerWaalsContact C-N 3.35Å; G620-T622 PolarHBondContact O-N 2.99Å; T622-T625 WeakPolarHBondContact O-CB 3.15Å; T622-T625 PolarHBondContact O-N 2.79Å; T622-L626 PolarHBondContact O-N 3.22Å
623	N	88.3	Confident	89.2	Confident	45 Å²	45	34.6 Å²	34.6	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-70.4	-41.7	179.9	-66.3	-27.1	0	0	0	111.3	V619 G620 T625 L626 E627 F783	V619-N623 HydrophobicContact CG1-CB 3.67Å; V619-N623 VanDerWaalsContact O-CB 3.29Å; V619-N623 WeakPolarHBondContact O-CB 3.42Å; V619-N623 PolarHBondContact O-ND2 2.83Å; G620-N623 PolarHBondContact O-N 3.03Å; N623-T625 PolarHBondContact O-N 2.98Å; N623-L626 CarbonylContact O-C 2.9Å; N623-L626 WeakPolarHBondContact O-CA 3.45Å; N623-L626 WeakPolarHBondContact O-CB 3.38Å; N623-L626 PolarHBondContact O-N 2.71Å; N623-E627 PolarHBondContact O-N 2.72Å; N623-F783 HydrophobicContact CB-CB 3.91Å; N623-F783 HydrophobicContact CB-CD1 3.74Å; N623-F783 HydrophobicContact CB-CD2 3.74Å; N623-F783 HydrophobicContact CB-CE1 4.17Å; N623-F783 HydrophobicContact CB-CE2 4.2Å; N623-F783 HydrophobicContact CB-CG 3.51Å; N623-F783 HydrophobicContact CB-CZ 4.4Å
624	F	90.8	Very high	88.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-29.9	170.9	177.1	-110.7	0	0	0	112.8	I613 V619 G620 K628 Q657 L687 W689	I613-F624 HydrophobicContact CD1-CE2 3.8Å; I613-F624 HydrophobicContact CD1-CZ 4.48Å; I613-F624 HydrophobicContact CG1-CE2 4.3Å; V619-F624 HydrophobicContact CG1-CB 4.41Å; G620-F624 WeakPolarHBondContact O-CB 3.48Å; G620-F624 PolarHBondContact O-N 3.25Å; F624-K628 HydrophobicContact CD1-CD 4.4Å; F624-K628 HydrophobicContact CE1-CD 3.77Å; F624-K628 HydrophobicContact CE1-CG 4.42Å; F624-K628 HydrophobicContact CE2-CG 4.42Å; F624-K628 HydrophobicContact CZ-CD 3.83Å; F624-K628 HydrophobicContact CZ-CG 4.2Å; F624-K628 WeakPolarHBondContact O-CG 3.3Å; F624-K628 PolarHBondContact O-N 3.5Å; F624-K628 VanDerWaalsContact O-N 3.12Å; F624-Q657 HydrophobicContact CE2-CG 3.97Å; F624-Q657 VanDerWaalsContact CZ-CD 3.43Å; F624-Q657 HydrophobicContact CZ-CG 4.19Å; F624-L687 HydrophobicContact CZ-CB 4.18Å; F624-W689 HydrophobicContact CD1-CB 3.7Å; F624-W689 HydrophobicContact CD1-CG 4.26Å; F624-W689 HydrophobicContact CE1-CB 4.01Å; F624-W689 HydrophobicContact CG-CB 4.47Å
625	T	89.6	Confident	88.5	Confident	56 Å²	56	35 Å²	35	34%	0.344	20%	0.195	S	C	.	.	H	α-helix	trans	-72.1	-34.8	172.8	-57.4	0	0	0	0	112	L621 T622 N623 N629	L621-T625 PolarHBondContact O-N 2.9Å; L621-T625 VanDerWaalsContact O-N 3.11Å; L621-T625 PolarHBondContact O-OG1 2.85Å; T622-T625 WeakPolarHBondContact O-CB 3.15Å; T622-T625 PolarHBondContact O-N 2.79Å; N623-T625 PolarHBondContact O-N 2.98Å; T625-N629 VanDerWaalsContact O-CG 3.26Å; T625-N629 PolarHBondContact O-N 3.31Å; T625-N629 VanDerWaalsContact O-N 3.09Å; T625-N629 PolarHBondContact O-ND2 2.78Å
626	L	89.9	Confident	87.9	Confident	47 Å²	47	36.7 Å²	36.7	25%	0.246	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-39.6	172.1	-62.2	170	0	0	0	111.8	T622 N623 N629 F630 F783 V787	T622-L626 PolarHBondContact O-N 3.22Å; N623-L626 CarbonylContact O-C 2.9Å; N623-L626 WeakPolarHBondContact O-CA 3.45Å; N623-L626 WeakPolarHBondContact O-CB 3.38Å; N623-L626 PolarHBondContact O-N 2.71Å; L626-N629 PolarHBondContact O-N 2.84Å; L626-F630 PolarHBondContact O-N 3.41Å; L626-F783 HydrophobicContact CB-CB 4.49Å; L626-F783 HydrophobicContact CD1-CB 3.92Å; L626-V787 HydrophobicContact CD2-CG2 4.12Å
627	E	91.3	Very high	87.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-48.3	172.7	-65.3	-169.1	165.7	0	0	111.9	I613 D614 N623 N629 F630 V631 I723 F783 L786	I613-E627 WeakPolarHBondContact CB-OE2 3.44Å; D614-E627 PolarHBondContact N-OE2 3.21Å; D614-E627 VanDerWaalsContact N-OE2 3.14Å; N623-E627 PolarHBondContact O-N 2.72Å; E627-N629 VanDerWaalsContact C-N 3.28Å; E627-N629 PolarHBondContact O-N 2.66Å; E627-F630 WeakPolarHBondContact O-CB 3.48Å; E627-F630 PolarHBondContact O-N 3.26Å; E627-F630 VanDerWaalsContact O-N 3.15Å; E627-V631 WeakPolarHBondContact O-CG2 3.42Å; E627-V631 PolarHBondContact O-N 3.15Å; E627-I723 HydrophobicContact CG-CG2 4.14Å; E627-I723 WeakPolarHBondContact OE1-CG2 3.28Å; E627-F783 HydrophobicContact CG-CD1 4.26Å; E627-F783 HydrophobicContact CG-CE1 4.45Å; E627-L786 HydrophobicContact CG-CD1 4.1Å
628	K	91.9	Very high	86.7	Confident	27 Å²	27	33 Å²	33	12%	0.117	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-39.3	175.9	-73.4	-171.5	-64.3	177.6	0	112.3	F624 I632 V684 L687	F624-K628 HydrophobicContact CD1-CD 4.4Å; F624-K628 HydrophobicContact CE1-CD 3.77Å; F624-K628 HydrophobicContact CE1-CG 4.42Å; F624-K628 HydrophobicContact CE2-CG 4.42Å; F624-K628 HydrophobicContact CZ-CD 3.83Å; F624-K628 HydrophobicContact CZ-CG 4.2Å; F624-K628 WeakPolarHBondContact O-CG 3.3Å; F624-K628 PolarHBondContact O-N 3.5Å; F624-K628 VanDerWaalsContact O-N 3.12Å; K628-I632 WeakPolarHBondContact O-CG1 3.33Å; K628-I632 PolarHBondContact O-N 2.8Å; K628-I632 VanDerWaalsContact O-N 3.12Å; K628-V684 HydrophobicContact CB-CG1 3.95Å; K628-V684 HydrophobicContact CD-CG1 4.47Å; K628-V684 WeakPolarHBondContact CD-O 3.45Å; K628-V684 HydrophobicContact CG-CG1 4.03Å; K628-L687 HydrophobicContact CD-CB 3.99Å; K628-L687 PolarHBondContact NZ-O 3.27Å
629	N	89.4	Confident	85.7	Confident	70 Å²	70	32.6 Å²	32.6	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-68.3	-39.1	175.8	-70.8	-15.4	0	0	0	112.3	T625 L626 E627 I632 N633	T625-N629 VanDerWaalsContact O-CG 3.26Å; T625-N629 PolarHBondContact O-N 3.31Å; T625-N629 VanDerWaalsContact O-N 3.09Å; T625-N629 PolarHBondContact O-ND2 2.78Å; L626-N629 PolarHBondContact O-N 2.84Å; E627-N629 VanDerWaalsContact C-N 3.28Å; E627-N629 PolarHBondContact O-N 2.66Å; N629-I632 PolarHBondContact O-N 3.24Å; N629-N633 WeakPolarHBondContact O-CB 3.21Å; N629-N633 VanDerWaalsContact O-CG 3.27Å; N629-N633 PolarHBondContact O-N 3.43Å
630	F	91.1	Very high	84.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-44.1	174.4	166.7	-106	0	0	0	112.7	F611 L626 E627 I632 N633 T634 I723 I751 L786 F791 I792 I795	F611-F630 HydrophobicContact CE1-CE1 4.19Å; L626-F630 PolarHBondContact O-N 3.41Å; E627-F630 WeakPolarHBondContact O-CB 3.48Å; E627-F630 PolarHBondContact O-N 3.26Å; E627-F630 VanDerWaalsContact O-N 3.15Å; F630-I632 VanDerWaalsContact C-N 3.31Å; F630-I632 PolarHBondContact O-N 2.94Å; F630-N633 PolarHBondContact O-N 2.84Å; F630-T634 VanDerWaalsContact CE2-OG1 3.29Å; F630-T634 WeakPolarHBondContact CE2-OG1 3.42Å; F630-T634 WeakPolarHBondContact O-CB 3.28Å; F630-T634 PolarHBondContact O-N 3.41Å; F630-T634 PolarHBondContact O-OG1 3.04Å; F630-I723 HydrophobicContact CD1-CD1 3.51Å; F630-I723 HydrophobicContact CE1-CD1 3.66Å; F630-I751 HydrophobicContact CE1-CD1 3.78Å; F630-I751 HydrophobicContact CZ-CD1 3.73Å; F630-L786 HydrophobicContact CB-CB 4.03Å; F630-L786 HydrophobicContact CB-CD1 4.44Å; F630-L786 HydrophobicContact CD1-CD2 4.18Å; F630-L786 HydrophobicContact CD2-CB 4.27Å; F630-L786 HydrophobicContact CD2-CD2 4.35Å; F630-L786 WeakPolarHBondContact CD2-O 3.26Å; F630-L786 HydrophobicContact CE1-CD2 4.38Å; F630-L786 HydrophobicContact CG-CB 4.18Å; F630-L786 HydrophobicContact CG-CD2 4.15Å; F630-F791 HydrophobicContact CD2-CD1 4.49Å; F630-F791 HydrophobicContact CD2-CE1 4.41Å; F630-F791 AromaticContact CE2-CD1 3.87Å; F630-F791 HydrophobicContact CE2-CD1 3.87Å; F630-F791 AromaticContact CE2-CE1 3.58Å; F630-F791 HydrophobicContact CE2-CE1 3.58Å; F630-F791 AromaticContact CZ-CE1 3.8Å; F630-F791 HydrophobicContact CZ-CE1 3.8Å; F630-I792 HydrophobicContact CD2-CG1 4.41Å; F630-I792 HydrophobicContact CE2-CG1 4.5Å; F630-I795 HydrophobicContact CE2-CG2 4.08Å; F630-I795 HydrophobicContact CZ-CG1 4.29Å; F630-I795 HydrophobicContact CZ-CG2 4.18Å
631	V	90.9	Very high	84.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-45	173.8	171.1	0	0	0	0	110.7	F611 I613 E627 I635 V655 F680 V684	F611-V631 HydrophobicContact CB-CG2 4.02Å; F611-V631 HydrophobicContact CD1-CG2 3.79Å; F611-V631 HydrophobicContact CD2-CG1 3.8Å; F611-V631 HydrophobicContact CD2-CG2 4.26Å; F611-V631 HydrophobicContact CE1-CG2 4.3Å; F611-V631 HydrophobicContact CE2-CG1 4.06Å; F611-V631 HydrophobicContact CG-CG1 4.15Å; F611-V631 HydrophobicContact CG-CG2 3.76Å; I613-V631 HydrophobicContact CG2-CG2 4.08Å; E627-V631 WeakPolarHBondContact O-CG2 3.42Å; E627-V631 PolarHBondContact O-N 3.15Å; V631-I635 WeakPolarHBondContact O-CG1 3.43Å; V631-I635 PolarHBondContact O-N 3.29Å; V631-V655 HydrophobicContact CG1-CG2 4.1Å; V631-F680 HydrophobicContact CG1-CE1 3.98Å; V631-F680 HydrophobicContact CG1-CZ 3.73Å; V631-V684 HydrophobicContact CG1-CG1 4.44Å; V631-V684 HydrophobicContact CG1-CG2 4.2Å
632	I	88.3	Confident	83.3	Confident	14 Å²	14	30.3 Å²	30.3	7%	0.072	18%	0.175	C	C	.	.	H	α-helix	trans	-64	-47.1	176.7	-73.9	167.9	0	0	0	111.6	K628 N629 F630 I635 N636 K681 V684 K685	K628-I632 WeakPolarHBondContact O-CG1 3.33Å; K628-I632 PolarHBondContact O-N 2.8Å; K628-I632 VanDerWaalsContact O-N 3.12Å; N629-I632 PolarHBondContact O-N 3.24Å; F630-I632 VanDerWaalsContact C-N 3.31Å; F630-I632 PolarHBondContact O-N 2.94Å; I632-I635 PolarHBondContact O-N 3.18Å; I632-N636 PolarHBondContact O-N 2.97Å; I632-N636 PolarHBondContact O-ND2 2.84Å; I632-K681 HydrophobicContact CG1-CG 4.34Å; I632-K681 HydrophobicContact CG2-CD 4.43Å; I632-K681 HydrophobicContact CG2-CG 3.88Å; I632-V684 HydrophobicContact CD1-CB 4.22Å; I632-V684 HydrophobicContact CD1-CG1 4.06Å; I632-V684 HydrophobicContact CG1-CB 4.18Å; I632-V684 HydrophobicContact CG1-CG1 4.06Å; I632-K685 HydrophobicContact CD1-CG 4.37Å
633	N	86.5	Confident	82.4	Confident	51 Å²	51	34.2 Å²	34.2	27%	0.273	18%	0.183	S	C	.	.	H	α-helix	trans	-71.6	-37.6	-174.1	-73.3	-9.5	0	0	0	113.3	N629 F630 I635 N636 R637 I792	N629-N633 WeakPolarHBondContact O-CB 3.21Å; N629-N633 VanDerWaalsContact O-CG 3.27Å; N629-N633 PolarHBondContact O-N 3.43Å; F630-N633 PolarHBondContact O-N 2.84Å; N633-I635 VanDerWaalsContact C-N 3.32Å; N633-I635 PolarHBondContact O-N 3.28Å; N633-N636 WeakPolarHBondContact O-CB 3.36Å; N633-N636 PolarHBondContact O-N 3.35Å; N633-N636 PolarHBondContact OD1-ND2 2.96Å; N633-R637 PolarHBondContact O-N 2.86Å; N633-I792 HydrophobicContact CB-CD1 4.11Å
634	T	86.2	Confident	81.5	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-45	172.6	-58.8	0	0	0	0	110.9	F611 F630 R637 L638 I795 L799	F611-T634 HydrophobicContact CZ-CG2 4.05Å; F630-T634 VanDerWaalsContact CE2-OG1 3.29Å; F630-T634 WeakPolarHBondContact CE2-OG1 3.42Å; F630-T634 WeakPolarHBondContact O-CB 3.28Å; F630-T634 PolarHBondContact O-N 3.41Å; F630-T634 PolarHBondContact O-OG1 3.04Å; T634-R637 PolarHBondContact O-N 3.01Å; T634-L638 HydrophobicContact CG2-CD1 4.38Å; T634-L638 PolarHBondContact O-N 3.5Å; T634-I795 HydrophobicContact CG2-CG2 3.82Å; T634-L799 HydrophobicContact CG2-CD1 3.4Å
635	I	85.1	Confident	80.3	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.036	20%	0.204	C	C	.	.	H	α-helix	trans	-76	-27.6	-178.8	-64.8	-54.2	0	0	0	112.8	I609 F611 V631 I632 N633 R637 L638 F641 V653 L677 F680	I609-I635 HydrophobicContact CD1-CD1 4.06Å; F611-I635 HydrophobicContact CE2-CD1 3.86Å; F611-I635 HydrophobicContact CE2-CG1 3.82Å; F611-I635 HydrophobicContact CZ-CD1 4.2Å; F611-I635 HydrophobicContact CZ-CG1 4.25Å; V631-I635 WeakPolarHBondContact O-CG1 3.43Å; V631-I635 PolarHBondContact O-N 3.29Å; I632-I635 PolarHBondContact O-N 3.18Å; N633-I635 VanDerWaalsContact C-N 3.32Å; N633-I635 PolarHBondContact O-N 3.28Å; I635-R637 VanDerWaalsContact C-N 3.3Å; I635-R637 PolarHBondContact O-N 3.41Å; I635-L638 HydrophobicContact CD1-CD1 4.15Å; I635-L638 PolarHBondContact O-N 2.8Å; I635-F641 HydrophobicContact CG2-CD2 4.21Å; I635-F641 HydrophobicContact CG2-CE2 3.35Å; I635-F641 HydrophobicContact CG2-CZ 3.92Å; I635-V653 HydrophobicContact CD1-CB 4.5Å; I635-V653 HydrophobicContact CD1-CG1 4.1Å; I635-V653 HydrophobicContact CD1-CG2 3.54Å; I635-V653 HydrophobicContact CG1-CG1 4.09Å; I635-V653 HydrophobicContact CG1-CG2 3.95Å; I635-V653 HydrophobicContact CG2-CG2 4.04Å; I635-L677 HydrophobicContact CG2-CD1 3.87Å; I635-F680 HydrophobicContact CB-CD1 4.41Å; I635-F680 HydrophobicContact CB-CE1 4.03Å; I635-F680 HydrophobicContact CG1-CE1 3.94Å; I635-F680 HydrophobicContact CG1-CZ 4.43Å; I635-F680 HydrophobicContact CG2-CD1 3.97Å; I635-F680 HydrophobicContact CG2-CE1 4.01Å
636	N	82.2	Confident	79.3	Confident	36 Å²	36	42.3 Å²	42.3	19%	0.193	22%	0.221	C	C	.	.	H	α-helix	trans	-57.1	-43.4	169.2	-71.2	-33.6	0	0	0	111.8	I632 N633 K681	I632-N636 PolarHBondContact O-N 2.97Å; I632-N636 PolarHBondContact O-ND2 2.84Å; N633-N636 WeakPolarHBondContact O-CB 3.36Å; N633-N636 PolarHBondContact O-N 3.35Å; N633-N636 PolarHBondContact OD1-ND2 2.96Å; N636-K681 WeakPolarHBondContact OD1-CE 3.31Å; N636-K681 PolarHBondContact OD1-NZ 3.38Å
637	R	76.8	Confident	78.3	Confident	56 Å²	56	41.5 Å²	41.5	21%	0.211	22%	0.22	C	C	.	.	H	α-helix	trans	-76.3	-26.3	-175.9	-84.2	160.7	148.2	-101.2	14.2	114	N633 T634 I635 G639 E789 I792 D793 E796	N633-R637 PolarHBondContact O-N 2.86Å; T634-R637 PolarHBondContact O-N 3.01Å; I635-R637 VanDerWaalsContact C-N 3.3Å; I635-R637 PolarHBondContact O-N 3.41Å; R637-G639 PolarHBondContact O-N 2.99Å; R637-E789 IonicContact CZ-OE1 3.82Å; R637-E789 IonicContact NE-OE1 2.7Å; R637-E789 IonicContact NH2-OE1 3.66Å; R637-E789 PolarHBondContact NH2-OE1 3.1Å; R637-I792 VanDerWaalsContact CD-CG2 3.45Å; R637-D793 IonicContact CZ-OD1 3Å; R637-D793 IonicContact NH1-OD1 2.62Å; R637-D793 PolarHBondContact NH1-OD1 3.38Å; R637-D793 IonicContact NH2-OD1 2.69Å; R637-D793 PolarHBondContact NH2-OD1 3.46Å; R637-D793 IonicContact NH2-OD2 3.36Å; R637-E796 IonicContact NH1-OE2 3.17Å; R637-E796 PolarHBondContact NH1-OE2 3.14Å; R637-E796 VanDerWaalsContact NH1-OE2 3.09Å
638	L	73.8	Confident	77	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	4	177.6	-69.4	172	0	0	0	115	I609 T634 I635 S640 E796 L799 C800	I609-L638 HydrophobicContact CD1-CD1 3.63Å; T634-L638 HydrophobicContact CG2-CD1 4.38Å; T634-L638 PolarHBondContact O-N 3.5Å; I635-L638 HydrophobicContact CD1-CD1 4.15Å; I635-L638 PolarHBondContact O-N 2.8Å; L638-S640 VanDerWaalsContact C-N 3.28Å; L638-S640 PolarHBondContact O-N 2.98Å; L638-E796 HydrophobicContact CD2-CG 3.77Å; L638-E796 HydrophobicContact CG-CG 4.46Å; L638-L799 HydrophobicContact CD1-CB 4.1Å; L638-L799 HydrophobicContact CD1-CD1 3.9Å; L638-C800 HydrophobicContact CD2-CB 4Å
639	G	62.4	Low	75.9	Confident	51 Å²	51	51.3 Å²	51.3	53%	0.526	27%	0.273	S	S	.	.			trans	71	-24.6	149.1	0	0	0	0	0	120	R637	R637-G639 PolarHBondContact O-N 2.99Å
640	S	65.2	Low	75.1	Confident	19 Å²	19	48.5 Å²	48.5	13%	0.133	26%	0.261	C	S	.	.			trans	-142.4	87	-168.5	55.3	0	0	0	0	114.2	L638 T651	L638-S640 VanDerWaalsContact C-N 3.28Å; L638-S640 PolarHBondContact O-N 2.98Å; S640-T651 WeakPolarHBondContact O-CB 3.2Å; S640-T651 PolarHBondContact O-N 3.49Å
641	F	74.3	Confident	74.6	Confident	39 Å²	39	48.7 Å²	48.7	17%	0.171	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-69.2	136.1	170.9	-111.1	-75.6	0	0	0	111.9	I635 K643 V653 I674 L677 F680	I635-F641 HydrophobicContact CG2-CD2 4.21Å; I635-F641 HydrophobicContact CG2-CE2 3.35Å; I635-F641 HydrophobicContact CG2-CZ 3.92Å; F641-K643 PolarHBondContact O-N 2.96Å; F641-V653 HydrophobicContact CE1-CB 4.43Å; F641-V653 HydrophobicContact CE1-CG2 4.06Å; F641-V653 HydrophobicContact CE2-CG2 4.49Å; F641-V653 HydrophobicContact CZ-CB 4.16Å; F641-V653 HydrophobicContact CZ-CG2 3.73Å; F641-I674 HydrophobicContact CE1-CG2 4.3Å; F641-L677 HydrophobicContact CD2-CB 3.98Å; F641-L677 HydrophobicContact CD2-CD1 4.09Å; F641-L677 HydrophobicContact CE2-CB 4.37Å; F641-L677 HydrophobicContact CE2-CD1 3.87Å; F641-F680 HydrophobicContact CE1-CB 4.4Å; F641-F680 HydrophobicContact CE2-CB 3.8Å; F641-F680 HydrophobicContact CE2-CD1 4.14Å; F641-F680 HydrophobicContact CE2-CG 4.03Å; F641-F680 HydrophobicContact CZ-CB 3.51Å; F641-F680 AromaticContact CZ-CD1 3.98Å; F641-F680 HydrophobicContact CZ-CD1 3.98Å; F641-F680 AromaticContact CZ-CD2 3.96Å; F641-F680 HydrophobicContact CZ-CD2 3.96Å; F641-F680 AromaticContact CZ-CG 3.54Å; F641-F680 HydrophobicContact CZ-CG 3.54Å
642	A	70.1	Confident	74.3	Confident	7 Å²	7	49.2 Å²	49.2	6%	0.058	26%	0.264	C	S	.	.			trans	-69.3	118	172.6	0	0	0	0	0	110.9	D644 T651 R652	A642-D644 VanDerWaalsContact C-N 3.25Å; A642-D644 PolarHBondContact O-N 2.8Å; A642-T651 PolarHBondContact N-O 2.89Å; A642-R652 HydrophobicContact CB-CG 3.84Å
643	K	67.3	Low	74.3	Confident	187 Å²	187	48.8 Å²	48.8	81%	0.813	26%	0.262	S	S	*	.	S	Bend	trans	-71.6	-18.5	179.3	-64.9	-178	178.8	179.6	0	113.9	F641	F641-K643 PolarHBondContact O-N 2.96Å
644	D	68.5	Low	74.5	Confident	90 Å²	90	46.3 Å²	46.3	48%	0.481	25%	0.249	S	C	.	.	S	Bend	trans	-131.1	125.8	175.8	-177	-26.3	0	0	0	108.1	A642 Q646 S647	A642-D644 VanDerWaalsContact C-N 3.25Å; A642-D644 PolarHBondContact O-N 2.8Å; D644-Q646 PolarHBondContact O-N 2.88Å; D644-Q646 WeakPolarHBondContact OD1-CB 3.4Å; D644-Q646 PolarHBondContact OD1-N 3.37Å; D644-S647 WeakPolarHBondContact O-CB 3.29Å; D644-S647 PolarHBondContact O-N 3.25Å
645	P	66.4	Low	74.9	Confident	31 Å²	31	46.2 Å²	46.2	20%	0.201	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-21.2	174.9	-29.8	37.5	0	0	0	115.9	R652 N670	P645-R652 WeakPolarHBondContact O-CD 3.43Å; P645-R652 PolarHBondContact O-NH1 3.44Å; P645-N670 HydrophobicContact CB-CB 4.33Å
646	Q	68.1	Low	75.4	Confident	150 Å²	150	45.9 Å²	45.9	70%	0.701	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	1.1	177.8	-59.1	-60.8	-30.8	0	0	113.8	D644 E648	D644-Q646 PolarHBondContact O-N 2.88Å; D644-Q646 WeakPolarHBondContact OD1-CB 3.4Å; D644-Q646 PolarHBondContact OD1-N 3.37Å; Q646-E648 PolarHBondContact O-N 2.93Å
647	S	69.4	Low	76	Confident	31 Å²	31	44.2 Å²	44.2	22%	0.217	24%	0.237	C	C	.	.			trans	-60.8	133.2	-179.9	-178.7	0	0	0	0	112.8	D644 T649 R713	D644-S647 WeakPolarHBondContact O-CB 3.29Å; D644-S647 PolarHBondContact O-N 3.25Å; S647-T649 WeakPolarHBondContact CB-O 3.38Å; S647-T649 PolarHBondContact O-N 3.43Å; S647-T649 PolarHBondContact OG-N 2.03Å; S647-T649 VanDerWaalsContact OG-N 3.15Å; S647-T649 PolarHBondContact OG-O 3.42Å; S647-T649 PolarHBondContact OG-OG1 3.43Å; S647-R713 WeakPolarHBondContact O-CD 3.36Å; S647-R713 PolarHBondContact O-NH1 2.82Å
648	E	64	Low	76.8	Confident	131 Å²	131	41.5 Å²	41.5	61%	0.612	23%	0.227	S	C	*	.	S	Bend	trans	-71	-5.4	170.8	-60.2	-146	136.4	0	0	113.3	Q646 K715	Q646-E648 PolarHBondContact O-N 2.93Å; E648-K715 WeakPolarHBondContact OE1-CE 3.24Å; E648-K715 IonicContact OE1-NZ 3.74Å; E648-K715 PolarHBondContact OE1-NZ 3.44Å; E648-K715 IonicContact OE2-NZ 3.95Å; E648-K715 PolarHBondContact OE2-NZ 2.9Å
649	T	67.4	Low	77.6	Confident	101 Å²	101	41.3 Å²	41.3	62%	0.62	23%	0.226	S	C	*	.	S	Bend	trans	-132.9	155.7	178.6	58.6	0	0	0	0	112.6	S647	S647-T649 WeakPolarHBondContact CB-O 3.38Å; S647-T649 PolarHBondContact O-N 3.43Å; S647-T649 PolarHBondContact OG-N 2.03Å; S647-T649 VanDerWaalsContact OG-N 3.15Å; S647-T649 PolarHBondContact OG-O 3.42Å; S647-T649 PolarHBondContact OG-OG1 3.43Å
650	G	72.8	Confident	78.8	Confident	12 Å²	12	42.4 Å²	42.4	12%	0.124	22%	0.217	C	C	.	.	S	Bend	trans	89.5	158.5	-179.8	0	0	0	0	0	114	R713	G650-R713 PolarHBondContact O-NH1 3.13Å; G650-R713 PolarHBondContact O-NH2 3.21Å
651	T	80.2	Confident	79.8	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.025	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-81.6	135.6	-176.6	-56.9	0	0	0	0	111.4	L607 I609 S640 A642 V653	L607-T651 HydrophobicContact CB-CG2 4.24Å; L607-T651 CarbonylContact O-C 3.49Å; L607-T651 WeakPolarHBondContact O-CA 3.27Å; I609-T651 HydrophobicContact CD1-CG2 3.82Å; I609-T651 HydrophobicContact CG1-CG2 4.29Å; S640-T651 WeakPolarHBondContact O-CB 3.2Å; S640-T651 PolarHBondContact O-N 3.49Å; A642-T651 PolarHBondContact N-O 2.89Å; T651-V653 HydrophobicContact CG2-CG2 3.93Å
652	R	85.6	Confident	79.9	Confident	10 Å²	10	47.2 Å²	47.2	4%	0.038	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.2	167.5	-59.1	-172.7	-52.2	155.3	18.1	108.6	L607 D608 I609 A642 P645 L669 S711	L607-R652 PolarHBondContact O-N 3Å; D608-R652 IonicContact OD1-CZ 3.26Å; D608-R652 IonicContact OD1-NE 3.51Å; D608-R652 PolarHBondContact OD1-NE 2.68Å; D608-R652 IonicContact OD1-NH2 3.18Å; D608-R652 PolarHBondContact OD1-NH2 2.79Å; D608-R652 IonicContact OD2-CZ 3.9Å; D608-R652 IonicContact OD2-NE 2.74Å; D608-R652 IonicContact OD2-NH2 3.93Å; D608-R652 PolarHBondContact OD2-NH2 3.01Å; I609-R652 PolarHBondContact N-O 2.87Å; A642-R652 HydrophobicContact CB-CG 3.84Å; P645-R652 WeakPolarHBondContact O-CD 3.43Å; P645-R652 PolarHBondContact O-NH1 3.44Å; R652-L669 HydrophobicContact CB-CD2 4.18Å; R652-S711 PolarHBondContact NH1-O 3.45Å; R652-S711 PolarHBondContact NH2-O 3.5Å
653	V	89.1	Confident	80.7	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.03	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.2	-174.7	-166.5	0	0	0	0	110.9	I609 F611 I635 F641 T651 F680	I609-V653 CarbonylContact O-C 3.55Å; I609-V653 WeakPolarHBondContact O-CA 3.47Å; F611-V653 HydrophobicContact CD2-CG1 3.89Å; F611-V653 HydrophobicContact CE2-CG1 3.85Å; I635-V653 HydrophobicContact CD1-CB 4.5Å; I635-V653 HydrophobicContact CD1-CG1 4.1Å; I635-V653 HydrophobicContact CD1-CG2 3.54Å; I635-V653 HydrophobicContact CG1-CG1 4.09Å; I635-V653 HydrophobicContact CG1-CG2 3.95Å; I635-V653 HydrophobicContact CG2-CG2 4.04Å; F641-V653 HydrophobicContact CE1-CB 4.43Å; F641-V653 HydrophobicContact CE1-CG2 4.06Å; F641-V653 HydrophobicContact CE2-CG2 4.49Å; F641-V653 HydrophobicContact CZ-CB 4.16Å; F641-V653 HydrophobicContact CZ-CG2 3.73Å; T651-V653 HydrophobicContact CG2-CG2 3.93Å; V653-F680 HydrophobicContact CB-CD2 4.32Å; V653-F680 HydrophobicContact CB-CE2 3.77Å; V653-F680 HydrophobicContact CB-CZ 3.96Å; V653-F680 HydrophobicContact CG1-CE1 4.26Å; V653-F680 HydrophobicContact CG1-CE2 3.62Å; V653-F680 HydrophobicContact CG1-CZ 3.42Å; V653-F680 VanDerWaalsContact CG1-CZ 3.42Å
654	G	90.6	Very high	81.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	158.1	166.8	0	0	0	0	0	111.3	I609 V610 F611 I667	I609-G654 PolarHBondContact O-N 3.03Å; V610-G654 WeakPolarHBondContact CA-O 3.38Å; F611-G654 PolarHBondContact N-O 3.06Å; G654-I667 CarbonylContact C-O 3.55Å; G654-I667 WeakPolarHBondContact CA-O 3.32Å
655	V	94.4	Very high	82.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	135.8	173.9	-174.7	0	0	0	0	108.2	F611 I613 V631 A666 I667 F680 V684 L687	F611-V655 HydrophobicContact CB-CG1 4.45Å; F611-V655 HydrophobicContact CB-CG2 4.47Å; F611-V655 CarbonylContact O-C 3.42Å; F611-V655 WeakPolarHBondContact O-CA 3.28Å; I613-V655 HydrophobicContact CD1-CG1 3.73Å; I613-V655 HydrophobicContact CG1-CG1 4.05Å; V631-V655 HydrophobicContact CG1-CG2 4.1Å; V655-A666 CarbonylContact O-C 3.59Å; V655-A666 VanDerWaalsContact O-CA 3.28Å; V655-A666 WeakPolarHBondContact O-CA 3.38Å; V655-I667 HydrophobicContact CB-CB 4.12Å; V655-I667 HydrophobicContact CB-CD1 4.15Å; V655-I667 HydrophobicContact CB-CG1 4.38Å; V655-I667 HydrophobicContact CG2-CB 4.49Å; V655-I667 HydrophobicContact CG2-CD1 4.21Å; V655-I667 PolarHBondContact N-O 3.43Å; V655-I667 PolarHBondContact O-N 3.29Å; V655-F680 HydrophobicContact CG2-CE2 3.95Å; V655-F680 HydrophobicContact CG2-CZ 3.93Å; V655-V684 HydrophobicContact CG2-CG2 4.19Å; V655-L687 HydrophobicContact CG1-CD1 3.97Å
656	V	94.6	Very high	83.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	112.2	170.7	-179.5	0	0	0	0	107.6	V610 F611 V612 I613 F702 A703 L707	V610-V656 HydrophobicContact CG1-CG2 4.38Å; F611-V656 PolarHBondContact O-N 3.05Å; V612-V656 CarbonylContact C-O 3.51Å; V612-V656 WeakPolarHBondContact CA-O 3.29Å; V612-V656 HydrophobicContact CG2-CB 4.44Å; I613-V656 PolarHBondContact N-O 3.31Å; V656-F702 HydrophobicContact CG1-CD1 3.82Å; V656-F702 HydrophobicContact CG1-CE1 4.26Å; V656-A703 HydrophobicContact CB-CB 4.37Å; V656-A703 HydrophobicContact CG2-CB 3.82Å; V656-L707 HydrophobicContact CG2-CD1 3.67Å; V656-L707 HydrophobicContact CG2-CD2 3.53Å; V656-L707 HydrophobicContact CG2-CG 4.24Å
657	Q	94.4	Very high	84.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.8	168.4	179.2	-172.7	-16.6	0	0	108.9	I613 S615 F624 F664 Q665 E688 I690	I613-Q657 HydrophobicContact CD1-CB 4.29Å; I613-Q657 HydrophobicContact CG1-CB 3.93Å; I613-Q657 HydrophobicContact CG1-CG 4.3Å; I613-Q657 WeakPolarHBondContact O-CA 3.36Å; S615-Q657 VanDerWaalsContact OG-CG 3.29Å; S615-Q657 WeakPolarHBondContact OG-CG 3.37Å; S615-Q657 PolarHBondContact OG-NE2 3.22Å; F624-Q657 HydrophobicContact CE2-CG 3.97Å; F624-Q657 VanDerWaalsContact CZ-CD 3.43Å; F624-Q657 HydrophobicContact CZ-CG 4.19Å; Q657-F664 WeakPolarHBondContact O-CA 3.16Å; Q657-Q665 HydrophobicContact CB-CB 4.39Å; Q657-Q665 PolarHBondContact N-O 3.22Å; Q657-Q665 PolarHBondContact O-N 2.89Å; Q657-E688 PolarHBondContact NE2-O 3.19Å; Q657-I690 HydrophobicContact CG-CD1 4.32Å
658	Y	93.4	Very high	85.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	163.2	173.5	69	-82.7	0	0	0	111.6	V612 I613 D614 S615 T694 T696 A699 T724	V612-Y658 HydrophobicContact CG1-CD1 3.85Å; V612-Y658 HydrophobicContact CG1-CE1 3.79Å; I613-Y658 WeakPolarHBondContact O-CD1 3.31Å; I613-Y658 WeakPolarHBondContact O-CE1 3.42Å; I613-Y658 PolarHBondContact O-N 3.15Å; D614-Y658 HydrophobicContact CB-CE1 4.09Å; D614-Y658 HydrophobicContact CB-CE2 4.43Å; D614-Y658 WeakPolarHBondContact CB-OH 3.4Å; D614-Y658 VanDerWaalsContact CG-OH 3.23Å; D614-Y658 PolarHBondContact OD2-OH 3.09Å; S615-Y658 WeakPolarHBondContact CA-O 3.1Å; S615-Y658 WeakPolarHBondContact CB-O 3.4Å; S615-Y658 PolarHBondContact N-O 2.92Å; S615-Y658 PolarHBondContact OG-O 3.19Å; Y658-T694 HydrophobicContact CE2-CG2 3.98Å; Y658-T696 WeakPolarHBondContact CE2-OG1 3.24Å; Y658-T696 PolarHBondContact OH-OG1 3.2Å; Y658-A699 HydrophobicContact CD1-CB 3.52Å; Y658-A699 HydrophobicContact CD2-CB 3.9Å; Y658-A699 HydrophobicContact CE1-CB 4.14Å; Y658-A699 HydrophobicContact CE2-CB 4.48Å; Y658-A699 HydrophobicContact CG-CB 3.38Å; Y658-T724 WeakPolarHBondContact OH-CB 3.46Å; Y658-T724 PolarHBondContact OH-OG1 3.48Å
659	S	90.8	Very high	86.5	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.183	C	C	.	.			trans	-143.1	-89.9	154.5	60.6	0	0	0	0	109.5	T663 I690 A691 G693 W695	S659-T663 PolarHBondContact N-O 3.44Å; S659-T663 PolarHBondContact OG-OG1 2.7Å; S659-I690 WeakPolarHBondContact OG-CG2 3.4Å; S659-A691 WeakPolarHBondContact CB-O 3.36Å; S659-A691 PolarHBondContact OG-O 3.26Å; S659-G693 CarbonylContact C-O 3.57Å; S659-G693 WeakPolarHBondContact CA-O 3.4Å; S659-W695 WeakPolarHBondContact O-CB 3.46Å; S659-W695 PolarHBondContact O-N 3.12Å
660	H	88.1	Confident	87.1	Confident	73 Å²	73	29.3 Å²	29.3	34%	0.338	17%	0.171	S	C	.	.	S	Bend	trans	-97.3	-178.8	-176	60.7	-91.2	0	0	0	113.4	G662 T663 A691 G693	H660-G662 PolarHBondContact O-N 3.35Å; H660-G662 VanDerWaalsContact O-N 3.09Å; H660-T663 PolarHBondContact N-OG1 3.04Å; H660-T663 VanDerWaalsContact N-OG1 3.15Å; H660-T663 PolarHBondContact ND1-OG1 2.96Å; H660-T663 WeakPolarHBondContact NE2-CG2 3.36Å; H660-T663 PolarHBondContact O-N 3.02Å; H660-T663 VanDerWaalsContact O-N 3.1Å; H660-T663 PolarHBondContact O-OG1 3.34Å; H660-A691 PolarHBondContact ND1-O 2.99Å; H660-G693 PolarHBondContact N-O 3.17Å
661	N	85.3	Confident	87.6	Confident	108 Å²	108	31.1 Å²	31.1	58%	0.578	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	116.1	-174.4	-170.9	-7.4	0	0	0	112.7	T663 W695	N661-T663 VanDerWaalsContact C-N 3.31Å; N661-T663 PolarHBondContact O-N 3.42Å; N661-W695 HydrophobicContact CB-CD2 3.79Å; N661-W695 HydrophobicContact CB-CE3 3.71Å; N661-W695 HydrophobicContact CB-CH2 3.74Å; N661-W695 HydrophobicContact CB-CZ2 3.78Å; N661-W695 HydrophobicContact CB-CZ3 3.69Å; N661-W695 VanDerWaalsContact CG-CZ3 3.47Å; N661-W695 WeakPolarHBondContact ND2-CH2 3.41Å
662	G	77.4	Confident	87.3	Confident	52 Å²	52	35.1 Å²	35.1	54%	0.536	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-6.9	176.2	0	0	0	0	0	115.4	H660 F664	H660-G662 PolarHBondContact O-N 3.35Å; H660-G662 VanDerWaalsContact O-N 3.09Å; G662-F664 PolarHBondContact O-N 3.32Å
663	T	86	Confident	87	Confident	37 Å²	37	40.3 Å²	40.3	23%	0.227	23%	0.234	C	C	.	.			trans	-91.8	86.5	177.6	53.3	0	0	0	0	111.6	S659 H660 N661 I690	S659-T663 PolarHBondContact N-O 3.44Å; S659-T663 PolarHBondContact OG-OG1 2.7Å; H660-T663 PolarHBondContact N-OG1 3.04Å; H660-T663 VanDerWaalsContact N-OG1 3.15Å; H660-T663 PolarHBondContact ND1-OG1 2.96Å; H660-T663 WeakPolarHBondContact NE2-CG2 3.36Å; H660-T663 PolarHBondContact O-N 3.02Å; H660-T663 VanDerWaalsContact O-N 3.1Å; H660-T663 PolarHBondContact O-OG1 3.34Å; N661-T663 VanDerWaalsContact C-N 3.31Å; N661-T663 PolarHBondContact O-N 3.42Å; T663-I690 HydrophobicContact CG2-CG2 4.19Å
664	F	87.4	Confident	86.6	Confident	51 Å²	51	41.1 Å²	41.1	22%	0.224	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.6	174.9	-50.8	-71.1	0	0	0	110.5	Q657 G662 A699 F702	Q657-F664 WeakPolarHBondContact O-CA 3.16Å; G662-F664 PolarHBondContact O-N 3.32Å; F664-A699 HydrophobicContact CD1-CB 4.48Å; F664-A699 HydrophobicContact CE1-CB 3.99Å; F664-F702 HydrophobicContact CB-CD1 3.92Å; F664-F702 HydrophobicContact CB-CD2 4.12Å; F664-F702 HydrophobicContact CB-CE1 3.77Å; F664-F702 HydrophobicContact CB-CE2 3.97Å; F664-F702 HydrophobicContact CB-CG 4.11Å; F664-F702 HydrophobicContact CB-CZ 3.79Å; F664-F702 HydrophobicContact CD1-CB 4.32Å; F664-F702 HydrophobicContact CD1-CD1 4.4Å; F664-F702 HydrophobicContact CD1-CG 4.2Å; F664-F702 HydrophobicContact CD2-CB 4.4Å; F664-F702 AromaticContact CD2-CD2 3.57Å; F664-F702 HydrophobicContact CD2-CD2 3.57Å; F664-F702 AromaticContact CD2-CE2 3.98Å; F664-F702 HydrophobicContact CD2-CE2 3.98Å; F664-F702 AromaticContact CD2-CG 3.94Å; F664-F702 HydrophobicContact CD2-CG 3.94Å; F664-F702 HydrophobicContact CE1-CB 4.39Å; F664-F702 HydrophobicContact CE2-CB 4.46Å; F664-F702 HydrophobicContact CE2-CD2 4.16Å; F664-F702 HydrophobicContact CE2-CG 4.45Å; F664-F702 HydrophobicContact CG-CB 4.34Å; F664-F702 HydrophobicContact CG-CD1 4.06Å; F664-F702 AromaticContact CG-CD2 3.86Å; F664-F702 HydrophobicContact CG-CD2 3.86Å; F664-F702 HydrophobicContact CG-CE1 4.38Å; F664-F702 HydrophobicContact CG-CE2 4.18Å; F664-F702 AromaticContact CG-CG 3.8Å; F664-F702 HydrophobicContact CG-CG 3.8Å; F664-F702 HydrophobicContact CG-CZ 4.44Å; F664-F702 HydrophobicContact CZ-CB 4.46Å
665	Q	89.4	Confident	85.9	Confident	75 Å²	75	44.9 Å²	44.9	35%	0.35	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.3	168.5	-172.5	174.3	7.9	0	0	108.7	Q657 L687	Q657-Q665 HydrophobicContact CB-CB 4.39Å; Q657-Q665 PolarHBondContact N-O 3.22Å; Q657-Q665 PolarHBondContact O-N 2.89Å; Q665-L687 VanDerWaalsContact CD-CD2 3.47Å; Q665-L687 HydrophobicContact CG-CD2 3.78Å
666	A	88.1	Confident	85.2	Confident	38 Å²	38	47 Å²	47	31%	0.314	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143	-172.3	0	0	0	0	0	114.2	V655 F702 L707	V655-A666 CarbonylContact O-C 3.59Å; V655-A666 VanDerWaalsContact O-CA 3.28Å; V655-A666 WeakPolarHBondContact O-CA 3.38Å; A666-F702 HydrophobicContact CB-CE1 4.17Å; A666-L707 HydrophobicContact CB-CD1 4.03Å
667	I	90.6	Very high	84.5	Confident	12 Å²	12	49.5 Å²	49.5	6%	0.062	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.1	167.2	-63.3	175.4	0	0	0	106.5	G654 V655 I674 A683 V684 L687 L707	G654-I667 CarbonylContact C-O 3.55Å; G654-I667 WeakPolarHBondContact CA-O 3.32Å; V655-I667 HydrophobicContact CB-CB 4.12Å; V655-I667 HydrophobicContact CB-CD1 4.15Å; V655-I667 HydrophobicContact CB-CG1 4.38Å; V655-I667 HydrophobicContact CG2-CB 4.49Å; V655-I667 HydrophobicContact CG2-CD1 4.21Å; V655-I667 PolarHBondContact N-O 3.43Å; V655-I667 PolarHBondContact O-N 3.29Å; I667-I674 HydrophobicContact CG2-CD1 3.34Å; I667-A683 HydrophobicContact CD1-CB 3.85Å; I667-V684 HydrophobicContact CD1-CG2 3.96Å; I667-L687 HydrophobicContact CD1-CD1 4.15Å; I667-L687 HydrophobicContact CD1-CD2 4.37Å; I667-L687 HydrophobicContact CD1-CG 4.37Å; I667-L707 WeakPolarHBondContact O-CD2 3.09Å
668	N	87.1	Confident	83.9	Confident	63 Å²	63	54 Å²	54	34%	0.337	31%	0.314	S	S	.	.			trans	-84.8	142.7	-171.3	-65.1	-54.6	0	0	0	112.8	N670 D671	N668-N670 WeakPolarHBondContact CB-OD1 3.28Å; N668-N670 PolarHBondContact O-N 3.32Å; N668-D671 PolarHBondContact O-N 3.32Å; N668-D671 VanDerWaalsContact O-N 3.16Å
669	L	83.4	Confident	83.4	Confident	7 Å²	7	55.2 Å²	55.2	4%	0.037	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-15.7	176.4	-79.1	168.6	0	0	0	115	D608 V610 R652	D608-L669 HydrophobicContact CB-CD2 4.27Å; V610-L669 HydrophobicContact CG2-CD1 3.79Å; V610-L669 HydrophobicContact CG2-CD2 4.16Å; V610-L669 HydrophobicContact CG2-CG 4.07Å; R652-L669 HydrophobicContact CB-CD2 4.18Å
670	N	80.9	Confident	83.3	Confident	69 Å²	69	55.2 Å²	55.2	37%	0.369	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	14.7	-175.7	62.5	-2.7	0	0	0	113.7	P645 N668 S672 S711	P645-N670 HydrophobicContact CB-CB 4.33Å; N668-N670 WeakPolarHBondContact CB-OD1 3.28Å; N668-N670 PolarHBondContact O-N 3.32Å; N670-S672 PolarHBondContact O-N 3Å; N670-S672 VanDerWaalsContact O-N 3.16Å; N670-S711 PolarHBondContact ND2-OG 3.49Å
671	D	82.1	Confident	83.2	Confident	50 Å²	50	53.8 Å²	53.8	27%	0.267	32%	0.316	S	S	.	.			trans	-64.1	114	177.9	-169.5	-23.8	0	0	0	111	N668 N673 I674	N668-D671 PolarHBondContact O-N 3.32Å; N668-D671 VanDerWaalsContact O-N 3.16Å; D671-N673 PolarHBondContact O-N 2.85Å; D671-N673 VanDerWaalsContact O-N 3.14Å; D671-N673 VanDerWaalsContact OD1-CB 3.3Å; D671-N673 WeakPolarHBondContact OD1-CB 3.18Å; D671-N673 PolarHBondContact OD1-N 2.59Å; D671-N673 PolarHBondContact OD1-ND2 2.99Å; D671-I674 HydrophobicContact CB-CB 4.41Å; D671-I674 HydrophobicContact CB-CD1 4.07Å; D671-I674 HydrophobicContact CB-CG1 4.11Å; D671-I674 PolarHBondContact O-N 2.97Å
672	S	74.8	Confident	83.3	Confident	87 Å²	87	52.5 Å²	52.5	61%	0.608	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.7	-178.7	54.9	0	0	0	0	114.1	N670 I674	N670-S672 PolarHBondContact O-N 3Å; N670-S672 VanDerWaalsContact O-N 3.16Å; S672-I674 VanDerWaalsContact C-N 3.32Å
673	N	78.9	Confident	83.8	Confident	119 Å²	119	50.5 Å²	50.5	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.2	174.1	-54.3	-80.5	0	0	0	112.3	D671 A679	D671-N673 PolarHBondContact O-N 2.85Å; D671-N673 VanDerWaalsContact O-N 3.14Å; D671-N673 VanDerWaalsContact OD1-CB 3.3Å; D671-N673 WeakPolarHBondContact OD1-CB 3.18Å; D671-N673 PolarHBondContact OD1-N 2.59Å; D671-N673 PolarHBondContact OD1-ND2 2.99Å; N673-A679 WeakPolarHBondContact O-CB 3.04Å
674	I	80.3	Confident	84.1	Confident	22 Å²	22	48.8 Å²	48.8	11%	0.113	28%	0.275	C	S	.	.			trans	-110.8	63.8	-173.6	-52.8	-178	0	0	0	109.5	F641 I667 D671 S672 F680 A683	F641-I674 HydrophobicContact CE1-CG2 4.3Å; I667-I674 HydrophobicContact CG2-CD1 3.34Å; D671-I674 HydrophobicContact CB-CB 4.41Å; D671-I674 HydrophobicContact CB-CD1 4.07Å; D671-I674 HydrophobicContact CB-CG1 4.11Å; D671-I674 PolarHBondContact O-N 2.97Å; S672-I674 VanDerWaalsContact C-N 3.32Å; I674-F680 HydrophobicContact CG2-CB 3.78Å; I674-F680 HydrophobicContact CG2-CD2 3.97Å; I674-F680 HydrophobicContact CG2-CG 4.38Å; I674-A683 HydrophobicContact CD1-CB 3.79Å
675	N	76	Confident	84.1	Confident	80 Å²	80	51.9 Å²	51.9	43%	0.428	29%	0.288	S	S	.	.			trans	-99.5	6.4	-179.9	60	21.5	0	0	0	113.4
676	S	80.7	Confident	84.2	Confident	43 Å²	43	56.5 Å²	56.5	30%	0.301	30%	0.302	S	S	.	.	S	Bend	trans	-154.5	154	-175	59.5	0	0	0	0	112.2	T678 A679 F680	S676-T678 VanDerWaalsContact C-N 3.26Å; S676-T678 PolarHBondContact O-N 2.88Å; S676-A679 PolarHBondContact O-N 2.8Å; S676-A679 WeakPolarHBondContact OG-CB 3.37Å; S676-A679 PolarHBondContact OG-N 2.84Å; S676-F680 PolarHBondContact O-N 3.26Å
677	L	79.8	Confident	84.3	Confident	54 Å²	54	54.9 Å²	54.9	28%	0.283	29%	0.288	S	S	.	.	H	α-helix	trans	-57.4	-38.3	178	-176.2	60	0	0	0	112.4	I635 F641 F680 K681	I635-L677 HydrophobicContact CG2-CD1 3.87Å; F641-L677 HydrophobicContact CD2-CB 3.98Å; F641-L677 HydrophobicContact CD2-CD1 4.09Å; F641-L677 HydrophobicContact CE2-CB 4.37Å; F641-L677 HydrophobicContact CE2-CD1 3.87Å; L677-F680 PolarHBondContact O-N 2.74Å; L677-K681 WeakPolarHBondContact O-CG 3.26Å; L677-K681 PolarHBondContact O-N 2.92Å
678	T	81.3	Confident	84.2	Confident	94 Å²	94	61.6 Å²	61.6	58%	0.577	32%	0.32	S	S	*	.	H	α-helix	trans	-68.1	-42.5	177.2	-45.4	0	0	0	0	112	S676 F680 K681 E682	S676-T678 VanDerWaalsContact C-N 3.26Å; S676-T678 PolarHBondContact O-N 2.88Å; T678-F680 VanDerWaalsContact C-N 3.31Å; T678-F680 PolarHBondContact O-N 2.85Å; T678-K681 PolarHBondContact O-N 2.92Å; T678-E682 PolarHBondContact O-N 2.82Å; T678-E682 VanDerWaalsContact O-N 3.1Å
679	A	83.3	Confident	84.4	Confident	25 Å²	25	62.8 Å²	62.8	21%	0.207	32%	0.319	C	S	.	.	H	α-helix	trans	-63.8	-37.9	175	0	0	0	0	0	112	N673 S676 A683	N673-A679 WeakPolarHBondContact O-CB 3.04Å; S676-A679 PolarHBondContact O-N 2.8Å; S676-A679 WeakPolarHBondContact OG-CB 3.37Å; S676-A679 PolarHBondContact OG-N 2.84Å; A679-A683 WeakPolarHBondContact O-CB 3.02Å; A679-A683 PolarHBondContact O-N 3.19Å
680	F	87.7	Confident	84.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.7	-46.6	173.8	-177.8	-108.9	0	0	0	112.4	V631 I635 F641 V653 V655 I674 S676 L677 T678 E682 A683 V684	V631-F680 HydrophobicContact CG1-CE1 3.98Å; V631-F680 HydrophobicContact CG1-CZ 3.73Å; I635-F680 HydrophobicContact CB-CD1 4.41Å; I635-F680 HydrophobicContact CB-CE1 4.03Å; I635-F680 HydrophobicContact CG1-CE1 3.94Å; I635-F680 HydrophobicContact CG1-CZ 4.43Å; I635-F680 HydrophobicContact CG2-CD1 3.97Å; I635-F680 HydrophobicContact CG2-CE1 4.01Å; F641-F680 HydrophobicContact CE1-CB 4.4Å; F641-F680 HydrophobicContact CE2-CB 3.8Å; F641-F680 HydrophobicContact CE2-CD1 4.14Å; F641-F680 HydrophobicContact CE2-CG 4.03Å; F641-F680 HydrophobicContact CZ-CB 3.51Å; F641-F680 AromaticContact CZ-CD1 3.98Å; F641-F680 HydrophobicContact CZ-CD1 3.98Å; F641-F680 AromaticContact CZ-CD2 3.96Å; F641-F680 HydrophobicContact CZ-CD2 3.96Å; F641-F680 AromaticContact CZ-CG 3.54Å; F641-F680 HydrophobicContact CZ-CG 3.54Å; V653-F680 HydrophobicContact CB-CD2 4.32Å; V653-F680 HydrophobicContact CB-CE2 3.77Å; V653-F680 HydrophobicContact CB-CZ 3.96Å; V653-F680 HydrophobicContact CG1-CE1 4.26Å; V653-F680 HydrophobicContact CG1-CE2 3.62Å; V653-F680 HydrophobicContact CG1-CZ 3.42Å; V653-F680 VanDerWaalsContact CG1-CZ 3.42Å; V655-F680 HydrophobicContact CG2-CE2 3.95Å; V655-F680 HydrophobicContact CG2-CZ 3.93Å; I674-F680 HydrophobicContact CG2-CB 3.78Å; I674-F680 HydrophobicContact CG2-CD2 3.97Å; I674-F680 HydrophobicContact CG2-CG 4.38Å; S676-F680 PolarHBondContact O-N 3.26Å; L677-F680 PolarHBondContact O-N 2.74Å; T678-F680 VanDerWaalsContact C-N 3.31Å; T678-F680 PolarHBondContact O-N 2.85Å; F680-E682 VanDerWaalsContact C-N 3.32Å; F680-E682 PolarHBondContact O-N 2.79Å; F680-A683 WeakPolarHBondContact O-CB 3.32Å; F680-A683 PolarHBondContact O-N 2.84Å; F680-A683 VanDerWaalsContact O-N 3.1Å; F680-V684 HydrophobicContact CD1-CG2 4.27Å; F680-V684 HydrophobicContact CD2-CG2 4.22Å; F680-V684 HydrophobicContact CE1-CG2 3.82Å; F680-V684 HydrophobicContact CE2-CG2 3.76Å; F680-V684 HydrophobicContact CG-CG2 4.46Å; F680-V684 HydrophobicContact CZ-CG2 3.53Å; F680-V684 WeakPolarHBondContact O-CG2 3.2Å; F680-V684 PolarHBondContact O-N 2.9Å
681	K	86.9	Confident	84.6	Confident	44 Å²	44	62.9 Å²	62.9	19%	0.191	32%	0.322	C	S	.	.	H	α-helix	trans	-51.9	-50	174.3	-78.4	170.6	179	174.7	0	111.7	I632 N636 L677 T678 V684 K685	I632-K681 HydrophobicContact CG1-CG 4.34Å; I632-K681 HydrophobicContact CG2-CD 4.43Å; I632-K681 HydrophobicContact CG2-CG 3.88Å; N636-K681 WeakPolarHBondContact OD1-CE 3.31Å; N636-K681 PolarHBondContact OD1-NZ 3.38Å; L677-K681 WeakPolarHBondContact O-CG 3.26Å; L677-K681 PolarHBondContact O-N 2.92Å; T678-K681 PolarHBondContact O-N 2.92Å; K681-V684 PolarHBondContact O-N 3.46Å; K681-K685 WeakPolarHBondContact O-CB 3.24Å; K681-K685 VanDerWaalsContact O-CG 3.3Å; K681-K685 WeakPolarHBondContact O-CG 3.33Å; K681-K685 PolarHBondContact O-N 2.67Å
682	E	87	Confident	84.9	Confident	80 Å²	80	61.5 Å²	61.5	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-71.4	-28.8	179.7	-62	-48.7	124.1	0	0	112.9	T678 F680 K685 R686	T678-E682 PolarHBondContact O-N 2.82Å; T678-E682 VanDerWaalsContact O-N 3.1Å; F680-E682 VanDerWaalsContact C-N 3.32Å; F680-E682 PolarHBondContact O-N 2.79Å; E682-K685 WeakPolarHBondContact OE1-CD 3.42Å; E682-K685 WeakPolarHBondContact OE1-CE 3.34Å; E682-K685 IonicContact OE1-NZ 2.78Å; E682-K685 PolarHBondContact OE1-NZ 3.03Å; E682-K685 IonicContact OE2-NZ 2.79Å; E682-R686 WeakPolarHBondContact O-CG 3.35Å; E682-R686 PolarHBondContact O-N 2.83Å; E682-R686 PolarHBondContact O-NE 2.84Å; E682-R686 PolarHBondContact O-NH2 3.01Å
683	A	88.2	Confident	85.4	Confident	11 Å²	11	58.6 Å²	58.6	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-48.3	170	0	0	0	0	0	112	I667 I674 A679 F680 R686	I667-A683 HydrophobicContact CD1-CB 3.85Å; I674-A683 HydrophobicContact CD1-CB 3.79Å; A679-A683 WeakPolarHBondContact O-CB 3.02Å; A679-A683 PolarHBondContact O-N 3.19Å; F680-A683 WeakPolarHBondContact O-CB 3.32Å; F680-A683 PolarHBondContact O-N 2.84Å; F680-A683 VanDerWaalsContact O-N 3.1Å; A683-R686 PolarHBondContact O-N 3.13Å
684	V	91.4	Very high	85.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-41.6	179.1	176.1	0	0	0	0	111.9	K628 V631 I632 V655 I667 F680 K681 R686 L687	K628-V684 HydrophobicContact CB-CG1 3.95Å; K628-V684 HydrophobicContact CD-CG1 4.47Å; K628-V684 WeakPolarHBondContact CD-O 3.45Å; K628-V684 HydrophobicContact CG-CG1 4.03Å; V631-V684 HydrophobicContact CG1-CG1 4.44Å; V631-V684 HydrophobicContact CG1-CG2 4.2Å; I632-V684 HydrophobicContact CD1-CB 4.22Å; I632-V684 HydrophobicContact CD1-CG1 4.06Å; I632-V684 HydrophobicContact CG1-CB 4.18Å; I632-V684 HydrophobicContact CG1-CG1 4.06Å; V655-V684 HydrophobicContact CG2-CG2 4.19Å; I667-V684 HydrophobicContact CD1-CG2 3.96Å; F680-V684 HydrophobicContact CD1-CG2 4.27Å; F680-V684 HydrophobicContact CD2-CG2 4.22Å; F680-V684 HydrophobicContact CE1-CG2 3.82Å; F680-V684 HydrophobicContact CE2-CG2 3.76Å; F680-V684 HydrophobicContact CG-CG2 4.46Å; F680-V684 HydrophobicContact CZ-CG2 3.53Å; F680-V684 WeakPolarHBondContact O-CG2 3.2Å; F680-V684 PolarHBondContact O-N 2.9Å; K681-V684 PolarHBondContact O-N 3.46Å; V684-R686 VanDerWaalsContact C-N 3.25Å; V684-R686 PolarHBondContact O-N 2.97Å; V684-L687 HydrophobicContact CG1-CD1 4.47Å; V684-L687 VanDerWaalsContact O-CB 3.29Å; V684-L687 WeakPolarHBondContact O-CB 3.12Å; V684-L687 WeakPolarHBondContact O-CG 3.37Å; V684-L687 PolarHBondContact O-N 3.08Å; V684-L687 VanDerWaalsContact O-N 3.12Å
685	K	88.9	Confident	86.4	Confident	117 Å²	117	53.7 Å²	53.7	51%	0.509	28%	0.276	S	S	.	.	H	α-helix	trans	-56.3	-38.1	176.5	-77.9	173.1	-178.1	176.4	0	113.1	I632 K681 E682 L687	I632-K685 HydrophobicContact CD1-CG 4.37Å; K681-K685 WeakPolarHBondContact O-CB 3.24Å; K681-K685 VanDerWaalsContact O-CG 3.3Å; K681-K685 WeakPolarHBondContact O-CG 3.33Å; K681-K685 PolarHBondContact O-N 2.67Å; E682-K685 WeakPolarHBondContact OE1-CD 3.42Å; E682-K685 WeakPolarHBondContact OE1-CE 3.34Å; E682-K685 IonicContact OE1-NZ 2.78Å; E682-K685 PolarHBondContact OE1-NZ 3.03Å; E682-K685 IonicContact OE2-NZ 2.79Å; K685-L687 PolarHBondContact O-N 3.15Å
686	R	90.6	Very high	87	Confident	171 Å²	171	50 Å²	50	65%	0.645	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	1.9	-179.8	-74.9	177.6	-68.2	179.5	0.2	114.8	E682 A683 V684 E688	E682-R686 WeakPolarHBondContact O-CG 3.35Å; E682-R686 PolarHBondContact O-N 2.83Å; E682-R686 PolarHBondContact O-NE 2.84Å; E682-R686 PolarHBondContact O-NH2 3.01Å; A683-R686 PolarHBondContact O-N 3.13Å; V684-R686 VanDerWaalsContact C-N 3.25Å; V684-R686 PolarHBondContact O-N 2.97Å; R686-E688 PolarHBondContact O-N 3.47Å
687	L	89.8	Confident	87.5	Confident	4 Å²	4	48 Å²	48	2%	0.021	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-74.6	116.3	169.5	-65.1	179.6	0	0	0	109.8	I613 F624 K628 V655 Q665 I667 V684 K685	I613-L687 HydrophobicContact CD1-CD1 4.08Å; F624-L687 HydrophobicContact CZ-CB 4.18Å; K628-L687 HydrophobicContact CD-CB 3.99Å; K628-L687 PolarHBondContact NZ-O 3.27Å; V655-L687 HydrophobicContact CG1-CD1 3.97Å; Q665-L687 VanDerWaalsContact CD-CD2 3.47Å; Q665-L687 HydrophobicContact CG-CD2 3.78Å; I667-L687 HydrophobicContact CD1-CD1 4.15Å; I667-L687 HydrophobicContact CD1-CD2 4.37Å; I667-L687 HydrophobicContact CD1-CG 4.37Å; V684-L687 HydrophobicContact CG1-CD1 4.47Å; V684-L687 VanDerWaalsContact O-CB 3.29Å; V684-L687 WeakPolarHBondContact O-CB 3.12Å; V684-L687 WeakPolarHBondContact O-CG 3.37Å; V684-L687 PolarHBondContact O-N 3.08Å; V684-L687 VanDerWaalsContact O-N 3.12Å; K685-L687 PolarHBondContact O-N 3.15Å
688	E	88.8	Confident	88.1	Confident	154 Å²	154	46.8 Å²	46.8	72%	0.72	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-91.8	142.2	-179.3	-65.6	-176.9	172.5	0	0	110.4	Q657 R686 I690	Q657-E688 PolarHBondContact NE2-O 3.19Å; R686-E688 PolarHBondContact O-N 3.47Å; E688-I690 PolarHBondContact O-N 3.4Å
689	W	91.9	Very high	88.6	Confident	88 Å²	88	42.3 Å²	42.3	33%	0.333	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-70.7	121.7	180	176.6	64.8	0	0	0	110.6	S615 S616 L621 F624 A691	S615-W689 PolarHBondContact O-NE1 3.19Å; S616-W689 PolarHBondContact O-NE1 3.44Å; L621-W689 HydrophobicContact CB-CD2 4.04Å; L621-W689 HydrophobicContact CB-CE3 3.96Å; L621-W689 HydrophobicContact CB-CG 4.4Å; L621-W689 HydrophobicContact CB-CZ3 4.39Å; L621-W689 HydrophobicContact CD1-CB 3.67Å; L621-W689 HydrophobicContact CD1-CD2 4.49Å; L621-W689 HydrophobicContact CD1-CE3 4.46Å; L621-W689 HydrophobicContact CD1-CG 4.21Å; F624-W689 HydrophobicContact CD1-CB 3.7Å; F624-W689 HydrophobicContact CD1-CG 4.26Å; F624-W689 HydrophobicContact CE1-CB 4.01Å; F624-W689 HydrophobicContact CG-CB 4.47Å; W689-A691 HydrophobicContact CD2-CB 4.18Å; W689-A691 HydrophobicContact CE3-CB 4.28Å; W689-A691 HydrophobicContact CH2-CB 3.73Å; W689-A691 HydrophobicContact CZ2-CB 3.58Å; W689-A691 HydrophobicContact CZ3-CB 4.07Å
690	I	86.5	Confident	89	Confident	56 Å²	56	41.1 Å²	41.1	29%	0.287	20%	0.201	S	C	.	.			trans	-87.5	-32.2	-171.7	-61.3	164.6	0	0	0	112.2	Q657 S659 T663 E688	Q657-I690 HydrophobicContact CG-CD1 4.32Å; S659-I690 WeakPolarHBondContact OG-CG2 3.4Å; T663-I690 HydrophobicContact CG2-CG2 4.19Å; E688-I690 PolarHBondContact O-N 3.4Å
691	A	82.8	Confident	89.1	Confident	21 Å²	21	44.8 Å²	44.8	17%	0.174	22%	0.217	C	C	.	.			trans	60	-179.5	-173.2	0	0	0	0	0	114.8	S615 S659 H660 W689	S615-A691 VanDerWaalsContact O-CA 3.25Å; S615-A691 WeakPolarHBondContact O-CA 3.49Å; S615-A691 PolarHBondContact O-N 3.08Å; S659-A691 WeakPolarHBondContact CB-O 3.36Å; S659-A691 PolarHBondContact OG-O 3.26Å; H660-A691 PolarHBondContact ND1-O 2.99Å; W689-A691 HydrophobicContact CD2-CB 4.18Å; W689-A691 HydrophobicContact CE3-CB 4.28Å; W689-A691 HydrophobicContact CH2-CB 3.73Å; W689-A691 HydrophobicContact CZ2-CB 3.58Å; W689-A691 HydrophobicContact CZ3-CB 4.07Å
692	G	87	Confident	89.4	Confident	21 Å²	21	44.7 Å²	44.7	22%	0.216	22%	0.217	C	C	.	.	S	Bend	trans	98.4	-162	-175.1	0	0	0	0	0	113.5	S616 E617	S616-G692 CarbonylContact C-O 3.24Å; S616-G692 WeakPolarHBondContact CA-O 3.31Å; S616-G692 WeakPolarHBondContact CB-O 3.47Å; E617-G692 WeakPolarHBondContact CB-O 3.4Å; E617-G692 PolarHBondContact N-O 3.41Å
693	G	86.3	Confident	89.6	Confident	27 Å²	27	40.9 Å²	40.9	28%	0.278	20%	0.199	S	C	.	.			trans	-68.3	-175.1	178.9	0	0	0	0	0	114.3	S616 S659 H660	S616-G693 WeakPolarHBondContact CB-O 3.49Å; S659-G693 CarbonylContact C-O 3.57Å; S659-G693 WeakPolarHBondContact CA-O 3.4Å; H660-G693 PolarHBondContact N-O 3.17Å
694	T	87.7	Confident	89.7	Confident	12 Å²	12	41.2 Å²	41.2	7%	0.074	20%	0.198	C	C	.	.			trans	-125.1	93.9	-166.6	-41.9	0	0	0	0	110.7	D614 S616 Y658 T696 R727 F728 D729	D614-T694 WeakPolarHBondContact OD2-CG2 3.37Å; S616-T694 WeakPolarHBondContact CB-OG1 3.43Å; S616-T694 PolarHBondContact OG-OG1 2.96Å; Y658-T694 HydrophobicContact CE2-CG2 3.98Å; T694-T696 PolarHBondContact O-N 2.7Å; T694-R727 WeakPolarHBondContact CG2-O 3.24Å; T694-F728 CarbonylContact O-C 3.58Å; T694-F728 WeakPolarHBondContact O-CA 3.4Å; T694-D729 PolarHBondContact O-N 3.38Å
695	W	91.6	Very high	89.6	Confident	26 Å²	26	42.3 Å²	42.3	10%	0.098	20%	0.204	C	C	.	.			trans	-100.9	56.9	-171.8	-76.1	51.3	0	0	0	111.5	S659 N661 S698 A699 D729 R731 D732	S659-W695 WeakPolarHBondContact O-CB 3.46Å; S659-W695 PolarHBondContact O-N 3.12Å; N661-W695 HydrophobicContact CB-CD2 3.79Å; N661-W695 HydrophobicContact CB-CE3 3.71Å; N661-W695 HydrophobicContact CB-CH2 3.74Å; N661-W695 HydrophobicContact CB-CZ2 3.78Å; N661-W695 HydrophobicContact CB-CZ3 3.69Å; N661-W695 VanDerWaalsContact CG-CZ3 3.47Å; N661-W695 WeakPolarHBondContact ND2-CH2 3.41Å; W695-S698 PolarHBondContact O-N 2.86Å; W695-A699 WeakPolarHBondContact O-CB 3.29Å; W695-A699 PolarHBondContact O-N 3.46Å; W695-D729 PolarHBondContact NE1-OD2 3.49Å; W695-R731 HydrophobicContact CH2-CB 4.19Å; W695-R731 WeakPolarHBondContact CH2-O 3.28Å; W695-R731 HydrophobicContact CZ2-CB 3.79Å; W695-D732 VanDerWaalsContact CA-OD2 3.29Å; W695-D732 WeakPolarHBondContact CA-OD2 3.12Å; W695-D732 WeakPolarHBondContact CB-OD2 3.3Å; W695-D732 HydrophobicContact CD2-CB 3.95Å; W695-D732 HydrophobicContact CE3-CB 3.83Å; W695-D732 HydrophobicContact CG-CB 4.33Å; W695-D732 HydrophobicContact CZ3-CB 4.21Å
696	T	89.8	Confident	89.5	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-49.8	-175.2	-41.8	0	0	0	0	112.9	Y658 T694 S698 A699 L700 R727 I769	Y658-T696 WeakPolarHBondContact CE2-OG1 3.24Å; Y658-T696 PolarHBondContact OH-OG1 3.2Å; T694-T696 PolarHBondContact O-N 2.7Å; T696-S698 VanDerWaalsContact C-N 3.34Å; T696-S698 PolarHBondContact O-N 3.08Å; T696-A699 WeakPolarHBondContact O-CB 3.22Å; T696-A699 PolarHBondContact O-N 3.13Å; T696-A699 VanDerWaalsContact O-N 3.11Å; T696-L700 HydrophobicContact CG2-CD1 4.49Å; T696-L700 WeakPolarHBondContact O-CG 3.37Å; T696-L700 PolarHBondContact O-N 2.93Å; T696-R727 PolarHBondContact OG1-O 2.99Å; T696-I769 HydrophobicContact CG2-CD1 4.01Å
697	P	90.8	Very high	89.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-54.1	-45.7	175.7	-18.5	23.8	0	0	0	113.6	L700 K701 F728 D732 D733 L736 L737	P697-L700 PolarHBondContact O-N 2.56Å; P697-K701 PolarHBondContact O-N 3.28Å; P697-F728 HydrophobicContact CG-CB 4.43Å; P697-F728 HydrophobicContact CG-CD2 3.96Å; P697-F728 HydrophobicContact CG-CG 4.26Å; P697-D732 WeakPolarHBondContact CD-OD2 3.2Å; P697-D732 HydrophobicContact CG-CB 4.22Å; P697-D733 WeakPolarHBondContact CB-O 3.44Å; P697-L736 HydrophobicContact CB-CB 3.79Å; P697-L736 WeakPolarHBondContact O-CB 3.17Å; P697-L737 HydrophobicContact CB-CD2 4.43Å; P697-L737 HydrophobicContact CB-CG 4.44Å; P697-L737 HydrophobicContact CG-CD2 3.85Å; P697-L737 HydrophobicContact CG-CG 4.05Å
698	S	91.3	Very high	89.2	Confident	29 Å²	29	33.3 Å²	33.3	20%	0.203	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-35.8	176.1	-83.3	0	0	0	0	113	W695 T696 K701 F702 D732	W695-S698 PolarHBondContact O-N 2.86Å; T696-S698 VanDerWaalsContact C-N 3.34Å; T696-S698 PolarHBondContact O-N 3.08Å; S698-K701 PolarHBondContact O-N 3.25Å; S698-F702 WeakPolarHBondContact O-CB 3.26Å; S698-F702 PolarHBondContact O-N 3.43Å; S698-D732 WeakPolarHBondContact CB-OD1 3.28Å; S698-D732 VanDerWaalsContact CB-OD2 3.31Å; S698-D732 WeakPolarHBondContact CB-OD2 3.32Å; S698-D732 PolarHBondContact N-OD2 3.42Å; S698-D732 PolarHBondContact OG-OD1 2.72Å; S698-D732 PolarHBondContact OG-OD2 3.39Å
699	A	91.6	Very high	88.9	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-40.9	176.6	0	0	0	0	0	112.6	V612 Y658 F664 W695 T696 K701 F702 A703	V612-A699 HydrophobicContact CG1-CB 4.32Å; Y658-A699 HydrophobicContact CD1-CB 3.52Å; Y658-A699 HydrophobicContact CD2-CB 3.9Å; Y658-A699 HydrophobicContact CE1-CB 4.14Å; Y658-A699 HydrophobicContact CE2-CB 4.48Å; Y658-A699 HydrophobicContact CG-CB 3.38Å; F664-A699 HydrophobicContact CD1-CB 4.48Å; F664-A699 HydrophobicContact CE1-CB 3.99Å; W695-A699 WeakPolarHBondContact O-CB 3.29Å; W695-A699 PolarHBondContact O-N 3.46Å; T696-A699 WeakPolarHBondContact O-CB 3.22Å; T696-A699 PolarHBondContact O-N 3.13Å; T696-A699 VanDerWaalsContact O-N 3.11Å; A699-K701 VanDerWaalsContact C-N 3.34Å; A699-K701 PolarHBondContact O-N 2.93Å; A699-F702 PolarHBondContact O-N 3.49Å; A699-A703 WeakPolarHBondContact O-CB 3.23Å; A699-A703 PolarHBondContact O-N 3.41Å
700	L	92.1	Very high	88.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-39.9	177	-61.1	170.8	0	0	0	111.5	V612 T696 P697 Y704 V722 L737 L740 I769	V612-L700 HydrophobicContact CG1-CD2 4.46Å; T696-L700 HydrophobicContact CG2-CD1 4.49Å; T696-L700 WeakPolarHBondContact O-CG 3.37Å; T696-L700 PolarHBondContact O-N 2.93Å; P697-L700 PolarHBondContact O-N 2.56Å; L700-Y704 PolarHBondContact O-N 2.78Å; L700-V722 HydrophobicContact CD2-CG1 4.14Å; L700-V722 HydrophobicContact CD2-CG2 3.53Å; L700-L737 WeakPolarHBondContact CD1-O 3.44Å; L700-L740 HydrophobicContact CB-CD1 4.22Å; L700-L740 HydrophobicContact CB-CG 4.37Å; L700-L740 HydrophobicContact CD2-CD1 3.76Å; L700-I769 HydrophobicContact CD1-CD1 4.32Å; L700-I769 HydrophobicContact CD1-CG1 3.87Å; L700-I769 HydrophobicContact CD1-CG2 4.11Å; L700-I769 HydrophobicContact CD2-CG2 4.39Å
701	K	91.4	Very high	87.7	Confident	77 Å²	77	30.2 Å²	30.2	34%	0.335	16%	0.16	S	C	.	.	H	α-helix	trans	-64.2	-46.1	171.5	-176.5	-176.8	-178.8	-56.6	0	111.9	P697 S698 A699 A703 Y704 D705 L736 Y739	P697-K701 PolarHBondContact O-N 3.28Å; S698-K701 PolarHBondContact O-N 3.25Å; A699-K701 VanDerWaalsContact C-N 3.34Å; A699-K701 PolarHBondContact O-N 2.93Å; K701-A703 PolarHBondContact O-N 3.21Å; K701-Y704 PolarHBondContact O-N 2.97Å; K701-D705 IonicContact NZ-OD2 2.67Å; K701-D705 PolarHBondContact NZ-OD2 2.58Å; K701-D705 PolarHBondContact O-N 3.18Å; K701-L736 HydrophobicContact CB-CD1 4.24Å; K701-L736 HydrophobicContact CD-CD1 3.85Å; K701-L736 HydrophobicContact CD-CD2 4.21Å; K701-Y739 HydrophobicContact CB-CD1 4.12Å; K701-Y739 HydrophobicContact CB-CE1 4.26Å; K701-Y739 HydrophobicContact CB-CG 4.36Å; K701-Y739 HydrophobicContact CG-CD1 4.23Å; K701-Y739 HydrophobicContact CG-CE1 3.88Å; K701-Y739 HydrophobicContact CG-CE2 4.25Å
702	F	91.9	Very high	87.4	Confident	42 Å²	42	33.5 Å²	33.5	18%	0.184	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-46.2	178.7	179.1	-85.8	0	0	0	111.7	V656 F664 A666 S698 A699 Y704 D705 H706 L707	V656-F702 HydrophobicContact CG1-CD1 3.82Å; V656-F702 HydrophobicContact CG1-CE1 4.26Å; F664-F702 HydrophobicContact CB-CD1 3.92Å; F664-F702 HydrophobicContact CB-CD2 4.12Å; F664-F702 HydrophobicContact CB-CE1 3.77Å; F664-F702 HydrophobicContact CB-CE2 3.97Å; F664-F702 HydrophobicContact CB-CG 4.11Å; F664-F702 HydrophobicContact CB-CZ 3.79Å; F664-F702 HydrophobicContact CD1-CB 4.32Å; F664-F702 HydrophobicContact CD1-CD1 4.4Å; F664-F702 HydrophobicContact CD1-CG 4.2Å; F664-F702 HydrophobicContact CD2-CB 4.4Å; F664-F702 AromaticContact CD2-CD2 3.57Å; F664-F702 HydrophobicContact CD2-CD2 3.57Å; F664-F702 AromaticContact CD2-CE2 3.98Å; F664-F702 HydrophobicContact CD2-CE2 3.98Å; F664-F702 AromaticContact CD2-CG 3.94Å; F664-F702 HydrophobicContact CD2-CG 3.94Å; F664-F702 HydrophobicContact CE1-CB 4.39Å; F664-F702 HydrophobicContact CE2-CB 4.46Å; F664-F702 HydrophobicContact CE2-CD2 4.16Å; F664-F702 HydrophobicContact CE2-CG 4.45Å; F664-F702 HydrophobicContact CG-CB 4.34Å; F664-F702 HydrophobicContact CG-CD1 4.06Å; F664-F702 AromaticContact CG-CD2 3.86Å; F664-F702 HydrophobicContact CG-CD2 3.86Å; F664-F702 HydrophobicContact CG-CE1 4.38Å; F664-F702 HydrophobicContact CG-CE2 4.18Å; F664-F702 AromaticContact CG-CG 3.8Å; F664-F702 HydrophobicContact CG-CG 3.8Å; F664-F702 HydrophobicContact CG-CZ 4.44Å; F664-F702 HydrophobicContact CZ-CB 4.46Å; A666-F702 HydrophobicContact CB-CE1 4.17Å; S698-F702 WeakPolarHBondContact O-CB 3.26Å; S698-F702 PolarHBondContact O-N 3.43Å; A699-F702 PolarHBondContact O-N 3.49Å; F702-Y704 VanDerWaalsContact C-N 3.32Å; F702-Y704 PolarHBondContact O-N 2.95Å; F702-D705 PolarHBondContact O-N 3.02Å; F702-H706 AromaticContact CD2-CE1 3.46Å; F702-H706 VanDerWaalsContact CD2-CE1 3.46Å; F702-H706 WeakPolarHBondContact CD2-CE1 3.42Å; F702-H706 AromaticContact CD2-ND1 3.34Å; F702-H706 VanDerWaalsContact CD2-ND1 3.34Å; F702-H706 WeakPolarHBondContact CD2-ND1 3.21Å; F702-H706 HydrophobicContact CE1-CB 4.36Å; F702-H706 AromaticContact CE2-CE1 3.53Å; F702-H706 AromaticContact CE2-CG 3.87Å; F702-H706 AromaticContact CE2-ND1 3.43Å; F702-H706 WeakPolarHBondContact CE2-ND1 3.3Å; F702-H706 AromaticContact CG-ND1 3.73Å; F702-H706 HydrophobicContact CZ-CB 4.29Å; F702-H706 AromaticContact CZ-CG 3.97Å; F702-H706 AromaticContact CZ-ND1 3.9Å; F702-H706 PolarHBondContact O-N 3.02Å; F702-H706 VanDerWaalsContact O-N 3.09Å; F702-H706 PolarHBondContact O-ND1 3.23Å; F702-L707 HydrophobicContact CE1-CD1 4.38Å
703	A	91.7	Very high	87	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.1	-43.8	178.1	0	0	0	0	0	111.9	V612 V656 A699 K701 L707 I708	V612-A703 HydrophobicContact CG2-CB 4.01Å; V656-A703 HydrophobicContact CB-CB 4.37Å; V656-A703 HydrophobicContact CG2-CB 3.82Å; A699-A703 WeakPolarHBondContact O-CB 3.23Å; A699-A703 PolarHBondContact O-N 3.41Å; K701-A703 PolarHBondContact O-N 3.21Å; A703-L707 WeakPolarHBondContact O-CB 3.29Å; A703-L707 PolarHBondContact O-N 3.27Å; A703-L707 VanDerWaalsContact O-N 3.13Å; A703-I708 PolarHBondContact O-N 3.4Å
704	Y	90.6	Very high	86.1	Confident	18 Å²	18	37.7 Å²	37.7	7%	0.071	19%	0.193	C	C	.	.	I	π-helix	trans	-64	-53.3	175.4	-171.5	-98.7	0	0	0	112.4	L700 K701 F702 H706 I708 R709 Y739 L740 H743 V746	L700-Y704 PolarHBondContact O-N 2.78Å; K701-Y704 PolarHBondContact O-N 2.97Å; F702-Y704 VanDerWaalsContact C-N 3.32Å; F702-Y704 PolarHBondContact O-N 2.95Å; Y704-H706 VanDerWaalsContact C-N 3.31Å; Y704-H706 PolarHBondContact O-N 2.79Å; Y704-I708 HydrophobicContact CD2-CB 3.9Å; Y704-I708 HydrophobicContact CD2-CD1 4.31Å; Y704-I708 HydrophobicContact CD2-CG2 3.82Å; Y704-I708 HydrophobicContact CE2-CB 4.3Å; Y704-I708 HydrophobicContact CE2-CG2 3.81Å; Y704-I708 PolarHBondContact O-N 3.37Å; Y704-R709 HydrophobicContact CD1-CB 4.23Å; Y704-R709 HydrophobicContact CE1-CB 3.86Å; Y704-R709 HydrophobicContact CE1-CG 3.94Å; Y704-R709 WeakPolarHBondContact O-CB 3.19Å; Y704-R709 PolarHBondContact O-N 3.26Å; Y704-Y739 AromaticContact CD1-CE1 3.84Å; Y704-Y739 HydrophobicContact CD1-CE1 3.84Å; Y704-Y739 HydrophobicContact CG-CE1 4.03Å; Y704-L740 HydrophobicContact CD2-CD2 4.06Å; Y704-L740 HydrophobicContact CG-CD2 4.37Å; Y704-H743 AromaticContact CD1-CD2 3.88Å; Y704-H743 AromaticContact CD1-NE2 3.76Å; Y704-H743 HydrophobicContact CD2-CB 4.43Å; Y704-H743 AromaticContact CD2-CD2 3.63Å; Y704-H743 AromaticContact CE1-CD2 3.66Å; Y704-H743 AromaticContact CE1-CE1 3.8Å; Y704-H743 AromaticContact CE1-CG 3.99Å; Y704-H743 AromaticContact CE1-NE2 3.53Å; Y704-H743 HydrophobicContact CE2-CB 3.62Å; Y704-H743 AromaticContact CE2-CD2 3.42Å; Y704-H743 VanDerWaalsContact CE2-CD2 3.42Å; Y704-H743 WeakPolarHBondContact CE2-CD2 3.48Å; Y704-H743 AromaticContact CE2-CG 3.48Å; Y704-H743 VanDerWaalsContact CE2-CG 3.48Å; Y704-H743 AromaticContact CG-CD2 3.86Å; Y704-H743 AromaticContact CZ-CD2 3.43Å; Y704-H743 VanDerWaalsContact CZ-CD2 3.43Å; Y704-H743 AromaticContact CZ-CE1 3.9Å; Y704-H743 AromaticContact CZ-CG 3.38Å; Y704-H743 AromaticContact CZ-ND1 3.69Å; Y704-H743 AromaticContact CZ-NE2 3.76Å; Y704-H743 PolarHBondContact OH-ND1 3.27Å; Y704-V746 HydrophobicContact CD2-CG2 4.35Å; Y704-V746 HydrophobicContact CE2-CG2 3.96Å
705	D	88.6	Confident	85	Confident	24 Å²	24	44.6 Å²	44.6	13%	0.128	22%	0.222	C	C	.	.	I	π-helix	trans	-68.7	-23.9	-169.9	-86.9	-30.4	0	0	0	114.7	K701 F702 R709	K701-D705 IonicContact NZ-OD2 2.67Å; K701-D705 PolarHBondContact NZ-OD2 2.58Å; K701-D705 PolarHBondContact O-N 3.18Å; F702-D705 PolarHBondContact O-N 3.02Å; D705-R709 PolarHBondContact O-NH1 2.72Å; D705-R709 PolarHBondContact O-NH2 3.46Å; D705-R709 IonicContact OD1-CZ 3.21Å; D705-R709 IonicContact OD1-NH1 2.66Å; D705-R709 PolarHBondContact OD1-NH1 2.9Å
706	H	86.4	Confident	84	Confident	102 Å²	102	43.8 Å²	43.8	47%	0.472	22%	0.221	S	C	.	.	I	π-helix	trans	-111.1	-38.5	-175.7	-59.6	87.6	0	0	0	113.5	F702 Y704	F702-H706 AromaticContact CD2-CE1 3.46Å; F702-H706 VanDerWaalsContact CD2-CE1 3.46Å; F702-H706 WeakPolarHBondContact CD2-CE1 3.42Å; F702-H706 AromaticContact CD2-ND1 3.34Å; F702-H706 VanDerWaalsContact CD2-ND1 3.34Å; F702-H706 WeakPolarHBondContact CD2-ND1 3.21Å; F702-H706 HydrophobicContact CE1-CB 4.36Å; F702-H706 AromaticContact CE2-CE1 3.53Å; F702-H706 AromaticContact CE2-CG 3.87Å; F702-H706 AromaticContact CE2-ND1 3.43Å; F702-H706 WeakPolarHBondContact CE2-ND1 3.3Å; F702-H706 AromaticContact CG-ND1 3.73Å; F702-H706 HydrophobicContact CZ-CB 4.29Å; F702-H706 AromaticContact CZ-CG 3.97Å; F702-H706 AromaticContact CZ-ND1 3.9Å; F702-H706 PolarHBondContact O-N 3.02Å; F702-H706 VanDerWaalsContact O-N 3.09Å; F702-H706 PolarHBondContact O-ND1 3.23Å; Y704-H706 VanDerWaalsContact C-N 3.31Å; Y704-H706 PolarHBondContact O-N 2.79Å
707	L	86.5	Confident	83.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-97.6	-51	-178.5	-70.3	71.1	0	0	0	111.4	V610 V656 A666 I667 F702 A703 S711	V610-L707 HydrophobicContact CG1-CD2 4.15Å; V656-L707 HydrophobicContact CG2-CD1 3.67Å; V656-L707 HydrophobicContact CG2-CD2 3.53Å; V656-L707 HydrophobicContact CG2-CG 4.24Å; A666-L707 HydrophobicContact CB-CD1 4.03Å; I667-L707 WeakPolarHBondContact O-CD2 3.09Å; F702-L707 HydrophobicContact CE1-CD1 4.38Å; A703-L707 WeakPolarHBondContact O-CB 3.29Å; A703-L707 PolarHBondContact O-N 3.27Å; A703-L707 VanDerWaalsContact O-N 3.13Å; L707-S711 WeakPolarHBondContact O-CB 3.45Å; L707-S711 PolarHBondContact O-OG 3.03Å
708	I	87.3	Confident	83.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-80.3	-52.4	-166.5	-57.1	179.7	0	0	0	112.1	V610 A703 Y704 D710 R712 V718 V720 L740 V746	V610-I708 HydrophobicContact CG2-CG1 4.15Å; A703-I708 PolarHBondContact O-N 3.4Å; Y704-I708 HydrophobicContact CD2-CB 3.9Å; Y704-I708 HydrophobicContact CD2-CD1 4.31Å; Y704-I708 HydrophobicContact CD2-CG2 3.82Å; Y704-I708 HydrophobicContact CE2-CB 4.3Å; Y704-I708 HydrophobicContact CE2-CG2 3.81Å; Y704-I708 PolarHBondContact O-N 3.37Å; I708-D710 VanDerWaalsContact C-N 3.34Å; I708-D710 PolarHBondContact O-N 3.44Å; I708-R712 VanDerWaalsContact O-CB 3.27Å; I708-R712 WeakPolarHBondContact O-CB 2.93Å; I708-R712 WeakPolarHBondContact O-CD 3.45Å; I708-R712 WeakPolarHBondContact O-CG 3.33Å; I708-R712 PolarHBondContact O-N 2.64Å; I708-V718 HydrophobicContact CD1-CG1 4.16Å; I708-V718 HydrophobicContact CG1-CG1 4.1Å; I708-V718 HydrophobicContact CG2-CB 4.27Å; I708-V718 HydrophobicContact CG2-CG1 4.21Å; I708-V718 HydrophobicContact CG2-CG2 4.12Å; I708-V720 HydrophobicContact CD1-CG2 3.65Å; I708-L740 HydrophobicContact CD1-CD2 3.86Å; I708-V746 HydrophobicContact CD1-CG1 4.45Å; I708-V746 HydrophobicContact CG2-CG2 3.88Å
709	R	84	Confident	83.2	Confident	106 Å²	106	48 Å²	48	40%	0.4	24%	0.241	S	C	.	.	H	α-helix	trans	-55	-47.4	-167.7	-170.6	-172.6	66.7	-132.2	-10.1	112.6	Y704 D705	Y704-R709 HydrophobicContact CD1-CB 4.23Å; Y704-R709 HydrophobicContact CE1-CB 3.86Å; Y704-R709 HydrophobicContact CE1-CG 3.94Å; Y704-R709 WeakPolarHBondContact O-CB 3.19Å; Y704-R709 PolarHBondContact O-N 3.26Å; D705-R709 PolarHBondContact O-NH1 2.72Å; D705-R709 PolarHBondContact O-NH2 3.46Å; D705-R709 IonicContact OD1-CZ 3.21Å; D705-R709 IonicContact OD1-NH1 2.66Å; D705-R709 PolarHBondContact OD1-NH1 2.9Å
710	D	76.1	Confident	83.2	Confident	112 Å²	112	48 Å²	48	60%	0.599	24%	0.241	S	C	*	.	H	α-helix	trans	-106.8	-10.6	-168.8	-56.9	-16.9	0	0	0	113.6	I708	I708-D710 VanDerWaalsContact C-N 3.34Å; I708-D710 PolarHBondContact O-N 3.44Å
711	S	76.6	Confident	83.2	Confident	16 Å²	16	48 Å²	48	11%	0.112	24%	0.241	C	C	.	.	H	α-helix	trans	-112.4	-10.1	-178.2	-43.2	0	0	0	0	115.4	R652 N670 L707	R652-S711 PolarHBondContact NH1-O 3.45Å; R652-S711 PolarHBondContact NH2-O 3.5Å; N670-S711 PolarHBondContact ND2-OG 3.49Å; L707-S711 WeakPolarHBondContact O-CB 3.45Å; L707-S711 PolarHBondContact O-OG 3.03Å
712	R	76.4	Confident	83.2	Confident	89 Å²	89	44.3 Å²	44.3	34%	0.336	23%	0.225	S	C	.	.	S	Bend	trans	-64.7	144.5	-179.3	65.5	-175.5	-179.7	153.4	-0.4	113.5	I708 V718 P744	I708-R712 VanDerWaalsContact O-CB 3.27Å; I708-R712 WeakPolarHBondContact O-CB 2.93Å; I708-R712 WeakPolarHBondContact O-CD 3.45Å; I708-R712 WeakPolarHBondContact O-CG 3.33Å; I708-R712 PolarHBondContact O-N 2.64Å; R712-V718 HydrophobicContact CB-CG2 3.64Å; R712-P744 PolarHBondContact NH1-O 3.45Å
713	R	78.2	Confident	83.2	Confident	23 Å²	23	42.3 Å²	42.3	9%	0.087	22%	0.217	C	C	.	.			trans	-73	138.2	174.4	-80.5	175.3	-67.4	-175.2	-2.4	110.9	L607 D608 S647 G650 K715 A716	L607-R713 VanDerWaalsContact C-NH2 3.33Å; L607-R713 PolarHBondContact O-NH2 3.43Å; D608-R713 IonicContact OD1-CZ 3.86Å; D608-R713 VanDerWaalsContact OD1-CZ 3.25Å; D608-R713 IonicContact OD1-NE 3.57Å; D608-R713 PolarHBondContact OD1-NE 3.45Å; D608-R713 IonicContact OD1-NH2 2.69Å; D608-R713 PolarHBondContact OD1-NH2 2.95Å; D608-R713 PolarHBondContact OD2-N 3.02Å; D608-R713 IonicContact OD2-NE 3.95Å; S647-R713 WeakPolarHBondContact O-CD 3.36Å; S647-R713 PolarHBondContact O-NH1 2.82Å; G650-R713 PolarHBondContact O-NH1 3.13Å; G650-R713 PolarHBondContact O-NH2 3.21Å; R713-K715 PolarHBondContact O-N 2.9Å; R713-A716 HydrophobicContact CB-CB 3.71Å; R713-A716 PolarHBondContact O-N 3.34Å
714	A	67.3	Low	83	Confident	113 Å²	113	42.3 Å²	42.3	93%	0.934	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-7.8	-175.8	0	0	0	0	0	115.8
715	K	65.2	Low	82.6	Confident	157 Å²	157	42 Å²	42	68%	0.683	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.3	1.3	175.8	-66.1	174.6	177.3	168	0	113.3	E648 R713	E648-K715 WeakPolarHBondContact OE1-CE 3.24Å; E648-K715 IonicContact OE1-NZ 3.74Å; E648-K715 PolarHBondContact OE1-NZ 3.44Å; E648-K715 IonicContact OE2-NZ 3.95Å; E648-K715 PolarHBondContact OE2-NZ 2.9Å; R713-K715 PolarHBondContact O-N 2.9Å
716	A	69.9	Low	81.8	Confident	10 Å²	10	41.1 Å²	41.1	8%	0.083	21%	0.213	C	C	.	.			trans	-103.3	141.4	-175.7	0	0	0	0	0	111.3	A606 R713	A606-A716 HydrophobicContact CB-CB 4.09Å; A606-A716 WeakPolarHBondContact O-CB 2.97Å; R713-A716 HydrophobicContact CB-CB 3.71Å; R713-A716 PolarHBondContact O-N 3.34Å
717	N	78.7	Confident	81.4	Confident	100 Å²	100	39.9 Å²	39.9	54%	0.535	20%	0.204	S	C	.	.			trans	-81.6	142.7	159.2	-73.3	-11.7	0	0	0	108.5
718	V	87.3	Confident	81.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115	176	-173.4	0	0	0	0	108.9	D608 V610 I708 R712 V720 G745 V746 D747	D608-V718 HydrophobicContact CB-CB 4.39Å; D608-V718 HydrophobicContact CB-CG1 4.29Å; D608-V718 HydrophobicContact CB-CG2 3.94Å; D608-V718 CarbonylContact O-C 3.13Å; D608-V718 VanDerWaalsContact O-CA 3.28Å; D608-V718 WeakPolarHBondContact O-CA 3.41Å; V610-V718 HydrophobicContact CG2-CG1 3.99Å; I708-V718 HydrophobicContact CD1-CG1 4.16Å; I708-V718 HydrophobicContact CG1-CG1 4.1Å; I708-V718 HydrophobicContact CG2-CB 4.27Å; I708-V718 HydrophobicContact CG2-CG1 4.21Å; I708-V718 HydrophobicContact CG2-CG2 4.12Å; R712-V718 HydrophobicContact CB-CG2 3.64Å; V718-V720 HydrophobicContact CG1-CG2 4.5Å; V718-G745 PolarHBondContact N-O 3.37Å; V718-V746 WeakPolarHBondContact O-CA 3Å; V718-D747 PolarHBondContact O-N 3.49Å
719	T	88.6	Confident	81	Confident	18 Å²	18	43.9 Å²	43.9	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.8	178.2	-49.8	0	0	0	0	109.6	D608 I609 V610 D747 L799	D608-T719 PolarHBondContact O-N 2.98Å; I609-T719 WeakPolarHBondContact CA-O 3.21Å; V610-T719 PolarHBondContact N-O 2.9Å; T719-D747 CarbonylContact C-O 3.59Å; T719-D747 VanDerWaalsContact CA-O 3.32Å; T719-D747 WeakPolarHBondContact CA-O 3.02Å; T719-L799 HydrophobicContact CG2-CD2 3.7Å
720	V	91.7	Very high	80.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.5	-179.1	-171	0	0	0	0	109.6	V610 V612 I708 V718 V722 L740 V746 D747 V748 S749	V610-V720 HydrophobicContact CB-CG2 4.44Å; V610-V720 CarbonylContact O-C 3.18Å; V610-V720 VanDerWaalsContact O-CA 3.29Å; V610-V720 WeakPolarHBondContact O-CA 3.25Å; V612-V720 HydrophobicContact CG2-CG1 3.82Å; I708-V720 HydrophobicContact CD1-CG2 3.65Å; V718-V720 HydrophobicContact CG1-CG2 4.5Å; V720-V722 HydrophobicContact CG1-CG2 4.15Å; V720-L740 HydrophobicContact CB-CD1 4.3Å; V720-L740 HydrophobicContact CG1-CD1 3.91Å; V720-L740 HydrophobicContact CG2-CD1 4.33Å; V720-V746 HydrophobicContact CG2-CG1 3.78Å; V720-D747 PolarHBondContact N-O 3.22Å; V720-V748 HydrophobicContact CB-CG1 4.43Å; V720-V748 HydrophobicContact CB-CG2 4.44Å; V720-V748 WeakPolarHBondContact O-CA 3.24Å; V720-S749 PolarHBondContact O-N 3.23Å
721	V	92.6	Very high	81.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.3	173.9	-179.4	0	0	0	0	108	V610 F611 V612 I723 S749 I751 L799	V610-V721 PolarHBondContact O-N 3.23Å; F611-V721 CarbonylContact C-O 3.56Å; F611-V721 WeakPolarHBondContact CA-O 3.44Å; F611-V721 HydrophobicContact CD1-CB 3.76Å; F611-V721 HydrophobicContact CD1-CG1 4.01Å; F611-V721 HydrophobicContact CD1-CG2 4.43Å; F611-V721 HydrophobicContact CE1-CB 3.99Å; F611-V721 HydrophobicContact CE1-CG1 4.14Å; F611-V721 HydrophobicContact CE1-CG2 4.2Å; V612-V721 PolarHBondContact N-O 3.27Å; V721-I723 HydrophobicContact CG1-CG1 4.37Å; V721-S749 WeakPolarHBondContact CA-O 3.32Å; V721-I751 HydrophobicContact CG1-CD1 3.57Å; V721-I751 HydrophobicContact CG1-CG1 4.23Å; V721-L799 HydrophobicContact CG2-CD2 3.79Å
722	V	92.3	Very high	81.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.6	176.4	-172.2	0	0	0	0	108.3	V612 L700 V720 T724 V748 S749 I751 I769	V612-V722 HydrophobicContact CB-CG1 4.39Å; V612-V722 HydrophobicContact CB-CG2 4.3Å; V612-V722 WeakPolarHBondContact O-CA 3.37Å; L700-V722 HydrophobicContact CD2-CG1 4.14Å; L700-V722 HydrophobicContact CD2-CG2 3.53Å; V720-V722 HydrophobicContact CG1-CG2 4.15Å; V722-T724 HydrophobicContact CG1-CG2 4.45Å; V722-V748 HydrophobicContact CG2-CG1 4Å; V722-S749 PolarHBondContact N-O 3.12Å; V722-I751 PolarHBondContact O-N 2.91Å; V722-I769 HydrophobicContact CB-CG2 4.05Å; V722-I769 HydrophobicContact CG1-CG2 4.23Å; V722-I769 HydrophobicContact CG2-CG2 3.73Å
723	I	91.9	Very high	82.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.6	174.3	-41	-178.9	0	0	0	107.2	V612 I613 D614 E627 F630 V721 I751 I753 L786	V612-I723 PolarHBondContact O-N 3.1Å; I613-I723 HydrophobicContact CG2-CD1 4.02Å; I613-I723 HydrophobicContact CG2-CG1 4.39Å; D614-I723 WeakPolarHBondContact CB-O 3.49Å; E627-I723 HydrophobicContact CG-CG2 4.14Å; E627-I723 WeakPolarHBondContact OE1-CG2 3.28Å; F630-I723 HydrophobicContact CD1-CD1 3.51Å; F630-I723 HydrophobicContact CE1-CD1 3.66Å; V721-I723 HydrophobicContact CG1-CG1 4.37Å; I723-I751 HydrophobicContact CG1-CD1 4.38Å; I723-I751 HydrophobicContact CG2-CB 4.49Å; I723-I751 HydrophobicContact CG2-CG2 4.5Å; I723-I753 HydrophobicContact CG2-CD1 3.7Å; I723-L786 HydrophobicContact CG2-CD1 4.44Å
724	T	88	Confident	82.6	Confident	1 Å²	1	50 Å²	50	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	162.7	179.5	178.8	0	0	0	0	110.1	D614 Y658 V722 G726 I751 G752 I753 L766	D614-T724 WeakPolarHBondContact OD2-CB 3.22Å; D614-T724 PolarHBondContact OD2-OG1 2.94Å; Y658-T724 WeakPolarHBondContact OH-CB 3.46Å; Y658-T724 PolarHBondContact OH-OG1 3.48Å; V722-T724 HydrophobicContact CG1-CG2 4.45Å; T724-G726 PolarHBondContact O-N 2.63Å; T724-G726 PolarHBondContact OG1-N 3.29Å; T724-I751 PolarHBondContact N-O 3.32Å; T724-G752 WeakPolarHBondContact O-CA 3.45Å; T724-I753 PolarHBondContact O-N 3.44Å; T724-L766 HydrophobicContact CG2-CD2 4.01Å
725	D	80.6	Confident	83.5	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.064	25%	0.252	C	S	.	.			trans	-70.8	-10.1	167.6	66.2	2.2	0	0	0	112.6	S618 R727 I753	S618-D725 WeakPolarHBondContact CB-OD2 3.36Å; S618-D725 PolarHBondContact OG-OD2 3.33Å; D725-R727 VanDerWaalsContact OD1-CB 3.23Å; D725-R727 WeakPolarHBondContact OD1-CB 3.49Å; D725-R727 PolarHBondContact OD1-N 3.46Å; D725-I753 WeakPolarHBondContact CA-O 3.32Å
726	G	73.3	Confident	84.6	Confident	5 Å²	5	47.4 Å²	47.4	5%	0.052	23%	0.227	C	C	.	.	S	Bend	trans	99.3	-6.2	179.8	0	0	0	0	0	113.5	T724 S765	T724-G726 PolarHBondContact O-N 2.63Å; T724-G726 PolarHBondContact OG1-N 3.29Å; G726-S765 PolarHBondContact O-OG 3.36Å
727	R	77.7	Confident	85.3	Confident	76 Å²	76	47.7 Å²	47.7	29%	0.287	23%	0.226	S	C	.	.			trans	-86	156.4	-178.7	-61	177.4	169.5	146	8.5	111	T694 T696 D725 D755 E762	T694-R727 WeakPolarHBondContact CG2-O 3.24Å; T696-R727 PolarHBondContact OG1-O 2.99Å; D725-R727 VanDerWaalsContact OD1-CB 3.23Å; D725-R727 WeakPolarHBondContact OD1-CB 3.49Å; D725-R727 PolarHBondContact OD1-N 3.46Å; R727-D755 IonicContact CZ-OD2 3.03Å; R727-D755 VanDerWaalsContact CZ-OD2 3.22Å; R727-D755 IonicContact NH1-OD2 3.8Å; R727-D755 PolarHBondContact NH1-OD2 3Å; R727-D755 IonicContact NH2-OD2 2.59Å; R727-D755 PolarHBondContact NH2-OD2 2.8Å; R727-E762 VanDerWaalsContact CG-OE1 3.27Å; R727-E762 WeakPolarHBondContact CG-OE1 3.38Å; R727-E762 IonicContact CZ-OE1 2.82Å; R727-E762 IonicContact NE-OE1 3.79Å; R727-E762 PolarHBondContact NE-OE1 3.25Å; R727-E762 IonicContact NE-OE2 3.64Å; R727-E762 IonicContact NH2-OE1 3.87Å; R727-E762 PolarHBondContact NH2-OE1 3.45Å; R727-E762 IonicContact NH2-OE2 3.31Å
728	F	81.8	Confident	85.7	Confident	66 Å²	66	45.2 Å²	45.2	29%	0.289	22%	0.216	S	C	.	.			trans	-147.8	154.8	164.4	64.6	-82.6	0	0	0	110.5	T694 P697 P730 D734 L737	T694-F728 CarbonylContact O-C 3.58Å; T694-F728 WeakPolarHBondContact O-CA 3.4Å; P697-F728 HydrophobicContact CG-CB 4.43Å; P697-F728 HydrophobicContact CG-CD2 3.96Å; P697-F728 HydrophobicContact CG-CG 4.26Å; F728-P730 WeakPolarHBondContact O-CD 3.48Å; F728-D734 HydrophobicContact CE2-CB 4.03Å; F728-D734 HydrophobicContact CZ-CB 4.24Å; F728-L737 HydrophobicContact CE1-CD1 3.94Å; F728-L737 HydrophobicContact CZ-CD1 4.04Å
729	D	84	Confident	85.8	Confident	18 Å²	18	47.7 Å²	47.7	10%	0.096	23%	0.226	C	C	.	.			trans	-69.7	123.1	178.5	-169	-31.6	0	0	0	109.7	T694 W695 R731 D732	T694-D729 PolarHBondContact O-N 3.38Å; W695-D729 PolarHBondContact NE1-OD2 3.49Å; D729-R731 PolarHBondContact O-N 2.83Å; D729-R731 VanDerWaalsContact OD1-CB 3.3Å; D729-R731 WeakPolarHBondContact OD1-CB 3.24Å; D729-R731 WeakPolarHBondContact OD1-CG 3.14Å; D729-R731 IonicContact OD1-CZ 2.74Å; D729-R731 PolarHBondContact OD1-N 2.91Å; D729-R731 VanDerWaalsContact OD1-N 3.12Å; D729-R731 IonicContact OD1-NE 2.75Å; D729-R731 PolarHBondContact OD1-NE 3.27Å; D729-R731 IonicContact OD1-NH2 3.08Å; D729-R731 IonicContact OD2-CZ 3.17Å; D729-R731 VanDerWaalsContact OD2-CZ 3.31Å; D729-R731 IonicContact OD2-NE 2.85Å; D729-R731 PolarHBondContact OD2-NE 2.98Å; D729-R731 IonicContact OD2-NH2 3.81Å; D729-R731 PolarHBondContact OD2-NH2 3.24Å; D729-D732 PolarHBondContact O-N 3.15Å
730	P	81.8	Confident	85.7	Confident	125 Å²	125	46.9 Å²	46.9	81%	0.812	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	3.2	178.2	-24.5	35.5	0	0	0	115.3	F728	F728-P730 WeakPolarHBondContact O-CD 3.48Å
731	R	85	Confident	85.5	Confident	190 Å²	190	48.9 Å²	48.9	72%	0.717	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-9.7	171.6	-60	174.8	-69.6	-177.7	-1	113.5	W695 D729	W695-R731 HydrophobicContact CH2-CB 4.19Å; W695-R731 WeakPolarHBondContact CH2-O 3.28Å; W695-R731 HydrophobicContact CZ2-CB 3.79Å; D729-R731 PolarHBondContact O-N 2.83Å; D729-R731 VanDerWaalsContact OD1-CB 3.3Å; D729-R731 WeakPolarHBondContact OD1-CB 3.24Å; D729-R731 WeakPolarHBondContact OD1-CG 3.14Å; D729-R731 IonicContact OD1-CZ 2.74Å; D729-R731 PolarHBondContact OD1-N 2.91Å; D729-R731 VanDerWaalsContact OD1-N 3.12Å; D729-R731 IonicContact OD1-NE 2.75Å; D729-R731 PolarHBondContact OD1-NE 3.27Å; D729-R731 IonicContact OD1-NH2 3.08Å; D729-R731 IonicContact OD2-CZ 3.17Å; D729-R731 VanDerWaalsContact OD2-CZ 3.31Å; D729-R731 IonicContact OD2-NE 2.85Å; D729-R731 PolarHBondContact OD2-NE 2.98Å; D729-R731 IonicContact OD2-NH2 3.81Å; D729-R731 PolarHBondContact OD2-NH2 3.24Å
732	D	86.5	Confident	85	Confident	14 Å²	14	54.5 Å²	54.5	8%	0.075	26%	0.264	C	S	.	.	S	Bend	trans	-86.9	162.3	171.7	-159.9	1.8	0	0	0	111.1	W695 P697 S698 D729 D734	W695-D732 VanDerWaalsContact CA-OD2 3.29Å; W695-D732 WeakPolarHBondContact CA-OD2 3.12Å; W695-D732 WeakPolarHBondContact CB-OD2 3.3Å; W695-D732 HydrophobicContact CD2-CB 3.95Å; W695-D732 HydrophobicContact CE3-CB 3.83Å; W695-D732 HydrophobicContact CG-CB 4.33Å; W695-D732 HydrophobicContact CZ3-CB 4.21Å; P697-D732 WeakPolarHBondContact CD-OD2 3.2Å; P697-D732 HydrophobicContact CG-CB 4.22Å; S698-D732 WeakPolarHBondContact CB-OD1 3.28Å; S698-D732 VanDerWaalsContact CB-OD2 3.31Å; S698-D732 WeakPolarHBondContact CB-OD2 3.32Å; S698-D732 PolarHBondContact N-OD2 3.42Å; S698-D732 PolarHBondContact OG-OD1 2.72Å; S698-D732 PolarHBondContact OG-OD2 3.39Å; D729-D732 PolarHBondContact O-N 3.15Å; D732-D734 PolarHBondContact O-N 3.32Å
733	D	86.4	Confident	84.6	Confident	56 Å²	56	56.5 Å²	56.5	30%	0.299	27%	0.274	S	S	.	.			trans	-86.8	92.2	-173.9	-168.1	20.2	0	0	0	111.4	P697 R735 L736	P697-D733 WeakPolarHBondContact CB-O 3.44Å; D733-R735 PolarHBondContact O-N 2.88Å; D733-R735 IonicContact OD1-CZ 2.87Å; D733-R735 IonicContact OD1-NE 2.79Å; D733-R735 PolarHBondContact OD1-NE 2.86Å; D733-R735 IonicContact OD1-NH2 2.68Å; D733-R735 PolarHBondContact OD1-NH2 2.8Å; D733-R735 IonicContact OD2-NE 3.66Å; D733-R735 IonicContact OD2-NH2 3.18Å; D733-L736 HydrophobicContact CB-CD1 3.97Å; D733-L736 HydrophobicContact CB-CG 4.09Å; D733-L736 WeakPolarHBondContact O-CB 3.4Å; D733-L736 PolarHBondContact O-N 2.89Å
734	D	84.4	Confident	83.9	Confident	90 Å²	90	61.8 Å²	61.8	48%	0.481	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-44.8	-35.3	179	67.9	-24.6	0	0	0	114.5	F728 D732 L736 L737	F728-D734 HydrophobicContact CE2-CB 4.03Å; F728-D734 HydrophobicContact CZ-CB 4.24Å; D732-D734 PolarHBondContact O-N 3.32Å; D734-L736 PolarHBondContact O-N 2.94Å; D734-L737 WeakPolarHBondContact O-CB 3.11Å; D734-L737 VanDerWaalsContact O-CG 3.28Å; D734-L737 WeakPolarHBondContact O-CG 3.37Å; D734-L737 PolarHBondContact O-N 3.38Å
735	R	86.3	Confident	83.5	Confident	188 Å²	188	63 Å²	63	71%	0.709	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-59.1	-14	174.8	-67.9	167.3	-64.3	-172.3	1.2	114.4	D733	D733-R735 PolarHBondContact O-N 2.88Å; D733-R735 IonicContact OD1-CZ 2.87Å; D733-R735 IonicContact OD1-NE 2.79Å; D733-R735 PolarHBondContact OD1-NE 2.86Å; D733-R735 IonicContact OD1-NH2 2.68Å; D733-R735 PolarHBondContact OD1-NH2 2.8Å; D733-R735 IonicContact OD2-NE 3.66Å; D733-R735 IonicContact OD2-NH2 3.18Å
736	L	87.1	Confident	83.9	Confident	27 Å²	27	63.1 Å²	63.1	14%	0.141	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-89.3	-6.5	174.6	-57.1	176.7	0	0	0	113.9	P697 K701 D733 D734 Y739	P697-L736 HydrophobicContact CB-CB 3.79Å; P697-L736 WeakPolarHBondContact O-CB 3.17Å; K701-L736 HydrophobicContact CB-CD1 4.24Å; K701-L736 HydrophobicContact CD-CD1 3.85Å; K701-L736 HydrophobicContact CD-CD2 4.21Å; D733-L736 HydrophobicContact CB-CD1 3.97Å; D733-L736 HydrophobicContact CB-CG 4.09Å; D733-L736 WeakPolarHBondContact O-CB 3.4Å; D733-L736 PolarHBondContact O-N 2.89Å; D734-L736 PolarHBondContact O-N 2.94Å; L736-Y739 HydrophobicContact CD2-CD2 3.75Å; L736-Y739 HydrophobicContact CD2-CE2 4.32Å; L736-Y739 HydrophobicContact CD2-CG 4.46Å; L736-Y739 WeakPolarHBondContact O-CB 3.17Å; L736-Y739 PolarHBondContact O-N 2.03Å
737	L	85	Confident	84.5	Confident	15 Å²	15	64.8 Å²	64.8	8%	0.079	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-47.8	174.6	-71.2	169.5	0	0	0	113.1	P697 L700 F728 D734 Y739 I769	P697-L737 HydrophobicContact CB-CD2 4.43Å; P697-L737 HydrophobicContact CB-CG 4.44Å; P697-L737 HydrophobicContact CG-CD2 3.85Å; P697-L737 HydrophobicContact CG-CG 4.05Å; L700-L737 WeakPolarHBondContact CD1-O 3.44Å; F728-L737 HydrophobicContact CE1-CD1 3.94Å; F728-L737 HydrophobicContact CZ-CD1 4.04Å; D734-L737 WeakPolarHBondContact O-CB 3.11Å; D734-L737 VanDerWaalsContact O-CG 3.28Å; D734-L737 WeakPolarHBondContact O-CG 3.37Å; D734-L737 PolarHBondContact O-N 3.38Å; L737-Y739 VanDerWaalsContact C-N 3.29Å; L737-Y739 PolarHBondContact O-N 2.8Å; L737-I769 HydrophobicContact CB-CG1 4.49Å; L737-I769 HydrophobicContact CD2-CD1 4Å; L737-I769 HydrophobicContact CD2-CG1 3.85Å
738	P	87.3	Confident	85.1	Confident	49 Å²	49	61.2 Å²	61.2	32%	0.318	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	16.5	175.3	36.5	-38.3	0	0	0	113.9	L740 C741 N742	P738-L740 PolarHBondContact O-N 3.35Å; P738-C741 HydrophobicContact CB-CB 4.44Å; P738-C741 VanDerWaalsContact O-CB 3.23Å; P738-C741 WeakPolarHBondContact O-CB 3.35Å; P738-C741 PolarHBondContact O-N 3.39Å; P738-N742 PolarHBondContact O-ND2 3Å; P738-N742 VanDerWaalsContact O-ND2 3.1Å
739	Y	89.8	Confident	85.5	Confident	51 Å²	51	58.1 Å²	58.1	20%	0.2	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-56	-47.7	-170.9	-173.9	-97.9	0	0	0	112.7	K701 Y704 L736 L737 C741 N742 H743	K701-Y739 HydrophobicContact CB-CD1 4.12Å; K701-Y739 HydrophobicContact CB-CE1 4.26Å; K701-Y739 HydrophobicContact CB-CG 4.36Å; K701-Y739 HydrophobicContact CG-CD1 4.23Å; K701-Y739 HydrophobicContact CG-CE1 3.88Å; K701-Y739 HydrophobicContact CG-CE2 4.25Å; Y704-Y739 AromaticContact CD1-CE1 3.84Å; Y704-Y739 HydrophobicContact CD1-CE1 3.84Å; Y704-Y739 HydrophobicContact CG-CE1 4.03Å; L736-Y739 HydrophobicContact CD2-CD2 3.75Å; L736-Y739 HydrophobicContact CD2-CE2 4.32Å; L736-Y739 HydrophobicContact CD2-CG 4.46Å; L736-Y739 WeakPolarHBondContact O-CB 3.17Å; L736-Y739 PolarHBondContact O-N 2.03Å; L737-Y739 VanDerWaalsContact C-N 3.29Å; L737-Y739 PolarHBondContact O-N 2.8Å; Y739-C741 PolarHBondContact O-N 3.27Å; Y739-N742 PolarHBondContact O-N 3.48Å; Y739-N742 PolarHBondContact O-ND2 2.8Å; Y739-H743 AromaticContact CE1-NE2 3.78Å; Y739-H743 AromaticContact CZ-NE2 3.97Å; Y739-H743 PolarHBondContact O-CD2 2.92Å
740	L	87.4	Confident	85.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59.7	-30.2	177.4	-69.2	170.9	0	0	0	113.5	L700 Y704 I708 V720 P738 N742 H743 V746 V748	L700-L740 HydrophobicContact CB-CD1 4.22Å; L700-L740 HydrophobicContact CB-CG 4.37Å; L700-L740 HydrophobicContact CD2-CD1 3.76Å; Y704-L740 HydrophobicContact CD2-CD2 4.06Å; Y704-L740 HydrophobicContact CG-CD2 4.37Å; I708-L740 HydrophobicContact CD1-CD2 3.86Å; V720-L740 HydrophobicContact CB-CD1 4.3Å; V720-L740 HydrophobicContact CG1-CD1 3.91Å; V720-L740 HydrophobicContact CG2-CD1 4.33Å; P738-L740 PolarHBondContact O-N 3.35Å; L740-N742 PolarHBondContact O-N 2.89Å; L740-H743 PolarHBondContact O-N 2.92Å; L740-V746 HydrophobicContact CB-CG1 4.31Å; L740-V746 HydrophobicContact CD2-CG1 4.27Å; L740-V748 HydrophobicContact CB-CG2 3.55Å; L740-V748 HydrophobicContact CD1-CG1 4.43Å; L740-V748 HydrophobicContact CD1-CG2 3.89Å; L740-V748 HydrophobicContact CG-CG2 4.37Å
741	C	86.7	Confident	86.1	Confident	42 Å²	42	51.3 Å²	51.3	28%	0.284	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-69.5	-19.5	-176.5	-53.3	0	0	0	0	113.5	P738 Y739 H743 C771	P738-C741 HydrophobicContact CB-CB 4.44Å; P738-C741 VanDerWaalsContact O-CB 3.23Å; P738-C741 WeakPolarHBondContact O-CB 3.35Å; P738-C741 PolarHBondContact O-N 3.39Å; Y739-C741 PolarHBondContact O-N 3.27Å; C741-H743 PolarHBondContact O-N 3.34Å; C741-C771 VanDerWaalsContact CA-SG 3.5Å; C741-C771 HydrophobicContact CB-CB 3.66Å; C741-C771 WeakPolarHBondContact CB-SG 3.2Å; C741-C771 WeakPolarHBondContact SG-CA 3.4Å; C741-C771 WeakPolarHBondContact SG-CB 3.32Å; C741-C771 CovalentContact SG-SG 2.03Å; C741-C771 PolarHBondContact SG-SG 2.95Å
742	N	81.8	Confident	86.1	Confident	117 Å²	117	42.4 Å²	42.4	63%	0.626	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-81.4	2.3	-179.7	-61.8	-64.2	0	0	0	113.4	P738 Y739 L740	P738-N742 PolarHBondContact O-ND2 3Å; P738-N742 VanDerWaalsContact O-ND2 3.1Å; Y739-N742 PolarHBondContact O-N 3.48Å; Y739-N742 PolarHBondContact O-ND2 2.8Å; L740-N742 PolarHBondContact O-N 2.89Å
743	H	83.8	Confident	85.9	Confident	43 Å²	43	41.8 Å²	41.8	20%	0.199	22%	0.224	C	C	.	.	S	Bend	trans	-118.1	116.5	-169.9	-64.4	-51.3	0	0	0	112.9	Y704 Y739 L740 C741 G745 V746	Y704-H743 AromaticContact CD1-CD2 3.88Å; Y704-H743 AromaticContact CD1-NE2 3.76Å; Y704-H743 HydrophobicContact CD2-CB 4.43Å; Y704-H743 AromaticContact CD2-CD2 3.63Å; Y704-H743 AromaticContact CE1-CD2 3.66Å; Y704-H743 AromaticContact CE1-CE1 3.8Å; Y704-H743 AromaticContact CE1-CG 3.99Å; Y704-H743 AromaticContact CE1-NE2 3.53Å; Y704-H743 HydrophobicContact CE2-CB 3.62Å; Y704-H743 AromaticContact CE2-CD2 3.42Å; Y704-H743 VanDerWaalsContact CE2-CD2 3.42Å; Y704-H743 WeakPolarHBondContact CE2-CD2 3.48Å; Y704-H743 AromaticContact CE2-CG 3.48Å; Y704-H743 VanDerWaalsContact CE2-CG 3.48Å; Y704-H743 AromaticContact CG-CD2 3.86Å; Y704-H743 AromaticContact CZ-CD2 3.43Å; Y704-H743 VanDerWaalsContact CZ-CD2 3.43Å; Y704-H743 AromaticContact CZ-CE1 3.9Å; Y704-H743 AromaticContact CZ-CG 3.38Å; Y704-H743 AromaticContact CZ-ND1 3.69Å; Y704-H743 AromaticContact CZ-NE2 3.76Å; Y704-H743 PolarHBondContact OH-ND1 3.27Å; Y739-H743 AromaticContact CE1-NE2 3.78Å; Y739-H743 AromaticContact CZ-NE2 3.97Å; Y739-H743 PolarHBondContact O-CD2 2.92Å; L740-H743 PolarHBondContact O-N 2.92Å; C741-H743 PolarHBondContact O-N 3.34Å; H743-G745 PolarHBondContact O-N 3.37Å; H743-V746 HydrophobicContact CB-CG2 3.99Å; H743-V746 PolarHBondContact O-N 3.46Å
744	P	77.2	Confident	85	Confident	110 Å²	110	40.6 Å²	40.6	71%	0.714	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	135.8	-179.9	27.5	-34.1	0	0	0	111.3	R712	R712-P744 PolarHBondContact NH1-O 3.45Å
745	G	80.3	Confident	83.7	Confident	27 Å²	27	39.6 Å²	39.6	28%	0.278	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	10.8	-174	0	0	0	0	0	114.4	V718 H743	V718-G745 PolarHBondContact N-O 3.37Å; H743-G745 PolarHBondContact O-N 3.37Å
746	V	87.4	Confident	81.4	Confident	14 Å²	14	38.4 Å²	38.4	9%	0.085	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.3	168	-173.8	0	0	0	0	108.9	Y704 I708 V718 V720 L740 H743 V748	Y704-V746 HydrophobicContact CD2-CG2 4.35Å; Y704-V746 HydrophobicContact CE2-CG2 3.96Å; I708-V746 HydrophobicContact CD1-CG1 4.45Å; I708-V746 HydrophobicContact CG2-CG2 3.88Å; V718-V746 WeakPolarHBondContact O-CA 3Å; V720-V746 HydrophobicContact CG2-CG1 3.78Å; L740-V746 HydrophobicContact CB-CG1 4.31Å; L740-V746 HydrophobicContact CD2-CG1 4.27Å; H743-V746 HydrophobicContact CB-CG2 3.99Å; H743-V746 PolarHBondContact O-N 3.46Å; V746-V748 HydrophobicContact CG1-CG2 4.35Å
747	D	87.6	Confident	79.3	Confident	41 Å²	41	44.4 Å²	44.4	22%	0.219	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	115.8	177.9	-111.7	-19	0	0	0	109.9	V718 T719 V720 K773 R776	V718-D747 PolarHBondContact O-N 3.49Å; T719-D747 CarbonylContact C-O 3.59Å; T719-D747 VanDerWaalsContact CA-O 3.32Å; T719-D747 WeakPolarHBondContact CA-O 3.02Å; V720-D747 PolarHBondContact N-O 3.22Å; D747-K773 IonicContact OD1-NZ 3.22Å; D747-K773 PolarHBondContact OD1-NZ 3.44Å; D747-R776 IonicContact OD1-CZ 3.48Å; D747-R776 IonicContact OD1-NH1 2.75Å; D747-R776 PolarHBondContact OD1-NH1 3.12Å; D747-R776 IonicContact OD1-NH2 3.33Å; D747-R776 PolarHBondContact OD1-NH2 3.09Å; D747-R776 IonicContact OD2-CZ 2.64Å; D747-R776 IonicContact OD2-NH1 3.82Å; D747-R776 IonicContact OD2-NH2 3.52Å; D747-R776 PolarHBondContact OD2-NH2 3.15Å
748	V	89.5	Confident	77.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	143.8	-175.6	-165.8	0	0	0	0	111	V720 V722 L740 V746 I769 R776	V720-V748 HydrophobicContact CB-CG1 4.43Å; V720-V748 HydrophobicContact CB-CG2 4.44Å; V720-V748 WeakPolarHBondContact O-CA 3.24Å; V722-V748 HydrophobicContact CG2-CG1 4Å; L740-V748 HydrophobicContact CB-CG2 3.55Å; L740-V748 HydrophobicContact CD1-CG1 4.43Å; L740-V748 HydrophobicContact CD1-CG2 3.89Å; L740-V748 HydrophobicContact CG-CG2 4.37Å; V746-V748 HydrophobicContact CG1-CG2 4.35Å; V748-I769 HydrophobicContact CG1-CG2 4.1Å; V748-I769 WeakPolarHBondContact CG1-O 3.41Å; V748-R776 WeakPolarHBondContact O-CD 3.23Å; V748-R776 PolarHBondContact O-NH1 3.02Å
749	S	89.9	Confident	75.8	Confident	1 Å²	1	55 Å²	55	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.8	164.7	-65.3	0	0	0	0	108.9	V720 V721 V722 R776	V720-S749 PolarHBondContact O-N 3.23Å; V721-S749 WeakPolarHBondContact CA-O 3.32Å; V722-S749 PolarHBondContact N-O 3.12Å; S749-R776 WeakPolarHBondContact CA-O 3.46Å
750	A	88.9	Confident	73.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.6	-178.2	0	0	0	0	0	110.6	L766 I769 A770 R776 V777 M778	A750-L766 HydrophobicContact CB-CD2 4.37Å; A750-I769 HydrophobicContact CB-CB 4.38Å; A750-I769 HydrophobicContact CB-CG2 4.09Å; A750-A770 HydrophobicContact CB-CB 4.06Å; A750-R776 PolarHBondContact N-O 3.2Å; A750-V777 CarbonylContact O-C 3.6Å; A750-V777 WeakPolarHBondContact O-CA 3.35Å; A750-M778 PolarHBondContact O-N 2.88Å
751	I	89.4	Confident	71.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	112.5	173.5	-57.3	172.4	0	0	0	106.7	F630 V721 V722 I723 T724 I753 M778 M780 L786 F791 I795	F630-I751 HydrophobicContact CE1-CD1 3.78Å; F630-I751 HydrophobicContact CZ-CD1 3.73Å; V721-I751 HydrophobicContact CG1-CD1 3.57Å; V721-I751 HydrophobicContact CG1-CG1 4.23Å; V722-I751 PolarHBondContact O-N 2.91Å; I723-I751 HydrophobicContact CG1-CD1 4.38Å; I723-I751 HydrophobicContact CG2-CB 4.49Å; I723-I751 HydrophobicContact CG2-CG2 4.5Å; T724-I751 PolarHBondContact N-O 3.32Å; I751-I753 HydrophobicContact CG2-CD1 4.3Å; I751-I753 HydrophobicContact CG2-CG1 4.07Å; I751-M778 WeakPolarHBondContact CA-O 3.46Å; I751-M778 HydrophobicContact CG1-CB 4.36Å; I751-M778 HydrophobicContact CG1-CE 4.04Å; I751-M780 HydrophobicContact CG2-CG 4.28Å; I751-M780 HydrophobicContact CG2-SD 3.45Å; I751-M780 WeakPolarHBondContact CG2-SD 3.44Å; I751-L786 HydrophobicContact CG2-CD2 3.96Å; I751-F791 HydrophobicContact CD1-CE1 4.04Å; I751-F791 HydrophobicContact CD1-CZ 3.8Å; I751-F791 HydrophobicContact CG1-CZ 4.11Å; I751-F791 HydrophobicContact CG2-CZ 4.18Å; I751-I795 HydrophobicContact CD1-CD1 4.31Å
752	G	84.9	Confident	70.2	Confident	4 Å²	4	67.5 Å²	67.5	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.4	-179	0	0	0	0	0	110.6	T724 M778 G779 M780	T724-G752 WeakPolarHBondContact O-CA 3.45Å; G752-M778 PolarHBondContact N-O 3.36Å; G752-G779 CarbonylContact O-C 3.53Å; G752-G779 WeakPolarHBondContact O-CA 3.44Å; G752-M780 PolarHBondContact O-N 3.43Å
753	I	82.8	Confident	69.3	Low	1 Å²	1	65.8 Å²	65.8	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	91.9	-170.8	-50.9	174.7	0	0	0	108.9	I723 T724 D725 I751 M780 F783 L786	I723-I753 HydrophobicContact CG2-CD1 3.7Å; T724-I753 PolarHBondContact O-N 3.44Å; D725-I753 WeakPolarHBondContact CA-O 3.32Å; I751-I753 HydrophobicContact CG2-CD1 4.3Å; I751-I753 HydrophobicContact CG2-CG1 4.07Å; I753-M780 HydrophobicContact CG1-CB 4.35Å; I753-F783 HydrophobicContact CB-CD1 4.4Å; I753-F783 HydrophobicContact CB-CD2 4.42Å; I753-F783 HydrophobicContact CB-CE1 4.08Å; I753-F783 HydrophobicContact CB-CE2 4.08Å; I753-F783 HydrophobicContact CB-CZ 3.89Å; I753-F783 HydrophobicContact CD1-CD1 3.46Å; I753-F783 VanDerWaalsContact CD1-CD1 3.46Å; I753-F783 HydrophobicContact CD1-CE1 3.54Å; I753-F783 HydrophobicContact CD1-CG 4.14Å; I753-F783 HydrophobicContact CD1-CZ 4.25Å; I753-F783 HydrophobicContact CG1-CE1 4.36Å; I753-F783 HydrophobicContact CG2-CB 4.49Å; I753-F783 HydrophobicContact CG2-CD1 4.1Å; I753-F783 HydrophobicContact CG2-CD2 3.57Å; I753-F783 HydrophobicContact CG2-CE1 4.18Å; I753-F783 HydrophobicContact CG2-CE2 3.64Å; I753-F783 HydrophobicContact CG2-CG 3.79Å; I753-F783 HydrophobicContact CG2-CZ 3.94Å; I753-L786 HydrophobicContact CD1-CD1 3.66Å; I753-L786 HydrophobicContact CD1-CD2 3.98Å; I753-L786 HydrophobicContact CD1-CG 3.83Å
754	G	68.3	Low	68.4	Low	31 Å²	31	71 Å²	71	32%	0.32	37%	0.374	S	S	.	.			trans	-69.4	152.1	-173.1	0	0	0	0	0	113.2	M780	G754-M780 PolarHBondContact N-O 3.24Å; G754-M780 VanDerWaalsContact N-O 3.12Å
755	D	56.5	Low	68.4	Low	68 Å²	68	66.4 Å²	66.4	36%	0.364	35%	0.345	S	S	.	.			trans	-79.5	-178.6	168.7	79.4	30.7	0	0	0	112.4	R727 F757	R727-D755 IonicContact CZ-OD2 3.03Å; R727-D755 VanDerWaalsContact CZ-OD2 3.22Å; R727-D755 IonicContact NH1-OD2 3.8Å; R727-D755 PolarHBondContact NH1-OD2 3Å; R727-D755 IonicContact NH2-OD2 2.59Å; R727-D755 PolarHBondContact NH2-OD2 2.8Å; D755-F757 PolarHBondContact O-N 2.91Å; D755-F757 VanDerWaalsContact O-N 3.12Å; D755-F757 WeakPolarHBondContact OD1-CB 3.37Å; D755-F757 WeakPolarHBondContact OD1-CD2 3.41Å; D755-F757 PolarHBondContact OD1-N 3.45Å
756	M	37.4	Very low	68.5	Low	164 Å²	164	65.8 Å²	65.8	81%	0.808	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	3.6	-172	-64.1	-171.3	-68.2	0	0	115.4
757	F	43.6	Very low	68.2	Low	152 Å²	152	69.1 Å²	69.1	67%	0.667	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	8.5	-169.9	-61.1	-62	0	0	0	116.5	D755 Q759	D755-F757 PolarHBondContact O-N 2.91Å; D755-F757 VanDerWaalsContact O-N 3.12Å; D755-F757 WeakPolarHBondContact OD1-CB 3.37Å; D755-F757 WeakPolarHBondContact OD1-CD2 3.41Å; D755-F757 PolarHBondContact OD1-N 3.45Å; F757-Q759 PolarHBondContact O-N 3.47Å
758	E	50.5	Low	68.1	Low	158 Å²	158	68.9 Å²	68.9	74%	0.738	35%	0.351	S	S	*	.			trans	48.1	35.1	171.3	-62.5	-162.8	137.4	0	0	115.5	R781	E758-R781 IonicContact OE1-NH2 2.6Å
759	Q	48.5	Very low	67.9	Low	130 Å²	130	69.1 Å²	69.1	61%	0.607	35%	0.352	S	S	*	.			trans	-76.1	135.4	178.3	-63.7	-164.6	-0.3	0	0	111.8	F757	F757-Q759 PolarHBondContact O-N 3.47Å
760	V	44.9	Very low	67.7	Low	132 Å²	132	69 Å²	69	80%	0.8	35%	0.352	S	S	*	.	S	Bend	trans	-88.2	-9.2	-167.4	-178.3	0	0	0	0	112.9
761	E	46.2	Very low	67.6	Low	170 Å²	170	70.7 Å²	70.7	79%	0.794	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-21.4	-167.1	-58	-171.6	165.7	0	0	114.4	N763	E761-N763 PolarHBondContact O-N 2.8Å; E761-N763 VanDerWaalsContact O-N 3.15Å
762	E	55.6	Low	67.1	Low	54 Å²	54	78.1 Å²	78.1	25%	0.252	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	7.6	-173.9	-67.5	173.4	159.9	0	0	114.4	R727 S765	R727-E762 VanDerWaalsContact CG-OE1 3.27Å; R727-E762 WeakPolarHBondContact CG-OE1 3.38Å; R727-E762 IonicContact CZ-OE1 2.82Å; R727-E762 IonicContact NE-OE1 3.79Å; R727-E762 PolarHBondContact NE-OE1 3.25Å; R727-E762 IonicContact NE-OE2 3.64Å; R727-E762 IonicContact NH2-OE1 3.87Å; R727-E762 PolarHBondContact NH2-OE1 3.45Å; R727-E762 IonicContact NH2-OE2 3.31Å; E762-S765 PolarHBondContact O-OG 3.38Å; E762-S765 VanDerWaalsContact O-OG 3.11Å
763	N	62.3	Low	66.9	Low	82 Å²	82	82 Å²	82	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-84.3	-25.4	-179.1	-152.4	-1.9	0	0	0	113	E761 Q767	E761-N763 PolarHBondContact O-N 2.8Å; E761-N763 VanDerWaalsContact O-N 3.15Å; N763-Q767 VanDerWaalsContact O-CG 3.29Å; N763-Q767 WeakPolarHBondContact O-CG 3.2Å; N763-Q767 PolarHBondContact O-N 3.09Å; N763-Q767 VanDerWaalsContact O-N 3.08Å
764	E	65.2	Low	66	Low	151 Å²	151	91.3 Å²	91.3	71%	0.706	46%	0.457	S	S	*	.	H	α-helix	trans	-72.6	-32.5	-178.8	-63.7	-167.5	171.1	0	0	113	S768	E764-S768 WeakPolarHBondContact O-CB 3.48Å; E764-S768 PolarHBondContact O-N 2.98Å; E764-S768 PolarHBondContact O-OG 2.92Å
765	S	77.1	Confident	66.1	Low	15 Å²	15	93.1 Å²	93.1	11%	0.105	48%	0.475	C	S	.	.	H	α-helix	trans	-64.8	-50.1	174.4	59.2	0	0	0	0	110.6	G726 E762 Q767 S768 I769	G726-S765 PolarHBondContact O-OG 3.36Å; E762-S765 PolarHBondContact O-OG 3.38Å; E762-S765 VanDerWaalsContact O-OG 3.11Å; S765-Q767 PolarHBondContact O-N 2.68Å; S765-S768 WeakPolarHBondContact O-CB 3.3Å; S765-S768 PolarHBondContact O-N 3.02Å; S765-S768 VanDerWaalsContact O-N 3.07Å; S765-I769 WeakPolarHBondContact O-CG1 3.29Å; S765-I769 PolarHBondContact O-N 3.33Å
766	L	81.8	Confident	67.2	Low	13 Å²	13	92.6 Å²	92.6	7%	0.068	47%	0.468	C	S	.	.	H	α-helix	trans	-60.5	-41	177.8	-64.6	168.2	0	0	0	112.4	T724 A750 S768 I769 A770 V777	T724-L766 HydrophobicContact CG2-CD2 4.01Å; A750-L766 HydrophobicContact CB-CD2 4.37Å; L766-S768 VanDerWaalsContact C-N 3.34Å; L766-I769 PolarHBondContact O-N 2.94Å; L766-A770 WeakPolarHBondContact O-CB 3.44Å; L766-A770 PolarHBondContact O-N 3.5Å; L766-V777 HydrophobicContact CB-CG1 3.93Å; L766-V777 HydrophobicContact CB-CG2 4.46Å; L766-V777 HydrophobicContact CD1-CG1 4.48Å
767	Q	82.4	Confident	69.4	Low	85 Å²	85	86.5 Å²	86.5	40%	0.397	44%	0.44	S	S	.	.	H	α-helix	trans	-64.5	-37.2	173.3	-73.3	175.3	28.1	0	0	112.4	N763 S765 A770 C771 Q772 V777	N763-Q767 VanDerWaalsContact O-CG 3.29Å; N763-Q767 WeakPolarHBondContact O-CG 3.2Å; N763-Q767 PolarHBondContact O-N 3.09Å; N763-Q767 VanDerWaalsContact O-N 3.08Å; S765-Q767 PolarHBondContact O-N 2.68Å; Q767-A770 CarbonylContact O-C 3.47Å; Q767-A770 PolarHBondContact O-N 3.33Å; Q767-C771 PolarHBondContact O-N 2.63Å; Q767-Q772 WeakPolarHBondContact O-CA 3.38Å; Q767-Q772 PolarHBondContact O-N 2.67Å; Q767-V777 HydrophobicContact CG-CG2 3.99Å
768	S	83.7	Confident	71.3	Confident	36 Å²	36	79.6 Å²	79.6	25%	0.252	41%	0.41	S	S	.	.	H	α-helix	trans	-66.9	-39.6	176.5	-60.1	0	0	0	0	112.1	E764 S765 L766 C771	E764-S768 WeakPolarHBondContact O-CB 3.48Å; E764-S768 PolarHBondContact O-N 2.98Å; E764-S768 PolarHBondContact O-OG 2.92Å; S765-S768 WeakPolarHBondContact O-CB 3.3Å; S765-S768 PolarHBondContact O-N 3.02Å; S765-S768 VanDerWaalsContact O-N 3.07Å; L766-S768 VanDerWaalsContact C-N 3.34Å; S768-C771 PolarHBondContact O-N 2.8Å
769	I	85.9	Confident	72.6	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-44.5	173.2	-63.3	170.5	0	0	0	110.8	T696 L700 V722 L737 V748 A750 S765 L766 C771	T696-I769 HydrophobicContact CG2-CD1 4.01Å; L700-I769 HydrophobicContact CD1-CD1 4.32Å; L700-I769 HydrophobicContact CD1-CG1 3.87Å; L700-I769 HydrophobicContact CD1-CG2 4.11Å; L700-I769 HydrophobicContact CD2-CG2 4.39Å; V722-I769 HydrophobicContact CB-CG2 4.05Å; V722-I769 HydrophobicContact CG1-CG2 4.23Å; V722-I769 HydrophobicContact CG2-CG2 3.73Å; L737-I769 HydrophobicContact CB-CG1 4.49Å; L737-I769 HydrophobicContact CD2-CD1 4Å; L737-I769 HydrophobicContact CD2-CG1 3.85Å; V748-I769 HydrophobicContact CG1-CG2 4.1Å; V748-I769 WeakPolarHBondContact CG1-O 3.41Å; A750-I769 HydrophobicContact CB-CB 4.38Å; A750-I769 HydrophobicContact CB-CG2 4.09Å; S765-I769 WeakPolarHBondContact O-CG1 3.29Å; S765-I769 PolarHBondContact O-N 3.33Å; L766-I769 PolarHBondContact O-N 2.94Å; I769-C771 PolarHBondContact O-N 3.45Å; I769-C771 VanDerWaalsContact O-N 3.13Å
770	A	85.7	Confident	74.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	19.2	177.6	0	0	0	0	0	114.3	A750 L766 Q767 Q772 K773 R776 V777	A750-A770 HydrophobicContact CB-CB 4.06Å; L766-A770 WeakPolarHBondContact O-CB 3.44Å; L766-A770 PolarHBondContact O-N 3.5Å; Q767-A770 CarbonylContact O-C 3.47Å; Q767-A770 PolarHBondContact O-N 3.33Å; A770-Q772 VanDerWaalsContact C-N 3.25Å; A770-Q772 PolarHBondContact O-N 3.36Å; A770-K773 WeakPolarHBondContact O-CB 3.11Å; A770-K773 PolarHBondContact O-N 3.29Å; A770-K773 VanDerWaalsContact O-N 3.07Å; A770-R776 HydrophobicContact CB-CB 4.36Å; A770-V777 HydrophobicContact CB-CG2 3.57Å
771	C	86.2	Confident	75.6	Confident	34 Å²	34	73.1 Å²	73.1	23%	0.23	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	31.9	174.4	-45.7	0	0	0	0	114.8	C741 Q767 S768 I769 K773	C741-C771 VanDerWaalsContact CA-SG 3.5Å; C741-C771 HydrophobicContact CB-CB 3.66Å; C741-C771 WeakPolarHBondContact CB-SG 3.2Å; C741-C771 WeakPolarHBondContact SG-CA 3.4Å; C741-C771 WeakPolarHBondContact SG-CB 3.32Å; C741-C771 CovalentContact SG-SG 2.03Å; C741-C771 PolarHBondContact SG-SG 2.95Å; Q767-C771 PolarHBondContact O-N 2.63Å; S768-C771 PolarHBondContact O-N 2.8Å; I769-C771 PolarHBondContact O-N 3.45Å; I769-C771 VanDerWaalsContact O-N 3.13Å; C771-K773 HydrophobicContact CB-CG 4.44Å; C771-K773 PolarHBondContact O-N 3.49Å; C771-K773 VanDerWaalsContact O-N 3.14Å
772	Q	80.7	Confident	77.3	Confident	157 Å²	157	73.1 Å²	73.1	73%	0.734	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	23.2	-174.7	-60.1	-179.3	-14.5	0	0	114.1	Q767 A770 E774	Q767-Q772 WeakPolarHBondContact O-CA 3.38Å; Q767-Q772 PolarHBondContact O-N 2.67Å; A770-Q772 VanDerWaalsContact C-N 3.25Å; A770-Q772 PolarHBondContact O-N 3.36Å; Q772-E774 PolarHBondContact O-N 3.3Å
773	K	80	Confident	78.5	Confident	84 Å²	84	71.5 Å²	71.5	37%	0.365	37%	0.365	S	S	.	.			trans	-85.1	99.8	175.8	-64.7	-179.3	-178.7	-175.4	0	110.3	D747 A770 C771 G775 R776	D747-K773 IonicContact OD1-NZ 3.22Å; D747-K773 PolarHBondContact OD1-NZ 3.44Å; A770-K773 WeakPolarHBondContact O-CB 3.11Å; A770-K773 PolarHBondContact O-N 3.29Å; A770-K773 VanDerWaalsContact O-N 3.07Å; C771-K773 HydrophobicContact CB-CG 4.44Å; C771-K773 PolarHBondContact O-N 3.49Å; C771-K773 VanDerWaalsContact O-N 3.14Å; K773-G775 PolarHBondContact O-N 3.32Å; K773-R776 HydrophobicContact CB-CB 4.22Å; K773-R776 HydrophobicContact CB-CG 4.19Å; K773-R776 PolarHBondContact O-N 2.91Å
774	E	64.6	Low	79.4	Confident	198 Å²	198	70.3 Å²	70.3	93%	0.925	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	137.4	169.2	-67	-171.7	161.4	0	0	110.8	Q772	Q772-E774 PolarHBondContact O-N 3.3Å
775	G	70.4	Confident	80.3	Confident	68 Å²	68	65.9 Å²	65.9	70%	0.701	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-8.1	-173.8	0	0	0	0	0	115.9	K773	K773-G775 PolarHBondContact O-N 3.32Å
776	R	79.5	Confident	80.6	Confident	57 Å²	57	65.1 Å²	65.1	22%	0.215	34%	0.343	C	S	.	.	S	Bend	trans	-104.1	-5.3	172	-67.5	-157.7	-176.4	172.6	-1.4	115.7	D747 V748 S749 A750 A770 K773	D747-R776 IonicContact OD1-CZ 3.48Å; D747-R776 IonicContact OD1-NH1 2.75Å; D747-R776 PolarHBondContact OD1-NH1 3.12Å; D747-R776 IonicContact OD1-NH2 3.33Å; D747-R776 PolarHBondContact OD1-NH2 3.09Å; D747-R776 IonicContact OD2-CZ 2.64Å; D747-R776 IonicContact OD2-NH1 3.82Å; D747-R776 IonicContact OD2-NH2 3.52Å; D747-R776 PolarHBondContact OD2-NH2 3.15Å; V748-R776 WeakPolarHBondContact O-CD 3.23Å; V748-R776 PolarHBondContact O-NH1 3.02Å; S749-R776 WeakPolarHBondContact CA-O 3.46Å; A750-R776 PolarHBondContact N-O 3.2Å; A770-R776 HydrophobicContact CB-CB 4.36Å; K773-R776 HydrophobicContact CB-CB 4.22Å; K773-R776 HydrophobicContact CB-CG 4.19Å; K773-R776 PolarHBondContact O-N 2.91Å
777	V	83.3	Confident	80.5	Confident	36 Å²	36	67 Å²	67	22%	0.218	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.1	161	-178.6	0	0	0	0	108.2	A750 L766 Q767 A770	A750-V777 CarbonylContact O-C 3.6Å; A750-V777 WeakPolarHBondContact O-CA 3.35Å; L766-V777 HydrophobicContact CB-CG1 3.93Å; L766-V777 HydrophobicContact CB-CG2 4.46Å; L766-V777 HydrophobicContact CD1-CG1 4.48Å; Q767-V777 HydrophobicContact CG-CG2 3.99Å; A770-V777 HydrophobicContact CB-CG2 3.57Å
778	M	83.3	Confident	80.5	Confident	7 Å²	7	65.1 Å²	65.1	3%	0.034	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	93.6	177.7	-74.6	165.4	-73.6	0	0	108.7	A750 I751 G752 F791 I795	A750-M778 PolarHBondContact O-N 2.88Å; I751-M778 WeakPolarHBondContact CA-O 3.46Å; I751-M778 HydrophobicContact CG1-CB 4.36Å; I751-M778 HydrophobicContact CG1-CE 4.04Å; G752-M778 PolarHBondContact N-O 3.36Å; M778-F791 HydrophobicContact CB-CE2 4.14Å; M778-F791 HydrophobicContact CB-CZ 4.44Å; M778-F791 HydrophobicContact CG-CE2 4.41Å; M778-F791 HydrophobicContact SD-CE2 4.09Å; M778-F791 HydrophobicContact SD-CZ 4.29Å; M778-I795 HydrophobicContact CE-CD1 3.51Å; M778-I795 HydrophobicContact SD-CD1 3.77Å
779	G	77.5	Confident	80	Confident	66 Å²	66	68.9 Å²	68.9	68%	0.68	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	135.1	174	0	0	0	0	0	111.5	G752	G752-G779 CarbonylContact O-C 3.53Å; G752-G779 WeakPolarHBondContact O-CA 3.44Å
780	M	78.9	Confident	79.6	Confident	24 Å²	24	76.9 Å²	76.9	12%	0.118	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	154.8	-177.8	-55	-178.9	71.6	0	0	109.8	I751 G752 I753 G754 D785 L786 F791	I751-M780 HydrophobicContact CG2-CG 4.28Å; I751-M780 HydrophobicContact CG2-SD 3.45Å; I751-M780 WeakPolarHBondContact CG2-SD 3.44Å; G752-M780 PolarHBondContact O-N 3.43Å; I753-M780 HydrophobicContact CG1-CB 4.35Å; G754-M780 PolarHBondContact N-O 3.24Å; G754-M780 VanDerWaalsContact N-O 3.12Å; M780-D785 HydrophobicContact CE-CB 3.59Å; M780-D785 WeakPolarHBondContact CE-O 3.26Å; M780-L786 HydrophobicContact CE-CD2 4.18Å; M780-L786 HydrophobicContact CE-CG 4.41Å; M780-L786 HydrophobicContact SD-CD2 3.83Å; M780-F791 HydrophobicContact CE-CB 4.35Å; M780-F791 HydrophobicContact CE-CD1 3.68Å; M780-F791 HydrophobicContact CE-CD2 3.76Å; M780-F791 HydrophobicContact CE-CE1 3.85Å; M780-F791 HydrophobicContact CE-CE2 3.95Å; M780-F791 HydrophobicContact CE-CG 3.63Å; M780-F791 HydrophobicContact CE-CZ 3.99Å; M780-F791 HydrophobicContact CG-CE2 4.41Å; M780-F791 HydrophobicContact SD-CD1 4.14Å; M780-F791 HydrophobicContact SD-CD2 4.02Å; M780-F791 HydrophobicContact SD-CE1 3.67Å; M780-F791 HydrophobicContact SD-CE2 3.55Å; M780-F791 VanDerWaalsContact SD-CE2 3.55Å; M780-F791 HydrophobicContact SD-CG 4.3Å; M780-F791 HydrophobicContact SD-CZ 3.36Å; M780-F791 WeakPolarHBondContact SD-CZ 3.47Å
781	R	77.1	Confident	79.4	Confident	195 Å²	195	78 Å²	78	74%	0.736	41%	0.409	S	S	*	.	S	Bend	trans	-96.5	-21.6	-174.8	-77.7	178.8	162.3	176.9	-9.2	113.5	E758 D785	E758-R781 IonicContact OE1-NH2 2.6Å; R781-D785 PolarHBondContact N-OD2 2.75Å
782	R	81.3	Confident	79.2	Confident	169 Å²	169	76.6 Å²	76.6	64%	0.638	40%	0.4	S	S	*	.			trans	-149.1	148	-179.7	-57.8	-179.4	172.5	175.2	-3.5	110.7	A784 D785	R782-A784 HydrophobicContact CB-CB 4.35Å; R782-A784 PolarHBondContact O-N 2.79Å; R782-D785 PolarHBondContact N-OD2 2.94Å; R782-D785 VanDerWaalsContact O-CB 3.28Å; R782-D785 WeakPolarHBondContact O-CB 3.13Å; R782-D785 PolarHBondContact O-N 3.22Å
783	F	81.6	Confident	79	Confident	20 Å²	20	72.7 Å²	72.7	9%	0.088	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-62.1	-22.3	170.4	-69.6	-93.6	0	0	0	113.1	V619 N623 L626 E627 I753 D785 L786	V619-F783 HydrophobicContact CB-CZ 4.43Å; V619-F783 HydrophobicContact CG1-CE1 3.84Å; V619-F783 HydrophobicContact CG1-CZ 4Å; V619-F783 HydrophobicContact CG2-CE1 4.4Å; V619-F783 HydrophobicContact CG2-CZ 4.08Å; N623-F783 HydrophobicContact CB-CB 3.91Å; N623-F783 HydrophobicContact CB-CD1 3.74Å; N623-F783 HydrophobicContact CB-CD2 3.74Å; N623-F783 HydrophobicContact CB-CE1 4.17Å; N623-F783 HydrophobicContact CB-CE2 4.2Å; N623-F783 HydrophobicContact CB-CG 3.51Å; N623-F783 HydrophobicContact CB-CZ 4.4Å; L626-F783 HydrophobicContact CB-CB 4.49Å; L626-F783 HydrophobicContact CD1-CB 3.92Å; E627-F783 HydrophobicContact CG-CD1 4.26Å; E627-F783 HydrophobicContact CG-CE1 4.45Å; I753-F783 HydrophobicContact CB-CD1 4.4Å; I753-F783 HydrophobicContact CB-CD2 4.42Å; I753-F783 HydrophobicContact CB-CE1 4.08Å; I753-F783 HydrophobicContact CB-CE2 4.08Å; I753-F783 HydrophobicContact CB-CZ 3.89Å; I753-F783 HydrophobicContact CD1-CD1 3.46Å; I753-F783 VanDerWaalsContact CD1-CD1 3.46Å; I753-F783 HydrophobicContact CD1-CE1 3.54Å; I753-F783 HydrophobicContact CD1-CG 4.14Å; I753-F783 HydrophobicContact CD1-CZ 4.25Å; I753-F783 HydrophobicContact CG1-CE1 4.36Å; I753-F783 HydrophobicContact CG2-CB 4.49Å; I753-F783 HydrophobicContact CG2-CD1 4.1Å; I753-F783 HydrophobicContact CG2-CD2 3.57Å; I753-F783 HydrophobicContact CG2-CE1 4.18Å; I753-F783 HydrophobicContact CG2-CE2 3.64Å; I753-F783 HydrophobicContact CG2-CG 3.79Å; I753-F783 HydrophobicContact CG2-CZ 3.94Å; F783-D785 VanDerWaalsContact C-N 3.26Å; F783-D785 PolarHBondContact O-N 3.03Å; F783-L786 HydrophobicContact CD1-CD1 4.27Å; F783-L786 WeakPolarHBondContact O-CB 3.37Å; F783-L786 PolarHBondContact O-N 3.07Å
784	A	81.5	Confident	79	Confident	57 Å²	57	74 Å²	74	47%	0.471	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.2	-33.4	171.9	0	0	0	0	0	112.4	R782 L786 V787	R782-A784 HydrophobicContact CB-CB 4.35Å; R782-A784 PolarHBondContact O-N 2.79Å; A784-L786 PolarHBondContact O-N 3.41Å; A784-V787 PolarHBondContact O-N 3.32Å; A784-V787 VanDerWaalsContact O-N 3.16Å
785	D	84.2	Confident	79.9	Confident	58 Å²	58	64.6 Å²	64.6	31%	0.31	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-66.1	-21.5	-177.4	-49.8	-20.6	0	0	0	111.3	M780 R781 R782 F783 V787 A788	M780-D785 HydrophobicContact CE-CB 3.59Å; M780-D785 WeakPolarHBondContact CE-O 3.26Å; R781-D785 PolarHBondContact N-OD2 2.75Å; R782-D785 PolarHBondContact N-OD2 2.94Å; R782-D785 VanDerWaalsContact O-CB 3.28Å; R782-D785 WeakPolarHBondContact O-CB 3.13Å; R782-D785 PolarHBondContact O-N 3.22Å; F783-D785 VanDerWaalsContact C-N 3.26Å; F783-D785 PolarHBondContact O-N 3.03Å; D785-V787 PolarHBondContact O-N 2.71Å; D785-A788 WeakPolarHBondContact O-CB 3.46Å; D785-A788 PolarHBondContact O-N 2.69Å
786	L	83.3	Confident	80.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58.1	-31.9	174.2	-74.9	173.8	0	0	0	112.9	E627 F630 I723 I751 I753 M780 F783 A784 F791	E627-L786 HydrophobicContact CG-CD1 4.1Å; F630-L786 HydrophobicContact CB-CB 4.03Å; F630-L786 HydrophobicContact CB-CD1 4.44Å; F630-L786 HydrophobicContact CD1-CD2 4.18Å; F630-L786 HydrophobicContact CD2-CB 4.27Å; F630-L786 HydrophobicContact CD2-CD2 4.35Å; F630-L786 WeakPolarHBondContact CD2-O 3.26Å; F630-L786 HydrophobicContact CE1-CD2 4.38Å; F630-L786 HydrophobicContact CG-CB 4.18Å; F630-L786 HydrophobicContact CG-CD2 4.15Å; I723-L786 HydrophobicContact CG2-CD1 4.44Å; I751-L786 HydrophobicContact CG2-CD2 3.96Å; I753-L786 HydrophobicContact CD1-CD1 3.66Å; I753-L786 HydrophobicContact CD1-CD2 3.98Å; I753-L786 HydrophobicContact CD1-CG 3.83Å; M780-L786 HydrophobicContact CE-CD2 4.18Å; M780-L786 HydrophobicContact CE-CG 4.41Å; M780-L786 HydrophobicContact SD-CD2 3.83Å; F783-L786 HydrophobicContact CD1-CD1 4.27Å; F783-L786 WeakPolarHBondContact O-CB 3.37Å; F783-L786 PolarHBondContact O-N 3.07Å; A784-L786 PolarHBondContact O-N 3.41Å; L786-F791 HydrophobicContact CD2-CD1 4.49Å; L786-F791 HydrophobicContact CD2-CE1 3.88Å
787	V	80.2	Confident	80.1	Confident	51 Å²	51	64 Å²	64	31%	0.309	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-92.7	-3.1	-172.8	-165.4	0	0	0	0	111.4	L626 A784 D785	L626-V787 HydrophobicContact CD2-CG2 4.12Å; A784-V787 PolarHBondContact O-N 3.32Å; A784-V787 VanDerWaalsContact O-N 3.16Å; D785-V787 PolarHBondContact O-N 2.71Å
788	A	81.3	Confident	79.9	Confident	47 Å²	47	64.7 Å²	64.7	39%	0.388	34%	0.338	S	S	.	.			trans	-71.3	133.5	177.4	0	0	0	0	0	111.9	D785 E790 F791 I792	D785-A788 WeakPolarHBondContact O-CB 3.46Å; D785-A788 PolarHBondContact O-N 2.69Å; A788-E790 VanDerWaalsContact C-N 3.32Å; A788-E790 PolarHBondContact O-N 3Å; A788-F791 PolarHBondContact O-N 3.46Å; A788-I792 PolarHBondContact O-N 2.64Å
789	E	72.8	Confident	79.7	Confident	114 Å²	114	64.4 Å²	64.4	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-57.5	-40.9	-175.6	-69.6	-134.5	95.7	0	0	113.2	R637 F791 I792 D793	R637-E789 IonicContact CZ-OE1 3.82Å; R637-E789 IonicContact NE-OE1 2.7Å; R637-E789 IonicContact NH2-OE1 3.66Å; R637-E789 PolarHBondContact NH2-OE1 3.1Å; E789-F791 PolarHBondContact O-N 3.05Å; E789-I792 CarbonylContact O-C 3.54Å; E789-I792 WeakPolarHBondContact O-CA 3.03Å; E789-I792 PolarHBondContact O-N 3.4Å; E789-D793 PolarHBondContact O-N 3.29Å
790	E	77.8	Confident	79.6	Confident	173 Å²	173	61.7 Å²	61.7	81%	0.808	31%	0.307	S	S	*	.	H	α-helix	trans	-56.7	-35.4	177.7	-60.6	-178.5	-178.5	0	0	112.9	A788 K794	A788-E790 VanDerWaalsContact C-N 3.32Å; A788-E790 PolarHBondContact O-N 3Å; E790-K794 WeakPolarHBondContact O-CB 3.27Å; E790-K794 PolarHBondContact O-N 2.82Å
791	F	81.8	Confident	78.9	Confident	22 Å²	22	65.3 Å²	65.3	10%	0.096	33%	0.332	C	S	.	.	H	α-helix	trans	-76	-35.8	176.5	-176.2	-107	0	0	0	111.7	F630 I751 M778 M780 L786 A788 E789 K794 I795	F630-F791 HydrophobicContact CD2-CD1 4.49Å; F630-F791 HydrophobicContact CD2-CE1 4.41Å; F630-F791 AromaticContact CE2-CD1 3.87Å; F630-F791 HydrophobicContact CE2-CD1 3.87Å; F630-F791 AromaticContact CE2-CE1 3.58Å; F630-F791 HydrophobicContact CE2-CE1 3.58Å; F630-F791 AromaticContact CZ-CE1 3.8Å; F630-F791 HydrophobicContact CZ-CE1 3.8Å; I751-F791 HydrophobicContact CD1-CE1 4.04Å; I751-F791 HydrophobicContact CD1-CZ 3.8Å; I751-F791 HydrophobicContact CG1-CZ 4.11Å; I751-F791 HydrophobicContact CG2-CZ 4.18Å; M778-F791 HydrophobicContact CB-CE2 4.14Å; M778-F791 HydrophobicContact CB-CZ 4.44Å; M778-F791 HydrophobicContact CG-CE2 4.41Å; M778-F791 HydrophobicContact SD-CE2 4.09Å; M778-F791 HydrophobicContact SD-CZ 4.29Å; M780-F791 HydrophobicContact CE-CB 4.35Å; M780-F791 HydrophobicContact CE-CD1 3.68Å; M780-F791 HydrophobicContact CE-CD2 3.76Å; M780-F791 HydrophobicContact CE-CE1 3.85Å; M780-F791 HydrophobicContact CE-CE2 3.95Å; M780-F791 HydrophobicContact CE-CG 3.63Å; M780-F791 HydrophobicContact CE-CZ 3.99Å; M780-F791 HydrophobicContact CG-CE2 4.41Å; M780-F791 HydrophobicContact SD-CD1 4.14Å; M780-F791 HydrophobicContact SD-CD2 4.02Å; M780-F791 HydrophobicContact SD-CE1 3.67Å; M780-F791 HydrophobicContact SD-CE2 3.55Å; M780-F791 VanDerWaalsContact SD-CE2 3.55Å; M780-F791 HydrophobicContact SD-CG 4.3Å; M780-F791 HydrophobicContact SD-CZ 3.36Å; M780-F791 WeakPolarHBondContact SD-CZ 3.47Å; L786-F791 HydrophobicContact CD2-CD1 4.49Å; L786-F791 HydrophobicContact CD2-CE1 3.88Å; A788-F791 PolarHBondContact O-N 3.46Å; E789-F791 PolarHBondContact O-N 3.05Å; F791-K794 WeakPolarHBondContact O-CB 3.1Å; F791-K794 PolarHBondContact O-N 2.98Å; F791-I795 PolarHBondContact O-N 2.91Å
792	I	81.7	Confident	78.4	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-38.8	177.9	-55.8	171	0	0	0	110.7	F630 N633 R637 A788 E789 K794 I795 E796	F630-I792 HydrophobicContact CD2-CG1 4.41Å; F630-I792 HydrophobicContact CE2-CG1 4.5Å; N633-I792 HydrophobicContact CB-CD1 4.11Å; R637-I792 VanDerWaalsContact CD-CG2 3.45Å; A788-I792 PolarHBondContact O-N 2.64Å; E789-I792 CarbonylContact O-C 3.54Å; E789-I792 WeakPolarHBondContact O-CA 3.03Å; E789-I792 PolarHBondContact O-N 3.4Å; I792-K794 VanDerWaalsContact C-N 3.29Å; I792-K794 PolarHBondContact O-N 3.17Å; I792-I795 WeakPolarHBondContact O-CG2 3.31Å; I792-I795 PolarHBondContact O-N 2.87Å; I792-E796 VanDerWaalsContact O-CB 3.3Å; I792-E796 WeakPolarHBondContact O-CB 3.33Å; I792-E796 PolarHBondContact O-N 3.06Å
793	D	76.7	Confident	77.7	Confident	74 Å²	74	57 Å²	57	40%	0.396	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-43.9	169.5	-73.9	-42.1	0	0	0	110.9	R637 E789 E796 T797	R637-D793 IonicContact CZ-OD1 3Å; R637-D793 IonicContact NH1-OD1 2.62Å; R637-D793 PolarHBondContact NH1-OD1 3.38Å; R637-D793 IonicContact NH2-OD1 2.69Å; R637-D793 PolarHBondContact NH2-OD1 3.46Å; R637-D793 IonicContact NH2-OD2 3.36Å; E789-D793 PolarHBondContact O-N 3.29Å; D793-E796 WeakPolarHBondContact O-CB 3.4Å; D793-E796 PolarHBondContact O-N 3.21Å; D793-T797 PolarHBondContact O-N 3.06Å
794	K	80.4	Confident	76.8	Confident	113 Å²	113	60.4 Å²	60.4	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-62.9	-48.9	177	-172	179.1	178.7	-178.2	0	112.2	E790 F791 I792 E796 T797 V798	E790-K794 WeakPolarHBondContact O-CB 3.27Å; E790-K794 PolarHBondContact O-N 2.82Å; F791-K794 WeakPolarHBondContact O-CB 3.1Å; F791-K794 PolarHBondContact O-N 2.98Å; I792-K794 VanDerWaalsContact C-N 3.29Å; I792-K794 PolarHBondContact O-N 3.17Å; K794-E796 VanDerWaalsContact C-N 3.29Å; K794-E796 PolarHBondContact O-N 2.61Å; K794-T797 PolarHBondContact O-N 3.21Å; K794-T797 PolarHBondContact O-OG1 2.93Å; K794-V798 PolarHBondContact O-N 2.73Å
795	I	83.1	Confident	75.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-66.5	-32.2	178.8	-155.5	71.4	0	0	0	111.7	F630 T634 I751 M778 F791 I792 T797 V798 L799	F630-I795 HydrophobicContact CE2-CG2 4.08Å; F630-I795 HydrophobicContact CZ-CG1 4.29Å; F630-I795 HydrophobicContact CZ-CG2 4.18Å; T634-I795 HydrophobicContact CG2-CG2 3.82Å; I751-I795 HydrophobicContact CD1-CD1 4.31Å; M778-I795 HydrophobicContact CE-CD1 3.51Å; M778-I795 HydrophobicContact SD-CD1 3.77Å; F791-I795 PolarHBondContact O-N 2.91Å; I792-I795 WeakPolarHBondContact O-CG2 3.31Å; I792-I795 PolarHBondContact O-N 2.87Å; I795-T797 PolarHBondContact O-N 2.76Å; I795-V798 PolarHBondContact O-N 2.75Å; I795-V798 VanDerWaalsContact O-N 3.13Å; I795-L799 HydrophobicContact CG1-CD1 3.99Å; I795-L799 HydrophobicContact CG1-CG 4.24Å; I795-L799 HydrophobicContact CG2-CD1 4.4Å; I795-L799 WeakPolarHBondContact O-CB 3.48Å; I795-L799 VanDerWaalsContact O-CG 3.31Å; I795-L799 WeakPolarHBondContact O-CG 3.12Å; I795-L799 PolarHBondContact O-N 3.35Å
796	E	78.4	Confident	74.6	Confident	21 Å²	21	63.5 Å²	63.5	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-58.9	-45.8	176.2	-159.5	-169.6	123.9	0	0	111.3	K602 R637 L638 I792 D793 K794 V798 L799 C800	K602-E796 WeakPolarHBondContact CD-OE1 3.44Å; K602-E796 WeakPolarHBondContact CE-OE1 3.48Å; K602-E796 IonicContact NZ-OE1 2.72Å; K602-E796 PolarHBondContact NZ-OE1 3.49Å; K602-E796 IonicContact NZ-OE2 3.6Å; R637-E796 IonicContact NH1-OE2 3.17Å; R637-E796 PolarHBondContact NH1-OE2 3.14Å; R637-E796 VanDerWaalsContact NH1-OE2 3.09Å; L638-E796 HydrophobicContact CD2-CG 3.77Å; L638-E796 HydrophobicContact CG-CG 4.46Å; I792-E796 VanDerWaalsContact O-CB 3.3Å; I792-E796 WeakPolarHBondContact O-CB 3.33Å; I792-E796 PolarHBondContact O-N 3.06Å; D793-E796 WeakPolarHBondContact O-CB 3.4Å; D793-E796 PolarHBondContact O-N 3.21Å; K794-E796 VanDerWaalsContact C-N 3.29Å; K794-E796 PolarHBondContact O-N 2.61Å; E796-V798 VanDerWaalsContact C-N 3.29Å; E796-V798 PolarHBondContact O-N 3.43Å; E796-L799 PolarHBondContact O-N 3.09Å; E796-C800 PolarHBondContact O-N 3.43Å
797	T	76.9	Confident	73.1	Confident	92 Å²	92	66.9 Å²	66.9	56%	0.564	37%	0.37	S	S	*	.	H	α-helix	trans	-65.3	-28.5	175.8	64.9	0	0	0	0	113.9	D793 K794 I795	D793-T797 PolarHBondContact O-N 3.06Å; K794-T797 PolarHBondContact O-N 3.21Å; K794-T797 PolarHBondContact O-OG1 2.93Å; I795-T797 PolarHBondContact O-N 2.76Å
798	V	78.9	Confident	71.8	Confident	49 Å²	49	67.6 Å²	67.6	30%	0.297	38%	0.375	S	S	.	.	H	α-helix	trans	-77.4	-34.8	176.1	174.5	0	0	0	0	111.5	K794 I795 E796	K794-V798 PolarHBondContact O-N 2.73Å; I795-V798 PolarHBondContact O-N 2.75Å; I795-V798 VanDerWaalsContact O-N 3.13Å; E796-V798 VanDerWaalsContact C-N 3.29Å; E796-V798 PolarHBondContact O-N 3.43Å
799	L	78.7	Confident	70	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	40%	0.402	C	S	.	.	H	α-helix	trans	-80.8	-28.4	179.9	-69.7	172.2	0	0	0	113.1	L607 I609 T634 L638 T719 V721 I795 E796	L607-L799 WeakPolarHBondContact CD1-O 3.38Å; I609-L799 HydrophobicContact CD1-CD2 4.33Å; I609-L799 HydrophobicContact CG2-CD2 4.24Å; T634-L799 HydrophobicContact CG2-CD1 3.4Å; L638-L799 HydrophobicContact CD1-CB 4.1Å; L638-L799 HydrophobicContact CD1-CD1 3.9Å; T719-L799 HydrophobicContact CG2-CD2 3.7Å; V721-L799 HydrophobicContact CG2-CD2 3.79Å; I795-L799 HydrophobicContact CG1-CD1 3.99Å; I795-L799 HydrophobicContact CG1-CG 4.24Å; I795-L799 HydrophobicContact CG2-CD1 4.4Å; I795-L799 WeakPolarHBondContact O-CB 3.48Å; I795-L799 VanDerWaalsContact O-CG 3.31Å; I795-L799 WeakPolarHBondContact O-CG 3.12Å; I795-L799 PolarHBondContact O-N 3.35Å; E796-L799 PolarHBondContact O-N 3.09Å
800	C	75.5	Confident	68.7	Low	10 Å²	10	73.8 Å²	73.8	7%	0.068	41%	0.405	C	S	.	.			trans	-138.5	82.1	179.8	-174	0	0	0	0	111.1	C604 L607 L638 E796 D802	C604-C800 HydrophobicContact CB-CB 4.13Å; C604-C800 WeakPolarHBondContact CB-SG 3.44Å; C604-C800 WeakPolarHBondContact SG-CB 3.49Å; C604-C800 CovalentContact SG-SG 2.03Å; C604-C800 PolarHBondContact SG-SG 2.95Å; L607-C800 HydrophobicContact CD1-CB 4.16Å; L638-C800 HydrophobicContact CD2-CB 4Å; E796-C800 PolarHBondContact O-N 3.43Å; C800-D802 VanDerWaalsContact C-N 3.31Å; C800-D802 PolarHBondContact O-N 2.83Å
801	P	64.3	Low	66.9	Low	99 Å²	99	71.5 Å²	71.5	64%	0.643	41%	0.405	S	S	*	.	S	Bend	trans	-69.9	-21.1	-173.5	25.6	-34.6	0	0	0	115
802	D	65.9	Low	64.7	Low	140 Å²	140	73.5 Å²	73.5	75%	0.749	42%	0.421	S	S	*	.	S	Bend	trans	-136.6	78.1	179.6	-70.3	-74.8	0	0	0	111.2	C800	C800-D802 VanDerWaalsContact C-N 3.31Å; C800-D802 PolarHBondContact O-N 2.83Å
803	P	66.8	Low	62.5	Low	51 Å²	51	81.8 Å²	81.8	33%	0.331	46%	0.457	S	S	.	.			trans	-75.6	126	-180	28.5	-32.8	0	0	0	112.2	K602 I805	K602-P803 HydrophobicContact CB-CB 4.35Å; P803-I805 PolarHBondContact O-N 2.99Å
804	V	63.3	Low	60.6	Low	90 Å²	90	83 Å²	83	55%	0.545	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	101.7	170.2	-175.6	0	0	0	0	108.8	R603 I806	R603-V804 WeakPolarHBondContact CB-O 3.37Å; R603-V804 PolarHBondContact N-O 3.07Å; R603-V804 WeakPolarHBondContact O-CA 3.21Å; R603-V804 WeakPolarHBondContact O-CB 3.09Å; R603-V804 PolarHBondContact O-N 2.82Å; V804-I806 HydrophobicContact CG1-CD1 4.48Å; V804-I806 HydrophobicContact CG1-CG1 4.04Å; V804-I806 PolarHBondContact O-N 3.03Å
805	I	61.8	Low	58.5	Low	105 Å²	105	84.8 Å²	84.8	54%	0.538	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	106.1	-179.4	-62	175.5	0	0	0	109.3	C600 P803	C600-I805 HydrophobicContact CB-CG2 3.32Å; P803-I805 PolarHBondContact O-N 2.99Å
806	I	57.8	Low	56.3	Low	75 Å²	75	90.6 Å²	90.6	39%	0.385	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	100.5	178.8	-54.3	-170.5	0	0	0	110.2	C600 E601 R603 V804	C600-I806 CarbonylContact C-O 3.55Å; C600-I806 WeakPolarHBondContact CA-O 3.48Å; E601-I806 PolarHBondContact N-O 2.72Å; E601-I806 PolarHBondContact O-N 3.01Å; R603-I806 HydrophobicContact CB-CD1 4.35Å; R603-I806 HydrophobicContact CB-CG1 4.5Å; R603-I806 HydrophobicContact CG-CD1 4.1Å; R603-I806 HydrophobicContact CG-CG1 4.33Å; V804-I806 HydrophobicContact CG1-CD1 4.48Å; V804-I806 HydrophobicContact CG1-CG1 4.04Å; V804-I806 PolarHBondContact O-N 3.03Å
807	C	51.8	Low	54.3	Low	72 Å²	72	93.3 Å²	93.3	49%	0.486	55%	0.545	S	S	.	.			trans	-77.1	140.8	168.6	-54.7	0	0	0	0	110.7	C600	C600-C807 HydrophobicContact CB-CB 3.9Å; C600-C807 WeakPolarHBondContact CB-SG 3.49Å; C600-C807 VanDerWaalsContact SG-CA 3.51Å; C600-C807 WeakPolarHBondContact SG-CB 3.48Å; C600-C807 CovalentContact SG-SG 2.04Å; C600-C807 PolarHBondContact SG-SG 2.95Å
808	P	51.8	Low	52.7	Low	65 Å²	65	92.1 Å²	92.1	42%	0.422	54%	0.537	S	S	.	.			trans	-62.1	141.9	163.6	-20.2	32.7	0	0	0	111.2	L810	P808-L810 HydrophobicContact CB-CD1 4.25Å; P808-L810 HydrophobicContact CB-CG 4.48Å; P808-L810 PolarHBondContact O-N 3.29Å
809	D	43.3	Very low	50.9	Low	180 Å²	180	92.8 Å²	92.8	96%	0.963	55%	0.548	S	S	*	.	S	Bend	trans	-74	66.5	172.5	-97.7	-36.2	0	0	0	111.1
810	L	45.7	Very low	49.7	Very low	112 Å²	112	96.6 Å²	96.6	59%	0.586	57%	0.574	S	S	*	*	S	Bend	trans	-118.2	141.7	173.5	-76	167.6	0	0	0	109.5	P808 C812	P808-L810 HydrophobicContact CB-CD1 4.25Å; P808-L810 HydrophobicContact CB-CG 4.48Å; P808-L810 PolarHBondContact O-N 3.29Å; L810-C812 PolarHBondContact O-N 2.81Å; L810-C812 PolarHBondContact O-SG 2.75Å
811	P	40	Very low	48.8	Very low	124 Å²	124	96.5 Å²	96.5	81%	0.805	57%	0.574	S	S	*	*			trans	-77.5	70.5	177.8	32.6	-35.3	0	0	0	110.7	K813	P811-K813 PolarHBondContact O-N 2.87Å
812	C	35.1	Very low	48.4	Very low	65 Å²	65	95 Å²	95	44%	0.439	56%	0.563	S	S	.	*			trans	-61.9	99.8	-177.6	-49.1	0	0	0	0	110.8	C598 L810	C598-C812 HydrophobicContact CB-CB 3.9Å; C598-C812 WeakPolarHBondContact CB-SG 3.49Å; C598-C812 WeakPolarHBondContact SG-CB 3.49Å; C598-C812 CovalentContact SG-SG 2.03Å; C598-C812 PolarHBondContact SG-SG 2.85Å; L810-C812 PolarHBondContact O-N 2.81Å; L810-C812 PolarHBondContact O-SG 2.75Å
813	K	36.1	Very low	48.4	Very low	180 Å²	180	96.2 Å²	96.2	78%	0.783	56%	0.564	S	S	*	*			trans	-69.1	140.1	166.3	-68.9	-178.8	178.3	178.4	0	108.3	P811 E815	P811-K813 PolarHBondContact O-N 2.87Å; K813-E815 PolarHBondContact O-N 2.91Å
814	S	37.3	Very low	48.7	Very low	100 Å²	100	98 Å²	98	70%	0.699	56%	0.564	S	S	*	*	S	Bend	trans	-79.2	25.4	-170	60.5	0	0	0	0	115
815	E	35.7	Very low	49.8	Very low	150 Å²	150	94.6 Å²	94.6	70%	0.701	54%	0.544	S	S	*	.	S	Bend	trans	-140.6	145.6	165.5	-67.3	-176.6	161.4	0	0	106.1	K813 A817	K813-E815 PolarHBondContact O-N 2.91Å; E815-A817 PolarHBondContact O-N 3.39Å
816	P	37.4	Very low	51.1	Low	122 Å²	122	89.7 Å²	89.7	79%	0.792	52%	0.519	S	S	*	.			trans	-63.6	93.7	161.4	28.7	-31.9	0	0	0	107	V818	P816-V818 PolarHBondContact O-N 3.02Å
817	A	36.6	Very low	52.8	Low	77 Å²	77	86.1 Å²	86.1	64%	0.636	50%	0.501	S	S	*	.			trans	-64.6	86.2	166.8	0	0	0	0	0	106.6	E815 A819	E815-A817 PolarHBondContact O-N 3.39Å; A817-A819 PolarHBondContact O-N 3.18Å
818	V	42.3	Very low	54.8	Low	68 Å²	68	82.8 Å²	82.8	41%	0.412	48%	0.478	S	S	.	.			trans	-41.6	116.8	169.6	177.3	0	0	0	0	105.6	P816 S820 R1011	P816-V818 PolarHBondContact O-N 3.02Å; V818-S820 PolarHBondContact O-N 3.31Å; V818-R1011 HydrophobicContact CG1-CB 4.4Å; V818-R1011 HydrophobicContact CG1-CG 3.95Å; V818-R1011 HydrophobicContact CG2-CG 3.9Å
819	A	41.4	Very low	56.9	Low	63 Å²	63	79.7 Å²	79.7	52%	0.521	46%	0.458	S	S	.	.			trans	-57.3	114.7	177.4	0	0	0	0	0	106.2	A817 C821 C1014	A817-A819 PolarHBondContact O-N 3.18Å; A819-C821 PolarHBondContact O-N 2.78Å; A819-C1014 WeakPolarHBondContact O-CB 3.44Å
820	S	53	Low	59.5	Low	80 Å²	80	71.1 Å²	71.1	56%	0.559	41%	0.412	S	S	*	.			trans	-52.8	129.3	164.5	54.5	0	0	0	0	106	V818 V822	V818-S820 PolarHBondContact O-N 3.31Å; S820-V822 CarbonylContact O-C 3.57Å; S820-V822 WeakPolarHBondContact O-CA 3.28Å; S820-V822 PolarHBondContact O-N 3.34Å
821	C	57.3	Low	61.9	Low	8 Å²	8	65.8 Å²	65.8	5%	0.054	38%	0.384	C	S	.	.	S	Bend	trans	-46.7	-11.3	-175.4	-87.8	0	0	0	0	116.2	A819 Q823 R824 L857 C1014	A819-C821 PolarHBondContact O-N 2.78Å; C821-Q823 PolarHBondContact O-N 2.97Å; C821-R824 PolarHBondContact O-N 2.8Å; C821-R824 VanDerWaalsContact O-N 3.09Å; C821-L857 HydrophobicContact CB-CD2 4.28Å; C821-L857 WeakPolarHBondContact SG-CD2 3.35Å; C821-C1014 HydrophobicContact CB-CB 4.12Å; C821-C1014 WeakPolarHBondContact CB-SG 3.2Å; C821-C1014 WeakPolarHBondContact SG-CA 3.44Å; C821-C1014 WeakPolarHBondContact SG-CB 3.07Å; C821-C1014 CovalentContact SG-SG 2.04Å; C821-C1014 PolarHBondContact SG-SG 3.45Å
822	V	57	Low	64.6	Low	68 Å²	68	59.9 Å²	59.9	41%	0.412	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	118.3	157.7	-165.4	0	0	0	0	111.3	S820 T858	S820-V822 CarbonylContact O-C 3.57Å; S820-V822 WeakPolarHBondContact O-CA 3.28Å; S820-V822 PolarHBondContact O-N 3.34Å; V822-T858 HydrophobicContact CG2-CG2 4.32Å
823	Q	64.6	Low	67.4	Low	165 Å²	165	56.8 Å²	56.8	77%	0.771	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	0.6	-175.5	-52.1	179.5	0.1	0	0	117	C821 T867	C821-Q823 PolarHBondContact O-N 2.97Å; Q823-T867 CarbonylContact C-O 3.57Å; Q823-T867 VanDerWaalsContact CA-O 3.26Å; Q823-T867 WeakPolarHBondContact CA-O 3.49Å; Q823-T867 PolarHBondContact N-O 3.41Å
824	R	72.7	Confident	70.1	Confident	88 Å²	88	48.2 Å²	48.2	33%	0.332	29%	0.288	S	S	.	.			trans	-108.8	116.4	165	-165.3	-179.9	-175.8	170.3	-7.9	111	C821 V826 T867 E936 C1014	C821-R824 PolarHBondContact O-N 2.8Å; C821-R824 VanDerWaalsContact O-N 3.09Å; R824-V826 HydrophobicContact CB-CG2 4.49Å; R824-V826 HydrophobicContact CG-CG2 3.91Å; R824-V826 PolarHBondContact O-N 3.38Å; R824-T867 PolarHBondContact N-O 3.45Å; R824-E936 IonicContact CZ-OE2 2.63Å; R824-E936 IonicContact NE-OE2 3.81Å; R824-E936 VanDerWaalsContact NH2-CD 3.3Å; R824-E936 IonicContact NH2-OE1 3.14Å; R824-E936 PolarHBondContact NH2-OE1 3.36Å; R824-E936 IonicContact NH2-OE2 3.77Å; R824-E936 PolarHBondContact NH2-OE2 3.46Å; R824-C1014 WeakPolarHBondContact CD-OXT 3.43Å; R824-C1014 PolarHBondContact NH1-O 2.91Å; R824-C1014 PolarHBondContact NH1-OXT 3.33Å
825	P	86.2	Confident	72.6	Confident	20 Å²	20	43.5 Å²	43.5	13%	0.13	26%	0.255	C	S	.	.			trans	-74.1	117.4	170.7	29.2	-32.8	0	0	0	110.8	D866 N934 A935 E936	P825-D866 WeakPolarHBondContact CB-O 3.32Å; P825-D866 VanDerWaalsContact CD-O 3.29Å; P825-D866 WeakPolarHBondContact CD-O 3.32Å; P825-D866 VanDerWaalsContact CG-O 3.22Å; P825-D866 WeakPolarHBondContact CG-O 3.42Å; P825-N934 WeakPolarHBondContact CG-O 3.21Å; P825-A935 HydrophobicContact CB-CB 3.83Å; P825-A935 HydrophobicContact CG-CB 4.49Å; P825-A935 WeakPolarHBondContact O-CA 3.14Å; P825-A935 WeakPolarHBondContact O-CB 3.47Å; P825-E936 PolarHBondContact O-N 3.3Å
826	V	89.9	Confident	75.2	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.3	174.6	-170.4	0	0	0	0	110.1	R824 V828 K868 A869 R870 R932 E936 A938	R824-V826 HydrophobicContact CB-CG2 4.49Å; R824-V826 HydrophobicContact CG-CG2 3.91Å; R824-V826 PolarHBondContact O-N 3.38Å; V826-V828 HydrophobicContact CB-CG2 4.46Å; V826-V828 HydrophobicContact CG1-CG2 3.71Å; V826-K868 PolarHBondContact N-O 2.9Å; V826-A869 CarbonylContact O-C 3.51Å; V826-A869 VanDerWaalsContact O-CA 3.29Å; V826-A869 WeakPolarHBondContact O-CA 3.33Å; V826-R870 PolarHBondContact O-N 3.18Å; V826-R932 PolarHBondContact O-NH2 2.87Å; V826-E936 CarbonylContact C-O 3.53Å; V826-E936 WeakPolarHBondContact CA-O 3.42Å; V826-E936 HydrophobicContact CG1-CB 4.47Å; V826-A938 HydrophobicContact CG1-CB 4.09Å
827	D	92.8	Very high	77.6	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	102.8	167.8	-76.9	-14.8	0	0	0	108.1	R870 L888 S931 R932 E936 L937 A938	D827-R870 VanDerWaalsContact CG-NH2 3.32Å; D827-R870 IonicContact OD1-CZ 3.69Å; D827-R870 IonicContact OD1-NE 2.94Å; D827-R870 PolarHBondContact OD1-NE 2.7Å; D827-R870 IonicContact OD1-NH2 3.05Å; D827-R870 PolarHBondContact OD1-NH2 2.84Å; D827-R870 IonicContact OD2-CZ 2.68Å; D827-R870 IonicContact OD2-NE 2.81Å; D827-R870 IonicContact OD2-NH2 2.7Å; D827-R870 PolarHBondContact OD2-NH2 2.9Å; D827-L888 HydrophobicContact CB-CD1 4.37Å; D827-L888 HydrophobicContact CB-CD2 3.96Å; D827-S931 WeakPolarHBondContact OD2-CA 3.38Å; D827-S931 WeakPolarHBondContact OD2-CB 3.34Å; D827-R932 IonicContact OD1-CZ 2.66Å; D827-R932 IonicContact OD1-NE 2.75Å; D827-R932 PolarHBondContact OD1-NE 3.22Å; D827-R932 IonicContact OD1-NH2 3.31Å; D827-R932 PolarHBondContact OD1-NH2 2.81Å; D827-R932 PolarHBondContact OD2-N 3.3Å; D827-R932 IonicContact OD2-NE 2.66Å; D827-E936 PolarHBondContact N-O 2.86Å; D827-L937 HydrophobicContact CB-CD1 3.94Å; D827-L937 WeakPolarHBondContact O-CA 3.35Å; D827-A938 PolarHBondContact O-N 3.44Å
828	V	94.6	Very high	80	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.7	-178.9	-173.4	0	0	0	0	109.6	V826 F830 R870 L871 A872 A938 V940 I1013	V826-V828 HydrophobicContact CB-CG2 4.46Å; V826-V828 HydrophobicContact CG1-CG2 3.71Å; V828-F830 HydrophobicContact CG1-CD2 3.98Å; V828-F830 HydrophobicContact CG1-CE2 3.63Å; V828-F830 HydrophobicContact CG1-CZ 4.04Å; V828-R870 PolarHBondContact N-O 3.33Å; V828-L871 HydrophobicContact CB-CD1 4.49Å; V828-L871 HydrophobicContact CB-CG 4.32Å; V828-L871 CarbonylContact O-C 3.48Å; V828-L871 VanDerWaalsContact O-CA 3.29Å; V828-L871 WeakPolarHBondContact O-CA 3.43Å; V828-A872 PolarHBondContact O-N 2.91Å; V828-A938 CarbonylContact C-O 3.17Å; V828-A938 WeakPolarHBondContact CA-O 3.17Å; V828-A938 HydrophobicContact CG2-CB 4.48Å; V828-V940 HydrophobicContact CG1-CG2 3.82Å; V828-I1013 HydrophobicContact CG2-CG2 4.07Å
829	I	96.8	Very high	82.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.7	173.4	-59.9	-179.1	0	0	0	107.8	M831 A872 L888 L922 V923 L937 A938 F939 V940	I829-M831 HydrophobicContact CG2-CG 4.39Å; I829-M831 HydrophobicContact CG2-SD 3.95Å; I829-A872 HydrophobicContact CG1-CB 4.31Å; I829-L888 HydrophobicContact CG1-CD2 4.28Å; I829-L922 HydrophobicContact CD1-CB 4.07Å; I829-L922 HydrophobicContact CD1-CD1 4.46Å; I829-L922 HydrophobicContact CG2-CD1 3.8Å; I829-V923 HydrophobicContact CD1-CG2 3.55Å; I829-L937 HydrophobicContact CD1-CD1 3.91Å; I829-L937 HydrophobicContact CG1-CD1 4.37Å; I829-A938 PolarHBondContact N-O 3.26Å; I829-F939 HydrophobicContact CB-CD1 4.29Å; I829-F939 HydrophobicContact CD1-CE1 4.17Å; I829-F939 HydrophobicContact CD1-CZ 4.14Å; I829-F939 HydrophobicContact CG2-CD1 4.29Å; I829-F939 HydrophobicContact CG2-CE1 4.36Å; I829-F939 WeakPolarHBondContact O-CA 3.48Å; I829-V940 PolarHBondContact O-N 3.44Å
830	F	97.6	Very high	84.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.7	170.2	-74.7	-82.5	0	0	0	110.2	V828 F849 I850 V853 L871 A872 L873 V874 V940 I942 F1009	V828-F830 HydrophobicContact CG1-CD2 3.98Å; V828-F830 HydrophobicContact CG1-CE2 3.63Å; V828-F830 HydrophobicContact CG1-CZ 4.04Å; F830-F849 HydrophobicContact CE1-CE1 4.5Å; F830-I850 HydrophobicContact CB-CD1 4.27Å; F830-I850 HydrophobicContact CD1-CD1 4.24Å; F830-I850 HydrophobicContact CD1-CG1 3.74Å; F830-I850 HydrophobicContact CD2-CG1 4.44Å; F830-I850 HydrophobicContact CD2-CG2 3.88Å; F830-I850 HydrophobicContact CE1-CG1 3.96Å; F830-I850 HydrophobicContact CE2-CG2 4.05Å; F830-I850 HydrophobicContact CG-CD1 4.27Å; F830-I850 HydrophobicContact CG-CG1 3.98Å; F830-I850 HydrophobicContact CG-CG2 4.19Å; F830-I850 HydrophobicContact CZ-CG1 4.41Å; F830-I850 HydrophobicContact CZ-CG2 4.49Å; F830-V853 HydrophobicContact CE2-CG1 4.42Å; F830-V853 HydrophobicContact CZ-CB 4.27Å; F830-V853 HydrophobicContact CZ-CG1 3.97Å; F830-V853 HydrophobicContact CZ-CG2 4.49Å; F830-L871 HydrophobicContact CE2-CD2 3.97Å; F830-L871 HydrophobicContact CE2-CG 4.2Å; F830-A872 PolarHBondContact N-O 2.9Å; F830-L873 HydrophobicContact CB-CD1 3.67Å; F830-L873 WeakPolarHBondContact O-CA 3.4Å; F830-V874 PolarHBondContact O-N 3.1Å; F830-V940 WeakPolarHBondContact CA-O 3.28Å; F830-V940 HydrophobicContact CD1-CB 3.75Å; F830-V940 HydrophobicContact CD1-CG1 3.78Å; F830-V940 HydrophobicContact CE1-CB 3.85Å; F830-V940 HydrophobicContact CE1-CG1 3.63Å; F830-V940 HydrophobicContact CE1-CG2 4.34Å; F830-V940 HydrophobicContact CG-CB 4.49Å; F830-I942 HydrophobicContact CD1-CD1 3.99Å; F830-I942 HydrophobicContact CE1-CD1 4.29Å; F830-F1009 HydrophobicContact CE1-CZ 4.28Å; F830-F1009 HydrophobicContact CZ-CZ 4.42Å
831	M	96.6	Very high	86.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	96.6	176	-63.2	-63.2	-60.5	0	0	106.6	I829 V874 F876 A914 A918 F939 V940 F941 I942	I829-M831 HydrophobicContact CG2-CG 4.39Å; I829-M831 HydrophobicContact CG2-SD 3.95Å; M831-V874 HydrophobicContact CE-CB 4.24Å; M831-V874 HydrophobicContact CE-CG1 4.4Å; M831-V874 HydrophobicContact SD-CB 3.86Å; M831-V874 HydrophobicContact SD-CG2 4.04Å; M831-F876 HydrophobicContact CB-CD1 4.43Å; M831-F876 HydrophobicContact CB-CE1 4.23Å; M831-F876 HydrophobicContact CE-CD1 4.37Å; M831-A914 VanDerWaalsContact CE-C 3.5Å; M831-A914 HydrophobicContact CE-CB 3.6Å; M831-A914 WeakPolarHBondContact CE-O 3.42Å; M831-A918 HydrophobicContact CE-CB 4.06Å; M831-A918 HydrophobicContact SD-CB 3.61Å; M831-F939 HydrophobicContact CG-CD1 4.29Å; M831-V940 PolarHBondContact N-O 2.96Å; M831-F941 HydrophobicContact CB-CD1 3.46Å; M831-F941 VanDerWaalsContact CB-CD1 3.46Å; M831-F941 HydrophobicContact CB-CE1 3.84Å; M831-F941 HydrophobicContact CB-CG 4.33Å; M831-F941 HydrophobicContact CG-CD1 3.81Å; M831-F941 HydrophobicContact CG-CE1 3.64Å; M831-F941 HydrophobicContact CG-CZ 4.48Å; M831-F941 WeakPolarHBondContact O-CA 3.34Å; M831-I942 PolarHBondContact O-N 3.4Å
832	L	95.8	Very high	87.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.4	-172.8	176.4	59	0	0	0	110.7	M838 H843 A846 K847 I850 L873 V874 Q875 F876 I942	L832-M838 HydrophobicContact CD1-CE 3.56Å; L832-H843 VanDerWaalsContact CD2-CE1 3.44Å; L832-H843 WeakPolarHBondContact CD2-CE1 3.49Å; L832-A846 HydrophobicContact CD1-CB 3.52Å; L832-K847 HydrophobicContact CD2-CG 4.08Å; L832-I850 HydrophobicContact CD2-CD1 4.17Å; L832-L873 HydrophobicContact CB-CD1 3.72Å; L832-L873 HydrophobicContact CD2-CD1 4.37Å; L832-V874 PolarHBondContact N-O 3.34Å; L832-Q875 CarbonylContact O-C 3.59Å; L832-Q875 WeakPolarHBondContact O-CA 3.45Å; L832-F876 VanDerWaalsContact C-CE1 3.44Å; L832-F876 VanDerWaalsContact O-CD1 3.24Å; L832-F876 WeakPolarHBondContact O-CD1 3.46Å; L832-F876 PolarHBondContact O-N 3.25Å; L832-I942 HydrophobicContact CD1-CB 4.18Å; L832-I942 HydrophobicContact CD1-CG2 4.26Å
833	D	93.8	Very high	89.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132.7	175.5	-157	-49.5	0	0	0	110.4	S835 M838 H843 F876 S909 I942 T943	D833-S835 WeakPolarHBondContact OD1-CB 3.31Å; D833-S835 PolarHBondContact OD1-N 2.91Å; D833-S835 PolarHBondContact OD1-OG 3.37Å; D833-M838 HydrophobicContact CB-SD 3.82Å; D833-H843 PolarHBondContact O-ND1 2.9Å; D833-H843 VanDerWaalsContact O-ND1 3.14Å; D833-F876 HydrophobicContact CB-CE1 4.07Å; D833-F876 HydrophobicContact CB-CE2 4.22Å; D833-F876 HydrophobicContact CB-CZ 3.68Å; D833-S909 PolarHBondContact OD2-OG 2.93Å; D833-I942 VanDerWaalsContact CB-O 3.29Å; D833-I942 WeakPolarHBondContact CB-O 3.46Å; D833-I942 PolarHBondContact N-O 3.32Å; D833-T943 PolarHBondContact OD2-OG1 2.95Å
834	G	92.6	Very high	90.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.			trans	-117.2	18.8	179.5	0	0	0	0	0	112.7	F876 D906 S907	G834-F876 PolarHBondContact N-O 2.87Å; G834-D906 PolarHBondContact O-N 2.84Å; G834-S907 PolarHBondContact O-N 3.35Å
835	S	91.1	Very high	91.8	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.014	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-78.1	156.1	-177.9	64.5	0	0	0	0	114.3	D833 R837 M838 G839 Y904 S907	D833-S835 WeakPolarHBondContact OD1-CB 3.31Å; D833-S835 PolarHBondContact OD1-N 2.91Å; D833-S835 PolarHBondContact OD1-OG 3.37Å; S835-R837 PolarHBondContact O-N 3.05Å; S835-R837 VanDerWaalsContact O-N 3.14Å; S835-M838 PolarHBondContact O-N 3Å; S835-M838 VanDerWaalsContact O-N 3.09Å; S835-G839 PolarHBondContact O-N 3.19Å; S835-Y904 PolarHBondContact O-OH 2.98Å; S835-Y904 VanDerWaalsContact O-OH 3.12Å; S835-S907 CarbonylContact C-O 3.52Å; S835-S907 WeakPolarHBondContact CA-O 3.41Å; S835-S907 WeakPolarHBondContact CB-O 3.47Å
836	E	89.3	Confident	92.1	Very high	148 Å²	148	34.8 Å²	34.8	69%	0.692	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-38.1	174.7	-173.6	-176.5	178.3	0	0	112.1	G839 Y904 S907	E836-G839 PolarHBondContact O-N 3.37Å; E836-Y904 VanDerWaalsContact CA-OH 3.29Å; E836-Y904 WeakPolarHBondContact CA-OH 3.32Å; E836-S907 PolarHBondContact N-O 3.39Å
837	R	86.9	Confident	92.3	Very high	133 Å²	133	35.8 Å²	35.8	50%	0.502	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-39.9	-178.9	-68.2	-178.9	52.9	89.8	19.3	113.2	S835 D944	S835-R837 PolarHBondContact O-N 3.05Å; S835-R837 VanDerWaalsContact O-N 3.14Å; R837-D944 WeakPolarHBondContact CB-OD2 3.46Å; R837-D944 IonicContact CZ-OD2 3.15Å; R837-D944 IonicContact NE-OD2 2.78Å; R837-D944 PolarHBondContact NE-OD2 3.14Å; R837-D944 IonicContact NH2-OD2 2.68Å; R837-D944 PolarHBondContact NH2-OD2 2.75Å
838	M	88.1	Confident	92.4	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-42	178.8	178.8	148.4	156.2	0	0	110.6	L832 D833 S835 N842 H843 A846 I942 F997	L832-M838 HydrophobicContact CD1-CE 3.56Å; D833-M838 HydrophobicContact CB-SD 3.82Å; S835-M838 PolarHBondContact O-N 3Å; S835-M838 VanDerWaalsContact O-N 3.09Å; M838-N842 HydrophobicContact CG-CB 4.21Å; M838-N842 VanDerWaalsContact O-CB 3.3Å; M838-N842 WeakPolarHBondContact O-CB 2.79Å; M838-N842 PolarHBondContact O-ND2 3.1Å; M838-H843 HydrophobicContact CE-CB 4.26Å; M838-A846 HydrophobicContact CE-CB 3.61Å; M838-I942 HydrophobicContact CE-CG2 4.3Å; M838-F997 HydrophobicContact CE-CD1 4.29Å; M838-F997 HydrophobicContact CE-CE1 3.47Å; M838-F997 VanDerWaalsContact CE-CE1 3.47Å; M838-F997 HydrophobicContact CE-CZ 3.95Å; M838-F997 HydrophobicContact CG-CE1 4.33Å; M838-F997 HydrophobicContact CG-CE2 4.47Å; M838-F997 HydrophobicContact CG-CZ 3.89Å; M838-F997 HydrophobicContact SD-CE1 3.77Å; M838-F997 HydrophobicContact SD-CZ 3.61Å
839	G	88.3	Confident	92.4	Very high	19 Å²	19	41.9 Å²	41.9	20%	0.196	20%	0.198	C	C	.	.			trans	77.5	149.4	175	0	0	0	0	0	114.4	S835 E836 E841 N842 H843 Y904	S835-G839 PolarHBondContact O-N 3.19Å; E836-G839 PolarHBondContact O-N 3.37Å; G839-E841 VanDerWaalsContact C-N 3.32Å; G839-E841 PolarHBondContact O-N 3.13Å; G839-N842 PolarHBondContact O-N 3.42Å; G839-H843 WeakPolarHBondContact O-CB 3.47Å; G839-H843 PolarHBondContact O-N 2.91Å; G839-Y904 WeakPolarHBondContact CA-OH 3.36Å
840	L	89.3	Confident	92.3	Very high	100 Å²	100	41.9 Å²	41.9	52%	0.524	20%	0.198	S	C	.	.	H	α-helix	trans	-55.3	-39.4	-171.9	-179.8	62.4	0	0	0	114.3	H843 L844 Y904	L840-H843 PolarHBondContact O-N 3.38Å; L840-L844 HydrophobicContact CG-CD1 4.35Å; L840-L844 VanDerWaalsContact O-CG 3.31Å; L840-L844 WeakPolarHBondContact O-CG 3.43Å; L840-L844 PolarHBondContact O-N 3.42Å; L840-Y904 HydrophobicContact CB-CD1 4.14Å; L840-Y904 HydrophobicContact CB-CE1 4.21Å; L840-Y904 HydrophobicContact CD1-CD1 3.98Å; L840-Y904 HydrophobicContact CD1-CG 3.98Å
841	E	89.1	Confident	92.2	Very high	125 Å²	125	44.3 Å²	44.3	58%	0.584	21%	0.21	S	C	*	.	H	α-helix	trans	-69.3	-41.6	-176.4	-163	-176.1	133.6	0	0	112.3	G839 L844 R845	G839-E841 VanDerWaalsContact C-N 3.32Å; G839-E841 PolarHBondContact O-N 3.13Å; E841-L844 PolarHBondContact O-N 3.34Å; E841-R845 PolarHBondContact O-N 2.94Å; E841-R845 VanDerWaalsContact O-N 3.08Å; E841-R845 IonicContact OE1-CZ 2.9Å; E841-R845 IonicContact OE1-NH1 2.7Å; E841-R845 PolarHBondContact OE1-NH1 3.2Å; E841-R845 IonicContact OE1-NH2 3.77Å; E841-R845 PolarHBondContact OE1-NH2 2.96Å
842	N	91.1	Very high	92	Very high	42 Å²	42	47.6 Å²	47.6	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-73.5	-35.1	176.8	-63.5	-30.8	0	0	0	111.5	M838 G839 L844 R845 A846 F997	M838-N842 HydrophobicContact CG-CB 4.21Å; M838-N842 VanDerWaalsContact O-CB 3.3Å; M838-N842 WeakPolarHBondContact O-CB 2.79Å; M838-N842 PolarHBondContact O-ND2 3.1Å; G839-N842 PolarHBondContact O-N 3.42Å; N842-L844 VanDerWaalsContact C-N 3.29Å; N842-L844 PolarHBondContact O-N 2.86Å; N842-R845 WeakPolarHBondContact O-CB 3.38Å; N842-R845 PolarHBondContact O-N 2.86Å; N842-R845 PolarHBondContact OD1-NH1 3.44Å; N842-A846 WeakPolarHBondContact O-CB 3.34Å; N842-A846 PolarHBondContact O-N 3.35Å; N842-F997 HydrophobicContact CB-CB 3.97Å; N842-F997 HydrophobicContact CB-CD1 3.92Å; N842-F997 HydrophobicContact CB-CD2 3.59Å; N842-F997 HydrophobicContact CB-CE1 4.3Å; N842-F997 HydrophobicContact CB-CE2 3.99Å; N842-F997 HydrophobicContact CB-CG 3.56Å; N842-F997 HydrophobicContact CB-CZ 4.34Å
843	H	92.9	Very high	91.8	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-37.6	170.5	-173.8	92	0	0	0	112	L832 D833 M838 G839 L840 A846 K847 Q875 Y904	L832-H843 VanDerWaalsContact CD2-CE1 3.44Å; L832-H843 WeakPolarHBondContact CD2-CE1 3.49Å; D833-H843 PolarHBondContact O-ND1 2.9Å; D833-H843 VanDerWaalsContact O-ND1 3.14Å; M838-H843 HydrophobicContact CE-CB 4.26Å; G839-H843 WeakPolarHBondContact O-CB 3.47Å; G839-H843 PolarHBondContact O-N 2.91Å; L840-H843 PolarHBondContact O-N 3.38Å; H843-A846 PolarHBondContact O-N 3.34Å; H843-K847 VanDerWaalsContact O-CG 3.32Å; H843-K847 WeakPolarHBondContact O-CG 3.42Å; H843-K847 PolarHBondContact O-N 3.21Å; H843-Q875 PolarHBondContact CE1-OE1 2.69Å; H843-Y904 HydrophobicContact CB-CD2 3.83Å; H843-Y904 HydrophobicContact CB-CE2 4.33Å; H843-Y904 AromaticContact CG-CD2 3.68Å; H843-Y904 AromaticContact ND1-CD2 3.89Å
844	L	91.5	Very high	91.7	Very high	89 Å²	89	47.7 Å²	47.7	47%	0.466	23%	0.228	S	C	.	.	H	α-helix	trans	-65.6	-42.7	171	-72	168.4	0	0	0	112.6	L840 E841 N842 A846 K847 E848	L840-L844 HydrophobicContact CG-CD1 4.35Å; L840-L844 VanDerWaalsContact O-CG 3.31Å; L840-L844 WeakPolarHBondContact O-CG 3.43Å; L840-L844 PolarHBondContact O-N 3.42Å; E841-L844 PolarHBondContact O-N 3.34Å; N842-L844 VanDerWaalsContact C-N 3.29Å; N842-L844 PolarHBondContact O-N 2.86Å; L844-A846 VanDerWaalsContact C-N 3.33Å; L844-A846 PolarHBondContact O-N 3.47Å; L844-K847 HydrophobicContact CD2-CD 4.5Å; L844-K847 PolarHBondContact O-N 2.79Å; L844-E848 PolarHBondContact O-N 3.05Å
845	R	92.6	Very high	91.7	Very high	66 Å²	66	54 Å²	54	25%	0.249	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-42.9	173.2	-69.4	175.9	172.5	104.1	14.8	112.2	E841 N842 E848 F849 F997	E841-R845 PolarHBondContact O-N 2.94Å; E841-R845 VanDerWaalsContact O-N 3.08Å; E841-R845 IonicContact OE1-CZ 2.9Å; E841-R845 IonicContact OE1-NH1 2.7Å; E841-R845 PolarHBondContact OE1-NH1 3.2Å; E841-R845 IonicContact OE1-NH2 3.77Å; E841-R845 PolarHBondContact OE1-NH2 2.96Å; N842-R845 WeakPolarHBondContact O-CB 3.38Å; N842-R845 PolarHBondContact O-N 2.86Å; N842-R845 PolarHBondContact OD1-NH1 3.44Å; R845-E848 PolarHBondContact O-N 2.98Å; R845-F849 WeakPolarHBondContact O-CB 3.15Å; R845-F849 PolarHBondContact O-N 3.19Å; R845-F997 HydrophobicContact CB-CB 4.3Å
846	A	94.1	Very high	91.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-39.4	177.7	0	0	0	0	0	112.4	L832 M838 N842 H843 L844 F849 I850 I942 L1000	L832-A846 HydrophobicContact CD1-CB 3.52Å; M838-A846 HydrophobicContact CE-CB 3.61Å; N842-A846 WeakPolarHBondContact O-CB 3.34Å; N842-A846 PolarHBondContact O-N 3.35Å; H843-A846 PolarHBondContact O-N 3.34Å; L844-A846 VanDerWaalsContact C-N 3.33Å; L844-A846 PolarHBondContact O-N 3.47Å; A846-F849 WeakPolarHBondContact O-CB 3.32Å; A846-F849 PolarHBondContact O-N 3.31Å; A846-I850 WeakPolarHBondContact O-CD1 3.46Å; A846-I850 VanDerWaalsContact O-CG1 3.26Å; A846-I850 WeakPolarHBondContact O-CG1 3.47Å; A846-I850 PolarHBondContact O-N 3.49Å; A846-I942 HydrophobicContact CB-CG2 3.92Å; A846-L1000 HydrophobicContact CB-CD1 4.28Å
847	K	94.1	Very high	91.4	Very high	23 Å²	23	53.4 Å²	53.4	10%	0.1	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-45	172.5	-71.8	169.3	56.2	171.2	0	112.3	L832 H843 L844 F849 I850 E851 L899 V902	L832-K847 HydrophobicContact CD2-CG 4.08Å; H843-K847 VanDerWaalsContact O-CG 3.32Å; H843-K847 WeakPolarHBondContact O-CG 3.42Å; H843-K847 PolarHBondContact O-N 3.21Å; L844-K847 HydrophobicContact CD2-CD 4.5Å; L844-K847 PolarHBondContact O-N 2.79Å; K847-F849 VanDerWaalsContact C-N 3.34Å; K847-F849 PolarHBondContact O-N 3.21Å; K847-I850 PolarHBondContact O-N 3.09Å; K847-E851 PolarHBondContact O-N 2.61Å; K847-L899 HydrophobicContact CB-CD2 4.39Å; K847-L899 WeakPolarHBondContact CE-O 3.29Å; K847-L899 HydrophobicContact CG-CD2 4.44Å; K847-L899 PolarHBondContact NZ-O 3.42Å; K847-V902 HydrophobicContact CD-CB 4.06Å; K847-V902 HydrophobicContact CD-CG1 4.11Å; K847-V902 PolarHBondContact NZ-O 2.84Å
848	E	93.4	Very high	91.4	Very high	125 Å²	125	49.5 Å²	49.5	58%	0.584	24%	0.235	S	C	*	.	H	α-helix	trans	-62.3	-40.2	176	179.2	174.2	-163.6	0	0	111.8	L844 R845 E851 N852	L844-E848 PolarHBondContact O-N 3.05Å; R845-E848 PolarHBondContact O-N 2.98Å; E848-E851 PolarHBondContact O-N 3.01Å; E848-N852 WeakPolarHBondContact O-CB 3.5Å; E848-N852 PolarHBondContact O-N 3.26Å; E848-N852 PolarHBondContact O-ND2 2.91Å
849	F	95.1	Very high	91.4	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-48.3	173.5	175.6	-101.4	0	0	0	112.3	F830 R845 A846 K847 E851 N852 V853 I942 I969 L1000 F1005 F1006 F1009	F830-F849 HydrophobicContact CE1-CE1 4.5Å; R845-F849 WeakPolarHBondContact O-CB 3.15Å; R845-F849 PolarHBondContact O-N 3.19Å; A846-F849 WeakPolarHBondContact O-CB 3.32Å; A846-F849 PolarHBondContact O-N 3.31Å; K847-F849 VanDerWaalsContact C-N 3.34Å; K847-F849 PolarHBondContact O-N 3.21Å; F849-E851 VanDerWaalsContact C-N 3.3Å; F849-E851 PolarHBondContact O-N 3.27Å; F849-N852 PolarHBondContact O-N 2.7Å; F849-V853 HydrophobicContact CD1-CG2 4.44Å; F849-V853 HydrophobicContact CE1-CG2 4.14Å; F849-V853 HydrophobicContact CE2-CG2 4.38Å; F849-V853 HydrophobicContact CZ-CG2 4.12Å; F849-V853 WeakPolarHBondContact O-CG2 3.36Å; F849-V853 PolarHBondContact O-N 2.88Å; F849-I942 HydrophobicContact CD1-CD1 3.98Å; F849-I942 HydrophobicContact CE1-CD1 4.24Å; F849-I969 HydrophobicContact CE1-CD1 3.68Å; F849-I969 HydrophobicContact CZ-CD1 3.91Å; F849-L1000 HydrophobicContact CB-CB 4.07Å; F849-L1000 HydrophobicContact CB-CD1 4.04Å; F849-L1000 HydrophobicContact CB-CG 4.48Å; F849-L1000 HydrophobicContact CD1-CD2 4.2Å; F849-L1000 HydrophobicContact CD2-CB 3.91Å; F849-L1000 HydrophobicContact CD2-CD2 3.92Å; F849-L1000 HydrophobicContact CD2-CG 4.43Å; F849-L1000 HydrophobicContact CE1-CD2 4.32Å; F849-L1000 HydrophobicContact CE2-CD2 4.05Å; F849-L1000 HydrophobicContact CG-CB 4.14Å; F849-L1000 HydrophobicContact CG-CD1 4.28Å; F849-L1000 HydrophobicContact CG-CD2 3.99Å; F849-L1000 HydrophobicContact CG-CG 4.38Å; F849-L1000 HydrophobicContact CZ-CD2 4.24Å; F849-F1005 HydrophobicContact CE2-CD1 4.14Å; F849-F1005 AromaticContact CE2-CE1 3.9Å; F849-F1005 HydrophobicContact CE2-CE1 3.9Å; F849-F1005 HydrophobicContact CZ-CE1 4.02Å; F849-F1006 HydrophobicContact CD2-CD2 4.05Å; F849-F1006 AromaticContact CE2-CD2 3.9Å; F849-F1006 HydrophobicContact CE2-CD2 3.9Å; F849-F1009 HydrophobicContact CE1-CD1 4.25Å; F849-F1009 HydrophobicContact CE1-CE1 4.12Å; F849-F1009 HydrophobicContact CE1-CZ 4.36Å; F849-F1009 HydrophobicContact CE2-CD1 4.34Å; F849-F1009 HydrophobicContact CZ-CB 4.28Å; F849-F1009 AromaticContact CZ-CD1 3.53Å; F849-F1009 HydrophobicContact CZ-CD1 3.53Å; F849-F1009 HydrophobicContact CZ-CD2 4.25Å; F849-F1009 AromaticContact CZ-CE1 3.87Å; F849-F1009 HydrophobicContact CZ-CE1 3.87Å; F849-F1009 AromaticContact CZ-CG 3.74Å; F849-F1009 HydrophobicContact CZ-CG 3.74Å; F849-F1009 HydrophobicContact CZ-CZ 4.35Å
850	I	95.6	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-40	176.9	-63.7	160	0	0	0	110.8	F830 L832 A846 K847 V853 A854 L873 L899 I942	F830-I850 HydrophobicContact CB-CD1 4.27Å; F830-I850 HydrophobicContact CD1-CD1 4.24Å; F830-I850 HydrophobicContact CD1-CG1 3.74Å; F830-I850 HydrophobicContact CD2-CG1 4.44Å; F830-I850 HydrophobicContact CD2-CG2 3.88Å; F830-I850 HydrophobicContact CE1-CG1 3.96Å; F830-I850 HydrophobicContact CE2-CG2 4.05Å; F830-I850 HydrophobicContact CG-CD1 4.27Å; F830-I850 HydrophobicContact CG-CG1 3.98Å; F830-I850 HydrophobicContact CG-CG2 4.19Å; F830-I850 HydrophobicContact CZ-CG1 4.41Å; F830-I850 HydrophobicContact CZ-CG2 4.49Å; L832-I850 HydrophobicContact CD2-CD1 4.17Å; A846-I850 WeakPolarHBondContact O-CD1 3.46Å; A846-I850 VanDerWaalsContact O-CG1 3.26Å; A846-I850 WeakPolarHBondContact O-CG1 3.47Å; A846-I850 PolarHBondContact O-N 3.49Å; K847-I850 PolarHBondContact O-N 3.09Å; I850-V853 PolarHBondContact O-N 3.23Å; I850-A854 WeakPolarHBondContact O-CB 3.36Å; I850-A854 PolarHBondContact O-N 2.72Å; I850-L873 HydrophobicContact CD1-CD1 4.02Å; I850-L899 HydrophobicContact CB-CD2 4.35Å; I850-L899 HydrophobicContact CG2-CD1 4.16Å; I850-L899 HydrophobicContact CG2-CD2 4.16Å; I850-I942 HydrophobicContact CD1-CD1 4.13Å; I850-I942 HydrophobicContact CG1-CD1 4.02Å
851	E	94.7	Very high	91.1	Very high	52 Å²	52	50.9 Å²	50.9	24%	0.243	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-45.4	175.8	-156.7	-168.3	124.7	0	0	111.8	K847 E848 F849 V853 A854 R855 V896 L899	K847-E851 PolarHBondContact O-N 2.61Å; E848-E851 PolarHBondContact O-N 3.01Å; F849-E851 VanDerWaalsContact C-N 3.3Å; F849-E851 PolarHBondContact O-N 3.27Å; E851-V853 VanDerWaalsContact C-N 3.35Å; E851-V853 PolarHBondContact O-N 3.15Å; E851-A854 WeakPolarHBondContact O-CB 3.41Å; E851-A854 PolarHBondContact O-N 2.95Å; E851-R855 VanDerWaalsContact O-CG 3.31Å; E851-R855 WeakPolarHBondContact O-CG 3.31Å; E851-R855 PolarHBondContact O-N 2.72Å; E851-R855 IonicContact OE1-CZ 3.32Å; E851-R855 IonicContact OE1-NE 2.71Å; E851-R855 PolarHBondContact OE1-NE 3.38Å; E851-R855 IonicContact OE1-NH2 2.72Å; E851-R855 PolarHBondContact OE1-NH2 3.42Å; E851-V896 HydrophobicContact CG-CG2 3.9Å; E851-L899 HydrophobicContact CB-CD1 3.78Å; E851-L899 HydrophobicContact CG-CD1 4.03Å
852	N	92.8	Very high	90.8	Very high	69 Å²	69	45.6 Å²	45.6	37%	0.369	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-39.2	177.5	-76.8	-48	0	0	0	111.9	E848 F849 R855 R856 F1006	E848-N852 WeakPolarHBondContact O-CB 3.5Å; E848-N852 PolarHBondContact O-N 3.26Å; E848-N852 PolarHBondContact O-ND2 2.91Å; F849-N852 PolarHBondContact O-N 2.7Å; N852-R855 PolarHBondContact O-N 2.72Å; N852-R856 WeakPolarHBondContact O-CB 3.45Å; N852-R856 PolarHBondContact O-N 3.16Å; N852-F1006 HydrophobicContact CB-CE2 3.67Å; N852-F1006 HydrophobicContact CB-CZ 4.03Å
853	V	92.6	Very high	90.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-46.6	172.1	174.3	0	0	0	0	110.7	F830 F849 I850 E851 R855 R856 L857 F1006 F1009 I1010	F830-V853 HydrophobicContact CE2-CG1 4.42Å; F830-V853 HydrophobicContact CZ-CB 4.27Å; F830-V853 HydrophobicContact CZ-CG1 3.97Å; F830-V853 HydrophobicContact CZ-CG2 4.49Å; F849-V853 HydrophobicContact CD1-CG2 4.44Å; F849-V853 HydrophobicContact CE1-CG2 4.14Å; F849-V853 HydrophobicContact CE2-CG2 4.38Å; F849-V853 HydrophobicContact CZ-CG2 4.12Å; F849-V853 WeakPolarHBondContact O-CG2 3.36Å; F849-V853 PolarHBondContact O-N 2.88Å; I850-V853 PolarHBondContact O-N 3.23Å; E851-V853 VanDerWaalsContact C-N 3.35Å; E851-V853 PolarHBondContact O-N 3.15Å; V853-R855 PolarHBondContact O-N 2.88Å; V853-R856 PolarHBondContact O-N 3.15Å; V853-R856 VanDerWaalsContact O-N 3.12Å; V853-L857 HydrophobicContact CG1-CD1 3.48Å; V853-L857 VanDerWaalsContact CG1-CD1 3.48Å; V853-L857 HydrophobicContact CG1-CG 3.92Å; V853-L857 WeakPolarHBondContact O-CB 3.21Å; V853-L857 WeakPolarHBondContact O-CG 3.27Å; V853-L857 PolarHBondContact O-N 2.86Å; V853-F1006 HydrophobicContact CG2-CD2 4.47Å; V853-F1006 HydrophobicContact CG2-CE2 3.74Å; V853-F1006 HydrophobicContact CG2-CZ 4.46Å; V853-F1009 HydrophobicContact CG1-CE1 4.2Å; V853-F1009 HydrophobicContact CG2-CD1 3.97Å; V853-F1009 HydrophobicContact CG2-CE1 3.69Å; V853-I1010 HydrophobicContact CB-CD1 4.39Å; V853-I1010 HydrophobicContact CG1-CD1 4.02Å; V853-I1010 HydrophobicContact CG2-CD1 4.18Å
854	A	91.7	Very high	89.6	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-31.3	177.5	0	0	0	0	0	113.4	I850 E851 L871 L892 I895	I850-A854 WeakPolarHBondContact O-CB 3.36Å; I850-A854 PolarHBondContact O-N 2.72Å; E851-A854 WeakPolarHBondContact O-CB 3.41Å; E851-A854 PolarHBondContact O-N 2.95Å; A854-L871 HydrophobicContact CB-CD2 3.59Å; A854-L892 HydrophobicContact CB-CD1 3.94Å; A854-I895 HydrophobicContact CB-CD1 4.3Å; A854-I895 HydrophobicContact CB-CG2 3.77Å
855	R	90.9	Very high	89.1	Confident	133 Å²	133	50.2 Å²	50.2	50%	0.502	25%	0.252	S	S	.	.	H	α-helix	trans	-79.5	-28.6	175.2	-69.5	175.2	-177.9	-68.8	0.6	113.6	E851 N852 V853 L892	E851-R855 VanDerWaalsContact O-CG 3.31Å; E851-R855 WeakPolarHBondContact O-CG 3.31Å; E851-R855 PolarHBondContact O-N 2.72Å; E851-R855 IonicContact OE1-CZ 3.32Å; E851-R855 IonicContact OE1-NE 2.71Å; E851-R855 PolarHBondContact OE1-NE 3.38Å; E851-R855 IonicContact OE1-NH2 2.72Å; E851-R855 PolarHBondContact OE1-NH2 3.42Å; N852-R855 PolarHBondContact O-N 2.72Å; V853-R855 PolarHBondContact O-N 2.88Å; R855-L892 HydrophobicContact CG-CD1 4.11Å; R855-L892 HydrophobicContact CG-CD2 4.35Å
856	R	88.3	Confident	88.5	Confident	126 Å²	126	51.3 Å²	51.3	48%	0.475	26%	0.263	S	S	.	.	H	α-helix	trans	-85.4	-35	-179	-174.9	71.5	168.7	97.1	1.8	112.8	N852 V853 F1006 E1007 I1010	N852-R856 WeakPolarHBondContact O-CB 3.45Å; N852-R856 PolarHBondContact O-N 3.16Å; V853-R856 PolarHBondContact O-N 3.15Å; V853-R856 VanDerWaalsContact O-N 3.12Å; R856-F1006 HydrophobicContact CB-CE1 4.01Å; R856-F1006 HydrophobicContact CB-CZ 3.74Å; R856-F1006 HydrophobicContact CG-CE1 3.81Å; R856-F1006 HydrophobicContact CG-CZ 4.03Å; R856-E1007 IonicContact CZ-OE1 2.72Å; R856-E1007 VanDerWaalsContact CZ-OE1 3.24Å; R856-E1007 IonicContact CZ-OE2 2.73Å; R856-E1007 IonicContact NE-OE1 3.68Å; R856-E1007 PolarHBondContact NE-OE1 2.67Å; R856-E1007 IonicContact NH2-OE1 3.91Å; R856-E1007 PolarHBondContact NH2-OE1 2.85Å; R856-E1007 IonicContact NH2-OE2 2.75Å; R856-E1007 PolarHBondContact NH2-OE2 3.18Å; R856-I1010 HydrophobicContact CB-CD1 4.04Å; R856-I1010 HydrophobicContact CG-CD1 3.83Å; R856-I1010 HydrophobicContact CG-CG1 4Å; R856-I1010 HydrophobicContact CG-CG2 4.13Å
857	L	86.4	Confident	87.8	Confident	11 Å²	11	53.8 Å²	53.8	6%	0.058	28%	0.278	C	S	.	.	S	Bend	trans	-73.8	143.3	178.4	-68.8	177.7	0	0	0	111.6	C821 V853 L859 A869 L871 I1010	C821-L857 HydrophobicContact CB-CD2 4.28Å; C821-L857 WeakPolarHBondContact SG-CD2 3.35Å; V853-L857 HydrophobicContact CG1-CD1 3.48Å; V853-L857 VanDerWaalsContact CG1-CD1 3.48Å; V853-L857 HydrophobicContact CG1-CG 3.92Å; V853-L857 WeakPolarHBondContact O-CB 3.21Å; V853-L857 WeakPolarHBondContact O-CG 3.27Å; V853-L857 PolarHBondContact O-N 2.86Å; L857-L859 HydrophobicContact CB-CD2 4.41Å; L857-L859 PolarHBondContact O-N 3.24Å; L857-L859 VanDerWaalsContact O-N 3.1Å; L857-A869 HydrophobicContact CB-CB 4.13Å; L857-A869 HydrophobicContact CD1-CB 4.26Å; L857-L871 HydrophobicContact CD1-CD1 4Å; L857-I1010 HydrophobicContact CD2-CD1 4.26Å; L857-I1010 HydrophobicContact CG-CD1 4.35Å
858	T	86	Confident	87.5	Confident	51 Å²	51	54.3 Å²	54.3	31%	0.313	28%	0.28	S	S	.	.			trans	-79.5	96	173.6	-57.2	0	0	0	0	109.4	V822 K868 A869	V822-T858 HydrophobicContact CG2-CG2 4.32Å; T858-K868 HydrophobicContact CG2-CD 4.02Å; T858-K868 HydrophobicContact CG2-CG 3.97Å; T858-K868 WeakPolarHBondContact O-CB 3.39Å; T858-A869 PolarHBondContact O-N 2.69Å
859	L	88.9	Confident	87.4	Confident	24 Å²	24	48.4 Å²	48.4	13%	0.126	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-68.6	145.3	180	-56.7	-174.1	0	0	0	112.7	L857 K868 A869 L871 L892 I895	L857-L859 HydrophobicContact CB-CD2 4.41Å; L857-L859 PolarHBondContact O-N 3.24Å; L857-L859 VanDerWaalsContact O-N 3.1Å; L859-K868 WeakPolarHBondContact O-CD 3.33Å; L859-K868 PolarHBondContact O-NZ 2.96Å; L859-A869 WeakPolarHBondContact CA-O 3.13Å; L859-A869 HydrophobicContact CD2-CB 4.3Å; L859-L871 HydrophobicContact CD2-CD1 3.64Å; L859-L892 HydrophobicContact CD1-CB 3.95Å; L859-L892 HydrophobicContact CD1-CD1 4.24Å; L859-I895 HydrophobicContact CD1-CD1 3.83Å
860	A	87.9	Confident	87.3	Confident	6 Å²	6	48.9 Å²	48.9	5%	0.05	26%	0.255	C	S	.	.			trans	-58.3	150.6	-175.8	0	0	0	0	0	114	G862 D865 K868 A869 R870 H890	A860-G862 VanDerWaalsContact C-N 3.25Å; A860-G862 PolarHBondContact O-N 2.9Å; A860-D865 HydrophobicContact CB-CB 4Å; A860-K868 HydrophobicContact CB-CB 4.07Å; A860-A869 WeakPolarHBondContact CB-O 3.36Å; A860-A869 PolarHBondContact N-O 2.76Å; A860-R870 HydrophobicContact CB-CG 3.92Å; A860-H890 HydrophobicContact CB-CB 3.74Å; A860-H890 WeakPolarHBondContact O-CB 3.3Å; A860-H890 PolarHBondContact O-CD2 3.17Å
861	N	84.2	Confident	87.3	Confident	120 Å²	120	48.9 Å²	48.9	64%	0.642	26%	0.255	S	S	*	.	S	Bend	trans	-80.1	-7.7	175.5	-52.2	-65.3	0	0	0	112.9	D865 K868	N861-D865 WeakPolarHBondContact CB-OD2 3.41Å; N861-D865 PolarHBondContact N-OD2 3.16Å; N861-D865 PolarHBondContact ND2-OD2 2.98Å; N861-K868 PolarHBondContact ND2-NZ 2.99Å; N861-K868 PolarHBondContact OD1-NZ 3.14Å
862	G	82.8	Confident	87.3	Confident	13 Å²	13	46.4 Å²	46.4	13%	0.134	24%	0.243	C	C	.	.	S	Bend	trans	178.3	176.8	-179.5	0	0	0	0	0	112.7	A860 T864 D865	A860-G862 VanDerWaalsContact C-N 3.25Å; A860-G862 PolarHBondContact O-N 2.9Å; G862-T864 PolarHBondContact O-N 3.24Å; G862-D865 PolarHBondContact O-N 2.86Å
863	P	78.2	Confident	87.5	Confident	81 Å²	81	43.1 Å²	43.1	53%	0.526	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.4	-175.4	-23.7	34.8	0	0	0	115.1	R870	P863-R870 PolarHBondContact O-NH1 3.48Å
864	T	79.1	Confident	87.7	Confident	129 Å²	129	43.1 Å²	43.1	79%	0.791	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.5	7	-174.4	59.4	0	0	0	0	113.9	G862	G862-T864 PolarHBondContact O-N 3.24Å
865	D	82.3	Confident	87.9	Confident	21 Å²	21	43.1 Å²	43.1	11%	0.112	23%	0.225	C	C	.	.			trans	-65.6	132.3	172.6	-179.5	-35.4	0	0	0	109.1	A860 N861 G862 T867 R932	A860-D865 HydrophobicContact CB-CB 4Å; N861-D865 WeakPolarHBondContact CB-OD2 3.41Å; N861-D865 PolarHBondContact N-OD2 3.16Å; N861-D865 PolarHBondContact ND2-OD2 2.98Å; G862-D865 PolarHBondContact O-N 2.86Å; D865-T867 PolarHBondContact OD1-N 2.83Å; D865-T867 PolarHBondContact OD1-OG1 3.43Å; D865-R932 WeakPolarHBondContact O-CD 3.28Å; D865-R932 PolarHBondContact O-NH1 2.88Å
866	D	79.6	Confident	88	Confident	88 Å²	88	36.8 Å²	36.8	47%	0.471	20%	0.202	S	C	.	.	S	Bend	trans	-112.5	21.8	-174.9	59	-14.4	0	0	0	113.3	P825 N934	P825-D866 WeakPolarHBondContact CB-O 3.32Å; P825-D866 VanDerWaalsContact CD-O 3.29Å; P825-D866 WeakPolarHBondContact CD-O 3.32Å; P825-D866 VanDerWaalsContact CG-O 3.22Å; P825-D866 WeakPolarHBondContact CG-O 3.42Å; D866-N934 WeakPolarHBondContact CB-ND2 3.37Å
867	T	80.4	Confident	88.1	Confident	52 Å²	52	30.8 Å²	30.8	32%	0.319	18%	0.179	S	C	.	.	S	Bend	trans	-123.4	0.7	-175.3	65	0	0	0	0	114.6	Q823 R824 D865	Q823-T867 CarbonylContact C-O 3.57Å; Q823-T867 VanDerWaalsContact CA-O 3.26Å; Q823-T867 WeakPolarHBondContact CA-O 3.49Å; Q823-T867 PolarHBondContact N-O 3.41Å; R824-T867 PolarHBondContact N-O 3.45Å; D865-T867 PolarHBondContact OD1-N 2.83Å; D865-T867 PolarHBondContact OD1-OG1 3.43Å
868	K	87.2	Confident	88.2	Confident	34 Å²	34	31.6 Å²	31.6	15%	0.148	19%	0.185	C	C	.	.	S	Bend	trans	-152	171.3	-160	-78.1	174.9	166.9	-152.5	0	114.3	V826 T858 L859 A860 N861 R932	V826-K868 PolarHBondContact N-O 2.9Å; T858-K868 HydrophobicContact CG2-CD 4.02Å; T858-K868 HydrophobicContact CG2-CG 3.97Å; T858-K868 WeakPolarHBondContact O-CB 3.39Å; L859-K868 WeakPolarHBondContact O-CD 3.33Å; L859-K868 PolarHBondContact O-NZ 2.96Å; A860-K868 HydrophobicContact CB-CB 4.07Å; N861-K868 PolarHBondContact ND2-NZ 2.99Å; N861-K868 PolarHBondContact OD1-NZ 3.14Å; K868-R932 PolarHBondContact O-NH1 3.47Å; K868-R932 PolarHBondContact O-NH2 2.83Å
869	A	90.6	Very high	88.1	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	147.7	-178.3	0	0	0	0	0	114.4	V826 L857 T858 L859 A860 L871	V826-A869 CarbonylContact O-C 3.51Å; V826-A869 VanDerWaalsContact O-CA 3.29Å; V826-A869 WeakPolarHBondContact O-CA 3.33Å; L857-A869 HydrophobicContact CB-CB 4.13Å; L857-A869 HydrophobicContact CD1-CB 4.26Å; T858-A869 PolarHBondContact O-N 2.69Å; L859-A869 WeakPolarHBondContact CA-O 3.13Å; L859-A869 HydrophobicContact CD2-CB 4.3Å; A860-A869 WeakPolarHBondContact CB-O 3.36Å; A860-A869 PolarHBondContact N-O 2.76Å; A869-L871 HydrophobicContact CB-CD1 4.28Å
870	R	93.1	Very high	87.7	Confident	14 Å²	14	33.6 Å²	33.6	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.2	160.4	-57.8	-171.8	-54.7	169.3	14.6	108.7	V826 D827 V828 A860 P863 L888 T889 H890 L930	V826-R870 PolarHBondContact O-N 3.18Å; D827-R870 VanDerWaalsContact CG-NH2 3.32Å; D827-R870 IonicContact OD1-CZ 3.69Å; D827-R870 IonicContact OD1-NE 2.94Å; D827-R870 PolarHBondContact OD1-NE 2.7Å; D827-R870 IonicContact OD1-NH2 3.05Å; D827-R870 PolarHBondContact OD1-NH2 2.84Å; D827-R870 IonicContact OD2-CZ 2.68Å; D827-R870 IonicContact OD2-NE 2.81Å; D827-R870 IonicContact OD2-NH2 2.7Å; D827-R870 PolarHBondContact OD2-NH2 2.9Å; V828-R870 PolarHBondContact N-O 3.33Å; A860-R870 HydrophobicContact CB-CG 3.92Å; P863-R870 PolarHBondContact O-NH1 3.48Å; R870-L888 HydrophobicContact CB-CD2 4.43Å; R870-T889 CarbonylContact C-O 3.55Å; R870-T889 VanDerWaalsContact CA-O 3.3Å; R870-T889 WeakPolarHBondContact CA-O 3.48Å; R870-T889 WeakPolarHBondContact CB-O 3.35Å; R870-H890 HydrophobicContact CG-CB 4.43Å; R870-L930 PolarHBondContact NH2-O 3.24Å
871	L	94.9	Very high	87.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.1	-178.1	-80.7	62.7	0	0	0	111.1	V828 F830 A854 L857 L859 A869 F886 L888 T889 I895	V828-L871 HydrophobicContact CB-CD1 4.49Å; V828-L871 HydrophobicContact CB-CG 4.32Å; V828-L871 CarbonylContact O-C 3.48Å; V828-L871 VanDerWaalsContact O-CA 3.29Å; V828-L871 WeakPolarHBondContact O-CA 3.43Å; F830-L871 HydrophobicContact CE2-CD2 3.97Å; F830-L871 HydrophobicContact CE2-CG 4.2Å; A854-L871 HydrophobicContact CB-CD2 3.59Å; L857-L871 HydrophobicContact CD1-CD1 4Å; L859-L871 HydrophobicContact CD2-CD1 3.64Å; A869-L871 HydrophobicContact CB-CD1 4.28Å; L871-F886 HydrophobicContact CB-CE2 4.09Å; L871-L888 WeakPolarHBondContact O-CA 3.36Å; L871-T889 PolarHBondContact N-O 3.27Å; L871-T889 PolarHBondContact O-N 2.62Å; L871-I895 HydrophobicContact CB-CD1 4.11Å; L871-I895 HydrophobicContact CD2-CD1 4.4Å
872	A	96	Very high	87.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.9	164.6	0	0	0	0	0	110.3	V828 I829 F830 F886 L888 L922	V828-A872 PolarHBondContact O-N 2.91Å; I829-A872 HydrophobicContact CG1-CB 4.31Å; F830-A872 PolarHBondContact N-O 2.9Å; A872-F886 WeakPolarHBondContact CA-O 3.42Å; A872-L888 HydrophobicContact CB-CB 4.49Å; A872-L888 HydrophobicContact CB-CD2 3.88Å; A872-L888 HydrophobicContact CB-CG 3.93Å; A872-L922 HydrophobicContact CB-CD1 3.75Å; A872-L922 HydrophobicContact CB-CD2 4.16Å
873	L	96.9	Very high	88.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	125.4	174.9	176.5	61.1	0	0	0	111.1	F830 L832 I850 E885 F886 L899 V902	F830-L873 HydrophobicContact CB-CD1 3.67Å; F830-L873 WeakPolarHBondContact O-CA 3.4Å; L832-L873 HydrophobicContact CB-CD1 3.72Å; L832-L873 HydrophobicContact CD2-CD1 4.37Å; I850-L873 HydrophobicContact CD1-CD1 4.02Å; L873-E885 HydrophobicContact CB-CB 4.16Å; L873-E885 HydrophobicContact CD2-CB 3.82Å; L873-E885 HydrophobicContact CD2-CG 4.06Å; L873-E885 HydrophobicContact CG-CB 3.88Å; L873-E885 HydrophobicContact CG-CG 4.08Å; L873-E885 PolarHBondContact O-N 3.1Å; L873-F886 HydrophobicContact CB-CD1 3.81Å; L873-F886 HydrophobicContact CB-CD2 4.45Å; L873-F886 HydrophobicContact CB-CE1 3.37Å; L873-F886 HydrophobicContact CB-CE2 4.07Å; L873-F886 HydrophobicContact CB-CG 4.34Å; L873-F886 HydrophobicContact CB-CZ 3.52Å; L873-F886 HydrophobicContact CD2-CD1 4.39Å; L873-F886 HydrophobicContact CD2-CE1 3.75Å; L873-F886 HydrophobicContact CD2-CZ 4.44Å; L873-F886 HydrophobicContact CG-CE1 4.21Å; L873-F886 PolarHBondContact N-O 3.22Å; L873-F886 PolarHBondContact O-N 3.36Å; L873-L899 HydrophobicContact CD2-CD2 3.69Å; L873-V902 HydrophobicContact CD2-CG2 4.13Å
874	V	96.1	Very high	89	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.9	161.3	-173.7	0	0	0	0	107.9	F830 M831 L832 K883 Y917 A918 L922	F830-V874 PolarHBondContact O-N 3.1Å; M831-V874 HydrophobicContact CE-CB 4.24Å; M831-V874 HydrophobicContact CE-CG1 4.4Å; M831-V874 HydrophobicContact SD-CB 3.86Å; M831-V874 HydrophobicContact SD-CG2 4.04Å; L832-V874 PolarHBondContact N-O 3.34Å; V874-K883 WeakPolarHBondContact CA-O 3.14Å; V874-Y917 HydrophobicContact CG1-CD1 4.05Å; V874-Y917 HydrophobicContact CG1-CE1 4.22Å; V874-Y917 HydrophobicContact CG2-CD1 4.49Å; V874-A918 HydrophobicContact CG2-CB 4.1Å; V874-L922 HydrophobicContact CG2-CD1 3.37Å; V874-L922 HydrophobicContact CG2-CG 4.33Å
875	Q	95.2	Very high	89.7	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.1	160.6	-170.6	-174.1	-179.6	0	0	108.6	L832 H843 K883 E885 N903 L905	L832-Q875 CarbonylContact O-C 3.59Å; L832-Q875 WeakPolarHBondContact O-CA 3.45Å; H843-Q875 PolarHBondContact CE1-OE1 2.69Å; Q875-K883 PolarHBondContact N-O 3.35Å; Q875-K883 PolarHBondContact O-N 2.84Å; Q875-E885 HydrophobicContact CB-CG 4.01Å; Q875-E885 PolarHBondContact NE2-OE1 2.96Å; Q875-N903 PolarHBondContact NE2-O 2.94Å; Q875-N903 PolarHBondContact OE1-O 3.2Å; Q875-L905 HydrophobicContact CB-CD1 4.47Å; Q875-L905 HydrophobicContact CG-CD1 3.84Å; Q875-L905 HydrophobicContact CG-CG 4.2Å; Q875-L905 VanDerWaalsContact OE1-N 3.08Å
876	F	93.8	Very high	90.3	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.1	-179.5	71.6	-87.5	0	0	0	113	M831 L832 D833 G834 S909 L911 A914	M831-F876 HydrophobicContact CB-CD1 4.43Å; M831-F876 HydrophobicContact CB-CE1 4.23Å; M831-F876 HydrophobicContact CE-CD1 4.37Å; L832-F876 VanDerWaalsContact C-CE1 3.44Å; L832-F876 VanDerWaalsContact O-CD1 3.24Å; L832-F876 WeakPolarHBondContact O-CD1 3.46Å; L832-F876 PolarHBondContact O-N 3.25Å; D833-F876 HydrophobicContact CB-CE1 4.07Å; D833-F876 HydrophobicContact CB-CE2 4.22Å; D833-F876 HydrophobicContact CB-CZ 3.68Å; G834-F876 PolarHBondContact N-O 2.87Å; F876-S909 WeakPolarHBondContact CE2-OG 3.44Å; F876-L911 HydrophobicContact CE1-CD1 4.09Å; F876-L911 HydrophobicContact CE2-CB 4.02Å; F876-L911 HydrophobicContact CE2-CD1 4.04Å; F876-L911 HydrophobicContact CZ-CB 4.44Å; F876-L911 HydrophobicContact CZ-CD1 3.75Å; F876-A914 HydrophobicContact CB-CB 3.39Å; F876-A914 HydrophobicContact CD1-CB 4.21Å; F876-A914 HydrophobicContact CD2-CB 3.94Å; F876-A914 HydrophobicContact CG-CB 3.59Å
877	G	90.2	Very high	90.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.165	C	C	.	.			trans	-125.7	-129.3	170.8	0	0	0	0	0	110.5	D881 S907 S908 A910	G877-D881 PolarHBondContact N-O 2.94Å; G877-S907 VanDerWaalsContact CA-OG 3.27Å; G877-S907 WeakPolarHBondContact CA-OG 3.32Å; G877-S908 CarbonylContact C-O 3.49Å; G877-S908 WeakPolarHBondContact CA-O 3.35Å; G877-A910 WeakPolarHBondContact O-CB 3.5Å; G877-A910 PolarHBondContact O-N 3.2Å
878	S	88.6	Confident	91.5	Very high	27 Å²	27	25.7 Å²	25.7	19%	0.189	16%	0.156	C	C	.	.	S	Bend	trans	-55.9	167.9	177.9	-21.8	0	0	0	0	113.5	G880 D881 H882 S908	S878-G880 PolarHBondContact O-N 3.3Å; S878-D881 WeakPolarHBondContact CB-OD2 3.19Å; S878-D881 PolarHBondContact O-N 3.12Å; S878-D881 PolarHBondContact OG-OD2 3.33Å; S878-H882 PolarHBondContact O-CE1 3.44Å; S878-S908 WeakPolarHBondContact CA-OG 3.37Å; S878-S908 VanDerWaalsContact CB-OG 3.31Å; S878-S908 WeakPolarHBondContact CB-OG 3.29Å; S878-S908 PolarHBondContact N-O 3.38Å; S878-S908 PolarHBondContact OG-OG 2.85Å
879	A	83.6	Confident	91.8	Very high	52 Å²	52	25 Å²	25	43%	0.43	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-7.3	-174.6	0	0	0	0	0	117.7	A910 N913	A879-A910 HydrophobicContact CB-CB 4.26Å; A879-N913 PolarHBondContact O-ND2 3.41Å
880	G	81.5	Confident	91.9	Very high	66 Å²	66	27.7 Å²	27.7	68%	0.68	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.8	-2.4	168.7	0	0	0	0	0	114.7	S878 H882	S878-G880 PolarHBondContact O-N 3.3Å; G880-H882 PolarHBondContact O-N 3.44Å
881	D	85.6	Confident	91.8	Very high	81 Å²	81	30.5 Å²	30.5	43%	0.433	18%	0.183	S	C	.	.			trans	-93.1	75.8	-178.4	-62.6	-48.8	0	0	0	109.2	G877 S878	G877-D881 PolarHBondContact N-O 2.94Å; S878-D881 WeakPolarHBondContact CB-OD2 3.19Å; S878-D881 PolarHBondContact O-N 3.12Å; S878-D881 PolarHBondContact OG-OD2 3.33Å
882	H	89.1	Confident	91.7	Very high	25 Å²	25	33.2 Å²	33.2	12%	0.116	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.8	179.5	-54.7	-27.4	0	0	0	109.8	S878 G880 N913 A914 Y917	S878-H882 PolarHBondContact O-CE1 3.44Å; G880-H882 PolarHBondContact O-N 3.44Å; H882-N913 VanDerWaalsContact NE2-C 3.28Å; H882-N913 WeakPolarHBondContact NE2-CB 3.41Å; H882-A914 PolarHBondContact NE2-N 2.98Å; H882-Y917 HydrophobicContact CB-CD1 4.01Å; H882-Y917 HydrophobicContact CB-CD2 4.06Å; H882-Y917 HydrophobicContact CB-CE1 4.36Å; H882-Y917 HydrophobicContact CB-CE2 4.38Å; H882-Y917 HydrophobicContact CB-CG 3.86Å
883	K	90.7	Very high	91.4	Very high	77 Å²	77	37.3 Å²	37.3	34%	0.335	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	112	-170.7	-171.8	162.2	170.8	-79.8	0	110.9	V874 Q875 E885	V874-K883 WeakPolarHBondContact CA-O 3.14Å; Q875-K883 PolarHBondContact N-O 3.35Å; Q875-K883 PolarHBondContact O-N 2.84Å; K883-E885 WeakPolarHBondContact CD-OE1 3.36Å; K883-E885 WeakPolarHBondContact CG-OE1 3.35Å; K883-E885 IonicContact NZ-OE1 3.41Å; K883-E885 PolarHBondContact NZ-OE1 3.44Å; K883-E885 IonicContact NZ-OE2 2.75Å; K883-E885 PolarHBondContact NZ-OE2 2.83Å; K883-E885 PolarHBondContact O-N 3.06Å; K883-E885 VanDerWaalsContact O-N 3.15Å
884	E	93.7	Very high	91.3	Very high	51 Å²	51	40.1 Å²	40.1	24%	0.238	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	103.9	165.2	179	167.7	121	0	0	108.8	Y917 L922 R925	E884-Y917 HydrophobicContact CB-CE1 4.42Å; E884-L922 HydrophobicContact CG-CD2 4.09Å; E884-L922 VanDerWaalsContact OE2-CD2 3.23Å; E884-L922 WeakPolarHBondContact OE2-CD2 3.33Å; E884-R925 IonicContact OE1-CZ 3.94Å; E884-R925 IonicContact OE1-NH1 2.78Å; E884-R925 IonicContact OE1-NH2 3.64Å; E884-R925 PolarHBondContact OE1-NH2 2.74Å; E884-R925 IonicContact OE2-CZ 3.99Å; E884-R925 IonicContact OE2-NH2 2.91Å; E884-R925 PolarHBondContact OE2-NH2 3.31Å
885	E	94.6	Very high	91.2	Very high	18 Å²	18	40.1 Å²	40.1	8%	0.084	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-33.8	179.8	-61.3	-63.5	175.2	0	0	111.3	L873 Q875 K883 S898 V902	L873-E885 HydrophobicContact CB-CB 4.16Å; L873-E885 HydrophobicContact CD2-CB 3.82Å; L873-E885 HydrophobicContact CD2-CG 4.06Å; L873-E885 HydrophobicContact CG-CB 3.88Å; L873-E885 HydrophobicContact CG-CG 4.08Å; L873-E885 PolarHBondContact O-N 3.1Å; Q875-E885 HydrophobicContact CB-CG 4.01Å; Q875-E885 PolarHBondContact NE2-OE1 2.96Å; K883-E885 WeakPolarHBondContact CD-OE1 3.36Å; K883-E885 WeakPolarHBondContact CG-OE1 3.35Å; K883-E885 IonicContact NZ-OE1 3.41Å; K883-E885 PolarHBondContact NZ-OE1 3.44Å; K883-E885 IonicContact NZ-OE2 2.75Å; K883-E885 PolarHBondContact NZ-OE2 2.83Å; K883-E885 PolarHBondContact O-N 3.06Å; K883-E885 VanDerWaalsContact O-N 3.15Å; E885-S898 WeakPolarHBondContact O-CB 3.3Å; E885-S898 PolarHBondContact O-OG 3.29Å; E885-V902 HydrophobicContact CB-CG2 3.88Å; E885-V902 HydrophobicContact CG-CG1 4.21Å; E885-V902 HydrophobicContact CG-CG2 3.7Å
886	F	94.6	Very high	91.1	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.009	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	141.6	160.4	52.1	-89.2	0	0	0	111.6	L871 A872 L873 T889 I895 L899	L871-F886 HydrophobicContact CB-CE2 4.09Å; A872-F886 WeakPolarHBondContact CA-O 3.42Å; L873-F886 HydrophobicContact CB-CD1 3.81Å; L873-F886 HydrophobicContact CB-CD2 4.45Å; L873-F886 HydrophobicContact CB-CE1 3.37Å; L873-F886 HydrophobicContact CB-CE2 4.07Å; L873-F886 HydrophobicContact CB-CG 4.34Å; L873-F886 HydrophobicContact CB-CZ 3.52Å; L873-F886 HydrophobicContact CD2-CD1 4.39Å; L873-F886 HydrophobicContact CD2-CE1 3.75Å; L873-F886 HydrophobicContact CD2-CZ 4.44Å; L873-F886 HydrophobicContact CG-CE1 4.21Å; L873-F886 PolarHBondContact N-O 3.22Å; L873-F886 PolarHBondContact O-N 3.36Å; F886-T889 HydrophobicContact CD2-CG2 3.84Å; F886-T889 HydrophobicContact CE2-CG2 4.41Å; F886-I895 HydrophobicContact CD2-CG1 4.28Å; F886-I895 HydrophobicContact CE1-CG2 4.19Å; F886-I895 HydrophobicContact CE2-CG1 3.95Å; F886-I895 HydrophobicContact CE2-CG2 4.27Å; F886-I895 HydrophobicContact CZ-CB 4.43Å; F886-I895 HydrophobicContact CZ-CG1 4.3Å; F886-I895 HydrophobicContact CZ-CG2 3.77Å; F886-L899 HydrophobicContact CE1-CD2 4.31Å; F886-L899 HydrophobicContact CE1-CG 4.1Å
887	P	93.4	Very high	91.1	Very high	63 Å²	63	46.3 Å²	46.3	41%	0.409	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	171	173.3	32.5	-36.6	0	0	0	112.3	T889 L922	P887-T889 WeakPolarHBondContact O-CB 3.33Å; P887-T889 PolarHBondContact O-N 3.28Å; P887-L922 HydrophobicContact CB-CD2 4.07Å
888	L	92.8	Very high	91.2	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.141	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	101.8	178.7	-81.6	171.9	0	0	0	111.9	D827 I829 R870 L871 A872	D827-L888 HydrophobicContact CB-CD1 4.37Å; D827-L888 HydrophobicContact CB-CD2 3.96Å; I829-L888 HydrophobicContact CG1-CD2 4.28Å; R870-L888 HydrophobicContact CB-CD2 4.43Å; L871-L888 WeakPolarHBondContact O-CA 3.36Å; A872-L888 HydrophobicContact CB-CB 4.49Å; A872-L888 HydrophobicContact CB-CD2 3.88Å; A872-L888 HydrophobicContact CB-CG 3.93Å
889	T	92.9	Very high	91.5	Very high	20 Å²	20	46.6 Å²	46.6	12%	0.123	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	163.2	-172.7	-170.1	0	0	0	0	111.5	R870 L871 F886 P887 N891 I895	R870-T889 CarbonylContact C-O 3.55Å; R870-T889 VanDerWaalsContact CA-O 3.3Å; R870-T889 WeakPolarHBondContact CA-O 3.48Å; R870-T889 WeakPolarHBondContact CB-O 3.35Å; L871-T889 PolarHBondContact N-O 3.27Å; L871-T889 PolarHBondContact O-N 2.62Å; F886-T889 HydrophobicContact CD2-CG2 3.84Å; F886-T889 HydrophobicContact CE2-CG2 4.41Å; P887-T889 WeakPolarHBondContact O-CB 3.33Å; P887-T889 PolarHBondContact O-N 3.28Å; T889-N891 PolarHBondContact OG1-N 3.16Å; T889-I895 HydrophobicContact CG2-CD1 4Å; T889-I895 HydrophobicContact CG2-CG1 3.52Å
890	H	91.8	Very high	91.8	Very high	58 Å²	58	48 Å²	48	27%	0.269	29%	0.287	S	S	.	.			trans	-125.2	-1.1	177.9	61.5	-81.5	0	0	0	112	A860 R870	A860-H890 HydrophobicContact CB-CB 3.74Å; A860-H890 WeakPolarHBondContact O-CB 3.3Å; A860-H890 PolarHBondContact O-CD2 3.17Å; R870-H890 HydrophobicContact CG-CB 4.43Å
891	N	92.4	Very high	92.3	Very high	73 Å²	73	47.9 Å²	47.9	39%	0.39	28%	0.279	S	S	.	.			trans	-90.3	107.2	-179.7	-176.7	-18.6	0	0	0	109.8	T889 T893 V894 I895	T889-N891 PolarHBondContact OG1-N 3.16Å; N891-T893 PolarHBondContact O-N 3.15Å; N891-T893 WeakPolarHBondContact OD1-CB 3.45Å; N891-T893 PolarHBondContact OD1-N 3.17Å; N891-V894 HydrophobicContact CB-CB 4.21Å; N891-V894 HydrophobicContact CB-CG2 3.99Å; N891-V894 PolarHBondContact O-N 3.39Å; N891-V894 VanDerWaalsContact O-N 3.1Å; N891-I895 PolarHBondContact O-N 3Å; N891-I895 VanDerWaalsContact O-N 3.14Å
892	L	91.6	Very high	92.5	Very high	56 Å²	56	44.2 Å²	44.2	29%	0.293	26%	0.26	S	S	.	.	H	α-helix	trans	-56.7	-35.5	-180	-176.1	61.2	0	0	0	113	A854 R855 L859 I895 V896	A854-L892 HydrophobicContact CB-CD1 3.94Å; R855-L892 HydrophobicContact CG-CD1 4.11Å; R855-L892 HydrophobicContact CG-CD2 4.35Å; L859-L892 HydrophobicContact CD1-CB 3.95Å; L859-L892 HydrophobicContact CD1-CD1 4.24Å; L892-I895 PolarHBondContact O-N 3.27Å; L892-V896 HydrophobicContact CD1-CG2 4.09Å; L892-V896 HydrophobicContact CG-CG2 4.26Å; L892-V896 VanDerWaalsContact O-CG2 3.28Å; L892-V896 WeakPolarHBondContact O-CG2 3.42Å; L892-V896 PolarHBondContact O-N 3.27Å
893	T	91.3	Very high	92.5	Very high	86 Å²	86	49 Å²	49	53%	0.528	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-43.8	177.1	-56.9	0	0	0	0	111	N891 I895 V896 D897	N891-T893 PolarHBondContact O-N 3.15Å; N891-T893 WeakPolarHBondContact OD1-CB 3.45Å; N891-T893 PolarHBondContact OD1-N 3.17Å; T893-I895 VanDerWaalsContact C-N 3.32Å; T893-I895 PolarHBondContact O-N 3.22Å; T893-V896 PolarHBondContact O-N 3.2Å; T893-D897 WeakPolarHBondContact CG2-OD2 3.45Å; T893-D897 VanDerWaalsContact O-CB 3.27Å; T893-D897 WeakPolarHBondContact O-CB 3.34Å; T893-D897 PolarHBondContact O-N 2.75Å
894	V	93	Very high	92.5	Very high	60 Å²	60	47.3 Å²	47.3	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176	175.4	0	0	0	0	111.3	N891 S898	N891-V894 HydrophobicContact CB-CB 4.21Å; N891-V894 HydrophobicContact CB-CG2 3.99Å; N891-V894 PolarHBondContact O-N 3.39Å; N891-V894 VanDerWaalsContact O-N 3.1Å; V894-S898 VanDerWaalsContact O-CB 3.27Å; V894-S898 WeakPolarHBondContact O-CB 3.14Å; V894-S898 PolarHBondContact O-N 3.48Å; V894-S898 PolarHBondContact O-OG 2.85Å
895	I	94.3	Very high	92.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-50.1	177.2	-63.8	167.6	0	0	0	110.7	A854 L859 L871 F886 T889 N891 L892 T893 L899	A854-I895 HydrophobicContact CB-CD1 4.3Å; A854-I895 HydrophobicContact CB-CG2 3.77Å; L859-I895 HydrophobicContact CD1-CD1 3.83Å; L871-I895 HydrophobicContact CB-CD1 4.11Å; L871-I895 HydrophobicContact CD2-CD1 4.4Å; F886-I895 HydrophobicContact CD2-CG1 4.28Å; F886-I895 HydrophobicContact CE1-CG2 4.19Å; F886-I895 HydrophobicContact CE2-CG1 3.95Å; F886-I895 HydrophobicContact CE2-CG2 4.27Å; F886-I895 HydrophobicContact CZ-CB 4.43Å; F886-I895 HydrophobicContact CZ-CG1 4.3Å; F886-I895 HydrophobicContact CZ-CG2 3.77Å; T889-I895 HydrophobicContact CG2-CD1 4Å; T889-I895 HydrophobicContact CG2-CG1 3.52Å; N891-I895 PolarHBondContact O-N 3Å; N891-I895 VanDerWaalsContact O-N 3.14Å; L892-I895 PolarHBondContact O-N 3.27Å; T893-I895 VanDerWaalsContact C-N 3.32Å; T893-I895 PolarHBondContact O-N 3.22Å; I895-L899 HydrophobicContact CG2-CD1 3.75Å; I895-L899 HydrophobicContact CG2-CG 4.43Å; I895-L899 VanDerWaalsContact O-CB 3.31Å; I895-L899 WeakPolarHBondContact O-CB 3.46Å; I895-L899 WeakPolarHBondContact O-CG 2.98Å; I895-L899 PolarHBondContact O-N 3.26Å
896	V	94	Very high	91.9	Very high	28 Å²	28	51.4 Å²	51.4	17%	0.17	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-44.8	-178.7	174.7	0	0	0	0	111.5	E851 L892 T893 L899 A900	E851-V896 HydrophobicContact CG-CG2 3.9Å; L892-V896 HydrophobicContact CD1-CG2 4.09Å; L892-V896 HydrophobicContact CG-CG2 4.26Å; L892-V896 VanDerWaalsContact O-CG2 3.28Å; L892-V896 WeakPolarHBondContact O-CG2 3.42Å; L892-V896 PolarHBondContact O-N 3.27Å; T893-V896 PolarHBondContact O-N 3.2Å; V896-L899 PolarHBondContact O-N 3.37Å; V896-A900 PolarHBondContact O-N 3.36Å
897	D	92.9	Very high	91.6	Very high	102 Å²	102	52.4 Å²	52.4	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-67.1	-40.7	-179.7	-67.9	-13.2	0	0	0	111.5	T893 A901	T893-D897 WeakPolarHBondContact CG2-OD2 3.45Å; T893-D897 VanDerWaalsContact O-CB 3.27Å; T893-D897 WeakPolarHBondContact O-CB 3.34Å; T893-D897 PolarHBondContact O-N 2.75Å; D897-A901 PolarHBondContact O-N 3.5Å
898	S	93.6	Very high	91.4	Very high	31 Å²	31	52.6 Å²	52.6	22%	0.217	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-46.1	171.3	-86.7	0	0	0	0	111.6	E885 V894 A900 A901 V902	E885-S898 WeakPolarHBondContact O-CB 3.3Å; E885-S898 PolarHBondContact O-OG 3.29Å; V894-S898 VanDerWaalsContact O-CB 3.27Å; V894-S898 WeakPolarHBondContact O-CB 3.14Å; V894-S898 PolarHBondContact O-N 3.48Å; V894-S898 PolarHBondContact O-OG 2.85Å; S898-A900 VanDerWaalsContact C-N 3.3Å; S898-A900 PolarHBondContact O-N 3.04Å; S898-A901 CarbonylContact O-C 3.59Å; S898-A901 WeakPolarHBondContact O-CA 2.98Å; S898-A901 PolarHBondContact O-N 2.76Å; S898-V902 WeakPolarHBondContact O-CG2 3.23Å; S898-V902 PolarHBondContact O-N 3.28Å
899	L	93.6	Very high	91.2	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-57.2	-42.5	177.5	-78.8	169.1	0	0	0	111.7	K847 I850 E851 L873 F886 I895 V896 A901 V902	K847-L899 HydrophobicContact CB-CD2 4.39Å; K847-L899 WeakPolarHBondContact CE-O 3.29Å; K847-L899 HydrophobicContact CG-CD2 4.44Å; K847-L899 PolarHBondContact NZ-O 3.42Å; I850-L899 HydrophobicContact CB-CD2 4.35Å; I850-L899 HydrophobicContact CG2-CD1 4.16Å; I850-L899 HydrophobicContact CG2-CD2 4.16Å; E851-L899 HydrophobicContact CB-CD1 3.78Å; E851-L899 HydrophobicContact CG-CD1 4.03Å; L873-L899 HydrophobicContact CD2-CD2 3.69Å; F886-L899 HydrophobicContact CE1-CD2 4.31Å; F886-L899 HydrophobicContact CE1-CG 4.1Å; I895-L899 HydrophobicContact CG2-CD1 3.75Å; I895-L899 HydrophobicContact CG2-CG 4.43Å; I895-L899 VanDerWaalsContact O-CB 3.31Å; I895-L899 WeakPolarHBondContact O-CB 3.46Å; I895-L899 WeakPolarHBondContact O-CG 2.98Å; I895-L899 PolarHBondContact O-N 3.26Å; V896-L899 PolarHBondContact O-N 3.37Å; L899-A901 PolarHBondContact O-N 2.03Å; L899-V902 PolarHBondContact O-N 3.01Å
900	A	90.9	Very high	91.1	Very high	82 Å²	82	51.1 Å²	51.1	68%	0.678	31%	0.305	S	S	*	.	H	α-helix	trans	-59.1	-35	173.6	0	0	0	0	0	112.5	V896 S898	V896-A900 PolarHBondContact O-N 3.36Å; S898-A900 VanDerWaalsContact C-N 3.3Å; S898-A900 PolarHBondContact O-N 3.04Å
901	A	90.8	Very high	91.1	Very high	62 Å²	62	48.7 Å²	48.7	51%	0.512	29%	0.294	S	S	.	.	H	α-helix	trans	-88.7	-2.8	-179.7	0	0	0	0	0	115.7	D897 S898 L899 N903	D897-A901 PolarHBondContact O-N 3.5Å; S898-A901 CarbonylContact O-C 3.59Å; S898-A901 WeakPolarHBondContact O-CA 2.98Å; S898-A901 PolarHBondContact O-N 2.76Å; L899-A901 PolarHBondContact O-N 2.03Å; A901-N903 PolarHBondContact O-N 2.78Å; A901-N903 VanDerWaalsContact O-N 3.11Å
902	V	91.1	Very high	91.1	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.03	28%	0.276	C	S	.	.			trans	-66.3	110.8	175.6	177.8	0	0	0	0	110.1	K847 L873 E885 S898 L899	K847-V902 HydrophobicContact CD-CB 4.06Å; K847-V902 HydrophobicContact CD-CG1 4.11Å; K847-V902 PolarHBondContact NZ-O 2.84Å; L873-V902 HydrophobicContact CD2-CG2 4.13Å; E885-V902 HydrophobicContact CB-CG2 3.88Å; E885-V902 HydrophobicContact CG-CG1 4.21Å; E885-V902 HydrophobicContact CG-CG2 3.7Å; S898-V902 WeakPolarHBondContact O-CG2 3.23Å; S898-V902 PolarHBondContact O-N 3.28Å; L899-V902 PolarHBondContact O-N 3.01Å
903	N	88.9	Confident	91.1	Very high	124 Å²	124	43.8 Å²	43.8	66%	0.663	27%	0.268	S	S	*	.			trans	-86.1	128.4	168.3	-65.2	-30.4	0	0	0	109.5	Q875 A901	Q875-N903 PolarHBondContact NE2-O 2.94Å; Q875-N903 PolarHBondContact OE1-O 3.2Å; A901-N903 PolarHBondContact O-N 2.78Å; A901-N903 VanDerWaalsContact O-N 3.11Å
904	Y	91.1	Very high	91.2	Very high	42 Å²	42	39.7 Å²	39.7	17%	0.165	24%	0.243	C	C	.	.			trans	-60.4	135.9	172.5	166.4	-110	0	0	0	111.4	S835 E836 G839 L840 H843 D906	S835-Y904 PolarHBondContact O-OH 2.98Å; S835-Y904 VanDerWaalsContact O-OH 3.12Å; E836-Y904 VanDerWaalsContact CA-OH 3.29Å; E836-Y904 WeakPolarHBondContact CA-OH 3.32Å; G839-Y904 WeakPolarHBondContact CA-OH 3.36Å; L840-Y904 HydrophobicContact CB-CD1 4.14Å; L840-Y904 HydrophobicContact CB-CE1 4.21Å; L840-Y904 HydrophobicContact CD1-CD1 3.98Å; L840-Y904 HydrophobicContact CD1-CG 3.98Å; H843-Y904 HydrophobicContact CB-CD2 3.83Å; H843-Y904 HydrophobicContact CB-CE2 4.33Å; H843-Y904 AromaticContact CG-CD2 3.68Å; H843-Y904 AromaticContact ND1-CD2 3.89Å; Y904-D906 HydrophobicContact CD1-CB 3.93Å; Y904-D906 HydrophobicContact CE1-CB 3.43Å; Y904-D906 VanDerWaalsContact CE1-CB 3.43Å; Y904-D906 VanDerWaalsContact CE1-CG 3.43Å; Y904-D906 WeakPolarHBondContact CE1-OD1 3.29Å; Y904-D906 VanDerWaalsContact CZ-OD1 3.24Å; Y904-D906 PolarHBondContact OH-OD1 2.89Å
905	L	87.7	Confident	91.2	Very high	55 Å²	55	36.8 Å²	36.8	29%	0.288	23%	0.226	S	C	.	.			trans	-82.2	-29	-171.7	-72	171.8	0	0	0	115.3	Q875	Q875-L905 HydrophobicContact CB-CD1 4.47Å; Q875-L905 HydrophobicContact CG-CD1 3.84Å; Q875-L905 HydrophobicContact CG-CG 4.2Å; Q875-L905 VanDerWaalsContact OE1-N 3.08Å
906	D	87.2	Confident	91.2	Very high	101 Å²	101	38.1 Å²	38.1	54%	0.54	23%	0.232	S	C	.	.			trans	51.8	57.8	179.5	-148.8	32.9	0	0	0	113.7	G834 Y904	G834-D906 PolarHBondContact O-N 2.84Å; Y904-D906 HydrophobicContact CD1-CB 3.93Å; Y904-D906 HydrophobicContact CE1-CB 3.43Å; Y904-D906 VanDerWaalsContact CE1-CB 3.43Å; Y904-D906 VanDerWaalsContact CE1-CG 3.43Å; Y904-D906 WeakPolarHBondContact CE1-OD1 3.29Å; Y904-D906 VanDerWaalsContact CZ-OD1 3.24Å; Y904-D906 PolarHBondContact OH-OD1 2.89Å
907	S	88.8	Confident	91.1	Very high	22 Å²	22	39.9 Å²	39.9	15%	0.154	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-138	-164	-170.2	61.9	0	0	0	0	113.3	G834 S835 E836 G877	G834-S907 PolarHBondContact O-N 3.35Å; S835-S907 CarbonylContact C-O 3.52Å; S835-S907 WeakPolarHBondContact CA-O 3.41Å; S835-S907 WeakPolarHBondContact CB-O 3.47Å; E836-S907 PolarHBondContact N-O 3.39Å; G877-S907 VanDerWaalsContact CA-OG 3.27Å; G877-S907 WeakPolarHBondContact CA-OG 3.32Å
908	S	87.5	Confident	91.2	Very high	67 Å²	67	35 Å²	35	47%	0.469	21%	0.211	S	C	.	.			trans	-79.3	169.6	171.7	62.6	0	0	0	0	111.4	G877 S878	G877-S908 CarbonylContact C-O 3.49Å; G877-S908 WeakPolarHBondContact CA-O 3.35Å; S878-S908 WeakPolarHBondContact CA-OG 3.37Å; S878-S908 VanDerWaalsContact CB-OG 3.31Å; S878-S908 WeakPolarHBondContact CB-OG 3.29Å; S878-S908 PolarHBondContact N-O 3.38Å; S878-S908 PolarHBondContact OG-OG 2.85Å
909	S	89.3	Confident	91.2	Very high	12 Å²	12	33.8 Å²	33.8	8%	0.084	20%	0.202	C	C	.	.			trans	-106.4	120.7	174.2	-176.4	0	0	0	0	109.8	D833 F876 T947 S948	D833-S909 PolarHBondContact OD2-OG 2.93Å; F876-S909 WeakPolarHBondContact CE2-OG 3.44Å; S909-T947 WeakPolarHBondContact CB-OG1 3.3Å; S909-T947 PolarHBondContact O-OG1 3.07Å; S909-T947 WeakPolarHBondContact OG-CB 3.32Å; S909-T947 PolarHBondContact OG-OG1 3.42Å; S909-S948 PolarHBondContact O-N 3.42Å
910	A	91.1	Very high	91	Very high	5 Å²	5	37.8 Å²	37.8	4%	0.041	22%	0.223	C	C	.	.			trans	-132.5	70.2	-179.7	0	0	0	0	0	111.9	G877 A879 G912 N913 A914 T947	G877-A910 WeakPolarHBondContact O-CB 3.5Å; G877-A910 PolarHBondContact O-N 3.2Å; A879-A910 HydrophobicContact CB-CB 4.26Å; A910-G912 VanDerWaalsContact C-N 3.34Å; A910-G912 PolarHBondContact O-N 3.26Å; A910-N913 PolarHBondContact O-N 3.07Å; A910-A914 PolarHBondContact O-N 2.77Å; A910-T947 PolarHBondContact N-OG1 2.83Å
911	L	91.8	Very high	91	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-33.8	-171.1	179.5	56.5	0	0	0	114.7	F876 N913 A914 I915 F941 T947 L952 V983	F876-L911 HydrophobicContact CE1-CD1 4.09Å; F876-L911 HydrophobicContact CE2-CB 4.02Å; F876-L911 HydrophobicContact CE2-CD1 4.04Å; F876-L911 HydrophobicContact CZ-CB 4.44Å; F876-L911 HydrophobicContact CZ-CD1 3.75Å; L911-N913 PolarHBondContact O-N 2.92Å; L911-A914 WeakPolarHBondContact O-CB 3.48Å; L911-A914 PolarHBondContact O-N 3.38Å; L911-I915 HydrophobicContact CD1-CD1 4.11Å; L911-I915 HydrophobicContact CD1-CG1 4.04Å; L911-I915 HydrophobicContact CG-CD1 3.97Å; L911-I915 HydrophobicContact CG-CG1 4.39Å; L911-I915 WeakPolarHBondContact O-CG1 3.36Å; L911-I915 PolarHBondContact O-N 3.15Å; L911-F941 HydrophobicContact CD1-CD1 3.58Å; L911-F941 HydrophobicContact CD1-CE1 3.72Å; L911-F941 HydrophobicContact CD2-CD1 4.42Å; L911-T947 HydrophobicContact CB-CG2 3.59Å; L911-T947 WeakPolarHBondContact CB-OG1 3.47Å; L911-T947 HydrophobicContact CD2-CG2 4.18Å; L911-T947 PolarHBondContact N-OG1 3.14Å; L911-L952 HydrophobicContact CB-CD1 4.45Å; L911-L952 HydrophobicContact CD2-CD1 4.5Å; L911-L952 HydrophobicContact CG-CD1 4.29Å; L911-V983 HydrophobicContact CD2-CB 4.5Å; L911-V983 HydrophobicContact CD2-CG1 4.19Å; L911-V983 HydrophobicContact CD2-CG2 3.47Å; L911-V983 VanDerWaalsContact CD2-CG2 3.47Å; L911-V983 HydrophobicContact CG-CG2 4.46Å
912	G	91.6	Very high	90.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-56.3	-52.4	179.3	0	0	0	0	0	112.6	A910 A914 I915 I916	A910-G912 VanDerWaalsContact C-N 3.34Å; A910-G912 PolarHBondContact O-N 3.26Å; G912-A914 VanDerWaalsContact C-N 3.31Å; G912-A914 PolarHBondContact O-N 3.13Å; G912-I915 PolarHBondContact O-N 3.34Å; G912-I916 WeakPolarHBondContact O-CG1 3.45Å; G912-I916 PolarHBondContact O-N 3.09Å
913	N	91.8	Very high	90.9	Very high	26 Å²	26	33 Å²	33	14%	0.139	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-34.3	177.4	-72.9	16.4	0	0	0	112.2	A879 H882 A910 L911 I915 I916 Y917 Q951	A879-N913 PolarHBondContact O-ND2 3.41Å; H882-N913 VanDerWaalsContact NE2-C 3.28Å; H882-N913 WeakPolarHBondContact NE2-CB 3.41Å; A910-N913 PolarHBondContact O-N 3.07Å; L911-N913 PolarHBondContact O-N 2.92Å; N913-I915 PolarHBondContact O-N 2.88Å; N913-I916 PolarHBondContact O-N 3.12Å; N913-Y917 WeakPolarHBondContact O-CB 3.49Å; N913-Y917 PolarHBondContact O-N 2.92Å; N913-Q951 WeakPolarHBondContact OD1-CB 3.44Å; N913-Q951 VanDerWaalsContact OD1-CD 3.31Å; N913-Q951 PolarHBondContact OD1-OE1 2.92Å; N913-Q951 VanDerWaalsContact OD1-OE1 3.1Å
914	A	93.1	Very high	90.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.5	-42.6	176.6	0	0	0	0	0	112.1	M831 F876 H882 A910 L911 G912 Y917 A918	M831-A914 VanDerWaalsContact CE-C 3.5Å; M831-A914 HydrophobicContact CE-CB 3.6Å; M831-A914 WeakPolarHBondContact CE-O 3.42Å; F876-A914 HydrophobicContact CB-CB 3.39Å; F876-A914 HydrophobicContact CD1-CB 4.21Å; F876-A914 HydrophobicContact CD2-CB 3.94Å; F876-A914 HydrophobicContact CG-CB 3.59Å; H882-A914 PolarHBondContact NE2-N 2.98Å; A910-A914 PolarHBondContact O-N 2.77Å; L911-A914 WeakPolarHBondContact O-CB 3.48Å; L911-A914 PolarHBondContact O-N 3.38Å; G912-A914 VanDerWaalsContact C-N 3.31Å; G912-A914 PolarHBondContact O-N 3.13Å; A914-Y917 PolarHBondContact O-N 2.82Å; A914-A918 WeakPolarHBondContact O-CB 3.4Å; A914-A918 PolarHBondContact O-N 3.01Å
915	I	94.4	Very high	90.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64	-44.2	175.7	-63.1	161.7	0	0	0	110.5	L911 G912 N913 Y917 A918 V919 F941 L952 G955 M959	L911-I915 HydrophobicContact CD1-CD1 4.11Å; L911-I915 HydrophobicContact CD1-CG1 4.04Å; L911-I915 HydrophobicContact CG-CD1 3.97Å; L911-I915 HydrophobicContact CG-CG1 4.39Å; L911-I915 WeakPolarHBondContact O-CG1 3.36Å; L911-I915 PolarHBondContact O-N 3.15Å; G912-I915 PolarHBondContact O-N 3.34Å; N913-I915 PolarHBondContact O-N 2.88Å; I915-Y917 VanDerWaalsContact C-N 3.31Å; I915-Y917 PolarHBondContact O-N 3.24Å; I915-A918 PolarHBondContact O-N 3.39Å; I915-V919 HydrophobicContact CG2-CG2 4.45Å; I915-V919 WeakPolarHBondContact O-CG2 3.29Å; I915-V919 PolarHBondContact O-N 3.2Å; I915-F941 HydrophobicContact CD1-CE1 3.97Å; I915-F941 HydrophobicContact CD1-CZ 4.05Å; I915-F941 HydrophobicContact CG1-CE1 3.67Å; I915-F941 HydrophobicContact CG1-CZ 3.97Å; I915-L952 HydrophobicContact CD1-CD1 4.39Å; I915-G955 WeakPolarHBondContact CG2-O 3.41Å; I915-M959 HydrophobicContact CD1-CE 4.47Å; I915-M959 HydrophobicContact CG2-CB 3.89Å
916	I	93.3	Very high	90.2	Very high	27 Å²	27	38.3 Å²	38.3	14%	0.138	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-43.8	176	-62	169.7	0	0	0	110.5	G912 N913 N920 Q951 E954 A958	G912-I916 WeakPolarHBondContact O-CG1 3.45Å; G912-I916 PolarHBondContact O-N 3.09Å; N913-I916 PolarHBondContact O-N 3.12Å; I916-N920 WeakPolarHBondContact CG2-ND2 3.34Å; I916-N920 WeakPolarHBondContact O-CB 3.39Å; I916-N920 VanDerWaalsContact O-CG 3.29Å; I916-N920 PolarHBondContact O-N 3.45Å; I916-N920 PolarHBondContact O-ND2 3.01Å; I916-N920 VanDerWaalsContact O-ND2 3.17Å; I916-Q951 HydrophobicContact CD1-CB 4.14Å; I916-E954 HydrophobicContact CD1-CB 4.01Å; I916-E954 HydrophobicContact CD1-CG 3.77Å; I916-E954 HydrophobicContact CG1-CG 4.43Å; I916-A958 HydrophobicContact CG1-CB 4.49Å
917	Y	93.4	Very high	89.7	Confident	66 Å²	66	41.2 Å²	41.2	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-48.1	176.6	178.2	-86	0	0	0	111.9	V874 H882 E884 N913 A914 I915 V919 N920 N921	V874-Y917 HydrophobicContact CG1-CD1 4.05Å; V874-Y917 HydrophobicContact CG1-CE1 4.22Å; V874-Y917 HydrophobicContact CG2-CD1 4.49Å; H882-Y917 HydrophobicContact CB-CD1 4.01Å; H882-Y917 HydrophobicContact CB-CD2 4.06Å; H882-Y917 HydrophobicContact CB-CE1 4.36Å; H882-Y917 HydrophobicContact CB-CE2 4.38Å; H882-Y917 HydrophobicContact CB-CG 3.86Å; E884-Y917 HydrophobicContact CB-CE1 4.42Å; N913-Y917 WeakPolarHBondContact O-CB 3.49Å; N913-Y917 PolarHBondContact O-N 2.92Å; A914-Y917 PolarHBondContact O-N 2.82Å; I915-Y917 VanDerWaalsContact C-N 3.31Å; I915-Y917 PolarHBondContact O-N 3.24Å; Y917-V919 PolarHBondContact O-N 3.44Å; Y917-N920 PolarHBondContact O-N 3.33Å; Y917-N921 WeakPolarHBondContact CD2-ND2 3.39Å; Y917-N921 HydrophobicContact CE1-CB 4.32Å; Y917-N921 WeakPolarHBondContact CE2-ND2 3.28Å; Y917-N921 WeakPolarHBondContact O-CB 3.28Å; Y917-N921 PolarHBondContact O-N 3.21Å; Y917-N921 PolarHBondContact O-ND2 3.36Å
918	A	94.1	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-44.6	179.4	0	0	0	0	0	111.7	M831 V874 A914 I915 N920 N921 L922 V923 F939	M831-A918 HydrophobicContact CE-CB 4.06Å; M831-A918 HydrophobicContact SD-CB 3.61Å; V874-A918 HydrophobicContact CG2-CB 4.1Å; A914-A918 WeakPolarHBondContact O-CB 3.4Å; A914-A918 PolarHBondContact O-N 3.01Å; I915-A918 PolarHBondContact O-N 3.39Å; A918-N920 PolarHBondContact O-N 2.95Å; A918-N921 PolarHBondContact O-N 3.21Å; A918-L922 WeakPolarHBondContact O-CA 3.07Å; A918-L922 WeakPolarHBondContact O-CB 3.47Å; A918-L922 PolarHBondContact O-N 3.45Å; A918-V923 PolarHBondContact O-N 3.32Å; A918-F939 HydrophobicContact CB-CE1 4.12Å
919	V	93.1	Very high	89.1	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.03	23%	0.227	C	C	.	.	I	π-helix	trans	-59.7	-44.7	175.3	170.8	0	0	0	0	111.5	I915 Y917 V923 I924 F939 A958 V962	I915-V919 HydrophobicContact CG2-CG2 4.45Å; I915-V919 WeakPolarHBondContact O-CG2 3.29Å; I915-V919 PolarHBondContact O-N 3.2Å; Y917-V919 PolarHBondContact O-N 3.44Å; V919-V923 WeakPolarHBondContact O-CB 3.32Å; V919-V923 PolarHBondContact O-N 3.47Å; V919-I924 PolarHBondContact O-N 3.38Å; V919-F939 HydrophobicContact CG2-CE1 4.46Å; V919-F939 HydrophobicContact CG2-CZ 3.96Å; V919-A958 HydrophobicContact CB-CB 4.35Å; V919-A958 HydrophobicContact CG1-CB 4.32Å; V919-A958 HydrophobicContact CG2-CB 4.16Å; V919-V962 HydrophobicContact CG1-CG1 3.82Å; V919-V962 HydrophobicContact CG2-CG2 4.09Å
920	N	91.1	Very high	88.9	Confident	87 Å²	87	50.3 Å²	50.3	47%	0.465	24%	0.241	S	C	.	.	I	π-helix	trans	-84.1	-5.2	-175.1	-67.8	-28.9	0	0	0	115.4	I916 Y917 A918 I924	I916-N920 WeakPolarHBondContact CG2-ND2 3.34Å; I916-N920 WeakPolarHBondContact O-CB 3.39Å; I916-N920 VanDerWaalsContact O-CG 3.29Å; I916-N920 PolarHBondContact O-N 3.45Å; I916-N920 PolarHBondContact O-ND2 3.01Å; I916-N920 VanDerWaalsContact O-ND2 3.17Å; Y917-N920 PolarHBondContact O-N 3.33Å; A918-N920 PolarHBondContact O-N 2.95Å; N920-I924 CarbonylContact C-O 3.43Å; N920-I924 WeakPolarHBondContact CA-O 3.48Å
921	N	89.7	Confident	88.7	Confident	46 Å²	46	50.4 Å²	50.4	25%	0.246	24%	0.241	C	C	.	.	I	π-helix	trans	-125	-37.5	179.4	-67.9	-79.7	0	0	0	113.7	Y917 A918 R925	Y917-N921 WeakPolarHBondContact CD2-ND2 3.39Å; Y917-N921 HydrophobicContact CE1-CB 4.32Å; Y917-N921 WeakPolarHBondContact CE2-ND2 3.28Å; Y917-N921 WeakPolarHBondContact O-CB 3.28Å; Y917-N921 PolarHBondContact O-N 3.21Å; Y917-N921 PolarHBondContact O-ND2 3.36Å; A918-N921 PolarHBondContact O-N 3.21Å; N921-R925 VanDerWaalsContact O-CZ 3.26Å; N921-R925 PolarHBondContact O-NE 3.17Å; N921-R925 PolarHBondContact O-NH2 3.44Å
922	L	89.8	Confident	88.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	24%	0.243	C	C	.	.	I	π-helix	trans	-99.7	-32.7	-178.5	-65.1	179.2	0	0	0	113.7	I829 A872 V874 E884 P887 A918 L930	I829-L922 HydrophobicContact CD1-CB 4.07Å; I829-L922 HydrophobicContact CD1-CD1 4.46Å; I829-L922 HydrophobicContact CG2-CD1 3.8Å; A872-L922 HydrophobicContact CB-CD1 3.75Å; A872-L922 HydrophobicContact CB-CD2 4.16Å; V874-L922 HydrophobicContact CG2-CD1 3.37Å; V874-L922 HydrophobicContact CG2-CG 4.33Å; E884-L922 HydrophobicContact CG-CD2 4.09Å; E884-L922 VanDerWaalsContact OE2-CD2 3.23Å; E884-L922 WeakPolarHBondContact OE2-CD2 3.33Å; P887-L922 HydrophobicContact CB-CD2 4.07Å; A918-L922 WeakPolarHBondContact O-CA 3.07Å; A918-L922 WeakPolarHBondContact O-CB 3.47Å; A918-L922 PolarHBondContact O-N 3.45Å; L922-L930 WeakPolarHBondContact O-CB 3.41Å
923	V	89.8	Confident	88	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.281	C	S	.	.	I	π-helix	trans	-94.3	-48.1	-177.1	-168.5	0	0	0	0	111.5	I829 A918 V919 R929 L930 S931 L937 F939 V962	I829-V923 HydrophobicContact CD1-CG2 3.55Å; A918-V923 PolarHBondContact O-N 3.32Å; V919-V923 WeakPolarHBondContact O-CB 3.32Å; V919-V923 PolarHBondContact O-N 3.47Å; V923-R929 CarbonylContact O-C 3.57Å; V923-R929 VanDerWaalsContact O-CA 3.31Å; V923-R929 WeakPolarHBondContact O-CA 3.29Å; V923-L930 PolarHBondContact O-N 3.44Å; V923-S931 WeakPolarHBondContact CG1-OG 3.45Å; V923-S931 PolarHBondContact O-N 3.42Å; V923-L937 HydrophobicContact CB-CD2 4.47Å; V923-L937 HydrophobicContact CG1-CD2 3.55Å; V923-L937 HydrophobicContact CG2-CD1 4.36Å; V923-L937 HydrophobicContact CG2-CD2 3.99Å; V923-F939 HydrophobicContact CG2-CZ 3.88Å; V923-V962 HydrophobicContact CG1-CB 3.89Å; V923-V962 HydrophobicContact CG1-CG1 4Å; V923-V962 HydrophobicContact CG1-CG2 4.11Å
924	I	87.2	Confident	87.6	Confident	57 Å²	57	64.5 Å²	64.5	29%	0.292	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	110	179	-55.6	177.1	0	0	0	108.7	V919 N920 Q928 R929 V962	V919-I924 PolarHBondContact O-N 3.38Å; N920-I924 CarbonylContact C-O 3.43Å; N920-I924 WeakPolarHBondContact CA-O 3.48Å; I924-Q928 CarbonylContact C-O 3.57Å; I924-Q928 WeakPolarHBondContact CA-O 3.4Å; I924-R929 HydrophobicContact CG1-CG 4.47Å; I924-V962 HydrophobicContact CD1-CG1 3.79Å; I924-V962 HydrophobicContact CG1-CG1 4.37Å
925	R	85.7	Confident	87.2	Confident	91 Å²	91	65 Å²	65	34%	0.343	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.7	175.9	-165.9	178.4	-68.2	-159.7	-0.4	108.8	E884 N921 N927 Q928 L930	E884-R925 IonicContact OE1-CZ 3.94Å; E884-R925 IonicContact OE1-NH1 2.78Å; E884-R925 IonicContact OE1-NH2 3.64Å; E884-R925 PolarHBondContact OE1-NH2 2.74Å; E884-R925 IonicContact OE2-CZ 3.99Å; E884-R925 IonicContact OE2-NH2 2.91Å; E884-R925 PolarHBondContact OE2-NH2 3.31Å; N921-R925 VanDerWaalsContact O-CZ 3.26Å; N921-R925 PolarHBondContact O-NE 3.17Å; N921-R925 PolarHBondContact O-NH2 3.44Å; R925-N927 VanDerWaalsContact C-N 3.33Å; R925-N927 PolarHBondContact O-N 2.93Å; R925-Q928 PolarHBondContact N-O 3Å; R925-Q928 PolarHBondContact O-N 3.32Å; R925-L930 HydrophobicContact CB-CD1 3.66Å; R925-L930 HydrophobicContact CB-CG 4.15Å
926	Q	80.4	Confident	86.9	Confident	186 Å²	186	68.1 Å²	68.1	87%	0.869	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	46.6	-179.4	-60.5	179.8	-4.5	0	0	114.1	Q928	Q926-Q928 PolarHBondContact O-N 3.09Å
927	N	76.9	Confident	86.9	Confident	162 Å²	162	67 Å²	67	87%	0.866	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	11.7	-175.1	-64.8	-10.8	0	0	0	116.1	R925	R925-N927 VanDerWaalsContact C-N 3.33Å; R925-N927 PolarHBondContact O-N 2.93Å
928	Q	80.8	Confident	87	Confident	144 Å²	144	64 Å²	64	67%	0.673	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	170.6	-58.9	-171.8	7.7	0	0	110.1	I924 R925 Q926 L930	I924-Q928 CarbonylContact C-O 3.57Å; I924-Q928 WeakPolarHBondContact CA-O 3.4Å; R925-Q928 PolarHBondContact N-O 3Å; R925-Q928 PolarHBondContact O-N 3.32Å; Q926-Q928 PolarHBondContact O-N 3.09Å; Q928-L930 PolarHBondContact O-N 3.1Å
929	R	83.7	Confident	87.1	Confident	76 Å²	76	64 Å²	64	29%	0.287	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114.1	174.7	-169.5	174.5	168.6	160.3	-5	108.4	V923 I924 S931 E963	V923-R929 CarbonylContact O-C 3.57Å; V923-R929 VanDerWaalsContact O-CA 3.31Å; V923-R929 WeakPolarHBondContact O-CA 3.29Å; I924-R929 HydrophobicContact CG1-CG 4.47Å; R929-S931 WeakPolarHBondContact CG-OG 3.42Å; R929-S931 PolarHBondContact NE-OG 3.13Å; R929-E963 IonicContact CZ-OE2 2.91Å; R929-E963 IonicContact NH1-OE2 3.97Å; R929-E963 PolarHBondContact NH1-OE2 2.94Å; R929-E963 IonicContact NH2-OE2 3.74Å
930	L	84.7	Confident	87.2	Confident	72 Å²	72	63.7 Å²	63.7	38%	0.377	30%	0.3	S	S	.	.			trans	-82.7	-26.8	177.2	-64.5	179.5	0	0	0	111.8	R870 L922 V923 R925 Q928	R870-L930 PolarHBondContact NH2-O 3.24Å; L922-L930 WeakPolarHBondContact O-CB 3.41Å; V923-L930 PolarHBondContact O-N 3.44Å; R925-L930 HydrophobicContact CB-CD1 3.66Å; R925-L930 HydrophobicContact CB-CG 4.15Å; Q928-L930 PolarHBondContact O-N 3.1Å
931	S	87.2	Confident	87.5	Confident	6 Å²	6	59.6 Å²	59.6	4%	0.042	28%	0.278	C	S	.	.	S	Bend	trans	-69.9	146.2	168.9	64.8	0	0	0	0	111.4	D827 V923 R929	D827-S931 WeakPolarHBondContact OD2-CA 3.38Å; D827-S931 WeakPolarHBondContact OD2-CB 3.34Å; V923-S931 WeakPolarHBondContact CG1-OG 3.45Å; V923-S931 PolarHBondContact O-N 3.42Å; R929-S931 WeakPolarHBondContact CG-OG 3.42Å; R929-S931 PolarHBondContact NE-OG 3.13Å
932	R	87.8	Confident	87.7	Confident	16 Å²	16	57.4 Å²	57.4	6%	0.06	27%	0.266	C	S	.	.			trans	-68.8	135.8	176.2	-72.1	169.7	-66.7	165	2.9	108.7	V826 D827 D865 K868 N934 A935	V826-R932 PolarHBondContact O-NH2 2.87Å; D827-R932 IonicContact OD1-CZ 2.66Å; D827-R932 IonicContact OD1-NE 2.75Å; D827-R932 PolarHBondContact OD1-NE 3.22Å; D827-R932 IonicContact OD1-NH2 3.31Å; D827-R932 PolarHBondContact OD1-NH2 2.81Å; D827-R932 PolarHBondContact OD2-N 3.3Å; D827-R932 IonicContact OD2-NE 2.66Å; D865-R932 WeakPolarHBondContact O-CD 3.28Å; D865-R932 PolarHBondContact O-NH1 2.88Å; K868-R932 PolarHBondContact O-NH1 3.47Å; K868-R932 PolarHBondContact O-NH2 2.83Å; R932-N934 VanDerWaalsContact C-N 3.28Å; R932-N934 PolarHBondContact O-N 2.96Å; R932-A935 HydrophobicContact CB-CB 3.57Å; R932-A935 PolarHBondContact O-N 3.37Å
933	R	81.3	Confident	87.8	Confident	216 Å²	216	57.6 Å²	57.6	82%	0.815	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.2	-178.4	-70.3	-173.1	179.3	-158.7	-0.1	114
934	N	81.6	Confident	87.7	Confident	97 Å²	97	58.1 Å²	58.1	52%	0.519	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	5.9	176.9	57.1	-21.1	0	0	0	112.2	P825 D866 R932	P825-N934 WeakPolarHBondContact CG-O 3.21Å; D866-N934 WeakPolarHBondContact CB-ND2 3.37Å; R932-N934 VanDerWaalsContact C-N 3.28Å; R932-N934 PolarHBondContact O-N 2.96Å
935	A	85.8	Confident	87.5	Confident	11 Å²	11	55.5 Å²	55.5	9%	0.091	26%	0.256	C	S	.	.	S	Bend	trans	-97.4	147.6	170.4	0	0	0	0	0	110.8	P825 R932	P825-A935 HydrophobicContact CB-CB 3.83Å; P825-A935 HydrophobicContact CG-CB 4.49Å; P825-A935 WeakPolarHBondContact O-CA 3.14Å; P825-A935 WeakPolarHBondContact O-CB 3.47Å; R932-A935 HydrophobicContact CB-CB 3.57Å; R932-A935 PolarHBondContact O-N 3.37Å
936	E	88.8	Confident	87.4	Confident	65 Å²	65	53.7 Å²	53.7	30%	0.304	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	141.9	164	-165.3	166.8	116.6	0	0	109.9	R824 P825 V826 D827 V965	R824-E936 IonicContact CZ-OE2 2.63Å; R824-E936 IonicContact NE-OE2 3.81Å; R824-E936 VanDerWaalsContact NH2-CD 3.3Å; R824-E936 IonicContact NH2-OE1 3.14Å; R824-E936 PolarHBondContact NH2-OE1 3.36Å; R824-E936 IonicContact NH2-OE2 3.77Å; R824-E936 PolarHBondContact NH2-OE2 3.46Å; P825-E936 PolarHBondContact O-N 3.3Å; V826-E936 CarbonylContact C-O 3.53Å; V826-E936 WeakPolarHBondContact CA-O 3.42Å; V826-E936 HydrophobicContact CG1-CB 4.47Å; D827-E936 PolarHBondContact N-O 2.86Å; E936-V965 HydrophobicContact CG-CG2 3.99Å
937	L	92.8	Very high	87.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	86.7	-175.7	-176.6	65.1	0	0	0	109.7	D827 I829 V923 F939 V962 G964 V965	D827-L937 HydrophobicContact CB-CD1 3.94Å; D827-L937 WeakPolarHBondContact O-CA 3.35Å; I829-L937 HydrophobicContact CD1-CD1 3.91Å; I829-L937 HydrophobicContact CG1-CD1 4.37Å; V923-L937 HydrophobicContact CB-CD2 4.47Å; V923-L937 HydrophobicContact CG1-CD2 3.55Å; V923-L937 HydrophobicContact CG2-CD1 4.36Å; V923-L937 HydrophobicContact CG2-CD2 3.99Å; L937-F939 HydrophobicContact CD2-CE2 3.8Å; L937-F939 HydrophobicContact CD2-CZ 4.46Å; L937-F939 HydrophobicContact CG-CD2 4.32Å; L937-F939 HydrophobicContact CG-CE2 3.8Å; L937-V962 HydrophobicContact CD2-CB 4.11Å; L937-V962 HydrophobicContact CD2-CG2 3.72Å; L937-G964 CarbonylContact O-C 3.59Å; L937-G964 WeakPolarHBondContact O-CA 3.48Å; L937-V965 PolarHBondContact O-N 3.12Å
938	A	94	Very high	88.1	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.4	-176.1	0	0	0	0	0	111.1	V826 D827 V828 I829 V965 I1013	V826-A938 HydrophobicContact CG1-CB 4.09Å; D827-A938 PolarHBondContact O-N 3.44Å; V828-A938 CarbonylContact C-O 3.17Å; V828-A938 WeakPolarHBondContact CA-O 3.17Å; V828-A938 HydrophobicContact CG2-CB 4.48Å; I829-A938 PolarHBondContact N-O 3.26Å; A938-V965 CarbonylContact C-O 3.56Å; A938-V965 WeakPolarHBondContact CA-O 3.39Å; A938-I1013 HydrophobicContact CB-CD1 4.46Å
939	F	96.4	Very high	88.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	109.2	171.5	-78	-98.5	0	0	0	109.4	I829 M831 A918 V919 V923 L937 F941 M959 V962 V965 P966 T967	I829-F939 HydrophobicContact CB-CD1 4.29Å; I829-F939 HydrophobicContact CD1-CE1 4.17Å; I829-F939 HydrophobicContact CD1-CZ 4.14Å; I829-F939 HydrophobicContact CG2-CD1 4.29Å; I829-F939 HydrophobicContact CG2-CE1 4.36Å; I829-F939 WeakPolarHBondContact O-CA 3.48Å; M831-F939 HydrophobicContact CG-CD1 4.29Å; A918-F939 HydrophobicContact CB-CE1 4.12Å; V919-F939 HydrophobicContact CG2-CE1 4.46Å; V919-F939 HydrophobicContact CG2-CZ 3.96Å; V923-F939 HydrophobicContact CG2-CZ 3.88Å; L937-F939 HydrophobicContact CD2-CE2 3.8Å; L937-F939 HydrophobicContact CD2-CZ 4.46Å; L937-F939 HydrophobicContact CG-CD2 4.32Å; L937-F939 HydrophobicContact CG-CE2 3.8Å; F939-F941 HydrophobicContact CB-CE2 3.76Å; F939-F941 HydrophobicContact CB-CZ 3.8Å; F939-F941 HydrophobicContact CD1-CZ 4.36Å; F939-F941 HydrophobicContact CG-CZ 4.43Å; F939-M959 HydrophobicContact CB-SD 3.69Å; F939-M959 HydrophobicContact CD1-SD 4.14Å; F939-M959 HydrophobicContact CD2-CG 3.8Å; F939-M959 HydrophobicContact CD2-SD 3.72Å; F939-M959 HydrophobicContact CE2-CG 3.88Å; F939-M959 HydrophobicContact CE2-SD 4.32Å; F939-M959 HydrophobicContact CG-CG 4.25Å; F939-M959 HydrophobicContact CG-SD 3.6Å; F939-M959 VanDerWaalsContact CG-SD 3.6Å; F939-M959 HydrophobicContact CZ-CG 4.39Å; F939-V962 HydrophobicContact CE2-CG2 4.27Å; F939-V962 HydrophobicContact CZ-CG2 4.45Å; F939-V965 PolarHBondContact N-O 3.29Å; F939-P966 CarbonylContact O-C 3.49Å; F939-T967 PolarHBondContact O-N 3.42Å
940	V	96.8	Very high	88.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	104.5	-178.7	-176.5	0	0	0	0	109.7	V828 I829 F830 M831 I942 T967 I969 F1009 I1013	V828-V940 HydrophobicContact CG1-CG2 3.82Å; I829-V940 PolarHBondContact O-N 3.44Å; F830-V940 WeakPolarHBondContact CA-O 3.28Å; F830-V940 HydrophobicContact CD1-CB 3.75Å; F830-V940 HydrophobicContact CD1-CG1 3.78Å; F830-V940 HydrophobicContact CE1-CB 3.85Å; F830-V940 HydrophobicContact CE1-CG1 3.63Å; F830-V940 HydrophobicContact CE1-CG2 4.34Å; F830-V940 HydrophobicContact CG-CB 4.49Å; M831-V940 PolarHBondContact N-O 2.96Å; V940-I942 HydrophobicContact CG1-CG1 4.42Å; V940-T967 CarbonylContact C-O 3.58Å; V940-T967 WeakPolarHBondContact CA-O 3.34Å; V940-I969 HydrophobicContact CG1-CD1 4.02Å; V940-F1009 HydrophobicContact CG1-CE2 3.79Å; V940-F1009 HydrophobicContact CG1-CZ 3.78Å; V940-F1009 HydrophobicContact CG2-CE2 4.31Å; V940-F1009 HydrophobicContact CG2-CZ 4Å; V940-I1013 HydrophobicContact CG2-CD1 3.95Å
941	F	95.6	Very high	88.5	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.7	176.7	-54.8	-79.6	0	0	0	110.1	M831 L911 I915 F939 M959 P966 T967 V968 I969 V983	M831-F941 HydrophobicContact CB-CD1 3.46Å; M831-F941 VanDerWaalsContact CB-CD1 3.46Å; M831-F941 HydrophobicContact CB-CE1 3.84Å; M831-F941 HydrophobicContact CB-CG 4.33Å; M831-F941 HydrophobicContact CG-CD1 3.81Å; M831-F941 HydrophobicContact CG-CE1 3.64Å; M831-F941 HydrophobicContact CG-CZ 4.48Å; M831-F941 WeakPolarHBondContact O-CA 3.34Å; L911-F941 HydrophobicContact CD1-CD1 3.58Å; L911-F941 HydrophobicContact CD1-CE1 3.72Å; L911-F941 HydrophobicContact CD2-CD1 4.42Å; I915-F941 HydrophobicContact CD1-CE1 3.97Å; I915-F941 HydrophobicContact CD1-CZ 4.05Å; I915-F941 HydrophobicContact CG1-CE1 3.67Å; I915-F941 HydrophobicContact CG1-CZ 3.97Å; F939-F941 HydrophobicContact CB-CE2 3.76Å; F939-F941 HydrophobicContact CB-CZ 3.8Å; F939-F941 HydrophobicContact CD1-CZ 4.36Å; F939-F941 HydrophobicContact CG-CZ 4.43Å; F941-M959 HydrophobicContact CE2-CE 4.06Å; F941-M959 HydrophobicContact CE2-SD 4Å; F941-M959 HydrophobicContact CZ-CE 3.89Å; F941-M959 HydrophobicContact CZ-SD 3.74Å; F941-P966 HydrophobicContact CE2-CB 4.08Å; F941-T967 WeakPolarHBondContact CD2-O 3.45Å; F941-T967 PolarHBondContact N-O 2.83Å; F941-V968 HydrophobicContact CB-CG1 4.49Å; F941-V968 HydrophobicContact CD2-CG2 3.98Å; F941-I969 WeakPolarHBondContact O-CB 3.39Å; F941-I969 PolarHBondContact O-N 3.18Å; F941-V983 HydrophobicContact CD1-CG1 4.41Å; F941-V983 HydrophobicContact CD2-CG1 3.59Å; F941-V983 HydrophobicContact CE1-CG1 4.42Å; F941-V983 HydrophobicContact CE2-CG1 3.6Å; F941-V983 HydrophobicContact CG-CG1 4.02Å; F941-V983 HydrophobicContact CZ-CG1 4.03Å
942	I	94.9	Very high	88.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	111.6	172.9	-54.9	176.3	0	0	0	107.3	F830 M831 L832 D833 M838 A846 F849 I850 V940 I969 F997	F830-I942 HydrophobicContact CD1-CD1 3.99Å; F830-I942 HydrophobicContact CE1-CD1 4.29Å; M831-I942 PolarHBondContact O-N 3.4Å; L832-I942 HydrophobicContact CD1-CB 4.18Å; L832-I942 HydrophobicContact CD1-CG2 4.26Å; D833-I942 VanDerWaalsContact CB-O 3.29Å; D833-I942 WeakPolarHBondContact CB-O 3.46Å; D833-I942 PolarHBondContact N-O 3.32Å; M838-I942 HydrophobicContact CE-CG2 4.3Å; A846-I942 HydrophobicContact CB-CG2 3.92Å; F849-I942 HydrophobicContact CD1-CD1 3.98Å; F849-I942 HydrophobicContact CE1-CD1 4.24Å; I850-I942 HydrophobicContact CD1-CD1 4.13Å; I850-I942 HydrophobicContact CG1-CD1 4.02Å; V940-I942 HydrophobicContact CG1-CG1 4.42Å; I942-I969 HydrophobicContact CG1-CB 4.31Å; I942-I969 HydrophobicContact CG1-CD1 4.15Å; I942-F997 HydrophobicContact CG2-CE1 4.01Å
943	T	92.4	Very high	88.9	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	164.1	-171.3	178.5	0	0	0	0	110.5	D833 G945 I969 L971	D833-T943 PolarHBondContact OD2-OG1 2.95Å; T943-G945 PolarHBondContact O-N 2.78Å; T943-G945 PolarHBondContact OG1-N 3.01Å; T943-I969 PolarHBondContact N-O 2.75Å; T943-I969 VanDerWaalsContact N-O 3.13Å; T943-L971 PolarHBondContact O-N 2.89Å
944	D	87.6	Confident	89.4	Confident	11 Å²	11	37.1 Å²	37.1	6%	0.059	20%	0.199	C	C	.	.			trans	-71.3	-16.2	168	81.2	-34.1	0	0	0	112	R837 I946 T975	R837-D944 WeakPolarHBondContact CB-OD2 3.46Å; R837-D944 IonicContact CZ-OD2 3.15Å; R837-D944 IonicContact NE-OD2 2.78Å; R837-D944 PolarHBondContact NE-OD2 3.14Å; R837-D944 IonicContact NH2-OD2 2.68Å; R837-D944 PolarHBondContact NH2-OD2 2.75Å; D944-I946 PolarHBondContact OD1-N 2.84Å; D944-T975 WeakPolarHBondContact O-CG2 3.34Å
945	G	81.4	Confident	90	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.01	18%	0.175	C	C	.	.	S	Bend	trans	101	8.3	177.7	0	0	0	0	0	114.8	T943 D976	T943-G945 PolarHBondContact O-N 2.78Å; T943-G945 PolarHBondContact OG1-N 3.01Å; G945-D976 PolarHBondContact O-N 3.28Å
946	I	84.5	Confident	90.4	Very high	53 Å²	53	32.2 Å²	32.2	27%	0.272	17%	0.172	S	C	.	.			trans	-126.1	115.5	176.6	-72.1	177.3	0	0	0	110.4	D944 D974 D976	D944-I946 PolarHBondContact OD1-N 2.84Å; I946-D974 HydrophobicContact CD1-CB 4.08Å; I946-D974 VanDerWaalsContact CD1-O 3.31Å; I946-D974 WeakPolarHBondContact CD1-O 3.43Å; I946-D976 HydrophobicContact CG1-CB 4.3Å
947	T	87.1	Confident	90.6	Very high	18 Å²	18	34.2 Å²	34.2	11%	0.11	18%	0.181	C	C	.	.			trans	-139.9	163	-176.8	-156.4	0	0	0	0	111.1	S909 A910 L911 V979	S909-T947 WeakPolarHBondContact CB-OG1 3.3Å; S909-T947 PolarHBondContact O-OG1 3.07Å; S909-T947 WeakPolarHBondContact OG-CB 3.32Å; S909-T947 PolarHBondContact OG-OG1 3.42Å; A910-T947 PolarHBondContact N-OG1 2.83Å; L911-T947 HydrophobicContact CB-CG2 3.59Å; L911-T947 WeakPolarHBondContact CB-OG1 3.47Å; L911-T947 HydrophobicContact CD2-CG2 4.18Å; L911-T947 PolarHBondContact N-OG1 3.14Å; T947-V979 HydrophobicContact CG2-CG1 3.6Å
948	S	84.8	Confident	90.6	Very high	38 Å²	38	34.1 Å²	34.1	27%	0.266	18%	0.181	S	C	.	.			trans	-68.4	137.5	171.8	-169.4	0	0	0	0	111.5	S909 D950	S909-S948 PolarHBondContact O-N 3.42Å; S948-D950 PolarHBondContact O-N 3.08Å; S948-D950 PolarHBondContact OG-N 3.21Å; S948-D950 PolarHBondContact OG-OD2 3.37Å
949	T	84.4	Confident	90.6	Very high	92 Å²	92	34 Å²	34	56%	0.564	18%	0.18	S	C	*	.			trans	-74.2	-3.9	171	49.1	0	0	0	0	113.1	Q951 L952 V979	T949-Q951 PolarHBondContact O-N 3.02Å; T949-L952 HydrophobicContact CG2-CD2 4.42Å; T949-L952 VanDerWaalsContact O-CB 3.32Å; T949-L952 WeakPolarHBondContact O-CB 3.38Å; T949-L952 PolarHBondContact O-N 3.19Å; T949-V979 HydrophobicContact CG2-CG2 3.82Å
950	D	85.6	Confident	90.4	Very high	99 Å²	99	39.3 Å²	39.3	53%	0.529	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	119.7	174.8	-71.8	-50.5	0	0	0	112	S948 L952	S948-D950 PolarHBondContact O-N 3.08Å; S948-D950 PolarHBondContact OG-N 3.21Å; S948-D950 PolarHBondContact OG-OD2 3.37Å; D950-L952 PolarHBondContact O-N 3.2Å
951	Q	87.6	Confident	90.1	Very high	96 Å²	96	47 Å²	47	45%	0.449	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	17.5	-176.9	-54.5	-172.6	-115	0	0	115.1	N913 I916 T949 D953 E954 G955	N913-Q951 WeakPolarHBondContact OD1-CB 3.44Å; N913-Q951 VanDerWaalsContact OD1-CD 3.31Å; N913-Q951 PolarHBondContact OD1-OE1 2.92Å; N913-Q951 VanDerWaalsContact OD1-OE1 3.1Å; I916-Q951 HydrophobicContact CD1-CB 4.14Å; T949-Q951 PolarHBondContact O-N 3.02Å; Q951-D953 VanDerWaalsContact C-N 3.34Å; Q951-D953 PolarHBondContact O-N 3.11Å; Q951-E954 HydrophobicContact CB-CB 4.38Å; Q951-E954 PolarHBondContact NE2-OE2 2.79Å; Q951-E954 WeakPolarHBondContact O-CA 3.49Å; Q951-E954 PolarHBondContact O-N 3.2Å; Q951-G955 PolarHBondContact O-N 2.86Å
952	L	91	Very high	89.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-40.1	-176.6	-171.6	55.3	0	0	0	112.2	L911 I915 T949 D950 E954 G955 V956 V979 Q982 V983	L911-L952 HydrophobicContact CB-CD1 4.45Å; L911-L952 HydrophobicContact CD2-CD1 4.5Å; L911-L952 HydrophobicContact CG-CD1 4.29Å; I915-L952 HydrophobicContact CD1-CD1 4.39Å; T949-L952 HydrophobicContact CG2-CD2 4.42Å; T949-L952 VanDerWaalsContact O-CB 3.32Å; T949-L952 WeakPolarHBondContact O-CB 3.38Å; T949-L952 PolarHBondContact O-N 3.19Å; D950-L952 PolarHBondContact O-N 3.2Å; L952-E954 VanDerWaalsContact C-N 3.32Å; L952-E954 PolarHBondContact O-N 2.96Å; L952-G955 PolarHBondContact O-N 3.12Å; L952-V956 WeakPolarHBondContact O-CG2 3.33Å; L952-V956 PolarHBondContact O-N 3.3Å; L952-V979 HydrophobicContact CD2-CB 4.44Å; L952-V979 HydrophobicContact CD2-CG1 4.09Å; L952-V979 HydrophobicContact CD2-CG2 4.12Å; L952-Q982 VanDerWaalsContact CD2-OE1 3.29Å; L952-V983 HydrophobicContact CD1-CG2 3.92Å; L952-V983 HydrophobicContact CD2-CG2 4.47Å
953	D	91.8	Very high	89.7	Confident	100 Å²	100	53.7 Å²	53.7	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-59	-38.6	170.4	-87.1	-47.4	0	0	0	113.4	Q951 Q957 Q982	Q951-D953 VanDerWaalsContact C-N 3.34Å; Q951-D953 PolarHBondContact O-N 3.11Å; D953-Q957 VanDerWaalsContact O-CB 3.28Å; D953-Q957 WeakPolarHBondContact O-CB 3.18Å; D953-Q957 WeakPolarHBondContact O-CG 3.46Å; D953-Q957 PolarHBondContact O-N 3.32Å; D953-Q957 PolarHBondContact O-NE2 2.64Å; D953-Q982 PolarHBondContact OD1-NE2 3.24Å; D953-Q982 PolarHBondContact OD2-NE2 2.75Å
954	E	93.1	Very high	89.6	Confident	87 Å²	87	53.7 Å²	53.7	41%	0.407	27%	0.265	S	S	.	.	H	α-helix	trans	-73.8	-37.1	179.7	-175.5	175.6	-165.5	0	0	111.2	I916 Q951 L952 Q957 A958	I916-E954 HydrophobicContact CD1-CB 4.01Å; I916-E954 HydrophobicContact CD1-CG 3.77Å; I916-E954 HydrophobicContact CG1-CG 4.43Å; Q951-E954 HydrophobicContact CB-CB 4.38Å; Q951-E954 PolarHBondContact NE2-OE2 2.79Å; Q951-E954 WeakPolarHBondContact O-CA 3.49Å; Q951-E954 PolarHBondContact O-N 3.2Å; L952-E954 VanDerWaalsContact C-N 3.32Å; L952-E954 PolarHBondContact O-N 2.96Å; E954-Q957 PolarHBondContact O-N 3.33Å; E954-A958 WeakPolarHBondContact O-CB 3.29Å; E954-A958 PolarHBondContact O-N 2.98Å
955	G	93.2	Very high	89.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-52.4	170.2	0	0	0	0	0	112.1	I915 Q951 L952 Q957 A958 M959	I915-G955 WeakPolarHBondContact CG2-O 3.41Å; Q951-G955 PolarHBondContact O-N 2.86Å; L952-G955 PolarHBondContact O-N 3.12Å; G955-Q957 VanDerWaalsContact C-N 3.29Å; G955-Q957 PolarHBondContact O-N 3.3Å; G955-A958 WeakPolarHBondContact O-CA 3.41Å; G955-A958 WeakPolarHBondContact O-CB 3.28Å; G955-A958 PolarHBondContact O-N 2.88Å; G955-M959 PolarHBondContact O-N 3.23Å
956	V	93.8	Very high	90.4	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.03	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-37.6	177.4	172.4	0	0	0	0	111.4	L952 M959 K960 Q982 M985	L952-V956 WeakPolarHBondContact O-CG2 3.33Å; L952-V956 PolarHBondContact O-N 3.3Å; V956-M959 PolarHBondContact O-N 3.39Å; V956-K960 HydrophobicContact CG1-CD 4.23Å; V956-K960 WeakPolarHBondContact O-CB 3.37Å; V956-K960 VanDerWaalsContact O-CG 3.32Å; V956-K960 WeakPolarHBondContact O-CG 3.46Å; V956-K960 PolarHBondContact O-N 3.48Å; V956-Q982 HydrophobicContact CG2-CG 4.5Å; V956-Q982 WeakPolarHBondContact CG2-O 3.37Å; V956-M985 HydrophobicContact CG1-CG 4.14Å
957	Q	92.9	Very high	90.9	Very high	108 Å²	108	53.9 Å²	53.9	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-66	-38.2	170.8	-75.7	173.9	56.5	0	0	112.7	D953 E954 G955 K960 R961	D953-Q957 VanDerWaalsContact O-CB 3.28Å; D953-Q957 WeakPolarHBondContact O-CB 3.18Å; D953-Q957 WeakPolarHBondContact O-CG 3.46Å; D953-Q957 PolarHBondContact O-N 3.32Å; D953-Q957 PolarHBondContact O-NE2 2.64Å; E954-Q957 PolarHBondContact O-N 3.33Å; G955-Q957 VanDerWaalsContact C-N 3.29Å; G955-Q957 PolarHBondContact O-N 3.3Å; Q957-K960 PolarHBondContact O-N 3.31Å; Q957-R961 VanDerWaalsContact O-CG 3.32Å; Q957-R961 WeakPolarHBondContact O-CG 3.15Å; Q957-R961 PolarHBondContact O-N 3.04Å
958	A	93.1	Very high	91.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-41.5	175.5	0	0	0	0	0	112	I916 V919 E954 G955 R961	I916-A958 HydrophobicContact CG1-CB 4.49Å; V919-A958 HydrophobicContact CB-CB 4.35Å; V919-A958 HydrophobicContact CG1-CB 4.32Å; V919-A958 HydrophobicContact CG2-CB 4.16Å; E954-A958 WeakPolarHBondContact O-CB 3.29Å; E954-A958 PolarHBondContact O-N 2.98Å; G955-A958 WeakPolarHBondContact O-CA 3.41Å; G955-A958 WeakPolarHBondContact O-CB 3.28Å; G955-A958 PolarHBondContact O-N 2.88Å; A958-R961 PolarHBondContact O-N 2.85Å
959	M	94.5	Very high	91.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-45.2	174	-174.1	164.1	49.5	0	0	111.6	I915 F939 F941 G955 V956 R961 V962 E963 G964 P966 M985	I915-M959 HydrophobicContact CD1-CE 4.47Å; I915-M959 HydrophobicContact CG2-CB 3.89Å; F939-M959 HydrophobicContact CB-SD 3.69Å; F939-M959 HydrophobicContact CD1-SD 4.14Å; F939-M959 HydrophobicContact CD2-CG 3.8Å; F939-M959 HydrophobicContact CD2-SD 3.72Å; F939-M959 HydrophobicContact CE2-CG 3.88Å; F939-M959 HydrophobicContact CE2-SD 4.32Å; F939-M959 HydrophobicContact CG-CG 4.25Å; F939-M959 HydrophobicContact CG-SD 3.6Å; F939-M959 VanDerWaalsContact CG-SD 3.6Å; F939-M959 HydrophobicContact CZ-CG 4.39Å; F941-M959 HydrophobicContact CE2-CE 4.06Å; F941-M959 HydrophobicContact CE2-SD 4Å; F941-M959 HydrophobicContact CZ-CE 3.89Å; F941-M959 HydrophobicContact CZ-SD 3.74Å; G955-M959 PolarHBondContact O-N 3.23Å; V956-M959 PolarHBondContact O-N 3.39Å; M959-R961 VanDerWaalsContact C-N 3.32Å; M959-R961 PolarHBondContact O-N 2.98Å; M959-V962 VanDerWaalsContact O-CG2 3.26Å; M959-V962 WeakPolarHBondContact O-CG2 3.49Å; M959-V962 PolarHBondContact O-N 3.47Å; M959-V962 VanDerWaalsContact O-N 3.15Å; M959-E963 PolarHBondContact O-N 3.11Å; M959-G964 PolarHBondContact O-N 3.34Å; M959-G964 VanDerWaalsContact O-N 3.09Å; M959-P966 HydrophobicContact CE-CB 4.12Å; M959-P966 HydrophobicContact SD-CB 4.34Å; M959-M985 HydrophobicContact CB-CE 3.99Å; M959-M985 HydrophobicContact CE-CE 3.63Å; M959-M985 HydrophobicContact CG-CE 3.52Å; M959-M985 HydrophobicContact SD-CE 4.03Å
960	K	92.3	Very high	92	Very high	111 Å²	111	47 Å²	47	48%	0.483	23%	0.225	S	C	.	.	H	α-helix	trans	-59	-38.9	173.6	-75.1	174.6	179.9	177.1	0	112.7	V956 Q957 V962 E963 M985	V956-K960 HydrophobicContact CG1-CD 4.23Å; V956-K960 WeakPolarHBondContact O-CB 3.37Å; V956-K960 VanDerWaalsContact O-CG 3.32Å; V956-K960 WeakPolarHBondContact O-CG 3.46Å; V956-K960 PolarHBondContact O-N 3.48Å; Q957-K960 PolarHBondContact O-N 3.31Å; K960-V962 PolarHBondContact O-N 2.98Å; K960-E963 PolarHBondContact O-N 3.3Å; K960-M985 HydrophobicContact CD-SD 4.02Å; K960-M985 WeakPolarHBondContact CE-SD 3.44Å; K960-M985 HydrophobicContact CG-CE 3.6Å; K960-M985 HydrophobicContact CG-CG 4.49Å; K960-M985 HydrophobicContact CG-SD 3.46Å; K960-M985 WeakPolarHBondContact CG-SD 3.45Å
961	R	90.7	Very high	92.1	Very high	163 Å²	163	42.4 Å²	42.4	62%	0.615	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.6	177.5	-76.6	-174.3	-55.3	-125.8	4.7	114.6	Q957 A958 M959	Q957-R961 VanDerWaalsContact O-CG 3.32Å; Q957-R961 WeakPolarHBondContact O-CG 3.15Å; Q957-R961 PolarHBondContact O-N 3.04Å; A958-R961 PolarHBondContact O-N 2.85Å; M959-R961 VanDerWaalsContact C-N 3.32Å; M959-R961 PolarHBondContact O-N 2.98Å
962	V	90.3	Very high	91.7	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.03	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	13.1	179.4	-61.1	0	0	0	0	113.9	V919 V923 I924 L937 F939 M959 K960 G964	V919-V962 HydrophobicContact CG1-CG1 3.82Å; V919-V962 HydrophobicContact CG2-CG2 4.09Å; V923-V962 HydrophobicContact CG1-CB 3.89Å; V923-V962 HydrophobicContact CG1-CG1 4Å; V923-V962 HydrophobicContact CG1-CG2 4.11Å; I924-V962 HydrophobicContact CD1-CG1 3.79Å; I924-V962 HydrophobicContact CG1-CG1 4.37Å; L937-V962 HydrophobicContact CD2-CB 4.11Å; L937-V962 HydrophobicContact CD2-CG2 3.72Å; F939-V962 HydrophobicContact CE2-CG2 4.27Å; F939-V962 HydrophobicContact CZ-CG2 4.45Å; M959-V962 VanDerWaalsContact O-CG2 3.26Å; M959-V962 WeakPolarHBondContact O-CG2 3.49Å; M959-V962 PolarHBondContact O-N 3.47Å; M959-V962 VanDerWaalsContact O-N 3.15Å; K960-V962 PolarHBondContact O-N 2.98Å; V962-G964 PolarHBondContact O-N 3.05Å
963	E	90.8	Very high	90.8	Very high	135 Å²	135	42.9 Å²	42.9	63%	0.631	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	33.5	-178.4	-54.9	147.4	144.2	0	0	111.7	R929 M959 K960	R929-E963 IonicContact CZ-OE2 2.91Å; R929-E963 IonicContact NH1-OE2 3.97Å; R929-E963 PolarHBondContact NH1-OE2 2.94Å; R929-E963 IonicContact NH2-OE2 3.74Å; M959-E963 PolarHBondContact O-N 3.11Å; K960-E963 PolarHBondContact O-N 3.3Å
964	G	90.8	Very high	90	Very high	6 Å²	6	44 Å²	44	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.9	179.5	0	0	0	0	0	112.5	L937 M959 V962 M985	L937-G964 CarbonylContact O-C 3.59Å; L937-G964 WeakPolarHBondContact O-CA 3.48Å; M959-G964 PolarHBondContact O-N 3.34Å; M959-G964 VanDerWaalsContact O-N 3.09Å; V962-G964 PolarHBondContact O-N 3.05Å; G964-M985 VanDerWaalsContact O-CE 3.24Å; G964-M985 WeakPolarHBondContact O-CE 3.35Å
965	V	92.6	Very high	89.6	Confident	56 Å²	56	41.8 Å²	41.8	34%	0.339	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	117.9	175.2	-179	0	0	0	0	108.5	E936 L937 A938 F939	E936-V965 HydrophobicContact CG-CG2 3.99Å; L937-V965 PolarHBondContact O-N 3.12Å; A938-V965 CarbonylContact C-O 3.56Å; A938-V965 WeakPolarHBondContact CA-O 3.39Å; F939-V965 PolarHBondContact N-O 3.29Å
966	P	94.4	Very high	89.2	Confident	12 Å²	12	44.9 Å²	44.9	8%	0.078	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	153	178.9	35.1	-37	0	0	0	111.3	F939 F941 M959 V983 M985	F939-P966 CarbonylContact O-C 3.49Å; F941-P966 HydrophobicContact CE2-CB 4.08Å; M959-P966 HydrophobicContact CE-CB 4.12Å; M959-P966 HydrophobicContact SD-CB 4.34Å; P966-V983 WeakPolarHBondContact CB-O 3.23Å; P966-M985 HydrophobicContact CG-CE 4.39Å; P966-M985 HydrophobicContact CG-CG 4.03Å; P966-M985 HydrophobicContact CG-SD 4.4Å
967	T	94.6	Very high	88.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	122.9	166.2	-65.1	0	0	0	0	107.1	F939 V940 F941 F992 F1009 W1012	F939-T967 PolarHBondContact O-N 3.42Å; V940-T967 CarbonylContact C-O 3.58Å; V940-T967 WeakPolarHBondContact CA-O 3.34Å; F941-T967 WeakPolarHBondContact CD2-O 3.45Å; F941-T967 PolarHBondContact N-O 2.83Å; T967-F992 HydrophobicContact CG2-CD2 3.98Å; T967-F992 HydrophobicContact CG2-CE2 3.93Å; T967-F1009 HydrophobicContact CG2-CE2 4.12Å; T967-W1012 PolarHBondContact OG1-NE1 3.34Å
968	V	94.4	Very high	88.4	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115	-169.1	-175	0	0	0	0	109.3	F941 A970 L980 V983 A990 I991 F992	F941-V968 HydrophobicContact CB-CG1 4.49Å; F941-V968 HydrophobicContact CD2-CG2 3.98Å; V968-A970 HydrophobicContact CG1-CB 4.44Å; V968-L980 HydrophobicContact CG1-CD2 3.96Å; V968-V983 HydrophobicContact CG2-CB 4.28Å; V968-V983 HydrophobicContact CG2-CG1 3.67Å; V968-A990 PolarHBondContact N-O 3.35Å; V968-I991 HydrophobicContact CB-CG1 4.42Å; V968-I991 HydrophobicContact CB-CG2 4.48Å; V968-I991 CarbonylContact O-C 3.48Å; V968-I991 WeakPolarHBondContact O-CA 3.13Å; V968-F992 PolarHBondContact O-N 3.15Å
969	I	94.4	Very high	88.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	102.7	170.2	-57.7	174.1	0	0	0	107.1	F849 V940 F941 I942 T943 L971 F992 L1000 F1005 F1009	F849-I969 HydrophobicContact CE1-CD1 3.68Å; F849-I969 HydrophobicContact CZ-CD1 3.91Å; V940-I969 HydrophobicContact CG1-CD1 4.02Å; F941-I969 WeakPolarHBondContact O-CB 3.39Å; F941-I969 PolarHBondContact O-N 3.18Å; I942-I969 HydrophobicContact CG1-CB 4.31Å; I942-I969 HydrophobicContact CG1-CD1 4.15Å; T943-I969 PolarHBondContact N-O 2.75Å; T943-I969 VanDerWaalsContact N-O 3.13Å; I969-L971 HydrophobicContact CG2-CD1 3.51Å; I969-L971 HydrophobicContact CG2-CD2 4.4Å; I969-L971 HydrophobicContact CG2-CG 3.79Å; I969-F992 WeakPolarHBondContact CA-O 3.21Å; I969-F992 HydrophobicContact CB-CB 4.5Å; I969-F992 HydrophobicContact CG1-CB 4.03Å; I969-L1000 HydrophobicContact CG2-CD2 4.04Å; I969-F1005 HydrophobicContact CD1-CZ 4.45Å; I969-F1005 HydrophobicContact CG1-CZ 4.48Å; I969-F1005 HydrophobicContact CG2-CZ 4.03Å; I969-F1009 HydrophobicContact CD1-CD2 3.92Å; I969-F1009 HydrophobicContact CD1-CE2 3.78Å; I969-F1009 HydrophobicContact CD1-CZ 4.47Å
970	A	91.2	Very high	87.9	Confident	1 Å²	1	50 Å²	50	1%	0.008	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.8	179.4	0	0	0	0	0	109	V968 T975 L980 F992 R993 G994	V968-A970 HydrophobicContact CG1-CB 4.44Å; A970-T975 HydrophobicContact CB-CG2 4.48Å; A970-L980 HydrophobicContact CB-CD1 3.64Å; A970-L980 HydrophobicContact CB-CD2 3.89Å; A970-L980 HydrophobicContact CB-CG 4.45Å; A970-F992 PolarHBondContact N-O 3.44Å; A970-R993 WeakPolarHBondContact O-CA 3.43Å; A970-G994 PolarHBondContact O-N 3.35Å
971	L	87.4	Confident	87.7	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	107.6	-167.2	-69.2	165.4	0	0	0	111.3	T943 I969 G994 F997 V999 L1000	T943-L971 PolarHBondContact O-N 2.89Å; I969-L971 HydrophobicContact CG2-CD1 3.51Å; I969-L971 HydrophobicContact CG2-CD2 4.4Å; I969-L971 HydrophobicContact CG2-CG 3.79Å; L971-G994 WeakPolarHBondContact CA-O 3.2Å; L971-F997 HydrophobicContact CB-CD1 4.26Å; L971-F997 HydrophobicContact CB-CD2 3.7Å; L971-F997 HydrophobicContact CB-CE1 4.12Å; L971-F997 HydrophobicContact CB-CE2 3.56Å; L971-F997 HydrophobicContact CB-CG 4.05Å; L971-F997 HydrophobicContact CB-CZ 3.77Å; L971-F997 HydrophobicContact CD1-CD1 3.53Å; L971-F997 HydrophobicContact CD1-CD2 4.41Å; L971-F997 HydrophobicContact CD1-CE1 3.72Å; L971-F997 HydrophobicContact CD1-CG 3.9Å; L971-F997 HydrophobicContact CD1-CZ 4.25Å; L971-F997 WeakPolarHBondContact O-CE2 3.48Å; L971-V999 HydrophobicContact CD2-CB 4.37Å; L971-L1000 HydrophobicContact CD1-CD1 3.98Å; L971-L1000 HydrophobicContact CD1-CD2 3.76Å; L971-L1000 HydrophobicContact CD1-CG 3.74Å
972	G	78.9	Confident	87.6	Confident	28 Å²	28	46.4 Å²	46.4	29%	0.289	26%	0.255	S	S	.	.	S	Bend	trans	150.5	167.4	-175.2	0	0	0	0	0	112.1	G994 D995	G972-G994 PolarHBondContact N-O 2.78Å; G972-D995 WeakPolarHBondContact CA-O 3.46Å
973	G	72	Confident	87.6	Confident	78 Å²	78	46.2 Å²	46.2	80%	0.804	25%	0.254	S	S	*	.	S	Bend	trans	-80.3	-29.3	176.9	0	0	0	0	0	114.4
974	D	75.1	Confident	87.5	Confident	124 Å²	124	39.9 Å²	39.9	66%	0.663	23%	0.225	S	C	*	.			trans	-105.2	101.3	-179.1	-60.6	-35.7	0	0	0	109.6	I946	I946-D974 HydrophobicContact CD1-CB 4.08Å; I946-D974 VanDerWaalsContact CD1-O 3.31Å; I946-D974 WeakPolarHBondContact CD1-O 3.43Å
975	T	83.4	Confident	87.5	Confident	40 Å²	40	42.3 Å²	42.3	25%	0.245	24%	0.235	C	C	.	.			trans	-127.1	144.7	178	74	0	0	0	0	111.5	D944 A970 E977	D944-T975 WeakPolarHBondContact O-CG2 3.34Å; A970-T975 HydrophobicContact CB-CG2 4.48Å; T975-E977 PolarHBondContact O-N 2.72Å
976	D	86.1	Confident	86.9	Confident	66 Å²	66	41.8 Å²	41.8	35%	0.353	24%	0.241	S	C	.	.			trans	-89.6	94.2	176.1	-174	-36.3	0	0	0	110.1	G945 I946 E978 V979 L980	G945-D976 PolarHBondContact O-N 3.28Å; I946-D976 HydrophobicContact CG1-CB 4.3Å; D976-E978 VanDerWaalsContact C-N 3.25Å; D976-E978 PolarHBondContact O-N 3.18Å; D976-E978 PolarHBondContact OD1-N 3.42Å; D976-E978 VanDerWaalsContact OD1-N 3.15Å; D976-V979 HydrophobicContact CB-CB 3.93Å; D976-V979 HydrophobicContact CB-CG2 4.06Å; D976-V979 WeakPolarHBondContact O-CB 3.18Å; D976-V979 PolarHBondContact O-N 3.39Å; D976-V979 VanDerWaalsContact O-N 3.15Å; D976-V979 PolarHBondContact OD1-N 2.6Å; D976-L980 WeakPolarHBondContact O-CG 3.29Å; D976-L980 PolarHBondContact O-N 3.09Å
977	E	84.3	Confident	86.3	Confident	89 Å²	89	44.3 Å²	44.3	42%	0.416	25%	0.254	S	S	.	.	H	α-helix	trans	-58.4	-29.6	-177.1	-79.6	-69.9	169.1	0	0	114.4	T975 R981 R993	T975-E977 PolarHBondContact O-N 2.72Å; E977-R981 WeakPolarHBondContact O-CB 3.22Å; E977-R981 PolarHBondContact O-N 2.68Å; E977-R993 IonicContact OE1-CZ 2.82Å; E977-R993 VanDerWaalsContact OE1-CZ 3.22Å; E977-R993 IonicContact OE1-NE 2.71Å; E977-R993 PolarHBondContact OE1-NE 2.7Å; E977-R993 IonicContact OE1-NH2 3.53Å; E977-R993 PolarHBondContact OE1-NH2 3.44Å; E977-R993 IonicContact OE2-CZ 3.57Å; E977-R993 IonicContact OE2-NE 3.9Å; E977-R993 IonicContact OE2-NH2 3.67Å; E977-R993 PolarHBondContact OE2-NH2 2.8Å
978	E	84.9	Confident	85.6	Confident	124 Å²	124	47.6 Å²	47.6	58%	0.579	28%	0.277	S	S	*	.	H	α-helix	trans	-74.6	-40.6	177.3	-174.5	65.4	-176.4	0	0	110.3	D976 R981 Q982	D976-E978 VanDerWaalsContact C-N 3.25Å; D976-E978 PolarHBondContact O-N 3.18Å; D976-E978 PolarHBondContact OD1-N 3.42Å; D976-E978 VanDerWaalsContact OD1-N 3.15Å; E978-R981 PolarHBondContact O-N 2.89Å; E978-Q982 VanDerWaalsContact O-CB 3.29Å; E978-Q982 WeakPolarHBondContact O-CB 3.4Å; E978-Q982 PolarHBondContact O-N 3Å
979	V	87.8	Confident	84.9	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-50.1	168.6	164.3	0	0	0	0	111.1	T947 T949 L952 D976 R981 Q982 V983	T947-V979 HydrophobicContact CG2-CG1 3.6Å; T949-V979 HydrophobicContact CG2-CG2 3.82Å; L952-V979 HydrophobicContact CD2-CB 4.44Å; L952-V979 HydrophobicContact CD2-CG1 4.09Å; L952-V979 HydrophobicContact CD2-CG2 4.12Å; D976-V979 HydrophobicContact CB-CB 3.93Å; D976-V979 HydrophobicContact CB-CG2 4.06Å; D976-V979 WeakPolarHBondContact O-CB 3.18Å; D976-V979 PolarHBondContact O-N 3.39Å; D976-V979 VanDerWaalsContact O-N 3.15Å; D976-V979 PolarHBondContact OD1-N 2.6Å; V979-R981 VanDerWaalsContact C-N 3.29Å; V979-R981 PolarHBondContact O-N 3.11Å; V979-Q982 PolarHBondContact O-N 2.92Å; V979-V983 HydrophobicContact CG1-CG2 4.38Å; V979-V983 VanDerWaalsContact O-CG2 3.23Å; V979-V983 WeakPolarHBondContact O-CG2 3.31Å; V979-V983 PolarHBondContact O-N 3.26Å
980	L	89.3	Confident	84.3	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-43.7	-179.1	-61.1	-168	0	0	0	111.1	V968 A970 D976 V983 S984 I991	V968-L980 HydrophobicContact CG1-CD2 3.96Å; A970-L980 HydrophobicContact CB-CD1 3.64Å; A970-L980 HydrophobicContact CB-CD2 3.89Å; A970-L980 HydrophobicContact CB-CG 4.45Å; D976-L980 WeakPolarHBondContact O-CG 3.29Å; D976-L980 PolarHBondContact O-N 3.09Å; L980-V983 PolarHBondContact O-N 3.21Å; L980-S984 WeakPolarHBondContact O-CB 3.48Å; L980-S984 PolarHBondContact O-N 3.21Å; L980-S984 PolarHBondContact O-OG 2.96Å; L980-I991 HydrophobicContact CB-CD1 4.02Å; L980-I991 HydrophobicContact CD1-CG2 4.04Å
981	R	87.8	Confident	84.1	Confident	151 Å²	151	50 Å²	50	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-67.4	-37.5	177.7	-171.8	-176.5	-167	-175.5	8.7	112.9	E977 E978 V979 S984 M985 G986	E977-R981 WeakPolarHBondContact O-CB 3.22Å; E977-R981 PolarHBondContact O-N 2.68Å; E978-R981 PolarHBondContact O-N 2.89Å; V979-R981 VanDerWaalsContact C-N 3.29Å; V979-R981 PolarHBondContact O-N 3.11Å; R981-S984 PolarHBondContact O-OG 3.12Å; R981-M985 PolarHBondContact O-N 3.06Å; R981-G986 PolarHBondContact O-N 3.09Å
982	Q	88.8	Confident	84.2	Confident	46 Å²	46	50 Å²	50	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-44.6	176	-167.3	178.5	17.6	0	0	110.6	L952 D953 V956 E978 V979 M985	L952-Q982 VanDerWaalsContact CD2-OE1 3.29Å; D953-Q982 PolarHBondContact OD1-NE2 3.24Å; D953-Q982 PolarHBondContact OD2-NE2 2.75Å; V956-Q982 HydrophobicContact CG2-CG 4.5Å; V956-Q982 WeakPolarHBondContact CG2-O 3.37Å; E978-Q982 VanDerWaalsContact O-CB 3.29Å; E978-Q982 WeakPolarHBondContact O-CB 3.4Å; E978-Q982 PolarHBondContact O-N 3Å; V979-Q982 PolarHBondContact O-N 2.92Å; Q982-M985 PolarHBondContact O-N 3.45Å; Q982-M985 VanDerWaalsContact O-N 3.15Å
983	V	90.5	Very high	84.5	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-44.6	177.1	175.6	0	0	0	0	111.7	L911 F941 L952 P966 V968 V979 L980 M985	L911-V983 HydrophobicContact CD2-CB 4.5Å; L911-V983 HydrophobicContact CD2-CG1 4.19Å; L911-V983 HydrophobicContact CD2-CG2 3.47Å; L911-V983 VanDerWaalsContact CD2-CG2 3.47Å; L911-V983 HydrophobicContact CG-CG2 4.46Å; F941-V983 HydrophobicContact CD1-CG1 4.41Å; F941-V983 HydrophobicContact CD2-CG1 3.59Å; F941-V983 HydrophobicContact CE1-CG1 4.42Å; F941-V983 HydrophobicContact CE2-CG1 3.6Å; F941-V983 HydrophobicContact CG-CG1 4.02Å; F941-V983 HydrophobicContact CZ-CG1 4.03Å; L952-V983 HydrophobicContact CD1-CG2 3.92Å; L952-V983 HydrophobicContact CD2-CG2 4.47Å; P966-V983 WeakPolarHBondContact CB-O 3.23Å; V968-V983 HydrophobicContact CG2-CB 4.28Å; V968-V983 HydrophobicContact CG2-CG1 3.67Å; V979-V983 HydrophobicContact CG1-CG2 4.38Å; V979-V983 VanDerWaalsContact O-CG2 3.23Å; V979-V983 WeakPolarHBondContact O-CG2 3.31Å; V979-V983 PolarHBondContact O-N 3.26Å; L980-V983 PolarHBondContact O-N 3.21Å; V983-M985 PolarHBondContact O-N 3.1Å; V983-M985 VanDerWaalsContact O-N 3.12Å
984	S	89.7	Confident	85	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.007	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	6.7	175.2	82	0	0	0	0	113.8	L980 R981 G986 D987	L980-S984 WeakPolarHBondContact O-CB 3.48Å; L980-S984 PolarHBondContact O-N 3.21Å; L980-S984 PolarHBondContact O-OG 2.96Å; R981-S984 PolarHBondContact O-OG 3.12Å; S984-G986 PolarHBondContact O-N 3.15Å; S984-G986 VanDerWaalsContact O-N 3.12Å; S984-D987 WeakPolarHBondContact CB-O 3.29Å; S984-D987 PolarHBondContact O-N 2.79Å; S984-D987 VanDerWaalsContact O-N 3.09Å; S984-D987 PolarHBondContact OG-O 2.68Å
985	M	89	Confident	85.1	Confident	57 Å²	57	51.4 Å²	51.4	28%	0.281	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	14.3	-179.8	-53.7	-173.7	-172.5	0	0	115.3	V956 M959 K960 G964 P966 R981 Q982 V983	V956-M985 HydrophobicContact CG1-CG 4.14Å; M959-M985 HydrophobicContact CB-CE 3.99Å; M959-M985 HydrophobicContact CE-CE 3.63Å; M959-M985 HydrophobicContact CG-CE 3.52Å; M959-M985 HydrophobicContact SD-CE 4.03Å; K960-M985 HydrophobicContact CD-SD 4.02Å; K960-M985 WeakPolarHBondContact CE-SD 3.44Å; K960-M985 HydrophobicContact CG-CE 3.6Å; K960-M985 HydrophobicContact CG-CG 4.49Å; K960-M985 HydrophobicContact CG-SD 3.46Å; K960-M985 WeakPolarHBondContact CG-SD 3.45Å; G964-M985 VanDerWaalsContact O-CE 3.24Å; G964-M985 WeakPolarHBondContact O-CE 3.35Å; P966-M985 HydrophobicContact CG-CE 4.39Å; P966-M985 HydrophobicContact CG-CG 4.03Å; P966-M985 HydrophobicContact CG-SD 4.4Å; R981-M985 PolarHBondContact O-N 3.06Å; Q982-M985 PolarHBondContact O-N 3.45Å; Q982-M985 VanDerWaalsContact O-N 3.15Å; V983-M985 PolarHBondContact O-N 3.1Å; V983-M985 VanDerWaalsContact O-N 3.12Å
986	G	81.2	Confident	85.2	Confident	46 Å²	46	52.8 Å²	52.8	47%	0.474	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-8.1	-175.7	0	0	0	0	0	114.8	R981 S984 S988	R981-G986 PolarHBondContact O-N 3.09Å; S984-G986 PolarHBondContact O-N 3.15Å; S984-G986 VanDerWaalsContact O-N 3.12Å; G986-S988 PolarHBondContact O-N 3.03Å
987	D	82	Confident	85.2	Confident	64 Å²	64	50 Å²	50	34%	0.342	26%	0.262	S	S	.	.			trans	-83.9	110.3	175.8	-177.9	-1.2	0	0	0	110.4	S984 S989 A990	S984-D987 WeakPolarHBondContact CB-O 3.29Å; S984-D987 PolarHBondContact O-N 2.79Å; S984-D987 VanDerWaalsContact O-N 3.09Å; S984-D987 PolarHBondContact OG-O 2.68Å; D987-S989 VanDerWaalsContact C-N 3.35Å; D987-S989 WeakPolarHBondContact OD1-CA 3.19Å; D987-S989 VanDerWaalsContact OD1-CB 3.29Å; D987-S989 WeakPolarHBondContact OD1-CB 3.38Å; D987-S989 PolarHBondContact OD1-N 3.24Å; D987-S989 PolarHBondContact OD1-OG 3.46Å; D987-S989 PolarHBondContact OD2-OG 3.02Å; D987-A990 HydrophobicContact CB-CB 4.3Å; D987-A990 PolarHBondContact OD1-N 2.78Å
988	S	79.5	Confident	85.3	Confident	71 Å²	71	51.7 Å²	51.7	50%	0.497	27%	0.268	S	S	.	.	S	Bend	trans	-79.1	-16.1	177.4	55.6	0	0	0	0	113.7	G986 I991	G986-S988 PolarHBondContact O-N 3.03Å; S988-I991 PolarHBondContact O-N 3.15Å
989	S	79.1	Confident	85.3	Confident	45 Å²	45	46.4 Å²	46.4	32%	0.315	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-29.4	178.1	76.8	0	0	0	0	112.3	D987 I991 W1012	D987-S989 VanDerWaalsContact C-N 3.35Å; D987-S989 WeakPolarHBondContact OD1-CA 3.19Å; D987-S989 VanDerWaalsContact OD1-CB 3.29Å; D987-S989 WeakPolarHBondContact OD1-CB 3.38Å; D987-S989 PolarHBondContact OD1-N 3.24Å; D987-S989 PolarHBondContact OD1-OG 3.46Å; D987-S989 PolarHBondContact OD2-OG 3.02Å; S989-I991 PolarHBondContact O-N 2.59Å; S989-W1012 WeakPolarHBondContact OG-CH2 3.19Å
990	A	81.9	Confident	85.3	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5	170.3	0	0	0	0	0	114.2	V968 D987 W1012	V968-A990 PolarHBondContact N-O 3.35Å; D987-A990 HydrophobicContact CB-CB 4.3Å; D987-A990 PolarHBondContact OD1-N 2.78Å; A990-W1012 HydrophobicContact CB-CH2 4.35Å; A990-W1012 HydrophobicContact CB-CZ2 3.78Å
991	I	88.3	Confident	84.9	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.041	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	106	-179.1	-49.6	173.2	0	0	0	110.7	V968 L980 S988 S989 R993	V968-I991 HydrophobicContact CB-CG1 4.42Å; V968-I991 HydrophobicContact CB-CG2 4.48Å; V968-I991 CarbonylContact O-C 3.48Å; V968-I991 WeakPolarHBondContact O-CA 3.13Å; L980-I991 HydrophobicContact CB-CD1 4.02Å; L980-I991 HydrophobicContact CD1-CG2 4.04Å; S988-I991 PolarHBondContact O-N 3.15Å; S989-I991 PolarHBondContact O-N 2.59Å; I991-R993 HydrophobicContact CG2-CG 3.97Å; I991-R993 PolarHBondContact O-N 3.38Å
992	F	88.6	Confident	84.7	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	95.4	171.9	-74.2	-110.3	0	0	0	109.6	T967 V968 I969 A970 F1005 R1008 F1009 W1012	T967-F992 HydrophobicContact CG2-CD2 3.98Å; T967-F992 HydrophobicContact CG2-CE2 3.93Å; V968-F992 PolarHBondContact O-N 3.15Å; I969-F992 WeakPolarHBondContact CA-O 3.21Å; I969-F992 HydrophobicContact CB-CB 4.5Å; I969-F992 HydrophobicContact CG1-CB 4.03Å; A970-F992 PolarHBondContact N-O 3.44Å; F992-F1005 HydrophobicContact CB-CE2 4.05Å; F992-F1005 HydrophobicContact CB-CZ 4.06Å; F992-F1005 AromaticContact CD1-CE2 3.8Å; F992-F1005 HydrophobicContact CD1-CE2 3.8Å; F992-F1005 AromaticContact CD1-CZ 3.91Å; F992-F1005 HydrophobicContact CD1-CZ 3.91Å; F992-F1005 HydrophobicContact CG-CE2 4.43Å; F992-F1005 HydrophobicContact CG-CZ 4.4Å; F992-R1008 HydrophobicContact CE1-CG 3.95Å; F992-F1009 HydrophobicContact CE1-CB 4.12Å; F992-F1009 HydrophobicContact CE1-CD2 4.41Å; F992-F1009 HydrophobicContact CZ-CD2 4.4Å; F992-W1012 HydrophobicContact CE2-CB 4.33Å; F992-W1012 AromaticContact CE2-CD1 3.81Å; F992-W1012 HydrophobicContact CE2-CD2 4.02Å; F992-W1012 AromaticContact CE2-CG 3.79Å; F992-W1012 HydrophobicContact CE2-CG 3.79Å; F992-W1012 HydrophobicContact CZ-CB 3.74Å; F992-W1012 HydrophobicContact CZ-CD2 4.2Å; F992-W1012 AromaticContact CZ-CG 3.71Å; F992-W1012 HydrophobicContact CZ-CG 3.71Å
993	R	86.2	Confident	84.1	Confident	107 Å²	107	49.5 Å²	49.5	40%	0.404	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	152.6	172.6	-62.1	178.8	-173.8	72.1	-1.3	111.7	A970 E977 I991	A970-R993 WeakPolarHBondContact O-CA 3.43Å; E977-R993 IonicContact OE1-CZ 2.82Å; E977-R993 VanDerWaalsContact OE1-CZ 3.22Å; E977-R993 IonicContact OE1-NE 2.71Å; E977-R993 PolarHBondContact OE1-NE 2.7Å; E977-R993 IonicContact OE1-NH2 3.53Å; E977-R993 PolarHBondContact OE1-NH2 3.44Å; E977-R993 IonicContact OE2-CZ 3.57Å; E977-R993 IonicContact OE2-NE 3.9Å; E977-R993 IonicContact OE2-NH2 3.67Å; E977-R993 PolarHBondContact OE2-NH2 2.8Å; I991-R993 HydrophobicContact CG2-CG 3.97Å; I991-R993 PolarHBondContact O-N 3.38Å
994	G	80.6	Confident	83.5	Confident	15 Å²	15	53.1 Å²	53.1	16%	0.155	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	154.3	168.7	0	0	0	0	0	111.7	A970 L971 G972 D996	A970-G994 PolarHBondContact O-N 3.35Å; L971-G994 WeakPolarHBondContact CA-O 3.2Å; G972-G994 PolarHBondContact N-O 2.78Å; G994-D996 PolarHBondContact O-N 2.8Å
995	D	78.9	Confident	83.2	Confident	137 Å²	137	53.9 Å²	53.9	73%	0.733	33%	0.327	S	S	*	.	S	Bend	trans	-70	-32.7	-168.6	-34.6	-79	0	0	0	113.2	G972	G972-D995 WeakPolarHBondContact CA-O 3.46Å
996	D	84	Confident	83	Confident	68 Å²	68	52.7 Å²	52.7	36%	0.364	32%	0.32	S	S	.	.	S	Bend	trans	-153.8	160.5	178.7	106.2	86.3	0	0	0	112.4	G994 F998 V999	G994-D996 PolarHBondContact O-N 2.8Å; D996-F998 PolarHBondContact O-N 3.18Å; D996-F998 VanDerWaalsContact O-N 3.15Å; D996-F998 WeakPolarHBondContact OD1-CB 3.44Å; D996-F998 PolarHBondContact OD1-N 3.25Å; D996-F998 WeakPolarHBondContact OD2-CB 3.38Å; D996-V999 VanDerWaalsContact O-CB 3.26Å; D996-V999 WeakPolarHBondContact O-CB 3.45Å; D996-V999 VanDerWaalsContact O-CG2 3.23Å; D996-V999 WeakPolarHBondContact O-CG2 3.41Å; D996-V999 PolarHBondContact O-N 2.94Å
997	F	87.6	Confident	82.9	Confident	7 Å²	7	53.2 Å²	53.2	3%	0.031	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-64.7	-15.7	-176.5	-75.6	-103.8	0	0	0	115.1	M838 N842 R845 I942 L971 V999 L1000	M838-F997 HydrophobicContact CE-CD1 4.29Å; M838-F997 HydrophobicContact CE-CE1 3.47Å; M838-F997 VanDerWaalsContact CE-CE1 3.47Å; M838-F997 HydrophobicContact CE-CZ 3.95Å; M838-F997 HydrophobicContact CG-CE1 4.33Å; M838-F997 HydrophobicContact CG-CE2 4.47Å; M838-F997 HydrophobicContact CG-CZ 3.89Å; M838-F997 HydrophobicContact SD-CE1 3.77Å; M838-F997 HydrophobicContact SD-CZ 3.61Å; N842-F997 HydrophobicContact CB-CB 3.97Å; N842-F997 HydrophobicContact CB-CD1 3.92Å; N842-F997 HydrophobicContact CB-CD2 3.59Å; N842-F997 HydrophobicContact CB-CE1 4.3Å; N842-F997 HydrophobicContact CB-CE2 3.99Å; N842-F997 HydrophobicContact CB-CG 3.56Å; N842-F997 HydrophobicContact CB-CZ 4.34Å; R845-F997 HydrophobicContact CB-CB 4.3Å; I942-F997 HydrophobicContact CG2-CE1 4.01Å; L971-F997 HydrophobicContact CB-CD1 4.26Å; L971-F997 HydrophobicContact CB-CD2 3.7Å; L971-F997 HydrophobicContact CB-CE1 4.12Å; L971-F997 HydrophobicContact CB-CE2 3.56Å; L971-F997 HydrophobicContact CB-CG 4.05Å; L971-F997 HydrophobicContact CB-CZ 3.77Å; L971-F997 HydrophobicContact CD1-CD1 3.53Å; L971-F997 HydrophobicContact CD1-CD2 4.41Å; L971-F997 HydrophobicContact CD1-CE1 3.72Å; L971-F997 HydrophobicContact CD1-CG 3.9Å; L971-F997 HydrophobicContact CD1-CZ 4.25Å; L971-F997 WeakPolarHBondContact O-CE2 3.48Å; F997-V999 PolarHBondContact O-N 3.37Å; F997-L1000 HydrophobicContact CD1-CD1 3.87Å; F997-L1000 VanDerWaalsContact O-CB 3.28Å; F997-L1000 WeakPolarHBondContact O-CB 3.25Å; F997-L1000 WeakPolarHBondContact O-CG 3.42Å; F997-L1000 PolarHBondContact O-N 3.44Å
998	F	84.9	Confident	82.8	Confident	126 Å²	126	56.6 Å²	56.6	55%	0.553	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-59.1	-23.1	168.5	-173.3	-96.9	0	0	0	112.2	D996 L1000 G1001	D996-F998 PolarHBondContact O-N 3.18Å; D996-F998 VanDerWaalsContact O-N 3.15Å; D996-F998 WeakPolarHBondContact OD1-CB 3.44Å; D996-F998 PolarHBondContact OD1-N 3.25Å; D996-F998 WeakPolarHBondContact OD2-CB 3.38Å; F998-L1000 PolarHBondContact O-N 2.75Å; F998-G1001 PolarHBondContact O-N 3.33Å
999	V	85.7	Confident	83.2	Confident	13 Å²	13	53.3 Å²	53.3	8%	0.079	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-56.2	-33.5	171.3	174.3	0	0	0	0	112.1	L971 D996 F997 G1001 K1002 F1005	L971-V999 HydrophobicContact CD2-CB 4.37Å; D996-V999 VanDerWaalsContact O-CB 3.26Å; D996-V999 WeakPolarHBondContact O-CB 3.45Å; D996-V999 VanDerWaalsContact O-CG2 3.23Å; D996-V999 WeakPolarHBondContact O-CG2 3.41Å; D996-V999 PolarHBondContact O-N 2.94Å; F997-V999 PolarHBondContact O-N 3.37Å; V999-G1001 PolarHBondContact O-N 2.62Å; V999-K1002 HydrophobicContact CG2-CD 4.39Å; V999-K1002 WeakPolarHBondContact O-CB 3.2Å; V999-K1002 PolarHBondContact O-N 3.04Å; V999-F1005 HydrophobicContact CG1-CB 3.95Å; V999-F1005 HydrophobicContact CG1-CD1 4.46Å; V999-F1005 HydrophobicContact CG1-CD2 3.39Å; V999-F1005 HydrophobicContact CG1-CE2 3.96Å; V999-F1005 HydrophobicContact CG1-CG 3.68Å; V999-F1005 WeakPolarHBondContact O-CB 3.21Å
1000	L	87.1	Confident	83.5	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.037	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-60.2	-29.6	176.4	-63.2	-178.7	0	0	0	113.3	A846 F849 I969 L971 F997 F998 F1005	A846-L1000 HydrophobicContact CB-CD1 4.28Å; F849-L1000 HydrophobicContact CB-CB 4.07Å; F849-L1000 HydrophobicContact CB-CD1 4.04Å; F849-L1000 HydrophobicContact CB-CG 4.48Å; F849-L1000 HydrophobicContact CD1-CD2 4.2Å; F849-L1000 HydrophobicContact CD2-CB 3.91Å; F849-L1000 HydrophobicContact CD2-CD2 3.92Å; F849-L1000 HydrophobicContact CD2-CG 4.43Å; F849-L1000 HydrophobicContact CE1-CD2 4.32Å; F849-L1000 HydrophobicContact CE2-CD2 4.05Å; F849-L1000 HydrophobicContact CG-CB 4.14Å; F849-L1000 HydrophobicContact CG-CD1 4.28Å; F849-L1000 HydrophobicContact CG-CD2 3.99Å; F849-L1000 HydrophobicContact CG-CG 4.38Å; F849-L1000 HydrophobicContact CZ-CD2 4.24Å; I969-L1000 HydrophobicContact CG2-CD2 4.04Å; L971-L1000 HydrophobicContact CD1-CD1 3.98Å; L971-L1000 HydrophobicContact CD1-CD2 3.76Å; L971-L1000 HydrophobicContact CD1-CG 3.74Å; F997-L1000 HydrophobicContact CD1-CD1 3.87Å; F997-L1000 VanDerWaalsContact O-CB 3.28Å; F997-L1000 WeakPolarHBondContact O-CB 3.25Å; F997-L1000 WeakPolarHBondContact O-CG 3.42Å; F997-L1000 PolarHBondContact O-N 3.44Å; F998-L1000 PolarHBondContact O-N 2.75Å; L1000-F1005 HydrophobicContact CD2-CD1 4.25Å; L1000-F1005 HydrophobicContact CD2-CE1 3.54Å; L1000-F1005 HydrophobicContact CD2-CZ 4.08Å
1001	G	80.6	Confident	83.4	Confident	71 Å²	71	58.9 Å²	58.9	73%	0.732	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-82.7	-6.8	176.9	0	0	0	0	0	114.4	F998 V999	F998-G1001 PolarHBondContact O-N 3.33Å; V999-G1001 PolarHBondContact O-N 2.62Å
1002	K	84.1	Confident	83.2	Confident	96 Å²	96	62.5 Å²	62.5	42%	0.417	32%	0.322	S	S	.	.			trans	-80.7	123.9	-179.9	-61.3	178	-172.1	171.7	0	109.8	V999 A1004 F1005 F1006	V999-K1002 HydrophobicContact CG2-CD 4.39Å; V999-K1002 WeakPolarHBondContact O-CB 3.2Å; V999-K1002 PolarHBondContact O-N 3.04Å; K1002-A1004 PolarHBondContact O-N 2.79Å; K1002-A1004 VanDerWaalsContact O-N 3.17Å; K1002-F1005 HydrophobicContact CB-CB 4.4Å; K1002-F1005 PolarHBondContact O-N 3.25Å; K1002-F1006 PolarHBondContact O-N 2.92Å
1003	S	76.7	Confident	82.9	Confident	95 Å²	95	62.7 Å²	62.7	66%	0.664	32%	0.323	S	S	*	.	H	α-helix	trans	-52.4	-39.4	180	52.5	0	0	0	0	113.7	F1006 E1007	S1003-F1006 PolarHBondContact O-N 2.78Å; S1003-E1007 WeakPolarHBondContact O-CB 3.27Å; S1003-E1007 PolarHBondContact O-N 2.84Å
1004	A	77.3	Confident	82.3	Confident	78 Å²	78	58.7 Å²	58.7	65%	0.645	31%	0.312	S	S	*	.	H	α-helix	trans	-64.6	-38.6	177.4	0	0	0	0	0	113.2	K1002 R1008	K1002-A1004 PolarHBondContact O-N 2.79Å; K1002-A1004 VanDerWaalsContact O-N 3.17Å; A1004-R1008 VanDerWaalsContact O-CB 3.26Å; A1004-R1008 WeakPolarHBondContact O-CB 3.43Å; A1004-R1008 PolarHBondContact O-N 2.82Å; A1004-R1008 VanDerWaalsContact O-N 3.11Å
1005	F	83.9	Confident	82.4	Confident	18 Å²	18	60.9 Å²	60.9	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-70.2	-47.1	174.3	-179.6	-86.5	0	0	0	110.6	F849 I969 F992 V999 L1000 K1002 E1007 R1008 F1009	F849-F1005 HydrophobicContact CE2-CD1 4.14Å; F849-F1005 AromaticContact CE2-CE1 3.9Å; F849-F1005 HydrophobicContact CE2-CE1 3.9Å; F849-F1005 HydrophobicContact CZ-CE1 4.02Å; I969-F1005 HydrophobicContact CD1-CZ 4.45Å; I969-F1005 HydrophobicContact CG1-CZ 4.48Å; I969-F1005 HydrophobicContact CG2-CZ 4.03Å; F992-F1005 HydrophobicContact CB-CE2 4.05Å; F992-F1005 HydrophobicContact CB-CZ 4.06Å; F992-F1005 AromaticContact CD1-CE2 3.8Å; F992-F1005 HydrophobicContact CD1-CE2 3.8Å; F992-F1005 AromaticContact CD1-CZ 3.91Å; F992-F1005 HydrophobicContact CD1-CZ 3.91Å; F992-F1005 HydrophobicContact CG-CE2 4.43Å; F992-F1005 HydrophobicContact CG-CZ 4.4Å; V999-F1005 HydrophobicContact CG1-CB 3.95Å; V999-F1005 HydrophobicContact CG1-CD1 4.46Å; V999-F1005 HydrophobicContact CG1-CD2 3.39Å; V999-F1005 HydrophobicContact CG1-CE2 3.96Å; V999-F1005 HydrophobicContact CG1-CG 3.68Å; V999-F1005 WeakPolarHBondContact O-CB 3.21Å; L1000-F1005 HydrophobicContact CD2-CD1 4.25Å; L1000-F1005 HydrophobicContact CD2-CE1 3.54Å; L1000-F1005 HydrophobicContact CD2-CZ 4.08Å; K1002-F1005 HydrophobicContact CB-CB 4.4Å; K1002-F1005 PolarHBondContact O-N 3.25Å; F1005-E1007 PolarHBondContact O-N 3.12Å; F1005-R1008 PolarHBondContact O-N 3.28Å; F1005-F1009 WeakPolarHBondContact O-CB 3.42Å; F1005-F1009 PolarHBondContact O-N 3.14Å
1006	F	84.3	Confident	82.6	Confident	31 Å²	31	56.9 Å²	56.9	14%	0.136	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-49.5	180	-177.9	-96.1	0	0	0	112.3	F849 N852 V853 R856 K1002 S1003 F1009 I1010	F849-F1006 HydrophobicContact CD2-CD2 4.05Å; F849-F1006 AromaticContact CE2-CD2 3.9Å; F849-F1006 HydrophobicContact CE2-CD2 3.9Å; N852-F1006 HydrophobicContact CB-CE2 3.67Å; N852-F1006 HydrophobicContact CB-CZ 4.03Å; V853-F1006 HydrophobicContact CG2-CD2 4.47Å; V853-F1006 HydrophobicContact CG2-CE2 3.74Å; V853-F1006 HydrophobicContact CG2-CZ 4.46Å; R856-F1006 HydrophobicContact CB-CE1 4.01Å; R856-F1006 HydrophobicContact CB-CZ 3.74Å; R856-F1006 HydrophobicContact CG-CE1 3.81Å; R856-F1006 HydrophobicContact CG-CZ 4.03Å; K1002-F1006 PolarHBondContact O-N 2.92Å; S1003-F1006 PolarHBondContact O-N 2.78Å; F1006-F1009 PolarHBondContact O-N 2.99Å; F1006-I1010 HydrophobicContact CD1-CG1 4.17Å; F1006-I1010 HydrophobicContact CE1-CD1 4.41Å; F1006-I1010 HydrophobicContact CE1-CG1 3.82Å; F1006-I1010 HydrophobicContact CE2-CG1 4.39Å; F1006-I1010 HydrophobicContact CZ-CD1 4.07Å; F1006-I1010 HydrophobicContact CZ-CG1 3.93Å; F1006-I1010 VanDerWaalsContact O-CG1 3.28Å; F1006-I1010 WeakPolarHBondContact O-CG1 3.3Å; F1006-I1010 PolarHBondContact O-N 3.28Å
1007	E	79.1	Confident	82.5	Confident	58 Å²	58	56.3 Å²	56.3	27%	0.271	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-32.7	177.1	-72.6	-71.6	131.5	0	0	112.2	R856 S1003 F1005 R1011	R856-E1007 IonicContact CZ-OE1 2.72Å; R856-E1007 VanDerWaalsContact CZ-OE1 3.24Å; R856-E1007 IonicContact CZ-OE2 2.73Å; R856-E1007 IonicContact NE-OE1 3.68Å; R856-E1007 PolarHBondContact NE-OE1 2.67Å; R856-E1007 IonicContact NH2-OE1 3.91Å; R856-E1007 PolarHBondContact NH2-OE1 2.85Å; R856-E1007 IonicContact NH2-OE2 2.75Å; R856-E1007 PolarHBondContact NH2-OE2 3.18Å; S1003-E1007 WeakPolarHBondContact O-CB 3.27Å; S1003-E1007 PolarHBondContact O-N 2.84Å; F1005-E1007 PolarHBondContact O-N 3.12Å; E1007-R1011 WeakPolarHBondContact O-CB 3.33Å; E1007-R1011 WeakPolarHBondContact O-CD 2.77Å; E1007-R1011 WeakPolarHBondContact O-CG 3.38Å; E1007-R1011 PolarHBondContact O-N 2.85Å
1008	R	81.3	Confident	82.2	Confident	135 Å²	135	59.2 Å²	59.2	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-61.7	-44.1	170.4	179.3	-171	152	-179.7	-7.3	111.4	F992 A1004 F1005 R1011 W1012	F992-R1008 HydrophobicContact CE1-CG 3.95Å; A1004-R1008 VanDerWaalsContact O-CB 3.26Å; A1004-R1008 WeakPolarHBondContact O-CB 3.43Å; A1004-R1008 PolarHBondContact O-N 2.82Å; A1004-R1008 VanDerWaalsContact O-N 3.11Å; F1005-R1008 PolarHBondContact O-N 3.28Å; R1008-R1011 PolarHBondContact O-N 3.4Å; R1008-W1012 PolarHBondContact O-N 2.74Å
1009	F	87.1	Confident	82	Confident	1 Å²	1	55 Å²	55	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-45.1	177.8	174.7	-96.1	0	0	0	111.9	F830 F849 V853 V940 T967 I969 F992 F1005 F1006 R1011 W1012 I1013	F830-F1009 HydrophobicContact CE1-CZ 4.28Å; F830-F1009 HydrophobicContact CZ-CZ 4.42Å; F849-F1009 HydrophobicContact CE1-CD1 4.25Å; F849-F1009 HydrophobicContact CE1-CE1 4.12Å; F849-F1009 HydrophobicContact CE1-CZ 4.36Å; F849-F1009 HydrophobicContact CE2-CD1 4.34Å; F849-F1009 HydrophobicContact CZ-CB 4.28Å; F849-F1009 AromaticContact CZ-CD1 3.53Å; F849-F1009 HydrophobicContact CZ-CD1 3.53Å; F849-F1009 HydrophobicContact CZ-CD2 4.25Å; F849-F1009 AromaticContact CZ-CE1 3.87Å; F849-F1009 HydrophobicContact CZ-CE1 3.87Å; F849-F1009 AromaticContact CZ-CG 3.74Å; F849-F1009 HydrophobicContact CZ-CG 3.74Å; F849-F1009 HydrophobicContact CZ-CZ 4.35Å; V853-F1009 HydrophobicContact CG1-CE1 4.2Å; V853-F1009 HydrophobicContact CG2-CD1 3.97Å; V853-F1009 HydrophobicContact CG2-CE1 3.69Å; V940-F1009 HydrophobicContact CG1-CE2 3.79Å; V940-F1009 HydrophobicContact CG1-CZ 3.78Å; V940-F1009 HydrophobicContact CG2-CE2 4.31Å; V940-F1009 HydrophobicContact CG2-CZ 4Å; T967-F1009 HydrophobicContact CG2-CE2 4.12Å; I969-F1009 HydrophobicContact CD1-CD2 3.92Å; I969-F1009 HydrophobicContact CD1-CE2 3.78Å; I969-F1009 HydrophobicContact CD1-CZ 4.47Å; F992-F1009 HydrophobicContact CE1-CB 4.12Å; F992-F1009 HydrophobicContact CE1-CD2 4.41Å; F992-F1009 HydrophobicContact CZ-CD2 4.4Å; F1005-F1009 WeakPolarHBondContact O-CB 3.42Å; F1005-F1009 PolarHBondContact O-N 3.14Å; F1006-F1009 PolarHBondContact O-N 2.99Å; F1009-R1011 VanDerWaalsContact C-N 3.27Å; F1009-R1011 PolarHBondContact O-N 3.33Å; F1009-W1012 WeakPolarHBondContact O-CB 2.99Å; F1009-W1012 PolarHBondContact O-N 2.75Å; F1009-I1013 HydrophobicContact CD1-CG1 4.35Å; F1009-I1013 HydrophobicContact CD2-CG1 4.39Å; F1009-I1013 HydrophobicContact CE1-CG1 3.84Å; F1009-I1013 HydrophobicContact CE2-CD1 4.08Å; F1009-I1013 HydrophobicContact CE2-CG1 3.89Å; F1009-I1013 HydrophobicContact CZ-CD1 3.94Å; F1009-I1013 HydrophobicContact CZ-CG1 3.59Å; F1009-I1013 WeakPolarHBondContact O-CG1 3.33Å; F1009-I1013 PolarHBondContact O-N 2.62Å; F1009-I1013 VanDerWaalsContact O-N 3.15Å
1010	I	85.7	Confident	81.8	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.056	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-36.7	176	-68.1	-72.3	0	0	0	111.5	V853 R856 L857 F1006 W1012 I1013 C1014	V853-I1010 HydrophobicContact CB-CD1 4.39Å; V853-I1010 HydrophobicContact CG1-CD1 4.02Å; V853-I1010 HydrophobicContact CG2-CD1 4.18Å; R856-I1010 HydrophobicContact CB-CD1 4.04Å; R856-I1010 HydrophobicContact CG-CD1 3.83Å; R856-I1010 HydrophobicContact CG-CG1 4Å; R856-I1010 HydrophobicContact CG-CG2 4.13Å; L857-I1010 HydrophobicContact CD2-CD1 4.26Å; L857-I1010 HydrophobicContact CG-CD1 4.35Å; F1006-I1010 HydrophobicContact CD1-CG1 4.17Å; F1006-I1010 HydrophobicContact CE1-CD1 4.41Å; F1006-I1010 HydrophobicContact CE1-CG1 3.82Å; F1006-I1010 HydrophobicContact CE2-CG1 4.39Å; F1006-I1010 HydrophobicContact CZ-CD1 4.07Å; F1006-I1010 HydrophobicContact CZ-CG1 3.93Å; F1006-I1010 VanDerWaalsContact O-CG1 3.28Å; F1006-I1010 WeakPolarHBondContact O-CG1 3.3Å; F1006-I1010 PolarHBondContact O-N 3.28Å; I1010-W1012 VanDerWaalsContact C-N 3.31Å; I1010-W1012 PolarHBondContact O-N 3.17Å; I1010-I1013 PolarHBondContact O-N 3.42Å; I1010-C1014 PolarHBondContact O-N 2.68Å; I1010-C1014 PolarHBondContact O-SG 2.72Å
1011	R	79.9	Confident	81.4	Confident	152 Å²	152	61.4 Å²	61.4	57%	0.574	33%	0.328	S	S	*	.	H	α-helix	trans	-67.4	-26.1	174	-73.5	169.7	-177.1	-143.5	0.3	114.3	V818 E1007 R1008 F1009	V818-R1011 HydrophobicContact CG1-CB 4.4Å; V818-R1011 HydrophobicContact CG1-CG 3.95Å; V818-R1011 HydrophobicContact CG2-CG 3.9Å; E1007-R1011 WeakPolarHBondContact O-CB 3.33Å; E1007-R1011 WeakPolarHBondContact O-CD 2.77Å; E1007-R1011 WeakPolarHBondContact O-CG 3.38Å; E1007-R1011 PolarHBondContact O-N 2.85Å; R1008-R1011 PolarHBondContact O-N 3.4Å; F1009-R1011 VanDerWaalsContact C-N 3.27Å; F1009-R1011 PolarHBondContact O-N 3.33Å
1012	W	84.3	Confident	81.4	Confident	85 Å²	85	60.7 Å²	60.7	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-81.2	-28.3	177.4	173.4	-91.4	0	0	0	112.4	T967 S989 A990 F992 R1008 F1009 I1010	T967-W1012 PolarHBondContact OG1-NE1 3.34Å; S989-W1012 WeakPolarHBondContact OG-CH2 3.19Å; A990-W1012 HydrophobicContact CB-CH2 4.35Å; A990-W1012 HydrophobicContact CB-CZ2 3.78Å; F992-W1012 HydrophobicContact CE2-CB 4.33Å; F992-W1012 AromaticContact CE2-CD1 3.81Å; F992-W1012 HydrophobicContact CE2-CD2 4.02Å; F992-W1012 AromaticContact CE2-CG 3.79Å; F992-W1012 HydrophobicContact CE2-CG 3.79Å; F992-W1012 HydrophobicContact CZ-CB 3.74Å; F992-W1012 HydrophobicContact CZ-CD2 4.2Å; F992-W1012 AromaticContact CZ-CG 3.71Å; F992-W1012 HydrophobicContact CZ-CG 3.71Å; R1008-W1012 PolarHBondContact O-N 2.74Å; F1009-W1012 WeakPolarHBondContact O-CB 2.99Å; F1009-W1012 PolarHBondContact O-N 2.75Å; I1010-W1012 VanDerWaalsContact C-N 3.31Å; I1010-W1012 PolarHBondContact O-N 3.17Å
1013	I	81.3	Confident	81.2	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-89.5	-14.3	-178.4	-62.6	-67.1	0	0	0	113.5	V828 A938 V940 F1009 I1010	V828-I1013 HydrophobicContact CG2-CG2 4.07Å; A938-I1013 HydrophobicContact CB-CD1 4.46Å; V940-I1013 HydrophobicContact CG2-CD1 3.95Å; F1009-I1013 HydrophobicContact CD1-CG1 4.35Å; F1009-I1013 HydrophobicContact CD2-CG1 4.39Å; F1009-I1013 HydrophobicContact CE1-CG1 3.84Å; F1009-I1013 HydrophobicContact CE2-CD1 4.08Å; F1009-I1013 HydrophobicContact CE2-CG1 3.89Å; F1009-I1013 HydrophobicContact CZ-CD1 3.94Å; F1009-I1013 HydrophobicContact CZ-CG1 3.59Å; F1009-I1013 WeakPolarHBondContact O-CG1 3.33Å; F1009-I1013 PolarHBondContact O-N 2.62Å; F1009-I1013 VanDerWaalsContact O-N 3.15Å; I1010-I1013 PolarHBondContact O-N 3.42Å
1014	C	73.8	Confident	81.6	Confident	24 Å²	24	54.4 Å²	54.4	16%	0.162	25%	0.253	C	S	.	.			trans	-99	0	-178.3	-69.8	0	0	0	0	114.4	A819 C821 R824 I1010	A819-C1014 WeakPolarHBondContact O-CB 3.44Å; C821-C1014 HydrophobicContact CB-CB 4.12Å; C821-C1014 WeakPolarHBondContact CB-SG 3.2Å; C821-C1014 WeakPolarHBondContact SG-CA 3.44Å; C821-C1014 WeakPolarHBondContact SG-CB 3.07Å; C821-C1014 CovalentContact SG-SG 2.04Å; C821-C1014 PolarHBondContact SG-SG 3.45Å; R824-C1014 WeakPolarHBondContact CD-OXT 3.43Å; R824-C1014 PolarHBondContact NH1-O 2.91Å; R824-C1014 PolarHBondContact NH1-OXT 3.33Å; I1010-C1014 PolarHBondContact O-N 2.68Å; I1010-C1014 PolarHBondContact O-SG 2.72Å

Retrieved 1,014 of 1,014 residues in 280.7 ms (Link to these results)

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