A0A087YDD5_POEFO Loading...

ADAM metallopeptidase with thrombospondin type 1 motif, 15b

AlphaFold DB , UniProt , Accession A0A087YDD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 927 aa.

						>A0A087YDD5_POEFO|A0A087YDD5
AEMAAFLLLFTAFTLRLTTTSCMEVDFCKPFRLEHEKHPQRRAEQTKVARVGFRLSAFRQEFYLHLTPDSTFLAAGGGSAASSASSDLRECFYSGDVNADPDSFVAVSLCESLRGGFTYKGMEYFITASAEDTADEYGHFLEKTHRISRRMSAGLPGANFPSRCGVTPDTNFSVSLEKYKHLDQLDAGGLTEGMLKSLGRSKRFASIPRFVEVMVVADQSMAAFHGDDLKHYLLTLMSVAARLYKHPSILNSINIVVVGFMVINEADKGPKVSSNAALTLRNFCSWQKKLNKANDKHPEYWDTAILFTKQDLCGATTCDTLGMADVGTMCDPKRSCSVIEDDGLPSAFTTAHELGHIFNMPHDNVKACGEVFGKLKDNHMMSPTLIQIDRSRPWSVCSAAIITEFLDRGHGDCLLDQPQKQLTLQDSLPGSSYSLHRQCELAFGSGSKPCPYMQPCAKLWCTGNARGQQVCQTRHFPWADGTSCVYGKVCYRGACVDKRSTMNVKTKVDGRWGKWGGFGDCSRSCGGGVQLARRECDNPVPENGGKYCYGLRIKYRSCNLNACPETVTPGKRFREEQCEAFNGLNLNTSRLGSSVVWIPKYSGISPKEKCKLICRANGTGYFSVLSPKVVDGTPCSPDTSAVCVQGKCIKAGCDGKLDSDKKFDKCGVCGGDNQSCKKISGMFTKPVNGYNFVVTLPTGASNIDIRQRGYRGMVSDENYLAVKNRHGKYLLNGNYVVSAVERDLLLKGTLLRYSGTSTYVEILQATRPLQEPLTVEVLSVGKMTPPRIRYSFYMSKEHKDEKTLQKEERSHKLQNSVLIHWKTAGWDSCTVTCGNGLQQRLVQCQSTEGHLTTDCDITKRPAAVRACGDPCPIWNVGTWSQCSKSCGRGFKRRSVCCTTENGLNLPRNHCSGKRKPQELDLCNLTPC
					

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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	A	50.5	Low	44.9	Very low	135 Å²	135	121.9 Å²	121.9	100%	1.116	68%	0.678	S	S	*	*				0	-31.3	0	0	0	0	0	0	112.5
2	E	41.7	Very low	44.4	Very low	175 Å²	175	116.9 Å²	116.9	82%	0.818	66%	0.664	S	S	*	*	H	α-helix	trans	-77.6	-24.2	-176.6	-70.3	177.2	142.4	0	0	115.7	A4	E2-A4 VanDerWaalsContact C-N 3.35Å; E2-A4 PolarHBondContact O-N 3.13Å
3	M	41.8	Very low	43.7	Very low	163 Å²	163	120.5 Å²	120.5	80%	0.803	67%	0.668	S	S	*	*	H	α-helix	trans	-75.6	-18.1	176.6	-77.1	-120.2	-64.3	0	0	114.6
4	A	43.5	Very low	43	Very low	65 Å²	65	118.2 Å²	118.2	54%	0.537	66%	0.659	S	S	.	*	H	α-helix	trans	-83.8	-26.7	179.8	0	0	0	0	0	112.7	E2	E2-A4 VanDerWaalsContact C-N 3.35Å; E2-A4 PolarHBondContact O-N 3.13Å
5	A	44.8	Very low	42.4	Very low	54 Å²	54	120.7 Å²	120.7	45%	0.446	67%	0.67	S	S	.	*	H	α-helix	trans	-73.9	-32.3	177.9	0	0	0	0	0	112.4	L9	A5-L9 PolarHBondContact O-N 2.93Å
6	F	46.9	Very low	42	Very low	156 Å²	156	127 Å²	127	68%	0.684	68%	0.68	S	S	*	*	H	α-helix	trans	-72	-36.5	-179.8	-117.7	-91.5	0	0	0	113.1	F10	F6-F10 WeakPolarHBondContact O-CB 3.43Å; F6-F10 PolarHBondContact O-N 3.17Å; F6-F10 VanDerWaalsContact O-N 3.13Å
7	L	45.7	Very low	41.2	Very low	124 Å²	124	127.8 Å²	127.8	65%	0.649	68%	0.684	S	S	*	*	H	α-helix	trans	-72.4	-30.3	176.8	-97.7	99.2	0	0	0	113.4	T11	L7-T11 WeakPolarHBondContact O-CB 3.24Å; L7-T11 WeakPolarHBondContact O-CG2 3.22Å; L7-T11 PolarHBondContact O-N 3.03Å; L7-T11 VanDerWaalsContact O-N 3.12Å; L7-T11 PolarHBondContact O-OG1 3.23Å
8	L	45.6	Very low	40.8	Very low	125 Å²	125	128 Å²	128	65%	0.654	69%	0.69	S	S	*	*	H	α-helix	trans	-74.5	-32.5	177	-80.9	162.5	0	0	0	112.5	T11 A12	L8-T11 WeakPolarHBondContact CA-OG1 3.24Å; L8-T11 PolarHBondContact O-OG1 3.47Å; L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.41Å
9	L	46.3	Very low	40.3	Very low	123 Å²	123	128.4 Å²	128.4	64%	0.644	70%	0.697	S	S	*	*	H	α-helix	trans	-75.2	-34.3	173.7	-79	160	0	0	0	112.4	A5 A12 F13	A5-L9 PolarHBondContact O-N 2.93Å; L9-A12 PolarHBondContact O-N 3.04Å; L9-F13 WeakPolarHBondContact O-CB 3.47Å; L9-F13 PolarHBondContact O-N 2.64Å
10	F	44.5	Very low	40.1	Very low	143 Å²	143	127.8 Å²	127.8	63%	0.627	70%	0.698	S	S	*	*	H	α-helix	trans	-73.8	-31.5	177.7	-134.3	-95.6	0	0	0	113.1	F6 T14	F6-F10 WeakPolarHBondContact O-CB 3.43Å; F6-F10 PolarHBondContact O-N 3.17Å; F6-F10 VanDerWaalsContact O-N 3.13Å; F10-T14 HydrophobicContact CD1-CG2 4.42Å; F10-T14 WeakPolarHBondContact O-CG2 2.95Å; F10-T14 PolarHBondContact O-N 2.9Å; F10-T14 PolarHBondContact O-OG1 3.44Å
11	T	42.7	Very low	40.3	Very low	78 Å²	78	126.3 Å²	126.3	48%	0.479	70%	0.698	S	S	.	*	H	α-helix	trans	-76.9	-28.8	173.8	47.4	0	0	0	0	112.6	L7 L8 T14	L7-T11 WeakPolarHBondContact O-CB 3.24Å; L7-T11 WeakPolarHBondContact O-CG2 3.22Å; L7-T11 PolarHBondContact O-N 3.03Å; L7-T11 VanDerWaalsContact O-N 3.12Å; L7-T11 PolarHBondContact O-OG1 3.23Å; L8-T11 WeakPolarHBondContact CA-OG1 3.24Å; L8-T11 PolarHBondContact O-OG1 3.47Å; T11-T14 PolarHBondContact O-OG1 2.8Å
12	A	38.6	Very low	40	Very low	62 Å²	62	124.4 Å²	124.4	51%	0.512	68%	0.675	S	S	.	*	H	α-helix	trans	-73.9	-29.7	170.9	0	0	0	0	0	113.4	L8 L9	L8-A12 WeakPolarHBondContact O-CB 3.29Å; L8-A12 PolarHBondContact O-N 3.41Å; L9-A12 PolarHBondContact O-N 3.04Å
13	F	35	Very low	40.9	Very low	163 Å²	163	121 Å²	121	72%	0.715	66%	0.66	S	S	*	*	H	α-helix	trans	-82.1	-28.4	179.5	-151.6	-98.4	0	0	0	113.2	L9	L9-F13 WeakPolarHBondContact O-CB 3.47Å; L9-F13 PolarHBondContact O-N 2.64Å
14	T	34.8	Very low	42.5	Very low	89 Å²	89	118 Å²	118	55%	0.546	64%	0.644	S	S	.	*	H	α-helix	trans	-82.9	-12.4	176.9	47.4	0	0	0	0	114	F10 T11	F10-T14 HydrophobicContact CD1-CG2 4.42Å; F10-T14 WeakPolarHBondContact O-CG2 2.95Å; F10-T14 PolarHBondContact O-N 2.9Å; F10-T14 PolarHBondContact O-OG1 3.44Å; T11-T14 PolarHBondContact O-OG1 2.8Å
15	L	34	Very low	44.2	Very low	156 Å²	156	117.8 Å²	117.8	82%	0.817	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	4.2	174.4	-121.7	83.1	0	0	0	114.8
16	R	35.1	Very low	46	Very low	221 Å²	221	117.9 Å²	117.9	83%	0.834	63%	0.629	S	S	*	*	S	Bend	trans	-119.3	32.2	-179.5	-85.6	-164	-177.6	-161.2	2.9	114.6
17	L	29.3	Very low	47.7	Very low	141 Å²	141	115.7 Å²	115.7	74%	0.738	62%	0.62	S	S	*	*			trans	-127.3	63.8	171.4	-89.6	147.8	0	0	0	110.7
18	T	33.2	Very low	49.3	Very low	131 Å²	131	110.1 Å²	110.1	80%	0.804	59%	0.591	S	S	*	*			trans	-76.7	119.7	148.9	46.1	0	0	0	0	107.2	T20	T18-T20 PolarHBondContact O-N 3.15Å
19	T	31.7	Very low	51	Low	135 Å²	135	110.5 Å²	110.5	83%	0.828	59%	0.587	S	S	*	*			trans	-57.6	100.8	-180	47.3	0	0	0	0	111.2	S21	T19-S21 PolarHBondContact O-N 3.16Å
20	T	37.3	Very low	52.6	Low	117 Å²	117	105 Å²	105	72%	0.718	56%	0.559	S	S	*	*			trans	-59.9	117.8	153.4	34.5	0	0	0	0	107.6	T18 C22	T18-T20 PolarHBondContact O-N 3.15Å; T20-C22 VanDerWaalsContact C-N 3.3Å; T20-C22 PolarHBondContact O-N 3.36Å
21	S	42.4	Very low	54.3	Low	97 Å²	97	104 Å²	104	68%	0.678	55%	0.554	S	S	*	*			trans	-70	92.4	168.7	-164.7	0	0	0	0	107.6	T19	T19-S21 PolarHBondContact O-N 3.16Å
22	C	46.2	Very low	56	Low	95 Å²	95	106.2 Å²	106.2	64%	0.642	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-70.2	127.5	176.3	-75.6	0	0	0	0	109.4	T20 E24	T20-C22 VanDerWaalsContact C-N 3.3Å; T20-C22 PolarHBondContact O-N 3.36Å; C22-E24 PolarHBondContact O-N 2.7Å
23	M	59.2	Low	57.6	Low	104 Å²	104	106.1 Å²	106.1	51%	0.512	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-69.6	122.6	166	-81.1	-179	68.9	0	0	108.9	S148 R150	M23-S148 WeakPolarHBondContact CE-OG 3.41Å; M23-R150 HydrophobicContact CG-CB 4.48Å
24	E	76.4	Confident	58.6	Low	98 Å²	98	107.3 Å²	107.3	46%	0.458	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.2	144	172.6	-69	178	-177.3	0	0	109.9	C22 F58 S148 R149	C22-E24 PolarHBondContact O-N 2.7Å; E24-F58 HydrophobicContact CB-CE1 4.01Å; E24-S148 CarbonylContact O-C 3.5Å; E24-S148 VanDerWaalsContact O-CA 3.24Å; E24-S148 WeakPolarHBondContact O-CA 3.39Å; E24-R149 HydrophobicContact CB-CG 4.03Å; E24-R149 PolarHBondContact N-O 3.47Å; E24-R149 PolarHBondContact O-N 2.95Å; E24-R149 IonicContact OE2-CZ 3.81Å; E24-R149 IonicContact OE2-NE 3.14Å; E24-R149 PolarHBondContact OE2-NE 2.9Å; E24-R149 IonicContact OE2-NH2 2.6Å; E24-R149 PolarHBondContact OE2-NH2 3.24Å
25	V	79.6	Confident	59.4	Low	62 Å²	62	111.5 Å²	111.5	38%	0.376	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.9	137.2	-175	-179	0	0	0	0	109.3	R146 I147	V25-R146 HydrophobicContact CG1-CG 3.72Å; V25-I147 WeakPolarHBondContact CA-O 3.36Å
26	D	81.3	Confident	59.6	Low	56 Å²	56	112.7 Å²	112.7	30%	0.299	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-144.7	173.1	174.1	-160.2	1.7	0	0	0	110.2	F58 I147	D26-F58 HydrophobicContact CB-CD1 3.69Å; D26-F58 HydrophobicContact CB-CD2 4.22Å; D26-F58 HydrophobicContact CB-CE1 3.45Å; D26-F58 VanDerWaalsContact CB-CE1 3.45Å; D26-F58 HydrophobicContact CB-CE2 4.01Å; D26-F58 HydrophobicContact CB-CG 4.08Å; D26-F58 HydrophobicContact CB-CZ 3.61Å; D26-F58 VanDerWaalsContact OD2-CA 3.31Å; D26-F58 WeakPolarHBondContact OD2-CA 3.43Å; D26-F58 PolarHBondContact OD2-N 3.01Å; D26-I147 PolarHBondContact N-O 2.76Å; D26-I147 PolarHBondContact O-N 2.74Å; D26-I147 VanDerWaalsContact O-O 3.05Å
27	F	82	Confident	59.5	Low	110 Å²	110	112.3 Å²	112.3	48%	0.482	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.4	142.2	-176.9	-59.6	-90.7	0	0	0	111.3	T144 H145 R146	F27-T144 HydrophobicContact CB-CG2 3.97Å; F27-T144 HydrophobicContact CD1-CG2 4.47Å; F27-H145 CarbonylContact C-O 3.47Å; F27-H145 VanDerWaalsContact CA-O 3.31Å; F27-H145 WeakPolarHBondContact CA-O 2.98Å; F27-R146 HydrophobicContact CD1-CB 3.99Å; F27-R146 HydrophobicContact CD1-CG 4.3Å; F27-R146 HydrophobicContact CE1-CB 3.88Å; F27-R146 HydrophobicContact CE1-CG 3.9Å; F27-R146 HydrophobicContact CZ-CG 4.45Å
28	C	81.1	Confident	59.6	Low	6 Å²	6	114.4 Å²	114.4	4%	0.041	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-142.5	159.6	-179.7	72	0	0	0	0	112.3	S56 A57 H145 I147	C28-S56 WeakPolarHBondContact CB-O 3.23Å; C28-A57 HydrophobicContact CB-CB 4.14Å; C28-H145 PolarHBondContact N-O 3.49Å; C28-H145 PolarHBondContact O-N 2.86Å; C28-I147 HydrophobicContact CB-CD1 4.22Å; C28-I147 WeakPolarHBondContact SG-CD1 3.27Å
29	K	80.5	Confident	59.8	Low	134 Å²	134	113.1 Å²	113.1	58%	0.583	57%	0.57	S	S	*	*			trans	-111.1	122.3	168.4	-68.7	-171.2	176.1	-164.8	0	109.9	T144	K29-T144 WeakPolarHBondContact CE-OG1 3.24Å
30	P	79.6	Confident	60	Low	7 Å²	7	115.2 Å²	115.2	5%	0.045	57%	0.571	C	S	.	*			trans	-69.9	129.8	178.7	-13.6	26.5	0	0	0	112.5	F53 L55 L113 H145	P30-F53 HydrophobicContact CB-CD1 4.18Å; P30-L55 HydrophobicContact CB-CD2 3.65Å; P30-L55 HydrophobicContact CG-CD2 3.8Å; P30-L113 HydrophobicContact CB-CD2 3.64Å; P30-L113 HydrophobicContact CG-CB 4.11Å; P30-L113 HydrophobicContact CG-CD2 3.74Å; P30-H145 WeakPolarHBondContact CD-ND1 2.97Å; P30-H145 VanDerWaalsContact CG-CE1 3.49Å; P30-H145 WeakPolarHBondContact CG-CE1 3.13Å; P30-H145 VanDerWaalsContact CG-ND1 3.3Å; P30-H145 WeakPolarHBondContact CG-ND1 3.22Å
31	F	79.9	Confident	59.8	Low	121 Å²	121	120.6 Å²	120.6	53%	0.531	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	123.8	172.7	-171.2	-95	0	0	0	110.4	L33 F53 R54	F31-L33 HydrophobicContact CD1-CD2 4.46Å; F31-F53 CarbonylContact O-C 3.54Å; F31-F53 WeakPolarHBondContact O-CA 3.36Å; F31-R54 HydrophobicContact CB-CB 4.42Å; F31-R54 PolarHBondContact N-O 2.66Å; F31-R54 PolarHBondContact O-N 3.29Å
32	R	77.8	Confident	59.6	Low	126 Å²	126	127.9 Å²	127.9	48%	0.475	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.9	133.5	178.7	-167.4	174.9	-177.8	171.3	2.7	110.4	F53 L141	R32-F53 HydrophobicContact CB-CD1 4.12Å; R32-F53 HydrophobicContact CB-CE1 3.7Å; R32-F53 HydrophobicContact CB-CZ 4.49Å; R32-F53 HydrophobicContact CG-CD1 4.46Å; R32-F53 HydrophobicContact CG-CE1 3.86Å; R32-F53 HydrophobicContact CG-CZ 4.17Å; R32-L141 HydrophobicContact CB-CD1 4.05Å; R32-L141 HydrophobicContact CG-CD1 4.49Å
33	L	72.9	Confident	58.9	Low	60 Å²	60	127.6 Å²	127.6	31%	0.314	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	116.3	179.6	-61	165.8	0	0	0	109.4	F31 G52 R54 Y63	F31-L33 HydrophobicContact CD1-CD2 4.46Å; L33-G52 PolarHBondContact N-O 3.31Å; L33-R54 HydrophobicContact CD2-CB 4.38Å; L33-Y63 HydrophobicContact CD1-CD1 4.04Å
34	E	57	Low	58	Low	188 Å²	188	132.6 Å²	132.6	88%	0.879	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-81.8	139.5	173.2	-69.4	-170.1	164.1	0	0	111.1
35	H	51.4	Low	56	Low	176 Å²	176	136.1 Å²	136.1	82%	0.815	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-89.3	116.3	174.2	-105.7	43.8	0	0	0	110.5
36	E	37.2	Very low	53.7	Low	182 Å²	182	139.8 Å²	139.8	85%	0.85	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61.4	131.7	166.4	-73.8	-174.1	148.1	0	0	110.8	H38	E36-H38 PolarHBondContact O-N 2.93Å
37	K	34.5	Very low	51.6	Low	212 Å²	212	147 Å²	147	92%	0.922	69%	0.686	S	S	*	*			trans	-73.6	109.3	179.4	-71.4	175.5	179	172.3	0	110.4
38	H	30	Very low	49.8	Very low	186 Å²	186	146.4 Å²	146.4	86%	0.861	69%	0.69	S	S	*	*			trans	-102.9	131.6	162.5	-110.3	-53.6	0	0	0	111.7	E36	E36-H38 PolarHBondContact O-N 2.93Å
39	P	37.6	Very low	48.3	Very low	103 Å²	103	149.6 Å²	149.6	67%	0.669	72%	0.717	S	S	*	*			trans	-95.2	146.6	-173.5	35.3	-31.1	0	0	0	114.2
40	Q	36.1	Very low	47.4	Very low	179 Å²	179	152.9 Å²	152.9	84%	0.836	73%	0.726	S	S	*	*			trans	75.9	136.8	165.8	-57.8	-177.1	-2.6	0	0	116.4
41	R	32.9	Very low	46.9	Very low	231 Å²	231	153.2 Å²	153.2	87%	0.872	73%	0.728	S	S	*	*			cis	-163.8	139	34.7	-131.7	171.6	-171.1	-170.1	2.9	110.7
42	R	39.6	Very low	46.8	Very low	249 Å²	249	148 Å²	148	94%	0.94	71%	0.708	S	S	*	*			trans	49	95.8	146.1	-131.8	179.2	-165.4	178.5	3.2	120.7
43	A	31.4	Very low	47.1	Very low	90 Å²	90	142.1 Å²	142.1	74%	0.744	69%	0.686	S	S	*	*			trans	-174.6	136.2	133.6	0	0	0	0	0	108.2	Q45	A43-Q45 PolarHBondContact O-N 3.09Å
44	E	39.7	Very low	47.7	Very low	208 Å²	208	143.5 Å²	143.5	97%	0.972	69%	0.687	S	S	*	*			trans	-64.9	98.3	177.2	-76.6	173.5	148.9	0	0	110.4
45	Q	33.5	Very low	49.2	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.804	65%	0.645	S	S	*	*			trans	-132.1	122.4	162.5	-86	178.4	-9.2	0	0	107.4	A43 K47	A43-Q45 PolarHBondContact O-N 3.09Å; Q45-K47 PolarHBondContact O-N 3.04Å
46	T	32.2	Very low	50.8	Low	139 Å²	139	129.3 Å²	129.3	85%	0.853	63%	0.628	S	S	*	*			trans	-54.1	108.5	173	30.4	0	0	0	0	110.1	V48	T46-V48 PolarHBondContact O-N 3.06Å
47	K	37.3	Very low	52.9	Low	209 Å²	209	120.7 Å²	120.7	91%	0.909	59%	0.589	S	S	*	*			trans	-60.9	112.8	176.7	-82	179.5	172.6	-179.9	0	110.6	Q45	Q45-K47 PolarHBondContact O-N 3.04Å
48	V	44.2	Very low	55.3	Low	96 Å²	96	111.9 Å²	111.9	58%	0.582	55%	0.55	S	S	*	*			trans	-87.3	122	167	-177.1	0	0	0	0	108.1	T46 R50	T46-V48 PolarHBondContact O-N 3.06Å; V48-R50 PolarHBondContact O-N 2.83Å; V48-R50 VanDerWaalsContact O-N 3.1Å
49	A	49.8	Very low	57.8	Low	73 Å²	73	115.3 Å²	115.3	60%	0.603	56%	0.556	S	S	*	*			trans	-67.5	105.2	179.4	0	0	0	0	0	110.5	P68	A49-P68 WeakPolarHBondContact O-CD 3.45Å; A49-P68 WeakPolarHBondContact O-CG 3.33Å
50	R	59.9	Low	59.9	Low	204 Å²	204	114.5 Å²	114.5	77%	0.77	54%	0.543	S	S	*	.			trans	-81.3	133.2	174.2	-73.3	179.9	173.9	-178.1	-3.1	110.1	V48 L66 T67	V48-R50 PolarHBondContact O-N 2.83Å; V48-R50 VanDerWaalsContact O-N 3.1Å; R50-L66 WeakPolarHBondContact CA-O 3.31Å; R50-T67 HydrophobicContact CG-CG2 3.89Å
51	V	69.9	Low	62.2	Low	13 Å²	13	110.1 Å²	110.1	8%	0.079	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.5	178.4	179.7	0	0	0	0	108.4	F53 L66 Y93 L109	V51-F53 HydrophobicContact CG1-CD2 4.35Å; V51-F53 HydrophobicContact CG1-CE2 3.6Å; V51-F53 HydrophobicContact CG1-CZ 4.1Å; V51-L66 PolarHBondContact N-O 3.26Å; V51-L66 VanDerWaalsContact O-CA 3.3Å; V51-L66 WeakPolarHBondContact O-CA 3.3Å; V51-L66 WeakPolarHBondContact O-CB 3.32Å; V51-L66 PolarHBondContact O-N 3.34Å; V51-Y93 HydrophobicContact CB-CD1 4.05Å; V51-Y93 HydrophobicContact CB-CE1 3.86Å; V51-Y93 HydrophobicContact CG2-CD1 4.11Å; V51-Y93 HydrophobicContact CG2-CE1 3.4Å; V51-Y93 VanDerWaalsContact CG2-CE1 3.4Å; V51-L109 HydrophobicContact CG1-CD1 3.99Å
52	G	78.9	Confident	64.7	Low	12 Å²	12	99.1 Å²	99.1	12%	0.124	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.5	-178.2	0	0	0	0	0	112.9	L33 L64	L33-G52 PolarHBondContact N-O 3.31Å; G52-L64 CarbonylContact C-O 3.54Å; G52-L64 VanDerWaalsContact CA-O 3.26Å; G52-L64 WeakPolarHBondContact CA-O 3.23Å
53	F	83.5	Confident	67	Low	2 Å²	2	90.9 Å²	90.9	1%	0.009	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	142.1	172.7	-72	-79.4	0	0	0	112.3	P30 F31 R32 V51 Y63 L64 L66 L109 L113 L141	P30-F53 HydrophobicContact CB-CD1 4.18Å; F31-F53 CarbonylContact O-C 3.54Å; F31-F53 WeakPolarHBondContact O-CA 3.36Å; R32-F53 HydrophobicContact CB-CD1 4.12Å; R32-F53 HydrophobicContact CB-CE1 3.7Å; R32-F53 HydrophobicContact CB-CZ 4.49Å; R32-F53 HydrophobicContact CG-CD1 4.46Å; R32-F53 HydrophobicContact CG-CE1 3.86Å; R32-F53 HydrophobicContact CG-CZ 4.17Å; V51-F53 HydrophobicContact CG1-CD2 4.35Å; V51-F53 HydrophobicContact CG1-CE2 3.6Å; V51-F53 HydrophobicContact CG1-CZ 4.1Å; F53-Y63 CarbonylContact O-C 3.55Å; F53-Y63 WeakPolarHBondContact O-CA 3.11Å; F53-L64 HydrophobicContact CB-CB 4.35Å; F53-L64 HydrophobicContact CB-CD1 4.4Å; F53-L64 PolarHBondContact N-O 3.07Å; F53-L64 PolarHBondContact O-N 3.14Å; F53-L66 HydrophobicContact CD2-CD1 3.55Å; F53-L66 HydrophobicContact CE2-CD1 3.96Å; F53-L109 HydrophobicContact CD2-CD2 4.29Å; F53-L109 HydrophobicContact CE2-CD1 3.57Å; F53-L109 HydrophobicContact CE2-CD2 3.42Å; F53-L109 VanDerWaalsContact CE2-CD2 3.42Å; F53-L109 HydrophobicContact CE2-CG 4.16Å; F53-L109 HydrophobicContact CZ-CD1 3.99Å; F53-L109 HydrophobicContact CZ-CD2 3.73Å; F53-L113 HydrophobicContact CB-CD2 4.32Å; F53-L113 HydrophobicContact CD2-CD1 3.86Å; F53-L113 HydrophobicContact CE2-CD1 4.11Å; F53-L113 HydrophobicContact CG-CD1 4.23Å; F53-L113 HydrophobicContact CG-CD2 4.24Å; F53-L141 HydrophobicContact CD1-CD2 4.33Å; F53-L141 HydrophobicContact CE1-CD1 4.32Å; F53-L141 HydrophobicContact CE1-CD2 3.3Å; F53-L141 HydrophobicContact CE1-CG 4.41Å; F53-L141 HydrophobicContact CZ-CD2 3.77Å
54	R	85.6	Confident	69.6	Low	89 Å²	89	86.6 Å²	86.6	34%	0.336	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.3	168.7	-174.9	-178.3	66	171.7	-1.8	110.1	F31 L33 E61 F62 Y63	F31-R54 HydrophobicContact CB-CB 4.42Å; F31-R54 PolarHBondContact N-O 2.66Å; F31-R54 PolarHBondContact O-N 3.29Å; L33-R54 HydrophobicContact CD2-CB 4.38Å; R54-E61 IonicContact NH1-OE1 3.96Å; R54-F62 CarbonylContact C-O 3.59Å; R54-F62 WeakPolarHBondContact CA-O 3.32Å; R54-Y63 HydrophobicContact CB-CD1 4.23Å; R54-Y63 HydrophobicContact CB-CE1 4.18Å; R54-Y63 WeakPolarHBondContact CD-OH 3.29Å; R54-Y63 HydrophobicContact CG-CD1 4.12Å; R54-Y63 HydrophobicContact CG-CE1 3.75Å; R54-Y63 HydrophobicContact CG-CE2 4.44Å
55	L	88.1	Confident	71.6	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.9	175.7	-59.8	168.3	0	0	0	109.7	P30 E61 F62 L64 L113 F117 I126 I147	P30-L55 HydrophobicContact CB-CD2 3.65Å; P30-L55 HydrophobicContact CG-CD2 3.8Å; L55-E61 CarbonylContact O-C 3.56Å; L55-E61 WeakPolarHBondContact O-CA 3.19Å; L55-F62 HydrophobicContact CB-CB 4.35Å; L55-F62 PolarHBondContact N-O 2.92Å; L55-F62 PolarHBondContact O-N 2.86Å; L55-L64 HydrophobicContact CD1-CD1 3.54Å; L55-L64 HydrophobicContact CD1-CD2 4.47Å; L55-L64 HydrophobicContact CD1-CG 4.09Å; L55-L64 HydrophobicContact CG-CD1 4.34Å; L55-L113 HydrophobicContact CD1-CD2 4.17Å; L55-L113 HydrophobicContact CD2-CD2 3.71Å; L55-L113 HydrophobicContact CG-CD2 4.3Å; L55-F117 HydrophobicContact CD1-CE1 4.17Å; L55-I126 HydrophobicContact CD1-CD1 3.47Å; L55-I126 VanDerWaalsContact CD1-CD1 3.47Å; L55-I126 HydrophobicContact CD1-CG1 4.34Å; L55-I147 HydrophobicContact CD1-CD1 4.19Å
56	S	84.3	Confident	73.7	Confident	66 Å²	66	72.1 Å²	72.1	46%	0.462	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110.2	172.2	-169.8	0	0	0	0	109.2	C28 Q60	C28-S56 WeakPolarHBondContact CB-O 3.23Å; S56-Q60 WeakPolarHBondContact CA-O 3.38Å
57	A	81.8	Confident	75.6	Confident	2 Å²	2	67.8 Å²	67.8	2%	0.017	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	148.2	-178.7	0	0	0	0	0	110.6	C28 R59 Q60 F62 I147	C28-A57 HydrophobicContact CB-CB 4.14Å; A57-R59 PolarHBondContact O-N 3.15Å; A57-Q60 PolarHBondContact N-O 3.4Å; A57-Q60 PolarHBondContact O-N 2.86Å; A57-F62 HydrophobicContact CB-CE2 4.34Å; A57-I147 HydrophobicContact CB-CB 4.43Å; A57-I147 HydrophobicContact CB-CD1 3.93Å
58	F	84.9	Confident	77	Confident	27 Å²	27	60.3 Å²	60.3	12%	0.118	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	36.7	-177.8	-53	-79.9	0	0	0	113.6	E24 D26 Q60 Y124 I147 R149	E24-F58 HydrophobicContact CB-CE1 4.01Å; D26-F58 HydrophobicContact CB-CD1 3.69Å; D26-F58 HydrophobicContact CB-CD2 4.22Å; D26-F58 HydrophobicContact CB-CE1 3.45Å; D26-F58 VanDerWaalsContact CB-CE1 3.45Å; D26-F58 HydrophobicContact CB-CE2 4.01Å; D26-F58 HydrophobicContact CB-CG 4.08Å; D26-F58 HydrophobicContact CB-CZ 3.61Å; D26-F58 VanDerWaalsContact OD2-CA 3.31Å; D26-F58 WeakPolarHBondContact OD2-CA 3.43Å; D26-F58 PolarHBondContact OD2-N 3.01Å; F58-Q60 PolarHBondContact O-N 2.88Å; F58-Y124 HydrophobicContact CD2-CD1 4.34Å; F58-Y124 HydrophobicContact CD2-CE1 4.13Å; F58-Y124 HydrophobicContact CE2-CD1 4.23Å; F58-Y124 HydrophobicContact CE2-CE1 4.41Å; F58-I147 HydrophobicContact CE2-CB 4.2Å; F58-I147 HydrophobicContact CE2-CG2 3.82Å; F58-I147 WeakPolarHBondContact CZ-O 3.2Å; F58-R149 HydrophobicContact CD1-CG 4.46Å; F58-R149 HydrophobicContact CE1-CG 4.03Å; F58-R149 HydrophobicContact CE2-CB 4.16Å; F58-R149 HydrophobicContact CE2-CG 4.07Å; F58-R149 HydrophobicContact CZ-CB 4.2Å; F58-R149 HydrophobicContact CZ-CG 3.82Å
59	R	81.7	Confident	77.5	Confident	257 Å²	257	58.3 Å²	58.3	97%	0.97	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	26	-173.2	-54.1	-178.5	-179.3	-178.7	-0.3	113.9	A57	A57-R59 PolarHBondContact O-N 3.15Å
60	Q	82.1	Confident	77.4	Confident	87 Å²	87	57.8 Å²	57.8	41%	0.407	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.7	177.2	-67	-178.5	1.7	0	0	110.4	S56 A57 F58 F62	S56-Q60 WeakPolarHBondContact CA-O 3.38Å; A57-Q60 PolarHBondContact N-O 3.4Å; A57-Q60 PolarHBondContact O-N 2.86Å; F58-Q60 PolarHBondContact O-N 2.88Å; Q60-F62 HydrophobicContact CB-CE2 4.13Å; Q60-F62 HydrophobicContact CB-CZ 3.95Å
61	E	84	Confident	76.7	Confident	87 Å²	87	54 Å²	54	41%	0.407	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	135	172.7	-63.4	-163.1	148.5	0	0	111	R54 L55 Y63 N98	R54-E61 IonicContact NH1-OE1 3.96Å; L55-E61 CarbonylContact O-C 3.56Å; L55-E61 WeakPolarHBondContact O-CA 3.19Å; E61-Y63 HydrophobicContact CB-CE2 3.89Å; E61-Y63 PolarHBondContact OE2-OH 3.43Å; E61-N98 PolarHBondContact O-ND2 3.24Å
62	F	87.1	Confident	75.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.2	176.9	-53.2	-81.3	0	0	0	109.7	R54 L55 A57 Q60 V97 F117 Y119 Y124	R54-F62 CarbonylContact C-O 3.59Å; R54-F62 WeakPolarHBondContact CA-O 3.32Å; L55-F62 HydrophobicContact CB-CB 4.35Å; L55-F62 PolarHBondContact N-O 2.92Å; L55-F62 PolarHBondContact O-N 2.86Å; A57-F62 HydrophobicContact CB-CE2 4.34Å; Q60-F62 HydrophobicContact CB-CE2 4.13Å; Q60-F62 HydrophobicContact CB-CZ 3.95Å; F62-V97 HydrophobicContact CB-CG1 4.02Å; F62-V97 HydrophobicContact CD1-CG1 4.06Å; F62-F117 HydrophobicContact CB-CE2 4.28Å; F62-F117 HydrophobicContact CB-CZ 4.01Å; F62-F117 AromaticContact CD1-CE2 3.43Å; F62-F117 HydrophobicContact CD1-CE2 3.43Å; F62-F117 VanDerWaalsContact CD1-CE2 3.43Å; F62-F117 AromaticContact CD1-CZ 3.71Å; F62-F117 HydrophobicContact CD1-CZ 3.71Å; F62-F117 HydrophobicContact CD2-CE2 4.39Å; F62-F117 AromaticContact CD2-CZ 3.81Å; F62-F117 HydrophobicContact CD2-CZ 3.81Å; F62-F117 AromaticContact CE1-CE2 3.75Å; F62-F117 HydrophobicContact CE1-CE2 3.75Å; F62-F117 HydrophobicContact CE1-CZ 4.08Å; F62-F117 HydrophobicContact CE2-CZ 4.18Å; F62-F117 AromaticContact CG-CE2 3.78Å; F62-F117 HydrophobicContact CG-CE2 3.78Å; F62-F117 AromaticContact CG-CZ 3.55Å; F62-F117 HydrophobicContact CG-CZ 3.55Å; F62-F117 HydrophobicContact CZ-CE2 4.37Å; F62-F117 HydrophobicContact CZ-CZ 4.31Å; F62-Y119 HydrophobicContact CD1-CD1 4.17Å; F62-Y119 AromaticContact CE1-CD1 3.8Å; F62-Y119 HydrophobicContact CE1-CD1 3.8Å; F62-Y119 HydrophobicContact CE1-CE1 4.39Å; F62-Y124 HydrophobicContact CE1-CE1 4.18Å; F62-Y124 HydrophobicContact CE1-CE2 4.27Å; F62-Y124 AromaticContact CE1-CZ 3.93Å; F62-Y124 HydrophobicContact CE2-CE1 4.33Å; F62-Y124 HydrophobicContact CZ-CD1 4.2Å; F62-Y124 AromaticContact CZ-CE1 3.58Å; F62-Y124 HydrophobicContact CZ-CE1 3.58Å; F62-Y124 HydrophobicContact CZ-CE2 4.48Å; F62-Y124 AromaticContact CZ-CZ 3.75Å
63	Y	86.6	Confident	72.9	Confident	75 Å²	75	60 Å²	60	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	105	177.2	-65.4	-97.9	0	0	0	108.1	L33 F53 R54 E61 V97 N98	L33-Y63 HydrophobicContact CD1-CD1 4.04Å; F53-Y63 CarbonylContact O-C 3.55Å; F53-Y63 WeakPolarHBondContact O-CA 3.11Å; R54-Y63 HydrophobicContact CB-CD1 4.23Å; R54-Y63 HydrophobicContact CB-CE1 4.18Å; R54-Y63 WeakPolarHBondContact CD-OH 3.29Å; R54-Y63 HydrophobicContact CG-CD1 4.12Å; R54-Y63 HydrophobicContact CG-CE1 3.75Å; R54-Y63 HydrophobicContact CG-CE2 4.44Å; E61-Y63 HydrophobicContact CB-CE2 3.89Å; E61-Y63 PolarHBondContact OE2-OH 3.43Å; Y63-V97 CarbonylContact O-C 3.53Å; Y63-V97 WeakPolarHBondContact O-CA 2.92Å; Y63-N98 WeakPolarHBondContact CB-OD1 3.38Å; Y63-N98 WeakPolarHBondContact CD2-OD1 3.42Å; Y63-N98 PolarHBondContact N-OD1 2.99Å; Y63-N98 PolarHBondContact O-N 3.48Å
64	L	86.4	Confident	70.4	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.8	179.1	-49.9	-177.7	0	0	0	108.9	G52 F53 L55 L66 V97 V105 V107 L113 F117 I126	G52-L64 CarbonylContact C-O 3.54Å; G52-L64 VanDerWaalsContact CA-O 3.26Å; G52-L64 WeakPolarHBondContact CA-O 3.23Å; F53-L64 HydrophobicContact CB-CB 4.35Å; F53-L64 HydrophobicContact CB-CD1 4.4Å; F53-L64 PolarHBondContact N-O 3.07Å; F53-L64 PolarHBondContact O-N 3.14Å; L55-L64 HydrophobicContact CD1-CD1 3.54Å; L55-L64 HydrophobicContact CD1-CD2 4.47Å; L55-L64 HydrophobicContact CD1-CG 4.09Å; L55-L64 HydrophobicContact CG-CD1 4.34Å; L64-L66 HydrophobicContact CB-CD1 4.45Å; L64-L66 HydrophobicContact CB-CD2 3.99Å; L64-L66 HydrophobicContact CB-CG 4.1Å; L64-V97 HydrophobicContact CD2-CB 4.33Å; L64-V97 HydrophobicContact CD2-CG1 4.03Å; L64-V97 HydrophobicContact CD2-CG2 3.59Å; L64-V105 HydrophobicContact CB-CG1 4.4Å; L64-V105 HydrophobicContact CB-CG2 4.38Å; L64-V105 HydrophobicContact CD1-CG2 3.96Å; L64-V105 HydrophobicContact CD2-CB 4.17Å; L64-V105 HydrophobicContact CD2-CG1 4.39Å; L64-V105 HydrophobicContact CD2-CG2 3.9Å; L64-V105 HydrophobicContact CG-CG2 4.29Å; L64-V107 HydrophobicContact CD1-CG1 4.48Å; L64-L113 HydrophobicContact CD1-CD2 4.28Å; L64-F117 HydrophobicContact CD2-CD1 4.08Å; L64-F117 HydrophobicContact CD2-CE1 4.39Å; L64-F117 HydrophobicContact CD2-CG 4.21Å; L64-I126 HydrophobicContact CD1-CD1 4.19Å
65	H	81.9	Confident	67.7	Low	76 Å²	76	61.7 Å²	61.7	35%	0.352	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.5	171.3	-58.8	137.5	0	0	0	108.9	G95 D96	H65-G95 VanDerWaalsContact O-CA 3.26Å; H65-G95 WeakPolarHBondContact O-CA 3.35Å; H65-D96 IonicContact CE1-OD2 3.96Å; H65-D96 IonicContact CG-OD2 3.62Å; H65-D96 PolarHBondContact N-O 3.42Å; H65-D96 IonicContact ND1-OD2 2.87Å; H65-D96 PolarHBondContact ND1-OD2 2.82Å; H65-D96 PolarHBondContact O-N 3.33Å
66	L	77.2	Confident	65.1	Low	1 Å²	1	65.1 Å²	65.1	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138	-168.8	-49.1	172.8	0	0	0	111.4	R50 V51 F53 L64 Y93 V105 V107	R50-L66 WeakPolarHBondContact CA-O 3.31Å; V51-L66 PolarHBondContact N-O 3.26Å; V51-L66 VanDerWaalsContact O-CA 3.3Å; V51-L66 WeakPolarHBondContact O-CA 3.3Å; V51-L66 WeakPolarHBondContact O-CB 3.32Å; V51-L66 PolarHBondContact O-N 3.34Å; F53-L66 HydrophobicContact CD2-CD1 3.55Å; F53-L66 HydrophobicContact CE2-CD1 3.96Å; L64-L66 HydrophobicContact CB-CD1 4.45Å; L64-L66 HydrophobicContact CB-CD2 3.99Å; L64-L66 HydrophobicContact CB-CG 4.1Å; L66-Y93 HydrophobicContact CB-CD1 4.16Å; L66-Y93 HydrophobicContact CB-CG 4.22Å; L66-V105 HydrophobicContact CD2-CB 4.29Å; L66-V105 HydrophobicContact CD2-CG1 3.48Å; L66-V105 VanDerWaalsContact CD2-CG1 3.48Å; L66-V105 HydrophobicContact CD2-CG2 3.79Å; L66-V107 HydrophobicContact CD1-CG2 3.33Å; L66-V107 HydrophobicContact CD2-CG2 3.65Å; L66-V107 HydrophobicContact CG-CG2 4.13Å
67	T	73.3	Confident	62.3	Low	47 Å²	47	66 Å²	66	29%	0.288	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.9	173.2	47.3	0	0	0	0	109.3	R50 D69 Y93 S94	R50-T67 HydrophobicContact CG-CG2 3.89Å; T67-D69 PolarHBondContact O-N 2.66Å; T67-Y93 CarbonylContact O-C 3.53Å; T67-Y93 WeakPolarHBondContact O-CA 3.48Å; T67-Y93 WeakPolarHBondContact O-CB 3.2Å; T67-S94 PolarHBondContact N-O 3.26Å; T67-S94 PolarHBondContact O-N 3.26Å; T67-S94 PolarHBondContact OG1-O 3.45Å
68	P	65.9	Low	60.1	Low	52 Å²	52	69.3 Å²	69.3	34%	0.338	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	121.7	175.6	-13.8	22.5	0	0	0	109.1	A49 F92 Y93	A49-P68 WeakPolarHBondContact O-CD 3.45Å; A49-P68 WeakPolarHBondContact O-CG 3.33Å; P68-F92 WeakPolarHBondContact CA-O 3.4Å; P68-Y93 HydrophobicContact CB-CD1 4.29Å; P68-Y93 HydrophobicContact CB-CE1 4.03Å; P68-Y93 HydrophobicContact CG-CD1 4.09Å; P68-Y93 HydrophobicContact CG-CE1 3.65Å
69	D	54.4	Low	57.7	Low	54 Å²	54	74.2 Å²	74.2	29%	0.289	46%	0.456	S	S	.	.			trans	-123.2	116	173.1	-173.8	-10.9	0	0	0	105.2	T67 T71 F72 F92 S94	T67-D69 PolarHBondContact O-N 2.66Å; D69-T71 WeakPolarHBondContact OD1-CB 3.32Å; D69-T71 WeakPolarHBondContact OD1-CG2 3.28Å; D69-T71 PolarHBondContact OD1-N 2.93Å; D69-T71 PolarHBondContact OD1-OG1 3.29Å; D69-F72 WeakPolarHBondContact O-CE1 3.32Å; D69-F72 WeakPolarHBondContact O-CZ 3.35Å; D69-F92 PolarHBondContact N-O 3.4Å; D69-F92 WeakPolarHBondContact O-CB 3.06Å; D69-F92 VanDerWaalsContact O-O 3.04Å; D69-S94 PolarHBondContact OD2-OG 3.47Å
70	S	47.8	Very low	55.1	Low	63 Å²	63	66.9 Å²	66.9	44%	0.441	45%	0.45	S	S	.	.			trans	-116.5	13.9	-174.5	61.4	0	0	0	0	112.5	F72 R89	S70-F72 PolarHBondContact O-N 3.05Å; S70-F72 VanDerWaalsContact O-N 3.1Å; S70-R89 WeakPolarHBondContact CB-O 3.2Å
71	T	44.7	Very low	52.4	Low	123 Å²	123	67.4 Å²	67.4	76%	0.755	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-6	-169.6	55.3	0	0	0	0	115.3	D69	D69-T71 WeakPolarHBondContact OD1-CB 3.32Å; D69-T71 WeakPolarHBondContact OD1-CG2 3.28Å; D69-T71 PolarHBondContact OD1-N 2.93Å; D69-T71 PolarHBondContact OD1-OG1 3.29Å
72	F	38.1	Very low	49.7	Very low	89 Å²	89	67.9 Å²	67.9	39%	0.39	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	11.8	-176.1	48.3	-90.8	0	0	0	113.9	D69 S70 F92	D69-F72 WeakPolarHBondContact O-CE1 3.32Å; D69-F72 WeakPolarHBondContact O-CZ 3.35Å; S70-F72 PolarHBondContact O-N 3.05Å; S70-F72 VanDerWaalsContact O-N 3.1Å; F72-F92 HydrophobicContact CD2-CD1 4.49Å; F72-F92 HydrophobicContact CD2-CD2 4.34Å; F72-F92 HydrophobicContact CD2-CE2 4.41Å; F72-F92 HydrophobicContact CD2-CG 4.37Å; F72-F92 HydrophobicContact CE1-CB 3.73Å; F72-F92 HydrophobicContact CE1-CG 4.09Å; F72-F92 HydrophobicContact CE2-CB 3.81Å; F72-F92 AromaticContact CE2-CD1 3.73Å; F72-F92 HydrophobicContact CE2-CD1 3.73Å; F72-F92 AromaticContact CE2-CD2 3.12Å; F72-F92 HydrophobicContact CE2-CD2 3.12Å; F72-F92 HydrophobicContact CE2-CE1 4.03Å; F72-F92 AromaticContact CE2-CE2 3.47Å; F72-F92 HydrophobicContact CE2-CE2 3.47Å; F72-F92 VanDerWaalsContact CE2-CE2 3.47Å; F72-F92 AromaticContact CE2-CG 3.26Å; F72-F92 HydrophobicContact CE2-CG 3.26Å; F72-F92 AromaticContact CE2-CZ 3.9Å; F72-F92 HydrophobicContact CE2-CZ 3.9Å; F72-F92 HydrophobicContact CZ-CB 3.1Å; F72-F92 AromaticContact CZ-CD1 3.88Å; F72-F92 HydrophobicContact CZ-CD1 3.88Å; F72-F92 AromaticContact CZ-CD2 3.33Å; F72-F92 HydrophobicContact CZ-CD2 3.33Å; F72-F92 HydrophobicContact CZ-CE2 4.15Å; F72-F92 AromaticContact CZ-CG 3.15Å; F72-F92 HydrophobicContact CZ-CG 3.15Å
73	L	31.3	Very low	47	Very low	63 Å²	63	73.7 Å²	73.7	33%	0.33	52%	0.523	S	S	.	.			trans	-131.7	107.9	175.7	-66.3	174.9	0	0	0	114.5	L88 R89 F92	L73-L88 HydrophobicContact CD1-CB 3.75Å; L73-L88 WeakPolarHBondContact CD1-O 3.48Å; L73-R89 HydrophobicContact CB-CG 4.14Å; L73-R89 HydrophobicContact CD1-CG 4.42Å; L73-R89 PolarHBondContact O-NE 2.93Å; L73-R89 VanDerWaalsContact O-NE 3.14Å; L73-R89 PolarHBondContact O-NH2 3.27Å; L73-F92 HydrophobicContact CD1-CD2 4.42Å; L73-F92 HydrophobicContact CD1-CE2 3.77Å
74	A	30.8	Very low	44.5	Very low	65 Å²	65	73.8 Å²	73.8	54%	0.537	54%	0.539	S	S	.	.			trans	-96.2	141.9	169.3	0	0	0	0	0	113	Y452	A74-Y452 HydrophobicContact CB-CE1 3.92Å; A74-Y452 WeakPolarHBondContact CB-OH 3.11Å
75	A	30.4	Very low	42.3	Very low	62 Å²	62	77 Å²	77	51%	0.512	56%	0.562	S	S	.	*			trans	-84.9	147.9	-168.3	0	0	0	0	0	113.2	R89	A75-R89 VanDerWaalsContact CB-NH2 3.28Å
76	G	32.6	Very low	40.6	Very low	71 Å²	71	77.2 Å²	77.2	73%	0.732	57%	0.572	S	S	*	*			trans	-89.9	178.4	-173	0	0	0	0	0	116.4
77	G	26.5	Very low	39.3	Very low	84 Å²	84	83.5 Å²	83.5	87%	0.866	61%	0.605	S	S	*	*			trans	133.4	103.8	162.5	0	0	0	0	0	112
78	G	35.1	Very low	38.3	Very low	73 Å²	73	85.5 Å²	85.5	75%	0.753	61%	0.614	S	S	*	*			cis	107.3	156.1	13.6	0	0	0	0	0	111.2
79	S	33.8	Very low	37.6	Very low	130 Å²	130	87.6 Å²	87.6	91%	0.909	62%	0.615	S	S	*	*	S	Bend	trans	-165.8	119.8	137.2	-74.9	0	0	0	0	108.7
80	A	26.7	Very low	37.8	Very low	103 Å²	103	92.4 Å²	92.4	85%	0.851	64%	0.636	S	S	*	*	S	Bend	cis	-153.4	154.9	3.2	0	0	0	0	0	107.4
81	A	25.6	Very low	38.6	Very low	97 Å²	97	90.4 Å²	90.4	80%	0.802	62%	0.621	S	S	*	*			cis	-143.2	169.9	8.9	0	0	0	0	0	106.8
82	S	27.3	Very low	39.6	Very low	97 Å²	97	87.2 Å²	87.2	68%	0.678	60%	0.597	S	S	*	*			cis	-164	133.1	33.7	44.6	0	0	0	0	111.5	A84	S82-A84 VanDerWaalsContact C-N 3.35Å; S82-A84 PolarHBondContact O-N 3.2Å
83	S	30	Very low	41.4	Very low	122 Å²	122	84.7 Å²	84.7	85%	0.853	59%	0.585	S	S	*	*			trans	31.1	2	141.4	61.2	0	0	0	0	126.1
84	A	33.8	Very low	43.3	Very low	78 Å²	78	82.7 Å²	82.7	65%	0.645	58%	0.577	S	S	*	*			trans	-91.5	-4.6	-170.6	0	0	0	0	0	116.9	S82 S86	S82-A84 VanDerWaalsContact C-N 3.35Å; S82-A84 PolarHBondContact O-N 3.2Å; A84-S86 PolarHBondContact O-N 2.76Å
85	S	42.2	Very low	45.7	Very low	67 Å²	67	80.5 Å²	80.5	47%	0.469	56%	0.56	S	S	.	*	S	Bend	trans	-90.8	6.6	-163	86.8	0	0	0	0	117.1
86	S	45.3	Very low	48	Very low	81 Å²	81	79.9 Å²	79.9	57%	0.566	55%	0.548	S	S	*	.	S	Bend	trans	-89.1	-35.5	-178.7	58	0	0	0	0	114.1	A84	A84-S86 PolarHBondContact O-N 2.76Å
87	D	49.7	Very low	50.4	Low	133 Å²	133	76.5 Å²	76.5	71%	0.711	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-81.1	-22.1	-168.3	-72.3	-4.7	0	0	0	114.7	R89	D87-R89 PolarHBondContact O-N 2.99Å
88	L	53.1	Low	53	Low	88 Å²	88	74.8 Å²	74.8	46%	0.461	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-72.4	-14.8	-177.8	-68	169	0	0	0	113.8	L73 E90 F92 C110	L73-L88 HydrophobicContact CD1-CB 3.75Å; L73-L88 WeakPolarHBondContact CD1-O 3.48Å; L88-E90 PolarHBondContact O-N 3.4Å; L88-F92 WeakPolarHBondContact O-CD2 3.45Å; L88-F92 VanDerWaalsContact O-CE2 3.23Å; L88-F92 WeakPolarHBondContact O-CE2 3.39Å; L88-C110 WeakPolarHBondContact CD2-SG 3.43Å
89	R	50.7	Low	54.8	Low	97 Å²	97	74.5 Å²	74.5	37%	0.366	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-74.2	-22.9	-173.9	-75.9	174.9	161.6	-169.1	-11.2	113.8	S70 L73 A75 D87	S70-R89 WeakPolarHBondContact CB-O 3.2Å; L73-R89 HydrophobicContact CB-CG 4.14Å; L73-R89 HydrophobicContact CD1-CG 4.42Å; L73-R89 PolarHBondContact O-NE 2.93Å; L73-R89 VanDerWaalsContact O-NE 3.14Å; L73-R89 PolarHBondContact O-NH2 3.27Å; A75-R89 VanDerWaalsContact CB-NH2 3.28Å; D87-R89 PolarHBondContact O-N 2.99Å
90	E	57.6	Low	56.3	Low	155 Å²	155	70.3 Å²	70.3	72%	0.724	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-95.9	4.8	-176.2	-60.3	-168.4	165.2	0	0	113.7	L88 Y93	L88-E90 PolarHBondContact O-N 3.4Å; E90-Y93 VanDerWaalsContact O-CE2 3.27Å; E90-Y93 WeakPolarHBondContact O-CE2 3.43Å; E90-Y93 PolarHBondContact O-OH 2.77Å
91	C	65.6	Low	58.1	Low	20 Å²	20	71 Å²	71	14%	0.135	44%	0.438	C	S	.	.	S	Bend	trans	-96	-14.5	-168.2	-70.3	0	0	0	0	116.7	Y93 L109 C110	C91-Y93 VanDerWaalsContact O-CD2 3.31Å; C91-Y93 WeakPolarHBondContact O-CD2 3.44Å; C91-Y93 WeakPolarHBondContact O-CE2 3.44Å; C91-L109 PolarHBondContact O-N 3.01Å; C91-C110 HydrophobicContact CB-CB 3.51Å; C91-C110 WeakPolarHBondContact CB-SG 3.39Å; C91-C110 WeakPolarHBondContact SG-CA 3.26Å; C91-C110 WeakPolarHBondContact SG-CB 3.07Å; C91-C110 CovalentContact SG-SG 2.02Å; C91-C110 PolarHBondContact SG-SG 3.05Å
92	F	65.6	Low	59.6	Low	57 Å²	57	73.6 Å²	73.6	25%	0.25	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.1	-169.3	-62.5	-97.3	0	0	0	109.3	P68 D69 F72 L73 L88	P68-F92 WeakPolarHBondContact CA-O 3.4Å; D69-F92 PolarHBondContact N-O 3.4Å; D69-F92 WeakPolarHBondContact O-CB 3.06Å; D69-F92 VanDerWaalsContact O-O 3.04Å; F72-F92 HydrophobicContact CD2-CD1 4.49Å; F72-F92 HydrophobicContact CD2-CD2 4.34Å; F72-F92 HydrophobicContact CD2-CE2 4.41Å; F72-F92 HydrophobicContact CD2-CG 4.37Å; F72-F92 HydrophobicContact CE1-CB 3.73Å; F72-F92 HydrophobicContact CE1-CG 4.09Å; F72-F92 HydrophobicContact CE2-CB 3.81Å; F72-F92 AromaticContact CE2-CD1 3.73Å; F72-F92 HydrophobicContact CE2-CD1 3.73Å; F72-F92 AromaticContact CE2-CD2 3.12Å; F72-F92 HydrophobicContact CE2-CD2 3.12Å; F72-F92 HydrophobicContact CE2-CE1 4.03Å; F72-F92 AromaticContact CE2-CE2 3.47Å; F72-F92 HydrophobicContact CE2-CE2 3.47Å; F72-F92 VanDerWaalsContact CE2-CE2 3.47Å; F72-F92 AromaticContact CE2-CG 3.26Å; F72-F92 HydrophobicContact CE2-CG 3.26Å; F72-F92 AromaticContact CE2-CZ 3.9Å; F72-F92 HydrophobicContact CE2-CZ 3.9Å; F72-F92 HydrophobicContact CZ-CB 3.1Å; F72-F92 AromaticContact CZ-CD1 3.88Å; F72-F92 HydrophobicContact CZ-CD1 3.88Å; F72-F92 AromaticContact CZ-CD2 3.33Å; F72-F92 HydrophobicContact CZ-CD2 3.33Å; F72-F92 HydrophobicContact CZ-CE2 4.15Å; F72-F92 AromaticContact CZ-CG 3.15Å; F72-F92 HydrophobicContact CZ-CG 3.15Å; L73-F92 HydrophobicContact CD1-CD2 4.42Å; L73-F92 HydrophobicContact CD1-CE2 3.77Å; L88-F92 WeakPolarHBondContact O-CD2 3.45Å; L88-F92 VanDerWaalsContact O-CE2 3.23Å; L88-F92 WeakPolarHBondContact O-CE2 3.39Å
93	Y	75.3	Confident	61.3	Low	36 Å²	36	69.4 Å²	69.4	14%	0.141	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.3	-174	-56.4	-113.7	0	0	0	110.6	V51 L66 T67 P68 E90 C91 V107 L109	V51-Y93 HydrophobicContact CB-CD1 4.05Å; V51-Y93 HydrophobicContact CB-CE1 3.86Å; V51-Y93 HydrophobicContact CG2-CD1 4.11Å; V51-Y93 HydrophobicContact CG2-CE1 3.4Å; V51-Y93 VanDerWaalsContact CG2-CE1 3.4Å; L66-Y93 HydrophobicContact CB-CD1 4.16Å; L66-Y93 HydrophobicContact CB-CG 4.22Å; T67-Y93 CarbonylContact O-C 3.53Å; T67-Y93 WeakPolarHBondContact O-CA 3.48Å; T67-Y93 WeakPolarHBondContact O-CB 3.2Å; P68-Y93 HydrophobicContact CB-CD1 4.29Å; P68-Y93 HydrophobicContact CB-CE1 4.03Å; P68-Y93 HydrophobicContact CG-CD1 4.09Å; P68-Y93 HydrophobicContact CG-CE1 3.65Å; E90-Y93 VanDerWaalsContact O-CE2 3.27Å; E90-Y93 WeakPolarHBondContact O-CE2 3.43Å; E90-Y93 PolarHBondContact O-OH 2.77Å; C91-Y93 VanDerWaalsContact O-CD2 3.31Å; C91-Y93 WeakPolarHBondContact O-CD2 3.44Å; C91-Y93 WeakPolarHBondContact O-CE2 3.44Å; Y93-V107 PolarHBondContact N-O 3.15Å; Y93-V107 PolarHBondContact O-N 2.8Å; Y93-L109 HydrophobicContact CD2-CB 4.31Å; Y93-L109 HydrophobicContact CD2-CD1 3.46Å; Y93-L109 VanDerWaalsContact CD2-CD1 3.46Å; Y93-L109 HydrophobicContact CD2-CG 3.71Å; Y93-L109 HydrophobicContact CE1-CD1 4.48Å; Y93-L109 HydrophobicContact CE2-CB 4.17Å; Y93-L109 HydrophobicContact CE2-CD1 3.44Å; Y93-L109 VanDerWaalsContact CE2-CD1 3.44Å; Y93-L109 HydrophobicContact CE2-CG 3.95Å; Y93-L109 HydrophobicContact CG-CD1 4.1Å
94	S	71.9	Confident	63.1	Low	21 Å²	21	69 Å²	69	15%	0.147	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.3	173.9	58.9	0	0	0	0	110.5	T67 D69 V105	T67-S94 PolarHBondContact N-O 3.26Å; T67-S94 PolarHBondContact O-N 3.26Å; T67-S94 PolarHBondContact OG1-O 3.45Å; D69-S94 PolarHBondContact OD2-OG 3.47Å; S94-V105 CarbonylContact C-O 3.55Å; S94-V105 VanDerWaalsContact CA-O 3.24Å; S94-V105 WeakPolarHBondContact CA-O 3.39Å
95	G	80.8	Confident	65.2	Low	19 Å²	19	65.3 Å²	65.3	20%	0.196	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-140.4	171.2	0	0	0	0	0	111.7	H65 V105	H65-G95 VanDerWaalsContact O-CA 3.26Å; H65-G95 WeakPolarHBondContact O-CA 3.35Å; G95-V105 PolarHBondContact N-O 3.46Å; G95-V105 WeakPolarHBondContact O-CG1 3.23Å; G95-V105 PolarHBondContact O-N 3.44Å
96	D	78.9	Confident	66.7	Low	49 Å²	49	64 Å²	64	26%	0.262	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	164.1	-171.4	59.4	-92.6	0	0	0	112.5	H65 A99 V105	H65-D96 IonicContact CE1-OD2 3.96Å; H65-D96 IonicContact CG-OD2 3.62Å; H65-D96 PolarHBondContact N-O 3.42Å; H65-D96 IonicContact ND1-OD2 2.87Å; H65-D96 PolarHBondContact ND1-OD2 2.82Å; H65-D96 PolarHBondContact O-N 3.33Å; D96-A99 WeakPolarHBondContact OD2-CA 2.96Å; D96-A99 PolarHBondContact OD2-N 3.25Å; D96-V105 WeakPolarHBondContact O-CG1 3.45Å
97	V	82.3	Confident	68.1	Low	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.3	177.4	-173.5	0	0	0	0	109.5	F62 Y63 L64 A99 D100 S103 V105 F117 Y119	F62-V97 HydrophobicContact CB-CG1 4.02Å; F62-V97 HydrophobicContact CD1-CG1 4.06Å; Y63-V97 CarbonylContact O-C 3.53Å; Y63-V97 WeakPolarHBondContact O-CA 2.92Å; L64-V97 HydrophobicContact CD2-CB 4.33Å; L64-V97 HydrophobicContact CD2-CG1 4.03Å; L64-V97 HydrophobicContact CD2-CG2 3.59Å; V97-A99 PolarHBondContact O-N 3.07Å; V97-D100 WeakPolarHBondContact O-CB 3.27Å; V97-D100 PolarHBondContact O-N 3.34Å; V97-S103 PolarHBondContact N-OG 2.94Å; V97-S103 PolarHBondContact O-OG 3.48Å; V97-S103 VanDerWaalsContact O-OG 3.05Å; V97-V105 HydrophobicContact CG2-CB 3.75Å; V97-V105 HydrophobicContact CG2-CG1 3.98Å; V97-F117 HydrophobicContact CB-CD2 4.38Å; V97-F117 HydrophobicContact CG1-CD2 4.12Å; V97-F117 HydrophobicContact CG1-CE2 4.21Å; V97-F117 HydrophobicContact CG2-CB 3.67Å; V97-F117 HydrophobicContact CG2-CD2 3.66Å; V97-F117 HydrophobicContact CG2-CG 3.85Å; V97-Y119 HydrophobicContact CB-CD2 4.36Å; V97-Y119 HydrophobicContact CG1-CD2 4.28Å; V97-Y119 HydrophobicContact CG1-CG 4.42Å
98	N	82.3	Confident	69.4	Low	47 Å²	47	55.4 Å²	55.4	25%	0.251	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	26.3	-178.8	-62.1	-18.4	0	0	0	114.2	E61 Y63 D100 Y119	E61-N98 PolarHBondContact O-ND2 3.24Å; Y63-N98 WeakPolarHBondContact CB-OD1 3.38Å; Y63-N98 WeakPolarHBondContact CD2-OD1 3.42Å; Y63-N98 PolarHBondContact N-OD1 2.99Å; Y63-N98 PolarHBondContact O-N 3.48Å; N98-D100 PolarHBondContact O-N 3.46Å; N98-Y119 HydrophobicContact CB-CE2 4.09Å; N98-Y119 PolarHBondContact ND2-OH 2.86Å
99	A	71.6	Confident	70.2	Confident	68 Å²	68	53.1 Å²	53.1	56%	0.562	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	21.2	-172.9	0	0	0	0	0	114.6	D96 V97 P101	D96-A99 WeakPolarHBondContact OD2-CA 2.96Å; D96-A99 PolarHBondContact OD2-N 3.25Å; V97-A99 PolarHBondContact O-N 3.07Å; A99-P101 WeakPolarHBondContact O-CD 3.35Å
100	D	67	Low	70.9	Confident	42 Å²	42	50.5 Å²	50.5	23%	0.225	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114.9	174.1	-174.4	-10.1	0	0	0	109.8	V97 N98 D102 S103 Y119	V97-D100 WeakPolarHBondContact O-CB 3.27Å; V97-D100 PolarHBondContact O-N 3.34Å; N98-D100 PolarHBondContact O-N 3.46Å; D100-D102 PolarHBondContact O-N 2.75Å; D100-D102 PolarHBondContact OD1-N 3.34Å; D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 2.96Å; D100-S103 VanDerWaalsContact O-N 3.09Å; D100-S103 PolarHBondContact O-OG 2.87Å; D100-Y119 HydrophobicContact CB-CD2 4.37Å; D100-Y119 HydrophobicContact CB-CE2 4.05Å
101	P	63.6	Low	71.1	Confident	116 Å²	116	49.2 Å²	49.2	75%	0.753	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	-17.8	-175.2	28.1	-34.5	0	0	0	114.1	A99 S103	A99-P101 WeakPolarHBondContact O-CD 3.35Å; P101-S103 VanDerWaalsContact C-N 3.29Å
102	D	56.9	Low	71.1	Confident	153 Å²	153	48.7 Å²	48.7	82%	0.818	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	0.3	175.3	-65.7	-37.2	0	0	0	112	D100	D100-D102 PolarHBondContact O-N 2.75Å; D100-D102 PolarHBondContact OD1-N 3.34Å
103	S	63.8	Low	71.5	Confident	8 Å²	8	46 Å²	46	6%	0.056	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	149.9	173	81.4	0	0	0	0	110.4	V97 D100 P101 T118	V97-S103 PolarHBondContact N-OG 2.94Å; V97-S103 PolarHBondContact O-OG 3.48Å; V97-S103 VanDerWaalsContact O-OG 3.05Å; D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 2.96Å; D100-S103 VanDerWaalsContact O-N 3.09Å; D100-S103 PolarHBondContact O-OG 2.87Å; P101-S103 VanDerWaalsContact C-N 3.29Å; S103-T118 VanDerWaalsContact CA-O 3.24Å; S103-T118 WeakPolarHBondContact CA-O 3.29Å; S103-T118 WeakPolarHBondContact CB-O 3.39Å
104	F	66.6	Low	71.3	Confident	115 Å²	115	50 Å²	50	50%	0.504	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135.5	179.3	178.7	-102.1	0	0	0	109.2	A106 F117 T118	F104-A106 HydrophobicContact CE1-CB 3.59Å; F104-A106 HydrophobicContact CZ-CB 3.88Å; F104-F117 CarbonylContact O-C 3.59Å; F104-F117 WeakPolarHBondContact O-CA 3.41Å; F104-F117 VanDerWaalsContact O-CB 3.22Å; F104-F117 WeakPolarHBondContact O-CB 3.28Å; F104-T118 PolarHBondContact N-O 2.91Å; F104-T118 PolarHBondContact N-OG1 2.95Å; F104-T118 PolarHBondContact O-N 2.92Å
105	V	77.6	Confident	71.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.8	171.5	53.4	0	0	0	0	109.9	L64 L66 S94 G95 D96 V97 V107 F117	L64-V105 HydrophobicContact CB-CG1 4.4Å; L64-V105 HydrophobicContact CB-CG2 4.38Å; L64-V105 HydrophobicContact CD1-CG2 3.96Å; L64-V105 HydrophobicContact CD2-CB 4.17Å; L64-V105 HydrophobicContact CD2-CG1 4.39Å; L64-V105 HydrophobicContact CD2-CG2 3.9Å; L64-V105 HydrophobicContact CG-CG2 4.29Å; L66-V105 HydrophobicContact CD2-CB 4.29Å; L66-V105 HydrophobicContact CD2-CG1 3.48Å; L66-V105 VanDerWaalsContact CD2-CG1 3.48Å; L66-V105 HydrophobicContact CD2-CG2 3.79Å; S94-V105 CarbonylContact C-O 3.55Å; S94-V105 VanDerWaalsContact CA-O 3.24Å; S94-V105 WeakPolarHBondContact CA-O 3.39Å; G95-V105 PolarHBondContact N-O 3.46Å; G95-V105 WeakPolarHBondContact O-CG1 3.23Å; G95-V105 PolarHBondContact O-N 3.44Å; D96-V105 WeakPolarHBondContact O-CG1 3.45Å; V97-V105 HydrophobicContact CG2-CB 3.75Å; V97-V105 HydrophobicContact CG2-CG1 3.98Å; V105-V107 HydrophobicContact CG2-CG1 3.68Å; V105-V107 HydrophobicContact CG2-CG2 4.25Å; V105-F117 HydrophobicContact CB-CB 3.6Å; V105-F117 HydrophobicContact CG2-CB 3.89Å
106	A	75.6	Confident	71.1	Confident	40 Å²	40	50.4 Å²	50.4	33%	0.331	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.1	168.9	0	0	0	0	0	109	F104 G115 G116	F104-A106 HydrophobicContact CE1-CB 3.59Å; F104-A106 HydrophobicContact CZ-CB 3.88Å; A106-G115 CarbonylContact O-C 3.59Å; A106-G115 VanDerWaalsContact O-CA 3.27Å; A106-G115 WeakPolarHBondContact O-CA 3.4Å; A106-G116 PolarHBondContact N-O 2.84Å; A106-G116 PolarHBondContact O-N 2.88Å
107	V	73.1	Confident	71.4	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	143.9	-174.7	-67	0	0	0	0	111.4	L64 L66 Y93 V105 L113 R114 I126	L64-V107 HydrophobicContact CD1-CG1 4.48Å; L66-V107 HydrophobicContact CD1-CG2 3.33Å; L66-V107 HydrophobicContact CD2-CG2 3.65Å; L66-V107 HydrophobicContact CG-CG2 4.13Å; Y93-V107 PolarHBondContact N-O 3.15Å; Y93-V107 PolarHBondContact O-N 2.8Å; V105-V107 HydrophobicContact CG2-CG1 3.68Å; V105-V107 HydrophobicContact CG2-CG2 4.25Å; V107-L113 HydrophobicContact CB-CD1 3.84Å; V107-L113 HydrophobicContact CG1-CD1 4.14Å; V107-L113 HydrophobicContact CG2-CD1 3.73Å; V107-R114 CarbonylContact C-O 3.59Å; V107-R114 VanDerWaalsContact CA-O 3.28Å; V107-R114 WeakPolarHBondContact CA-O 3.26Å; V107-I126 HydrophobicContact CG1-CD1 4.22Å
108	S	77.9	Confident	71.1	Confident	26 Å²	26	50.8 Å²	50.8	18%	0.182	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	141.8	169.8	-173.9	0	0	0	0	109.5	L113 R114	S108-L113 WeakPolarHBondContact O-CA 3.4Å; S108-R114 PolarHBondContact N-O 3.06Å; S108-R114 PolarHBondContact O-N 3.29Å; S108-R114 VanDerWaalsContact O-N 3.1Å
109	L	69.6	Low	71	Confident	40 Å²	40	50.1 Å²	50.1	21%	0.209	29%	0.289	C	S	.	.			trans	-116.2	3.4	177.5	-56	-178	0	0	0	113.1	V51 F53 C91 Y93 E111 L113	V51-L109 HydrophobicContact CG1-CD1 3.99Å; F53-L109 HydrophobicContact CD2-CD2 4.29Å; F53-L109 HydrophobicContact CE2-CD1 3.57Å; F53-L109 HydrophobicContact CE2-CD2 3.42Å; F53-L109 VanDerWaalsContact CE2-CD2 3.42Å; F53-L109 HydrophobicContact CE2-CG 4.16Å; F53-L109 HydrophobicContact CZ-CD1 3.99Å; F53-L109 HydrophobicContact CZ-CD2 3.73Å; C91-L109 PolarHBondContact O-N 3.01Å; Y93-L109 HydrophobicContact CD2-CB 4.31Å; Y93-L109 HydrophobicContact CD2-CD1 3.46Å; Y93-L109 VanDerWaalsContact CD2-CD1 3.46Å; Y93-L109 HydrophobicContact CD2-CG 3.71Å; Y93-L109 HydrophobicContact CE1-CD1 4.48Å; Y93-L109 HydrophobicContact CE2-CB 4.17Å; Y93-L109 HydrophobicContact CE2-CD1 3.44Å; Y93-L109 VanDerWaalsContact CE2-CD1 3.44Å; Y93-L109 HydrophobicContact CE2-CG 3.95Å; Y93-L109 HydrophobicContact CG-CD1 4.1Å; L109-E111 VanDerWaalsContact C-N 3.33Å; L109-E111 PolarHBondContact O-N 3.19Å; L109-L113 HydrophobicContact CD2-CB 4.32Å; L109-L113 HydrophobicContact CD2-CD1 3.32Å; L109-L113 HydrophobicContact CD2-CG 4.42Å
110	C	65.4	Low	71.1	Confident	43 Å²	43	54.4 Å²	54.4	29%	0.291	30%	0.295	S	S	.	.	S	Bend	trans	-58.4	-39.8	-174.9	-106.5	0	0	0	0	113.7	L88 C91	L88-C110 WeakPolarHBondContact CD2-SG 3.43Å; C91-C110 HydrophobicContact CB-CB 3.51Å; C91-C110 WeakPolarHBondContact CB-SG 3.39Å; C91-C110 WeakPolarHBondContact SG-CA 3.26Å; C91-C110 WeakPolarHBondContact SG-CB 3.07Å; C91-C110 CovalentContact SG-SG 2.02Å; C91-C110 PolarHBondContact SG-SG 3.05Å
111	E	62.5	Low	71	Confident	128 Å²	128	54.8 Å²	54.8	60%	0.598	31%	0.308	S	S	*	.	S	Bend	trans	-128	-27.3	178.9	-65.8	-179.7	172.8	0	0	112.3	L109 F140	L109-E111 VanDerWaalsContact C-N 3.33Å; L109-E111 PolarHBondContact O-N 3.19Å; E111-F140 WeakPolarHBondContact O-CD1 2.94Å; E111-F140 WeakPolarHBondContact O-CE1 3.34Å; E111-F140 WeakPolarHBondContact O-CG 3.48Å
112	S	65.2	Low	71.3	Confident	9 Å²	9	51 Å²	51	6%	0.063	28%	0.282	C	S	.	.	S	Bend	trans	-174.6	159.5	174.9	54	0	0	0	0	108.6	R114 A128	S112-R114 PolarHBondContact O-N 2.82Å; S112-R114 PolarHBondContact OG-NE 2.87Å; S112-R114 VanDerWaalsContact OG-NE 3.08Å; S112-A128 WeakPolarHBondContact OG-CB 3.27Å
113	L	73.9	Confident	72	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.254	C	S	.	.			trans	-63.2	96	178	-173.9	74.6	0	0	0	111.2	P30 F53 L55 L64 V107 S108 L109 I126 H145	P30-L113 HydrophobicContact CB-CD2 3.64Å; P30-L113 HydrophobicContact CG-CB 4.11Å; P30-L113 HydrophobicContact CG-CD2 3.74Å; F53-L113 HydrophobicContact CB-CD2 4.32Å; F53-L113 HydrophobicContact CD2-CD1 3.86Å; F53-L113 HydrophobicContact CE2-CD1 4.11Å; F53-L113 HydrophobicContact CG-CD1 4.23Å; F53-L113 HydrophobicContact CG-CD2 4.24Å; L55-L113 HydrophobicContact CD1-CD2 4.17Å; L55-L113 HydrophobicContact CD2-CD2 3.71Å; L55-L113 HydrophobicContact CG-CD2 4.3Å; L64-L113 HydrophobicContact CD1-CD2 4.28Å; V107-L113 HydrophobicContact CB-CD1 3.84Å; V107-L113 HydrophobicContact CG1-CD1 4.14Å; V107-L113 HydrophobicContact CG2-CD1 3.73Å; S108-L113 WeakPolarHBondContact O-CA 3.4Å; L109-L113 HydrophobicContact CD2-CB 4.32Å; L109-L113 HydrophobicContact CD2-CD1 3.32Å; L109-L113 HydrophobicContact CD2-CG 4.42Å; L113-I126 WeakPolarHBondContact O-CG2 3.29Å; L113-H145 PolarHBondContact N-NE2 2.83Å; L113-H145 PolarHBondContact O-CD2 2.91Å; L113-H145 PolarHBondContact O-NE2 3.14Å
114	R	71.3	Confident	72.8	Confident	118 Å²	118	46.1 Å²	46.1	45%	0.445	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.5	-178.6	-70.3	-179.5	-178	174.3	-0.9	110.6	V107 S108 S112 A128	V107-R114 CarbonylContact C-O 3.59Å; V107-R114 VanDerWaalsContact CA-O 3.28Å; V107-R114 WeakPolarHBondContact CA-O 3.26Å; S108-R114 PolarHBondContact N-O 3.06Å; S108-R114 PolarHBondContact O-N 3.29Å; S108-R114 VanDerWaalsContact O-N 3.1Å; S112-R114 PolarHBondContact O-N 2.82Å; S112-R114 PolarHBondContact OG-NE 2.87Å; S112-R114 VanDerWaalsContact OG-NE 3.08Å; R114-A128 HydrophobicContact CG-CB 4.29Å
115	G	75.4	Confident	73.5	Confident	30 Å²	30	44.3 Å²	44.3	31%	0.309	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	155.4	-152	-177.3	0	0	0	0	0	111.4	A106 I126	A106-G115 CarbonylContact O-C 3.59Å; A106-G115 VanDerWaalsContact O-CA 3.27Å; A106-G115 WeakPolarHBondContact O-CA 3.4Å; G115-I126 PolarHBondContact N-O 2.01Å; G115-I126 WeakPolarHBondContact O-CA 3.37Å; G115-I126 PolarHBondContact O-N 3.11Å; G115-I126 VanDerWaalsContact O-O 3.09Å
116	G	72.9	Confident	73.6	Confident	20 Å²	20	44.4 Å²	44.4	21%	0.206	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.8	-179.2	0	0	0	0	0	111.4	A106 Y124	A106-G116 PolarHBondContact N-O 2.84Å; A106-G116 PolarHBondContact O-N 2.88Å; G116-Y124 CarbonylContact C-O 3.52Å; G116-Y124 WeakPolarHBondContact CA-O 3.18Å
117	F	85.4	Confident	73.5	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.013	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.7	174.9	68	-90.7	0	0	0	112.3	L55 F62 L64 V97 F104 V105 Y124 I126	L55-F117 HydrophobicContact CD1-CE1 4.17Å; F62-F117 HydrophobicContact CB-CE2 4.28Å; F62-F117 HydrophobicContact CB-CZ 4.01Å; F62-F117 AromaticContact CD1-CE2 3.43Å; F62-F117 HydrophobicContact CD1-CE2 3.43Å; F62-F117 VanDerWaalsContact CD1-CE2 3.43Å; F62-F117 AromaticContact CD1-CZ 3.71Å; F62-F117 HydrophobicContact CD1-CZ 3.71Å; F62-F117 HydrophobicContact CD2-CE2 4.39Å; F62-F117 AromaticContact CD2-CZ 3.81Å; F62-F117 HydrophobicContact CD2-CZ 3.81Å; F62-F117 AromaticContact CE1-CE2 3.75Å; F62-F117 HydrophobicContact CE1-CE2 3.75Å; F62-F117 HydrophobicContact CE1-CZ 4.08Å; F62-F117 HydrophobicContact CE2-CZ 4.18Å; F62-F117 AromaticContact CG-CE2 3.78Å; F62-F117 HydrophobicContact CG-CE2 3.78Å; F62-F117 AromaticContact CG-CZ 3.55Å; F62-F117 HydrophobicContact CG-CZ 3.55Å; F62-F117 HydrophobicContact CZ-CE2 4.37Å; F62-F117 HydrophobicContact CZ-CZ 4.31Å; L64-F117 HydrophobicContact CD2-CD1 4.08Å; L64-F117 HydrophobicContact CD2-CE1 4.39Å; L64-F117 HydrophobicContact CD2-CG 4.21Å; V97-F117 HydrophobicContact CB-CD2 4.38Å; V97-F117 HydrophobicContact CG1-CD2 4.12Å; V97-F117 HydrophobicContact CG1-CE2 4.21Å; V97-F117 HydrophobicContact CG2-CB 3.67Å; V97-F117 HydrophobicContact CG2-CD2 3.66Å; V97-F117 HydrophobicContact CG2-CG 3.85Å; F104-F117 CarbonylContact O-C 3.59Å; F104-F117 WeakPolarHBondContact O-CA 3.41Å; F104-F117 VanDerWaalsContact O-CB 3.22Å; F104-F117 WeakPolarHBondContact O-CB 3.28Å; V105-F117 HydrophobicContact CB-CB 3.6Å; V105-F117 HydrophobicContact CG2-CB 3.89Å; F117-Y124 AromaticContact CD2-CD2 3.86Å; F117-Y124 HydrophobicContact CD2-CD2 3.86Å; F117-Y124 HydrophobicContact CD2-CG 4.18Å; F117-Y124 HydrophobicContact CE1-CG 4.35Å; F117-Y124 HydrophobicContact CE2-CD1 4.3Å; F117-Y124 AromaticContact CE2-CD2 3.48Å; F117-Y124 HydrophobicContact CE2-CD2 3.48Å; F117-Y124 VanDerWaalsContact CE2-CD2 3.48Å; F117-Y124 HydrophobicContact CE2-CE2 4.12Å; F117-Y124 AromaticContact CE2-CG 3.6Å; F117-Y124 HydrophobicContact CE2-CG 3.6Å; F117-Y124 HydrophobicContact CZ-CD1 4.14Å; F117-Y124 HydrophobicContact CZ-CD2 4.09Å; F117-Y124 AromaticContact CZ-CG 3.7Å; F117-Y124 HydrophobicContact CZ-CG 3.7Å; F117-Y124 PolarHBondContact N-O 3.15Å; F117-Y124 WeakPolarHBondContact O-CA 3.09Å; F117-Y124 WeakPolarHBondContact O-CB 3.25Å; F117-Y124 PolarHBondContact O-N 2.98Å; F117-I126 HydrophobicContact CD1-CD1 3.77Å; F117-I126 HydrophobicContact CD1-CG1 4.19Å; F117-I126 HydrophobicContact CE1-CD1 3.81Å; F117-I126 HydrophobicContact CE1-CG1 4.04Å
118	T	75.3	Confident	73.1	Confident	53 Å²	53	46.6 Å²	46.6	33%	0.325	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.2	176.9	56.6	0	0	0	0	109.1	S103 F104 M122 E123	S103-T118 VanDerWaalsContact CA-O 3.24Å; S103-T118 WeakPolarHBondContact CA-O 3.29Å; S103-T118 WeakPolarHBondContact CB-O 3.39Å; F104-T118 PolarHBondContact N-O 2.91Å; F104-T118 PolarHBondContact N-OG1 2.95Å; F104-T118 PolarHBondContact O-N 2.92Å; T118-M122 WeakPolarHBondContact CA-O 3.22Å; T118-E123 HydrophobicContact CG2-CB 4.41Å; T118-E123 HydrophobicContact CG2-CG 3.98Å
119	Y	79.7	Confident	72.1	Confident	33 Å²	33	47.8 Å²	47.8	13%	0.129	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	128.5	179.3	-178.9	-110.3	0	0	0	110.3	F62 V97 N98 D100 G121 M122	F62-Y119 HydrophobicContact CD1-CD1 4.17Å; F62-Y119 AromaticContact CE1-CD1 3.8Å; F62-Y119 HydrophobicContact CE1-CD1 3.8Å; F62-Y119 HydrophobicContact CE1-CE1 4.39Å; V97-Y119 HydrophobicContact CB-CD2 4.36Å; V97-Y119 HydrophobicContact CG1-CD2 4.28Å; V97-Y119 HydrophobicContact CG1-CG 4.42Å; N98-Y119 HydrophobicContact CB-CE2 4.09Å; N98-Y119 PolarHBondContact ND2-OH 2.86Å; D100-Y119 HydrophobicContact CB-CD2 4.37Å; D100-Y119 HydrophobicContact CB-CE2 4.05Å; Y119-G121 VanDerWaalsContact C-N 3.35Å; Y119-G121 PolarHBondContact O-N 2.86Å; Y119-M122 PolarHBondContact N-O 3.27Å; Y119-M122 PolarHBondContact O-N 2.84Å; Y119-M122 VanDerWaalsContact O-N 3.13Å
120	K	75.2	Confident	71.4	Confident	158 Å²	158	50.8 Å²	50.8	69%	0.687	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	46.9	-179.8	-64.2	-173	174.3	-178.8	0	114.9	M122	K120-M122 VanDerWaalsContact C-N 3.27Å; K120-M122 PolarHBondContact O-N 3.26Å
121	G	63.5	Low	70.6	Confident	50 Å²	50	57 Å²	57	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	10.1	175.9	0	0	0	0	0	115	Y119 S152	Y119-G121 VanDerWaalsContact C-N 3.35Å; Y119-G121 PolarHBondContact O-N 2.86Å; G121-S152 WeakPolarHBondContact O-CB 3.49Å; G121-S152 PolarHBondContact O-N 2.86Å
122	M	69.6	Low	69.6	Low	38 Å²	38	56.5 Å²	56.5	19%	0.187	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.7	173.2	-62.8	-68.6	-70.8	0	0	109.6	T118 Y119 K120 Y124 R149 R150 M151	T118-M122 WeakPolarHBondContact CA-O 3.22Å; Y119-M122 PolarHBondContact N-O 3.27Å; Y119-M122 PolarHBondContact O-N 2.84Å; Y119-M122 VanDerWaalsContact O-N 3.13Å; K120-M122 VanDerWaalsContact C-N 3.27Å; K120-M122 PolarHBondContact O-N 3.26Å; M122-Y124 HydrophobicContact CB-CD2 4.28Å; M122-Y124 HydrophobicContact CB-CE2 3.48Å; M122-Y124 VanDerWaalsContact CB-CE2 3.48Å; M122-R149 HydrophobicContact CE-CB 4.27Å; M122-R149 HydrophobicContact CE-CG 3.91Å; M122-R150 WeakPolarHBondContact CA-O 3.25Å; M122-M151 HydrophobicContact CE-CG 4.18Å; M122-M151 WeakPolarHBondContact SD-CA 3.19Å; M122-M151 HydrophobicContact SD-CB 3.96Å; M122-M151 HydrophobicContact SD-CG 3.27Å; M122-M151 WeakPolarHBondContact SD-CG 3.49Å
123	E	73.4	Confident	68.5	Low	51 Å²	51	62.7 Å²	62.7	24%	0.238	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128	172.9	-58.1	-175.9	157	0	0	109.3	T118 F125 R149 R150	T118-E123 HydrophobicContact CG2-CB 4.41Å; T118-E123 HydrophobicContact CG2-CG 3.98Å; E123-F125 HydrophobicContact CB-CE2 4.03Å; E123-F125 HydrophobicContact CB-CZ 4.18Å; E123-R149 WeakPolarHBondContact O-CA 3.42Å; E123-R150 HydrophobicContact CB-CG 4.24Å; E123-R150 PolarHBondContact N-O 2.67Å; E123-R150 PolarHBondContact O-N 2.85Å; E123-R150 VanDerWaalsContact O-N 3.09Å; E123-R150 IonicContact OE2-CZ 3.72Å; E123-R150 IonicContact OE2-NE 3.71Å; E123-R150 PolarHBondContact OE2-NE 3.09Å; E123-R150 IonicContact OE2-NH2 3.67Å; E123-R150 PolarHBondContact OE2-NH2 3.46Å
124	Y	80.3	Confident	67.1	Low	6 Å²	6	67 Å²	67	2%	0.024	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.3	-179.1	-59.1	-98.8	0	0	0	110.1	F58 F62 G116 F117 M122 I147 S148 R149	F58-Y124 HydrophobicContact CD2-CD1 4.34Å; F58-Y124 HydrophobicContact CD2-CE1 4.13Å; F58-Y124 HydrophobicContact CE2-CD1 4.23Å; F58-Y124 HydrophobicContact CE2-CE1 4.41Å; F62-Y124 HydrophobicContact CE1-CE1 4.18Å; F62-Y124 HydrophobicContact CE1-CE2 4.27Å; F62-Y124 AromaticContact CE1-CZ 3.93Å; F62-Y124 HydrophobicContact CE2-CE1 4.33Å; F62-Y124 HydrophobicContact CZ-CD1 4.2Å; F62-Y124 AromaticContact CZ-CE1 3.58Å; F62-Y124 HydrophobicContact CZ-CE1 3.58Å; F62-Y124 HydrophobicContact CZ-CE2 4.48Å; F62-Y124 AromaticContact CZ-CZ 3.75Å; G116-Y124 CarbonylContact C-O 3.52Å; G116-Y124 WeakPolarHBondContact CA-O 3.18Å; F117-Y124 AromaticContact CD2-CD2 3.86Å; F117-Y124 HydrophobicContact CD2-CD2 3.86Å; F117-Y124 HydrophobicContact CD2-CG 4.18Å; F117-Y124 HydrophobicContact CE1-CG 4.35Å; F117-Y124 HydrophobicContact CE2-CD1 4.3Å; F117-Y124 AromaticContact CE2-CD2 3.48Å; F117-Y124 HydrophobicContact CE2-CD2 3.48Å; F117-Y124 VanDerWaalsContact CE2-CD2 3.48Å; F117-Y124 HydrophobicContact CE2-CE2 4.12Å; F117-Y124 AromaticContact CE2-CG 3.6Å; F117-Y124 HydrophobicContact CE2-CG 3.6Å; F117-Y124 HydrophobicContact CZ-CD1 4.14Å; F117-Y124 HydrophobicContact CZ-CD2 4.09Å; F117-Y124 AromaticContact CZ-CG 3.7Å; F117-Y124 HydrophobicContact CZ-CG 3.7Å; F117-Y124 PolarHBondContact N-O 3.15Å; F117-Y124 WeakPolarHBondContact O-CA 3.09Å; F117-Y124 WeakPolarHBondContact O-CB 3.25Å; F117-Y124 PolarHBondContact O-N 2.98Å; M122-Y124 HydrophobicContact CB-CD2 4.28Å; M122-Y124 HydrophobicContact CB-CE2 3.48Å; M122-Y124 VanDerWaalsContact CB-CE2 3.48Å; Y124-I147 HydrophobicContact CD1-CG2 4.27Å; Y124-S148 CarbonylContact C-O 3.51Å; Y124-S148 WeakPolarHBondContact CA-O 3.34Å; Y124-R149 HydrophobicContact CD1-CB 3.68Å; Y124-R149 HydrophobicContact CE1-CB 3.82Å; Y124-R149 HydrophobicContact CE1-CG 4.42Å; Y124-R149 HydrophobicContact CG-CB 4.33Å
125	F	80.4	Confident	65.4	Low	78 Å²	78	69.2 Å²	69.2	34%	0.342	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.4	179.3	-57.5	-85	0	0	0	110	E123 I147 S148	E123-F125 HydrophobicContact CB-CE2 4.03Å; E123-F125 HydrophobicContact CB-CZ 4.18Å; F125-I147 CarbonylContact O-C 3.43Å; F125-I147 WeakPolarHBondContact O-CA 3.2Å; F125-S148 PolarHBondContact N-O 3.04Å; F125-S148 PolarHBondContact O-N 3.09Å
126	I	79.3	Confident	63.9	Low	1 Å²	1	76.2 Å²	76.2	1%	0.005	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	119.3	-179.2	-49.6	165.6	0	0	0	109	L55 L64 V107 L113 G115 F117 H145 I147	L55-I126 HydrophobicContact CD1-CD1 3.47Å; L55-I126 VanDerWaalsContact CD1-CD1 3.47Å; L55-I126 HydrophobicContact CD1-CG1 4.34Å; L64-I126 HydrophobicContact CD1-CD1 4.19Å; V107-I126 HydrophobicContact CG1-CD1 4.22Å; L113-I126 WeakPolarHBondContact O-CG2 3.29Å; G115-I126 PolarHBondContact N-O 2.01Å; G115-I126 WeakPolarHBondContact O-CA 3.37Å; G115-I126 PolarHBondContact O-N 3.11Å; G115-I126 VanDerWaalsContact O-O 3.09Å; F117-I126 HydrophobicContact CD1-CD1 3.77Å; F117-I126 HydrophobicContact CD1-CG1 4.19Å; F117-I126 HydrophobicContact CE1-CD1 3.81Å; F117-I126 HydrophobicContact CE1-CG1 4.04Å; I126-H145 HydrophobicContact CG2-CB 3.94Å; I126-I147 HydrophobicContact CB-CG1 4.49Å; I126-I147 HydrophobicContact CG1-CD1 4Å; I126-I147 HydrophobicContact CG1-CG1 4.1Å; I126-I147 HydrophobicContact CG2-CG1 4.33Å
127	T	73.7	Confident	62.4	Low	70 Å²	70	86.1 Å²	86.1	43%	0.429	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.9	175.3	52.3	0	0	0	0	109.1	H145 R146	T127-H145 CarbonylContact O-C 3.58Å; T127-H145 WeakPolarHBondContact O-CA 3.44Å; T127-R146 PolarHBondContact N-O 2.87Å; T127-R146 PolarHBondContact O-N 2.8Å; T127-R146 PolarHBondContact OG1-O 2.81Å
128	A	65	Low	60.5	Low	23 Å²	23	88.9 Å²	88.9	19%	0.19	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138	175.8	0	0	0	0	0	109.8	S112 R114	S112-A128 WeakPolarHBondContact OG-CB 3.27Å; R114-A128 HydrophobicContact CG-CB 4.29Å
129	S	58.1	Low	59.2	Low	51 Å²	51	93.9 Å²	93.9	36%	0.357	52%	0.522	S	S	.	.			trans	-69.4	144.6	175.3	-168.3	0	0	0	0	110.6	T144	S129-T144 WeakPolarHBondContact CB-O 3.27Å; S129-T144 PolarHBondContact N-O 2.89Å; S129-T144 VanDerWaalsContact N-O 3.11Å
130	A	53	Low	57.7	Low	103 Å²	103	97.8 Å²	97.8	85%	0.851	54%	0.54	S	S	*	.	S	Bend	trans	-94.2	10.6	-175.6	0	0	0	0	0	113.8
131	E	50.1	Low	56.6	Low	172 Å²	172	92.3 Å²	92.3	80%	0.804	52%	0.518	S	S	*	.			trans	-103.6	6.1	-167.7	-84.6	-176.5	168.9	0	0	117.2
132	D	41.5	Very low	56.1	Low	118 Å²	118	97 Å²	97	63%	0.631	53%	0.527	S	S	*	.	S	Bend	trans	-107.1	108.2	169.5	-74.5	-37.8	0	0	0	110.2
133	T	41.1	Very low	55.9	Low	139 Å²	139	99.5 Å²	99.5	85%	0.853	54%	0.536	S	S	*	.			trans	-60	146.9	174	40.2	0	0	0	0	111.4	D135	T133-D135 PolarHBondContact O-N 2.84Å
134	A	45.5	Very low	55.8	Low	92 Å²	92	99 Å²	99	76%	0.76	54%	0.537	S	S	*	.			trans	-44.9	126	-176.1	0	0	0	0	0	113.5
135	D	34.9	Very low	55.7	Low	165 Å²	165	98.8 Å²	98.8	88%	0.882	54%	0.536	S	S	*	.			trans	-131.7	150.9	148.1	-101.7	-22.3	0	0	0	110.4	T133	T133-D135 PolarHBondContact O-N 2.84Å
136	E	43.2	Very low	55.8	Low	177 Å²	177	100.6 Å²	100.6	83%	0.827	54%	0.541	S	S	*	.			trans	-70.1	141.1	-157.1	-137.9	169.6	179.2	0	0	113.5
137	Y	43	Very low	56	Low	227 Å²	227	100.5 Å²	100.5	89%	0.89	54%	0.541	S	S	*	.	S	Bend	trans	44.4	98.7	164.2	-94.3	-96.4	0	0	0	118.7
138	G	45.8	Very low	56.3	Low	62 Å²	62	97.8 Å²	97.8	64%	0.639	52%	0.524	S	S	*	.	S	Bend	trans	91.6	83.3	141.1	0	0	0	0	0	117.4
139	H	47.6	Very low	56.9	Low	157 Å²	157	99.1 Å²	99.1	73%	0.727	52%	0.524	S	S	*	.			trans	176.2	87.6	130.9	-101	-78.9	0	0	0	108.9	L141	H139-L141 PolarHBondContact O-N 2.98Å
140	F	48.6	Very low	57.6	Low	116 Å²	116	102.1 Å²	102.1	51%	0.509	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-1.7	-173.9	-84.3	-76.5	0	0	0	116.1	E111	E111-F140 WeakPolarHBondContact O-CD1 2.94Å; E111-F140 WeakPolarHBondContact O-CE1 3.34Å; E111-F140 WeakPolarHBondContact O-CG 3.48Å
141	L	51.6	Low	57.5	Low	42 Å²	42	104.2 Å²	104.2	22%	0.22	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-8.5	-170.5	-69.6	170.4	0	0	0	114.6	R32 F53 H139	R32-L141 HydrophobicContact CB-CD1 4.05Å; R32-L141 HydrophobicContact CG-CD1 4.49Å; F53-L141 HydrophobicContact CD1-CD2 4.33Å; F53-L141 HydrophobicContact CE1-CD1 4.32Å; F53-L141 HydrophobicContact CE1-CD2 3.3Å; F53-L141 HydrophobicContact CE1-CG 4.41Å; F53-L141 HydrophobicContact CZ-CD2 3.77Å; H139-L141 PolarHBondContact O-N 2.98Å
142	E	52.1	Low	57.4	Low	148 Å²	148	99.3 Å²	99.3	69%	0.692	51%	0.506	S	S	*	.	S	Bend	trans	-98.5	-0.3	-178.2	-65.7	-171.5	156.5	0	0	114.5
143	K	65.6	Low	57.2	Low	91 Å²	91	98.9 Å²	98.9	40%	0.396	52%	0.519	S	S	.	.	S	Bend	trans	-73.3	147.6	-180	-64.1	-170.9	177.7	-172.3	0	111.5	H145	K143-H145 PolarHBondContact O-CE1 2.8Å; K143-H145 PolarHBondContact O-ND1 2.88Å
144	T	71.6	Confident	57.1	Low	41 Å²	41	95.6 Å²	95.6	25%	0.252	51%	0.513	S	S	.	.			trans	-79.9	128	179.1	-48.8	0	0	0	0	110.8	F27 K29 S129	F27-T144 HydrophobicContact CB-CG2 3.97Å; F27-T144 HydrophobicContact CD1-CG2 4.47Å; K29-T144 WeakPolarHBondContact CE-OG1 3.24Å; S129-T144 WeakPolarHBondContact CB-O 3.27Å; S129-T144 PolarHBondContact N-O 2.89Å; S129-T144 VanDerWaalsContact N-O 3.11Å
145	H	78.9	Confident	56.2	Low	1 Å²	1	98.9 Å²	98.9	1%	0.005	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.7	178.7	-65.3	72.3	0	0	0	110.9	F27 C28 P30 L113 I126 T127 K143	F27-H145 CarbonylContact C-O 3.47Å; F27-H145 VanDerWaalsContact CA-O 3.31Å; F27-H145 WeakPolarHBondContact CA-O 2.98Å; C28-H145 PolarHBondContact N-O 3.49Å; C28-H145 PolarHBondContact O-N 2.86Å; P30-H145 WeakPolarHBondContact CD-ND1 2.97Å; P30-H145 VanDerWaalsContact CG-CE1 3.49Å; P30-H145 WeakPolarHBondContact CG-CE1 3.13Å; P30-H145 VanDerWaalsContact CG-ND1 3.3Å; P30-H145 WeakPolarHBondContact CG-ND1 3.22Å; L113-H145 PolarHBondContact N-NE2 2.83Å; L113-H145 PolarHBondContact O-CD2 2.91Å; L113-H145 PolarHBondContact O-NE2 3.14Å; I126-H145 HydrophobicContact CG2-CB 3.94Å; T127-H145 CarbonylContact O-C 3.58Å; T127-H145 WeakPolarHBondContact O-CA 3.44Å; K143-H145 PolarHBondContact O-CE1 2.8Å; K143-H145 PolarHBondContact O-ND1 2.88Å
146	R	81.4	Confident	56.1	Low	116 Å²	116	97.2 Å²	97.2	44%	0.438	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.2	172.5	-177.8	-178	173.4	-161.7	0.1	109.1	V25 F27 T127	V25-R146 HydrophobicContact CG1-CG 3.72Å; F27-R146 HydrophobicContact CD1-CB 3.99Å; F27-R146 HydrophobicContact CD1-CG 4.3Å; F27-R146 HydrophobicContact CE1-CB 3.88Å; F27-R146 HydrophobicContact CE1-CG 3.9Å; F27-R146 HydrophobicContact CZ-CG 4.45Å; T127-R146 PolarHBondContact N-O 2.87Å; T127-R146 PolarHBondContact O-N 2.8Å; T127-R146 PolarHBondContact OG1-O 2.81Å
147	I	84.8	Confident	55.5	Low	0 Å²	0	92.6 Å²	92.6	0%	0	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130	173.7	-55.5	-170.1	0	0	0	109.7	V25 D26 C28 L55 A57 F58 Y124 F125 I126	V25-I147 WeakPolarHBondContact CA-O 3.36Å; D26-I147 PolarHBondContact N-O 2.76Å; D26-I147 PolarHBondContact O-N 2.74Å; D26-I147 VanDerWaalsContact O-O 3.05Å; C28-I147 HydrophobicContact CB-CD1 4.22Å; C28-I147 WeakPolarHBondContact SG-CD1 3.27Å; L55-I147 HydrophobicContact CD1-CD1 4.19Å; A57-I147 HydrophobicContact CB-CB 4.43Å; A57-I147 HydrophobicContact CB-CD1 3.93Å; F58-I147 HydrophobicContact CE2-CB 4.2Å; F58-I147 HydrophobicContact CE2-CG2 3.82Å; F58-I147 WeakPolarHBondContact CZ-O 3.2Å; Y124-I147 HydrophobicContact CD1-CG2 4.27Å; F125-I147 CarbonylContact O-C 3.43Å; F125-I147 WeakPolarHBondContact O-CA 3.2Å; I126-I147 HydrophobicContact CB-CG1 4.49Å; I126-I147 HydrophobicContact CG1-CD1 4Å; I126-I147 HydrophobicContact CG1-CG1 4.1Å; I126-I147 HydrophobicContact CG2-CG1 4.33Å
148	S	79	Confident	54.6	Low	13 Å²	13	85.7 Å²	85.7	9%	0.091	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.2	173.7	60	0	0	0	0	111.5	M23 E24 Y124 F125	M23-S148 WeakPolarHBondContact CE-OG 3.41Å; E24-S148 CarbonylContact O-C 3.5Å; E24-S148 VanDerWaalsContact O-CA 3.24Å; E24-S148 WeakPolarHBondContact O-CA 3.39Å; Y124-S148 CarbonylContact C-O 3.51Å; Y124-S148 WeakPolarHBondContact CA-O 3.34Å; F125-S148 PolarHBondContact N-O 3.04Å; F125-S148 PolarHBondContact O-N 3.09Å
149	R	77.3	Confident	53.7	Low	50 Å²	50	90.6 Å²	90.6	19%	0.189	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149	-178.6	75.5	178.5	-175.6	-178.6	-1.5	114.5	E24 F58 M122 E123 Y124	E24-R149 HydrophobicContact CB-CG 4.03Å; E24-R149 PolarHBondContact N-O 3.47Å; E24-R149 PolarHBondContact O-N 2.95Å; E24-R149 IonicContact OE2-CZ 3.81Å; E24-R149 IonicContact OE2-NE 3.14Å; E24-R149 PolarHBondContact OE2-NE 2.9Å; E24-R149 IonicContact OE2-NH2 2.6Å; E24-R149 PolarHBondContact OE2-NH2 3.24Å; F58-R149 HydrophobicContact CD1-CG 4.46Å; F58-R149 HydrophobicContact CE1-CG 4.03Å; F58-R149 HydrophobicContact CE2-CB 4.16Å; F58-R149 HydrophobicContact CE2-CG 4.07Å; F58-R149 HydrophobicContact CZ-CB 4.2Å; F58-R149 HydrophobicContact CZ-CG 3.82Å; M122-R149 HydrophobicContact CE-CB 4.27Å; M122-R149 HydrophobicContact CE-CG 3.91Å; E123-R149 WeakPolarHBondContact O-CA 3.42Å; Y124-R149 HydrophobicContact CD1-CB 3.68Å; Y124-R149 HydrophobicContact CE1-CB 3.82Å; Y124-R149 HydrophobicContact CE1-CG 4.42Å; Y124-R149 HydrophobicContact CG-CB 4.33Å
150	R	72.6	Confident	52.8	Low	114 Å²	114	92.3 Å²	92.3	43%	0.43	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.3	171.7	67.9	179.3	-176.4	178.3	2.9	112.2	M23 M122 E123	M23-R150 HydrophobicContact CG-CB 4.48Å; M122-R150 WeakPolarHBondContact CA-O 3.25Å; E123-R150 HydrophobicContact CB-CG 4.24Å; E123-R150 PolarHBondContact N-O 2.67Å; E123-R150 PolarHBondContact O-N 2.85Å; E123-R150 VanDerWaalsContact O-N 3.09Å; E123-R150 IonicContact OE2-CZ 3.72Å; E123-R150 IonicContact OE2-NE 3.71Å; E123-R150 PolarHBondContact OE2-NE 3.09Å; E123-R150 IonicContact OE2-NH2 3.67Å; E123-R150 PolarHBondContact OE2-NH2 3.46Å
151	M	51.4	Low	52.1	Low	147 Å²	147	90 Å²	90	72%	0.724	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	132.4	174.4	-91.8	-171.4	-109.1	0	0	111.6	M122 A153	M122-M151 HydrophobicContact CE-CG 4.18Å; M122-M151 WeakPolarHBondContact SD-CA 3.19Å; M122-M151 HydrophobicContact SD-CB 3.96Å; M122-M151 HydrophobicContact SD-CG 3.27Å; M122-M151 WeakPolarHBondContact SD-CG 3.49Å; M151-A153 PolarHBondContact O-N 3.43Å
152	S	47.9	Very low	51.5	Low	69 Å²	69	90 Å²	90	48%	0.483	52%	0.522	S	S	.	.			trans	-77.5	113.8	169.2	-167.6	0	0	0	0	109	G121 G154	G121-S152 WeakPolarHBondContact O-CB 3.49Å; G121-S152 PolarHBondContact O-N 2.86Å; S152-G154 PolarHBondContact O-N 3.16Å
153	A	37.5	Very low	51.2	Low	109 Å²	109	87.5 Å²	87.5	90%	0.901	51%	0.506	S	S	*	.			trans	-77.2	83.1	-173.3	0	0	0	0	0	111.5	M151	M151-A153 PolarHBondContact O-N 3.43Å
154	G	38.5	Very low	50.1	Low	70 Å²	70	83.3 Å²	83.3	72%	0.722	49%	0.489	S	S	*	.			trans	-113.7	94.4	169.1	0	0	0	0	0	111.6	S152	S152-G154 PolarHBondContact O-N 3.16Å
155	L	26.2	Very low	48.5	Very low	162 Å²	162	82.5 Å²	82.5	85%	0.848	49%	0.489	S	S	*	.			trans	-144	139	160.9	-95.2	164	0	0	0	109.7
156	P	33.9	Very low	46.5	Very low	130 Å²	130	84.3 Å²	84.3	84%	0.844	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	118.8	-178.7	30	-25.6	0	0	0	110.4
157	G	30.3	Very low	44.3	Very low	80 Å²	80	84 Å²	84	83%	0.825	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	143.3	0.8	170.4	0	0	0	0	0	117.9
158	A	24.3	Very low	41.8	Very low	81 Å²	81	88.8 Å²	88.8	67%	0.669	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-87.5	128.6	176.6	0	0	0	0	0	111.8	F160	A158-F160 PolarHBondContact O-N 2.81Å
159	N	27.3	Very low	39.5	Very low	165 Å²	165	94.5 Å²	94.5	88%	0.882	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-58.7	117.6	170.7	-78.9	-30.7	0	0	0	110.1
160	F	28.5	Very low	37.2	Very low	193 Å²	193	98.6 Å²	98.6	85%	0.846	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-70.2	133.8	169.2	-72.6	-86.2	0	0	0	110	A158 S162	A158-F160 PolarHBondContact O-N 2.81Å; F160-S162 PolarHBondContact O-N 3.12Å
161	P	33.9	Very low	35.3	Very low	69 Å²	69	100.1 Å²	100.1	45%	0.448	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-66.1	127.8	168.9	26.3	-30	0	0	0	109.4	T317	P161-T317 HydrophobicContact CB-CG2 3.77Å; P161-T317 HydrophobicContact CG-CG2 4.3Å
162	S	37.9	Very low	34.5	Very low	40 Å²	40	95.9 Å²	95.9	28%	0.28	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-68.3	138.1	177.1	51.2	0	0	0	0	110.4	F160 C164	F160-S162 PolarHBondContact O-N 3.12Å; S162-C164 WeakPolarHBondContact CB-O 3.27Å; S162-C164 PolarHBondContact O-N 3.46Å; S162-C164 VanDerWaalsContact O-N 3.17Å; S162-C164 PolarHBondContact OG-O 3.07Å
163	R	46.4	Very low	34	Very low	96 Å²	96	97 Å²	97	36%	0.362	60%	0.604	S	S	.	*	S	Bend	trans	-78.4	14.6	172	-64.7	-162.5	173.1	179.7	-4	113.2	D319 T320 L321 P383	R163-D319 CarbonylContact C-O 3.49Å; R163-D319 VanDerWaalsContact CA-O 3.32Å; R163-D319 WeakPolarHBondContact CA-O 3.2Å; R163-D319 HydrophobicContact CB-CB 4.45Å; R163-D319 VanDerWaalsContact CB-O 3.28Å; R163-D319 WeakPolarHBondContact CB-O 3.15Å; R163-D319 HydrophobicContact CG-CB 3.91Å; R163-T320 WeakPolarHBondContact O-CA 3.43Å; R163-L321 PolarHBondContact O-N 2.93Å; R163-P383 PolarHBondContact N-O 2.88Å
164	C	42.5	Very low	34.1	Very low	4 Å²	4	93 Å²	93	3%	0.027	57%	0.569	C	S	.	*	S	Bend	trans	-132.8	127.6	175.9	175.9	0	0	0	0	106.3	S162 V166	S162-C164 WeakPolarHBondContact CB-O 3.27Å; S162-C164 PolarHBondContact O-N 3.46Å; S162-C164 VanDerWaalsContact O-N 3.17Å; S162-C164 PolarHBondContact OG-O 3.07Å; C164-V166 PolarHBondContact O-N 3.24Å; C164-V166 VanDerWaalsContact O-N 3.08Å
165	G	37.5	Very low	34.3	Very low	24 Å²	24	92 Å²	92	25%	0.247	55%	0.55	C	S	.	*			trans	-76.6	12.2	-170.2	0	0	0	0	0	115	T167 M323	G165-T167 PolarHBondContact O-N 2.01Å; G165-M323 WeakPolarHBondContact O-CE 3.26Å
166	V	38.3	Very low	35.2	Very low	38 Å²	38	84.4 Å²	84.4	23%	0.23	51%	0.51	C	S	.	.			trans	-84.6	112.3	178.6	-175.7	0	0	0	0	109.2	C164	C164-V166 PolarHBondContact O-N 3.24Å; C164-V166 VanDerWaalsContact O-N 3.08Å
167	T	33.3	Very low	35.6	Very low	109 Å²	109	85 Å²	85	67%	0.669	50%	0.502	S	S	*	.			trans	-63	133.7	170.5	49.3	0	0	0	0	109.4	G165 D169	G165-T167 PolarHBondContact O-N 2.01Å; T167-D169 PolarHBondContact O-N 3.34Å
168	P	32.7	Very low	36.3	Very low	102 Å²	102	83 Å²	83	66%	0.662	47%	0.471	S	S	*	.			trans	-63.6	107.1	177.5	24.2	-30.9	0	0	0	109.3	T170	P168-T170 PolarHBondContact O-N 3.3Å; P168-T170 VanDerWaalsContact O-N 3.13Å
169	D	31.3	Very low	37.1	Very low	132 Å²	132	80.4 Å²	80.4	71%	0.706	44%	0.444	S	S	*	.			trans	-61	117	172.9	-94.2	-24.6	0	0	0	109.1	T167 N171	T167-D169 PolarHBondContact O-N 3.34Å; D169-N171 PolarHBondContact O-N 2.81Å
170	T	28.9	Very low	37.6	Very low	137 Å²	137	79.7 Å²	79.7	84%	0.84	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	0.6	179.5	43.4	0	0	0	0	113.8	P168	P168-T170 PolarHBondContact O-N 3.3Å; P168-T170 VanDerWaalsContact O-N 3.13Å
171	N	32.7	Very low	38.2	Very low	146 Å²	146	77.6 Å²	77.6	78%	0.781	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	34.1	-177.9	-79	-21.2	0	0	0	113.9	D169 S173	D169-N171 PolarHBondContact O-N 2.81Å; N171-S173 VanDerWaalsContact C-N 3.34Å; N171-S173 PolarHBondContact O-N 3.45Å
172	F	35.7	Very low	38.4	Very low	58 Å²	58	77.9 Å²	77.9	25%	0.254	42%	0.423	S	S	.	.			trans	-77.2	81.6	172.3	-148.4	-96.3	0	0	0	111.2	V174 P361 I401	F172-V174 HydrophobicContact CD1-CB 4.26Å; F172-V174 HydrophobicContact CD1-CG2 3.96Å; F172-V174 HydrophobicContact CE1-CB 4.09Å; F172-V174 HydrophobicContact CE1-CG2 3.61Å; F172-V174 HydrophobicContact CZ-CG2 4.22Å; F172-V174 PolarHBondContact O-N 3Å; F172-P361 HydrophobicContact CE1-CG 3.97Å; F172-P361 HydrophobicContact CE2-CB 4.49Å; F172-P361 HydrophobicContact CZ-CB 4.38Å; F172-P361 HydrophobicContact CZ-CG 4Å; F172-I401 HydrophobicContact CE1-CD1 4.44Å
173	S	35.8	Very low	38	Very low	91 Å²	91	83.4 Å²	83.4	64%	0.636	45%	0.449	S	S	*	.			trans	-88.6	61.8	179.8	60.4	0	0	0	0	112.7	N171 P627	N171-S173 VanDerWaalsContact C-N 3.34Å; N171-S173 PolarHBondContact O-N 3.45Å; S173-P627 WeakPolarHBondContact O-CG 3.42Å
174	V	41.3	Very low	37.1	Very low	27 Å²	27	86.1 Å²	86.1	16%	0.164	47%	0.466	C	S	.	.			trans	-101.5	111.8	167.7	-177.1	0	0	0	0	108.6	F172 L176 E404	F172-V174 HydrophobicContact CD1-CB 4.26Å; F172-V174 HydrophobicContact CD1-CG2 3.96Å; F172-V174 HydrophobicContact CE1-CB 4.09Å; F172-V174 HydrophobicContact CE1-CG2 3.61Å; F172-V174 HydrophobicContact CZ-CG2 4.22Å; F172-V174 PolarHBondContact O-N 3Å; V174-L176 HydrophobicContact CG1-CD2 4.41Å; V174-L176 HydrophobicContact CG1-CG 4.28Å; V174-L176 PolarHBondContact O-N 2.99Å; V174-E404 WeakPolarHBondContact CG1-OE2 3.07Å
175	S	41.8	Very low	36.4	Very low	47 Å²	47	93.8 Å²	93.8	33%	0.329	51%	0.506	S	S	.	.			trans	-68.9	94.8	173	167.4	0	0	0	0	109.6	E177	S175-E177 VanDerWaalsContact C-N 3.31Å
176	L	44.7	Very low	35.9	Very low	3 Å²	3	100 Å²	100	2%	0.016	53%	0.534	C	S	.	.			trans	-81.9	-5.7	178.4	-75.3	163.4	0	0	0	112.6	V174 K178 Y179 A367 V371 F372 A400 I401	V174-L176 HydrophobicContact CG1-CD2 4.41Å; V174-L176 HydrophobicContact CG1-CG 4.28Å; V174-L176 PolarHBondContact O-N 2.99Å; L176-K178 PolarHBondContact O-N 2.78Å; L176-Y179 HydrophobicContact CD2-CD2 4.25Å; L176-Y179 HydrophobicContact CD2-CE2 4.37Å; L176-Y179 WeakPolarHBondContact O-CD2 3.37Å; L176-Y179 PolarHBondContact O-N 3.28Å; L176-A367 HydrophobicContact CD1-CB 4.24Å; L176-A367 WeakPolarHBondContact CD1-O 3Å; L176-V371 HydrophobicContact CB-CB 3.87Å; L176-V371 HydrophobicContact CB-CG1 3.88Å; L176-V371 HydrophobicContact CB-CG2 3.5Å; L176-V371 VanDerWaalsContact CB-CG2 3.5Å; L176-V371 WeakPolarHBondContact O-CG1 3.49Å; L176-F372 HydrophobicContact CB-CE2 4.35Å; L176-F372 HydrophobicContact CD1-CE2 4.34Å; L176-F372 HydrophobicContact CD2-CE2 4.21Å; L176-A400 HydrophobicContact CD2-CB 4.4Å; L176-I401 HydrophobicContact CD1-CD1 4.47Å; L176-I401 HydrophobicContact CD2-CG1 3.92Å
177	E	42.8	Very low	35.2	Very low	142 Å²	142	102.8 Å²	102.8	66%	0.664	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-47.8	-26.5	-175.6	-69	-179.9	142.8	0	0	114.6	S175 Y179 K180	S175-E177 VanDerWaalsContact C-N 3.31Å; E177-Y179 PolarHBondContact O-N 3.19Å; E177-Y179 VanDerWaalsContact O-N 3.11Å; E177-K180 WeakPolarHBondContact O-CB 3.31Å; E177-K180 PolarHBondContact O-N 3.22Å
178	K	44	Very low	34.8	Very low	39 Å²	39	101.3 Å²	101.3	17%	0.17	57%	0.567	C	S	.	*	G	3₁₀ helix	trans	-62.1	-14.1	178.6	-155.9	-146	173.2	-172.4	0	114.7	L176 R533	L176-K178 PolarHBondContact O-N 2.78Å; K178-R533 VanDerWaalsContact CG-NH2 3.31Å; K178-R533 PolarHBondContact O-NH2 3.28Å
179	Y	40.9	Very low	34.4	Very low	27 Å²	27	99.8 Å²	99.8	11%	0.106	57%	0.569	C	S	.	*	G	3₁₀ helix	trans	-109.7	6.4	-174.7	-60.6	-81.8	0	0	0	114.3	L176 E177 H181 L182 F372 A400	L176-Y179 HydrophobicContact CD2-CD2 4.25Å; L176-Y179 HydrophobicContact CD2-CE2 4.37Å; L176-Y179 WeakPolarHBondContact O-CD2 3.37Å; L176-Y179 PolarHBondContact O-N 3.28Å; E177-Y179 PolarHBondContact O-N 3.19Å; E177-Y179 VanDerWaalsContact O-N 3.11Å; Y179-H181 PolarHBondContact O-N 3.37Å; Y179-H181 VanDerWaalsContact O-N 3.08Å; Y179-L182 HydrophobicContact CD1-CD1 3.97Å; Y179-L182 PolarHBondContact O-N 3.15Å; Y179-F372 HydrophobicContact CD2-CZ 4.21Å; Y179-F372 HydrophobicContact CG-CE1 4.34Å; Y179-F372 AromaticContact CG-CZ 4Å; Y179-F372 HydrophobicContact CG-CZ 4Å; Y179-A400 HydrophobicContact CD1-CB 4.02Å; Y179-A400 HydrophobicContact CD2-CB 3.8Å; Y179-A400 HydrophobicContact CE1-CB 3.91Å; Y179-A400 HydrophobicContact CE2-CB 3.67Å; Y179-A400 HydrophobicContact CG-CB 3.97Å; Y179-A400 PolarHBondContact OH-O 3.29Å
180	K	37.9	Very low	34.1	Very low	149 Å²	149	101.9 Å²	101.9	65%	0.648	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-14.8	-178.2	-154.3	173.6	-175.6	178	0	114.9	E177	E177-K180 WeakPolarHBondContact O-CB 3.31Å; E177-K180 PolarHBondContact O-N 3.22Å
181	H	40.9	Very low	34.1	Very low	150 Å²	150	101.8 Å²	101.8	69%	0.694	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	23.5	-175.3	-68.9	-76.2	0	0	0	114.5	Y179 D183	Y179-H181 PolarHBondContact O-N 3.37Å; Y179-H181 VanDerWaalsContact O-N 3.08Å; H181-D183 PolarHBondContact O-N 3.49Å; H181-D183 VanDerWaalsContact O-N 3.08Å
182	L	38.8	Very low	33.8	Very low	75 Å²	75	103.4 Å²	103.4	39%	0.393	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.6	-4	179.4	-114.9	102.3	0	0	0	114.5	Y179 V396	Y179-L182 HydrophobicContact CD1-CD1 3.97Å; Y179-L182 PolarHBondContact O-N 3.15Å; L182-V396 HydrophobicContact CD1-CG1 4.33Å; L182-V396 HydrophobicContact CD2-CG1 3.83Å
183	D	30.5	Very low	33.5	Very low	156 Å²	156	104.1 Å²	104.1	83%	0.834	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	2	-167.6	-143.3	16.8	0	0	0	115.1	H181	H181-D183 PolarHBondContact O-N 3.49Å; H181-D183 VanDerWaalsContact O-N 3.08Å
184	Q	27.3	Very low	33.2	Very low	152 Å²	152	108.7 Å²	108.7	71%	0.71	62%	0.619	S	S	*	*			trans	-144.6	115.8	-170.6	-72.2	-175.4	-0.4	0	0	116.2
185	L	26.8	Very low	32.8	Very low	165 Å²	165	113.3 Å²	113.3	86%	0.864	64%	0.642	S	S	*	*			trans	101	145.1	131.7	-68.1	163.6	0	0	0	122
186	D	26.6	Very low	32.2	Very low	156 Å²	156	121.3 Å²	121.3	83%	0.834	67%	0.671	S	S	*	*			trans	-90	168.9	-158.6	-119.3	-35	0	0	0	116
187	A	25.3	Very low	31.5	Very low	95 Å²	95	125.7 Å²	125.7	79%	0.785	70%	0.702	S	S	*	*			trans	75.8	125.9	150.2	0	0	0	0	0	123.7
188	G	24	Very low	30.9	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	71%	0.708	S	S	*	*			trans	83.1	123.7	152.6	0	0	0	0	0	116.5
189	G	24	Very low	30.3	Very low	69 Å²	69	128.2 Å²	128.2	71%	0.711	74%	0.741	S	S	*	*			cis	141.6	121.7	17.6	0	0	0	0	0	106
190	L	25.1	Very low	30.2	Very low	177 Å²	177	138 Å²	138	93%	0.927	78%	0.777	S	S	*	*			trans	163.4	154.4	155.3	-88.4	160.3	0	0	0	112.7
191	T	28.6	Very low	30.2	Very low	135 Å²	135	135.7 Å²	135.7	83%	0.828	78%	0.78	S	S	*	*			trans	-92.4	162.7	-137.2	41.9	0	0	0	0	118.4	G193	T191-G193 VanDerWaalsContact C-N 3.27Å; T191-G193 PolarHBondContact O-N 3.26Å
192	E	27.7	Very low	30.5	Very low	180 Å²	180	134.7 Å²	134.7	84%	0.841	77%	0.774	S	S	*	*	S	Bend	trans	-75	24.2	-163.1	-152.7	163.7	179	0	0	116.3
193	G	29.9	Very low	31.4	Very low	72 Å²	72	137 Å²	137	74%	0.742	78%	0.777	S	S	*	*			trans	-87.6	-17	-168.6	0	0	0	0	0	117.6	T191	T191-G193 VanDerWaalsContact C-N 3.27Å; T191-G193 PolarHBondContact O-N 3.26Å
194	M	29	Very low	33.2	Very low	187 Å²	187	129.7 Å²	129.7	92%	0.921	74%	0.738	S	S	*	*	S	Bend	trans	-105.3	2.8	-170.4	-75.9	-176.2	92	0	0	115.6	K196	M194-K196 PolarHBondContact O-N 3Å
195	L	31.5	Very low	35.1	Very low	124 Å²	124	122.7 Å²	122.7	65%	0.649	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	5.9	-169.4	-89.7	157.1	0	0	0	116.1
196	K	29.4	Very low	37.5	Very low	216 Å²	216	115 Å²	115	94%	0.939	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	3.5	-175.1	-82.7	-171.4	177.7	179.5	0	116.5	M194	M194-K196 PolarHBondContact O-N 3Å
197	S	30.5	Very low	40.1	Very low	95 Å²	95	110.1 Å²	110.1	66%	0.664	64%	0.64	S	S	*	*			trans	-126.9	115.6	170.6	175.4	0	0	0	0	108.1
198	L	30.1	Very low	43	Very low	150 Å²	150	107.3 Å²	107.3	79%	0.785	61%	0.614	S	S	*	*			trans	170.4	87.1	146.2	-87.1	162.3	0	0	0	109.7
199	G	32.5	Very low	46.1	Very low	84 Å²	84	104.2 Å²	104.2	87%	0.866	58%	0.577	S	S	*	*			trans	-86	98.9	160.8	0	0	0	0	0	110.8
200	R	37.4	Very low	49.4	Very low	231 Å²	231	102.6 Å²	102.6	87%	0.872	55%	0.551	S	S	*	*	S	Bend	trans	-172.7	142.4	154.9	-114.2	176.4	179.3	172.9	1.3	106.9	K202	R200-K202 PolarHBondContact O-N 3.44Å
201	S	38.6	Very low	52.6	Low	102 Å²	102	94.1 Å²	94.1	71%	0.713	51%	0.507	S	S	*	.			trans	-17.6	103.4	-177.5	175.3	0	0	0	0	113.6	R203	S201-R203 WeakPolarHBondContact O-CG 3.49Å; S201-R203 PolarHBondContact O-N 3.4Å
202	K	47.9	Very low	55.7	Low	129 Å²	129	88 Å²	88	56%	0.561	47%	0.469	S	S	*	.			trans	-65.1	106.9	-174.5	-64	179.3	178.4	176.1	0	109.3	R200 A205	R200-K202 PolarHBondContact O-N 3.44Å; K202-A205 HydrophobicContact CB-CB 3.68Å
203	R	57.8	Low	58.9	Low	122 Å²	122	79.5 Å²	79.5	46%	0.46	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	145.2	179.9	-60.2	176.5	-176.9	-170.3	-0.9	109.6	S201 A205 L551 C648	S201-R203 WeakPolarHBondContact O-CG 3.49Å; S201-R203 PolarHBondContact O-N 3.4Å; R203-A205 PolarHBondContact O-N 3.12Å; R203-L551 VanDerWaalsContact O-CD2 3.25Å; R203-L551 WeakPolarHBondContact O-CD2 3.47Å; R203-C648 PolarHBondContact NH1-O 2.93Å
204	F	67.4	Low	62	Low	3 Å²	3	76.9 Å²	76.9	1%	0.013	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	33.3	-173.7	-40.7	-69.3	0	0	0	112.8	R552 I553 Y555 V644 Q645 K647 I649	F204-R552 WeakPolarHBondContact O-CG 3.39Å; F204-R552 PolarHBondContact O-N 2.59Å; F204-I553 HydrophobicContact CB-CB 3.97Å; F204-I553 HydrophobicContact CB-CD1 4.38Å; F204-I553 PolarHBondContact O-N 3.13Å; F204-Y555 HydrophobicContact CD2-CD1 4.33Å; F204-Y555 AromaticContact CD2-CE1 3.95Å; F204-Y555 HydrophobicContact CD2-CE1 3.95Å; F204-Y555 HydrophobicContact CE2-CD1 4.41Å; F204-Y555 AromaticContact CE2-CE1 3.99Å; F204-Y555 HydrophobicContact CE2-CE1 3.99Å; F204-V644 WeakPolarHBondContact CZ-O 3.47Å; F204-Q645 HydrophobicContact CD1-CB 4.28Å; F204-Q645 HydrophobicContact CE1-CB 3.45Å; F204-Q645 VanDerWaalsContact CE1-CB 3.45Å; F204-Q645 HydrophobicContact CE1-CG 4.35Å; F204-Q645 HydrophobicContact CZ-CB 3.8Å; F204-K647 HydrophobicContact CE1-CD 4.08Å; F204-K647 HydrophobicContact CE1-CG 4.42Å; F204-K647 HydrophobicContact CZ-CB 4.06Å; F204-K647 HydrophobicContact CZ-CD 3.9Å; F204-K647 HydrophobicContact CZ-CG 4.19Å; F204-I649 HydrophobicContact CE2-CD1 4.11Å
205	A	66.5	Low	65.2	Low	5 Å²	5	68 Å²	68	4%	0.041	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142	174.6	0	0	0	0	0	109.1	K202 R203 I207 G550 L551	K202-A205 HydrophobicContact CB-CB 3.68Å; R203-A205 PolarHBondContact O-N 3.12Å; A205-I207 HydrophobicContact CB-CG1 4.13Å; A205-I207 PolarHBondContact O-N 3.02Å; A205-G550 CarbonylContact C-O 3.59Å; A205-G550 WeakPolarHBondContact CA-O 3.33Å; A205-G550 VanDerWaalsContact CB-C 3.48Å; A205-G550 WeakPolarHBondContact CB-O 3.19Å; A205-L551 HydrophobicContact CB-CD2 4.34Å
206	S	77.7	Confident	68.2	Low	4 Å²	4	62.1 Å²	62.1	3%	0.028	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	116.5	159.7	178	0	0	0	0	107.6	C548 Y549 G550	S206-C548 WeakPolarHBondContact CB-O 3.21Å; S206-C548 PolarHBondContact OG-O 3.42Å; S206-Y549 WeakPolarHBondContact O-CA 3.24Å; S206-G550 PolarHBondContact N-O 3.18Å; S206-G550 PolarHBondContact O-N 3.32Å
207	I	81.1	Confident	71.4	Confident	53 Å²	53	51.8 Å²	51.8	27%	0.272	28%	0.278	S	S	.	.			trans	-122.7	136.8	178.2	-58.9	172	0	0	0	105.6	A205 R209 L415	A205-I207 HydrophobicContact CB-CG1 4.13Å; A205-I207 PolarHBondContact O-N 3.02Å; I207-R209 PolarHBondContact O-N 2.93Å; I207-L415 HydrophobicContact CG2-CD2 3.88Å
208	P	86.3	Confident	74.4	Confident	36 Å²	36	48 Å²	48	23%	0.234	25%	0.25	C	S	.	.			trans	-57.9	129.9	174.5	25.9	-34.8	0	0	0	110.1	F210 Y549	P208-F210 HydrophobicContact CB-CE2 4.13Å; P208-F210 HydrophobicContact CB-CZ 4.27Å; P208-F210 HydrophobicContact CG-CE2 4.47Å; P208-Y549 HydrophobicContact CB-CE1 4.08Å; P208-Y549 HydrophobicContact CG-CE1 4.32Å
209	R	89.9	Confident	77.4	Confident	15 Å²	15	45.5 Å²	45.5	6%	0.057	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135.8	171.6	-57.1	-60.6	179.5	147.7	-0.5	109	I207 S252 N254 L406 G411 L414 L415	I207-R209 PolarHBondContact O-N 2.93Å; R209-S252 PolarHBondContact N-O 3.44Å; R209-N254 WeakPolarHBondContact O-CB 3.34Å; R209-N254 PolarHBondContact O-N 3.05Å; R209-N254 PolarHBondContact O-ND2 3.25Å; R209-L406 HydrophobicContact CG-CD1 4.26Å; R209-L406 HydrophobicContact CG-CD2 4.12Å; R209-G411 PolarHBondContact NH1-O 2.75Å; R209-L414 CarbonylContact C-O 3.55Å; R209-L414 WeakPolarHBondContact CA-O 3.42Å; R209-L414 HydrophobicContact CB-CB 3.94Å; R209-L414 HydrophobicContact CB-CD1 4.36Å; R209-L414 HydrophobicContact CG-CB 4.48Å; R209-L415 VanDerWaalsContact CZ-CD2 3.42Å
210	F	91.9	Very high	80.2	Confident	34 Å²	34	43.3 Å²	43.3	15%	0.149	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.7	174.4	-57.8	-88.2	0	0	0	107.6	P208 N254 V256 L414 D416 Q417	P208-F210 HydrophobicContact CB-CE2 4.13Å; P208-F210 HydrophobicContact CB-CZ 4.27Å; P208-F210 HydrophobicContact CG-CE2 4.47Å; F210-N254 CarbonylContact C-O 3.5Å; F210-N254 WeakPolarHBondContact CA-O 3.3Å; F210-N254 HydrophobicContact CD1-CB 3.84Å; F210-N254 HydrophobicContact CE1-CB 4.21Å; F210-V256 HydrophobicContact CD1-CG2 4.27Å; F210-L414 PolarHBondContact N-O 3.45Å; F210-L414 VanDerWaalsContact O-CA 3.28Å; F210-L414 WeakPolarHBondContact O-CA 3.4Å; F210-L414 VanDerWaalsContact O-CB 3.3Å; F210-L414 WeakPolarHBondContact O-CB 3.38Å; F210-L414 WeakPolarHBondContact O-CD2 3.29Å; F210-D416 WeakPolarHBondContact CB-O 3.25Å; F210-D416 WeakPolarHBondContact CD2-O 3.33Å; F210-Q417 HydrophobicContact CD1-CG 4.36Å; F210-Q417 HydrophobicContact CD2-CB 4.23Å; F210-Q417 HydrophobicContact CD2-CG 4.43Å; F210-Q417 HydrophobicContact CE1-CG 4.07Å; F210-Q417 HydrophobicContact CE2-CB 4.08Å; F210-Q417 HydrophobicContact CE2-CG 4.14Å; F210-Q417 HydrophobicContact CZ-CB 4.39Å; F210-Q417 HydrophobicContact CZ-CG 3.95Å
211	V	93.8	Very high	82.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	107.9	176	-174.8	0	0	0	0	106.8	V213 I253 N254 I255 V256 T303 M329 F358 L414	V211-V213 HydrophobicContact CG1-CG2 3.93Å; V211-V213 PolarHBondContact O-N 3.05Å; V211-I253 HydrophobicContact CG2-CG2 4.05Å; V211-N254 PolarHBondContact N-O 3Å; V211-I255 HydrophobicContact CB-CD1 3.8Å; V211-I255 HydrophobicContact CG1-CD1 4.31Å; V211-I255 HydrophobicContact CG2-CD1 3.75Å; V211-V256 PolarHBondContact O-N 3.07Å; V211-V256 VanDerWaalsContact O-O 3.04Å; V211-T303 HydrophobicContact CG1-CG2 3.87Å; V211-M329 HydrophobicContact CG1-CE 4.05Å; V211-M329 HydrophobicContact CG1-SD 4.03Å; V211-M329 HydrophobicContact CG2-CE 4.5Å; V211-F358 HydrophobicContact CG2-CE2 4.24Å; V211-F358 HydrophobicContact CG2-CZ 3.6Å; V211-L414 HydrophobicContact CB-CD2 4.47Å; V211-L414 HydrophobicContact CG2-CD1 4.13Å; V211-L414 HydrophobicContact CG2-CD2 4.13Å
212	E	93.3	Very high	85.3	Confident	7 Å²	7	28.6 Å²	28.6	3%	0.033	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.3	176.8	-61.3	-171.5	132.2	0	0	109.9	V256 V258 Y300 D302 T303 P418	E212-V256 WeakPolarHBondContact CA-O 3.4Å; E212-V258 HydrophobicContact CB-CG1 3.74Å; E212-V258 HydrophobicContact CB-CG2 4.02Å; E212-V258 HydrophobicContact CG-CG1 3.86Å; E212-Y300 WeakPolarHBondContact OE2-CD1 3.49Å; E212-D302 HydrophobicContact CB-CB 4.48Å; E212-D302 PolarHBondContact N-OD2 2.93Å; E212-D302 PolarHBondContact O-N 3.03Å; E212-T303 PolarHBondContact O-N 3.35Å; E212-T303 VanDerWaalsContact O-N 3.17Å; E212-P418 HydrophobicContact CG-CB 4.2Å; E212-P418 VanDerWaalsContact OE1-CA 3.23Å; E212-P418 WeakPolarHBondContact OE1-CA 3.35Å; E212-P418 VanDerWaalsContact OE1-CB 3.24Å; E212-P418 WeakPolarHBondContact OE1-CB 3.03Å
213	V	94.3	Very high	87.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.4	-174	-173.5	0	0	0	0	111.2	V211 V215 M237 I255 V256 V257 V258 T303 I305	V211-V213 HydrophobicContact CG1-CG2 3.93Å; V211-V213 PolarHBondContact O-N 3.05Å; V213-V215 HydrophobicContact CG1-CG2 4.19Å; V213-M237 HydrophobicContact CB-CE 4.32Å; V213-M237 HydrophobicContact CG1-CE 3.92Å; V213-M237 HydrophobicContact CG2-CE 4.33Å; V213-I255 HydrophobicContact CG2-CG2 3.72Å; V213-V256 PolarHBondContact N-O 3.22Å; V213-V257 WeakPolarHBondContact O-CA 3.32Å; V213-V258 PolarHBondContact O-N 3.1Å; V213-T303 WeakPolarHBondContact CA-O 3.32Å; V213-T303 HydrophobicContact CB-CG2 4.5Å; V213-T303 HydrophobicContact CG1-CG2 4.41Å; V213-T303 HydrophobicContact CG2-CG2 3.9Å; V213-I305 HydrophobicContact CG1-CD1 3.72Å; V213-I305 HydrophobicContact CG1-CG1 3.8Å
214	M	94.8	Very high	88.7	Confident	17 Å²	17	24 Å²	24	8%	0.084	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.2	163.2	175.6	60.5	74.4	0	0	109.8	V216 M261 W301 T303 A304 I305	M214-V216 HydrophobicContact CG-CG2 3.87Å; M214-M261 HydrophobicContact SD-CB 4.46Å; M214-W301 HydrophobicContact CB-CB 4.02Å; M214-W301 HydrophobicContact CB-CD2 3.64Å; M214-W301 HydrophobicContact CB-CE3 4.17Å; M214-W301 HydrophobicContact CB-CG 3.56Å; M214-W301 HydrophobicContact CE-CD2 4Å; M214-W301 HydrophobicContact CE-CE3 3.33Å; M214-W301 HydrophobicContact CE-CH2 3.82Å; M214-W301 HydrophobicContact CE-CZ2 4.41Å; M214-W301 HydrophobicContact CE-CZ3 3.24Å; M214-W301 HydrophobicContact CG-CD2 4.18Å; M214-W301 HydrophobicContact CG-CE3 4.45Å; M214-W301 HydrophobicContact CG-CZ2 4.44Å; M214-T303 PolarHBondContact N-O 3.15Å; M214-A304 HydrophobicContact CB-CB 4.13Å; M214-A304 CarbonylContact O-C 3.43Å; M214-A304 WeakPolarHBondContact O-CA 3.39Å; M214-I305 PolarHBondContact O-N 2.86Å
215	V	95.9	Very high	89.6	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123	177	177.1	0	0	0	0	109.4	V213 L233 M237 V257 G259 F260 M261 F307	V213-V215 HydrophobicContact CG1-CG2 4.19Å; V215-L233 HydrophobicContact CG1-CB 4.25Å; V215-L233 HydrophobicContact CG1-CD1 4.01Å; V215-M237 HydrophobicContact CG2-CE 4.47Å; V215-M237 HydrophobicContact CG2-CG 3.88Å; V215-M237 HydrophobicContact CG2-SD 4.16Å; V215-V257 HydrophobicContact CG2-CG1 3.87Å; V215-V257 HydrophobicContact CG2-CG2 4.17Å; V215-G259 PolarHBondContact N-O 3.24Å; V215-F260 HydrophobicContact CB-CD2 4.01Å; V215-F260 HydrophobicContact CG1-CD2 3.86Å; V215-F260 HydrophobicContact CG1-CE2 3.96Å; V215-F260 CarbonylContact O-C 3.59Å; V215-F260 WeakPolarHBondContact O-CA 3.19Å; V215-M261 PolarHBondContact O-N 3.36Å; V215-F307 HydrophobicContact CG1-CD2 4.08Å; V215-F307 HydrophobicContact CG1-CE2 3.99Å
216	V	96.1	Very high	90.6	Very high	1 Å²	1	26 Å²	26	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.1	-178.4	-172.3	0	0	0	0	109.3	M214 M261 I263 F283 W286 I305 L306 F307	M214-V216 HydrophobicContact CG-CG2 3.87Å; V216-M261 CarbonylContact C-O 3.54Å; V216-M261 WeakPolarHBondContact CA-O 3.48Å; V216-I263 HydrophobicContact CG1-CD1 3.66Å; V216-I263 HydrophobicContact CG1-CG1 4.06Å; V216-F283 HydrophobicContact CB-CE2 4.06Å; V216-F283 HydrophobicContact CB-CZ 4.23Å; V216-F283 HydrophobicContact CG1-CE2 4.28Å; V216-F283 HydrophobicContact CG2-CE2 3.94Å; V216-F283 HydrophobicContact CG2-CZ 4.01Å; V216-W286 HydrophobicContact CG1-CH2 4.17Å; V216-W286 HydrophobicContact CG1-CZ3 4.16Å; V216-W286 HydrophobicContact CG2-CZ3 4.22Å; V216-I305 PolarHBondContact N-O 2.95Å; V216-L306 HydrophobicContact CB-CD1 4.13Å; V216-L306 HydrophobicContact CG1-CD1 3.83Å; V216-L306 CarbonylContact O-C 3.51Å; V216-L306 WeakPolarHBondContact O-CA 3.45Å; V216-F307 PolarHBondContact O-N 3.11Å
217	A	95.8	Very high	91	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.7	175	0	0	0	0	0	109.4	M221 L229 L233 M261 V262 I263	A217-M221 HydrophobicContact CB-CB 3.98Å; A217-M221 HydrophobicContact CB-CG 4.49Å; A217-L229 HydrophobicContact CB-CD1 4.28Å; A217-L229 HydrophobicContact CB-CD2 3.77Å; A217-L229 HydrophobicContact CB-CG 4.38Å; A217-L233 HydrophobicContact CB-CD1 3.67Å; A217-M261 PolarHBondContact N-O 3.29Å; A217-V262 WeakPolarHBondContact O-CA 3.24Å; A217-I263 PolarHBondContact O-N 2.9Å
218	D	94	Very high	91.1	Very high	15 Å²	15	33.8 Å²	33.8	8%	0.08	20%	0.2	C	C	.	.			trans	-79	179.7	177.1	79.5	-3	0	0	0	112.9	S220 M221 A222 I263 L306 F307 T308	D218-S220 VanDerWaalsContact CG-OG 3.25Å; D218-S220 PolarHBondContact O-N 3.08Å; D218-S220 WeakPolarHBondContact OD1-CA 3.25Å; D218-S220 WeakPolarHBondContact OD1-CB 3.26Å; D218-S220 PolarHBondContact OD1-N 3.01Å; D218-S220 PolarHBondContact OD1-OG 3.35Å; D218-S220 PolarHBondContact OD2-OG 3.21Å; D218-M221 WeakPolarHBondContact O-CB 3.29Å; D218-M221 PolarHBondContact O-N 2.99Å; D218-M221 PolarHBondContact OD1-N 2.81Å; D218-A222 PolarHBondContact O-N 3.39Å; D218-A222 VanDerWaalsContact O-N 3.15Å; D218-I263 CarbonylContact C-O 3.55Å; D218-L306 HydrophobicContact CB-CD1 4.35Å; D218-F307 PolarHBondContact N-O 3.46Å; D218-T308 WeakPolarHBondContact OD2-CB 2.96Å; D218-T308 PolarHBondContact OD2-OG1 3.16Å
219	Q	92.3	Very high	91.2	Very high	98 Å²	98	32.4 Å²	32.4	46%	0.458	19%	0.191	S	C	.	.	H	α-helix	trans	-61.2	-34.6	180	-174.8	-177.1	-1	0	0	112.2	M221 A222 A223 I263	Q219-M221 VanDerWaalsContact C-N 3.33Å; Q219-M221 PolarHBondContact O-N 2.73Å; Q219-A222 PolarHBondContact O-N 3.45Å; Q219-A223 WeakPolarHBondContact O-CB 3.33Å; Q219-A223 PolarHBondContact O-N 2.85Å; Q219-I263 WeakPolarHBondContact CA-O 3.29Å; Q219-I263 WeakPolarHBondContact CB-O 3.44Å; Q219-I263 PolarHBondContact N-O 3.09Å
220	S	91.4	Very high	91	Very high	38 Å²	38	36.9 Å²	36.9	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-66.4	-37.4	-179.8	76.7	0	0	0	0	111.7	D218 A223 F224 T308 K309	D218-S220 VanDerWaalsContact CG-OG 3.25Å; D218-S220 PolarHBondContact O-N 3.08Å; D218-S220 WeakPolarHBondContact OD1-CA 3.25Å; D218-S220 WeakPolarHBondContact OD1-CB 3.26Å; D218-S220 PolarHBondContact OD1-N 3.01Å; D218-S220 PolarHBondContact OD1-OG 3.35Å; D218-S220 PolarHBondContact OD2-OG 3.21Å; S220-A223 PolarHBondContact O-N 2.87Å; S220-F224 PolarHBondContact O-N 2.99Å; S220-F224 VanDerWaalsContact O-N 3.08Å; S220-T308 PolarHBondContact OG-OG1 3.48Å; S220-K309 PolarHBondContact OG-N 3.36Å
221	M	92.9	Very high	90.6	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-43.8	173.4	-69.5	-62.8	-68	0	0	111.9	A217 D218 Q219 A223 F224 H225 L229 Y232 L233 F307 K309 D341	A217-M221 HydrophobicContact CB-CB 3.98Å; A217-M221 HydrophobicContact CB-CG 4.49Å; D218-M221 WeakPolarHBondContact O-CB 3.29Å; D218-M221 PolarHBondContact O-N 2.99Å; D218-M221 PolarHBondContact OD1-N 2.81Å; Q219-M221 VanDerWaalsContact C-N 3.33Å; Q219-M221 PolarHBondContact O-N 2.73Å; M221-A223 VanDerWaalsContact C-N 3.33Å; M221-A223 PolarHBondContact O-N 2.88Å; M221-F224 PolarHBondContact O-N 3.29Å; M221-H225 PolarHBondContact O-CD2 2.87Å; M221-H225 PolarHBondContact O-N 3.11Å; M221-L229 HydrophobicContact CB-CD1 3.89Å; M221-L229 HydrophobicContact CB-CD2 4.38Å; M221-L229 HydrophobicContact CE-CD1 3.91Å; M221-Y232 HydrophobicContact CE-CD1 4.47Å; M221-Y232 HydrophobicContact CE-CE1 4.15Å; M221-L233 HydrophobicContact CE-CD2 3.94Å; M221-F307 HydrophobicContact CE-CB 4Å; M221-F307 HydrophobicContact CG-CB 4.18Å; M221-F307 VanDerWaalsContact CG-O 3.26Å; M221-F307 WeakPolarHBondContact CG-O 3.31Å; M221-F307 HydrophobicContact SD-CB 4.36Å; M221-K309 HydrophobicContact SD-CD 3.7Å; M221-K309 HydrophobicContact SD-CG 3.72Å; M221-D341 HydrophobicContact CE-CB 3.68Å; M221-D341 HydrophobicContact SD-CB 3.37Å; M221-D341 WeakPolarHBondContact SD-CB 3.36Å
222	A	90.9	Very high	90.3	Very high	23 Å²	23	38 Å²	38	19%	0.19	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-42.5	176.7	0	0	0	0	0	111.8	D218 Q219 G226 L229 V262	D218-A222 PolarHBondContact O-N 3.39Å; D218-A222 VanDerWaalsContact O-N 3.15Å; Q219-A222 PolarHBondContact O-N 3.45Å; A222-G226 WeakPolarHBondContact O-CA 3.19Å; A222-G226 PolarHBondContact O-N 2.99Å; A222-L229 HydrophobicContact CB-CD2 4.19Å; A222-V262 HydrophobicContact CB-CG1 3.72Å
223	A	89.6	Confident	90.2	Very high	87 Å²	87	37.6 Å²	37.6	72%	0.719	22%	0.215	S	C	*	.	H	α-helix	trans	-65.8	-38.7	178.5	0	0	0	0	0	113	Q219 S220 M221	Q219-A223 WeakPolarHBondContact O-CB 3.33Å; Q219-A223 PolarHBondContact O-N 2.85Å; S220-A223 PolarHBondContact O-N 2.87Å; M221-A223 VanDerWaalsContact C-N 3.33Å; M221-A223 PolarHBondContact O-N 2.88Å
224	F	87.7	Confident	89.8	Confident	69 Å²	69	38.6 Å²	38.6	30%	0.303	22%	0.22	S	C	.	.	H	α-helix	trans	-79.4	-45.1	-177.1	-175.3	-92.2	0	0	0	113.3	S220 M221 K309	S220-F224 PolarHBondContact O-N 2.99Å; S220-F224 VanDerWaalsContact O-N 3.08Å; M221-F224 PolarHBondContact O-N 3.29Å; F224-K309 HydrophobicContact CB-CD 4.49Å; F224-K309 HydrophobicContact CB-CG 4.09Å; F224-K309 HydrophobicContact CD1-CD 4.42Å; F224-K309 HydrophobicContact CG-CD 4.37Å; F224-K309 HydrophobicContact CG-CG 4.43Å
225	H	85.7	Confident	89.3	Confident	9 Å²	9	38 Å²	38	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-91.9	-19.5	-173	-67.5	-79.6	0	0	0	113.6	M221 D227 D228 L229 Y232 D341	M221-H225 PolarHBondContact O-CD2 2.87Å; M221-H225 PolarHBondContact O-N 3.11Å; H225-D227 PolarHBondContact O-N 2.94Å; H225-D228 PolarHBondContact O-N 2.02Å; H225-L229 HydrophobicContact CB-CB 3.75Å; H225-L229 HydrophobicContact CB-CD1 3.94Å; H225-L229 HydrophobicContact CB-CG 4.44Å; H225-Y232 AromaticContact CE1-CD1 3.41Å; H225-Y232 VanDerWaalsContact CE1-CD1 3.41Å; H225-Y232 WeakPolarHBondContact CE1-CD1 3.3Å; H225-Y232 AromaticContact CE1-CE1 3.3Å; H225-Y232 WeakPolarHBondContact CE1-CE1 3.18Å; H225-Y232 AromaticContact CE1-CG 3.83Å; H225-Y232 AromaticContact CE1-CZ 3.64Å; H225-Y232 AromaticContact ND1-CD1 3.73Å; H225-Y232 AromaticContact ND1-CG 3.85Å; H225-Y232 AromaticContact NE2-CD1 3.69Å; H225-Y232 AromaticContact NE2-CE1 3.45Å; H225-Y232 WeakPolarHBondContact NE2-CE1 3.24Å; H225-D341 IonicContact CE1-OD2 2.79Å; H225-D341 IonicContact NE2-OD2 3.09Å; H225-D341 PolarHBondContact NE2-OD2 3.31Å
226	G	87.9	Confident	88.9	Confident	40 Å²	40	38.1 Å²	38.1	41%	0.412	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	56.4	-136	-178.1	0	0	0	0	0	112.4	A222 D228 L229	A222-G226 WeakPolarHBondContact O-CA 3.19Å; A222-G226 PolarHBondContact O-N 2.99Å; G226-D228 PolarHBondContact O-N 2.84Å; G226-L229 VanDerWaalsContact O-CB 3.31Å; G226-L229 WeakPolarHBondContact O-CB 3.07Å; G226-L229 PolarHBondContact O-N 2.74Å
227	D	84.9	Confident	88.5	Confident	176 Å²	176	38 Å²	38	94%	0.941	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-65	-21.6	-178	-62.4	-31.3	0	0	0	113.5	H225 L229	H225-D227 PolarHBondContact O-N 2.94Å; D227-L229 VanDerWaalsContact C-N 3.3Å; D227-L229 PolarHBondContact O-N 3.36Å
228	D	83.5	Confident	88	Confident	44 Å²	44	38.4 Å²	38.4	24%	0.235	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-78.9	-10.7	179.4	-168.7	35.3	0	0	0	112.9	H225 G226 K230 H231 Y232 R437	H225-D228 PolarHBondContact O-N 2.02Å; G226-D228 PolarHBondContact O-N 2.84Å; D228-K230 VanDerWaalsContact C-N 3.31Å; D228-K230 PolarHBondContact O-N 3.11Å; D228-H231 PolarHBondContact O-N 3.02Å; D228-H231 VanDerWaalsContact O-N 3.08Å; D228-H231 IonicContact OD1-CD2 2.92Å; D228-H231 PolarHBondContact OD1-CD2 3.31Å; D228-H231 VanDerWaalsContact OD1-CD2 3.28Å; D228-H231 IonicContact OD1-CG 2.77Å; D228-Y232 WeakPolarHBondContact O-CB 3.03Å; D228-Y232 PolarHBondContact O-N 3.27Å; D228-R437 IonicContact OD2-NH2 3.92Å; D228-R437 PolarHBondContact OD2-NH2 2.82Å
229	L	88.3	Confident	87.5	Confident	7 Å²	7	39 Å²	39	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-52.3	-45.9	-173.8	175.8	60.8	0	0	0	113.3	A217 M221 A222 H225 G226 D227 Y232 L233 F260 V262	A217-L229 HydrophobicContact CB-CD1 4.28Å; A217-L229 HydrophobicContact CB-CD2 3.77Å; A217-L229 HydrophobicContact CB-CG 4.38Å; M221-L229 HydrophobicContact CB-CD1 3.89Å; M221-L229 HydrophobicContact CB-CD2 4.38Å; M221-L229 HydrophobicContact CE-CD1 3.91Å; A222-L229 HydrophobicContact CB-CD2 4.19Å; H225-L229 HydrophobicContact CB-CB 3.75Å; H225-L229 HydrophobicContact CB-CD1 3.94Å; H225-L229 HydrophobicContact CB-CG 4.44Å; G226-L229 VanDerWaalsContact O-CB 3.31Å; G226-L229 WeakPolarHBondContact O-CB 3.07Å; G226-L229 PolarHBondContact O-N 2.74Å; D227-L229 VanDerWaalsContact C-N 3.3Å; D227-L229 PolarHBondContact O-N 3.36Å; L229-Y232 PolarHBondContact O-N 2.06Å; L229-L233 HydrophobicContact CD1-CD1 3.76Å; L229-L233 HydrophobicContact CD1-CG 3.96Å; L229-L233 HydrophobicContact CG-CD1 4.29Å; L229-L233 PolarHBondContact O-N 2.88Å; L229-F260 HydrophobicContact CG-CZ 4.41Å; L229-V262 HydrophobicContact CD2-CG1 3.93Å; L229-V262 HydrophobicContact CD2-CG2 4.02Å
230	K	86.2	Confident	87.3	Confident	109 Å²	109	34.4 Å²	34.4	47%	0.474	20%	0.203	S	C	.	.	H	α-helix	trans	-66	-42.2	-178.1	-175.8	178.4	178.6	-178.7	0	111.4	D228 L234 F260	D228-K230 VanDerWaalsContact C-N 3.31Å; D228-K230 PolarHBondContact O-N 3.11Å; K230-L234 HydrophobicContact CG-CD1 4.11Å; K230-L234 WeakPolarHBondContact O-CB 3.18Å; K230-L234 WeakPolarHBondContact O-CG 3.08Å; K230-L234 PolarHBondContact O-N 3.33Å; K230-F260 HydrophobicContact CB-CE1 3.9Å; K230-F260 HydrophobicContact CB-CZ 3.9Å; K230-F260 HydrophobicContact CD-CD1 4.37Å; K230-F260 HydrophobicContact CD-CE1 4.38Å; K230-F260 HydrophobicContact CG-CD1 4.15Å; K230-F260 HydrophobicContact CG-CE1 3.9Å; K230-F260 HydrophobicContact CG-CE2 4.41Å; K230-F260 HydrophobicContact CG-CG 4.48Å; K230-F260 HydrophobicContact CG-CZ 4.07Å
231	H	84	Confident	87.2	Confident	57 Å²	57	32.9 Å²	32.9	26%	0.264	19%	0.193	S	C	.	.	H	α-helix	trans	-67.4	-41.4	178.2	177.6	62.1	0	0	0	111.2	D228 T235 Q425 Y433	D228-H231 PolarHBondContact O-N 3.02Å; D228-H231 VanDerWaalsContact O-N 3.08Å; D228-H231 IonicContact OD1-CD2 2.92Å; D228-H231 PolarHBondContact OD1-CD2 3.31Å; D228-H231 VanDerWaalsContact OD1-CD2 3.28Å; D228-H231 IonicContact OD1-CG 2.77Å; H231-T235 PolarHBondContact O-N 2.9Å; H231-T235 PolarHBondContact O-OG1 2.83Å; H231-Q425 PolarHBondContact CE1-NE2 3.44Å; H231-Q425 PolarHBondContact CE1-OE1 2.92Å; H231-Q425 PolarHBondContact ND1-NE2 3.25Å; H231-Q425 PolarHBondContact ND1-OE1 3.37Å; H231-Y433 AromaticContact CD2-CZ 3.81Å; H231-Y433 PolarHBondContact CD2-OH 3.07Å
232	Y	87.1	Confident	86.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-55.4	175.3	175.8	-104.7	0	0	0	113.1	M221 H225 D228 L229 L234 T235 L236 D341 G343 L344 Y433 L441	M221-Y232 HydrophobicContact CE-CD1 4.47Å; M221-Y232 HydrophobicContact CE-CE1 4.15Å; H225-Y232 AromaticContact CE1-CD1 3.41Å; H225-Y232 VanDerWaalsContact CE1-CD1 3.41Å; H225-Y232 WeakPolarHBondContact CE1-CD1 3.3Å; H225-Y232 AromaticContact CE1-CE1 3.3Å; H225-Y232 WeakPolarHBondContact CE1-CE1 3.18Å; H225-Y232 AromaticContact CE1-CG 3.83Å; H225-Y232 AromaticContact CE1-CZ 3.64Å; H225-Y232 AromaticContact ND1-CD1 3.73Å; H225-Y232 AromaticContact ND1-CG 3.85Å; H225-Y232 AromaticContact NE2-CD1 3.69Å; H225-Y232 AromaticContact NE2-CE1 3.45Å; H225-Y232 WeakPolarHBondContact NE2-CE1 3.24Å; D228-Y232 WeakPolarHBondContact O-CB 3.03Å; D228-Y232 PolarHBondContact O-N 3.27Å; L229-Y232 PolarHBondContact O-N 2.06Å; Y232-L234 PolarHBondContact O-N 2.03Å; Y232-T235 WeakPolarHBondContact O-CA 3.08Å; Y232-T235 VanDerWaalsContact O-CB 3.32Å; Y232-T235 WeakPolarHBondContact O-CB 3.48Å; Y232-T235 PolarHBondContact O-N 3.46Å; Y232-L236 HydrophobicContact CD1-CD1 4.49Å; Y232-L236 HydrophobicContact CE1-CD1 3.77Å; Y232-L236 HydrophobicContact CE1-CG 4.29Å; Y232-L236 HydrophobicContact CE2-CD2 4.18Å; Y232-L236 HydrophobicContact CE2-CG 4.47Å; Y232-L236 PolarHBondContact O-N 3.17Å; Y232-D341 WeakPolarHBondContact CE1-OD1 3.32Å; Y232-D341 VanDerWaalsContact CZ-OD1 3.27Å; Y232-D341 PolarHBondContact OH-OD1 3.41Å; Y232-G343 WeakPolarHBondContact OH-CA 3.34Å; Y232-G343 PolarHBondContact OH-N 3.17Å; Y232-G343 PolarHBondContact OH-O 2.94Å; Y232-L344 HydrophobicContact CD2-CD2 4.41Å; Y232-L344 HydrophobicContact CE2-CD2 3.97Å; Y232-Y433 WeakPolarHBondContact CA-OH 3.3Å; Y232-Y433 HydrophobicContact CD2-CE1 4.29Å; Y232-Y433 PolarHBondContact N-OH 2.82Å; Y232-Y433 VanDerWaalsContact N-OH 3.16Å; Y232-L441 HydrophobicContact CD2-CD1 4.15Å; Y232-L441 HydrophobicContact CD2-CD2 4.02Å; Y232-L441 HydrophobicContact CE2-CD1 3.91Å; Y232-L441 HydrophobicContact CE2-CD2 3.85Å; Y232-L441 HydrophobicContact CE2-CG 4.37Å
233	L	90.2	Very high	86.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-37.3	-178.9	-71.5	-178.2	0	0	0	112.9	V215 A217 M221 L229 T235 L236 M237 F260 F307	V215-L233 HydrophobicContact CG1-CB 4.25Å; V215-L233 HydrophobicContact CG1-CD1 4.01Å; A217-L233 HydrophobicContact CB-CD1 3.67Å; M221-L233 HydrophobicContact CE-CD2 3.94Å; L229-L233 HydrophobicContact CD1-CD1 3.76Å; L229-L233 HydrophobicContact CD1-CG 3.96Å; L229-L233 HydrophobicContact CG-CD1 4.29Å; L229-L233 PolarHBondContact O-N 2.88Å; L233-T235 PolarHBondContact O-N 2.89Å; L233-L236 HydrophobicContact CD2-CD1 3.95Å; L233-L236 PolarHBondContact O-N 2.79Å; L233-M237 WeakPolarHBondContact O-CG 3.37Å; L233-M237 PolarHBondContact O-N 2.98Å; L233-F260 HydrophobicContact CB-CE2 4.01Å; L233-F260 HydrophobicContact CD1-CE2 3.77Å; L233-F260 HydrophobicContact CD1-CZ 4.16Å; L233-F260 HydrophobicContact CG-CE2 4.49Å; L233-F307 HydrophobicContact CD1-CB 4.46Å; L233-F307 HydrophobicContact CD1-CD2 4.24Å; L233-F307 HydrophobicContact CD1-CG 4.46Å; L233-F307 HydrophobicContact CD2-CB 4.02Å; L233-F307 HydrophobicContact CD2-CD1 3.72Å; L233-F307 HydrophobicContact CD2-CD2 3.75Å; L233-F307 HydrophobicContact CD2-CE1 4.08Å; L233-F307 HydrophobicContact CD2-CE2 4.11Å; L233-F307 HydrophobicContact CD2-CG 3.54Å; L233-F307 HydrophobicContact CD2-CZ 4.26Å
234	L	86.9	Confident	86.5	Confident	21 Å²	21	34 Å²	34	11%	0.11	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-29.7	173.7	-68.5	175.6	0	0	0	112.2	K230 Y232 S238 V257 L422 L424	K230-L234 HydrophobicContact CG-CD1 4.11Å; K230-L234 WeakPolarHBondContact O-CB 3.18Å; K230-L234 WeakPolarHBondContact O-CG 3.08Å; K230-L234 PolarHBondContact O-N 3.33Å; Y232-L234 PolarHBondContact O-N 2.03Å; L234-S238 WeakPolarHBondContact O-CB 3.29Å; L234-S238 PolarHBondContact O-N 2.93Å; L234-V257 HydrophobicContact CD2-CG1 4.26Å; L234-L422 HydrophobicContact CD2-CD1 4.43Å; L234-L424 HydrophobicContact CB-CD2 4.48Å; L234-L424 HydrophobicContact CD2-CD2 4.02Å
235	T	83.3	Confident	86.4	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-68.7	-44.1	173	-58.8	0	0	0	0	111.4	H231 Y232 L233 M237 S238 V239 P429 Y433	H231-T235 PolarHBondContact O-N 2.9Å; H231-T235 PolarHBondContact O-OG1 2.83Å; Y232-T235 WeakPolarHBondContact O-CA 3.08Å; Y232-T235 VanDerWaalsContact O-CB 3.32Å; Y232-T235 WeakPolarHBondContact O-CB 3.48Å; Y232-T235 PolarHBondContact O-N 3.46Å; L233-T235 PolarHBondContact O-N 2.89Å; T235-M237 VanDerWaalsContact C-N 3.32Å; T235-M237 PolarHBondContact O-N 2.73Å; T235-S238 WeakPolarHBondContact O-CB 3.07Å; T235-S238 PolarHBondContact O-N 3.37Å; T235-V239 PolarHBondContact O-N 3.04Å; T235-V239 VanDerWaalsContact O-N 3.13Å; T235-P429 HydrophobicContact CG2-CB 3.68Å; T235-P429 HydrophobicContact CG2-CG 3.99Å; T235-Y433 HydrophobicContact CG2-CD2 4.15Å; T235-Y433 HydrophobicContact CG2-CE2 3.68Å; T235-Y433 WeakPolarHBondContact OG1-CE2 3.39Å
236	L	87.4	Confident	86.4	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-58.5	-46.3	174.5	-58.8	-172.4	0	0	0	111.2	Y232 L233 S238 V239 A240 F307 L344 A347	Y232-L236 HydrophobicContact CD1-CD1 4.49Å; Y232-L236 HydrophobicContact CE1-CD1 3.77Å; Y232-L236 HydrophobicContact CE1-CG 4.29Å; Y232-L236 HydrophobicContact CE2-CD2 4.18Å; Y232-L236 HydrophobicContact CE2-CG 4.47Å; Y232-L236 PolarHBondContact O-N 3.17Å; L233-L236 HydrophobicContact CD2-CD1 3.95Å; L233-L236 PolarHBondContact O-N 2.79Å; L236-S238 VanDerWaalsContact C-N 3.32Å; L236-S238 PolarHBondContact O-N 2.74Å; L236-V239 PolarHBondContact O-N 3.39Å; L236-A240 PolarHBondContact O-N 3.45Å; L236-F307 HydrophobicContact CD1-CD1 4.39Å; L236-F307 HydrophobicContact CD1-CE1 3.89Å; L236-L344 HydrophobicContact CD2-CD2 4.01Å; L236-A347 HydrophobicContact CB-CB 4.22Å; L236-A347 HydrophobicContact CD2-CB 4.18Å; L236-A347 WeakPolarHBondContact O-CB 3.26Å
237	M	89.4	Confident	86.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-34.6	177.5	-67.1	-53.8	-61.5	0	0	112.7	V213 V215 L233 T235 A240 A241 I255 V257 I305 F307 T350 L424	V213-M237 HydrophobicContact CB-CE 4.32Å; V213-M237 HydrophobicContact CG1-CE 3.92Å; V213-M237 HydrophobicContact CG2-CE 4.33Å; V215-M237 HydrophobicContact CG2-CE 4.47Å; V215-M237 HydrophobicContact CG2-CG 3.88Å; V215-M237 HydrophobicContact CG2-SD 4.16Å; L233-M237 WeakPolarHBondContact O-CG 3.37Å; L233-M237 PolarHBondContact O-N 2.98Å; T235-M237 VanDerWaalsContact C-N 3.32Å; T235-M237 PolarHBondContact O-N 2.73Å; M237-A240 PolarHBondContact O-N 2.79Å; M237-A241 VanDerWaalsContact O-CB 3.22Å; M237-A241 WeakPolarHBondContact O-CB 3.48Å; M237-A241 PolarHBondContact O-N 3.32Å; M237-I255 HydrophobicContact CE-CG2 3.87Å; M237-V257 HydrophobicContact CB-CG2 4.04Å; M237-V257 HydrophobicContact CE-CG2 4.23Å; M237-V257 HydrophobicContact CG-CG2 4.1Å; M237-I305 HydrophobicContact CE-CD1 4.05Å; M237-I305 HydrophobicContact SD-CD1 4.22Å; M237-F307 HydrophobicContact SD-CZ 4.35Å; M237-T350 HydrophobicContact CE-CG2 4.47Å; M237-T350 HydrophobicContact SD-CG2 3.81Å; M237-L424 HydrophobicContact CB-CD2 4.05Å
238	S	84.3	Confident	86.2	Confident	8 Å²	8	29 Å²	29	6%	0.056	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-42.7	174	-179	0	0	0	0	111.8	L234 T235 L236 A241 R242 Q425	L234-S238 WeakPolarHBondContact O-CB 3.29Å; L234-S238 PolarHBondContact O-N 2.93Å; T235-S238 WeakPolarHBondContact O-CB 3.07Å; T235-S238 PolarHBondContact O-N 3.37Å; L236-S238 VanDerWaalsContact C-N 3.32Å; L236-S238 PolarHBondContact O-N 2.74Å; S238-A241 PolarHBondContact O-N 2.87Å; S238-R242 VanDerWaalsContact O-CG 3.32Å; S238-R242 WeakPolarHBondContact O-CG 3.36Å; S238-R242 PolarHBondContact O-N 2.91Å; S238-Q425 PolarHBondContact OG-O 3.23Å
239	V	83.6	Confident	86.4	Confident	28 Å²	28	26.9 Å²	26.9	17%	0.17	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-47.1	176	175.2	0	0	0	0	110.9	T235 L236 A241 R242 L243 A347 P429	T235-V239 PolarHBondContact O-N 3.04Å; T235-V239 VanDerWaalsContact O-N 3.13Å; L236-V239 PolarHBondContact O-N 3.39Å; V239-A241 VanDerWaalsContact C-N 3.34Å; V239-A241 PolarHBondContact O-N 3.43Å; V239-R242 WeakPolarHBondContact O-CB 3.45Å; V239-R242 PolarHBondContact O-N 2.94Å; V239-R242 VanDerWaalsContact O-N 3.15Å; V239-L243 HydrophobicContact CG1-CD1 4.36Å; V239-L243 WeakPolarHBondContact O-CG 3.27Å; V239-L243 PolarHBondContact O-N 2.79Å; V239-A347 HydrophobicContact CB-CB 3.66Å; V239-A347 HydrophobicContact CG1-CB 3.65Å; V239-A347 HydrophobicContact CG2-CB 4.48Å; V239-P429 HydrophobicContact CG2-CG 3.33Å
240	A	89.3	Confident	86.3	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.7	-44.5	175.7	0	0	0	0	0	111.8	L236 M237 R242 L243 Y244 T350 A351	L236-A240 PolarHBondContact O-N 3.45Å; M237-A240 PolarHBondContact O-N 2.79Å; A240-R242 VanDerWaalsContact C-N 3.31Å; A240-R242 PolarHBondContact O-N 2.81Å; A240-L243 WeakPolarHBondContact O-CB 3.08Å; A240-L243 PolarHBondContact O-N 2.89Å; A240-L243 VanDerWaalsContact O-N 3.16Å; A240-Y244 WeakPolarHBondContact O-CD2 3.5Å; A240-Y244 PolarHBondContact O-N 3.32Å; A240-Y244 VanDerWaalsContact O-N 3.11Å; A240-T350 HydrophobicContact CB-CG2 4.13Å; A240-A351 HydrophobicContact CB-CB 4.43Å
241	A	88.6	Confident	86.3	Confident	7 Å²	7	24.1 Å²	24.1	6%	0.058	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-37	176.2	0	0	0	0	0	112.7	M237 S238 V239 Y244 K245 I255 L424	M237-A241 VanDerWaalsContact O-CB 3.22Å; M237-A241 WeakPolarHBondContact O-CB 3.48Å; M237-A241 PolarHBondContact O-N 3.32Å; S238-A241 PolarHBondContact O-N 2.87Å; V239-A241 VanDerWaalsContact C-N 3.34Å; V239-A241 PolarHBondContact O-N 3.43Å; A241-Y244 PolarHBondContact O-N 3.46Å; A241-K245 WeakPolarHBondContact O-CG 2.96Å; A241-K245 PolarHBondContact O-N 3.43Å; A241-K245 VanDerWaalsContact O-N 3.16Å; A241-I255 HydrophobicContact CB-CB 3.94Å; A241-I255 HydrophobicContact CB-CG1 4.48Å; A241-L424 HydrophobicContact CB-CD1 4.01Å
242	R	82.6	Confident	86.5	Confident	109 Å²	109	21.8 Å²	21.8	41%	0.411	11%	0.108	S	C	.	.	H	α-helix	trans	-67.1	-39.1	174.6	-74.5	171.9	118.3	132.4	5.5	112.1	S238 V239 A240 Y244 K245 H246 D426 S427	S238-R242 VanDerWaalsContact O-CG 3.32Å; S238-R242 WeakPolarHBondContact O-CG 3.36Å; S238-R242 PolarHBondContact O-N 2.91Å; V239-R242 WeakPolarHBondContact O-CB 3.45Å; V239-R242 PolarHBondContact O-N 2.94Å; V239-R242 VanDerWaalsContact O-N 3.15Å; A240-R242 VanDerWaalsContact C-N 3.31Å; A240-R242 PolarHBondContact O-N 2.81Å; R242-Y244 VanDerWaalsContact C-N 3.35Å; R242-K245 PolarHBondContact O-N 2.87Å; R242-H246 PolarHBondContact O-N 3.42Å; R242-D426 PolarHBondContact NH1-O 3.29Å; R242-D426 PolarHBondContact NH2-O 2.98Å; R242-S427 PolarHBondContact NH1-O 3.26Å
243	L	86.2	Confident	86.7	Confident	24 Å²	24	21.9 Å²	21.9	13%	0.126	11%	0.108	C	C	.	.	H	α-helix	trans	-61.9	-42.1	175.7	-68.8	166.8	0	0	0	111.4	V239 A240 K245 H246 F348 A351 M380 P393 W394	V239-L243 HydrophobicContact CG1-CD1 4.36Å; V239-L243 WeakPolarHBondContact O-CG 3.27Å; V239-L243 PolarHBondContact O-N 2.79Å; A240-L243 WeakPolarHBondContact O-CB 3.08Å; A240-L243 PolarHBondContact O-N 2.89Å; A240-L243 VanDerWaalsContact O-N 3.16Å; L243-K245 VanDerWaalsContact C-N 3.29Å; L243-K245 PolarHBondContact O-N 2.86Å; L243-H246 VanDerWaalsContact O-CB 3.23Å; L243-H246 WeakPolarHBondContact O-CB 3.38Å; L243-H246 PolarHBondContact O-N 3.28Å; L243-H246 VanDerWaalsContact O-N 3.17Å; L243-F348 HydrophobicContact CD1-CD1 3.85Å; L243-F348 HydrophobicContact CD1-CE1 4.01Å; L243-F348 HydrophobicContact CD2-CE1 4.27Å; L243-A351 HydrophobicContact CB-CB 4.47Å; L243-A351 HydrophobicContact CD1-CB 3.8Å; L243-M380 HydrophobicContact CB-CE 4.47Å; L243-M380 HydrophobicContact CD1-CE 3.62Å; L243-M380 HydrophobicContact CD1-SD 4.36Å; L243-M380 HydrophobicContact CD2-CE 3.73Å; L243-M380 HydrophobicContact CG-CE 4.13Å; L243-P393 HydrophobicContact CD2-CB 4.15Å; L243-P393 HydrophobicContact CD2-CG 4.48Å; L243-W394 PolarHBondContact O-NE1 2.74Å
244	Y	90.1	Very high	86.7	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71.7	-17.8	175.4	-83.9	-75.8	0	0	0	114.8	A240 A241 R242 H246 I253 I255 A351 L354 G355 F358 W394	A240-Y244 WeakPolarHBondContact O-CD2 3.5Å; A240-Y244 PolarHBondContact O-N 3.32Å; A240-Y244 VanDerWaalsContact O-N 3.11Å; A241-Y244 PolarHBondContact O-N 3.46Å; R242-Y244 VanDerWaalsContact C-N 3.35Å; Y244-H246 VanDerWaalsContact C-N 3.34Å; Y244-I253 HydrophobicContact CD1-CB 4.36Å; Y244-I253 HydrophobicContact CD1-CD1 4.03Å; Y244-I253 HydrophobicContact CD1-CG2 3.98Å; Y244-I253 HydrophobicContact CG-CG2 4.29Å; Y244-I255 HydrophobicContact CD2-CD1 3.98Å; Y244-I255 HydrophobicContact CD2-CG1 3.81Å; Y244-I255 HydrophobicContact CE2-CD1 4.43Å; Y244-I255 HydrophobicContact CG-CD1 4.12Å; Y244-I255 HydrophobicContact CG-CG1 4.08Å; Y244-A351 HydrophobicContact CE2-CB 4.18Å; Y244-A351 PolarHBondContact OH-O 2.75Å; Y244-L354 HydrophobicContact CE2-CB 3.84Å; Y244-L354 HydrophobicContact CE2-CD1 3.93Å; Y244-L354 WeakPolarHBondContact OH-CB 3.3Å; Y244-G355 WeakPolarHBondContact OH-CA 3.41Å; Y244-G355 PolarHBondContact OH-N 2.87Å; Y244-F358 HydrophobicContact CD1-CE2 4.46Å; Y244-F358 AromaticContact CE1-CD2 3.91Å; Y244-F358 HydrophobicContact CE1-CD2 3.91Å; Y244-F358 AromaticContact CE1-CE2 3.86Å; Y244-F358 HydrophobicContact CE1-CE2 3.86Å; Y244-W394 HydrophobicContact CD1-CH2 4.34Å; Y244-W394 AromaticContact CD1-CZ2 3.84Å; Y244-W394 HydrophobicContact CD1-CZ2 3.84Å; Y244-W394 HydrophobicContact CD2-CZ2 4.23Å; Y244-W394 AromaticContact CE1-CH2 3.63Å; Y244-W394 HydrophobicContact CE1-CH2 3.63Å; Y244-W394 AromaticContact CE1-CZ2 3.62Å; Y244-W394 HydrophobicContact CE1-CZ2 3.62Å; Y244-W394 HydrophobicContact CE2-CH2 4.12Å; Y244-W394 HydrophobicContact CE2-CZ2 4.04Å; Y244-W394 HydrophobicContact CG-CZ2 4.14Å; Y244-W394 AromaticContact CZ-CH2 3.5Å; Y244-W394 AromaticContact CZ-CZ2 3.72Å
245	K	85.3	Confident	86.9	Confident	105 Å²	105	22.9 Å²	22.9	46%	0.457	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.4	170.9	-76.1	-179.7	178.5	175.7	0	113.3	A241 R242 L243	A241-K245 WeakPolarHBondContact O-CG 2.96Å; A241-K245 PolarHBondContact O-N 3.43Å; A241-K245 VanDerWaalsContact O-N 3.16Å; R242-K245 PolarHBondContact O-N 2.87Å; L243-K245 VanDerWaalsContact C-N 3.29Å; L243-K245 PolarHBondContact O-N 2.86Å
246	H	85.2	Confident	87.3	Confident	38 Å²	38	23.1 Å²	23.1	18%	0.176	12%	0.115	C	C	.	.	S	Bend	trans	-67.3	134	-177.6	-166.7	-86.6	0	0	0	111.3	R242 L243 Y244 S248 I249 S391 P393	R242-H246 PolarHBondContact O-N 3.42Å; L243-H246 VanDerWaalsContact O-CB 3.23Å; L243-H246 WeakPolarHBondContact O-CB 3.38Å; L243-H246 PolarHBondContact O-N 3.28Å; L243-H246 VanDerWaalsContact O-N 3.17Å; Y244-H246 VanDerWaalsContact C-N 3.34Å; H246-S248 WeakPolarHBondContact ND1-CB 3.03Å; H246-S248 PolarHBondContact ND1-N 2.93Å; H246-S248 PolarHBondContact ND1-OG 3.18Å; H246-S248 PolarHBondContact O-N 2.99Å; H246-I249 VanDerWaalsContact O-CG2 3.27Å; H246-I249 WeakPolarHBondContact O-CG2 3.35Å; H246-I249 PolarHBondContact O-N 3.01Å; H246-S391 PolarHBondContact CE1-O 2.79Å; H246-S391 PolarHBondContact NE2-O 3.45Å; H246-P393 HydrophobicContact CB-CG 3.89Å; H246-P393 WeakPolarHBondContact ND1-CD 3.27Å
247	P	83.4	Confident	87.4	Confident	25 Å²	25	23.1 Å²	23.1	16%	0.162	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-60	-22.9	-173.7	22.9	-35.4	0	0	0	114.5	I249 L250 V540 P541	P247-I249 PolarHBondContact O-N 3.09Å; P247-I249 VanDerWaalsContact O-N 3.12Å; P247-L250 PolarHBondContact O-N 3.44Å; P247-V540 HydrophobicContact CB-CG1 3.85Å; P247-V540 HydrophobicContact CG-CG1 3.76Å; P247-P541 HydrophobicContact CB-CG 4.38Å
248	S	85.8	Confident	87.5	Confident	20 Å²	20	24.1 Å²	24.1	14%	0.14	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-61.2	-18.3	178.2	65.9	0	0	0	0	114.5	H246 L250 W394 A399	H246-S248 WeakPolarHBondContact ND1-CB 3.03Å; H246-S248 PolarHBondContact ND1-N 2.93Å; H246-S248 PolarHBondContact ND1-OG 3.18Å; H246-S248 PolarHBondContact O-N 2.99Å; S248-L250 VanDerWaalsContact C-N 3.27Å; S248-W394 PolarHBondContact OG-N 3Å; S248-A399 WeakPolarHBondContact O-CB 3.49Å
249	I	87.3	Confident	87.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-78.3	-11.9	174.6	-159.9	51	0	0	0	113.2	H246 P247 N251 I253 M360 W394 I402	H246-I249 VanDerWaalsContact O-CG2 3.27Å; H246-I249 WeakPolarHBondContact O-CG2 3.35Å; H246-I249 PolarHBondContact O-N 3.01Å; P247-I249 PolarHBondContact O-N 3.09Å; P247-I249 VanDerWaalsContact O-N 3.12Å; I249-N251 WeakPolarHBondContact CG2-O 3.42Å; I249-N251 PolarHBondContact O-N 3.37Å; I249-N251 VanDerWaalsContact O-N 3.09Å; I249-N251 PolarHBondContact O-ND2 2.86Å; I249-I253 HydrophobicContact CG1-CD1 4.03Å; I249-M360 HydrophobicContact CD1-CE 3.71Å; I249-W394 HydrophobicContact CB-CB 4.47Å; I249-W394 HydrophobicContact CB-CG 4.01Å; I249-W394 HydrophobicContact CD1-CB 4.01Å; I249-W394 HydrophobicContact CD1-CD2 3.54Å; I249-W394 HydrophobicContact CD1-CE3 3.79Å; I249-W394 HydrophobicContact CD1-CG 3.65Å; I249-W394 HydrophobicContact CD1-CZ3 4.45Å; I249-W394 HydrophobicContact CG1-CD2 4.32Å; I249-W394 HydrophobicContact CG1-CG 4.27Å; I249-I402 HydrophobicContact CD1-CG2 3.85Å; I249-I402 HydrophobicContact CG1-CG2 4.23Å
250	L	86.1	Confident	88	Confident	51 Å²	51	25.3 Å²	25.3	27%	0.267	13%	0.126	S	C	.	.			trans	56.4	21.2	178.3	-55.9	177.8	0	0	0	115.7	P247 S248 A399 Y547	P247-L250 PolarHBondContact O-N 3.44Å; S248-L250 VanDerWaalsContact C-N 3.27Å; L250-A399 HydrophobicContact CB-CB 4.29Å; L250-A399 HydrophobicContact CD1-CB 3.98Å; L250-A399 HydrophobicContact CG-CB 4.07Å; L250-Y547 WeakPolarHBondContact CA-OH 3.43Å; L250-Y547 PolarHBondContact O-OH 3.02Å
251	N	86.7	Confident	88.2	Confident	7 Å²	7	28.5 Å²	28.5	4%	0.037	14%	0.142	C	C	.	.	S	Bend	trans	-143.1	151.6	-178.3	-70	-87.9	0	0	0	111	I249 I253 T403 L406 R552	I249-N251 WeakPolarHBondContact CG2-O 3.42Å; I249-N251 PolarHBondContact O-N 3.37Å; I249-N251 VanDerWaalsContact O-N 3.09Å; I249-N251 PolarHBondContact O-ND2 2.86Å; N251-I253 HydrophobicContact CB-CD1 4.01Å; N251-I253 HydrophobicContact CB-CG1 4.16Å; N251-I253 PolarHBondContact O-N 3.47Å; N251-T403 PolarHBondContact ND2-OG1 3.42Å; N251-L406 HydrophobicContact CB-CD1 4.14Å; N251-R552 PolarHBondContact OD1-NH1 3.3Å
252	S	88.8	Confident	88.3	Confident	8 Å²	8	30.5 Å²	30.5	6%	0.056	15%	0.153	C	C	.	.			trans	-87.7	94.4	173.7	-180	0	0	0	0	110.6	R209	R209-S252 PolarHBondContact N-O 3.44Å
253	I	90.9	Very high	88.7	Confident	2 Å²	2	26 Å²	26	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.5	179.3	-59.7	157	0	0	0	109.1	V211 Y244 I249 N251 I255 F358 I402	V211-I253 HydrophobicContact CG2-CG2 4.05Å; Y244-I253 HydrophobicContact CD1-CB 4.36Å; Y244-I253 HydrophobicContact CD1-CD1 4.03Å; Y244-I253 HydrophobicContact CD1-CG2 3.98Å; Y244-I253 HydrophobicContact CG-CG2 4.29Å; I249-I253 HydrophobicContact CG1-CD1 4.03Å; N251-I253 HydrophobicContact CB-CD1 4.01Å; N251-I253 HydrophobicContact CB-CG1 4.16Å; N251-I253 PolarHBondContact O-N 3.47Å; I253-I255 HydrophobicContact CG2-CD1 3.9Å; I253-F358 HydrophobicContact CG2-CE2 4.23Å; I253-F358 HydrophobicContact CG2-CZ 3.92Å; I253-I402 HydrophobicContact CD1-CD1 3.25Å; I253-I402 HydrophobicContact CD1-CG1 4.33Å; I253-I402 HydrophobicContact CG1-CD1 4.45Å
254	N	90.6	Very high	88.5	Confident	33 Å²	33	30.2 Å²	30.2	18%	0.176	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	110.3	177.3	-59.1	-77.7	0	0	0	108.6	R209 F210 V211 V256	R209-N254 WeakPolarHBondContact O-CB 3.34Å; R209-N254 PolarHBondContact O-N 3.05Å; R209-N254 PolarHBondContact O-ND2 3.25Å; F210-N254 CarbonylContact C-O 3.5Å; F210-N254 WeakPolarHBondContact CA-O 3.3Å; F210-N254 HydrophobicContact CD1-CB 3.84Å; F210-N254 HydrophobicContact CE1-CB 4.21Å; V211-N254 PolarHBondContact N-O 3Å; N254-V256 HydrophobicContact CB-CG2 4.48Å
255	I	90.9	Very high	87.9	Confident	9 Å²	9	35.1 Å²	35.1	5%	0.046	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.3	171.3	-50.8	-55.9	0	0	0	108.2	V211 V213 M237 A241 Y244 I253 L354	V211-I255 HydrophobicContact CB-CD1 3.8Å; V211-I255 HydrophobicContact CG1-CD1 4.31Å; V211-I255 HydrophobicContact CG2-CD1 3.75Å; V213-I255 HydrophobicContact CG2-CG2 3.72Å; M237-I255 HydrophobicContact CE-CG2 3.87Å; A241-I255 HydrophobicContact CB-CB 3.94Å; A241-I255 HydrophobicContact CB-CG1 4.48Å; Y244-I255 HydrophobicContact CD2-CD1 3.98Å; Y244-I255 HydrophobicContact CD2-CG1 3.81Å; Y244-I255 HydrophobicContact CE2-CD1 4.43Å; Y244-I255 HydrophobicContact CG-CD1 4.12Å; Y244-I255 HydrophobicContact CG-CG1 4.08Å; I253-I255 HydrophobicContact CG2-CD1 3.9Å; I255-L354 HydrophobicContact CD1-CD1 4.35Å
256	V	90.9	Very high	87.3	Confident	11 Å²	11	33.1 Å²	33.1	7%	0.067	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.3	-177.4	-173.5	0	0	0	0	109.5	F210 V211 E212 V213 N254 V258 P418 Q421	F210-V256 HydrophobicContact CD1-CG2 4.27Å; V211-V256 PolarHBondContact O-N 3.07Å; V211-V256 VanDerWaalsContact O-O 3.04Å; E212-V256 WeakPolarHBondContact CA-O 3.4Å; V213-V256 PolarHBondContact N-O 3.22Å; N254-V256 HydrophobicContact CB-CG2 4.48Å; V256-V258 HydrophobicContact CG1-CG1 4.49Å; V256-V258 PolarHBondContact O-N 3.43Å; V256-P418 HydrophobicContact CB-CG 4.04Å; V256-P418 HydrophobicContact CG1-CB 4.34Å; V256-P418 HydrophobicContact CG1-CG 3.69Å; V256-P418 HydrophobicContact CG2-CG 4.06Å; V256-Q421 HydrophobicContact CG1-CB 3.45Å; V256-Q421 VanDerWaalsContact CG1-CB 3.45Å; V256-Q421 HydrophobicContact CG1-CG 4.48Å
257	V	90.4	Very high	86.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	114.6	176.3	-177	0	0	0	0	109	V213 V215 L234 M237 G259 L422 L424	V213-V257 WeakPolarHBondContact O-CA 3.32Å; V215-V257 HydrophobicContact CG2-CG1 3.87Å; V215-V257 HydrophobicContact CG2-CG2 4.17Å; L234-V257 HydrophobicContact CD2-CG1 4.26Å; M237-V257 HydrophobicContact CB-CG2 4.04Å; M237-V257 HydrophobicContact CE-CG2 4.23Å; M237-V257 HydrophobicContact CG-CG2 4.1Å; V257-G259 WeakPolarHBondContact CG1-O 3.48Å; V257-L422 HydrophobicContact CB-CB 4.49Å; V257-L422 HydrophobicContact CG1-CD1 4.01Å; V257-L422 PolarHBondContact O-N 3Å; V257-L424 HydrophobicContact CG2-CD2 3.93Å
258	V	90.1	Very high	86.4	Confident	21 Å²	21	44.7 Å²	44.7	13%	0.127	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-24	-178.4	-65	0	0	0	0	112.4	E212 V213 V256 Y300 W301 P418	E212-V258 HydrophobicContact CB-CG1 3.74Å; E212-V258 HydrophobicContact CB-CG2 4.02Å; E212-V258 HydrophobicContact CG-CG1 3.86Å; V213-V258 PolarHBondContact O-N 3.1Å; V256-V258 HydrophobicContact CG1-CG1 4.49Å; V256-V258 PolarHBondContact O-N 3.43Å; V258-Y300 WeakPolarHBondContact CG2-O 3.46Å; V258-W301 HydrophobicContact CG2-CB 3.82Å; V258-P418 HydrophobicContact CG1-CB 3.98Å
259	G	89.1	Confident	86.3	Confident	12 Å²	12	44.4 Å²	44.4	12%	0.124	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	153.9	-179.8	0	0	0	0	0	112.9	V215 V257	V215-G259 PolarHBondContact N-O 3.24Å; V257-G259 WeakPolarHBondContact CG1-O 3.48Å
260	F	90.9	Very high	86.4	Confident	49 Å²	49	45 Å²	45	22%	0.215	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	125.5	176.7	-177	-93.3	0	0	0	108.9	V215 L229 K230 L233 V262 L422	V215-F260 HydrophobicContact CB-CD2 4.01Å; V215-F260 HydrophobicContact CG1-CD2 3.86Å; V215-F260 HydrophobicContact CG1-CE2 3.96Å; V215-F260 CarbonylContact O-C 3.59Å; V215-F260 WeakPolarHBondContact O-CA 3.19Å; L229-F260 HydrophobicContact CG-CZ 4.41Å; K230-F260 HydrophobicContact CB-CE1 3.9Å; K230-F260 HydrophobicContact CB-CZ 3.9Å; K230-F260 HydrophobicContact CD-CD1 4.37Å; K230-F260 HydrophobicContact CD-CE1 4.38Å; K230-F260 HydrophobicContact CG-CD1 4.15Å; K230-F260 HydrophobicContact CG-CE1 3.9Å; K230-F260 HydrophobicContact CG-CE2 4.41Å; K230-F260 HydrophobicContact CG-CG 4.48Å; K230-F260 HydrophobicContact CG-CZ 4.07Å; L233-F260 HydrophobicContact CB-CE2 4.01Å; L233-F260 HydrophobicContact CD1-CE2 3.77Å; L233-F260 HydrophobicContact CD1-CZ 4.16Å; L233-F260 HydrophobicContact CG-CE2 4.49Å; F260-V262 HydrophobicContact CD1-CG2 4.13Å; F260-V262 HydrophobicContact CE1-CG2 3.3Å; F260-V262 HydrophobicContact CZ-CG2 3.87Å; F260-L422 HydrophobicContact CB-CD1 4.02Å
261	M	91.8	Very high	86.5	Confident	68 Å²	68	50.8 Å²	50.8	34%	0.335	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133	-178.2	-170.4	174.5	-63	0	0	110.9	M214 V215 V216 A217 W286 L290	M214-M261 HydrophobicContact SD-CB 4.46Å; V215-M261 PolarHBondContact O-N 3.36Å; V216-M261 CarbonylContact C-O 3.54Å; V216-M261 WeakPolarHBondContact CA-O 3.48Å; A217-M261 PolarHBondContact N-O 3.29Å; M261-W286 HydrophobicContact SD-CH2 3.5Å; M261-W286 WeakPolarHBondContact SD-CH2 3.31Å; M261-W286 HydrophobicContact SD-CZ2 4.01Å; M261-L290 HydrophobicContact CE-CD1 4.39Å; M261-L290 HydrophobicContact SD-CD1 4.4Å
262	V	91.8	Very high	86.7	Confident	48 Å²	48	52.6 Å²	52.6	29%	0.291	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129	173.5	-172	0	0	0	0	108.6	A217 A222 L229 F260 N264	A217-V262 WeakPolarHBondContact O-CA 3.24Å; A222-V262 HydrophobicContact CB-CG1 3.72Å; L229-V262 HydrophobicContact CD2-CG1 3.93Å; L229-V262 HydrophobicContact CD2-CG2 4.02Å; F260-V262 HydrophobicContact CD1-CG2 4.13Å; F260-V262 HydrophobicContact CE1-CG2 3.3Å; F260-V262 HydrophobicContact CZ-CG2 3.87Å; V262-N264 WeakPolarHBondContact CG1-OD1 3.47Å
263	I	90.1	Very high	86.7	Confident	14 Å²	14	54 Å²	54	7%	0.072	29%	0.289	C	S	.	.			trans	-97.6	96.5	-179.6	-55.4	178.8	0	0	0	107.9	V216 A217 D218 Q219 E265 P270 W286	V216-I263 HydrophobicContact CG1-CD1 3.66Å; V216-I263 HydrophobicContact CG1-CG1 4.06Å; A217-I263 PolarHBondContact O-N 2.9Å; D218-I263 CarbonylContact C-O 3.55Å; Q219-I263 WeakPolarHBondContact CA-O 3.29Å; Q219-I263 WeakPolarHBondContact CB-O 3.44Å; Q219-I263 PolarHBondContact N-O 3.09Å; I263-E265 WeakPolarHBondContact CG2-O 3.39Å; I263-P270 HydrophobicContact CD1-CG 4.31Å; I263-W286 HydrophobicContact CD1-CH2 4.01Å; I263-W286 HydrophobicContact CD1-CZ2 4.04Å
264	N	81.8	Confident	86.5	Confident	114 Å²	114	56.9 Å²	56.9	61%	0.61	31%	0.309	S	S	*	.			trans	-78.8	-28.5	-179.1	-63.6	-27.5	0	0	0	112.8	V262	V262-N264 WeakPolarHBondContact CG1-OD1 3.47Å
265	E	78.7	Confident	86.1	Confident	103 Å²	103	59.1 Å²	59.1	48%	0.481	32%	0.321	S	S	.	.	S	Bend	trans	-115.7	119.1	-179.8	-67.6	171.2	-141.8	0	0	109.9	I263 D267 K268	I263-E265 WeakPolarHBondContact CG2-O 3.39Å; E265-D267 PolarHBondContact O-N 3.29Å; E265-K268 HydrophobicContact CB-CD 4.31Å; E265-K268 HydrophobicContact CB-CG 4.45Å; E265-K268 PolarHBondContact O-N 3.04Å; E265-K268 VanDerWaalsContact O-N 3.12Å; E265-K268 IonicContact OE1-NZ 2.72Å; E265-K268 PolarHBondContact OE1-NZ 2.72Å; E265-K268 VanDerWaalsContact OE2-CD 3.31Å; E265-K268 WeakPolarHBondContact OE2-CD 3.46Å; E265-K268 WeakPolarHBondContact OE2-CE 3.45Å; E265-K268 IonicContact OE2-NZ 3.64Å; E265-K268 PolarHBondContact OE2-NZ 2.83Å
266	A	71.4	Confident	85.8	Confident	62 Å²	62	58.7 Å²	58.7	51%	0.512	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-55.3	-35.5	-177.4	0	0	0	0	0	113.6	K268 G269	A266-K268 VanDerWaalsContact C-N 3.26Å; A266-K268 PolarHBondContact O-N 2.77Å; A266-G269 PolarHBondContact O-N 2.93Å; A266-G269 VanDerWaalsContact O-N 3.15Å
267	D	73.1	Confident	85.2	Confident	164 Å²	164	60.8 Å²	60.8	88%	0.877	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-69.3	-21.2	-177.5	-64.9	-35.4	0	0	0	113.9	E265	E265-D267 PolarHBondContact O-N 3.29Å
268	K	77.6	Confident	84.9	Confident	143 Å²	143	63.6 Å²	63.6	62%	0.622	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-89.2	-13.2	176.3	-68.7	177.3	178.5	153.9	0	112.5	E265 A266 W286	E265-K268 HydrophobicContact CB-CD 4.31Å; E265-K268 HydrophobicContact CB-CG 4.45Å; E265-K268 PolarHBondContact O-N 3.04Å; E265-K268 VanDerWaalsContact O-N 3.12Å; E265-K268 IonicContact OE1-NZ 2.72Å; E265-K268 PolarHBondContact OE1-NZ 2.72Å; E265-K268 VanDerWaalsContact OE2-CD 3.31Å; E265-K268 WeakPolarHBondContact OE2-CD 3.46Å; E265-K268 WeakPolarHBondContact OE2-CE 3.45Å; E265-K268 IonicContact OE2-NZ 3.64Å; E265-K268 PolarHBondContact OE2-NZ 2.83Å; A266-K268 VanDerWaalsContact C-N 3.26Å; A266-K268 PolarHBondContact O-N 2.77Å; K268-W286 PolarHBondContact O-NE1 2.7Å; K268-W286 VanDerWaalsContact O-NE1 3.13Å
269	G	83.6	Confident	84.9	Confident	13 Å²	13	62.7 Å²	62.7	13%	0.134	35%	0.347	C	S	.	.	S	Bend	trans	-96.4	178.2	-177.3	0	0	0	0	0	115.4	A266	A266-G269 PolarHBondContact O-N 2.93Å; A266-G269 VanDerWaalsContact O-N 3.15Å
270	P	89.2	Confident	84.8	Confident	14 Å²	14	62.6 Å²	62.6	9%	0.091	34%	0.344	C	S	.	.			trans	-68.1	146	166.8	33.7	-35	0	0	0	109.7	I263 V272 F283 W286 L306	I263-P270 HydrophobicContact CD1-CG 4.31Å; P270-V272 PolarHBondContact O-N 2.86Å; P270-V272 VanDerWaalsContact O-N 3.14Å; P270-F283 HydrophobicContact CB-CB 4.3Å; P270-F283 HydrophobicContact CB-CD2 4.44Å; P270-F283 HydrophobicContact CG-CD2 4Å; P270-W286 HydrophobicContact CB-CB 4.02Å; P270-W286 HydrophobicContact CB-CG 4.15Å; P270-W286 HydrophobicContact CG-CD2 4.5Å; P270-L306 HydrophobicContact CG-CD2 4.2Å
271	K	89.1	Confident	84.7	Confident	172 Å²	172	68.3 Å²	68.3	75%	0.748	36%	0.363	S	S	*	.			trans	-70.3	111.5	173.4	-67.9	-171.6	177.6	-170.5	0	110	N282	K271-N282 PolarHBondContact O-ND2 3Å
272	V	90.6	Very high	84.6	Confident	44 Å²	44	67 Å²	67	27%	0.267	36%	0.358	S	S	.	.			trans	-94.4	130.4	174.7	-176.7	0	0	0	0	109.1	P270 T279 L306 T308 Q310	P270-V272 PolarHBondContact O-N 2.86Å; P270-V272 VanDerWaalsContact O-N 3.14Å; V272-T279 HydrophobicContact CB-CG2 4.34Å; V272-T279 HydrophobicContact CG1-CG2 3.96Å; V272-T279 HydrophobicContact CG2-CG2 4.31Å; V272-L306 HydrophobicContact CG2-CD2 4.02Å; V272-T308 HydrophobicContact CG1-CG2 4.39Å; V272-Q310 HydrophobicContact CG1-CB 3.93Å; V272-Q310 HydrophobicContact CG1-CG 4.11Å
273	S	88.8	Confident	84.8	Confident	38 Å²	38	64.8 Å²	64.8	27%	0.266	34%	0.344	S	S	.	.			trans	-138	172	171.9	73.9	0	0	0	0	110.7	N275 T279	S273-N275 PolarHBondContact O-N 2.82Å; S273-N275 VanDerWaalsContact O-N 3.12Å; S273-N275 PolarHBondContact OG-N 3.29Å; S273-T279 PolarHBondContact N-OG1 2.95Å; S273-T279 PolarHBondContact O-OG1 2.91Å
274	S	85.6	Confident	84.9	Confident	62 Å²	62	64.5 Å²	64.5	43%	0.434	34%	0.344	S	S	.	.	S	Bend	trans	-64.6	-9	173.5	58.4	0	0	0	0	113.8	A276 D311 C313	S274-A276 PolarHBondContact O-N 3.4Å; S274-D311 WeakPolarHBondContact CA-O 3.46Å; S274-D311 WeakPolarHBondContact CB-O 3.29Å; S274-C313 WeakPolarHBondContact O-CA 3.36Å; S274-C313 VanDerWaalsContact O-CB 3.24Å; S274-C313 WeakPolarHBondContact O-CB 3.3Å; S274-C313 PolarHBondContact O-N 3.44Å
275	N	83.3	Confident	85.5	Confident	81 Å²	81	62.2 Å²	62.2	43%	0.433	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-87.7	104.7	173.2	-176.5	-43.6	0	0	0	109.7	S273 A277 L278 T279	S273-N275 PolarHBondContact O-N 2.82Å; S273-N275 VanDerWaalsContact O-N 3.12Å; S273-N275 PolarHBondContact OG-N 3.29Å; N275-A277 VanDerWaalsContact C-N 3.31Å; N275-A277 PolarHBondContact O-N 2.87Å; N275-A277 PolarHBondContact OD1-N 2.87Å; N275-A277 VanDerWaalsContact OD1-N 3.16Å; N275-L278 HydrophobicContact CB-CB 3.97Å; N275-L278 PolarHBondContact O-N 2.03Å; N275-L278 PolarHBondContact OD1-N 2.96Å; N275-T279 PolarHBondContact O-N 3.46Å; N275-T279 PolarHBondContact O-OG1 3.41Å
276	A	83.4	Confident	86.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57	-41.6	-176	0	0	0	0	0	112.8	S274 T279 L280 L312 C313 T320 M323	S274-A276 PolarHBondContact O-N 3.4Å; A276-T279 PolarHBondContact O-N 2.73Å; A276-L280 WeakPolarHBondContact O-CB 3.16Å; A276-L280 PolarHBondContact O-N 3.48Å; A276-L312 HydrophobicContact CB-CB 4.2Å; A276-C313 WeakPolarHBondContact CB-O 3.25Å; A276-C313 PolarHBondContact N-O 3.18Å; A276-T320 HydrophobicContact CB-CG2 4.38Å; A276-M323 HydrophobicContact CB-CB 4.32Å; A276-M323 HydrophobicContact CB-CE 4.11Å; A276-M323 HydrophobicContact CB-SD 4Å
277	A	79.6	Confident	87.3	Confident	55 Å²	55	56.6 Å²	56.6	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-67.5	-38.8	-179.2	0	0	0	0	0	112.4	N275 R281 M323	N275-A277 VanDerWaalsContact C-N 3.31Å; N275-A277 PolarHBondContact O-N 2.87Å; N275-A277 PolarHBondContact OD1-N 2.87Å; N275-A277 VanDerWaalsContact OD1-N 3.16Å; A277-R281 WeakPolarHBondContact O-CB 2.92Å; A277-R281 PolarHBondContact O-N 2.66Å; A277-R281 VanDerWaalsContact O-N 3.09Å; A277-M323 VanDerWaalsContact CA-SD 3.51Å; A277-M323 HydrophobicContact CB-CE 4.47Å; A277-M323 HydrophobicContact CB-SD 3.93Å
278	L	82.9	Confident	88.2	Confident	59 Å²	59	51.8 Å²	51.8	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-68	-44.1	175.6	-178.6	58.6	0	0	0	111.2	N275 R281 N282	N275-L278 HydrophobicContact CB-CB 3.97Å; N275-L278 PolarHBondContact O-N 2.03Å; N275-L278 PolarHBondContact OD1-N 2.96Å; L278-R281 PolarHBondContact O-N 2.97Å; L278-N282 WeakPolarHBondContact O-CB 3.21Å; L278-N282 PolarHBondContact O-N 2.9Å; L278-N282 PolarHBondContact O-ND2 2.04Å
279	T	89.7	Confident	88.9	Confident	1 Å²	1	53 Å²	53	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-46.7	176.8	-63.9	0	0	0	0	111	V272 S273 N275 A276 R281 N282 F283 L306 L312 V338	V272-T279 HydrophobicContact CB-CG2 4.34Å; V272-T279 HydrophobicContact CG1-CG2 3.96Å; V272-T279 HydrophobicContact CG2-CG2 4.31Å; S273-T279 PolarHBondContact N-OG1 2.95Å; S273-T279 PolarHBondContact O-OG1 2.91Å; N275-T279 PolarHBondContact O-N 3.46Å; N275-T279 PolarHBondContact O-OG1 3.41Å; A276-T279 PolarHBondContact O-N 2.73Å; T279-R281 PolarHBondContact O-N 3.2Å; T279-N282 PolarHBondContact O-N 3.03Å; T279-F283 WeakPolarHBondContact O-CB 3.11Å; T279-F283 PolarHBondContact O-N 3.14Å; T279-L306 HydrophobicContact CG2-CD2 4.33Å; T279-L312 HydrophobicContact CG2-CD2 4.48Å; T279-V338 HydrophobicContact CG2-CB 4.47Å; T279-V338 HydrophobicContact CG2-CG1 4.14Å
280	L	88.4	Confident	89.2	Confident	11 Å²	11	56 Å²	56	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-52.7	174.7	179.6	64.1	0	0	0	111.1	A276 N282 F283 C284 M323 C336 V338	A276-L280 WeakPolarHBondContact O-CB 3.16Å; A276-L280 PolarHBondContact O-N 3.48Å; L280-N282 VanDerWaalsContact C-N 3.3Å; L280-N282 PolarHBondContact O-N 3.27Å; L280-F283 PolarHBondContact O-N 2.02Å; L280-C284 VanDerWaalsContact CD1-SG 3.6Å; L280-C284 WeakPolarHBondContact O-CB 3.45Å; L280-C284 PolarHBondContact O-N 3.18Å; L280-C284 PolarHBondContact O-SG 3.34Å; L280-M323 HydrophobicContact CD2-CG 3.92Å; L280-M323 HydrophobicContact CD2-SD 4.3Å; L280-C336 HydrophobicContact CD1-CB 4.45Å; L280-V338 HydrophobicContact CB-CG1 4.29Å; L280-V338 HydrophobicContact CB-CG2 4.13Å; L280-V338 HydrophobicContact CD1-CG1 4.07Å; L280-V338 HydrophobicContact CD1-CG2 4.45Å
281	R	87.7	Confident	89.4	Confident	168 Å²	168	56 Å²	56	63%	0.634	29%	0.287	S	S	*	.	H	α-helix	trans	-57.4	-43.2	179.9	-173.2	-178.8	70.8	175.4	1	112.5	A277 L278 T279 S285	A277-R281 WeakPolarHBondContact O-CB 2.92Å; A277-R281 PolarHBondContact O-N 2.66Å; A277-R281 VanDerWaalsContact O-N 3.09Å; L278-R281 PolarHBondContact O-N 2.97Å; T279-R281 PolarHBondContact O-N 3.2Å; R281-S285 WeakPolarHBondContact O-CB 3.27Å; R281-S285 PolarHBondContact O-N 2.49Å; R281-S285 VanDerWaalsContact O-N 3.15Å
282	N	91.4	Very high	89.4	Confident	42 Å²	42	51.6 Å²	51.6	23%	0.225	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-45.2	179.1	-67.6	-19.5	0	0	0	111.1	K271 L278 T279 L280 S285 W286	K271-N282 PolarHBondContact O-ND2 3Å; L278-N282 WeakPolarHBondContact O-CB 3.21Å; L278-N282 PolarHBondContact O-N 2.9Å; L278-N282 PolarHBondContact O-ND2 2.04Å; T279-N282 PolarHBondContact O-N 3.03Å; L280-N282 VanDerWaalsContact C-N 3.3Å; L280-N282 PolarHBondContact O-N 3.27Å; N282-S285 PolarHBondContact O-N 3.1Å; N282-W286 WeakPolarHBondContact O-CB 3.39Å; N282-W286 PolarHBondContact O-N 3.4Å
283	F	95.3	Very high	88.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-45.8	178.7	177.7	-124.2	0	0	0	112.4	V216 P270 T279 L280 S285 W286 Q287 A304 L306 C336 S337 V338	V216-F283 HydrophobicContact CB-CE2 4.06Å; V216-F283 HydrophobicContact CB-CZ 4.23Å; V216-F283 HydrophobicContact CG1-CE2 4.28Å; V216-F283 HydrophobicContact CG2-CE2 3.94Å; V216-F283 HydrophobicContact CG2-CZ 4.01Å; P270-F283 HydrophobicContact CB-CB 4.3Å; P270-F283 HydrophobicContact CB-CD2 4.44Å; P270-F283 HydrophobicContact CG-CD2 4Å; T279-F283 WeakPolarHBondContact O-CB 3.11Å; T279-F283 PolarHBondContact O-N 3.14Å; L280-F283 PolarHBondContact O-N 2.02Å; F283-S285 VanDerWaalsContact C-N 3.32Å; F283-S285 PolarHBondContact O-N 3.16Å; F283-W286 HydrophobicContact CD2-CE3 4.02Å; F283-W286 HydrophobicContact CD2-CZ3 4.43Å; F283-W286 AromaticContact CE2-CE3 3.97Å; F283-W286 HydrophobicContact CE2-CE3 3.97Å; F283-W286 AromaticContact CE2-CZ3 3.97Å; F283-W286 HydrophobicContact CE2-CZ3 3.97Å; F283-W286 PolarHBondContact O-N 3.27Å; F283-W286 VanDerWaalsContact O-N 3.11Å; F283-Q287 HydrophobicContact CE2-CB 4.29Å; F283-Q287 HydrophobicContact CZ-CB 4.46Å; F283-Q287 WeakPolarHBondContact O-CG 3.33Å; F283-Q287 PolarHBondContact O-N 3.44Å; F283-A304 HydrophobicContact CE1-CB 4.09Å; F283-A304 WeakPolarHBondContact CE1-O 3.07Å; F283-A304 HydrophobicContact CZ-CB 3.73Å; F283-L306 HydrophobicContact CB-CD2 4.13Å; F283-L306 HydrophobicContact CD1-CB 3.74Å; F283-L306 HydrophobicContact CD2-CB 3.94Å; F283-L306 HydrophobicContact CD2-CD2 4.08Å; F283-L306 HydrophobicContact CD2-CG 4.42Å; F283-L306 HydrophobicContact CE1-CB 3.63Å; F283-L306 HydrophobicContact CE2-CB 3.83Å; F283-L306 HydrophobicContact CE2-CD1 4.43Å; F283-L306 HydrophobicContact CG-CB 3.89Å; F283-L306 HydrophobicContact CG-CD2 4.01Å; F283-L306 HydrophobicContact CZ-CB 3.66Å; F283-C336 HydrophobicContact CD1-CB 4.02Å; F283-C336 HydrophobicContact CE1-CB 4.12Å; F283-S337 WeakPolarHBondContact CE1-O 3.26Å; F283-V338 HydrophobicContact CB-CG1 4.13Å; F283-V338 HydrophobicContact CD1-CG1 3.95Å; F283-V338 HydrophobicContact CG-CG1 4.35Å
284	C	92.8	Very high	88.6	Confident	8 Å²	8	57.3 Å²	57.3	5%	0.054	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-43.7	176.5	-65.5	0	0	0	0	112.5	L280 K288 C336	L280-C284 VanDerWaalsContact CD1-SG 3.6Å; L280-C284 WeakPolarHBondContact O-CB 3.45Å; L280-C284 PolarHBondContact O-N 3.18Å; L280-C284 PolarHBondContact O-SG 3.34Å; C284-K288 WeakPolarHBondContact O-CB 3.29Å; C284-K288 PolarHBondContact O-N 2.79Å; C284-C336 VanDerWaalsContact CA-SG 3.51Å; C284-C336 HydrophobicContact CB-CB 4.09Å; C284-C336 WeakPolarHBondContact CB-SG 3.23Å; C284-C336 WeakPolarHBondContact SG-CB 3.32Å; C284-C336 CovalentContact SG-SG 2Å; C284-C336 PolarHBondContact SG-SG 3.31Å
285	S	93.3	Very high	88.3	Confident	67 Å²	67	56.2 Å²	56.2	47%	0.469	30%	0.298	S	S	.	.	H	α-helix	trans	-65.6	-39.2	175.8	-175.8	0	0	0	0	112.2	R281 N282 F283 K289	R281-S285 WeakPolarHBondContact O-CB 3.27Å; R281-S285 PolarHBondContact O-N 2.49Å; R281-S285 VanDerWaalsContact O-N 3.15Å; N282-S285 PolarHBondContact O-N 3.1Å; F283-S285 VanDerWaalsContact C-N 3.32Å; F283-S285 PolarHBondContact O-N 3.16Å; S285-K289 WeakPolarHBondContact O-CG 3.24Å
286	W	94	Very high	88.1	Confident	43 Å²	43	60 Å²	60	16%	0.163	31%	0.31	C	S	.	.	H	α-helix	trans	-70.1	-50.3	179.6	178.2	95.1	0	0	0	112.1	V216 M261 I263 K268 P270 N282 F283 K288 K289 L290	V216-W286 HydrophobicContact CG1-CH2 4.17Å; V216-W286 HydrophobicContact CG1-CZ3 4.16Å; V216-W286 HydrophobicContact CG2-CZ3 4.22Å; M261-W286 HydrophobicContact SD-CH2 3.5Å; M261-W286 WeakPolarHBondContact SD-CH2 3.31Å; M261-W286 HydrophobicContact SD-CZ2 4.01Å; I263-W286 HydrophobicContact CD1-CH2 4.01Å; I263-W286 HydrophobicContact CD1-CZ2 4.04Å; K268-W286 PolarHBondContact O-NE1 2.7Å; K268-W286 VanDerWaalsContact O-NE1 3.13Å; P270-W286 HydrophobicContact CB-CB 4.02Å; P270-W286 HydrophobicContact CB-CG 4.15Å; P270-W286 HydrophobicContact CG-CD2 4.5Å; N282-W286 WeakPolarHBondContact O-CB 3.39Å; N282-W286 PolarHBondContact O-N 3.4Å; F283-W286 HydrophobicContact CD2-CE3 4.02Å; F283-W286 HydrophobicContact CD2-CZ3 4.43Å; F283-W286 AromaticContact CE2-CE3 3.97Å; F283-W286 HydrophobicContact CE2-CE3 3.97Å; F283-W286 AromaticContact CE2-CZ3 3.97Å; F283-W286 HydrophobicContact CE2-CZ3 3.97Å; F283-W286 PolarHBondContact O-N 3.27Å; F283-W286 VanDerWaalsContact O-N 3.11Å; W286-K288 VanDerWaalsContact C-N 3.26Å; W286-K288 PolarHBondContact O-N 3.11Å; W286-K289 WeakPolarHBondContact O-CB 3.31Å; W286-K289 PolarHBondContact O-N 3.17Å; W286-K289 VanDerWaalsContact O-N 3.14Å; W286-L290 HydrophobicContact CD2-CD1 3.99Å; W286-L290 HydrophobicContact CE3-CD1 4.04Å; W286-L290 HydrophobicContact CH2-CD1 3.43Å; W286-L290 VanDerWaalsContact CH2-CD1 3.43Å; W286-L290 HydrophobicContact CZ2-CD1 3.36Å; W286-L290 HydrophobicContact CZ3-CD1 3.76Å
287	Q	93.8	Very high	88.1	Confident	3 Å²	3	63.5 Å²	63.5	1%	0.014	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-37.7	-178.6	73.5	76.3	17.3	0	0	110.9	F283 K289 L290 N291 A304 P332 C336	F283-Q287 HydrophobicContact CE2-CB 4.29Å; F283-Q287 HydrophobicContact CZ-CB 4.46Å; F283-Q287 WeakPolarHBondContact O-CG 3.33Å; F283-Q287 PolarHBondContact O-N 3.44Å; Q287-K289 VanDerWaalsContact C-N 3.25Å; Q287-K289 PolarHBondContact O-N 2.91Å; Q287-L290 PolarHBondContact O-N 2.84Å; Q287-N291 PolarHBondContact O-N 2.73Å; Q287-A304 HydrophobicContact CB-CB 3.98Å; Q287-A304 HydrophobicContact CG-CB 3.98Å; Q287-P332 PolarHBondContact NE2-O 3.04Å; Q287-C336 HydrophobicContact CG-CB 4.44Å
288	K	92.8	Very high	88.2	Confident	63 Å²	63	63.5 Å²	63.5	27%	0.274	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-32.1	-179.3	176.9	61.7	-156.5	153.3	0	112.8	C284 W286 L290 P332 K333	C284-K288 WeakPolarHBondContact O-CB 3.29Å; C284-K288 PolarHBondContact O-N 2.79Å; W286-K288 VanDerWaalsContact C-N 3.26Å; W286-K288 PolarHBondContact O-N 3.11Å; K288-L290 VanDerWaalsContact C-N 3.29Å; K288-P332 HydrophobicContact CD-CB 3.75Å; K288-P332 WeakPolarHBondContact CD-O 3.5Å; K288-K333 HydrophobicContact CD-CG 4.48Å; K288-K333 HydrophobicContact CG-CG 4.38Å
289	K	91.6	Very high	88.1	Confident	170 Å²	170	66.1 Å²	66.1	74%	0.739	33%	0.332	S	S	*	.	H	α-helix	trans	-69.5	-29.2	177.1	-69.6	171.9	-175.6	-179.9	0	112.2	S285 W286 Q287	S285-K289 WeakPolarHBondContact O-CG 3.24Å; W286-K289 WeakPolarHBondContact O-CB 3.31Å; W286-K289 PolarHBondContact O-N 3.17Å; W286-K289 VanDerWaalsContact O-N 3.14Å; Q287-K289 VanDerWaalsContact C-N 3.25Å; Q287-K289 PolarHBondContact O-N 2.91Å
290	L	90.8	Very high	88.2	Confident	76 Å²	76	66.9 Å²	66.9	40%	0.398	34%	0.335	S	S	.	.	H	α-helix	trans	-89.6	-31.2	-179.4	-62.8	176.9	0	0	0	112.5	M261 W286 Q287 K288 W301	M261-L290 HydrophobicContact CE-CD1 4.39Å; M261-L290 HydrophobicContact SD-CD1 4.4Å; W286-L290 HydrophobicContact CD2-CD1 3.99Å; W286-L290 HydrophobicContact CE3-CD1 4.04Å; W286-L290 HydrophobicContact CH2-CD1 3.43Å; W286-L290 VanDerWaalsContact CH2-CD1 3.43Å; W286-L290 HydrophobicContact CZ2-CD1 3.36Å; W286-L290 HydrophobicContact CZ3-CD1 3.76Å; Q287-L290 PolarHBondContact O-N 2.84Å; K288-L290 VanDerWaalsContact C-N 3.29Å; L290-W301 HydrophobicContact CB-CH2 3.98Å; L290-W301 HydrophobicContact CB-CZ2 4.16Å
291	N	92.8	Very high	88.4	Confident	14 Å²	14	67 Å²	67	8%	0.075	34%	0.335	C	S	.	.	S	Bend	trans	-66.8	143.6	-178.2	-161.5	-2.4	0	0	0	111.6	Q287 Y300 W301	Q287-N291 PolarHBondContact O-N 2.73Å; N291-Y300 VanDerWaalsContact OD1-CD2 3.26Å; N291-Y300 WeakPolarHBondContact OD1-CD2 3.46Å; N291-W301 VanDerWaalsContact CA-CZ2 3.43Å; N291-W301 HydrophobicContact CB-CD2 4.23Å; N291-W301 HydrophobicContact CB-CH2 4.1Å; N291-W301 HydrophobicContact CB-CZ2 3.45Å; N291-W301 VanDerWaalsContact CB-CZ2 3.45Å; N291-W301 VanDerWaalsContact CG-CE2 3.42Å; N291-W301 PolarHBondContact ND2-NE1 2.94Å; N291-W301 PolarHBondContact ND2-O 2.73Å; N291-W301 PolarHBondContact OD1-N 3.31Å
292	K	88.1	Confident	88.7	Confident	78 Å²	78	59.3 Å²	59.3	34%	0.339	31%	0.306	S	S	.	.			trans	-71.8	156.1	178.8	-51.8	-59.8	-176.5	-177.6	0	110.6	H297 E299 Y300	K292-H297 HydrophobicContact CB-CB 4.12Å; K292-H297 HydrophobicContact CG-CB 4.16Å; K292-E299 VanDerWaalsContact CE-OE2 3.32Å; K292-E299 WeakPolarHBondContact CE-OE2 3.03Å; K292-E299 IonicContact NZ-OE2 2.64Å; K292-E299 PolarHBondContact NZ-OE2 3.15Å; K292-Y300 HydrophobicContact CB-CD2 4.44Å; K292-Y300 WeakPolarHBondContact O-CD2 3.29Å
293	A	80.3	Confident	88.9	Confident	107 Å²	107	57.3 Å²	57.3	88%	0.884	30%	0.295	S	S	*	.	S	Bend	trans	-81.1	-20.6	178.2	0	0	0	0	0	113.3
294	N	82.4	Confident	89	Confident	95 Å²	95	57.3 Å²	57.3	51%	0.508	30%	0.295	S	S	.	.			trans	-111.5	122.8	-177.4	-177.3	11.6	0	0	0	109.9	K296 H297	N294-K296 PolarHBondContact O-N 3.06Å; N294-K296 PolarHBondContact OD1-N 2.86Å; N294-K296 VanDerWaalsContact OD1-N 3.16Å; N294-H297 VanDerWaalsContact O-CB 3.31Å; N294-H297 WeakPolarHBondContact O-CB 3.05Å; N294-H297 PolarHBondContact O-N 3.2Å; N294-H297 VanDerWaalsContact O-N 3.14Å
295	D	80.2	Confident	89.2	Confident	40 Å²	40	56.9 Å²	56.9	21%	0.214	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.2	177.6	-157.9	-19.9	0	0	0	112.5	H297 Y300	D295-H297 PolarHBondContact O-N 3.38Å; D295-Y300 HydrophobicContact CB-CD1 4.22Å; D295-Y300 HydrophobicContact CB-CE1 4.04Å; D295-Y300 VanDerWaalsContact CG-CE1 3.49Å; D295-Y300 WeakPolarHBondContact OD1-CD1 3.47Å; D295-Y300 WeakPolarHBondContact OD1-CE1 3.11Å
296	K	79.8	Confident	89.4	Confident	159 Å²	159	53.7 Å²	53.7	69%	0.691	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	0.5	179.9	-58.4	-174.8	178.4	-176.4	0	115	N294	N294-K296 PolarHBondContact O-N 3.06Å; N294-K296 PolarHBondContact OD1-N 2.86Å; N294-K296 VanDerWaalsContact OD1-N 3.16Å
297	H	83.5	Confident	89.5	Confident	74 Å²	74	51.7 Å²	51.7	34%	0.343	26%	0.263	S	S	.	.	S	Bend	trans	-80.9	136.6	-178.3	-167.9	-83.5	0	0	0	110.1	K292 N294 D295 E299 Y300	K292-H297 HydrophobicContact CB-CB 4.12Å; K292-H297 HydrophobicContact CG-CB 4.16Å; N294-H297 VanDerWaalsContact O-CB 3.31Å; N294-H297 WeakPolarHBondContact O-CB 3.05Å; N294-H297 PolarHBondContact O-N 3.2Å; N294-H297 VanDerWaalsContact O-N 3.14Å; D295-H297 PolarHBondContact O-N 3.38Å; H297-E299 IonicContact CE1-OE2 3.44Å; H297-E299 PolarHBondContact ND1-N 3.06Å; H297-E299 VanDerWaalsContact ND1-N 3.19Å; H297-E299 PolarHBondContact O-N 3.17Å; H297-Y300 VanDerWaalsContact O-CB 3.23Å; H297-Y300 WeakPolarHBondContact O-CB 3.29Å; H297-Y300 PolarHBondContact O-N 3.4Å
298	P	80.6	Confident	89.5	Confident	55 Å²	55	51.5 Å²	51.5	36%	0.357	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.1	-177.9	-20.3	26.1	0	0	0	116.4
299	E	82	Confident	89.4	Confident	114 Å²	114	51.5 Å²	51.5	53%	0.533	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	14.1	179	-53.8	-177.9	134.2	0	0	111.6	K292 H297 W301	K292-E299 VanDerWaalsContact CE-OE2 3.32Å; K292-E299 WeakPolarHBondContact CE-OE2 3.03Å; K292-E299 IonicContact NZ-OE2 2.64Å; K292-E299 PolarHBondContact NZ-OE2 3.15Å; H297-E299 IonicContact CE1-OE2 3.44Å; H297-E299 PolarHBondContact ND1-N 3.06Å; H297-E299 VanDerWaalsContact ND1-N 3.19Å; H297-E299 PolarHBondContact O-N 3.17Å; E299-W301 WeakPolarHBondContact O-CZ3 3.18Å
300	Y	90.1	Very high	89.3	Confident	18 Å²	18	47.3 Å²	47.3	7%	0.071	25%	0.245	C	C	.	.			trans	-71.7	157	168.7	179.6	-103	0	0	0	109.7	E212 V258 N291 K292 D295 H297	E212-Y300 WeakPolarHBondContact OE2-CD1 3.49Å; V258-Y300 WeakPolarHBondContact CG2-O 3.46Å; N291-Y300 VanDerWaalsContact OD1-CD2 3.26Å; N291-Y300 WeakPolarHBondContact OD1-CD2 3.46Å; K292-Y300 HydrophobicContact CB-CD2 4.44Å; K292-Y300 WeakPolarHBondContact O-CD2 3.29Å; D295-Y300 HydrophobicContact CB-CD1 4.22Å; D295-Y300 HydrophobicContact CB-CE1 4.04Å; D295-Y300 VanDerWaalsContact CG-CE1 3.49Å; D295-Y300 WeakPolarHBondContact OD1-CD1 3.47Å; D295-Y300 WeakPolarHBondContact OD1-CE1 3.11Å; H297-Y300 VanDerWaalsContact O-CB 3.23Å; H297-Y300 WeakPolarHBondContact O-CB 3.29Å; H297-Y300 PolarHBondContact O-N 3.4Å
301	W	92.9	Very high	89	Confident	14 Å²	14	47.3 Å²	47.3	5%	0.053	25%	0.246	C	C	.	.			trans	-144.5	142.8	169.9	55.1	86.1	0	0	0	110.4	M214 V258 L290 N291 E299	M214-W301 HydrophobicContact CB-CB 4.02Å; M214-W301 HydrophobicContact CB-CD2 3.64Å; M214-W301 HydrophobicContact CB-CE3 4.17Å; M214-W301 HydrophobicContact CB-CG 3.56Å; M214-W301 HydrophobicContact CE-CD2 4Å; M214-W301 HydrophobicContact CE-CE3 3.33Å; M214-W301 HydrophobicContact CE-CH2 3.82Å; M214-W301 HydrophobicContact CE-CZ2 4.41Å; M214-W301 HydrophobicContact CE-CZ3 3.24Å; M214-W301 HydrophobicContact CG-CD2 4.18Å; M214-W301 HydrophobicContact CG-CE3 4.45Å; M214-W301 HydrophobicContact CG-CZ2 4.44Å; V258-W301 HydrophobicContact CG2-CB 3.82Å; L290-W301 HydrophobicContact CB-CH2 3.98Å; L290-W301 HydrophobicContact CB-CZ2 4.16Å; N291-W301 VanDerWaalsContact CA-CZ2 3.43Å; N291-W301 HydrophobicContact CB-CD2 4.23Å; N291-W301 HydrophobicContact CB-CH2 4.1Å; N291-W301 HydrophobicContact CB-CZ2 3.45Å; N291-W301 VanDerWaalsContact CB-CZ2 3.45Å; N291-W301 VanDerWaalsContact CG-CE2 3.42Å; N291-W301 PolarHBondContact ND2-NE1 2.94Å; N291-W301 PolarHBondContact ND2-O 2.73Å; N291-W301 PolarHBondContact OD1-N 3.31Å; E299-W301 WeakPolarHBondContact O-CZ3 3.18Å
302	D	94.1	Very high	88.6	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.027	24%	0.242	C	C	.	.	S	Bend	trans	-69.5	-42.9	174.2	-67.7	-55.4	0	0	0	111.4	E212 M329 S335 L414	E212-D302 HydrophobicContact CB-CB 4.48Å; E212-D302 PolarHBondContact N-OD2 2.93Å; E212-D302 PolarHBondContact O-N 3.03Å; D302-M329 HydrophobicContact CB-SD 4.49Å; D302-S335 WeakPolarHBondContact O-CB 2.99Å; D302-S335 PolarHBondContact O-OG 3.14Å; D302-L414 HydrophobicContact CB-CD2 4Å; D302-L414 VanDerWaalsContact CG-CD2 3.49Å; D302-L414 VanDerWaalsContact OD2-CD2 3.3Å; D302-L414 WeakPolarHBondContact OD2-CD2 3.23Å
303	T	95.8	Very high	88.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	152.4	-173.5	-160.4	0	0	0	0	111.9	V211 E212 V213 M214 M329 S335 L354 I357	V211-T303 HydrophobicContact CG1-CG2 3.87Å; E212-T303 PolarHBondContact O-N 3.35Å; E212-T303 VanDerWaalsContact O-N 3.17Å; V213-T303 WeakPolarHBondContact CA-O 3.32Å; V213-T303 HydrophobicContact CB-CG2 4.5Å; V213-T303 HydrophobicContact CG1-CG2 4.41Å; V213-T303 HydrophobicContact CG2-CG2 3.9Å; M214-T303 PolarHBondContact N-O 3.15Å; T303-M329 HydrophobicContact CG2-SD 4.42Å; T303-S335 WeakPolarHBondContact CA-OG 3.47Å; T303-S335 WeakPolarHBondContact CB-OG 3.33Å; T303-S335 PolarHBondContact OG1-O 3.31Å; T303-S335 PolarHBondContact OG1-OG 2.85Å; T303-L354 HydrophobicContact CG2-CD2 4.01Å; T303-I357 WeakPolarHBondContact OG1-CD1 3.23Å
304	A	96.6	Very high	87.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141	179.2	0	0	0	0	0	111.1	M214 F283 Q287 S335 C336 S337	M214-A304 HydrophobicContact CB-CB 4.13Å; M214-A304 CarbonylContact O-C 3.43Å; M214-A304 WeakPolarHBondContact O-CA 3.39Å; F283-A304 HydrophobicContact CE1-CB 4.09Å; F283-A304 WeakPolarHBondContact CE1-O 3.07Å; F283-A304 HydrophobicContact CZ-CB 3.73Å; Q287-A304 HydrophobicContact CB-CB 3.98Å; Q287-A304 HydrophobicContact CG-CB 3.98Å; A304-S335 PolarHBondContact N-O 3.05Å; A304-C336 CarbonylContact O-C 3.57Å; A304-C336 VanDerWaalsContact O-CA 3.26Å; A304-C336 WeakPolarHBondContact O-CA 3.09Å; A304-S337 PolarHBondContact O-N 3.34Å
305	I	97.4	Very high	86.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.5	-177.9	-52.8	-175.9	0	0	0	108.8	V213 M214 V216 M237 F307 I339 T350 L354	V213-I305 HydrophobicContact CG1-CD1 3.72Å; V213-I305 HydrophobicContact CG1-CG1 3.8Å; M214-I305 PolarHBondContact O-N 2.86Å; V216-I305 PolarHBondContact N-O 2.95Å; M237-I305 HydrophobicContact CE-CD1 4.05Å; M237-I305 HydrophobicContact SD-CD1 4.22Å; I305-F307 HydrophobicContact CB-CE2 4.23Å; I305-F307 HydrophobicContact CG2-CD2 4.09Å; I305-F307 HydrophobicContact CG2-CE2 3.53Å; I305-F307 HydrophobicContact CG2-CZ 3.9Å; I305-I339 HydrophobicContact CG2-CD1 3.36Å; I305-I339 HydrophobicContact CG2-CG1 3.99Å; I305-T350 HydrophobicContact CD1-CG2 3.8Å; I305-L354 HydrophobicContact CD1-CD1 4.24Å; I305-L354 HydrophobicContact CD1-CD2 4.1Å; I305-L354 HydrophobicContact CD1-CG 4.18Å
306	L	97.1	Very high	85.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125	173.7	178.7	64.8	0	0	0	110.4	V216 D218 P270 V272 T279 F283 S337 V338 I339	V216-L306 HydrophobicContact CB-CD1 4.13Å; V216-L306 HydrophobicContact CG1-CD1 3.83Å; V216-L306 CarbonylContact O-C 3.51Å; V216-L306 WeakPolarHBondContact O-CA 3.45Å; D218-L306 HydrophobicContact CB-CD1 4.35Å; P270-L306 HydrophobicContact CG-CD2 4.2Å; V272-L306 HydrophobicContact CG2-CD2 4.02Å; T279-L306 HydrophobicContact CG2-CD2 4.33Å; F283-L306 HydrophobicContact CB-CD2 4.13Å; F283-L306 HydrophobicContact CD1-CB 3.74Å; F283-L306 HydrophobicContact CD2-CB 3.94Å; F283-L306 HydrophobicContact CD2-CD2 4.08Å; F283-L306 HydrophobicContact CD2-CG 4.42Å; F283-L306 HydrophobicContact CE1-CB 3.63Å; F283-L306 HydrophobicContact CE2-CB 3.83Å; F283-L306 HydrophobicContact CE2-CD1 4.43Å; F283-L306 HydrophobicContact CG-CB 3.89Å; F283-L306 HydrophobicContact CG-CD2 4.01Å; F283-L306 HydrophobicContact CZ-CB 3.66Å; L306-S337 PolarHBondContact N-O 2.91Å; L306-V338 HydrophobicContact CB-CG1 4.17Å; L306-V338 HydrophobicContact CD2-CG1 4.18Å; L306-I339 PolarHBondContact O-N 2.96Å
307	F	96.5	Very high	84.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.1	169	-67.8	-91.8	0	0	0	110.6	V215 V216 D218 M221 L233 L236 M237 I305 I339 T350	V215-F307 HydrophobicContact CG1-CD2 4.08Å; V215-F307 HydrophobicContact CG1-CE2 3.99Å; V216-F307 PolarHBondContact O-N 3.11Å; D218-F307 PolarHBondContact N-O 3.46Å; M221-F307 HydrophobicContact CE-CB 4Å; M221-F307 HydrophobicContact CG-CB 4.18Å; M221-F307 VanDerWaalsContact CG-O 3.26Å; M221-F307 WeakPolarHBondContact CG-O 3.31Å; M221-F307 HydrophobicContact SD-CB 4.36Å; L233-F307 HydrophobicContact CD1-CB 4.46Å; L233-F307 HydrophobicContact CD1-CD2 4.24Å; L233-F307 HydrophobicContact CD1-CG 4.46Å; L233-F307 HydrophobicContact CD2-CB 4.02Å; L233-F307 HydrophobicContact CD2-CD1 3.72Å; L233-F307 HydrophobicContact CD2-CD2 3.75Å; L233-F307 HydrophobicContact CD2-CE1 4.08Å; L233-F307 HydrophobicContact CD2-CE2 4.11Å; L233-F307 HydrophobicContact CD2-CG 3.54Å; L233-F307 HydrophobicContact CD2-CZ 4.26Å; L236-F307 HydrophobicContact CD1-CD1 4.39Å; L236-F307 HydrophobicContact CD1-CE1 3.89Å; M237-F307 HydrophobicContact SD-CZ 4.35Å; I305-F307 HydrophobicContact CB-CE2 4.23Å; I305-F307 HydrophobicContact CG2-CD2 4.09Å; I305-F307 HydrophobicContact CG2-CE2 3.53Å; I305-F307 HydrophobicContact CG2-CZ 3.9Å; F307-I339 WeakPolarHBondContact CA-O 3.32Å; F307-I339 HydrophobicContact CD1-CB 4.11Å; F307-I339 HydrophobicContact CD1-CG2 4.07Å; F307-I339 HydrophobicContact CE1-CB 4.18Å; F307-I339 HydrophobicContact CE1-CD1 3.98Å; F307-I339 HydrophobicContact CE1-CG2 3.98Å; F307-I339 HydrophobicContact CZ-CD1 4.01Å; F307-T350 HydrophobicContact CZ-CG2 4.38Å
308	T	94.3	Very high	83.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148.8	178.9	-175.5	0	0	0	0	111.5	D218 S220 V272 Q310 L312 I339 E340 D341	D218-T308 WeakPolarHBondContact OD2-CB 2.96Å; D218-T308 PolarHBondContact OD2-OG1 3.16Å; S220-T308 PolarHBondContact OG-OG1 3.48Å; V272-T308 HydrophobicContact CG1-CG2 4.39Å; T308-Q310 VanDerWaalsContact C-N 3.3Å; T308-Q310 HydrophobicContact CG2-CB 4.15Å; T308-Q310 VanDerWaalsContact OG1-CB 3.25Å; T308-Q310 WeakPolarHBondContact OG1-CB 3.45Å; T308-Q310 PolarHBondContact OG1-N 2.03Å; T308-L312 HydrophobicContact CG2-CD1 4.27Å; T308-L312 HydrophobicContact CG2-CD2 4.29Å; T308-L312 HydrophobicContact CG2-CG 4.32Å; T308-I339 PolarHBondContact N-O 2.83Å; T308-E340 WeakPolarHBondContact O-CA 3.49Å; T308-D341 PolarHBondContact O-N 3.07Å
309	K	90.1	Very high	82.9	Confident	62 Å²	62	39.7 Å²	39.7	27%	0.27	23%	0.233	S	C	.	.	S	Bend	trans	-87.2	2	165.6	-60.7	-61.9	-86.8	177.5	0	112.6	S220 M221 F224 D341	S220-K309 PolarHBondContact OG-N 3.36Å; M221-K309 HydrophobicContact SD-CD 3.7Å; M221-K309 HydrophobicContact SD-CG 3.72Å; F224-K309 HydrophobicContact CB-CD 4.49Å; F224-K309 HydrophobicContact CB-CG 4.09Å; F224-K309 HydrophobicContact CD1-CD 4.42Å; F224-K309 HydrophobicContact CG-CD 4.37Å; F224-K309 HydrophobicContact CG-CG 4.43Å; K309-D341 HydrophobicContact CD-CB 3.72Å; K309-D341 WeakPolarHBondContact CD-OD2 3.18Å; K309-D341 PolarHBondContact NZ-O 2.87Å; K309-D341 IonicContact NZ-OD2 2.76Å; K309-D341 PolarHBondContact NZ-OD2 2.86Å
310	Q	89.4	Confident	82.5	Confident	82 Å²	82	34.2 Å²	34.2	38%	0.383	21%	0.207	S	C	.	.	S	Bend	trans	-71.1	128.9	174.6	-178.3	59.1	54.4	0	0	110.1	V272 T308 L312	V272-Q310 HydrophobicContact CG1-CB 3.93Å; V272-Q310 HydrophobicContact CG1-CG 4.11Å; T308-Q310 VanDerWaalsContact C-N 3.3Å; T308-Q310 HydrophobicContact CG2-CB 4.15Å; T308-Q310 VanDerWaalsContact OG1-CB 3.25Å; T308-Q310 WeakPolarHBondContact OG1-CB 3.45Å; T308-Q310 PolarHBondContact OG1-N 2.03Å; Q310-L312 PolarHBondContact O-N 2.9Å
311	D	85.6	Confident	82.1	Confident	77 Å²	77	34.3 Å²	34.3	41%	0.412	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-61.4	116.8	172.8	-176.4	3.4	0	0	0	110	S274 E340	S274-D311 WeakPolarHBondContact CA-O 3.46Å; S274-D311 WeakPolarHBondContact CB-O 3.29Å; D311-E340 WeakPolarHBondContact CA-OE2 3.28Å
312	L	83.8	Confident	81.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-96.7	119.7	-176.2	-66	-178.1	0	0	0	110.5	A276 T279 T308 Q310 T320 V338 E340	A276-L312 HydrophobicContact CB-CB 4.2Å; T279-L312 HydrophobicContact CG2-CD2 4.48Å; T308-L312 HydrophobicContact CG2-CD1 4.27Å; T308-L312 HydrophobicContact CG2-CD2 4.29Å; T308-L312 HydrophobicContact CG2-CG 4.32Å; Q310-L312 PolarHBondContact O-N 2.9Å; L312-T320 WeakPolarHBondContact CB-O 3.3Å; L312-T320 WeakPolarHBondContact O-CB 3.48Å; L312-V338 HydrophobicContact CD1-CG2 4.17Å; L312-E340 HydrophobicContact CD1-CB 4.21Å; L312-E340 HydrophobicContact CG-CB 4.31Å; L312-E340 PolarHBondContact N-OE2 3.17Å
313	C	77.5	Confident	81.4	Confident	18 Å²	18	34.2 Å²	34.2	12%	0.122	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-107.1	137.7	178.4	-53	0	0	0	0	112.4	S274 A276 C318	S274-C313 WeakPolarHBondContact O-CA 3.36Å; S274-C313 VanDerWaalsContact O-CB 3.24Å; S274-C313 WeakPolarHBondContact O-CB 3.3Å; S274-C313 PolarHBondContact O-N 3.44Å; A276-C313 WeakPolarHBondContact CB-O 3.25Å; A276-C313 PolarHBondContact N-O 3.18Å; C313-C318 HydrophobicContact CB-CB 3.93Å; C313-C318 WeakPolarHBondContact CB-SG 3.44Å; C313-C318 WeakPolarHBondContact SG-CB 3.29Å; C313-C318 CovalentContact SG-SG 2.04Å; C313-C318 PolarHBondContact SG-SG 3.19Å
314	G	67.9	Low	81	Confident	19 Å²	19	34.4 Å²	34.4	20%	0.196	21%	0.211	C	C	.	.			trans	-77.8	-172.5	164.8	0	0	0	0	0	111.8	T316 T317 T320	G314-T316 VanDerWaalsContact C-N 3.26Å; G314-T316 PolarHBondContact O-N 3.45Å; G314-T317 PolarHBondContact N-O 2.89Å; G314-T320 PolarHBondContact N-OG1 3.4Å
315	A	58.6	Low	80.4	Confident	111 Å²	111	36.3 Å²	36.3	92%	0.917	22%	0.221	S	C	*	.	S	Bend	trans	-67.4	-25.6	-178.7	0	0	0	0	0	113.8
316	T	53.5	Low	79.6	Confident	130 Å²	130	38.7 Å²	38.7	80%	0.798	24%	0.235	S	C	*	.	S	Bend	trans	-123.3	-24.9	-172.2	51.9	0	0	0	0	114.5	G314	G314-T316 VanDerWaalsContact C-N 3.26Å; G314-T316 PolarHBondContact O-N 3.45Å
317	T	64.2	Low	79	Confident	36 Å²	36	39.9 Å²	39.9	22%	0.221	25%	0.248	C	C	.	.			trans	-144.8	153.9	-177.6	56.5	0	0	0	0	111.4	P161 G314	P161-T317 HydrophobicContact CB-CG2 3.77Å; P161-T317 HydrophobicContact CG-CG2 4.3Å; G314-T317 PolarHBondContact N-O 2.89Å
318	C	66.8	Low	78.7	Confident	68 Å²	68	40.3 Å²	40.3	46%	0.459	25%	0.25	S	S	.	.	S	Bend	trans	-97.4	23	174.4	-65.4	0	0	0	0	113.1	C313 T320	C313-C318 HydrophobicContact CB-CB 3.93Å; C313-C318 WeakPolarHBondContact CB-SG 3.44Å; C313-C318 WeakPolarHBondContact SG-CB 3.29Å; C313-C318 CovalentContact SG-SG 2.04Å; C313-C318 PolarHBondContact SG-SG 3.19Å; C318-T320 PolarHBondContact O-N 3.18Å
319	D	66.9	Low	78.6	Confident	79 Å²	79	40.3 Å²	40.3	42%	0.422	25%	0.25	S	S	.	.			trans	-85.6	14.5	174.7	-59	-56.9	0	0	0	112.4	R163 L321	R163-D319 CarbonylContact C-O 3.49Å; R163-D319 VanDerWaalsContact CA-O 3.32Å; R163-D319 WeakPolarHBondContact CA-O 3.2Å; R163-D319 HydrophobicContact CB-CB 4.45Å; R163-D319 VanDerWaalsContact CB-O 3.28Å; R163-D319 WeakPolarHBondContact CB-O 3.15Å; R163-D319 HydrophobicContact CG-CB 3.91Å; D319-L321 PolarHBondContact O-N 3.08Å
320	T	72.8	Confident	78.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.253	C	S	.	.			trans	-87.6	104.9	-168.7	-59.8	0	0	0	0	111.3	R163 A276 L312 G314 C318 G322	R163-T320 WeakPolarHBondContact O-CA 3.43Å; A276-T320 HydrophobicContact CB-CG2 4.38Å; L312-T320 WeakPolarHBondContact CB-O 3.3Å; L312-T320 WeakPolarHBondContact O-CB 3.48Å; G314-T320 PolarHBondContact N-OG1 3.4Å; C318-T320 PolarHBondContact O-N 3.18Å; T320-G322 WeakPolarHBondContact CG2-O 3.5Å
321	L	82.1	Confident	78.6	Confident	20 Å²	20	38.5 Å²	38.5	11%	0.105	25%	0.249	C	C	.	.			trans	-83	-14.4	-178.1	-64.8	172.1	0	0	0	113.9	R163 D319 E340 D342 T349 L385	R163-L321 PolarHBondContact O-N 2.93Å; D319-L321 PolarHBondContact O-N 3.08Å; L321-E340 WeakPolarHBondContact O-CB 3.06Å; L321-E340 PolarHBondContact O-N 2.62Å; L321-D342 HydrophobicContact CD2-CB 4.49Å; L321-T349 HydrophobicContact CB-CG2 3.93Å; L321-T349 WeakPolarHBondContact O-CG2 3.4Å; L321-L385 HydrophobicContact CD1-CD1 4.03Å
322	G	86	Confident	78.7	Confident	1 Å²	1	37 Å²	37	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	162.3	-177.5	0	0	0	0	0	112.8	T320 V338	T320-G322 WeakPolarHBondContact CG2-O 3.5Å; G322-V338 CarbonylContact C-O 3.58Å; G322-V338 VanDerWaalsContact CA-O 3.23Å; G322-V338 WeakPolarHBondContact CA-O 2.98Å
323	M	87	Confident	78.8	Confident	15 Å²	15	44.2 Å²	44.2	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	138	173.5	-167.7	176.5	-95.8	0	0	112.1	G165 A276 A277 L280 S337 V338 E353	G165-M323 WeakPolarHBondContact O-CE 3.26Å; A276-M323 HydrophobicContact CB-CB 4.32Å; A276-M323 HydrophobicContact CB-CE 4.11Å; A276-M323 HydrophobicContact CB-SD 4Å; A277-M323 VanDerWaalsContact CA-SD 3.51Å; A277-M323 HydrophobicContact CB-CE 4.47Å; A277-M323 HydrophobicContact CB-SD 3.93Å; L280-M323 HydrophobicContact CD2-CG 3.92Å; L280-M323 HydrophobicContact CD2-SD 4.3Å; M323-S337 WeakPolarHBondContact O-CA 3.48Å; M323-V338 HydrophobicContact CB-CG2 3.95Å; M323-V338 PolarHBondContact N-O 3.05Å; M323-V338 PolarHBondContact O-N 2.89Å; M323-E353 VanDerWaalsContact CA-OE2 3.3Å; M323-E353 WeakPolarHBondContact CA-OE2 3.45Å; M323-E353 PolarHBondContact N-OE2 2.91Å
324	A	87.8	Confident	79.2	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.033	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	159	173.3	0	0	0	0	0	111.7	E353 H356 I357	A324-E353 HydrophobicContact CB-CB 4.15Å; A324-E353 PolarHBondContact N-OE2 2.83Å; A324-H356 HydrophobicContact CB-CB 4.17Å; A324-I357 HydrophobicContact CB-CD1 4.44Å; A324-I357 HydrophobicContact CB-CG1 3.92Å
325	D	82	Confident	80.5	Confident	40 Å²	40	48 Å²	48	21%	0.214	28%	0.281	C	S	.	.			trans	-77.2	148.9	168.4	-82	-42	0	0	0	111.2	T328 R334 H356	D325-T328 HydrophobicContact CB-CG2 3.62Å; D325-T328 PolarHBondContact O-OG1 2.94Å; D325-R334 IonicContact OD1-CZ 3.17Å; D325-R334 IonicContact OD1-NE 2.79Å; D325-R334 IonicContact OD1-NH2 2.9Å; D325-R334 PolarHBondContact OD1-NH2 3.22Å; D325-R334 IonicContact OD2-CZ 3.11Å; D325-R334 IonicContact OD2-NE 3.56Å; D325-R334 PolarHBondContact OD2-NE 3.05Å; D325-R334 IonicContact OD2-NH2 3.56Å; D325-R334 PolarHBondContact OD2-NH2 3.3Å; D325-R334 VanDerWaalsContact OD2-NH2 3.14Å; D325-H356 CarbonylContact O-C 3.49Å
326	V	82.4	Confident	82.2	Confident	51 Å²	51	42.7 Å²	42.7	31%	0.309	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	125.9	-177.7	-174.6	0	0	0	0	111.5	H356	V326-H356 CarbonylContact C-O 3.53Å; V326-H356 VanDerWaalsContact CA-O 3.24Å; V326-H356 WeakPolarHBondContact CA-O 2.74Å; V326-H356 HydrophobicContact CG2-CB 4.32Å
327	G	84.4	Confident	84.2	Confident	25 Å²	25	36.5 Å²	36.5	26%	0.258	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	26.4	171	0	0	0	0	0	115.4	H356 I357	G327-H356 PolarHBondContact N-O 2.97Å; G327-I357 CarbonylContact C-O 3.41Å; G327-I357 VanDerWaalsContact CA-O 3.28Å; G327-I357 WeakPolarHBondContact CA-O 3.35Å; G327-I357 PolarHBondContact N-O 3.13Å
328	T	89.8	Confident	85.7	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	19%	0.189	C	C	.	.			trans	-101.6	12.2	-173	54.8	0	0	0	0	114.4	D325 C330 D331 R334 S335 I357	D325-T328 HydrophobicContact CB-CG2 3.62Å; D325-T328 PolarHBondContact O-OG1 2.94Å; T328-C330 PolarHBondContact O-N 2.91Å; T328-D331 WeakPolarHBondContact O-CB 3.21Å; T328-D331 PolarHBondContact O-N 3.31Å; T328-R334 VanDerWaalsContact CB-O 3.32Å; T328-R334 WeakPolarHBondContact CB-O 3.42Å; T328-R334 HydrophobicContact CG2-CB 3.65Å; T328-R334 PolarHBondContact OG1-O 3.26Å; T328-S335 VanDerWaalsContact O-CB 3.27Å; T328-S335 WeakPolarHBondContact O-CB 2.93Å; T328-I357 PolarHBondContact N-O 3.28Å
329	M	92.5	Very high	87	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-49.9	-175.2	-172.4	57.3	80.7	0	0	114.9	V211 D302 T303 S335 I357 F358 F405 L414	V211-M329 HydrophobicContact CG1-CE 4.05Å; V211-M329 HydrophobicContact CG1-SD 4.03Å; V211-M329 HydrophobicContact CG2-CE 4.5Å; D302-M329 HydrophobicContact CB-SD 4.49Å; T303-M329 HydrophobicContact CG2-SD 4.42Å; M329-S335 WeakPolarHBondContact O-CB 3.24Å; M329-S335 PolarHBondContact O-OG 3.38Å; M329-I357 VanDerWaalsContact CA-CG2 3.4Å; M329-I357 HydrophobicContact CB-CG2 3.8Å; M329-I357 HydrophobicContact CE-CB 4.2Å; M329-I357 HydrophobicContact CE-CG2 3.62Å; M329-I357 HydrophobicContact CG-CG2 4.39Å; M329-I357 PolarHBondContact N-O 2.68Å; M329-I357 HydrophobicContact SD-CG2 3.77Å; M329-F358 HydrophobicContact CE-CD1 3.96Å; M329-F358 HydrophobicContact CE-CD2 3.76Å; M329-F358 HydrophobicContact CE-CE1 3.73Å; M329-F358 HydrophobicContact CE-CE2 3.51Å; M329-F358 HydrophobicContact CE-CG 3.98Å; M329-F358 HydrophobicContact CE-CZ 3.51Å; M329-F358 HydrophobicContact CG-CE1 4.42Å; M329-F405 HydrophobicContact CB-CE1 4.09Å; M329-F405 HydrophobicContact CB-CZ 3.95Å; M329-L414 HydrophobicContact CG-CD1 3.95Å; M329-L414 HydrophobicContact CG-CD2 3.83Å; M329-L414 HydrophobicContact CG-CG 4.18Å; M329-L414 HydrophobicContact SD-CD2 4.11Å
330	C	90.4	Very high	88.2	Confident	48 Å²	48	29 Å²	29	32%	0.324	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	22.1	177.2	-58.1	0	0	0	0	113.2	T328 P332 H410 G411 C413	T328-C330 PolarHBondContact O-N 2.91Å; C330-P332 WeakPolarHBondContact O-CD 3.23Å; C330-H410 PolarHBondContact SG-O 2.85Å; C330-G411 VanDerWaalsContact SG-CA 3.59Å; C330-C413 WeakPolarHBondContact CA-SG 3.46Å; C330-C413 HydrophobicContact CB-CB 3.92Å; C330-C413 WeakPolarHBondContact CB-SG 3.42Å; C330-C413 WeakPolarHBondContact SG-CB 3.37Å; C330-C413 PolarHBondContact SG-N 3.03Å; C330-C413 CovalentContact SG-SG 2.04Å; C330-C413 PolarHBondContact SG-SG 3.02Å
331	D	89.2	Confident	89.1	Confident	58 Å²	58	29.2 Å²	29.2	31%	0.31	15%	0.154	S	C	.	.			trans	-100.9	102.9	167.9	-177.5	-12.7	0	0	0	109.1	T328 K333 R334 S335	T328-D331 WeakPolarHBondContact O-CB 3.21Å; T328-D331 PolarHBondContact O-N 3.31Å; D331-K333 PolarHBondContact O-N 2.91Å; D331-K333 WeakPolarHBondContact OD1-CB 3.49Å; D331-K333 PolarHBondContact OD1-N 3.42Å; D331-R334 HydrophobicContact CB-CB 4.45Å; D331-R334 PolarHBondContact O-N 3.34Å; D331-S335 VanDerWaalsContact O-CB 3.27Å; D331-S335 WeakPolarHBondContact O-CB 3.44Å; D331-S335 PolarHBondContact O-N 3.32Å
332	P	86.6	Confident	89.1	Confident	45 Å²	45	28.6 Å²	28.6	29%	0.292	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.8	-176.1	-25.6	34.5	0	0	0	114.2	Q287 K288 C330	Q287-P332 PolarHBondContact NE2-O 3.04Å; K288-P332 HydrophobicContact CD-CB 3.75Å; K288-P332 WeakPolarHBondContact CD-O 3.5Å; C330-P332 WeakPolarHBondContact O-CD 3.23Å
333	K	86.3	Confident	89.1	Confident	151 Å²	151	28.6 Å²	28.6	66%	0.657	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-23.7	-178	-65.6	-178.2	179.7	179.4	0	112.9	K288 D331	K288-K333 HydrophobicContact CD-CG 4.48Å; K288-K333 HydrophobicContact CG-CG 4.38Å; D331-K333 PolarHBondContact O-N 2.91Å; D331-K333 WeakPolarHBondContact OD1-CB 3.49Å; D331-K333 PolarHBondContact OD1-N 3.42Å
334	R	86.3	Confident	88.9	Confident	115 Å²	115	29 Å²	29	43%	0.434	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.6	1.7	-169.7	-62.1	-176.8	66	-169.7	0.4	114	D325 T328 D331 C336	D325-R334 IonicContact OD1-CZ 3.17Å; D325-R334 IonicContact OD1-NE 2.79Å; D325-R334 IonicContact OD1-NH2 2.9Å; D325-R334 PolarHBondContact OD1-NH2 3.22Å; D325-R334 IonicContact OD2-CZ 3.11Å; D325-R334 IonicContact OD2-NE 3.56Å; D325-R334 PolarHBondContact OD2-NE 3.05Å; D325-R334 IonicContact OD2-NH2 3.56Å; D325-R334 PolarHBondContact OD2-NH2 3.3Å; D325-R334 VanDerWaalsContact OD2-NH2 3.14Å; T328-R334 VanDerWaalsContact CB-O 3.32Å; T328-R334 WeakPolarHBondContact CB-O 3.42Å; T328-R334 HydrophobicContact CG2-CB 3.65Å; T328-R334 PolarHBondContact OG1-O 3.26Å; D331-R334 HydrophobicContact CB-CB 4.45Å; D331-R334 PolarHBondContact O-N 3.34Å; R334-C336 PolarHBondContact O-N 3.44Å; R334-C336 VanDerWaalsContact O-N 3.07Å; R334-C336 PolarHBondContact O-SG 3.14Å
335	S	94.3	Very high	88.6	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.155	C	C	.	.			trans	-79.3	82.6	173.3	-168.1	0	0	0	0	110.6	D302 T303 A304 T328 M329 D331	D302-S335 WeakPolarHBondContact O-CB 2.99Å; D302-S335 PolarHBondContact O-OG 3.14Å; T303-S335 WeakPolarHBondContact CA-OG 3.47Å; T303-S335 WeakPolarHBondContact CB-OG 3.33Å; T303-S335 PolarHBondContact OG1-O 3.31Å; T303-S335 PolarHBondContact OG1-OG 2.85Å; A304-S335 PolarHBondContact N-O 3.05Å; T328-S335 VanDerWaalsContact O-CB 3.27Å; T328-S335 WeakPolarHBondContact O-CB 2.93Å; M329-S335 WeakPolarHBondContact O-CB 3.24Å; M329-S335 PolarHBondContact O-OG 3.38Å; D331-S335 VanDerWaalsContact O-CB 3.27Å; D331-S335 WeakPolarHBondContact O-CB 3.44Å; D331-S335 PolarHBondContact O-N 3.32Å
336	C	94.4	Very high	88.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	148.2	-172.5	30.4	0	0	0	0	110.2	L280 F283 C284 Q287 A304 R334	L280-C336 HydrophobicContact CD1-CB 4.45Å; F283-C336 HydrophobicContact CD1-CB 4.02Å; F283-C336 HydrophobicContact CE1-CB 4.12Å; C284-C336 VanDerWaalsContact CA-SG 3.51Å; C284-C336 HydrophobicContact CB-CB 4.09Å; C284-C336 WeakPolarHBondContact CB-SG 3.23Å; C284-C336 WeakPolarHBondContact SG-CB 3.32Å; C284-C336 CovalentContact SG-SG 2Å; C284-C336 PolarHBondContact SG-SG 3.31Å; Q287-C336 HydrophobicContact CG-CB 4.44Å; A304-C336 CarbonylContact O-C 3.57Å; A304-C336 VanDerWaalsContact O-CA 3.26Å; A304-C336 WeakPolarHBondContact O-CA 3.09Å; R334-C336 PolarHBondContact O-N 3.44Å; R334-C336 VanDerWaalsContact O-N 3.07Å; R334-C336 PolarHBondContact O-SG 3.14Å
337	S	95.8	Very high	89.1	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.7	170.5	58.5	0	0	0	0	111.6	F283 A304 L306 M323	F283-S337 WeakPolarHBondContact CE1-O 3.26Å; A304-S337 PolarHBondContact O-N 3.34Å; L306-S337 PolarHBondContact N-O 2.91Å; M323-S337 WeakPolarHBondContact O-CA 3.48Å
338	V	95.5	Very high	89.2	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.3	175.3	-59.1	0	0	0	0	108.6	T279 L280 F283 L306 L312 G322 M323	T279-V338 HydrophobicContact CG2-CB 4.47Å; T279-V338 HydrophobicContact CG2-CG1 4.14Å; L280-V338 HydrophobicContact CB-CG1 4.29Å; L280-V338 HydrophobicContact CB-CG2 4.13Å; L280-V338 HydrophobicContact CD1-CG1 4.07Å; L280-V338 HydrophobicContact CD1-CG2 4.45Å; F283-V338 HydrophobicContact CB-CG1 4.13Å; F283-V338 HydrophobicContact CD1-CG1 3.95Å; F283-V338 HydrophobicContact CG-CG1 4.35Å; L306-V338 HydrophobicContact CB-CG1 4.17Å; L306-V338 HydrophobicContact CD2-CG1 4.18Å; L312-V338 HydrophobicContact CD1-CG2 4.17Å; G322-V338 CarbonylContact C-O 3.58Å; G322-V338 VanDerWaalsContact CA-O 3.23Å; G322-V338 WeakPolarHBondContact CA-O 2.98Å; M323-V338 HydrophobicContact CB-CG2 3.95Å; M323-V338 PolarHBondContact N-O 3.05Å; M323-V338 PolarHBondContact O-N 2.89Å
339	I	94.8	Very high	89.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.4	-171.6	-57.3	178.3	0	0	0	109	I305 L306 F307 T308 T349 T350 E353	I305-I339 HydrophobicContact CG2-CD1 3.36Å; I305-I339 HydrophobicContact CG2-CG1 3.99Å; L306-I339 PolarHBondContact O-N 2.96Å; F307-I339 WeakPolarHBondContact CA-O 3.32Å; F307-I339 HydrophobicContact CD1-CB 4.11Å; F307-I339 HydrophobicContact CD1-CG2 4.07Å; F307-I339 HydrophobicContact CE1-CB 4.18Å; F307-I339 HydrophobicContact CE1-CD1 3.98Å; F307-I339 HydrophobicContact CE1-CG2 3.98Å; F307-I339 HydrophobicContact CZ-CD1 4.01Å; T308-I339 PolarHBondContact N-O 2.83Å; I339-T349 HydrophobicContact CG2-CG2 4.07Å; I339-T350 VanDerWaalsContact CD1-CA 3.48Å; I339-T350 HydrophobicContact CD1-CG2 3.91Å; I339-T350 VanDerWaalsContact CD1-OG1 3.27Å; I339-T350 WeakPolarHBondContact CD1-OG1 3.25Å; I339-E353 HydrophobicContact CG1-CG 4.33Å
340	E	92.3	Very high	89.1	Confident	25 Å²	25	24.7 Å²	24.7	12%	0.117	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	129.5	166.9	-173	-178.6	135.6	0	0	109.9	T308 D311 L312 L321 D342 S346	T308-E340 WeakPolarHBondContact O-CA 3.49Å; D311-E340 WeakPolarHBondContact CA-OE2 3.28Å; L312-E340 HydrophobicContact CD1-CB 4.21Å; L312-E340 HydrophobicContact CG-CB 4.31Å; L312-E340 PolarHBondContact N-OE2 3.17Å; L321-E340 WeakPolarHBondContact O-CB 3.06Å; L321-E340 PolarHBondContact O-N 2.62Å; E340-D342 PolarHBondContact O-N 2.98Å; E340-S346 PolarHBondContact O-OG 2.77Å
341	D	90.5	Very high	89.2	Confident	5 Å²	5	22.4 Å²	22.4	3%	0.027	11%	0.105	C	C	.	.			trans	-82.7	107.1	178.4	177.7	59.1	0	0	0	112.2	M221 H225 Y232 T308 K309 S346	M221-D341 HydrophobicContact CE-CB 3.68Å; M221-D341 HydrophobicContact SD-CB 3.37Å; M221-D341 WeakPolarHBondContact SD-CB 3.36Å; H225-D341 IonicContact CE1-OD2 2.79Å; H225-D341 IonicContact NE2-OD2 3.09Å; H225-D341 PolarHBondContact NE2-OD2 3.31Å; Y232-D341 WeakPolarHBondContact CE1-OD1 3.32Å; Y232-D341 VanDerWaalsContact CZ-OD1 3.27Å; Y232-D341 PolarHBondContact OH-OD1 3.41Å; T308-D341 PolarHBondContact O-N 3.07Å; K309-D341 HydrophobicContact CD-CB 3.72Å; K309-D341 WeakPolarHBondContact CD-OD2 3.18Å; K309-D341 PolarHBondContact NZ-O 2.87Å; K309-D341 IonicContact NZ-OD2 2.76Å; K309-D341 PolarHBondContact NZ-OD2 2.86Å; D341-S346 WeakPolarHBondContact CA-OG 3.45Å
342	D	82.9	Confident	89.2	Confident	8 Å²	8	19.9 Å²	19.9	4%	0.043	9%	0.092	C	C	.	.			trans	-112.7	29.7	-179.5	-167.3	11.2	0	0	0	112.4	L321 E340 P345 S346 R474	L321-D342 HydrophobicContact CD2-CB 4.49Å; E340-D342 PolarHBondContact O-N 2.98Å; D342-P345 WeakPolarHBondContact O-CD 3.44Å; D342-S346 PolarHBondContact N-OG 3.5Å; D342-R474 VanDerWaalsContact CG-CD 3.45Å; D342-R474 WeakPolarHBondContact OD1-CD 3.47Å; D342-R474 IonicContact OD1-CZ 3.16Å; D342-R474 IonicContact OD1-NE 3.34Å; D342-R474 PolarHBondContact OD1-NE 3.18Å; D342-R474 IonicContact OD1-NH1 2.75Å; D342-R474 PolarHBondContact OD1-NH1 2.96Å; D342-R474 IonicContact OD1-NH2 2.78Å; D342-R474 PolarHBondContact OD1-NH2 3.47Å; D342-R474 VanDerWaalsContact OD1-NH2 3.15Å; D342-R474 WeakPolarHBondContact OD2-CD 3.25Å; D342-R474 IonicContact OD2-CZ 3.19Å; D342-R474 IonicContact OD2-NE 3.89Å; D342-R474 IonicContact OD2-NH1 2.74Å; D342-R474 PolarHBondContact OD2-NH1 2.82Å
343	G	85.3	Confident	89.5	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.078	C	C	.	.	S	Bend	trans	80.3	-161.5	-173.9	0	0	0	0	0	112.4	Y232 S346	Y232-G343 WeakPolarHBondContact OH-CA 3.34Å; Y232-G343 PolarHBondContact OH-N 3.17Å; Y232-G343 PolarHBondContact OH-O 2.94Å; G343-S346 WeakPolarHBondContact O-CB 3.17Å; G343-S346 PolarHBondContact O-N 3.45Å; G343-S346 PolarHBondContact O-OG 3.03Å
344	L	82.8	Confident	89.9	Confident	25 Å²	25	10.7 Å²	10.7	13%	0.131	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-31.1	-179.1	-64.2	-176.6	0	0	0	115.6	Y232 L236 S346 A347 P429 Y433 Q438 L441 A479	Y232-L344 HydrophobicContact CD2-CD2 4.41Å; Y232-L344 HydrophobicContact CE2-CD2 3.97Å; L236-L344 HydrophobicContact CD2-CD2 4.01Å; L344-S346 PolarHBondContact O-N 2.81Å; L344-A347 WeakPolarHBondContact O-CB 3.18Å; L344-A347 PolarHBondContact O-N 3.17Å; L344-P429 HydrophobicContact CD1-CB 4.44Å; L344-Y433 HydrophobicContact CD1-CG 4.45Å; L344-Y433 HydrophobicContact CD2-CD2 4.14Å; L344-Y433 HydrophobicContact CD2-CE2 4.48Å; L344-Y433 HydrophobicContact CD2-CG 4.41Å; L344-Q438 HydrophobicContact CD1-CG 3.7Å; L344-L441 HydrophobicContact CG-CD1 4.42Å; L344-A479 HydrophobicContact CD1-CB 3.69Å
345	P	81.6	Confident	90.2	Very high	11 Å²	11	5.2 Å²	5.2	7%	0.071	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.5	172.6	-28.8	37.8	0	0	0	115.8	D342 A347 F348 F476	D342-P345 WeakPolarHBondContact O-CD 3.44Å; P345-A347 PolarHBondContact O-N 2.92Å; P345-F348 WeakPolarHBondContact O-CB 3.34Å; P345-F348 PolarHBondContact O-N 2.04Å; P345-F476 HydrophobicContact CB-CB 4.49Å; P345-F476 HydrophobicContact CB-CD1 3.9Å; P345-F476 HydrophobicContact CB-CD2 3.43Å; P345-F476 VanDerWaalsContact CB-CD2 3.43Å; P345-F476 HydrophobicContact CB-CE1 3.91Å; P345-F476 HydrophobicContact CB-CE2 3.43Å; P345-F476 VanDerWaalsContact CB-CE2 3.43Å; P345-F476 HydrophobicContact CB-CG 3.66Å; P345-F476 HydrophobicContact CB-CZ 3.68Å; P345-F476 HydrophobicContact CG-CB 3.8Å; P345-F476 HydrophobicContact CG-CD1 4.14Å; P345-F476 HydrophobicContact CG-CD2 3.26Å; P345-F476 HydrophobicContact CG-CE2 3.81Å; P345-F476 HydrophobicContact CG-CG 3.45Å; P345-F476 VanDerWaalsContact CG-CG 3.45Å; P345-F476 HydrophobicContact CG-CZ 4.45Å
346	S	88.2	Confident	89.8	Confident	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-59.4	-16.4	176.1	-70.1	0	0	0	0	113.4	E340 D341 D342 G343 L344 F348 T349 T350	E340-S346 PolarHBondContact O-OG 2.77Å; D341-S346 WeakPolarHBondContact CA-OG 3.45Å; D342-S346 PolarHBondContact N-OG 3.5Å; G343-S346 WeakPolarHBondContact O-CB 3.17Å; G343-S346 PolarHBondContact O-N 3.45Å; G343-S346 PolarHBondContact O-OG 3.03Å; L344-S346 PolarHBondContact O-N 2.81Å; S346-F348 VanDerWaalsContact C-N 3.32Å; S346-F348 PolarHBondContact O-N 3.3Å; S346-T349 PolarHBondContact O-N 3.32Å; S346-T350 WeakPolarHBondContact O-CB 3.37Å; S346-T350 PolarHBondContact O-N 3.43Å; S346-T350 PolarHBondContact O-OG1 3.14Å
347	A	86.9	Confident	89.8	Confident	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62.3	-35.9	168.5	0	0	0	0	0	113.5	L236 V239 L344 P345 T350 A351	L236-A347 HydrophobicContact CB-CB 4.22Å; L236-A347 HydrophobicContact CD2-CB 4.18Å; L236-A347 WeakPolarHBondContact O-CB 3.26Å; V239-A347 HydrophobicContact CB-CB 3.66Å; V239-A347 HydrophobicContact CG1-CB 3.65Å; V239-A347 HydrophobicContact CG2-CB 4.48Å; L344-A347 WeakPolarHBondContact O-CB 3.18Å; L344-A347 PolarHBondContact O-N 3.17Å; P345-A347 PolarHBondContact O-N 2.92Å; A347-T350 WeakPolarHBondContact O-CB 3.42Å; A347-T350 PolarHBondContact O-N 2.82Å; A347-A351 PolarHBondContact O-N 3.19Å
348	F	85.9	Confident	89.7	Confident	24 Å²	24	5.3 Å²	5.3	11%	0.105	3%	0.027	C	C	.	.	H	α-helix	trans	-73.3	-41.1	176.2	-64.6	-85.9	0	0	0	110.7	L243 P345 S346 T350 A351 H352 M380 L385 I388	L243-F348 HydrophobicContact CD1-CD1 3.85Å; L243-F348 HydrophobicContact CD1-CE1 4.01Å; L243-F348 HydrophobicContact CD2-CE1 4.27Å; P345-F348 WeakPolarHBondContact O-CB 3.34Å; P345-F348 PolarHBondContact O-N 2.04Å; S346-F348 VanDerWaalsContact C-N 3.32Å; S346-F348 PolarHBondContact O-N 3.3Å; F348-T350 VanDerWaalsContact C-N 3.28Å; F348-T350 PolarHBondContact O-N 3.42Å; F348-A351 PolarHBondContact O-N 2.04Å; F348-A351 VanDerWaalsContact O-N 3.17Å; F348-H352 WeakPolarHBondContact O-CB 2.95Å; F348-H352 PolarHBondContact O-N 3.37Å; F348-M380 HydrophobicContact CB-SD 4.36Å; F348-M380 HydrophobicContact CD1-CE 3.93Å; F348-M380 HydrophobicContact CD1-SD 4.15Å; F348-L385 HydrophobicContact CB-CD2 4.25Å; F348-I388 HydrophobicContact CB-CD1 4.35Å; F348-I388 HydrophobicContact CD1-CD1 3.82Å; F348-I388 HydrophobicContact CG-CD1 4.32Å
349	T	88.5	Confident	89.3	Confident	3 Å²	3	7.3 Å²	7.3	2%	0.018	4%	0.038	C	C	.	.	H	α-helix	trans	-58.2	-43.2	170.8	-45.1	0	0	0	0	110.8	L321 I339 S346 A351 H352 E353	L321-T349 HydrophobicContact CB-CG2 3.93Å; L321-T349 WeakPolarHBondContact O-CG2 3.4Å; I339-T349 HydrophobicContact CG2-CG2 4.07Å; S346-T349 PolarHBondContact O-N 3.32Å; T349-A351 VanDerWaalsContact C-N 3.34Å; T349-A351 PolarHBondContact O-N 2.94Å; T349-H352 WeakPolarHBondContact O-CB 3.28Å; T349-H352 PolarHBondContact O-N 3.14Å; T349-H352 VanDerWaalsContact O-N 3.13Å; T349-E353 HydrophobicContact CG2-CG 4.42Å; T349-E353 WeakPolarHBondContact O-CG 3.47Å; T349-E353 PolarHBondContact O-N 2.92Å
350	T	92.7	Very high	88.9	Confident	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-58	-45.1	174.7	-53.8	0	0	0	0	112.1	M237 A240 I305 F307 I339 S346 A347 F348 L354	M237-T350 HydrophobicContact CE-CG2 4.47Å; M237-T350 HydrophobicContact SD-CG2 3.81Å; A240-T350 HydrophobicContact CB-CG2 4.13Å; I305-T350 HydrophobicContact CD1-CG2 3.8Å; F307-T350 HydrophobicContact CZ-CG2 4.38Å; I339-T350 VanDerWaalsContact CD1-CA 3.48Å; I339-T350 HydrophobicContact CD1-CG2 3.91Å; I339-T350 VanDerWaalsContact CD1-OG1 3.27Å; I339-T350 WeakPolarHBondContact CD1-OG1 3.25Å; S346-T350 WeakPolarHBondContact O-CB 3.37Å; S346-T350 PolarHBondContact O-N 3.43Å; S346-T350 PolarHBondContact O-OG1 3.14Å; A347-T350 WeakPolarHBondContact O-CB 3.42Å; A347-T350 PolarHBondContact O-N 2.82Å; F348-T350 VanDerWaalsContact C-N 3.28Å; F348-T350 PolarHBondContact O-N 3.42Å; T350-L354 HydrophobicContact CG2-CD1 4.29Å; T350-L354 WeakPolarHBondContact O-CB 3.28Å; T350-L354 WeakPolarHBondContact O-CG 3.4Å; T350-L354 PolarHBondContact O-N 3.3Å; T350-L354 VanDerWaalsContact O-N 3.09Å
351	A	92.4	Very high	88.5	Confident	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-66.9	-36	176.6	0	0	0	0	0	112.7	A240 L243 Y244 A347 F348 T349 G355 M380	A240-A351 HydrophobicContact CB-CB 4.43Å; L243-A351 HydrophobicContact CB-CB 4.47Å; L243-A351 HydrophobicContact CD1-CB 3.8Å; Y244-A351 HydrophobicContact CE2-CB 4.18Å; Y244-A351 PolarHBondContact OH-O 2.75Å; A347-A351 PolarHBondContact O-N 3.19Å; F348-A351 PolarHBondContact O-N 2.04Å; F348-A351 VanDerWaalsContact O-N 3.17Å; T349-A351 VanDerWaalsContact C-N 3.34Å; T349-A351 PolarHBondContact O-N 2.94Å; A351-G355 PolarHBondContact O-N 2.8Å; A351-G355 VanDerWaalsContact O-N 3.12Å; A351-M380 HydrophobicContact CB-CG 4.29Å; A351-M380 HydrophobicContact CB-SD 3.93Å
352	H	89.8	Confident	88.2	Confident	5 Å²	5	7.3 Å²	7.3	2%	0.023	4%	0.038	C	C	.	.	H	α-helix	trans	-64	-51.3	176	-173.2	100.2	0	0	0	111.8	F348 T349 L354 G355 H356 H362 M380 S382	F348-H352 WeakPolarHBondContact O-CB 2.95Å; F348-H352 PolarHBondContact O-N 3.37Å; T349-H352 WeakPolarHBondContact O-CB 3.28Å; T349-H352 PolarHBondContact O-N 3.14Å; T349-H352 VanDerWaalsContact O-N 3.13Å; H352-L354 PolarHBondContact O-N 2.95Å; H352-G355 VanDerWaalsContact O-CA 3.28Å; H352-G355 WeakPolarHBondContact O-CA 3.21Å; H352-G355 PolarHBondContact O-N 2.96Å; H352-H356 AromaticContact CD2-CD2 3.95Å; H352-H356 AromaticContact CD2-NE2 3.69Å; H352-H356 AromaticContact NE2-CE1 4Å; H352-H356 AromaticContact NE2-NE2 3.31Å; H352-H356 PolarHBondContact NE2-NE2 3.02Å; H352-H356 PolarHBondContact O-N 3.02Å; H352-H362 AromaticContact CE1-CD2 3.77Å; H352-H362 AromaticContact CE1-NE2 3.9Å; H352-H362 AromaticContact NE2-CD2 3.67Å; H352-H362 AromaticContact NE2-NE2 3.42Å; H352-H362 PolarHBondContact NE2-NE2 2.77Å; H352-M380 PolarHBondContact ND1-O 2.87Å; H352-S382 PolarHBondContact CE1-O 3.19Å; H352-S382 VanDerWaalsContact CE1-O 3.27Å
353	E	93	Very high	88.1	Confident	3 Å²	3	7.8 Å²	7.8	1%	0.014	4%	0.041	C	C	.	.	H	α-helix	trans	-65.5	-38.9	-179.1	-62.8	-44.9	136.1	0	0	112.2	M323 A324 I339 T349 G355 H356 I357	M323-E353 VanDerWaalsContact CA-OE2 3.3Å; M323-E353 WeakPolarHBondContact CA-OE2 3.45Å; M323-E353 PolarHBondContact N-OE2 2.91Å; A324-E353 HydrophobicContact CB-CB 4.15Å; A324-E353 PolarHBondContact N-OE2 2.83Å; I339-E353 HydrophobicContact CG1-CG 4.33Å; T349-E353 HydrophobicContact CG2-CG 4.42Å; T349-E353 WeakPolarHBondContact O-CG 3.47Å; T349-E353 PolarHBondContact O-N 2.92Å; E353-G355 PolarHBondContact O-N 2.69Å; E353-H356 WeakPolarHBondContact O-CB 3.49Å; E353-H356 PolarHBondContact O-N 3.06Å; E353-H356 VanDerWaalsContact O-N 3.15Å; E353-H356 IonicContact OE2-CD2 3.17Å; E353-I357 WeakPolarHBondContact O-CG1 3.5Å; E353-I357 PolarHBondContact O-N 2.71Å; E353-I357 VanDerWaalsContact O-N 3.14Å
354	L	94.6	Very high	87.6	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.3	-32.3	170.4	-76.6	173.8	0	0	0	111.5	Y244 I255 T303 I305 T350 H352 I357 F358	Y244-L354 HydrophobicContact CE2-CB 3.84Å; Y244-L354 HydrophobicContact CE2-CD1 3.93Å; Y244-L354 WeakPolarHBondContact OH-CB 3.3Å; I255-L354 HydrophobicContact CD1-CD1 4.35Å; T303-L354 HydrophobicContact CG2-CD2 4.01Å; I305-L354 HydrophobicContact CD1-CD1 4.24Å; I305-L354 HydrophobicContact CD1-CD2 4.1Å; I305-L354 HydrophobicContact CD1-CG 4.18Å; T350-L354 HydrophobicContact CG2-CD1 4.29Å; T350-L354 WeakPolarHBondContact O-CB 3.28Å; T350-L354 WeakPolarHBondContact O-CG 3.4Å; T350-L354 PolarHBondContact O-N 3.3Å; T350-L354 VanDerWaalsContact O-N 3.09Å; H352-L354 PolarHBondContact O-N 2.95Å; L354-I357 HydrophobicContact CD2-CD1 4.15Å; L354-I357 PolarHBondContact O-N 2.78Å; L354-F358 WeakPolarHBondContact O-CD2 3.39Å; L354-F358 PolarHBondContact O-N 2.81Å
355	G	91.9	Very high	87.2	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.2	-44	174.3	0	0	0	0	0	111.8	Y244 A351 H352 E353 F358 N359 M360	Y244-G355 WeakPolarHBondContact OH-CA 3.41Å; Y244-G355 PolarHBondContact OH-N 2.87Å; A351-G355 PolarHBondContact O-N 2.8Å; A351-G355 VanDerWaalsContact O-N 3.12Å; H352-G355 VanDerWaalsContact O-CA 3.28Å; H352-G355 WeakPolarHBondContact O-CA 3.21Å; H352-G355 PolarHBondContact O-N 2.96Å; E353-G355 PolarHBondContact O-N 2.69Å; G355-F358 CarbonylContact O-C 3.54Å; G355-F358 WeakPolarHBondContact O-CA 3.45Å; G355-F358 WeakPolarHBondContact O-CB 3.39Å; G355-F358 PolarHBondContact O-N 2.91Å; G355-F358 VanDerWaalsContact O-N 3.13Å; G355-N359 PolarHBondContact O-N 3.49Å; G355-M360 VanDerWaalsContact O-CB 3.24Å; G355-M360 WeakPolarHBondContact O-CB 3.49Å; G355-M360 WeakPolarHBondContact O-CG 3.3Å; G355-M360 PolarHBondContact O-N 2.84Å
356	H	86.9	Confident	86.5	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.009	10%	0.1	C	C	.	.	H	α-helix	trans	-60.5	-45.7	172.4	-71.8	-39.1	0	0	0	112.1	A324 D325 V326 G327 H352 E353 F358 N359 M360 H362 M381	A324-H356 HydrophobicContact CB-CB 4.17Å; D325-H356 CarbonylContact O-C 3.49Å; V326-H356 CarbonylContact C-O 3.53Å; V326-H356 VanDerWaalsContact CA-O 3.24Å; V326-H356 WeakPolarHBondContact CA-O 2.74Å; V326-H356 HydrophobicContact CG2-CB 4.32Å; G327-H356 PolarHBondContact N-O 2.97Å; H352-H356 AromaticContact CD2-CD2 3.95Å; H352-H356 AromaticContact CD2-NE2 3.69Å; H352-H356 AromaticContact NE2-CE1 4Å; H352-H356 AromaticContact NE2-NE2 3.31Å; H352-H356 PolarHBondContact NE2-NE2 3.02Å; H352-H356 PolarHBondContact O-N 3.02Å; E353-H356 WeakPolarHBondContact O-CB 3.49Å; E353-H356 PolarHBondContact O-N 3.06Å; E353-H356 VanDerWaalsContact O-N 3.15Å; E353-H356 IonicContact OE2-CD2 3.17Å; H356-F358 PolarHBondContact O-N 2.92Å; H356-F358 VanDerWaalsContact O-N 3.16Å; H356-N359 WeakPolarHBondContact O-CA 3.36Å; H356-N359 PolarHBondContact O-N 2.84Å; H356-M360 PolarHBondContact ND1-O 2.99Å; H356-H362 AromaticContact CE1-CD2 3.5Å; H356-H362 AromaticContact CE1-NE2 3.49Å; H356-H362 PolarHBondContact CE1-NE2 2.99Å; H356-H362 AromaticContact NE2-CD2 3.8Å; H356-H362 AromaticContact NE2-NE2 3.36Å; H356-H362 PolarHBondContact NE2-NE2 3.48Å; H356-M381 VanDerWaalsContact CE1-CE 3.48Å; H356-M381 WeakPolarHBondContact CE1-CE 3.37Å
357	I	93.3	Very high	85.4	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.5	-32.5	176.3	-58.7	176.6	0	0	0	111.2	T303 A324 G327 T328 M329 E353 L354 N359	T303-I357 WeakPolarHBondContact OG1-CD1 3.23Å; A324-I357 HydrophobicContact CB-CD1 4.44Å; A324-I357 HydrophobicContact CB-CG1 3.92Å; G327-I357 CarbonylContact C-O 3.41Å; G327-I357 VanDerWaalsContact CA-O 3.28Å; G327-I357 WeakPolarHBondContact CA-O 3.35Å; G327-I357 PolarHBondContact N-O 3.13Å; T328-I357 PolarHBondContact N-O 3.28Å; M329-I357 VanDerWaalsContact CA-CG2 3.4Å; M329-I357 HydrophobicContact CB-CG2 3.8Å; M329-I357 HydrophobicContact CE-CB 4.2Å; M329-I357 HydrophobicContact CE-CG2 3.62Å; M329-I357 HydrophobicContact CG-CG2 4.39Å; M329-I357 PolarHBondContact N-O 2.68Å; M329-I357 HydrophobicContact SD-CG2 3.77Å; E353-I357 WeakPolarHBondContact O-CG1 3.5Å; E353-I357 PolarHBondContact O-N 2.71Å; E353-I357 VanDerWaalsContact O-N 3.14Å; L354-I357 HydrophobicContact CD2-CD1 4.15Å; L354-I357 PolarHBondContact O-N 2.78Å; I357-N359 PolarHBondContact O-N 3.22Å
358	F	93.3	Very high	84.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	11.2	171.2	-82.8	-62.5	0	0	0	115.8	V211 Y244 I253 M329 L354 G355 H356 M360 I402 F405 L406 L414	V211-F358 HydrophobicContact CG2-CE2 4.24Å; V211-F358 HydrophobicContact CG2-CZ 3.6Å; Y244-F358 HydrophobicContact CD1-CE2 4.46Å; Y244-F358 AromaticContact CE1-CD2 3.91Å; Y244-F358 HydrophobicContact CE1-CD2 3.91Å; Y244-F358 AromaticContact CE1-CE2 3.86Å; Y244-F358 HydrophobicContact CE1-CE2 3.86Å; I253-F358 HydrophobicContact CG2-CE2 4.23Å; I253-F358 HydrophobicContact CG2-CZ 3.92Å; M329-F358 HydrophobicContact CE-CD1 3.96Å; M329-F358 HydrophobicContact CE-CD2 3.76Å; M329-F358 HydrophobicContact CE-CE1 3.73Å; M329-F358 HydrophobicContact CE-CE2 3.51Å; M329-F358 HydrophobicContact CE-CG 3.98Å; M329-F358 HydrophobicContact CE-CZ 3.51Å; M329-F358 HydrophobicContact CG-CE1 4.42Å; L354-F358 WeakPolarHBondContact O-CD2 3.39Å; L354-F358 PolarHBondContact O-N 2.81Å; G355-F358 CarbonylContact O-C 3.54Å; G355-F358 WeakPolarHBondContact O-CA 3.45Å; G355-F358 WeakPolarHBondContact O-CB 3.39Å; G355-F358 PolarHBondContact O-N 2.91Å; G355-F358 VanDerWaalsContact O-N 3.13Å; H356-F358 PolarHBondContact O-N 2.92Å; H356-F358 VanDerWaalsContact O-N 3.16Å; F358-M360 VanDerWaalsContact C-N 3.32Å; F358-M360 HydrophobicContact CB-CE 4.07Å; F358-M360 PolarHBondContact O-N 2.88Å; F358-I402 HydrophobicContact CB-CD1 3.84Å; F358-I402 HydrophobicContact CB-CG1 4.24Å; F358-I402 HydrophobicContact CD1-CD1 3.59Å; F358-I402 HydrophobicContact CD1-CG1 4.03Å; F358-I402 HydrophobicContact CD2-CD1 3.93Å; F358-I402 HydrophobicContact CE1-CD1 4Å; F358-I402 HydrophobicContact CE2-CD1 4.32Å; F358-I402 HydrophobicContact CG-CD1 3.54Å; F358-I402 HydrophobicContact CG-CG1 4.24Å; F358-I402 HydrophobicContact CZ-CD1 4.34Å; F358-F405 HydrophobicContact CD1-CD1 4.26Å; F358-F405 HydrophobicContact CD1-CE1 4.21Å; F358-L406 HydrophobicContact CE1-CD2 4.4Å; F358-L414 HydrophobicContact CE1-CD1 3.57Å; F358-L414 HydrophobicContact CZ-CD1 4.03Å
359	N	87.6	Confident	83.5	Confident	43 Å²	43	21.7 Å²	21.7	23%	0.23	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	18.2	-179.2	-160.1	71.6	0	0	0	114.8	G355 H356 I357 P361 I401 F405	G355-N359 PolarHBondContact O-N 3.49Å; H356-N359 WeakPolarHBondContact O-CA 3.36Å; H356-N359 PolarHBondContact O-N 2.84Å; I357-N359 PolarHBondContact O-N 3.22Å; N359-P361 WeakPolarHBondContact O-CD 3.44Å; N359-I401 WeakPolarHBondContact O-CG2 3.35Å; N359-F405 HydrophobicContact CB-CD2 3.47Å; N359-F405 VanDerWaalsContact CB-CD2 3.47Å; N359-F405 HydrophobicContact CB-CE2 3.89Å; N359-F405 HydrophobicContact CB-CG 4.21Å
360	M	87.4	Confident	82.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-79.7	120.4	175.3	-56	179.8	-157.4	0	0	110	I249 G355 H356 F358 M381 W394 I402	I249-M360 HydrophobicContact CD1-CE 3.71Å; G355-M360 VanDerWaalsContact O-CB 3.24Å; G355-M360 WeakPolarHBondContact O-CB 3.49Å; G355-M360 WeakPolarHBondContact O-CG 3.3Å; G355-M360 PolarHBondContact O-N 2.84Å; H356-M360 PolarHBondContact ND1-O 2.99Å; F358-M360 VanDerWaalsContact C-N 3.32Å; F358-M360 HydrophobicContact CB-CE 4.07Å; F358-M360 PolarHBondContact O-N 2.88Å; M360-M381 HydrophobicContact CB-CE 4.08Å; M360-M381 HydrophobicContact CB-CG 4.06Å; M360-M381 HydrophobicContact CB-SD 4.28Å; M360-M381 HydrophobicContact SD-CG 4Å; M360-M381 HydrophobicContact SD-SD 4.28Å; M360-W394 HydrophobicContact CE-CE3 4.44Å; M360-W394 HydrophobicContact CE-CZ3 4.08Å; M360-W394 HydrophobicContact SD-CE3 4.02Å; M360-W394 HydrophobicContact SD-CZ3 3.65Å; M360-I402 HydrophobicContact CE-CB 3.58Å; M360-I402 HydrophobicContact CE-CD1 3.37Å; M360-I402 HydrophobicContact CE-CG1 3.99Å; M360-I402 HydrophobicContact CE-CG2 3.92Å
361	P	83	Confident	80.7	Confident	13 Å²	13	28.3 Å²	28.3	8%	0.084	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-77	173.8	166.9	35.9	-35.3	0	0	0	110.3	F172 N359 V365 I401	F172-P361 HydrophobicContact CE1-CG 3.97Å; F172-P361 HydrophobicContact CE2-CB 4.49Å; F172-P361 HydrophobicContact CZ-CB 4.38Å; F172-P361 HydrophobicContact CZ-CG 4Å; N359-P361 WeakPolarHBondContact O-CD 3.44Å; P361-V365 HydrophobicContact CB-CG1 4.12Å; P361-V365 HydrophobicContact CB-CG2 4.05Å; P361-V365 HydrophobicContact CG-CG2 3.93Å; P361-I401 HydrophobicContact CG-CD1 3.61Å
362	H	84.9	Confident	79.3	Confident	17 Å²	17	30.4 Å²	30.4	8%	0.079	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-63.1	148.6	170.8	-63.1	152.5	0	0	0	112.1	H352 H356 N364 V365 M381	H352-H362 AromaticContact CE1-CD2 3.77Å; H352-H362 AromaticContact CE1-NE2 3.9Å; H352-H362 AromaticContact NE2-CD2 3.67Å; H352-H362 AromaticContact NE2-NE2 3.42Å; H352-H362 PolarHBondContact NE2-NE2 2.77Å; H356-H362 AromaticContact CE1-CD2 3.5Å; H356-H362 AromaticContact CE1-NE2 3.49Å; H356-H362 PolarHBondContact CE1-NE2 2.99Å; H356-H362 AromaticContact NE2-CD2 3.8Å; H356-H362 AromaticContact NE2-NE2 3.36Å; H356-H362 PolarHBondContact NE2-NE2 3.48Å; H362-N364 VanDerWaalsContact CB-OD1 3.27Å; H362-N364 WeakPolarHBondContact CB-OD1 3.48Å; H362-N364 PolarHBondContact O-N 2.72Å; H362-V365 HydrophobicContact CB-CG1 4.39Å; H362-V365 WeakPolarHBondContact O-CG1 3.09Å; H362-V365 VanDerWaalsContact O-CG2 3.22Å; H362-V365 WeakPolarHBondContact O-CG2 3.12Å; H362-V365 PolarHBondContact O-N 2.92Å; H362-M381 CarbonylContact C-O 3.59Å; H362-M381 WeakPolarHBondContact CA-O 3.43Å
363	D	79.8	Confident	78	Confident	17 Å²	17	31.9 Å²	31.9	9%	0.091	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.5	-176.3	-74.2	-44.4	0	0	0	114	V365 C368 L375 H379 M381 S395 S398	D363-V365 VanDerWaalsContact C-N 3.35Å; D363-C368 WeakPolarHBondContact O-CB 3.45Å; D363-L375 HydrophobicContact CB-CD1 3.86Å; D363-H379 WeakPolarHBondContact OD2-CB 3.19Å; D363-M381 PolarHBondContact N-O 2.89Å; D363-S395 VanDerWaalsContact OD1-CB 3.3Å; D363-S395 WeakPolarHBondContact OD1-CB 3.31Å; D363-S395 PolarHBondContact OD1-OG 3.28Å; D363-S398 PolarHBondContact OD1-OG 2.83Å
364	N	75.8	Confident	76.5	Confident	112 Å²	112	41.5 Å²	41.5	60%	0.599	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.2	179.8	71.4	-24.2	0	0	0	114.1	H362	H362-N364 VanDerWaalsContact CB-OD1 3.27Å; H362-N364 WeakPolarHBondContact CB-OD1 3.48Å; H362-N364 PolarHBondContact O-N 2.72Å
365	V	72.8	Confident	75.1	Confident	27 Å²	27	44.2 Å²	44.2	16%	0.164	23%	0.234	C	C	.	.	S	Bend	trans	-65	145.9	179.1	-62.5	0	0	0	0	111.4	P361 H362 D363 A367 C368 G369	P361-V365 HydrophobicContact CB-CG1 4.12Å; P361-V365 HydrophobicContact CB-CG2 4.05Å; P361-V365 HydrophobicContact CG-CG2 3.93Å; H362-V365 HydrophobicContact CB-CG1 4.39Å; H362-V365 WeakPolarHBondContact O-CG1 3.09Å; H362-V365 VanDerWaalsContact O-CG2 3.22Å; H362-V365 WeakPolarHBondContact O-CG2 3.12Å; H362-V365 PolarHBondContact O-N 2.92Å; D363-V365 VanDerWaalsContact C-N 3.35Å; V365-A367 HydrophobicContact CG2-CB 4.42Å; V365-A367 PolarHBondContact O-N 3.31Å; V365-A367 VanDerWaalsContact O-N 3.12Å; V365-C368 HydrophobicContact CG2-CB 4.14Å; V365-C368 PolarHBondContact O-N 3.12Å; V365-G369 PolarHBondContact O-N 3.25Å; V365-G369 VanDerWaalsContact O-N 3.15Å
366	K	66.9	Low	73.5	Confident	158 Å²	158	53.8 Å²	53.8	69%	0.687	28%	0.275	S	S	*	.	H	α-helix	trans	-52.3	-39.3	-177.1	-162.7	-177.1	-171.2	-119.3	0	112.8	C368 G369 E370	K366-C368 VanDerWaalsContact C-N 3.32Å; K366-C368 PolarHBondContact O-N 2.99Å; K366-G369 PolarHBondContact O-N 2.96Å; K366-G369 VanDerWaalsContact O-N 3.16Å; K366-E370 WeakPolarHBondContact CD-OE1 3.18Å; K366-E370 WeakPolarHBondContact CE-OE1 3.42Å; K366-E370 HydrophobicContact CG-CG 4.16Å; K366-E370 WeakPolarHBondContact CG-OE1 3.49Å; K366-E370 IonicContact NZ-OE1 2.69Å; K366-E370 PolarHBondContact NZ-OE1 3.46Å; K366-E370 WeakPolarHBondContact O-CB 3.28Å; K366-E370 WeakPolarHBondContact O-CG 3.02Å; K366-E370 PolarHBondContact O-N 3.06Å
367	A	66.1	Low	72.4	Confident	17 Å²	17	58 Å²	58	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-36.5	178	0	0	0	0	0	113.4	L176 V365	L176-A367 HydrophobicContact CD1-CB 4.24Å; L176-A367 WeakPolarHBondContact CD1-O 3Å; V365-A367 HydrophobicContact CG2-CB 4.42Å; V365-A367 PolarHBondContact O-N 3.31Å; V365-A367 VanDerWaalsContact O-N 3.12Å
368	C	69.1	Low	71.4	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.014	32%	0.315	C	S	.	.	H	α-helix	trans	-72.4	-43.9	173.4	-69.5	0	0	0	0	110.7	D363 V365 K366 E370 V371 F372 C397	D363-C368 WeakPolarHBondContact O-CB 3.45Å; V365-C368 HydrophobicContact CG2-CB 4.14Å; V365-C368 PolarHBondContact O-N 3.12Å; K366-C368 VanDerWaalsContact C-N 3.32Å; K366-C368 PolarHBondContact O-N 2.99Å; C368-E370 PolarHBondContact O-N 3.26Å; C368-V371 PolarHBondContact O-N 2.84Å; C368-F372 PolarHBondContact O-N 2.77Å; C368-C397 HydrophobicContact CB-CB 3.84Å; C368-C397 WeakPolarHBondContact CB-SG 3.3Å; C368-C397 WeakPolarHBondContact SG-CB 3.37Å; C368-C397 CovalentContact SG-SG 2.04Å; C368-C397 PolarHBondContact SG-SG 3.48Å
369	G	63.6	Low	71	Confident	36 Å²	36	61.7 Å²	61.7	37%	0.371	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-35.6	-178.9	0	0	0	0	0	114.7	V365 K366 V371 G373	V365-G369 PolarHBondContact O-N 3.25Å; V365-G369 VanDerWaalsContact O-N 3.15Å; K366-G369 PolarHBondContact O-N 2.96Å; K366-G369 VanDerWaalsContact O-N 3.16Å; G369-V371 VanDerWaalsContact C-N 3.33Å; G369-V371 PolarHBondContact O-N 2.76Å; G369-G373 VanDerWaalsContact O-CA 3.24Å; G369-G373 WeakPolarHBondContact O-CA 3.44Å; G369-G373 PolarHBondContact O-N 2.95Å; G369-G373 VanDerWaalsContact O-N 3.11Å
370	E	62.7	Low	71	Confident	122 Å²	122	59.6 Å²	59.6	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-69	-28.5	178.8	-76.5	175.2	173.6	0	0	113.1	K366 C368	K366-E370 WeakPolarHBondContact CD-OE1 3.18Å; K366-E370 WeakPolarHBondContact CE-OE1 3.42Å; K366-E370 HydrophobicContact CG-CG 4.16Å; K366-E370 WeakPolarHBondContact CG-OE1 3.49Å; K366-E370 IonicContact NZ-OE1 2.69Å; K366-E370 PolarHBondContact NZ-OE1 3.46Å; K366-E370 WeakPolarHBondContact O-CB 3.28Å; K366-E370 WeakPolarHBondContact O-CG 3.02Å; K366-E370 PolarHBondContact O-N 3.06Å; C368-E370 PolarHBondContact O-N 3.26Å
371	V	58.8	Low	71.1	Confident	21 Å²	21	59.6 Å²	59.6	13%	0.127	31%	0.306	C	S	.	.	H	α-helix	trans	-100.7	-42.4	-175.6	174.4	0	0	0	0	113	L176 C368 G369	L176-V371 HydrophobicContact CB-CB 3.87Å; L176-V371 HydrophobicContact CB-CG1 3.88Å; L176-V371 HydrophobicContact CB-CG2 3.5Å; L176-V371 VanDerWaalsContact CB-CG2 3.5Å; L176-V371 WeakPolarHBondContact O-CG1 3.49Å; C368-V371 PolarHBondContact O-N 2.84Å; G369-V371 VanDerWaalsContact C-N 3.33Å; G369-V371 PolarHBondContact O-N 2.76Å
372	F	63.6	Low	71.1	Confident	44 Å²	44	59.4 Å²	59.4	19%	0.193	31%	0.305	C	S	.	.	H	α-helix	trans	-105.4	-1.8	-173.4	-58.9	-76.8	0	0	0	113.1	L176 Y179 C368 V396 C397 A400	L176-F372 HydrophobicContact CB-CE2 4.35Å; L176-F372 HydrophobicContact CD1-CE2 4.34Å; L176-F372 HydrophobicContact CD2-CE2 4.21Å; Y179-F372 HydrophobicContact CD2-CZ 4.21Å; Y179-F372 HydrophobicContact CG-CE1 4.34Å; Y179-F372 AromaticContact CG-CZ 4Å; Y179-F372 HydrophobicContact CG-CZ 4Å; C368-F372 PolarHBondContact O-N 2.77Å; F372-V396 HydrophobicContact CD1-CB 4.41Å; F372-V396 HydrophobicContact CD1-CG1 3.93Å; F372-V396 HydrophobicContact CE1-CB 4.41Å; F372-V396 HydrophobicContact CE1-CG1 3.57Å; F372-V396 HydrophobicContact CZ-CG1 4.29Å; F372-C397 HydrophobicContact CD2-CB 3.96Å; F372-C397 HydrophobicContact CE2-CB 4Å; F372-A400 HydrophobicContact CZ-CB 4.01Å
373	G	62.3	Low	70.4	Confident	35 Å²	35	59.8 Å²	59.8	36%	0.361	31%	0.309	S	S	.	.			trans	74.3	-172.8	-172.1	0	0	0	0	0	112.6	G369 L375	G369-G373 VanDerWaalsContact O-CA 3.24Å; G369-G373 WeakPolarHBondContact O-CA 3.44Å; G369-G373 PolarHBondContact O-N 2.95Å; G369-G373 VanDerWaalsContact O-N 3.11Å; G373-L375 PolarHBondContact O-N 2.94Å
374	K	62.5	Low	69.8	Low	206 Å²	206	61 Å²	61	90%	0.896	32%	0.318	S	S	*	.			trans	-71.8	112.8	173.3	-71.3	-174.2	179.3	-178.2	0	109.2	K376	K374-K376 PolarHBondContact O-N 2.67Å
375	L	65.3	Low	69	Low	57 Å²	57	56.6 Å²	56.6	30%	0.298	29%	0.294	S	S	.	.			trans	-62.4	125.3	170.9	-63.7	168	0	0	0	108.4	D363 G373	D363-L375 HydrophobicContact CB-CD1 3.86Å; G373-L375 PolarHBondContact O-N 2.94Å
376	K	56.9	Low	68.4	Low	200 Å²	200	57.7 Å²	57.7	87%	0.87	30%	0.298	S	S	*	.			trans	-78.5	-26.7	-174	-68.5	-177.7	179.2	178.2	0	113.3	K374	K374-K376 PolarHBondContact O-N 2.67Å
377	D	64.3	Low	68.2	Low	92 Å²	92	56.6 Å²	56.6	49%	0.492	30%	0.295	S	S	.	.	S	Bend	trans	-113.9	153.2	-172.4	-53.8	-54.2	0	0	0	112.2	H379	D377-H379 PolarHBondContact O-CE1 2.81Å; D377-H379 PolarHBondContact O-ND1 2.9Å
378	N	73.3	Confident	68.3	Low	64 Å²	64	57 Å²	57	34%	0.342	30%	0.295	S	S	.	.			trans	-81.2	122.5	174.1	-67.2	-18.4	0	0	0	109.9	I386 I388 D389	N378-I386 PolarHBondContact ND2-O 3.36Å; N378-I388 WeakPolarHBondContact O-CA 3.27Å; N378-D389 PolarHBondContact O-N 2.89Å
379	H	85.5	Confident	68.4	Low	12 Å²	12	59.2 Å²	59.2	6%	0.056	31%	0.307	C	S	.	.			trans	-112.6	179.3	179	-56.3	77.7	0	0	0	110.4	D363 D377 M381 S382 R392 S395	D363-H379 WeakPolarHBondContact OD2-CB 3.19Å; D377-H379 PolarHBondContact O-CE1 2.81Å; D377-H379 PolarHBondContact O-ND1 2.9Å; H379-M381 VanDerWaalsContact C-N 3.28Å; H379-M381 PolarHBondContact O-N 2.88Å; H379-S382 WeakPolarHBondContact O-CB 3.46Å; H379-S382 PolarHBondContact O-N 3.31Å; H379-R392 PolarHBondContact CD2-O 2Å; H379-R392 VanDerWaalsContact CD2-O 3.25Å; H379-S395 VanDerWaalsContact CD2-CA 3.41Å; H379-S395 WeakPolarHBondContact CD2-CA 3.48Å; H379-S395 PolarHBondContact CD2-N 2.86Å
380	M	87.3	Confident	68.7	Low	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-39.9	-175.9	-164.3	64.1	55.2	0	0	113.2	L243 F348 A351 H352 S382 I388 P393 W394	L243-M380 HydrophobicContact CB-CE 4.47Å; L243-M380 HydrophobicContact CD1-CE 3.62Å; L243-M380 HydrophobicContact CD1-SD 4.36Å; L243-M380 HydrophobicContact CD2-CE 3.73Å; L243-M380 HydrophobicContact CG-CE 4.13Å; F348-M380 HydrophobicContact CB-SD 4.36Å; F348-M380 HydrophobicContact CD1-CE 3.93Å; F348-M380 HydrophobicContact CD1-SD 4.15Å; A351-M380 HydrophobicContact CB-CG 4.29Å; A351-M380 HydrophobicContact CB-SD 3.93Å; H352-M380 PolarHBondContact ND1-O 2.87Å; M380-S382 PolarHBondContact O-N 3.46Å; M380-I388 HydrophobicContact CE-CD1 4.31Å; M380-I388 HydrophobicContact CE-CG2 4.34Å; M380-I388 HydrophobicContact SD-CD1 4.06Å; M380-P393 VanDerWaalsContact CB-O 3.3Å; M380-P393 WeakPolarHBondContact CB-O 3.47Å; M380-P393 HydrophobicContact CE-CB 4.06Å; M380-P393 PolarHBondContact N-O 2.82Å; M380-W394 HydrophobicContact CB-CD2 4.24Å; M380-W394 HydrophobicContact CB-CE3 3.82Å; M380-W394 HydrophobicContact CB-CH2 4.28Å; M380-W394 HydrophobicContact CB-CZ3 3.85Å; M380-W394 HydrophobicContact CG-CE3 4.3Å; M380-W394 HydrophobicContact CG-CH2 3.84Å; M380-W394 HydrophobicContact CG-CZ2 4.3Å; M380-W394 HydrophobicContact CG-CZ3 3.84Å
381	M	88.7	Confident	69.2	Low	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	18.7	-179.5	-58.6	-52.9	-56.7	0	0	112.6	H356 M360 H362 D363 H379 W394 S398	H356-M381 VanDerWaalsContact CE1-CE 3.48Å; H356-M381 WeakPolarHBondContact CE1-CE 3.37Å; M360-M381 HydrophobicContact CB-CE 4.08Å; M360-M381 HydrophobicContact CB-CG 4.06Å; M360-M381 HydrophobicContact CB-SD 4.28Å; M360-M381 HydrophobicContact SD-CG 4Å; M360-M381 HydrophobicContact SD-SD 4.28Å; H362-M381 CarbonylContact C-O 3.59Å; H362-M381 WeakPolarHBondContact CA-O 3.43Å; D363-M381 PolarHBondContact N-O 2.89Å; H379-M381 VanDerWaalsContact C-N 3.28Å; H379-M381 PolarHBondContact O-N 2.88Å; M381-W394 HydrophobicContact CG-CE3 4.47Å; M381-W394 HydrophobicContact CG-CZ3 4.14Å; M381-W394 HydrophobicContact SD-CZ3 4.08Å; M381-S398 VanDerWaalsContact CG-OG 3.23Å; M381-S398 WeakPolarHBondContact CG-OG 3.35Å
382	S	83.4	Confident	70.1	Confident	9 Å²	9	62.7 Å²	62.7	6%	0.063	31%	0.311	C	S	.	.	S	Bend	trans	-64	140.5	167	178.2	0	0	0	0	110.3	H352 H379 M380 T384	H352-S382 PolarHBondContact CE1-O 3.19Å; H352-S382 VanDerWaalsContact CE1-O 3.27Å; H379-S382 WeakPolarHBondContact O-CB 3.46Å; H379-S382 PolarHBondContact O-N 3.31Å; M380-S382 PolarHBondContact O-N 3.46Å; S382-T384 WeakPolarHBondContact CB-O 3.17Å; S382-T384 PolarHBondContact O-N 3.01Å; S382-T384 VanDerWaalsContact O-N 3.1Å; S382-T384 PolarHBondContact OG-N 2.99Å; S382-T384 PolarHBondContact OG-O 3.28Å
383	P	70.2	Confident	71.1	Confident	25 Å²	25	60.7 Å²	60.7	16%	0.162	30%	0.303	C	S	.	.	S	Bend	trans	-66.2	-9.9	175.9	30.7	-38.9	0	0	0	113.5	R163	R163-P383 PolarHBondContact N-O 2.88Å
384	T	66.4	Low	72.3	Confident	43 Å²	43	59.1 Å²	59.1	26%	0.264	29%	0.286	S	S	.	.	S	Bend	trans	-125.3	129.9	171.8	57.5	0	0	0	0	109.9	S382 I386	S382-T384 WeakPolarHBondContact CB-O 3.17Å; S382-T384 PolarHBondContact O-N 3.01Å; S382-T384 VanDerWaalsContact O-N 3.1Å; S382-T384 PolarHBondContact OG-N 2.99Å; S382-T384 PolarHBondContact OG-O 3.28Å; T384-I386 PolarHBondContact O-N 3.25Å
385	L	59.8	Low	73.4	Confident	19 Å²	19	49.3 Å²	49.3	10%	0.099	24%	0.243	C	C	.	.			trans	-78.8	25.3	-179.6	-73.2	164.1	0	0	0	113.6	L321 F348 I388 F476	L321-L385 HydrophobicContact CD1-CD1 4.03Å; F348-L385 HydrophobicContact CB-CD2 4.25Å; L385-I388 HydrophobicContact CD2-CD1 3.98Å; L385-F476 HydrophobicContact CB-CE1 4.34Å; L385-F476 HydrophobicContact CB-CZ 4.17Å
386	I	59.8	Low	74.2	Confident	50 Å²	50	48.1 Å²	48.1	26%	0.256	24%	0.238	S	C	.	.	S	Bend	trans	-93.1	123.9	-174.6	-57.8	172.5	0	0	0	109.4	N378 T384	N378-I386 PolarHBondContact ND2-O 3.36Å; T384-I386 PolarHBondContact O-N 3.25Å
387	Q	63.6	Low	75.5	Confident	134 Å²	134	38.6 Å²	38.6	63%	0.626	20%	0.197	S	C	*	.	S	Bend	trans	58.3	53.8	172.1	-65.6	175.3	-45	0	0	114.9	D389	Q387-D389 PolarHBondContact O-N 3.3Å
388	I	67.4	Low	76.6	Confident	27 Å²	27	34.3 Å²	34.3	14%	0.138	17%	0.174	C	C	.	.			trans	-63.4	128.9	173.1	-57.7	170.2	0	0	0	110.1	F348 N378 M380 L385 R390	F348-I388 HydrophobicContact CB-CD1 4.35Å; F348-I388 HydrophobicContact CD1-CD1 3.82Å; F348-I388 HydrophobicContact CG-CD1 4.32Å; N378-I388 WeakPolarHBondContact O-CA 3.27Å; M380-I388 HydrophobicContact CE-CD1 4.31Å; M380-I388 HydrophobicContact CE-CG2 4.34Å; M380-I388 HydrophobicContact SD-CD1 4.06Å; L385-I388 HydrophobicContact CD2-CD1 3.98Å; I388-R390 PolarHBondContact O-N 3.25Å; I388-R390 VanDerWaalsContact O-N 3.12Å
389	D	71.5	Confident	77.3	Confident	47 Å²	47	31.3 Å²	31.3	25%	0.251	16%	0.158	S	C	.	.			trans	-65.3	110.4	170.7	180	3.4	0	0	0	110.4	N378 Q387 S391 R392 P393	N378-D389 PolarHBondContact O-N 2.89Å; Q387-D389 PolarHBondContact O-N 3.3Å; D389-S391 VanDerWaalsContact C-N 3.3Å; D389-S391 VanDerWaalsContact CG-OG 3.26Å; D389-S391 PolarHBondContact O-N 3.09Å; D389-S391 WeakPolarHBondContact OD1-CA 3.5Å; D389-S391 VanDerWaalsContact OD1-CB 3.32Å; D389-S391 WeakPolarHBondContact OD1-CB 3.5Å; D389-S391 PolarHBondContact OD1-N 2.79Å; D389-S391 PolarHBondContact OD1-OG 3.32Å; D389-S391 PolarHBondContact OD2-OG 3.5Å; D389-S391 VanDerWaalsContact OD2-OG 3.04Å; D389-R392 CarbonylContact O-C 3.42Å; D389-R392 PolarHBondContact O-N 3.31Å; D389-P393 WeakPolarHBondContact O-CA 3.2Å; D389-P393 VanDerWaalsContact O-N 3.08Å
390	R	69.6	Low	77.1	Confident	58 Å²	58	30.9 Å²	30.9	22%	0.219	16%	0.157	C	C	.	.	S	Bend	trans	-76.1	-16.1	-179.3	-68.4	-174.9	164.4	-157.3	-6	113.7	I388 P477 D480	I388-R390 PolarHBondContact O-N 3.25Å; I388-R390 VanDerWaalsContact O-N 3.12Å; R390-P477 VanDerWaalsContact CZ-CG 3.47Å; R390-D480 IonicContact NH1-OD1 3.17Å; R390-D480 PolarHBondContact NH1-OD1 3.41Å; R390-D480 IonicContact NH1-OD2 2.72Å
391	S	72.8	Confident	76.8	Confident	66 Å²	66	31.1 Å²	31.1	46%	0.462	16%	0.158	S	C	.	.	S	Bend	trans	-78.4	-30.4	174.7	78	0	0	0	0	111.6	H246 D389	H246-S391 PolarHBondContact CE1-O 2.79Å; H246-S391 PolarHBondContact NE2-O 3.45Å; D389-S391 VanDerWaalsContact C-N 3.3Å; D389-S391 VanDerWaalsContact CG-OG 3.26Å; D389-S391 PolarHBondContact O-N 3.09Å; D389-S391 WeakPolarHBondContact OD1-CA 3.5Å; D389-S391 VanDerWaalsContact OD1-CB 3.32Å; D389-S391 WeakPolarHBondContact OD1-CB 3.5Å; D389-S391 PolarHBondContact OD1-N 2.79Å; D389-S391 PolarHBondContact OD1-OG 3.32Å; D389-S391 PolarHBondContact OD2-OG 3.5Å; D389-S391 VanDerWaalsContact OD2-OG 3.04Å
392	R	78.9	Confident	76.8	Confident	128 Å²	128	31.1 Å²	31.1	48%	0.483	16%	0.158	S	C	.	.	S	Bend	trans	-139.6	72.8	176.7	-65.9	-179.1	66.2	-176.2	2.3	110.3	H379 D389 W394	H379-R392 PolarHBondContact CD2-O 2Å; H379-R392 VanDerWaalsContact CD2-O 3.25Å; D389-R392 CarbonylContact O-C 3.42Å; D389-R392 PolarHBondContact O-N 3.31Å; R392-W394 PolarHBondContact O-N 2.85Å; R392-W394 VanDerWaalsContact O-N 3.14Å
393	P	83.6	Confident	76.8	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.019	16%	0.158	C	C	.	.			trans	-62.7	-25.6	-175	24	-34.6	0	0	0	113.8	L243 H246 M380 D389	L243-P393 HydrophobicContact CD2-CB 4.15Å; L243-P393 HydrophobicContact CD2-CG 4.48Å; H246-P393 HydrophobicContact CB-CG 3.89Å; H246-P393 WeakPolarHBondContact ND1-CD 3.27Å; M380-P393 VanDerWaalsContact CB-O 3.3Å; M380-P393 WeakPolarHBondContact CB-O 3.47Å; M380-P393 HydrophobicContact CE-CB 4.06Å; M380-P393 PolarHBondContact N-O 2.82Å; D389-P393 WeakPolarHBondContact O-CA 3.2Å; D389-P393 VanDerWaalsContact O-N 3.08Å
394	W	87.5	Confident	77.1	Confident	1 Å²	1	31.1 Å²	31.1	0%	0.004	16%	0.156	C	C	.	.	S	Bend	trans	-109.4	133.2	-179.3	-58.7	101.2	0	0	0	110.9	L243 Y244 S248 I249 M360 M380 M381 R392	L243-W394 PolarHBondContact O-NE1 2.74Å; Y244-W394 HydrophobicContact CD1-CH2 4.34Å; Y244-W394 AromaticContact CD1-CZ2 3.84Å; Y244-W394 HydrophobicContact CD1-CZ2 3.84Å; Y244-W394 HydrophobicContact CD2-CZ2 4.23Å; Y244-W394 AromaticContact CE1-CH2 3.63Å; Y244-W394 HydrophobicContact CE1-CH2 3.63Å; Y244-W394 AromaticContact CE1-CZ2 3.62Å; Y244-W394 HydrophobicContact CE1-CZ2 3.62Å; Y244-W394 HydrophobicContact CE2-CH2 4.12Å; Y244-W394 HydrophobicContact CE2-CZ2 4.04Å; Y244-W394 HydrophobicContact CG-CZ2 4.14Å; Y244-W394 AromaticContact CZ-CH2 3.5Å; Y244-W394 AromaticContact CZ-CZ2 3.72Å; S248-W394 PolarHBondContact OG-N 3Å; I249-W394 HydrophobicContact CB-CB 4.47Å; I249-W394 HydrophobicContact CB-CG 4.01Å; I249-W394 HydrophobicContact CD1-CB 4.01Å; I249-W394 HydrophobicContact CD1-CD2 3.54Å; I249-W394 HydrophobicContact CD1-CE3 3.79Å; I249-W394 HydrophobicContact CD1-CG 3.65Å; I249-W394 HydrophobicContact CD1-CZ3 4.45Å; I249-W394 HydrophobicContact CG1-CD2 4.32Å; I249-W394 HydrophobicContact CG1-CG 4.27Å; M360-W394 HydrophobicContact CE-CE3 4.44Å; M360-W394 HydrophobicContact CE-CZ3 4.08Å; M360-W394 HydrophobicContact SD-CE3 4.02Å; M360-W394 HydrophobicContact SD-CZ3 3.65Å; M380-W394 HydrophobicContact CB-CD2 4.24Å; M380-W394 HydrophobicContact CB-CE3 3.82Å; M380-W394 HydrophobicContact CB-CH2 4.28Å; M380-W394 HydrophobicContact CB-CZ3 3.85Å; M380-W394 HydrophobicContact CG-CE3 4.3Å; M380-W394 HydrophobicContact CG-CH2 3.84Å; M380-W394 HydrophobicContact CG-CZ2 4.3Å; M380-W394 HydrophobicContact CG-CZ3 3.84Å; M381-W394 HydrophobicContact CG-CE3 4.47Å; M381-W394 HydrophobicContact CG-CZ3 4.14Å; M381-W394 HydrophobicContact SD-CZ3 4.08Å; R392-W394 PolarHBondContact O-N 2.85Å; R392-W394 VanDerWaalsContact O-N 3.14Å
395	S	86.3	Confident	78	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.			trans	-71.8	161.1	175.7	80.7	0	0	0	0	111.3	D363 H379 C397 S398 A399	D363-S395 VanDerWaalsContact OD1-CB 3.3Å; D363-S395 WeakPolarHBondContact OD1-CB 3.31Å; D363-S395 PolarHBondContact OD1-OG 3.28Å; H379-S395 VanDerWaalsContact CD2-CA 3.41Å; H379-S395 WeakPolarHBondContact CD2-CA 3.48Å; H379-S395 PolarHBondContact CD2-N 2.86Å; S395-C397 PolarHBondContact O-N 3.35Å; S395-C397 PolarHBondContact OG-N 3.36Å; S395-S398 PolarHBondContact O-N 2.88Å; S395-S398 WeakPolarHBondContact OG-CB 3.48Å; S395-S398 PolarHBondContact OG-N 2.73Å; S395-S398 PolarHBondContact OG-OG 2.81Å; S395-A399 WeakPolarHBondContact O-CB 3.43Å; S395-A399 PolarHBondContact O-N 2.81Å
396	V	82.6	Confident	79.2	Confident	33 Å²	33	28.8 Å²	28.8	20%	0.2	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-33.3	172.5	-176.9	0	0	0	0	111.1	L182 F372 A400	L182-V396 HydrophobicContact CD1-CG1 4.33Å; L182-V396 HydrophobicContact CD2-CG1 3.83Å; F372-V396 HydrophobicContact CD1-CB 4.41Å; F372-V396 HydrophobicContact CD1-CG1 3.93Å; F372-V396 HydrophobicContact CE1-CB 4.41Å; F372-V396 HydrophobicContact CE1-CG1 3.57Å; F372-V396 HydrophobicContact CZ-CG1 4.29Å; V396-A400 VanDerWaalsContact O-CB 3.23Å; V396-A400 WeakPolarHBondContact O-CB 3.31Å; V396-A400 PolarHBondContact O-N 3.41Å
397	C	83.7	Confident	80	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-49.5	176.6	-162.8	0	0	0	0	110.9	C368 F372 S395 A399 A400 I401	C368-C397 HydrophobicContact CB-CB 3.84Å; C368-C397 WeakPolarHBondContact CB-SG 3.3Å; C368-C397 WeakPolarHBondContact SG-CB 3.37Å; C368-C397 CovalentContact SG-SG 2.04Å; C368-C397 PolarHBondContact SG-SG 3.48Å; F372-C397 HydrophobicContact CD2-CB 3.96Å; F372-C397 HydrophobicContact CE2-CB 4Å; S395-C397 PolarHBondContact O-N 3.35Å; S395-C397 PolarHBondContact OG-N 3.36Å; C397-A399 PolarHBondContact O-N 2.86Å; C397-A400 PolarHBondContact O-N 3.44Å; C397-I401 VanDerWaalsContact O-CG1 3.28Å; C397-I401 WeakPolarHBondContact O-CG1 3.31Å; C397-I401 PolarHBondContact O-N 3.37Å
398	S	87.1	Confident	80.4	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.007	12%	0.116	C	C	.	.	H	α-helix	trans	-56.8	-48.7	176.9	-70.8	0	0	0	0	111.5	D363 M381 S395 A400 I401 I402	D363-S398 PolarHBondContact OD1-OG 2.83Å; M381-S398 VanDerWaalsContact CG-OG 3.23Å; M381-S398 WeakPolarHBondContact CG-OG 3.35Å; S395-S398 PolarHBondContact O-N 2.88Å; S395-S398 WeakPolarHBondContact OG-CB 3.48Å; S395-S398 PolarHBondContact OG-N 2.73Å; S395-S398 PolarHBondContact OG-OG 2.81Å; S398-A400 PolarHBondContact O-N 3.12Å; S398-I401 PolarHBondContact O-N 3.16Å; S398-I402 WeakPolarHBondContact O-CG2 3.45Å; S398-I402 PolarHBondContact O-N 2.74Å; S398-I402 VanDerWaalsContact O-N 3.08Å
399	A	87	Confident	80.8	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-62.7	-38.4	178.3	0	0	0	0	0	113	S248 L250 S395 C397 I402 T403	S248-A399 WeakPolarHBondContact O-CB 3.49Å; L250-A399 HydrophobicContact CB-CB 4.29Å; L250-A399 HydrophobicContact CD1-CB 3.98Å; L250-A399 HydrophobicContact CG-CB 4.07Å; S395-A399 WeakPolarHBondContact O-CB 3.43Å; S395-A399 PolarHBondContact O-N 2.81Å; C397-A399 PolarHBondContact O-N 2.86Å; A399-I402 WeakPolarHBondContact O-CG2 3.3Å; A399-T403 WeakPolarHBondContact O-CB 3.3Å; A399-T403 PolarHBondContact O-N 2.6Å; A399-T403 VanDerWaalsContact O-N 3.14Å; A399-T403 PolarHBondContact O-OG1 3.09Å
400	A	81	Confident	81.3	Confident	4 Å²	4	25.3 Å²	25.3	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-66.9	-42.4	176.8	0	0	0	0	0	112.4	L176 Y179 F372 V396 C397 S398 T403 E404	L176-A400 HydrophobicContact CD2-CB 4.4Å; Y179-A400 HydrophobicContact CD1-CB 4.02Å; Y179-A400 HydrophobicContact CD2-CB 3.8Å; Y179-A400 HydrophobicContact CE1-CB 3.91Å; Y179-A400 HydrophobicContact CE2-CB 3.67Å; Y179-A400 HydrophobicContact CG-CB 3.97Å; Y179-A400 PolarHBondContact OH-O 3.29Å; F372-A400 HydrophobicContact CZ-CB 4.01Å; V396-A400 VanDerWaalsContact O-CB 3.23Å; V396-A400 WeakPolarHBondContact O-CB 3.31Å; V396-A400 PolarHBondContact O-N 3.41Å; C397-A400 PolarHBondContact O-N 3.44Å; S398-A400 PolarHBondContact O-N 3.12Å; A400-T403 WeakPolarHBondContact O-CB 3.45Å; A400-E404 WeakPolarHBondContact O-CB 2.99Å; A400-E404 PolarHBondContact O-N 3.29Å
401	I	82.1	Confident	82	Confident	4 Å²	4	22.6 Å²	22.6	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-70	-45.6	-176.9	-69.6	171.6	0	0	0	111.1	F172 L176 N359 P361 C397 S398 T403 E404 F405	F172-I401 HydrophobicContact CE1-CD1 4.44Å; L176-I401 HydrophobicContact CD1-CD1 4.47Å; L176-I401 HydrophobicContact CD2-CG1 3.92Å; N359-I401 WeakPolarHBondContact O-CG2 3.35Å; P361-I401 HydrophobicContact CG-CD1 3.61Å; C397-I401 VanDerWaalsContact O-CG1 3.28Å; C397-I401 WeakPolarHBondContact O-CG1 3.31Å; C397-I401 PolarHBondContact O-N 3.37Å; S398-I401 PolarHBondContact O-N 3.16Å; I401-T403 VanDerWaalsContact C-N 3.35Å; I401-T403 PolarHBondContact O-N 3.48Å; I401-E404 PolarHBondContact O-N 2.04Å; I401-F405 WeakPolarHBondContact O-CB 3.43Å; I401-F405 PolarHBondContact O-N 3.48Å
402	I	88	Confident	82.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.5	-37.7	176.4	-170.4	166.3	0	0	0	112.3	I249 I253 F358 M360 S398 A399 E404 F405 L406	I249-I402 HydrophobicContact CD1-CG2 3.85Å; I249-I402 HydrophobicContact CG1-CG2 4.23Å; I253-I402 HydrophobicContact CD1-CD1 3.25Å; I253-I402 HydrophobicContact CD1-CG1 4.33Å; I253-I402 HydrophobicContact CG1-CD1 4.45Å; F358-I402 HydrophobicContact CB-CD1 3.84Å; F358-I402 HydrophobicContact CB-CG1 4.24Å; F358-I402 HydrophobicContact CD1-CD1 3.59Å; F358-I402 HydrophobicContact CD1-CG1 4.03Å; F358-I402 HydrophobicContact CD2-CD1 3.93Å; F358-I402 HydrophobicContact CE1-CD1 4Å; F358-I402 HydrophobicContact CE2-CD1 4.32Å; F358-I402 HydrophobicContact CG-CD1 3.54Å; F358-I402 HydrophobicContact CG-CG1 4.24Å; F358-I402 HydrophobicContact CZ-CD1 4.34Å; M360-I402 HydrophobicContact CE-CB 3.58Å; M360-I402 HydrophobicContact CE-CD1 3.37Å; M360-I402 HydrophobicContact CE-CG1 3.99Å; M360-I402 HydrophobicContact CE-CG2 3.92Å; S398-I402 WeakPolarHBondContact O-CG2 3.45Å; S398-I402 PolarHBondContact O-N 2.74Å; S398-I402 VanDerWaalsContact O-N 3.08Å; A399-I402 WeakPolarHBondContact O-CG2 3.3Å; I402-E404 VanDerWaalsContact C-N 3.26Å; I402-E404 PolarHBondContact O-N 2.75Å; I402-F405 PolarHBondContact O-N 2.82Å; I402-L406 HydrophobicContact CG1-CD1 4.03Å; I402-L406 HydrophobicContact CG1-CG 4.14Å; I402-L406 WeakPolarHBondContact O-CB 3.41Å; I402-L406 VanDerWaalsContact O-CG 3.28Å; I402-L406 WeakPolarHBondContact O-CG 3.22Å; I402-L406 PolarHBondContact O-N 3.5Å
403	T	83.7	Confident	83.2	Confident	12 Å²	12	17 Å²	17	7%	0.074	9%	0.089	C	C	.	.	H	α-helix	trans	-54.5	-47.4	172.9	-69.6	0	0	0	0	110.3	N251 A399 A400 I401 D407 R552	N251-T403 PolarHBondContact ND2-OG1 3.42Å; A399-T403 WeakPolarHBondContact O-CB 3.3Å; A399-T403 PolarHBondContact O-N 2.6Å; A399-T403 VanDerWaalsContact O-N 3.14Å; A399-T403 PolarHBondContact O-OG1 3.09Å; A400-T403 WeakPolarHBondContact O-CB 3.45Å; I401-T403 VanDerWaalsContact C-N 3.35Å; I401-T403 PolarHBondContact O-N 3.48Å; T403-D407 VanDerWaalsContact O-CB 3.25Å; T403-D407 WeakPolarHBondContact O-CB 3.47Å; T403-D407 PolarHBondContact O-N 3.46Å; T403-R552 VanDerWaalsContact CG2-NH2 3.29Å; T403-R552 PolarHBondContact O-NH2 3.14Å; T403-R552 PolarHBondContact OG1-NH1 3.18Å
404	E	77.6	Confident	83.5	Confident	22 Å²	22	16.9 Å²	16.9	10%	0.103	9%	0.088	C	C	.	.	H	α-helix	trans	-68	-41.6	179	179.1	158.7	-143.8	0	0	112.7	V174 A400 I401 I402 L406 D407 R408	V174-E404 WeakPolarHBondContact CG1-OE2 3.07Å; A400-E404 WeakPolarHBondContact O-CB 2.99Å; A400-E404 PolarHBondContact O-N 3.29Å; I401-E404 PolarHBondContact O-N 2.04Å; I402-E404 VanDerWaalsContact C-N 3.26Å; I402-E404 PolarHBondContact O-N 2.75Å; E404-L406 PolarHBondContact O-N 3.31Å; E404-D407 PolarHBondContact O-N 3.49Å; E404-R408 HydrophobicContact CG-CG 4.31Å; E404-R408 VanDerWaalsContact CG-NE 3.27Å; E404-R408 VanDerWaalsContact O-CB 3.3Å; E404-R408 WeakPolarHBondContact O-CB 3.03Å; E404-R408 WeakPolarHBondContact O-CG 3.44Å; E404-R408 PolarHBondContact O-N 2.89Å; E404-R408 IonicContact OE1-CZ 3.44Å; E404-R408 IonicContact OE1-NE 3.4Å; E404-R408 PolarHBondContact OE1-NE 2.87Å; E404-R408 VanDerWaalsContact OE1-NE 3.16Å; E404-R408 IonicContact OE1-NH2 2.72Å; E404-R408 PolarHBondContact OE1-NH2 2.64Å
405	F	83.5	Confident	83.5	Confident	9 Å²	9	20.5 Å²	20.5	4%	0.039	11%	0.107	C	C	.	.	H	α-helix	trans	-56.4	-50.4	174.7	-179.6	-94.6	0	0	0	111.6	M329 F358 N359 I401 I402 R408 H410	M329-F405 HydrophobicContact CB-CE1 4.09Å; M329-F405 HydrophobicContact CB-CZ 3.95Å; F358-F405 HydrophobicContact CD1-CD1 4.26Å; F358-F405 HydrophobicContact CD1-CE1 4.21Å; N359-F405 HydrophobicContact CB-CD2 3.47Å; N359-F405 VanDerWaalsContact CB-CD2 3.47Å; N359-F405 HydrophobicContact CB-CE2 3.89Å; N359-F405 HydrophobicContact CB-CG 4.21Å; I401-F405 WeakPolarHBondContact O-CB 3.43Å; I401-F405 PolarHBondContact O-N 3.48Å; I402-F405 PolarHBondContact O-N 2.82Å; F405-R408 PolarHBondContact O-N 3.16Å; F405-H410 HydrophobicContact CD1-CB 4.14Å; F405-H410 HydrophobicContact CD2-CB 3.54Å; F405-H410 HydrophobicContact CE1-CB 3.93Å; F405-H410 HydrophobicContact CE2-CB 3.32Å; F405-H410 HydrophobicContact CG-CB 3.95Å; F405-H410 HydrophobicContact CZ-CB 3.52Å; F405-H410 WeakPolarHBondContact CZ-O 3.47Å; F405-H410 WeakPolarHBondContact O-CB 3.1Å; F405-H410 PolarHBondContact O-N 3.03Å; F405-H410 VanDerWaalsContact O-N 3.14Å
406	L	85.4	Confident	83.4	Confident	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-67.9	-42.5	178.8	-65.4	176.7	0	0	0	112.2	R209 N251 F358 I402 E404 R408 G409 L414	R209-L406 HydrophobicContact CG-CD1 4.26Å; R209-L406 HydrophobicContact CG-CD2 4.12Å; N251-L406 HydrophobicContact CB-CD1 4.14Å; F358-L406 HydrophobicContact CE1-CD2 4.4Å; I402-L406 HydrophobicContact CG1-CD1 4.03Å; I402-L406 HydrophobicContact CG1-CG 4.14Å; I402-L406 WeakPolarHBondContact O-CB 3.41Å; I402-L406 VanDerWaalsContact O-CG 3.28Å; I402-L406 WeakPolarHBondContact O-CG 3.22Å; I402-L406 PolarHBondContact O-N 3.5Å; E404-L406 PolarHBondContact O-N 3.31Å; L406-R408 VanDerWaalsContact C-N 3.31Å; L406-R408 PolarHBondContact O-N 3.09Å; L406-G409 PolarHBondContact O-N 2.79Å; L406-G409 VanDerWaalsContact O-N 3.12Å; L406-L414 HydrophobicContact CD2-CD1 4.27Å
407	D	77	Confident	83.5	Confident	19 Å²	19	28.1 Å²	28.1	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-64.8	-37.1	178.6	-85.4	-11.5	0	0	0	110.8	T403 E404 G409 R552 K647	T403-D407 VanDerWaalsContact O-CB 3.25Å; T403-D407 WeakPolarHBondContact O-CB 3.47Å; T403-D407 PolarHBondContact O-N 3.46Å; E404-D407 PolarHBondContact O-N 3.49Å; D407-G409 PolarHBondContact O-N 3.46Å; D407-G409 VanDerWaalsContact O-N 3.17Å; D407-R552 IonicContact OD1-CZ 2.93Å; D407-R552 IonicContact OD1-NE 3.55Å; D407-R552 IonicContact OD1-NH2 3.34Å; D407-R552 PolarHBondContact OD1-NH2 2.76Å; D407-R552 IonicContact OD2-CZ 3.56Å; D407-R552 IonicContact OD2-NE 3.9Å; D407-R552 PolarHBondContact OD2-NE 3.25Å; D407-R552 IonicContact OD2-NH2 2.73Å; D407-R552 PolarHBondContact OD2-NH2 3.29Å; D407-R552 VanDerWaalsContact OD2-NH2 3.09Å; D407-K647 WeakPolarHBondContact O-CE 3.38Å; D407-K647 PolarHBondContact O-NZ 3.49Å
408	R	72.5	Confident	83.4	Confident	67 Å²	67	28.8 Å²	28.8	25%	0.253	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-8.3	177	-72.7	172.8	177.5	-156.7	3.6	113.9	E404 F405 L406 H410	E404-R408 HydrophobicContact CG-CG 4.31Å; E404-R408 VanDerWaalsContact CG-NE 3.27Å; E404-R408 VanDerWaalsContact O-CB 3.3Å; E404-R408 WeakPolarHBondContact O-CB 3.03Å; E404-R408 WeakPolarHBondContact O-CG 3.44Å; E404-R408 PolarHBondContact O-N 2.89Å; E404-R408 IonicContact OE1-CZ 3.44Å; E404-R408 IonicContact OE1-NE 3.4Å; E404-R408 PolarHBondContact OE1-NE 2.87Å; E404-R408 VanDerWaalsContact OE1-NE 3.16Å; E404-R408 IonicContact OE1-NH2 2.72Å; E404-R408 PolarHBondContact OE1-NH2 2.64Å; F405-R408 PolarHBondContact O-N 3.16Å; L406-R408 VanDerWaalsContact C-N 3.31Å; L406-R408 PolarHBondContact O-N 3.09Å; R408-H410 VanDerWaalsContact CB-CD2 3.48Å; R408-H410 WeakPolarHBondContact CB-CD2 3.37Å
409	G	75.7	Confident	82.7	Confident	16 Å²	16	35.5 Å²	35.5	17%	0.165	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	17.4	-179.1	0	0	0	0	0	113.3	L406 D407 G411 D412	L406-G409 PolarHBondContact O-N 2.79Å; L406-G409 VanDerWaalsContact O-N 3.12Å; D407-G409 PolarHBondContact O-N 3.46Å; D407-G409 VanDerWaalsContact O-N 3.17Å; G409-G411 PolarHBondContact O-N 3.06Å; G409-D412 WeakPolarHBondContact CA-OD1 3.02Å; G409-D412 WeakPolarHBondContact O-CB 3.15Å; G409-D412 PolarHBondContact O-N 3.36Å
410	H	81.3	Confident	82.1	Confident	83 Å²	83	42.9 Å²	42.9	38%	0.384	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-15.7	172.4	-65.5	-65.5	0	0	0	112.6	C330 F405 R408	C330-H410 PolarHBondContact SG-O 2.85Å; F405-H410 HydrophobicContact CD1-CB 4.14Å; F405-H410 HydrophobicContact CD2-CB 3.54Å; F405-H410 HydrophobicContact CE1-CB 3.93Å; F405-H410 HydrophobicContact CE2-CB 3.32Å; F405-H410 HydrophobicContact CG-CB 3.95Å; F405-H410 HydrophobicContact CZ-CB 3.52Å; F405-H410 WeakPolarHBondContact CZ-O 3.47Å; F405-H410 WeakPolarHBondContact O-CB 3.1Å; F405-H410 PolarHBondContact O-N 3.03Å; F405-H410 VanDerWaalsContact O-N 3.14Å; R408-H410 VanDerWaalsContact CB-CD2 3.48Å; R408-H410 WeakPolarHBondContact CB-CD2 3.37Å
411	G	85.6	Confident	81.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	29.4	171	0	0	0	0	0	113.7	R209 C330 G409 C413 L414	R209-G411 PolarHBondContact NH1-O 2.75Å; C330-G411 VanDerWaalsContact SG-CA 3.59Å; G409-G411 PolarHBondContact O-N 3.06Å; G411-C413 VanDerWaalsContact C-N 3.27Å; G411-C413 PolarHBondContact O-N 2.88Å; G411-L414 WeakPolarHBondContact O-CB 3.43Å; G411-L414 PolarHBondContact O-N 3.4Å
412	D	86.4	Confident	81.5	Confident	62 Å²	62	50.8 Å²	50.8	33%	0.332	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-66	-24.7	-178.1	-82.4	-7.5	0	0	0	113.2	G409 L414 L415 K607	G409-D412 WeakPolarHBondContact CA-OD1 3.02Å; G409-D412 WeakPolarHBondContact O-CB 3.15Å; G409-D412 PolarHBondContact O-N 3.36Å; D412-L414 PolarHBondContact O-N 2.69Å; D412-L415 WeakPolarHBondContact O-CB 3.09Å; D412-L415 WeakPolarHBondContact O-CD1 3.45Å; D412-L415 WeakPolarHBondContact O-CG 3.28Å; D412-K607 IonicContact OD2-NZ 2.86Å; D412-K607 PolarHBondContact OD2-NZ 3.48Å
413	C	88.9	Confident	80.6	Confident	15 Å²	15	56.6 Å²	56.6	10%	0.101	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-63.6	-26.9	172.1	59.3	0	0	0	0	112.4	C330 G411 L415	C330-C413 WeakPolarHBondContact CA-SG 3.46Å; C330-C413 HydrophobicContact CB-CB 3.92Å; C330-C413 WeakPolarHBondContact CB-SG 3.42Å; C330-C413 WeakPolarHBondContact SG-CB 3.37Å; C330-C413 PolarHBondContact SG-N 3.03Å; C330-C413 CovalentContact SG-SG 2.04Å; C330-C413 PolarHBondContact SG-SG 3.02Å; G411-C413 VanDerWaalsContact C-N 3.27Å; G411-C413 PolarHBondContact O-N 2.88Å; C413-L415 PolarHBondContact O-N 2.96Å
414	L	91.3	Very high	79.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-80.9	13.2	-175.9	-48.3	179.1	0	0	0	114.1	R209 F210 V211 D302 M329 F358 L406 G411 D412	R209-L414 CarbonylContact C-O 3.55Å; R209-L414 WeakPolarHBondContact CA-O 3.42Å; R209-L414 HydrophobicContact CB-CB 3.94Å; R209-L414 HydrophobicContact CB-CD1 4.36Å; R209-L414 HydrophobicContact CG-CB 4.48Å; F210-L414 PolarHBondContact N-O 3.45Å; F210-L414 VanDerWaalsContact O-CA 3.28Å; F210-L414 WeakPolarHBondContact O-CA 3.4Å; F210-L414 VanDerWaalsContact O-CB 3.3Å; F210-L414 WeakPolarHBondContact O-CB 3.38Å; F210-L414 WeakPolarHBondContact O-CD2 3.29Å; V211-L414 HydrophobicContact CB-CD2 4.47Å; V211-L414 HydrophobicContact CG2-CD1 4.13Å; V211-L414 HydrophobicContact CG2-CD2 4.13Å; D302-L414 HydrophobicContact CB-CD2 4Å; D302-L414 VanDerWaalsContact CG-CD2 3.49Å; D302-L414 VanDerWaalsContact OD2-CD2 3.3Å; D302-L414 WeakPolarHBondContact OD2-CD2 3.23Å; M329-L414 HydrophobicContact CG-CD1 3.95Å; M329-L414 HydrophobicContact CG-CD2 3.83Å; M329-L414 HydrophobicContact CG-CG 4.18Å; M329-L414 HydrophobicContact SD-CD2 4.11Å; F358-L414 HydrophobicContact CE1-CD1 3.57Å; F358-L414 HydrophobicContact CZ-CD1 4.03Å; L406-L414 HydrophobicContact CD2-CD1 4.27Å; G411-L414 WeakPolarHBondContact O-CB 3.43Å; G411-L414 PolarHBondContact O-N 3.4Å; D412-L414 PolarHBondContact O-N 2.69Å
415	L	87.9	Confident	79.1	Confident	78 Å²	78	59.8 Å²	59.8	41%	0.408	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-89.4	-28.6	-169.8	-78.7	175.1	0	0	0	113.4	I207 R209 D412 C413	I207-L415 HydrophobicContact CG2-CD2 3.88Å; R209-L415 VanDerWaalsContact CZ-CD2 3.42Å; D412-L415 WeakPolarHBondContact O-CB 3.09Å; D412-L415 WeakPolarHBondContact O-CD1 3.45Å; D412-L415 WeakPolarHBondContact O-CG 3.28Å; C413-L415 PolarHBondContact O-N 2.96Å
416	D	84.2	Confident	78.1	Confident	57 Å²	57	66 Å²	66	31%	0.305	33%	0.332	S	S	.	.	S	Bend	trans	-82.4	162.7	176.1	59.2	-71.8	0	0	0	111.3	F210	F210-D416 WeakPolarHBondContact CB-O 3.25Å; F210-D416 WeakPolarHBondContact CD2-O 3.33Å
417	Q	83.8	Confident	77.3	Confident	135 Å²	135	68.2 Å²	68.2	63%	0.631	35%	0.348	S	S	*	.			trans	-107.4	133.6	-175.2	-172	176.9	-6	0	0	108.3	F210 Q419	F210-Q417 HydrophobicContact CD1-CG 4.36Å; F210-Q417 HydrophobicContact CD2-CB 4.23Å; F210-Q417 HydrophobicContact CD2-CG 4.43Å; F210-Q417 HydrophobicContact CE1-CG 4.07Å; F210-Q417 HydrophobicContact CE2-CB 4.08Å; F210-Q417 HydrophobicContact CE2-CG 4.14Å; F210-Q417 HydrophobicContact CZ-CB 4.39Å; F210-Q417 HydrophobicContact CZ-CG 3.95Å; Q417-Q419 PolarHBondContact O-N 2.9Å
418	P	81.1	Confident	77.2	Confident	15 Å²	15	69.1 Å²	69.1	10%	0.097	35%	0.353	C	S	.	.			trans	-59.6	136.2	-177.3	16.1	-28.3	0	0	0	111.9	E212 V256 V258	E212-P418 HydrophobicContact CG-CB 4.2Å; E212-P418 VanDerWaalsContact OE1-CA 3.23Å; E212-P418 WeakPolarHBondContact OE1-CA 3.35Å; E212-P418 VanDerWaalsContact OE1-CB 3.24Å; E212-P418 WeakPolarHBondContact OE1-CB 3.03Å; V256-P418 HydrophobicContact CB-CG 4.04Å; V256-P418 HydrophobicContact CG1-CB 4.34Å; V256-P418 HydrophobicContact CG1-CG 3.69Å; V256-P418 HydrophobicContact CG2-CG 4.06Å; V258-P418 HydrophobicContact CG1-CB 3.98Å
419	Q	73.2	Confident	77.4	Confident	142 Å²	142	66.6 Å²	66.6	66%	0.664	35%	0.345	S	S	*	.	S	Bend	trans	-75.9	-30.8	178.5	-65.4	-169.9	-7.3	0	0	112.8	Q417	Q417-Q419 PolarHBondContact O-N 2.9Å
420	K	73.9	Confident	77.5	Confident	155 Å²	155	66.2 Å²	66.2	67%	0.674	34%	0.341	S	S	*	.	S	Bend	trans	-137.8	128.2	178.9	-171.4	178.9	-180	-177	0	109
421	Q	75.9	Confident	77.4	Confident	116 Å²	116	66 Å²	66	54%	0.542	35%	0.349	S	S	.	.			trans	-132.5	144.5	-179	63.3	-179.9	11.3	0	0	111.3	V256	V256-Q421 HydrophobicContact CG1-CB 3.45Å; V256-Q421 VanDerWaalsContact CG1-CB 3.45Å; V256-Q421 HydrophobicContact CG1-CG 4.48Å
422	L	74.1	Confident	77.1	Confident	58 Å²	58	68.3 Å²	68.3	30%	0.304	37%	0.365	S	S	.	.			trans	-77.8	128.7	165.6	-65.3	178.6	0	0	0	108.8	L234 V257 F260 L424	L234-L422 HydrophobicContact CD2-CD1 4.43Å; V257-L422 HydrophobicContact CB-CB 4.49Å; V257-L422 HydrophobicContact CG1-CD1 4.01Å; V257-L422 PolarHBondContact O-N 3Å; F260-L422 HydrophobicContact CB-CD1 4.02Å; L422-L424 PolarHBondContact O-N 3.47Å; L422-L424 VanDerWaalsContact O-N 3.16Å
423	T	69.3	Low	76.9	Confident	123 Å²	123	65.5 Å²	65.5	76%	0.755	35%	0.35	S	S	*	.			trans	-69.2	113.4	176.8	-45.9	0	0	0	0	109.3
424	L	66.9	Low	76.8	Confident	30 Å²	30	67.9 Å²	67.9	16%	0.157	37%	0.367	C	S	.	.			trans	-70.4	144.9	169.8	-64.7	175.3	0	0	0	109.4	L234 M237 A241 V257 L422 D426	L234-L424 HydrophobicContact CB-CD2 4.48Å; L234-L424 HydrophobicContact CD2-CD2 4.02Å; M237-L424 HydrophobicContact CB-CD2 4.05Å; A241-L424 HydrophobicContact CB-CD1 4.01Å; V257-L424 HydrophobicContact CG2-CD2 3.93Å; L422-L424 PolarHBondContact O-N 3.47Å; L422-L424 VanDerWaalsContact O-N 3.16Å; L424-D426 PolarHBondContact O-N 2.86Å
425	Q	63.6	Low	76.4	Confident	71 Å²	71	69.4 Å²	69.4	33%	0.332	38%	0.375	S	S	.	.			trans	-73.1	128.1	178.4	-65.3	-171.7	-15.6	0	0	110.9	H231 S238 S427	H231-Q425 PolarHBondContact CE1-NE2 3.44Å; H231-Q425 PolarHBondContact CE1-OE1 2.92Å; H231-Q425 PolarHBondContact ND1-NE2 3.25Å; H231-Q425 PolarHBondContact ND1-OE1 3.37Å; S238-Q425 PolarHBondContact OG-O 3.23Å; Q425-S427 VanDerWaalsContact C-N 3.32Å
426	D	63	Low	76.3	Confident	139 Å²	139	70.7 Å²	70.7	74%	0.743	38%	0.378	S	S	*	.			trans	-82	-10.9	178.4	-80.8	-27.8	0	0	0	113.3	R242 L424	R242-D426 PolarHBondContact NH1-O 3.29Å; R242-D426 PolarHBondContact NH2-O 2.98Å; L424-D426 PolarHBondContact O-N 2.86Å
427	S	69.1	Low	76.4	Confident	51 Å²	51	71.1 Å²	71.1	36%	0.357	38%	0.376	S	S	.	.	S	Bend	trans	-66.4	151.4	175.7	51.3	0	0	0	0	112	R242 Q425	R242-S427 PolarHBondContact NH1-O 3.26Å; Q425-S427 VanDerWaalsContact C-N 3.32Å
428	L	73.6	Confident	76.5	Confident	39 Å²	39	65 Å²	65	20%	0.204	35%	0.347	C	S	.	.			trans	-73.3	139.4	175.9	-63.2	173	0	0	0	109.2	G430 S431 D480 Y491	L428-G430 VanDerWaalsContact C-N 3.25Å; L428-G430 PolarHBondContact O-N 2.99Å; L428-G430 VanDerWaalsContact O-N 3.11Å; L428-S431 PolarHBondContact O-N 3.28Å; L428-S431 PolarHBondContact O-OG 2.89Å; L428-D480 CarbonylContact C-O 3.53Å; L428-D480 HydrophobicContact CB-CB 4.43Å; L428-D480 VanDerWaalsContact CB-O 3.22Å; L428-D480 WeakPolarHBondContact CB-O 3.19Å; L428-D480 HydrophobicContact CD1-CB 4.44Å; L428-D480 HydrophobicContact CD2-CB 4.1Å; L428-Y491 HydrophobicContact CD1-CD2 4.18Å; L428-Y491 HydrophobicContact CD2-CE2 4.47Å
429	P	77.6	Confident	76.6	Confident	13 Å²	13	64.2 Å²	64.2	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-57	-35.2	-170.6	-23.6	30.9	0	0	0	114.3	T235 V239 L344 S431 S432 Y433 A479	T235-P429 HydrophobicContact CG2-CB 3.68Å; T235-P429 HydrophobicContact CG2-CG 3.99Å; V239-P429 HydrophobicContact CG2-CG 3.33Å; L344-P429 HydrophobicContact CD1-CB 4.44Å; P429-S431 PolarHBondContact O-N 2.81Å; P429-S432 PolarHBondContact O-N 2.85Å; P429-Y433 WeakPolarHBondContact O-CD2 3.47Å; P429-Y433 PolarHBondContact O-N 2.82Å; P429-A479 HydrophobicContact CB-CB 4.13Å
430	G	77.9	Confident	77.3	Confident	8 Å²	8	60.2 Å²	60.2	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-70.1	-7.1	178.1	0	0	0	0	0	115.5	L428 D480 G481 T482	L428-G430 VanDerWaalsContact C-N 3.25Å; L428-G430 PolarHBondContact O-N 2.99Å; L428-G430 VanDerWaalsContact O-N 3.11Å; G430-D480 WeakPolarHBondContact CA-O 3.45Å; G430-D480 PolarHBondContact N-O 3.09Å; G430-G481 VanDerWaalsContact C-C 3.47Å; G430-G481 CarbonylContact C-O 3.5Å; G430-T482 WeakPolarHBondContact CA-OG1 3.48Å; G430-T482 WeakPolarHBondContact O-CA 3.39Å
431	S	79	Confident	77.8	Confident	80 Å²	80	52.9 Å²	52.9	56%	0.559	29%	0.292	S	S	*	.	H	α-helix	trans	-82	-27.4	166.9	68.1	0	0	0	0	112.9	L428 P429	L428-S431 PolarHBondContact O-N 3.28Å; L428-S431 PolarHBondContact O-OG 2.89Å; P429-S431 PolarHBondContact O-N 2.81Å
432	S	78.7	Confident	77.9	Confident	48 Å²	48	47.8 Å²	47.8	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-93.5	-35	178	-52	0	0	0	0	111.3	P429	P429-S432 PolarHBondContact O-N 2.85Å
433	Y	82.7	Confident	78.2	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.012	27%	0.265	C	S	.	.	S	Bend	trans	-110.7	105.4	-178.6	-61.4	-79.6	0	0	0	110.4	H231 Y232 T235 L344 P429 R437 Q438 L441	H231-Y433 AromaticContact CD2-CZ 3.81Å; H231-Y433 PolarHBondContact CD2-OH 3.07Å; Y232-Y433 WeakPolarHBondContact CA-OH 3.3Å; Y232-Y433 HydrophobicContact CD2-CE1 4.29Å; Y232-Y433 PolarHBondContact N-OH 2.82Å; Y232-Y433 VanDerWaalsContact N-OH 3.16Å; T235-Y433 HydrophobicContact CG2-CD2 4.15Å; T235-Y433 HydrophobicContact CG2-CE2 3.68Å; T235-Y433 WeakPolarHBondContact OG1-CE2 3.39Å; L344-Y433 HydrophobicContact CD1-CG 4.45Å; L344-Y433 HydrophobicContact CD2-CD2 4.14Å; L344-Y433 HydrophobicContact CD2-CE2 4.48Å; L344-Y433 HydrophobicContact CD2-CG 4.41Å; P429-Y433 WeakPolarHBondContact O-CD2 3.47Å; P429-Y433 PolarHBondContact O-N 2.82Å; Y433-R437 HydrophobicContact CD1-CG 3.78Å; Y433-Q438 PolarHBondContact O-NE2 3.01Å; Y433-L441 HydrophobicContact CD1-CD1 3.75Å; Y433-L441 HydrophobicContact CE1-CD1 4.18Å; Y433-L441 HydrophobicContact CG-CD1 4.44Å
434	S	85.4	Confident	78.7	Confident	65 Å²	65	42.4 Å²	42.4	46%	0.455	24%	0.239	S	C	.	.			trans	-59.8	160	174.4	75.5	0	0	0	0	111.4	H436 R437 Q438	S434-H436 PolarHBondContact O-N 3.29Å; S434-H436 VanDerWaalsContact O-N 3.15Å; S434-R437 PolarHBondContact O-N 3.44Å; S434-R437 PolarHBondContact OG-N 2.04Å; S434-Q438 WeakPolarHBondContact O-CG 3.48Å; S434-Q438 PolarHBondContact O-N 2.86Å
435	L	83.9	Confident	79.2	Confident	32 Å²	32	46 Å²	46	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-54.9	-35.9	177.7	-173	65.3	0	0	0	112.3	Q438 C439 P449 L459 W478 T482	L435-Q438 PolarHBondContact O-N 3.04Å; L435-C439 PolarHBondContact O-N 2Å; L435-P449 HydrophobicContact CB-CG 4.08Å; L435-P449 HydrophobicContact CD2-CB 3.57Å; L435-P449 HydrophobicContact CD2-CG 3.91Å; L435-P449 HydrophobicContact CG-CB 3.7Å; L435-P449 HydrophobicContact CG-CG 3.61Å; L435-L459 HydrophobicContact CD1-CD1 3.45Å; L435-L459 VanDerWaalsContact CD1-CD1 3.45Å; L435-L459 HydrophobicContact CG-CD1 4.5Å; L435-W478 HydrophobicContact CD1-CB 4.46Å; L435-W478 HydrophobicContact CD1-CD2 3.41Å; L435-W478 VanDerWaalsContact CD1-CD2 3.41Å; L435-W478 HydrophobicContact CD1-CE3 3.79Å; L435-W478 HydrophobicContact CD1-CG 3.72Å; L435-W478 HydrophobicContact CD1-CH2 4.32Å; L435-W478 HydrophobicContact CD1-CZ2 4.01Å; L435-W478 HydrophobicContact CD1-CZ3 4.21Å; L435-W478 HydrophobicContact CD2-CD2 4.36Å; L435-W478 HydrophobicContact CD2-CE3 4.22Å; L435-W478 HydrophobicContact CD2-CH2 3.45Å; L435-W478 VanDerWaalsContact CD2-CH2 3.45Å; L435-W478 HydrophobicContact CD2-CZ2 3.61Å; L435-W478 HydrophobicContact CD2-CZ3 3.77Å; L435-W478 HydrophobicContact CG-CZ2 4.47Å; L435-T482 HydrophobicContact CB-CG2 4.13Å; L435-T482 HydrophobicContact CD1-CG2 4.4Å
436	H	85.5	Confident	79.8	Confident	104 Å²	104	45.1 Å²	45.1	48%	0.481	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-48.5	175.2	-74.4	74.1	0	0	0	111.7	S434 Q438 C439 E440 P449	S434-H436 PolarHBondContact O-N 3.29Å; S434-H436 VanDerWaalsContact O-N 3.15Å; H436-Q438 VanDerWaalsContact C-N 3.26Å; H436-Q438 PolarHBondContact O-N 3.11Å; H436-C439 WeakPolarHBondContact O-CB 3.45Å; H436-C439 PolarHBondContact O-N 3.15Å; H436-C439 VanDerWaalsContact O-N 3.07Å; H436-E440 PolarHBondContact O-N 2.83Å; H436-E440 VanDerWaalsContact O-N 3.15Å; H436-P449 HydrophobicContact CB-CG 4.23Å; H436-P449 WeakPolarHBondContact CD2-CD 3.17Å; H436-P449 VanDerWaalsContact CG-CD 3.43Å; H436-P449 WeakPolarHBondContact NE2-CD 3.33Å
437	R	86	Confident	80.7	Confident	67 Å²	67	38.8 Å²	38.8	25%	0.253	24%	0.243	S	C	.	.	H	α-helix	trans	-62.6	-35.8	178.4	-172	57.7	173.7	169.5	1.7	112	D228 Y433 S434 C439 E440 L441	D228-R437 IonicContact OD2-NH2 3.92Å; D228-R437 PolarHBondContact OD2-NH2 2.82Å; Y433-R437 HydrophobicContact CD1-CG 3.78Å; S434-R437 PolarHBondContact O-N 3.44Å; S434-R437 PolarHBondContact OG-N 2.04Å; R437-C439 VanDerWaalsContact C-N 3.27Å; R437-C439 PolarHBondContact O-N 3.44Å; R437-E440 WeakPolarHBondContact CD-OE2 3.33Å; R437-E440 IonicContact CZ-OE2 3.5Å; R437-E440 IonicContact NH1-OE2 3.82Å; R437-E440 PolarHBondContact NH1-OE2 2.74Å; R437-E440 PolarHBondContact O-N 3Å; R437-L441 HydrophobicContact CG-CD1 4.03Å; R437-L441 HydrophobicContact CG-CG 4.38Å; R437-L441 WeakPolarHBondContact O-CB 3.24Å; R437-L441 WeakPolarHBondContact O-CD1 3.43Å; R437-L441 WeakPolarHBondContact O-CG 3.48Å; R437-L441 PolarHBondContact O-N 2.78Å
438	Q	85.7	Confident	81.5	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.023	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-35.5	175.1	-67	176.4	49.2	0	0	112.5	L344 Y433 S434 L435 H436 A442 L459 T482	L344-Q438 HydrophobicContact CD1-CG 3.7Å; Y433-Q438 PolarHBondContact O-NE2 3.01Å; S434-Q438 WeakPolarHBondContact O-CG 3.48Å; S434-Q438 PolarHBondContact O-N 2.86Å; L435-Q438 PolarHBondContact O-N 3.04Å; H436-Q438 VanDerWaalsContact C-N 3.26Å; H436-Q438 PolarHBondContact O-N 3.11Å; Q438-A442 WeakPolarHBondContact O-CB 3.46Å; Q438-A442 PolarHBondContact O-N 3.37Å; Q438-L459 HydrophobicContact CB-CD1 4.21Å; Q438-L459 HydrophobicContact CB-CD2 3.92Å; Q438-T482 PolarHBondContact NE2-OG1 2.99Å
439	C	84.2	Confident	82	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-71	-42.4	175.1	-74.2	0	0	0	0	113.3	L435 H436 R437 L441 A442 F443 S447 P449 C461	L435-C439 PolarHBondContact O-N 2Å; H436-C439 WeakPolarHBondContact O-CB 3.45Å; H436-C439 PolarHBondContact O-N 3.15Å; H436-C439 VanDerWaalsContact O-N 3.07Å; R437-C439 VanDerWaalsContact C-N 3.27Å; R437-C439 PolarHBondContact O-N 3.44Å; C439-L441 VanDerWaalsContact C-N 3.3Å; C439-L441 PolarHBondContact O-N 2.81Å; C439-A442 PolarHBondContact O-N 3.05Å; C439-F443 PolarHBondContact O-N 2.85Å; C439-S447 WeakPolarHBondContact CB-O 3.4Å; C439-S447 WeakPolarHBondContact O-CB 3.35Å; C439-P449 VanDerWaalsContact SG-CA 3.57Å; C439-C461 WeakPolarHBondContact CA-SG 3.45Å; C439-C461 HydrophobicContact CB-CB 3.43Å; C439-C461 VanDerWaalsContact CB-CB 3.43Å; C439-C461 WeakPolarHBondContact CB-SG 3.49Å; C439-C461 VanDerWaalsContact SG-CA 3.5Å; C439-C461 WeakPolarHBondContact SG-CB 3.33Å; C439-C461 CovalentContact SG-SG 2.03Å; C439-C461 PolarHBondContact SG-SG 2.75Å
440	E	87.4	Confident	82.2	Confident	58 Å²	58	41.2 Å²	41.2	27%	0.271	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-40.8	174.8	-66	177.2	168.2	0	0	112.3	H436 R437 G444	H436-E440 PolarHBondContact O-N 2.83Å; H436-E440 VanDerWaalsContact O-N 3.15Å; R437-E440 WeakPolarHBondContact CD-OE2 3.33Å; R437-E440 IonicContact CZ-OE2 3.5Å; R437-E440 IonicContact NH1-OE2 3.82Å; R437-E440 PolarHBondContact NH1-OE2 2.74Å; R437-E440 PolarHBondContact O-N 3Å; E440-G444 WeakPolarHBondContact CA-O 3.16Å; E440-G444 CarbonylContact O-C 3.58Å; E440-G444 VanDerWaalsContact O-C 3.31Å; E440-G444 WeakPolarHBondContact O-CA 3.4Å; E440-G444 PolarHBondContact O-N 2.84Å
441	L	85.1	Confident	81.7	Confident	1 Å²	1	45 Å²	45	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-37	-179.8	-68.7	166.8	0	0	0	112.5	Y232 L344 Y433 R437 C439	Y232-L441 HydrophobicContact CD2-CD1 4.15Å; Y232-L441 HydrophobicContact CD2-CD2 4.02Å; Y232-L441 HydrophobicContact CE2-CD1 3.91Å; Y232-L441 HydrophobicContact CE2-CD2 3.85Å; Y232-L441 HydrophobicContact CE2-CG 4.37Å; L344-L441 HydrophobicContact CG-CD1 4.42Å; Y433-L441 HydrophobicContact CD1-CD1 3.75Å; Y433-L441 HydrophobicContact CE1-CD1 4.18Å; Y433-L441 HydrophobicContact CG-CD1 4.44Å; R437-L441 HydrophobicContact CG-CD1 4.03Å; R437-L441 HydrophobicContact CG-CG 4.38Å; R437-L441 WeakPolarHBondContact O-CB 3.24Å; R437-L441 WeakPolarHBondContact O-CD1 3.43Å; R437-L441 WeakPolarHBondContact O-CG 3.48Å; R437-L441 PolarHBondContact O-N 2.78Å; C439-L441 VanDerWaalsContact C-N 3.3Å; C439-L441 PolarHBondContact O-N 2.81Å
442	A	77.8	Confident	81	Confident	9 Å²	9	49.8 Å²	49.8	7%	0.074	28%	0.278	C	S	.	.	H	α-helix	trans	-85	-30	-176.7	0	0	0	0	0	114.1	Q438 C439 R474	Q438-A442 WeakPolarHBondContact O-CB 3.46Å; Q438-A442 PolarHBondContact O-N 3.37Å; C439-A442 PolarHBondContact O-N 3.05Å; A442-R474 PolarHBondContact O-NE 3.15Å; A442-R474 PolarHBondContact O-NH2 3.18Å
443	F	80.3	Confident	80.5	Confident	48 Å²	48	50.3 Å²	50.3	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-131.1	2.6	-171.3	-62.1	-73.6	0	0	0	115	C439 C461 Q472 R474	C439-F443 PolarHBondContact O-N 2.85Å; F443-C461 HydrophobicContact CD2-CB 3.33Å; F443-C461 HydrophobicContact CE2-CB 3.57Å; F443-C461 HydrophobicContact CG-CB 4.36Å; F443-Q472 HydrophobicContact CD1-CG 3.72Å; F443-Q472 HydrophobicContact CD2-CG 4.42Å; F443-Q472 HydrophobicContact CE1-CB 4.14Å; F443-Q472 HydrophobicContact CE1-CG 3.59Å; F443-Q472 HydrophobicContact CE2-CG 4.31Å; F443-Q472 HydrophobicContact CG-CG 4.1Å; F443-Q472 HydrophobicContact CZ-CB 4.3Å; F443-Q472 HydrophobicContact CZ-CG 3.88Å; F443-R474 HydrophobicContact CE1-CG 3.72Å; F443-R474 HydrophobicContact CZ-CG 3.6Å
444	G	78.6	Confident	80	Confident	20 Å²	20	57.6 Å²	57.6	21%	0.206	31%	0.309	C	S	.	.			trans	99.4	165	175.6	0	0	0	0	0	114.3	E440 G446 S447	E440-G444 WeakPolarHBondContact CA-O 3.16Å; E440-G444 CarbonylContact O-C 3.58Å; E440-G444 VanDerWaalsContact O-C 3.31Å; E440-G444 WeakPolarHBondContact O-CA 3.4Å; E440-G444 PolarHBondContact O-N 2.84Å; G444-G446 PolarHBondContact O-N 3.14Å; G444-S447 VanDerWaalsContact O-CB 3.28Å; G444-S447 WeakPolarHBondContact O-CB 3.43Å; G444-S447 PolarHBondContact O-N 2.91Å
445	S	78.9	Confident	79.7	Confident	105 Å²	105	57 Å²	57	73%	0.734	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.9	-177.1	-58.4	0	0	0	0	112.2
446	G	76.4	Confident	79.4	Confident	53 Å²	53	55.5 Å²	55.5	55%	0.546	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-6.8	-177.1	0	0	0	0	0	115	G444	G444-G446 PolarHBondContact O-N 3.14Å
447	S	81.8	Confident	78.9	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.042	29%	0.29	C	S	.	.			trans	-72.3	123.6	171.5	-171.6	0	0	0	0	111.8	C439 G444 C461 T462	C439-S447 WeakPolarHBondContact CB-O 3.4Å; C439-S447 WeakPolarHBondContact O-CB 3.35Å; G444-S447 VanDerWaalsContact O-CB 3.28Å; G444-S447 WeakPolarHBondContact O-CB 3.43Å; G444-S447 PolarHBondContact O-N 2.91Å; S447-C461 WeakPolarHBondContact OG-CB 3.41Å; S447-T462 WeakPolarHBondContact CA-O 3.18Å; S447-T462 VanDerWaalsContact CB-O 3.24Å; S447-T462 WeakPolarHBondContact CB-O 3.39Å; S447-T462 PolarHBondContact OG-O 3.41Å
448	K	85.6	Confident	78.6	Confident	123 Å²	123	53 Å²	53	54%	0.535	29%	0.293	S	S	.	.			trans	-111.1	159.1	-178.8	-63.1	-178.3	-177.5	178	0	111	C461 T462	K448-C461 CarbonylContact O-C 3.52Å; K448-C461 VanDerWaalsContact O-CA 3.27Å; K448-C461 WeakPolarHBondContact O-CA 3.38Å; K448-T462 HydrophobicContact CB-CG2 4.37Å; K448-T462 PolarHBondContact N-OG1 2.97Å; K448-T462 WeakPolarHBondContact O-CG2 3.48Å; K448-T462 PolarHBondContact O-N 3.3Å; K448-T462 PolarHBondContact O-OG1 3.3Å
449	P	84.6	Confident	78.4	Confident	21 Å²	21	53.3 Å²	53.3	14%	0.136	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-64.3	138.4	175.2	-21.4	36.3	0	0	0	111.4	L435 H436 C439	L435-P449 HydrophobicContact CB-CG 4.08Å; L435-P449 HydrophobicContact CD2-CB 3.57Å; L435-P449 HydrophobicContact CD2-CG 3.91Å; L435-P449 HydrophobicContact CG-CB 3.7Å; L435-P449 HydrophobicContact CG-CG 3.61Å; H436-P449 HydrophobicContact CB-CG 4.23Å; H436-P449 WeakPolarHBondContact CD2-CD 3.17Å; H436-P449 VanDerWaalsContact CG-CD 3.43Å; H436-P449 WeakPolarHBondContact NE2-CD 3.33Å; C439-P449 VanDerWaalsContact SG-CA 3.57Å
450	C	80.9	Confident	78.4	Confident	9 Å²	9	56.8 Å²	56.8	6%	0.061	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-72.8	128.2	176.5	-75.4	0	0	0	0	111.3	M453 W460 C461 C471	C450-M453 HydrophobicContact CB-CE 4.45Å; C450-M453 HydrophobicContact CB-CG 4.03Å; C450-W460 HydrophobicContact CB-CB 3.7Å; C450-W460 WeakPolarHBondContact CB-O 3.35Å; C450-W460 PolarHBondContact N-O 2.77Å; C450-C461 PolarHBondContact SG-N 3.03Å; C450-C471 HydrophobicContact CB-CB 3.86Å; C450-C471 WeakPolarHBondContact CB-SG 3.44Å; C450-C471 WeakPolarHBondContact SG-CA 3.26Å; C450-C471 WeakPolarHBondContact SG-CB 3.34Å; C450-C471 CovalentContact SG-SG 2.01Å; C450-C471 PolarHBondContact SG-SG 3.12Å
451	P	66.8	Low	78.3	Confident	88 Å²	88	54 Å²	54	57%	0.571	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	149.5	178.2	26.9	-31.7	0	0	0	111.3	M453	P451-M453 PolarHBondContact O-N 3.2Å
452	Y	64.4	Low	78.4	Confident	181 Å²	181	54.7 Å²	54.7	71%	0.71	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	15	175.4	-45.4	-72.3	0	0	0	118.3	A74	A74-Y452 HydrophobicContact CB-CE1 3.92Å; A74-Y452 WeakPolarHBondContact CB-OH 3.11Å
453	M	67.9	Low	78.4	Confident	59 Å²	59	54.6 Å²	54.6	29%	0.291	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-84.8	143.1	177.1	-66.9	-74.2	-167.3	0	0	111.9	C450 P451 P455 W460 C471	C450-M453 HydrophobicContact CB-CE 4.45Å; C450-M453 HydrophobicContact CB-CG 4.03Å; P451-M453 PolarHBondContact O-N 3.2Å; M453-P455 VanDerWaalsContact O-CD 3.29Å; M453-P455 WeakPolarHBondContact O-CD 3.27Å; M453-P455 VanDerWaalsContact O-N 3.15Å; M453-W460 HydrophobicContact CB-CB 4.34Å; M453-W460 HydrophobicContact CB-CG 4.41Å; M453-W460 HydrophobicContact CE-CB 3.85Å; M453-W460 HydrophobicContact CE-CD2 3.35Å; M453-W460 HydrophobicContact CE-CE3 3.68Å; M453-W460 HydrophobicContact CE-CG 3.45Å; M453-W460 VanDerWaalsContact CE-CG 3.45Å; M453-W460 HydrophobicContact CE-CZ2 4.4Å; M453-W460 HydrophobicContact CE-CZ3 4.33Å; M453-W460 HydrophobicContact CG-CB 3.68Å; M453-W460 HydrophobicContact CG-CG 3.77Å; M453-W460 HydrophobicContact SD-CB 4.11Å; M453-W460 HydrophobicContact SD-CD2 3.89Å; M453-W460 HydrophobicContact SD-CG 3.55Å; M453-W460 VanDerWaalsContact SD-CG 3.55Å; M453-C471 HydrophobicContact CE-CB 4.39Å
454	Q	73.5	Confident	77.9	Confident	155 Å²	155	58.4 Å²	58.4	72%	0.724	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-56.1	118.4	178.2	-76.7	-170.8	-15.4	0	0	110.5	A457	Q454-A457 HydrophobicContact CB-CB 4.11Å; Q454-A457 PolarHBondContact O-N 3.03Å
455	P	79.1	Confident	76.9	Confident	53 Å²	53	59.7 Å²	59.7	34%	0.344	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	143.2	-179.3	-23.8	33.5	0	0	0	111.6	M453 A457 W478 C484	M453-P455 VanDerWaalsContact O-CD 3.29Å; M453-P455 WeakPolarHBondContact O-CD 3.27Å; M453-P455 VanDerWaalsContact O-N 3.15Å; P455-A457 PolarHBondContact O-N 2.87Å; P455-W478 HydrophobicContact CB-CE3 4.33Å; P455-W478 HydrophobicContact CB-CH2 3.8Å; P455-W478 HydrophobicContact CB-CZ2 4.35Å; P455-W478 HydrophobicContact CB-CZ3 3.79Å; P455-W478 HydrophobicContact CG-CH2 4.19Å; P455-C484 HydrophobicContact CB-CB 3.5Å; P455-C484 HydrophobicContact CG-CB 4.4Å
456	C	77.4	Confident	75.7	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	-14.9	175.6	-39.7	0	0	0	0	116.5	P477 C490 G493	C456-P477 WeakPolarHBondContact O-CB 3.45Å; C456-C490 WeakPolarHBondContact CA-SG 3.37Å; C456-C490 HydrophobicContact CB-CB 3.64Å; C456-C490 WeakPolarHBondContact CB-SG 3.43Å; C456-C490 WeakPolarHBondContact SG-CA 3.35Å; C456-C490 WeakPolarHBondContact SG-CB 3.04Å; C456-C490 CovalentContact SG-SG 2.03Å; C456-C490 PolarHBondContact SG-SG 3.2Å; C456-G493 CarbonylContact C-O 3.51Å; C456-G493 WeakPolarHBondContact CB-O 3.5Å; C456-G493 CarbonylContact O-C 3.57Å; C456-G493 VanDerWaalsContact O-CA 3.3Å; C456-G493 WeakPolarHBondContact O-CA 3.46Å
457	A	75.6	Confident	74.8	Confident	42 Å²	42	68.1 Å²	68.1	35%	0.347	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-53.7	-178.6	0	0	0	0	0	112.8	Q454 P455 P477	Q454-A457 HydrophobicContact CB-CB 4.11Å; Q454-A457 PolarHBondContact O-N 3.03Å; P455-A457 PolarHBondContact O-N 2.87Å; A457-P477 WeakPolarHBondContact O-CA 3.21Å; A457-P477 WeakPolarHBondContact O-CB 3.34Å
458	K	79.8	Confident	73.4	Confident	76 Å²	76	75.1 Å²	75.1	33%	0.33	39%	0.386	S	S	.	.			trans	-144.8	136.4	179.6	-68.5	178.9	-176.5	169.6	0	110.5	F476 W478	K458-F476 CarbonylContact C-O 3.57Å; K458-F476 WeakPolarHBondContact CA-O 3.32Å; K458-W478 PolarHBondContact O-NE1 3.41Å
459	L	81.1	Confident	72.4	Confident	13 Å²	13	75.2 Å²	75.2	7%	0.068	39%	0.389	C	S	.	.			trans	-82.7	113.2	174.6	-177.8	66.7	0	0	0	108.4	L435 Q438 T473 F476	L435-L459 HydrophobicContact CD1-CD1 3.45Å; L435-L459 VanDerWaalsContact CD1-CD1 3.45Å; L435-L459 HydrophobicContact CG-CD1 4.5Å; Q438-L459 HydrophobicContact CB-CD1 4.21Å; Q438-L459 HydrophobicContact CB-CD2 3.92Å; L459-T473 VanDerWaalsContact O-CB 3.25Å; L459-T473 WeakPolarHBondContact O-CB 3.15Å; L459-T473 PolarHBondContact O-OG1 3.41Å; L459-F476 WeakPolarHBondContact CB-O 3.09Å; L459-F476 PolarHBondContact N-O 3.19Å
460	W	84.4	Confident	72.2	Confident	73 Å²	73	76.7 Å²	76.7	28%	0.277	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.3	177	-72.5	92.9	0	0	0	108.6	C450 M453 C471 Q472 T473	C450-W460 HydrophobicContact CB-CB 3.7Å; C450-W460 WeakPolarHBondContact CB-O 3.35Å; C450-W460 PolarHBondContact N-O 2.77Å; M453-W460 HydrophobicContact CB-CB 4.34Å; M453-W460 HydrophobicContact CB-CG 4.41Å; M453-W460 HydrophobicContact CE-CB 3.85Å; M453-W460 HydrophobicContact CE-CD2 3.35Å; M453-W460 HydrophobicContact CE-CE3 3.68Å; M453-W460 HydrophobicContact CE-CG 3.45Å; M453-W460 VanDerWaalsContact CE-CG 3.45Å; M453-W460 HydrophobicContact CE-CZ2 4.4Å; M453-W460 HydrophobicContact CE-CZ3 4.33Å; M453-W460 HydrophobicContact CG-CB 3.68Å; M453-W460 HydrophobicContact CG-CG 3.77Å; M453-W460 HydrophobicContact SD-CB 4.11Å; M453-W460 HydrophobicContact SD-CD2 3.89Å; M453-W460 HydrophobicContact SD-CG 3.55Å; M453-W460 VanDerWaalsContact SD-CG 3.55Å; W460-C471 HydrophobicContact CE3-CB 4.31Å; W460-Q472 WeakPolarHBondContact CA-O 3.45Å; W460-T473 HydrophobicContact CD2-CG2 3.83Å; W460-T473 HydrophobicContact CE3-CG2 3.74Å; W460-T473 HydrophobicContact CH2-CG2 3.45Å; W460-T473 VanDerWaalsContact CH2-CG2 3.45Å; W460-T473 HydrophobicContact CZ2-CG2 3.54Å; W460-T473 HydrophobicContact CZ3-CG2 3.55Å
461	C	85.5	Confident	72.1	Confident	0 Å²	0	79 Å²	79	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148	-169.8	-60.1	0	0	0	0	110.3	C439 F443 S447 K448 C450 G463 C471 Q472	C439-C461 WeakPolarHBondContact CA-SG 3.45Å; C439-C461 HydrophobicContact CB-CB 3.43Å; C439-C461 VanDerWaalsContact CB-CB 3.43Å; C439-C461 WeakPolarHBondContact CB-SG 3.49Å; C439-C461 VanDerWaalsContact SG-CA 3.5Å; C439-C461 WeakPolarHBondContact SG-CB 3.33Å; C439-C461 CovalentContact SG-SG 2.03Å; C439-C461 PolarHBondContact SG-SG 2.75Å; F443-C461 HydrophobicContact CD2-CB 3.33Å; F443-C461 HydrophobicContact CE2-CB 3.57Å; F443-C461 HydrophobicContact CG-CB 4.36Å; S447-C461 WeakPolarHBondContact OG-CB 3.41Å; K448-C461 CarbonylContact O-C 3.52Å; K448-C461 VanDerWaalsContact O-CA 3.27Å; K448-C461 WeakPolarHBondContact O-CA 3.38Å; C450-C461 PolarHBondContact SG-N 3.03Å; C461-G463 PolarHBondContact O-N 3.49Å; C461-C471 WeakPolarHBondContact O-CA 3.38Å; C461-Q472 PolarHBondContact N-O 3.16Å; C461-Q472 WeakPolarHBondContact O-CG 3.35Å; C461-Q472 PolarHBondContact O-N 2.76Å
462	T	85.5	Confident	72.6	Confident	15 Å²	15	78 Å²	78	9%	0.092	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	127.4	179.7	67.5	0	0	0	0	109.5	S447 K448 Q469 V470	S447-T462 WeakPolarHBondContact CA-O 3.18Å; S447-T462 VanDerWaalsContact CB-O 3.24Å; S447-T462 WeakPolarHBondContact CB-O 3.39Å; S447-T462 PolarHBondContact OG-O 3.41Å; K448-T462 HydrophobicContact CB-CG2 4.37Å; K448-T462 PolarHBondContact N-OG1 2.97Å; K448-T462 WeakPolarHBondContact O-CG2 3.48Å; K448-T462 PolarHBondContact O-N 3.3Å; K448-T462 PolarHBondContact O-OG1 3.3Å; T462-Q469 VanDerWaalsContact CB-NE2 3.35Å; T462-Q469 HydrophobicContact CG2-CG 4.11Å; T462-Q469 PolarHBondContact OG1-NE2 2.79Å; T462-Q469 VanDerWaalsContact OG1-NE2 3.09Å; T462-V470 CarbonylContact C-O 3.58Å; T462-V470 WeakPolarHBondContact CA-O 3.43Å
463	G	78.4	Confident	73.1	Confident	7 Å²	7	70.5 Å²	70.5	7%	0.072	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	178.3	167.9	0	0	0	0	0	110.4	C461 Q469 V470 Q472	C461-G463 PolarHBondContact O-N 3.49Å; G463-Q469 CarbonylContact O-C 3.57Å; G463-Q469 VanDerWaalsContact O-CA 3.29Å; G463-Q469 WeakPolarHBondContact O-CA 2.95Å; G463-V470 PolarHBondContact N-O 3.23Å; G463-V470 PolarHBondContact O-N 3.5Å; G463-Q472 VanDerWaalsContact CA-NE2 3.32Å
464	N	70	Confident	73.1	Confident	127 Å²	127	72.2 Å²	72.2	68%	0.679	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	109.6	174.8	-73	-10.8	0	0	0	108.6	Q468	N464-Q468 WeakPolarHBondContact CA-O 3.38Å
465	A	56.8	Low	73	Confident	48 Å²	48	68.8 Å²	68.8	40%	0.397	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.5	169.5	0	0	0	0	0	107.7	G467 Q468 V470	A465-G467 VanDerWaalsContact C-N 3.31Å; A465-G467 PolarHBondContact O-N 2.02Å; A465-Q468 PolarHBondContact N-O 3.38Å; A465-Q468 VanDerWaalsContact N-O 3.1Å; A465-Q468 PolarHBondContact O-N 3.03Å; A465-V470 HydrophobicContact CB-CG1 4.1Å; A465-V470 HydrophobicContact CB-CG2 3.61Å
466	R	54.1	Low	72.6	Confident	258 Å²	258	67.3 Å²	67.3	97%	0.974	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	39.4	179.3	-59.5	-178.3	-80.2	-160.1	-4.6	114	Q468	R466-Q468 PolarHBondContact O-N 3.35Å
467	G	57.9	Low	72.7	Confident	77 Å²	77	68.7 Å²	68.7	79%	0.794	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-2.4	175.8	0	0	0	0	0	115.8	A465	A465-G467 VanDerWaalsContact C-N 3.31Å; A465-G467 PolarHBondContact O-N 2.02Å
468	Q	52.5	Low	73.2	Confident	152 Å²	152	67.8 Å²	67.8	71%	0.71	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.6	173.3	-119.3	176.8	-6	0	0	111.5	N464 A465 R466 V470	N464-Q468 WeakPolarHBondContact CA-O 3.38Å; A465-Q468 PolarHBondContact N-O 3.38Å; A465-Q468 VanDerWaalsContact N-O 3.1Å; A465-Q468 PolarHBondContact O-N 3.03Å; R466-Q468 PolarHBondContact O-N 3.35Å; Q468-V470 PolarHBondContact O-N 3.35Å
469	Q	64.9	Low	73.3	Confident	125 Å²	125	64.8 Å²	64.8	58%	0.584	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	106	-179.3	-165.7	157.2	2.6	0	0	109.7	T462 G463	T462-Q469 VanDerWaalsContact CB-NE2 3.35Å; T462-Q469 HydrophobicContact CG2-CG 4.11Å; T462-Q469 PolarHBondContact OG1-NE2 2.79Å; T462-Q469 VanDerWaalsContact OG1-NE2 3.09Å; G463-Q469 CarbonylContact O-C 3.57Å; G463-Q469 VanDerWaalsContact O-CA 3.29Å; G463-Q469 WeakPolarHBondContact O-CA 2.95Å
470	V	79.3	Confident	73.4	Confident	52 Å²	52	65.8 Å²	65.8	32%	0.315	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	152.2	-176.6	-66.6	0	0	0	0	111.1	T462 G463 A465 Q468	T462-V470 CarbonylContact C-O 3.58Å; T462-V470 WeakPolarHBondContact CA-O 3.43Å; G463-V470 PolarHBondContact N-O 3.23Å; G463-V470 PolarHBondContact O-N 3.5Å; A465-V470 HydrophobicContact CB-CG1 4.1Å; A465-V470 HydrophobicContact CB-CG2 3.61Å; Q468-V470 PolarHBondContact O-N 3.35Å
471	C	78.8	Confident	73.2	Confident	57 Å²	57	62.8 Å²	62.8	39%	0.385	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.3	171.5	-78.6	0	0	0	0	110.8	C450 M453 W460 C461	C450-C471 HydrophobicContact CB-CB 3.86Å; C450-C471 WeakPolarHBondContact CB-SG 3.44Å; C450-C471 WeakPolarHBondContact SG-CA 3.26Å; C450-C471 WeakPolarHBondContact SG-CB 3.34Å; C450-C471 CovalentContact SG-SG 2.01Å; C450-C471 PolarHBondContact SG-SG 3.12Å; M453-C471 HydrophobicContact CE-CB 4.39Å; W460-C471 HydrophobicContact CE3-CB 4.31Å; C461-C471 WeakPolarHBondContact O-CA 3.38Å
472	Q	77	Confident	73.3	Confident	67 Å²	67	63 Å²	63	31%	0.313	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.8	178.5	54.5	-177.7	6	0	0	110.7	F443 W460 C461 G463	F443-Q472 HydrophobicContact CD1-CG 3.72Å; F443-Q472 HydrophobicContact CD2-CG 4.42Å; F443-Q472 HydrophobicContact CE1-CB 4.14Å; F443-Q472 HydrophobicContact CE1-CG 3.59Å; F443-Q472 HydrophobicContact CE2-CG 4.31Å; F443-Q472 HydrophobicContact CG-CG 4.1Å; F443-Q472 HydrophobicContact CZ-CB 4.3Å; F443-Q472 HydrophobicContact CZ-CG 3.88Å; W460-Q472 WeakPolarHBondContact CA-O 3.45Å; C461-Q472 PolarHBondContact N-O 3.16Å; C461-Q472 WeakPolarHBondContact O-CG 3.35Å; C461-Q472 PolarHBondContact O-N 2.76Å; G463-Q472 VanDerWaalsContact CA-NE2 3.32Å
473	T	76.2	Confident	73.3	Confident	25 Å²	25	66.2 Å²	66.2	15%	0.153	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.2	177.5	-173.8	0	0	0	0	110	L459 W460 H475	L459-T473 VanDerWaalsContact O-CB 3.25Å; L459-T473 WeakPolarHBondContact O-CB 3.15Å; L459-T473 PolarHBondContact O-OG1 3.41Å; W460-T473 HydrophobicContact CD2-CG2 3.83Å; W460-T473 HydrophobicContact CE3-CG2 3.74Å; W460-T473 HydrophobicContact CH2-CG2 3.45Å; W460-T473 VanDerWaalsContact CH2-CG2 3.45Å; W460-T473 HydrophobicContact CZ2-CG2 3.54Å; W460-T473 HydrophobicContact CZ3-CG2 3.55Å; T473-H475 PolarHBondContact OG1-N 3.45Å
474	R	66.9	Low	73.6	Confident	94 Å²	94	66.9 Å²	66.9	36%	0.355	36%	0.36	S	S	.	.			trans	-100.8	15.1	168.3	-58.1	-164.2	-175.3	-145.2	11.5	112.6	D342 A442 F443 F476	D342-R474 VanDerWaalsContact CG-CD 3.45Å; D342-R474 WeakPolarHBondContact OD1-CD 3.47Å; D342-R474 IonicContact OD1-CZ 3.16Å; D342-R474 IonicContact OD1-NE 3.34Å; D342-R474 PolarHBondContact OD1-NE 3.18Å; D342-R474 IonicContact OD1-NH1 2.75Å; D342-R474 PolarHBondContact OD1-NH1 2.96Å; D342-R474 IonicContact OD1-NH2 2.78Å; D342-R474 PolarHBondContact OD1-NH2 3.47Å; D342-R474 VanDerWaalsContact OD1-NH2 3.15Å; D342-R474 WeakPolarHBondContact OD2-CD 3.25Å; D342-R474 IonicContact OD2-CZ 3.19Å; D342-R474 IonicContact OD2-NE 3.89Å; D342-R474 IonicContact OD2-NH1 2.74Å; D342-R474 PolarHBondContact OD2-NH1 2.82Å; A442-R474 PolarHBondContact O-NE 3.15Å; A442-R474 PolarHBondContact O-NH2 3.18Å; F443-R474 HydrophobicContact CE1-CG 3.72Å; F443-R474 HydrophobicContact CZ-CG 3.6Å; R474-F476 VanDerWaalsContact C-N 3.28Å; R474-F476 HydrophobicContact CB-CD2 3.79Å; R474-F476 HydrophobicContact CB-CE2 4.03Å; R474-F476 WeakPolarHBondContact O-CD2 3.06Å; R474-F476 WeakPolarHBondContact O-CE2 2.95Å; R474-F476 PolarHBondContact O-N 2.75Å
475	H	71.1	Confident	74.1	Confident	83 Å²	83	64.6 Å²	64.6	38%	0.384	35%	0.351	S	S	.	.	S	Bend	trans	65.6	18.3	-178.9	-54.1	-68.6	0	0	0	116.2	T473	T473-H475 PolarHBondContact OG1-N 3.45Å
476	F	71.6	Confident	75.3	Confident	22 Å²	22	73.4 Å²	73.4	10%	0.096	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-93.4	143.1	172.5	-64.2	-72.6	0	0	0	111.6	P345 L385 K458 L459 R474	P345-F476 HydrophobicContact CB-CB 4.49Å; P345-F476 HydrophobicContact CB-CD1 3.9Å; P345-F476 HydrophobicContact CB-CD2 3.43Å; P345-F476 VanDerWaalsContact CB-CD2 3.43Å; P345-F476 HydrophobicContact CB-CE1 3.91Å; P345-F476 HydrophobicContact CB-CE2 3.43Å; P345-F476 VanDerWaalsContact CB-CE2 3.43Å; P345-F476 HydrophobicContact CB-CG 3.66Å; P345-F476 HydrophobicContact CB-CZ 3.68Å; P345-F476 HydrophobicContact CG-CB 3.8Å; P345-F476 HydrophobicContact CG-CD1 4.14Å; P345-F476 HydrophobicContact CG-CD2 3.26Å; P345-F476 HydrophobicContact CG-CE2 3.81Å; P345-F476 HydrophobicContact CG-CG 3.45Å; P345-F476 VanDerWaalsContact CG-CG 3.45Å; P345-F476 HydrophobicContact CG-CZ 4.45Å; L385-F476 HydrophobicContact CB-CE1 4.34Å; L385-F476 HydrophobicContact CB-CZ 4.17Å; K458-F476 CarbonylContact C-O 3.57Å; K458-F476 WeakPolarHBondContact CA-O 3.32Å; L459-F476 WeakPolarHBondContact CB-O 3.09Å; L459-F476 PolarHBondContact N-O 3.19Å; R474-F476 VanDerWaalsContact C-N 3.28Å; R474-F476 HydrophobicContact CB-CD2 3.79Å; R474-F476 HydrophobicContact CB-CE2 4.03Å; R474-F476 WeakPolarHBondContact O-CD2 3.06Å; R474-F476 WeakPolarHBondContact O-CE2 2.95Å; R474-F476 PolarHBondContact O-N 2.75Å
477	P	80	Confident	76.4	Confident	30 Å²	30	63 Å²	63	20%	0.195	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-70.1	169.2	174	31.4	-37.9	0	0	0	111.9	R390 C456 A457	R390-P477 VanDerWaalsContact CZ-CG 3.47Å; C456-P477 WeakPolarHBondContact O-CB 3.45Å; A457-P477 WeakPolarHBondContact O-CA 3.21Å; A457-P477 WeakPolarHBondContact O-CB 3.34Å
478	W	84.6	Confident	77.7	Confident	23 Å²	23	62.9 Å²	62.9	9%	0.087	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-63.8	149.8	171.8	-56.7	4	0	0	0	109.5	L435 P455 K458 T482 C484	L435-W478 HydrophobicContact CD1-CB 4.46Å; L435-W478 HydrophobicContact CD1-CD2 3.41Å; L435-W478 VanDerWaalsContact CD1-CD2 3.41Å; L435-W478 HydrophobicContact CD1-CE3 3.79Å; L435-W478 HydrophobicContact CD1-CG 3.72Å; L435-W478 HydrophobicContact CD1-CH2 4.32Å; L435-W478 HydrophobicContact CD1-CZ2 4.01Å; L435-W478 HydrophobicContact CD1-CZ3 4.21Å; L435-W478 HydrophobicContact CD2-CD2 4.36Å; L435-W478 HydrophobicContact CD2-CE3 4.22Å; L435-W478 HydrophobicContact CD2-CH2 3.45Å; L435-W478 VanDerWaalsContact CD2-CH2 3.45Å; L435-W478 HydrophobicContact CD2-CZ2 3.61Å; L435-W478 HydrophobicContact CD2-CZ3 3.77Å; L435-W478 HydrophobicContact CG-CZ2 4.47Å; P455-W478 HydrophobicContact CB-CE3 4.33Å; P455-W478 HydrophobicContact CB-CH2 3.8Å; P455-W478 HydrophobicContact CB-CZ2 4.35Å; P455-W478 HydrophobicContact CB-CZ3 3.79Å; P455-W478 HydrophobicContact CG-CH2 4.19Å; K458-W478 PolarHBondContact O-NE1 3.41Å; W478-T482 HydrophobicContact CE3-CG2 3.87Å; W478-C484 HydrophobicContact CZ3-CB 4.35Å
479	A	82.9	Confident	79.4	Confident	12 Å²	12	56.3 Å²	56.3	10%	0.099	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-60.3	141.6	177.9	0	0	0	0	0	111.4	L344 P429 G481 T482	L344-A479 HydrophobicContact CD1-CB 3.69Å; P429-A479 HydrophobicContact CB-CB 4.13Å; A479-G481 PolarHBondContact O-N 3.35Å; A479-T482 VanDerWaalsContact O-CB 3.26Å; A479-T482 WeakPolarHBondContact O-CB 3.45Å; A479-T482 PolarHBondContact O-N 3.47Å; A479-T482 VanDerWaalsContact O-N 3.12Å; A479-T482 PolarHBondContact O-OG1 3.16Å
480	D	82.4	Confident	80.3	Confident	34 Å²	34	50.4 Å²	50.4	18%	0.182	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	140.5	174.3	-70.9	-8.5	0	0	0	109.1	R390 L428 G430 C490 R492	R390-D480 IonicContact NH1-OD1 3.17Å; R390-D480 PolarHBondContact NH1-OD1 3.41Å; R390-D480 IonicContact NH1-OD2 2.72Å; L428-D480 CarbonylContact C-O 3.53Å; L428-D480 HydrophobicContact CB-CB 4.43Å; L428-D480 VanDerWaalsContact CB-O 3.22Å; L428-D480 WeakPolarHBondContact CB-O 3.19Å; L428-D480 HydrophobicContact CD1-CB 4.44Å; L428-D480 HydrophobicContact CD2-CB 4.1Å; G430-D480 WeakPolarHBondContact CA-O 3.45Å; G430-D480 PolarHBondContact N-O 3.09Å; D480-C490 CarbonylContact C-O 3.51Å; D480-C490 VanDerWaalsContact CA-O 3.32Å; D480-C490 WeakPolarHBondContact CA-O 3.48Å; D480-R492 PolarHBondContact OD1-N 2.75Å
481	G	81.3	Confident	80.3	Confident	11 Å²	11	50.9 Å²	50.9	11%	0.113	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-11.9	-173	0	0	0	0	0	115	G430 A479 S483 C490	G430-G481 VanDerWaalsContact C-C 3.47Å; G430-G481 CarbonylContact C-O 3.5Å; A479-G481 PolarHBondContact O-N 3.35Å; G481-S483 PolarHBondContact O-N 3.06Å; G481-C490 PolarHBondContact N-O 3.06Å
482	T	86.8	Confident	80.1	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.025	27%	0.271	C	S	.	.			trans	-65.9	131.4	178.7	-52.4	0	0	0	0	109.8	G430 L435 Q438 W478 A479 C484 V489 C490	G430-T482 WeakPolarHBondContact CA-OG1 3.48Å; G430-T482 WeakPolarHBondContact O-CA 3.39Å; L435-T482 HydrophobicContact CB-CG2 4.13Å; L435-T482 HydrophobicContact CD1-CG2 4.4Å; Q438-T482 PolarHBondContact NE2-OG1 2.99Å; W478-T482 HydrophobicContact CE3-CG2 3.87Å; A479-T482 VanDerWaalsContact O-CB 3.26Å; A479-T482 WeakPolarHBondContact O-CB 3.45Å; A479-T482 PolarHBondContact O-N 3.47Å; A479-T482 VanDerWaalsContact O-N 3.12Å; A479-T482 PolarHBondContact O-OG1 3.16Å; T482-C484 PolarHBondContact O-N 3.26Å; T482-V489 CarbonylContact O-C 3.59Å; T482-V489 WeakPolarHBondContact O-CA 2.99Å; T482-C490 PolarHBondContact O-N 2.94Å
483	S	85.7	Confident	80	Confident	82 Å²	82	52.4 Å²	52.4	57%	0.573	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	121.8	175.7	-169.9	0	0	0	0	110.2	G481	G481-S483 PolarHBondContact O-N 3.06Å
484	C	84.6	Confident	80.3	Confident	21 Å²	21	53.6 Å²	53.6	14%	0.142	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-37.9	179	46.9	0	0	0	0	112.6	P455 W478 T482 K488 V489 C495	P455-C484 HydrophobicContact CB-CB 3.5Å; P455-C484 HydrophobicContact CG-CB 4.4Å; W478-C484 HydrophobicContact CZ3-CB 4.35Å; T482-C484 PolarHBondContact O-N 3.26Å; C484-K488 PolarHBondContact N-O 3.47Å; C484-V489 VanDerWaalsContact SG-C 3.5Å; C484-C495 HydrophobicContact CB-CB 3.83Å; C484-C495 WeakPolarHBondContact CB-SG 3.39Å; C484-C495 VanDerWaalsContact SG-CA 3.53Å; C484-C495 WeakPolarHBondContact SG-CB 3.43Å; C484-C495 CovalentContact SG-SG 2.03Å; C484-C495 PolarHBondContact SG-SG 3.42Å
485	V	80.9	Confident	81.2	Confident	80 Å²	80	51.1 Å²	51.1	49%	0.485	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.3	177.2	-177.7	0	0	0	0	107.8	G487 K488	V485-G487 PolarHBondContact O-N 2.78Å; V485-K488 HydrophobicContact CB-CB 4.17Å; V485-K488 HydrophobicContact CB-CD 4.47Å; V485-K488 HydrophobicContact CB-CG 4.42Å; V485-K488 PolarHBondContact O-N 3.02Å
486	Y	82	Confident	81.8	Confident	232 Å²	232	49.3 Å²	49.3	91%	0.91	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	123.6	175.7	-170.6	-98.8	0	0	0	111.4	K488	Y486-K488 PolarHBondContact O-N 3.06Å
487	G	77.9	Confident	82.4	Confident	41 Å²	41	51.9 Å²	51.9	42%	0.423	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	3.1	-176.9	0	0	0	0	0	115.7	V485 K498	V485-G487 PolarHBondContact O-N 2.78Å; G487-K498 WeakPolarHBondContact O-CB 3.22Å; G487-K498 PolarHBondContact O-N 3.48Å
488	K	84.8	Confident	81.9	Confident	73 Å²	73	55.4 Å²	55.4	32%	0.317	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	150.9	177	-57	-165.1	173.2	-174.1	0	112.4	C484 V485 Y486 V496 D497	C484-K488 PolarHBondContact N-O 3.47Å; V485-K488 HydrophobicContact CB-CB 4.17Å; V485-K488 HydrophobicContact CB-CD 4.47Å; V485-K488 HydrophobicContact CB-CG 4.42Å; V485-K488 PolarHBondContact O-N 3.02Å; Y486-K488 PolarHBondContact O-N 3.06Å; K488-V496 CarbonylContact C-O 3.54Å; K488-V496 WeakPolarHBondContact CA-O 3.47Å; K488-V496 VanDerWaalsContact CB-O 3.31Å; K488-V496 WeakPolarHBondContact CB-O 3.45Å; K488-D497 WeakPolarHBondContact CE-OD1 3.45Å; K488-D497 IonicContact NZ-OD2 2.81Å
489	V	87.5	Confident	81.1	Confident	15 Å²	15	64.4 Å²	64.4	9%	0.091	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.5	-179.9	-67.1	0	0	0	0	110.8	T482 C484 V496 K498 T501	T482-V489 CarbonylContact O-C 3.59Å; T482-V489 WeakPolarHBondContact O-CA 2.99Å; C484-V489 VanDerWaalsContact SG-C 3.5Å; V489-V496 PolarHBondContact N-O 3.43Å; V489-V496 WeakPolarHBondContact O-CG2 3.38Å; V489-V496 PolarHBondContact O-N 2.96Å; V489-K498 HydrophobicContact CG1-CB 4.47Å; V489-K498 HydrophobicContact CG1-CD 4.39Å; V489-K498 HydrophobicContact CG1-CG 4.27Å; V489-T501 HydrophobicContact CG2-CG2 4.23Å; V489-T501 WeakPolarHBondContact CG2-OG1 3.36Å
490	C	83.6	Confident	80	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.1	171.7	-65.4	0	0	0	0	110.7	C456 D480 G481 T482 A494	C456-C490 WeakPolarHBondContact CA-SG 3.37Å; C456-C490 HydrophobicContact CB-CB 3.64Å; C456-C490 WeakPolarHBondContact CB-SG 3.43Å; C456-C490 WeakPolarHBondContact SG-CA 3.35Å; C456-C490 WeakPolarHBondContact SG-CB 3.04Å; C456-C490 CovalentContact SG-SG 2.03Å; C456-C490 PolarHBondContact SG-SG 3.2Å; D480-C490 CarbonylContact C-O 3.51Å; D480-C490 VanDerWaalsContact CA-O 3.32Å; D480-C490 WeakPolarHBondContact CA-O 3.48Å; G481-C490 PolarHBondContact N-O 3.06Å; T482-C490 PolarHBondContact O-N 2.94Å; C490-A494 CarbonylContact C-O 3.52Å; C490-A494 WeakPolarHBondContact CA-O 3.31Å
491	Y	79.5	Confident	78.8	Confident	62 Å²	62	66.6 Å²	66.6	24%	0.243	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	125.3	172.9	-171.1	-107.1	0	0	0	108.9	L428 G493 A494 T501	L428-Y491 HydrophobicContact CD1-CD2 4.18Å; L428-Y491 HydrophobicContact CD2-CE2 4.47Å; Y491-G493 PolarHBondContact O-N 3.41Å; Y491-G493 VanDerWaalsContact O-N 3.16Å; Y491-A494 PolarHBondContact N-O 2.84Å; Y491-A494 PolarHBondContact O-N 3.49Å; Y491-A494 VanDerWaalsContact O-N 3.11Å; Y491-T501 HydrophobicContact CD1-CG2 4.3Å; Y491-T501 HydrophobicContact CD2-CG2 4.4Å; Y491-T501 HydrophobicContact CG-CG2 3.95Å
492	R	74.1	Confident	77.4	Confident	131 Å²	131	71.1 Å²	71.1	49%	0.494	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	33.6	-178.8	-61	-178.6	177.3	-177.9	-1.8	113.9	D480 A494	D480-R492 PolarHBondContact OD1-N 2.75Å; R492-A494 VanDerWaalsContact C-N 3.35Å
493	G	74.9	Confident	75.5	Confident	26 Å²	26	77.1 Å²	77.1	27%	0.268	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	2.5	177.7	0	0	0	0	0	115.5	C456 Y491	C456-G493 CarbonylContact C-O 3.51Å; C456-G493 WeakPolarHBondContact CB-O 3.5Å; C456-G493 CarbonylContact O-C 3.57Å; C456-G493 VanDerWaalsContact O-CA 3.3Å; C456-G493 WeakPolarHBondContact O-CA 3.46Å; Y491-G493 PolarHBondContact O-N 3.41Å; Y491-G493 VanDerWaalsContact O-N 3.16Å
494	A	82.5	Confident	73.9	Confident	49 Å²	49	76.3 Å²	76.3	41%	0.405	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	151.7	176.5	0	0	0	0	0	111.7	C490 Y491 R492 V496	C490-A494 CarbonylContact C-O 3.52Å; C490-A494 WeakPolarHBondContact CA-O 3.31Å; Y491-A494 PolarHBondContact N-O 2.84Å; Y491-A494 PolarHBondContact O-N 3.49Å; Y491-A494 VanDerWaalsContact O-N 3.11Å; R492-A494 VanDerWaalsContact C-N 3.35Å; A494-V496 HydrophobicContact CB-CG1 4.35Å
495	C	85.6	Confident	72.4	Confident	43 Å²	43	83.4 Å²	83.4	29%	0.291	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	109.5	175.7	-176.7	0	0	0	0	110.1	C484	C484-C495 HydrophobicContact CB-CB 3.83Å; C484-C495 WeakPolarHBondContact CB-SG 3.39Å; C484-C495 VanDerWaalsContact SG-CA 3.53Å; C484-C495 WeakPolarHBondContact SG-CB 3.43Å; C484-C495 CovalentContact SG-SG 2.03Å; C484-C495 PolarHBondContact SG-SG 3.42Å
496	V	85.1	Confident	71.7	Confident	44 Å²	44	84.4 Å²	84.4	27%	0.267	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.7	-171.4	-64.2	0	0	0	0	111.7	K488 V489 A494 K498 T501	K488-V496 CarbonylContact C-O 3.54Å; K488-V496 WeakPolarHBondContact CA-O 3.47Å; K488-V496 VanDerWaalsContact CB-O 3.31Å; K488-V496 WeakPolarHBondContact CB-O 3.45Å; V489-V496 PolarHBondContact N-O 3.43Å; V489-V496 WeakPolarHBondContact O-CG2 3.38Å; V489-V496 PolarHBondContact O-N 2.96Å; A494-V496 HydrophobicContact CB-CG1 4.35Å; V496-K498 PolarHBondContact O-N 2.91Å; V496-T501 HydrophobicContact CB-CG2 4.41Å; V496-T501 HydrophobicContact CG2-CG2 3.28Å
497	D	82.9	Confident	71.4	Confident	77 Å²	77	78.7 Å²	78.7	41%	0.412	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	135.5	-179.7	-73.7	-71.6	0	0	0	112.6	K488 R499 S500 T501	K488-D497 WeakPolarHBondContact CE-OD1 3.45Å; K488-D497 IonicContact NZ-OD2 2.81Å; D497-R499 PolarHBondContact O-N 3.25Å; D497-S500 VanDerWaalsContact CB-OG 3.24Å; D497-S500 WeakPolarHBondContact CB-OG 3.4Å; D497-S500 PolarHBondContact O-N 3.06Å; D497-S500 PolarHBondContact O-OG 3.45Å; D497-T501 PolarHBondContact O-N 3.14Å; D497-T501 PolarHBondContact O-OG1 3.23Å
498	K	71.4	Confident	71.6	Confident	104 Å²	104	78.7 Å²	78.7	45%	0.452	40%	0.398	S	S	.	.	H	α-helix	trans	-62.9	-30.6	-178.3	-170.9	175	-179.5	178.4	0	111.6	G487 V489 V496 T501 M502	G487-K498 WeakPolarHBondContact O-CB 3.22Å; G487-K498 PolarHBondContact O-N 3.48Å; V489-K498 HydrophobicContact CG1-CB 4.47Å; V489-K498 HydrophobicContact CG1-CD 4.39Å; V489-K498 HydrophobicContact CG1-CG 4.27Å; V496-K498 PolarHBondContact O-N 2.91Å; K498-T501 VanDerWaalsContact CA-OG1 3.26Å; K498-T501 WeakPolarHBondContact CA-OG1 3.45Å; K498-T501 PolarHBondContact O-OG1 2.66Å; K498-M502 HydrophobicContact CG-CE 4.38Å; K498-M502 VanDerWaalsContact O-CB 3.3Å; K498-M502 WeakPolarHBondContact O-CB 3.2Å; K498-M502 VanDerWaalsContact O-CG 3.26Å; K498-M502 WeakPolarHBondContact O-CG 3.37Å; K498-M502 PolarHBondContact O-N 3.35Å
499	R	66.1	Low	71.6	Confident	212 Å²	212	78.5 Å²	78.5	80%	0.8	40%	0.4	S	S	*	.	H	α-helix	trans	-74.5	-39.4	176.1	-71.8	-176.6	179.5	178	0.2	112.5	D497 M502 N503	D497-R499 PolarHBondContact O-N 3.25Å; R499-M502 PolarHBondContact O-N 3.36Å; R499-N503 VanDerWaalsContact O-CB 3.31Å; R499-N503 WeakPolarHBondContact O-CB 3.39Å; R499-N503 PolarHBondContact O-N 2.88Å; R499-N503 PolarHBondContact O-ND2 2.85Å
500	S	60.8	Low	71.4	Confident	61 Å²	61	78.3 Å²	78.3	43%	0.427	40%	0.402	S	S	.	.	H	α-helix	trans	-72.2	-32.8	175.4	41.7	0	0	0	0	112	D497 N503 V504	D497-S500 VanDerWaalsContact CB-OG 3.24Å; D497-S500 WeakPolarHBondContact CB-OG 3.4Å; D497-S500 PolarHBondContact O-N 3.06Å; D497-S500 PolarHBondContact O-OG 3.45Å; S500-N503 PolarHBondContact O-N 3.08Å; S500-V504 WeakPolarHBondContact O-CG2 3.19Å; S500-V504 PolarHBondContact O-N 3.18Å
501	T	56.9	Low	71.6	Confident	31 Å²	31	86.8 Å²	86.8	19%	0.19	43%	0.434	C	S	.	.	H	α-helix	trans	-71.3	-30.2	169.4	35.5	0	0	0	0	113.9	V489 Y491 V496 D497 K498	V489-T501 HydrophobicContact CG2-CG2 4.23Å; V489-T501 WeakPolarHBondContact CG2-OG1 3.36Å; Y491-T501 HydrophobicContact CD1-CG2 4.3Å; Y491-T501 HydrophobicContact CD2-CG2 4.4Å; Y491-T501 HydrophobicContact CG-CG2 3.95Å; V496-T501 HydrophobicContact CB-CG2 4.41Å; V496-T501 HydrophobicContact CG2-CG2 3.28Å; D497-T501 PolarHBondContact O-N 3.14Å; D497-T501 PolarHBondContact O-OG1 3.23Å; K498-T501 VanDerWaalsContact CA-OG1 3.26Å; K498-T501 WeakPolarHBondContact CA-OG1 3.45Å; K498-T501 PolarHBondContact O-OG1 2.66Å
502	M	51.5	Low	71.9	Confident	105 Å²	105	85.9 Å²	85.9	52%	0.517	43%	0.43	S	S	.	.	H	α-helix	trans	-79.8	-23.1	172.4	-77.2	-167.6	176.8	0	0	114.1	K498 R499 V504 K505	K498-M502 HydrophobicContact CG-CE 4.38Å; K498-M502 VanDerWaalsContact O-CB 3.3Å; K498-M502 WeakPolarHBondContact O-CB 3.2Å; K498-M502 VanDerWaalsContact O-CG 3.26Å; K498-M502 WeakPolarHBondContact O-CG 3.37Å; K498-M502 PolarHBondContact O-N 3.35Å; R499-M502 PolarHBondContact O-N 3.36Å; M502-V504 VanDerWaalsContact C-N 3.29Å; M502-K505 WeakPolarHBondContact O-CB 3.41Å; M502-K505 WeakPolarHBondContact O-CG 3.48Å
503	N	46.8	Very low	72.4	Confident	131 Å²	131	80.1 Å²	80.1	70%	0.701	41%	0.411	S	S	*	.	H	α-helix	trans	-78.8	-10.4	173	-73.3	-13.1	0	0	0	112.9	R499 S500 K505	R499-N503 VanDerWaalsContact O-CB 3.31Å; R499-N503 WeakPolarHBondContact O-CB 3.39Å; R499-N503 PolarHBondContact O-N 2.88Å; R499-N503 PolarHBondContact O-ND2 2.85Å; S500-N503 PolarHBondContact O-N 3.08Å; N503-K505 PolarHBondContact O-N 2.88Å
504	V	52.7	Low	73	Confident	64 Å²	64	87.6 Å²	87.6	39%	0.388	44%	0.436	S	S	.	.			trans	-82.2	42.2	170.1	178.9	0	0	0	0	110.1	S500 M502 N543	S500-V504 WeakPolarHBondContact O-CG2 3.19Å; S500-V504 PolarHBondContact O-N 3.18Å; M502-V504 VanDerWaalsContact C-N 3.29Å; V504-N543 HydrophobicContact CG1-CB 4.47Å; V504-N543 WeakPolarHBondContact CG1-ND2 3.48Å; V504-N543 WeakPolarHBondContact CG1-OD1 3.26Å
505	K	53.9	Low	73	Confident	170 Å²	170	88.6 Å²	88.6	74%	0.739	43%	0.429	S	S	*	.			trans	-102.2	-0.8	-178.5	-96.1	-174.3	179.9	-177.4	0	114.2	M502 N503 K507	M502-K505 WeakPolarHBondContact O-CB 3.41Å; M502-K505 WeakPolarHBondContact O-CG 3.48Å; N503-K505 PolarHBondContact O-N 2.88Å; K505-K507 PolarHBondContact O-N 3.02Å
506	T	64.3	Low	72.7	Confident	102 Å²	102	88.3 Å²	88.3	63%	0.626	43%	0.434	S	S	*	.			trans	-81.5	102.1	168.5	51	0	0	0	0	108.1	V508 N543	T506-V508 PolarHBondContact O-N 3.37Å; T506-N543 PolarHBondContact O-ND2 2.82Å
507	K	75.7	Confident	72.7	Confident	111 Å²	111	89.4 Å²	89.4	48%	0.483	45%	0.454	S	S	.	.			trans	-54.4	118.3	164.3	176.3	172.7	170.8	149.7	0	108.4	K505 D509 G544	K505-K507 PolarHBondContact O-N 3.02Å; K507-D509 WeakPolarHBondContact CE-OD1 3.34Å; K507-G544 WeakPolarHBondContact CE-O 3.1Å; K507-G544 PolarHBondContact NZ-O 3.05Å
508	V	82.2	Confident	72.8	Confident	41 Å²	41	88.6 Å²	88.6	25%	0.248	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-102.6	104	176.8	-177.3	0	0	0	0	107.4	T506 P539 P541 E542 G545	T506-V508 PolarHBondContact O-N 3.37Å; V508-P539 HydrophobicContact CG1-CB 4.09Å; V508-P539 HydrophobicContact CG1-CG 3.62Å; V508-P541 WeakPolarHBondContact O-CA 3.42Å; V508-E542 HydrophobicContact CB-CB 4.12Å; V508-E542 HydrophobicContact CG2-CB 4.4Å; V508-E542 PolarHBondContact N-O 3.17Å; V508-E542 VanDerWaalsContact N-O 3.12Å; V508-E542 PolarHBondContact O-N 3.41Å; V508-G545 WeakPolarHBondContact O-CA 3.45Å
509	D	84.9	Confident	73.4	Confident	69 Å²	69	85.5 Å²	85.5	37%	0.369	45%	0.445	S	S	.	.			trans	-70	131.9	172.5	-74.2	-12.4	0	0	0	109.5	K507 K546	K507-D509 WeakPolarHBondContact CE-OD1 3.34Å; D509-K546 HydrophobicContact CB-CB 4.44Å; D509-K546 PolarHBondContact OD1-N 2.98Å
510	G	84.7	Confident	74.5	Confident	11 Å²	11	82.3 Å²	82.3	11%	0.113	44%	0.443	C	S	.	.			trans	-70.1	147.8	-179	0	0	0	0	0	112.1	P539 K546 C548	G510-P539 WeakPolarHBondContact CA-O 3.21Å; G510-K546 PolarHBondContact N-O 3.06Å; G510-C548 PolarHBondContact O-SG 2.98Å
511	R	87.1	Confident	75.9	Confident	179 Å²	179	80.9 Å²	80.9	68%	0.675	43%	0.433	S	S	*	.			trans	-128.6	149.9	172.9	-61.6	175	-179.1	-173.9	-0.5	110.4	G513 D537 N538 P539 C548	R511-G513 PolarHBondContact O-N 3.48Å; R511-D537 PolarHBondContact O-N 2.87Å; R511-N538 VanDerWaalsContact CB-O 3.25Å; R511-N538 WeakPolarHBondContact CB-O 3.44Å; R511-N538 PolarHBondContact O-N 2.6Å; R511-P539 PolarHBondContact N-O 3.25Å; R511-C548 WeakPolarHBondContact CA-SG 3.41Å; R511-C548 PolarHBondContact N-SG 3.08Å; R511-C548 VanDerWaalsContact N-SG 3.41Å; R511-C548 PolarHBondContact O-SG 2.95Å
512	W	86.1	Confident	77.4	Confident	43 Å²	43	81.3 Å²	81.3	16%	0.163	44%	0.438	C	S	.	.			trans	-62.9	129.9	-177.7	-73.8	115.8	0	0	0	110.9	R534 C536 C548 Y549 G550 R552	W512-R534 VanDerWaalsContact CD1-CZ 3.43Å; W512-R534 VanDerWaalsContact CD1-NH2 3.26Å; W512-R534 HydrophobicContact CD2-CG 4.19Å; W512-R534 HydrophobicContact CE3-CG 3.66Å; W512-R534 HydrophobicContact CZ3-CG 4.18Å; W512-C536 HydrophobicContact CE3-CB 4.44Å; W512-C536 HydrophobicContact CZ3-CB 4.25Å; W512-C548 HydrophobicContact CD2-CB 3.63Å; W512-C548 HydrophobicContact CE3-CB 4.01Å; W512-C548 HydrophobicContact CG-CB 4.15Å; W512-C548 HydrophobicContact CH2-CB 3.87Å; W512-C548 HydrophobicContact CZ2-CB 3.52Å; W512-C548 HydrophobicContact CZ3-CB 4.12Å; W512-C548 PolarHBondContact N-SG 2.91Å; W512-C548 VanDerWaalsContact N-SG 3.41Å; W512-Y549 PolarHBondContact NE1-O 3Å; W512-G550 WeakPolarHBondContact CZ2-O 3.38Å; W512-R552 HydrophobicContact CH2-CB 3.65Å; W512-R552 HydrophobicContact CZ2-CB 4.37Å; W512-R552 HydrophobicContact CZ3-CB 4.07Å
513	G	84.6	Confident	79.2	Confident	9 Å²	9	77.7 Å²	77.7	9%	0.093	42%	0.418	C	S	.	.			trans	-64.9	179.4	163.5	0	0	0	0	0	113	R511 E535 D537	R511-G513 PolarHBondContact O-N 3.48Å; G513-E535 PolarHBondContact N-O 3.3Å; G513-D537 WeakPolarHBondContact CA-OD1 3.34Å; G513-D537 PolarHBondContact N-OD1 3.28Å
514	K	86.4	Confident	81.2	Confident	183 Å²	183	76.5 Å²	76.5	80%	0.796	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-64.5	152.7	174.6	-65.6	177.7	-176.6	170.9	0	109.7	G516 R534	K514-G516 PolarHBondContact O-N 3.22Å; K514-R534 WeakPolarHBondContact O-CB 3.24Å
515	W	83.3	Confident	82.8	Confident	70 Å²	70	74.8 Å²	74.8	27%	0.265	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-69.4	129	169.3	-71	101.2	0	0	0	109.8	R534 L551 K554	W515-R534 HydrophobicContact CD2-CB 4.14Å; W515-R534 HydrophobicContact CD2-CG 4.07Å; W515-R534 HydrophobicContact CE3-CB 3.87Å; W515-R534 HydrophobicContact CE3-CG 3.79Å; W515-R534 HydrophobicContact CH2-CG 3.97Å; W515-R534 HydrophobicContact CZ2-CG 4.24Å; W515-R534 HydrophobicContact CZ3-CB 4.28Å; W515-R534 HydrophobicContact CZ3-CG 3.73Å; W515-L551 HydrophobicContact CH2-CB 4.15Å; W515-L551 HydrophobicContact CZ2-CB 4.41Å; W515-K554 VanDerWaalsContact CB-NZ 3.27Å; W515-K554 HydrophobicContact CD2-CD 3.64Å; W515-K554 HydrophobicContact CD2-CG 4.16Å; W515-K554 HydrophobicContact CE3-CB 4.28Å; W515-K554 HydrophobicContact CE3-CD 3.74Å; W515-K554 HydrophobicContact CE3-CG 3.72Å; W515-K554 HydrophobicContact CG-CD 4Å; W515-K554 HydrophobicContact CH2-CB 3.9Å; W515-K554 HydrophobicContact CH2-CG 4.26Å; W515-K554 HydrophobicContact CZ2-CB 4.34Å; W515-K554 HydrophobicContact CZ2-CD 4.47Å; W515-K554 HydrophobicContact CZ3-CB 3.87Å; W515-K554 HydrophobicContact CZ3-CD 4.21Å; W515-K554 HydrophobicContact CZ3-CG 3.79Å
516	G	80	Confident	84.2	Confident	37 Å²	37	68.2 Å²	68.2	38%	0.381	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64	167.4	165.2	0	0	0	0	0	112.1	K514 A532 R533	K514-G516 PolarHBondContact O-N 3.22Å; G516-A532 WeakPolarHBondContact O-CB 3.46Å; G516-R533 PolarHBondContact N-O 3.05Å
517	G	84	Confident	85.3	Confident	68 Å²	68	63.9 Å²	63.9	70%	0.701	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-59.2	158	174.8	0	0	0	0	0	112.8	G519 A532	G517-G519 PolarHBondContact O-N 3.47Å; G517-A532 WeakPolarHBondContact O-CB 3.28Å
518	F	85.6	Confident	86	Confident	60 Å²	60	58.6 Å²	58.6	26%	0.263	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-72.2	122.9	167.5	-78.3	-77.4	0	0	0	108.6	Q530 L531 A532 K554 R556	F518-Q530 HydrophobicContact CB-CB 4.03Å; F518-Q530 HydrophobicContact CD1-CB 3.8Å; F518-Q530 HydrophobicContact CG-CB 4.28Å; F518-L531 WeakPolarHBondContact CA-O 3.42Å; F518-A532 HydrophobicContact CD1-CB 3.74Å; F518-A532 HydrophobicContact CD2-CB 4.44Å; F518-A532 HydrophobicContact CE1-CB 3.87Å; F518-A532 HydrophobicContact CG-CB 4.05Å; F518-A532 HydrophobicContact CZ-CB 4.29Å; F518-K554 HydrophobicContact CE1-CG 4.13Å; F518-K554 HydrophobicContact CZ-CD 4.03Å; F518-K554 HydrophobicContact CZ-CG 4.06Å; F518-R556 HydrophobicContact CD1-CG 3.83Å; F518-R556 VanDerWaalsContact CD2-CZ 3.46Å; F518-R556 HydrophobicContact CE1-CB 4.06Å; F518-R556 HydrophobicContact CE1-CG 3.59Å; F518-R556 HydrophobicContact CE2-CG 4.45Å; F518-R556 HydrophobicContact CG-CG 4.36Å; F518-R556 HydrophobicContact CZ-CB 4.22Å; F518-R556 HydrophobicContact CZ-CG 3.93Å
519	G	83.4	Confident	86.4	Confident	39 Å²	39	56.9 Å²	56.9	40%	0.402	33%	0.333	S	S	.	.			trans	-68.7	-172.5	173.2	0	0	0	0	0	112.6	G517 Q530 L531	G517-G519 PolarHBondContact O-N 3.47Å; G519-Q530 VanDerWaalsContact O-CG 3.31Å; G519-Q530 WeakPolarHBondContact O-CG 3.48Å; G519-Q530 PolarHBondContact O-NE2 2.78Å; G519-L531 PolarHBondContact N-O 3.37Å
520	D	88.6	Confident	86.5	Confident	144 Å²	144	55.1 Å²	55.1	77%	0.77	32%	0.323	S	S	*	.			trans	-59.3	150.8	-178.3	-62.3	-44.6	0	0	0	113.2	S522	D520-S522 PolarHBondContact O-N 3.5Å
521	C	90.5	Very high	86.6	Confident	32 Å²	32	55.5 Å²	55.5	22%	0.216	32%	0.322	C	S	.	.			trans	-71.2	128.9	175.6	-172.9	0	0	0	0	109.8	R523 Q530 C558 N559	C521-R523 PolarHBondContact O-N 3.19Å; C521-R523 PolarHBondContact SG-O 3.15Å; C521-Q530 HydrophobicContact CB-CG 4.1Å; C521-C558 VanDerWaalsContact CA-SG 3.53Å; C521-C558 HydrophobicContact CB-CB 3.8Å; C521-C558 WeakPolarHBondContact CB-SG 3.47Å; C521-C558 WeakPolarHBondContact SG-CB 3.27Å; C521-C558 CovalentContact SG-SG 2Å; C521-C558 PolarHBondContact SG-SG 3.34Å; C521-N559 PolarHBondContact SG-ND2 3.3Å
522	S	89.3	Confident	86.5	Confident	40 Å²	40	47 Å²	47	28%	0.28	29%	0.291	S	S	.	.	S	Bend	trans	-61.8	-17.5	-179.2	64.2	0	0	0	0	115	D520 V529 D631	D520-S522 PolarHBondContact O-N 3.5Å; S522-V529 WeakPolarHBondContact CB-O 3.44Å; S522-V529 PolarHBondContact N-O 3.24Å; S522-V529 PolarHBondContact OG-N 3.31Å; S522-V529 PolarHBondContact OG-O 2.83Å; S522-D631 WeakPolarHBondContact CB-O 3.47Å; S522-D631 PolarHBondContact OG-O 2.93Å
523	R	88.8	Confident	86.2	Confident	28 Å²	28	49 Å²	49	11%	0.106	30%	0.298	C	S	.	.			trans	-142	143.5	-179	-61.9	178.6	63	-152.2	-4.3	110.2	C521 C525 G526 G527 N559 F573 V630 G632	C521-R523 PolarHBondContact O-N 3.19Å; C521-R523 PolarHBondContact SG-O 3.15Å; R523-C525 PolarHBondContact NH2-O 3.14Å; R523-G526 PolarHBondContact NH1-O 3.13Å; R523-G527 WeakPolarHBondContact CD-O 3.34Å; R523-G527 PolarHBondContact NH1-O 3.19Å; R523-N559 WeakPolarHBondContact O-CB 3.46Å; R523-N559 PolarHBondContact O-ND2 2.8Å; R523-F573 HydrophobicContact CG-CE1 3.95Å; R523-F573 HydrophobicContact CG-CZ 4.09Å; R523-V630 HydrophobicContact CG-CG1 4.39Å; R523-G632 PolarHBondContact NH1-O 3.36Å
524	S	88.4	Confident	86.2	Confident	106 Å²	106	50.7 Å²	50.7	74%	0.741	30%	0.302	S	S	*	.	S	Bend	trans	-77.9	-22.4	176.3	51.9	0	0	0	0	113.6	N559	S524-N559 WeakPolarHBondContact O-CB 3.32Å
525	C	87.2	Confident	86	Confident	28 Å²	28	46.3 Å²	46.3	19%	0.189	28%	0.284	C	S	.	.	S	Bend	trans	-154.4	169.5	179.7	62.2	0	0	0	0	111.5	R523 G527 N559 C563	R523-C525 PolarHBondContact NH2-O 3.14Å; C525-G527 VanDerWaalsContact C-N 3.29Å; C525-G527 PolarHBondContact O-N 3.5Å; C525-N559 CarbonylContact C-O 3.59Å; C525-C563 HydrophobicContact CB-CB 3.98Å; C525-C563 WeakPolarHBondContact CB-SG 3.17Å; C525-C563 WeakPolarHBondContact SG-CA 3.45Å; C525-C563 WeakPolarHBondContact SG-CB 3.48Å; C525-C563 CovalentContact SG-SG 2.04Å; C525-C563 PolarHBondContact SG-SG 3.15Å
526	G	83.1	Confident	86.1	Confident	32 Å²	32	43.3 Å²	43.3	33%	0.33	27%	0.273	S	S	.	.	S	Bend	trans	71.5	20	171.8	0	0	0	0	0	114.5	R523 N559 N561 C563	R523-G526 PolarHBondContact NH1-O 3.13Å; G526-N559 PolarHBondContact N-O 2.87Å; G526-N561 WeakPolarHBondContact CA-O 3.46Å; G526-N561 PolarHBondContact N-O 3.16Å; G526-C563 PolarHBondContact N-SG 2.99Å
527	G	87.4	Confident	86.3	Confident	11 Å²	11	45.3 Å²	45.3	11%	0.113	28%	0.275	C	S	.	.			trans	86.1	100.5	179.7	0	0	0	0	0	113.5	R523 C525 N559	R523-G527 WeakPolarHBondContact CD-O 3.34Å; R523-G527 PolarHBondContact NH1-O 3.19Å; C525-G527 VanDerWaalsContact C-N 3.29Å; C525-G527 PolarHBondContact O-N 3.5Å; G527-N559 WeakPolarHBondContact CA-O 3.31Å; G527-N559 PolarHBondContact N-O 3.29Å
528	G	90.1	Very high	86.4	Confident	1 Å²	1	47 Å²	47	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-177.1	170.4	0	0	0	0	0	112.8	S557 C558	G528-S557 WeakPolarHBondContact O-CA 3.23Å; G528-C558 PolarHBondContact N-O 2.95Å; G528-C558 PolarHBondContact O-N 3.37Å
529	V	90.8	Very high	86.5	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.8	-179.2	-174.8	0	0	0	0	109.5	S522 L531 R556 C558 D631 V644 L657	S522-V529 WeakPolarHBondContact CB-O 3.44Å; S522-V529 PolarHBondContact N-O 3.24Å; S522-V529 PolarHBondContact OG-N 3.31Å; S522-V529 PolarHBondContact OG-O 2.83Å; V529-L531 HydrophobicContact CG1-CD2 3.96Å; V529-R556 WeakPolarHBondContact CA-O 3.47Å; V529-C558 VanDerWaalsContact C-SG 3.55Å; V529-C558 PolarHBondContact N-SG 3.09Å; V529-D631 HydrophobicContact CB-CB 3.99Å; V529-D631 HydrophobicContact CG2-CB 4.22Å; V529-V644 HydrophobicContact CG1-CG1 4.09Å; V529-V644 HydrophobicContact CG1-CG2 4.28Å; V529-V644 HydrophobicContact CG2-CG2 4.14Å; V529-L657 HydrophobicContact CG1-CD1 4.03Å; V529-L657 HydrophobicContact CG2-CD1 3.85Å
530	Q	87.9	Confident	86.5	Confident	33 Å²	33	47.8 Å²	47.8	15%	0.154	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.5	166.3	-67.7	-179.2	-62.3	0	0	109.8	F518 G519 C521 Y555 R556 C558	F518-Q530 HydrophobicContact CB-CB 4.03Å; F518-Q530 HydrophobicContact CD1-CB 3.8Å; F518-Q530 HydrophobicContact CG-CB 4.28Å; G519-Q530 VanDerWaalsContact O-CG 3.31Å; G519-Q530 WeakPolarHBondContact O-CG 3.48Å; G519-Q530 PolarHBondContact O-NE2 2.78Å; C521-Q530 HydrophobicContact CB-CG 4.1Å; Q530-Y555 CarbonylContact O-C 3.53Å; Q530-Y555 WeakPolarHBondContact O-CA 3.32Å; Q530-R556 HydrophobicContact CB-CG 4.11Å; Q530-R556 PolarHBondContact N-O 3.48Å; Q530-R556 PolarHBondContact O-N 3.22Å; Q530-R556 VanDerWaalsContact OE1-CZ 3.29Å; Q530-C558 HydrophobicContact CG-CB 3.96Å
531	L	85.6	Confident	86.3	Confident	18 Å²	18	41.2 Å²	41.2	9%	0.094	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.8	179.7	-55	175.8	0	0	0	109.7	F518 G519 V529 I553 K554 V644 Q645	F518-L531 WeakPolarHBondContact CA-O 3.42Å; G519-L531 PolarHBondContact N-O 3.37Å; V529-L531 HydrophobicContact CG1-CD2 3.96Å; L531-I553 HydrophobicContact CB-CG2 4.47Å; L531-I553 HydrophobicContact CD2-CG2 4.2Å; L531-K554 WeakPolarHBondContact CA-O 3.01Å; L531-V644 HydrophobicContact CD2-CG1 4.07Å; L531-Q645 HydrophobicContact CD1-CG 3.93Å; L531-Q645 VanDerWaalsContact CD1-NE2 3.26Å; L531-Q645 HydrophobicContact CD2-CG 4.44Å
532	A	84.6	Confident	85.7	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.008	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.8	168.4	0	0	0	0	0	109	G516 G517 F518 I553 K554	G516-A532 WeakPolarHBondContact O-CB 3.46Å; G517-A532 WeakPolarHBondContact O-CB 3.28Å; F518-A532 HydrophobicContact CD1-CB 3.74Å; F518-A532 HydrophobicContact CD2-CB 4.44Å; F518-A532 HydrophobicContact CE1-CB 3.87Å; F518-A532 HydrophobicContact CG-CB 4.05Å; F518-A532 HydrophobicContact CZ-CB 4.29Å; A532-I553 WeakPolarHBondContact O-CA 3.36Å; A532-K554 HydrophobicContact CB-CD 4.09Å; A532-K554 HydrophobicContact CB-CG 3.6Å; A532-K554 PolarHBondContact N-O 3.48Å; A532-K554 PolarHBondContact O-N 3.43Å
533	R	81.4	Confident	84.9	Confident	85 Å²	85	45.3 Å²	45.3	32%	0.321	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	162	-173.7	-61.1	-178.3	174.5	95.1	-26.1	110.4	K178 G516 R552 I553	K178-R533 VanDerWaalsContact CG-NH2 3.31Å; K178-R533 PolarHBondContact O-NH2 3.28Å; G516-R533 PolarHBondContact N-O 3.05Å; R533-R552 WeakPolarHBondContact CA-O 3.43Å; R533-I553 HydrophobicContact CG-CG1 4.29Å
534	R	83.9	Confident	83.9	Confident	45 Å²	45	46.1 Å²	46.1	17%	0.17	27%	0.266	C	S	.	.			trans	-142.7	153	167.7	61.4	178.2	-179	173.9	1	109.6	W512 K514 W515 L551 R552	W512-R534 VanDerWaalsContact CD1-CZ 3.43Å; W512-R534 VanDerWaalsContact CD1-NH2 3.26Å; W512-R534 HydrophobicContact CD2-CG 4.19Å; W512-R534 HydrophobicContact CE3-CG 3.66Å; W512-R534 HydrophobicContact CZ3-CG 4.18Å; K514-R534 WeakPolarHBondContact O-CB 3.24Å; W515-R534 HydrophobicContact CD2-CB 4.14Å; W515-R534 HydrophobicContact CD2-CG 4.07Å; W515-R534 HydrophobicContact CE3-CB 3.87Å; W515-R534 HydrophobicContact CE3-CG 3.79Å; W515-R534 HydrophobicContact CH2-CG 3.97Å; W515-R534 HydrophobicContact CZ2-CG 4.24Å; W515-R534 HydrophobicContact CZ3-CB 4.28Å; W515-R534 HydrophobicContact CZ3-CG 3.73Å; R534-L551 PolarHBondContact NE-O 3.45Å; R534-L551 PolarHBondContact NH2-O 3.04Å; R534-R552 PolarHBondContact N-O 2.57Å
535	E	81.8	Confident	83.3	Confident	90 Å²	90	41.5 Å²	41.5	42%	0.421	24%	0.236	S	C	.	.			trans	-107.9	162.8	-178.2	-56.1	-153.7	164.9	0	0	111.5	G513 D537	G513-E535 PolarHBondContact N-O 3.3Å; E535-D537 HydrophobicContact CB-CB 4.39Å; E535-D537 PolarHBondContact O-N 3.15Å
536	C	85.4	Confident	83	Confident	7 Å²	7	45.3 Å²	45.3	5%	0.047	25%	0.249	C	C	.	.	S	Bend	trans	-94.4	72.6	178	-172.7	0	0	0	0	109.2	W512 P541 Y547 C548	W512-C536 HydrophobicContact CE3-CB 4.44Å; W512-C536 HydrophobicContact CZ3-CB 4.25Å; C536-P541 WeakPolarHBondContact O-CD 3.42Å; C536-Y547 HydrophobicContact CB-CD2 4.37Å; C536-Y547 HydrophobicContact CB-CE1 3.95Å; C536-Y547 HydrophobicContact CB-CE2 3.71Å; C536-Y547 VanDerWaalsContact CB-CZ 3.45Å; C536-Y547 WeakPolarHBondContact CB-OH 3.28Å; C536-C548 WeakPolarHBondContact CA-SG 3.49Å; C536-C548 HydrophobicContact CB-CB 3.7Å; C536-C548 WeakPolarHBondContact CB-SG 3.4Å; C536-C548 WeakPolarHBondContact SG-CB 3.39Å; C536-C548 PolarHBondContact SG-N 3.31Å; C536-C548 CovalentContact SG-SG 2.02Å; C536-C548 PolarHBondContact SG-SG 3.49Å
537	D	84.9	Confident	83.1	Confident	79 Å²	79	44.8 Å²	44.8	42%	0.422	24%	0.238	S	C	.	.			trans	-131.8	-0.8	-164.9	63.4	-10.5	0	0	0	114.6	R511 G513 E535 P539 V540	R511-D537 PolarHBondContact O-N 2.87Å; G513-D537 WeakPolarHBondContact CA-OD1 3.34Å; G513-D537 PolarHBondContact N-OD1 3.28Å; E535-D537 HydrophobicContact CB-CB 4.39Å; E535-D537 PolarHBondContact O-N 3.15Å; D537-P539 CarbonylContact O-C 3.56Å; D537-P539 WeakPolarHBondContact O-CA 3.29Å; D537-V540 HydrophobicContact CB-CG2 4.07Å; D537-V540 PolarHBondContact O-N 3.2Å
538	N	86.1	Confident	83.1	Confident	103 Å²	103	44.5 Å²	44.5	55%	0.551	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.6	62.5	-173.3	-172.6	38.2	0	0	0	114.3	R511	R511-N538 VanDerWaalsContact CB-O 3.25Å; R511-N538 WeakPolarHBondContact CB-O 3.44Å; R511-N538 PolarHBondContact O-N 2.6Å
539	P	86.8	Confident	82.9	Confident	56 Å²	56	49.4 Å²	49.4	36%	0.364	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.8	166.2	7.9	35.3	-35	0	0	0	113.3	V508 G510 R511 D537	V508-P539 HydrophobicContact CG1-CB 4.09Å; V508-P539 HydrophobicContact CG1-CG 3.62Å; G510-P539 WeakPolarHBondContact CA-O 3.21Å; R511-P539 PolarHBondContact N-O 3.25Å; D537-P539 CarbonylContact O-C 3.56Å; D537-P539 WeakPolarHBondContact O-CA 3.29Å
540	V	82.9	Confident	82.4	Confident	60 Å²	60	49.8 Å²	49.8	36%	0.364	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-65.3	138.4	169.2	-179.4	0	0	0	0	109.2	P247 D537 E542	P247-V540 HydrophobicContact CB-CG1 3.85Å; P247-V540 HydrophobicContact CG-CG1 3.76Å; D537-V540 HydrophobicContact CB-CG2 4.07Å; D537-V540 PolarHBondContact O-N 3.2Å; V540-E542 PolarHBondContact O-N 2.84Å
541	P	84.8	Confident	82	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.039	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-62.2	127.5	173.8	-9.8	15.1	0	0	0	112.1	P247 V508 C536 Y547	P247-P541 HydrophobicContact CB-CG 4.38Å; V508-P541 WeakPolarHBondContact O-CA 3.42Å; C536-P541 WeakPolarHBondContact O-CD 3.42Å; P541-Y547 HydrophobicContact CG-CD2 3.81Å; P541-Y547 HydrophobicContact CG-CE2 4.41Å; P541-Y547 HydrophobicContact CG-CG 4.5Å
542	E	78.1	Confident	81.7	Confident	106 Å²	106	51.4 Å²	51.4	50%	0.495	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-132.1	156.9	178.6	-63.8	-173.6	169.7	0	0	111.9	V508 V540 G544 G545	V508-E542 HydrophobicContact CB-CB 4.12Å; V508-E542 HydrophobicContact CG2-CB 4.4Å; V508-E542 PolarHBondContact N-O 3.17Å; V508-E542 VanDerWaalsContact N-O 3.12Å; V508-E542 PolarHBondContact O-N 3.41Å; V540-E542 PolarHBondContact O-N 2.84Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 2.96Å; E542-G545 WeakPolarHBondContact O-CA 3.39Å; E542-G545 PolarHBondContact O-N 2.94Å
543	N	71.9	Confident	81.6	Confident	53 Å²	53	51.9 Å²	51.9	28%	0.283	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	40.6	171.4	-48.8	-38	0	0	0	114.1	V504 T506 G545	V504-N543 HydrophobicContact CG1-CB 4.47Å; V504-N543 WeakPolarHBondContact CG1-ND2 3.48Å; V504-N543 WeakPolarHBondContact CG1-OD1 3.26Å; T506-N543 PolarHBondContact O-ND2 2.82Å; N543-G545 VanDerWaalsContact C-N 3.33Å
544	G	69.1	Low	81.8	Confident	44 Å²	44	51 Å²	51	45%	0.454	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	18	-176.5	0	0	0	0	0	114	K507 E542	K507-G544 WeakPolarHBondContact CE-O 3.1Å; K507-G544 PolarHBondContact NZ-O 3.05Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 2.96Å
545	G	74.9	Confident	82	Confident	10 Å²	10	51.3 Å²	51.3	10%	0.103	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-47.7	145.3	166.2	0	0	0	0	0	113.5	V508 E542 N543	V508-G545 WeakPolarHBondContact O-CA 3.45Å; E542-G545 WeakPolarHBondContact O-CA 3.39Å; E542-G545 PolarHBondContact O-N 2.94Å; N543-G545 VanDerWaalsContact C-N 3.33Å
546	K	81.2	Confident	82.4	Confident	108 Å²	108	52.6 Å²	52.6	47%	0.47	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-68.5	134.5	169.6	-67	178.5	-178.8	174.5	0	109.2	D509 G510 Y549	D509-K546 HydrophobicContact CB-CB 4.44Å; D509-K546 PolarHBondContact OD1-N 2.98Å; G510-K546 PolarHBondContact N-O 3.06Å; K546-Y549 HydrophobicContact CD-CE2 4.35Å
547	Y	86.4	Confident	82.7	Confident	21 Å²	21	53.5 Å²	53.5	8%	0.082	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-68.9	155.9	168.4	-163.8	-93.7	0	0	0	110.3	L250 C536 P541 Y549	L250-Y547 WeakPolarHBondContact CA-OH 3.43Å; L250-Y547 PolarHBondContact O-OH 3.02Å; C536-Y547 HydrophobicContact CB-CD2 4.37Å; C536-Y547 HydrophobicContact CB-CE1 3.95Å; C536-Y547 HydrophobicContact CB-CE2 3.71Å; C536-Y547 VanDerWaalsContact CB-CZ 3.45Å; C536-Y547 WeakPolarHBondContact CB-OH 3.28Å; P541-Y547 HydrophobicContact CG-CD2 3.81Å; P541-Y547 HydrophobicContact CG-CE2 4.41Å; P541-Y547 HydrophobicContact CG-CG 4.5Å; Y547-Y549 WeakPolarHBondContact O-CD1 3.49Å; Y547-Y549 VanDerWaalsContact O-CE1 3.3Å; Y547-Y549 WeakPolarHBondContact O-CE1 3.45Å
548	C	86	Confident	83	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.027	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-62.6	138.8	-176.5	-61.6	0	0	0	0	112.2	S206 G510 R511 W512 C536	S206-C548 WeakPolarHBondContact CB-O 3.21Å; S206-C548 PolarHBondContact OG-O 3.42Å; G510-C548 PolarHBondContact O-SG 2.98Å; R511-C548 WeakPolarHBondContact CA-SG 3.41Å; R511-C548 PolarHBondContact N-SG 3.08Å; R511-C548 VanDerWaalsContact N-SG 3.41Å; R511-C548 PolarHBondContact O-SG 2.95Å; W512-C548 HydrophobicContact CD2-CB 3.63Å; W512-C548 HydrophobicContact CE3-CB 4.01Å; W512-C548 HydrophobicContact CG-CB 4.15Å; W512-C548 HydrophobicContact CH2-CB 3.87Å; W512-C548 HydrophobicContact CZ2-CB 3.52Å; W512-C548 HydrophobicContact CZ3-CB 4.12Å; W512-C548 PolarHBondContact N-SG 2.91Å; W512-C548 VanDerWaalsContact N-SG 3.41Å; C536-C548 WeakPolarHBondContact CA-SG 3.49Å; C536-C548 HydrophobicContact CB-CB 3.7Å; C536-C548 WeakPolarHBondContact CB-SG 3.4Å; C536-C548 WeakPolarHBondContact SG-CB 3.39Å; C536-C548 PolarHBondContact SG-N 3.31Å; C536-C548 CovalentContact SG-SG 2.02Å; C536-C548 PolarHBondContact SG-SG 3.49Å
549	Y	85.3	Confident	83.3	Confident	104 Å²	104	49.1 Å²	49.1	41%	0.408	25%	0.253	S	S	.	.			trans	-108.8	144.5	174.9	-54.4	-39.6	0	0	0	111.7	S206 P208 W512 K546 Y547	S206-Y549 WeakPolarHBondContact O-CA 3.24Å; P208-Y549 HydrophobicContact CB-CE1 4.08Å; P208-Y549 HydrophobicContact CG-CE1 4.32Å; W512-Y549 PolarHBondContact NE1-O 3Å; K546-Y549 HydrophobicContact CD-CE2 4.35Å; Y547-Y549 WeakPolarHBondContact O-CD1 3.49Å; Y547-Y549 VanDerWaalsContact O-CE1 3.3Å; Y547-Y549 WeakPolarHBondContact O-CE1 3.45Å
550	G	81.3	Confident	83.3	Confident	13 Å²	13	50.2 Å²	50.2	13%	0.134	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	110.9	-171.6	178.4	0	0	0	0	0	113.5	A205 S206 W512 R552	A205-G550 CarbonylContact C-O 3.59Å; A205-G550 WeakPolarHBondContact CA-O 3.33Å; A205-G550 VanDerWaalsContact CB-C 3.48Å; A205-G550 WeakPolarHBondContact CB-O 3.19Å; S206-G550 PolarHBondContact N-O 3.18Å; S206-G550 PolarHBondContact O-N 3.32Å; W512-G550 WeakPolarHBondContact CZ2-O 3.38Å; G550-R552 PolarHBondContact O-N 2.98Å
551	L	79.4	Confident	83.5	Confident	63 Å²	63	53.6 Å²	53.6	33%	0.33	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	126.9	-171.4	-64.6	170.5	0	0	0	111.1	R203 A205 W515 R534	R203-L551 VanDerWaalsContact O-CD2 3.25Å; R203-L551 WeakPolarHBondContact O-CD2 3.47Å; A205-L551 HydrophobicContact CB-CD2 4.34Å; W515-L551 HydrophobicContact CH2-CB 4.15Å; W515-L551 HydrophobicContact CZ2-CB 4.41Å; R534-L551 PolarHBondContact NE-O 3.45Å; R534-L551 PolarHBondContact NH2-O 3.04Å
552	R	79.9	Confident	83.4	Confident	22 Å²	22	57.7 Å²	57.7	8%	0.083	31%	0.306	C	S	.	.	S	Bend	trans	-104.3	-18.5	172.9	56.3	165.3	173.8	-151.6	-6.8	113	F204 N251 T403 D407 W512 R533 R534 G550	F204-R552 WeakPolarHBondContact O-CG 3.39Å; F204-R552 PolarHBondContact O-N 2.59Å; N251-R552 PolarHBondContact OD1-NH1 3.3Å; T403-R552 VanDerWaalsContact CG2-NH2 3.29Å; T403-R552 PolarHBondContact O-NH2 3.14Å; T403-R552 PolarHBondContact OG1-NH1 3.18Å; D407-R552 IonicContact OD1-CZ 2.93Å; D407-R552 IonicContact OD1-NE 3.55Å; D407-R552 IonicContact OD1-NH2 3.34Å; D407-R552 PolarHBondContact OD1-NH2 2.76Å; D407-R552 IonicContact OD2-CZ 3.56Å; D407-R552 IonicContact OD2-NE 3.9Å; D407-R552 PolarHBondContact OD2-NE 3.25Å; D407-R552 IonicContact OD2-NH2 2.73Å; D407-R552 PolarHBondContact OD2-NH2 3.29Å; D407-R552 VanDerWaalsContact OD2-NH2 3.09Å; W512-R552 HydrophobicContact CH2-CB 3.65Å; W512-R552 HydrophobicContact CZ2-CB 4.37Å; W512-R552 HydrophobicContact CZ3-CB 4.07Å; R533-R552 WeakPolarHBondContact CA-O 3.43Å; R534-R552 PolarHBondContact N-O 2.57Å; G550-R552 PolarHBondContact O-N 2.98Å
553	I	82.6	Confident	83.6	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.056	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.5	176.8	-60.3	166.7	0	0	0	107.9	F204 L531 A532 R533	F204-I553 HydrophobicContact CB-CB 3.97Å; F204-I553 HydrophobicContact CB-CD1 4.38Å; F204-I553 PolarHBondContact O-N 3.13Å; L531-I553 HydrophobicContact CB-CG2 4.47Å; L531-I553 HydrophobicContact CD2-CG2 4.2Å; A532-I553 WeakPolarHBondContact O-CA 3.36Å; R533-I553 HydrophobicContact CG-CG1 4.29Å
554	K	85.7	Confident	84.1	Confident	67 Å²	67	56.4 Å²	56.4	29%	0.291	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	152.1	164.4	70	-177.9	177.9	-176	0	109	W515 F518 L531 A532	W515-K554 VanDerWaalsContact CB-NZ 3.27Å; W515-K554 HydrophobicContact CD2-CD 3.64Å; W515-K554 HydrophobicContact CD2-CG 4.16Å; W515-K554 HydrophobicContact CE3-CB 4.28Å; W515-K554 HydrophobicContact CE3-CD 3.74Å; W515-K554 HydrophobicContact CE3-CG 3.72Å; W515-K554 HydrophobicContact CG-CD 4Å; W515-K554 HydrophobicContact CH2-CB 3.9Å; W515-K554 HydrophobicContact CH2-CG 4.26Å; W515-K554 HydrophobicContact CZ2-CB 4.34Å; W515-K554 HydrophobicContact CZ2-CD 4.47Å; W515-K554 HydrophobicContact CZ3-CB 3.87Å; W515-K554 HydrophobicContact CZ3-CD 4.21Å; W515-K554 HydrophobicContact CZ3-CG 3.79Å; F518-K554 HydrophobicContact CE1-CG 4.13Å; F518-K554 HydrophobicContact CZ-CD 4.03Å; F518-K554 HydrophobicContact CZ-CG 4.06Å; L531-K554 WeakPolarHBondContact CA-O 3.01Å; A532-K554 HydrophobicContact CB-CD 4.09Å; A532-K554 HydrophobicContact CB-CG 3.6Å; A532-K554 PolarHBondContact N-O 3.48Å; A532-K554 PolarHBondContact O-N 3.43Å
555	Y	88.3	Confident	83.9	Confident	51 Å²	51	62.7 Å²	62.7	20%	0.2	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	156.4	-177.9	51.8	-100.8	0	0	0	110.6	F204 Q530 V644 I649 L657	F204-Y555 HydrophobicContact CD2-CD1 4.33Å; F204-Y555 AromaticContact CD2-CE1 3.95Å; F204-Y555 HydrophobicContact CD2-CE1 3.95Å; F204-Y555 HydrophobicContact CE2-CD1 4.41Å; F204-Y555 AromaticContact CE2-CE1 3.99Å; F204-Y555 HydrophobicContact CE2-CE1 3.99Å; Q530-Y555 CarbonylContact O-C 3.53Å; Q530-Y555 WeakPolarHBondContact O-CA 3.32Å; Y555-V644 HydrophobicContact CD1-CG1 4.08Å; Y555-V644 HydrophobicContact CG-CG1 4.09Å; Y555-I649 HydrophobicContact CE2-CG2 4.16Å; Y555-L657 HydrophobicContact CD2-CB 4.37Å; Y555-L657 HydrophobicContact CD2-CD1 3.87Å; Y555-L657 HydrophobicContact CD2-CD2 4.3Å; Y555-L657 HydrophobicContact CD2-CG 4.42Å; Y555-L657 HydrophobicContact CE2-CB 4.38Å; Y555-L657 HydrophobicContact CE2-CD1 4.43Å; Y555-L657 HydrophobicContact CE2-CD2 4.04Å
556	R	88.7	Confident	83	Confident	117 Å²	117	68.4 Å²	68.4	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.1	171.4	70.2	179.6	-174.7	-172.9	0.5	110.6	F518 V529 Q530	F518-R556 HydrophobicContact CD1-CG 3.83Å; F518-R556 VanDerWaalsContact CD2-CZ 3.46Å; F518-R556 HydrophobicContact CE1-CB 4.06Å; F518-R556 HydrophobicContact CE1-CG 3.59Å; F518-R556 HydrophobicContact CE2-CG 4.45Å; F518-R556 HydrophobicContact CG-CG 4.36Å; F518-R556 HydrophobicContact CZ-CB 4.22Å; F518-R556 HydrophobicContact CZ-CG 3.93Å; V529-R556 WeakPolarHBondContact CA-O 3.47Å; Q530-R556 HydrophobicContact CB-CG 4.11Å; Q530-R556 PolarHBondContact N-O 3.48Å; Q530-R556 PolarHBondContact O-N 3.22Å; Q530-R556 VanDerWaalsContact OE1-CZ 3.29Å
557	S	91.6	Very high	81.8	Confident	26 Å²	26	68.4 Å²	68.4	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	149.3	171.3	-63.3	0	0	0	0	111.8	G528 G655 L657	G528-S557 WeakPolarHBondContact O-CA 3.23Å; S557-G655 PolarHBondContact OG-O 2.96Å; S557-L657 WeakPolarHBondContact OG-CB 3.43Å; S557-L657 PolarHBondContact OG-N 3.1Å
558	C	92.5	Very high	80.2	Confident	15 Å²	15	69.7 Å²	69.7	10%	0.101	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	163	174.4	51.8	0	0	0	0	109.8	C521 G528 V529 Q530 L560	C521-C558 VanDerWaalsContact CA-SG 3.53Å; C521-C558 HydrophobicContact CB-CB 3.8Å; C521-C558 WeakPolarHBondContact CB-SG 3.47Å; C521-C558 WeakPolarHBondContact SG-CB 3.27Å; C521-C558 CovalentContact SG-SG 2Å; C521-C558 PolarHBondContact SG-SG 3.34Å; G528-C558 PolarHBondContact N-O 2.95Å; G528-C558 PolarHBondContact O-N 3.37Å; V529-C558 VanDerWaalsContact C-SG 3.55Å; V529-C558 PolarHBondContact N-SG 3.09Å; Q530-C558 HydrophobicContact CG-CB 3.96Å; C558-L560 PolarHBondContact O-N 2.97Å
559	N	91.1	Very high	78.5	Confident	74 Å²	74	75 Å²	75	40%	0.396	41%	0.413	S	S	.	.			trans	48.1	53	174.1	-62	-15.2	0	0	0	114.2	C521 R523 S524 C525 G526 G527 N561	C521-N559 PolarHBondContact SG-ND2 3.3Å; R523-N559 WeakPolarHBondContact O-CB 3.46Å; R523-N559 PolarHBondContact O-ND2 2.8Å; S524-N559 WeakPolarHBondContact O-CB 3.32Å; C525-N559 CarbonylContact C-O 3.59Å; G526-N559 PolarHBondContact N-O 2.87Å; G527-N559 WeakPolarHBondContact CA-O 3.31Å; G527-N559 PolarHBondContact N-O 3.29Å; N559-N561 VanDerWaalsContact C-N 3.25Å; N559-N561 PolarHBondContact O-N 3Å
560	L	87.3	Confident	77.2	Confident	79 Å²	79	74 Å²	74	41%	0.414	44%	0.436	S	S	.	.			trans	-72.6	-13.6	-174.8	-66.8	178.4	0	0	0	114.4	C558 G655	C558-L560 PolarHBondContact O-N 2.97Å; L560-G655 WeakPolarHBondContact CD2-O 3.48Å
561	N	87.7	Confident	76.5	Confident	132 Å²	132	77.9 Å²	77.9	71%	0.706	45%	0.449	S	S	*	.	S	Bend	trans	-61.2	140.6	-179.8	-60.4	-25.5	0	0	0	110.5	G526 N559	G526-N561 WeakPolarHBondContact CA-O 3.46Å; G526-N561 PolarHBondContact N-O 3.16Å; N559-N561 VanDerWaalsContact C-N 3.25Å; N559-N561 PolarHBondContact O-N 3Å
562	A	83.1	Confident	76.5	Confident	92 Å²	92	77.3 Å²	77.3	76%	0.76	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-57.3	144.5	177.5	0	0	0	0	0	111.1
563	C	82.7	Confident	76.8	Confident	56 Å²	56	78.9 Å²	78.9	38%	0.378	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-70.6	141.3	174.8	-67.7	0	0	0	0	110.2	C525 G526 E565	C525-C563 HydrophobicContact CB-CB 3.98Å; C525-C563 WeakPolarHBondContact CB-SG 3.17Å; C525-C563 WeakPolarHBondContact SG-CA 3.45Å; C525-C563 WeakPolarHBondContact SG-CB 3.48Å; C525-C563 CovalentContact SG-SG 2.04Å; C525-C563 PolarHBondContact SG-SG 3.15Å; G526-C563 PolarHBondContact N-SG 2.99Å; C563-E565 PolarHBondContact O-N 3.29Å
564	P	81.1	Confident	77	Confident	75 Å²	75	78.6 Å²	78.6	49%	0.487	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-59.5	135.3	176.8	-19.9	30.7	0	0	0	111.6	T566 V567	P564-T566 PolarHBondContact O-N 2.81Å; P564-T566 VanDerWaalsContact O-N 3.09Å; P564-V567 HydrophobicContact CB-CG2 4.36Å; P564-V567 PolarHBondContact O-N 2.97Å
565	E	65.3	Low	77.1	Confident	176 Å²	176	76.6 Å²	76.6	82%	0.822	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-13.3	177.7	-65.3	-169.3	162.2	0	0	113.4	C563	C563-E565 PolarHBondContact O-N 3.29Å
566	T	55.4	Low	77.1	Confident	131 Å²	131	77 Å²	77	80%	0.804	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.2	179.9	52.5	0	0	0	0	114.3	P564	P564-T566 PolarHBondContact O-N 2.81Å; P564-T566 VanDerWaalsContact O-N 3.09Å
567	V	56.7	Low	77.1	Confident	108 Å²	108	72.5 Å²	72.5	66%	0.655	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-32.9	-175.9	-177.9	0	0	0	0	112	P564	P564-V567 HydrophobicContact CB-CG2 4.36Å; P564-V567 PolarHBondContact O-N 2.97Å
568	T	52.8	Low	76.9	Confident	48 Å²	48	71.3 Å²	71.3	29%	0.294	42%	0.419	S	S	.	.	S	Bend	trans	-162.6	99.7	175.3	17.9	0	0	0	0	110.7	G570 K571 E576	T568-G570 PolarHBondContact O-N 3.19Å; T568-K571 HydrophobicContact CG2-CD 4.42Å; T568-E576 WeakPolarHBondContact CB-OE1 3.44Å; T568-E576 PolarHBondContact OG1-OE1 3.17Å
569	P	51	Low	76.7	Confident	114 Å²	114	73.4 Å²	73.4	74%	0.74	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	112.9	-177.2	-21.1	31.4	0	0	0	111.8	K571	P569-K571 VanDerWaalsContact C-N 3.33Å; P569-K571 PolarHBondContact O-N 3.3Å
570	G	58.2	Low	76.5	Confident	85 Å²	85	73.8 Å²	73.8	88%	0.876	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	7.4	169.4	0	0	0	0	0	117	T568	T568-G570 PolarHBondContact O-N 3.19Å
571	K	66.7	Low	76.3	Confident	94 Å²	94	73 Å²	73	41%	0.409	43%	0.434	S	S	.	.			trans	-97.6	148.6	176.1	-63.6	-170.3	-176.7	-172.1	0	112.2	T568 P569 E575 E579	T568-K571 HydrophobicContact CG2-CD 4.42Å; P569-K571 VanDerWaalsContact C-N 3.33Å; P569-K571 PolarHBondContact O-N 3.3Å; K571-E575 WeakPolarHBondContact CA-OE2 3.45Å; K571-E579 WeakPolarHBondContact CE-OE1 3.24Å; K571-E579 IonicContact NZ-OE1 2.72Å; K571-E579 PolarHBondContact NZ-OE1 2.86Å; K571-E579 IonicContact NZ-OE2 2.81Å; K571-E579 PolarHBondContact NZ-OE2 3.13Å
572	R	77.8	Confident	76.1	Confident	51 Å²	51	69.9 Å²	69.9	19%	0.192	42%	0.417	C	S	.	.			trans	-98	149.9	178.4	-66.1	167.4	168	-127	8.3	110.5	R574 E575 E576 G748	R572-R574 PolarHBondContact O-N 3.36Å; R572-E575 HydrophobicContact CB-CG 4.3Å; R572-E575 PolarHBondContact N-OE2 3.41Å; R572-E575 WeakPolarHBondContact O-CA 3.42Å; R572-E575 VanDerWaalsContact O-CB 3.27Å; R572-E575 WeakPolarHBondContact O-CB 3.15Å; R572-E575 PolarHBondContact O-N 3.45Å; R572-E576 PolarHBondContact O-N 3.42Å; R572-G748 PolarHBondContact NH2-O 2.9Å
573	F	86.1	Confident	75.6	Confident	54 Å²	54	67.6 Å²	67.6	24%	0.237	40%	0.403	C	S	.	.	H	α-helix	trans	-55.5	-27.3	-178.5	-170.6	-121.2	0	0	0	115.4	R523 E576 Q577 V630 T633	R523-F573 HydrophobicContact CG-CE1 3.95Å; R523-F573 HydrophobicContact CG-CZ 4.09Å; F573-E576 WeakPolarHBondContact CD2-OE2 3.46Å; F573-Q577 WeakPolarHBondContact O-CG 3.23Å; F573-Q577 PolarHBondContact O-N 3.25Å; F573-Q577 PolarHBondContact O-NE2 3.19Å; F573-V630 HydrophobicContact CE1-CB 3.78Å; F573-V630 HydrophobicContact CE1-CG1 3.91Å; F573-V630 HydrophobicContact CZ-CB 4.09Å; F573-V630 HydrophobicContact CZ-CG1 4.02Å; F573-V630 HydrophobicContact CZ-CG2 4.45Å; F573-T633 HydrophobicContact CD1-CG2 4.46Å; F573-T633 WeakPolarHBondContact CD1-OG1 3.33Å; F573-T633 WeakPolarHBondContact CE1-OG1 3.37Å
574	R	88.4	Confident	75	Confident	5 Å²	5	68.9 Å²	68.9	2%	0.019	41%	0.405	C	S	.	.	H	α-helix	trans	-77	-26.9	174.8	-161.4	174.9	-169.6	156.7	-5.2	113.1	R572 C578 P599 Y601 K609 K611 L612 V629 T633 C635	R572-R574 PolarHBondContact O-N 3.36Å; R574-C578 PolarHBondContact O-N 3.31Å; R574-P599 HydrophobicContact CB-CG 4.5Å; R574-P599 HydrophobicContact CG-CB 4.46Å; R574-P599 HydrophobicContact CG-CG 4.38Å; R574-Y601 WeakPolarHBondContact CD-OH 3.41Å; R574-K609 VanDerWaalsContact CZ-O 3.26Å; R574-K609 PolarHBondContact NH1-O 3.12Å; R574-K609 PolarHBondContact NH2-O 3.17Å; R574-K611 PolarHBondContact NH2-O 2.94Å; R574-L612 HydrophobicContact CG-CD1 4.27Å; R574-V629 HydrophobicContact CG-CG1 4.4Å; R574-T633 HydrophobicContact CB-CG2 3.82Å; R574-T633 HydrophobicContact CG-CG2 4.07Å; R574-C635 PolarHBondContact NH1-O 2.88Å
575	E	87.1	Confident	74.1	Confident	25 Å²	25	68.4 Å²	68.4	12%	0.117	40%	0.399	C	S	.	.	H	α-helix	trans	-69.7	-45.1	174.6	-64.6	161.6	-175.6	0	0	109.6	K571 R572 Q577 C578 E579 P599 L745	K571-E575 WeakPolarHBondContact CA-OE2 3.45Å; R572-E575 HydrophobicContact CB-CG 4.3Å; R572-E575 PolarHBondContact N-OE2 3.41Å; R572-E575 WeakPolarHBondContact O-CA 3.42Å; R572-E575 VanDerWaalsContact O-CB 3.27Å; R572-E575 WeakPolarHBondContact O-CB 3.15Å; R572-E575 PolarHBondContact O-N 3.45Å; E575-Q577 VanDerWaalsContact C-N 3.26Å; E575-Q577 PolarHBondContact O-N 3.12Å; E575-C578 PolarHBondContact O-N 3.04Å; E575-E579 WeakPolarHBondContact O-CG 3.38Å; E575-E579 PolarHBondContact O-N 3.26Å; E575-P599 HydrophobicContact CB-CG 4.23Å; E575-P599 HydrophobicContact CG-CG 3.6Å; E575-L745 WeakPolarHBondContact OE1-CD2 3.09Å
576	E	87.3	Confident	74	Confident	59 Å²	59	63 Å²	63	28%	0.276	38%	0.375	S	S	.	.	H	α-helix	trans	-55.2	-42.2	174.1	-65.2	172.7	-179.4	0	0	111.8	T568 R572 F573 C578 E579 A580	T568-E576 WeakPolarHBondContact CB-OE1 3.44Å; T568-E576 PolarHBondContact OG1-OE1 3.17Å; R572-E576 PolarHBondContact O-N 3.42Å; F573-E576 WeakPolarHBondContact CD2-OE2 3.46Å; E576-C578 PolarHBondContact O-N 3.33Å; E576-E579 PolarHBondContact O-N 2.99Å; E576-A580 PolarHBondContact O-N 3.3Å
577	Q	89.4	Confident	73.9	Confident	24 Å²	24	64.8 Å²	64.8	11%	0.112	38%	0.38	C	S	.	.	H	α-helix	trans	-63.3	-37.1	175.5	-74.2	171.3	78.7	0	0	113.1	F573 E575 F581 L612 V629 T633	F573-Q577 WeakPolarHBondContact O-CG 3.23Å; F573-Q577 PolarHBondContact O-N 3.25Å; F573-Q577 PolarHBondContact O-NE2 3.19Å; E575-Q577 VanDerWaalsContact C-N 3.26Å; E575-Q577 PolarHBondContact O-N 3.12Å; Q577-F581 VanDerWaalsContact O-CD2 3.29Å; Q577-F581 WeakPolarHBondContact O-CD2 3.42Å; Q577-L612 HydrophobicContact CB-CD1 3.7Å; Q577-L612 HydrophobicContact CB-CD2 4.11Å; Q577-V629 VanDerWaalsContact OE1-CA 3.32Å; Q577-T633 PolarHBondContact NE2-OG1 3.48Å
578	C	88.4	Confident	73.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-72.8	-40	173.6	-73.6	0	0	0	0	111.4	R574 E575 E576 A580 F581 W597 C614	R574-C578 PolarHBondContact O-N 3.31Å; E575-C578 PolarHBondContact O-N 3.04Å; E576-C578 PolarHBondContact O-N 3.33Å; C578-A580 PolarHBondContact O-N 3.2Å; C578-F581 PolarHBondContact O-N 3.44Å; C578-W597 HydrophobicContact CB-CB 4.15Å; C578-C614 HydrophobicContact CB-CB 3.95Å; C578-C614 WeakPolarHBondContact CB-SG 3.35Å; C578-C614 WeakPolarHBondContact SG-CB 3.3Å; C578-C614 CovalentContact SG-SG 2.04Å; C578-C614 PolarHBondContact SG-SG 3.09Å
579	E	88.2	Confident	73.7	Confident	59 Å²	59	65.9 Å²	65.9	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-28	-178.4	-74.2	-177.5	171.9	0	0	112.8	K571 E575 E576 F581 N582	K571-E579 WeakPolarHBondContact CE-OE1 3.24Å; K571-E579 IonicContact NZ-OE1 2.72Å; K571-E579 PolarHBondContact NZ-OE1 2.86Å; K571-E579 IonicContact NZ-OE2 2.81Å; K571-E579 PolarHBondContact NZ-OE2 3.13Å; E575-E579 WeakPolarHBondContact O-CG 3.38Å; E575-E579 PolarHBondContact O-N 3.26Å; E576-E579 PolarHBondContact O-N 2.99Å; E579-F581 PolarHBondContact O-N 3.16Å; E579-N582 VanDerWaalsContact O-CB 3.28Å; E579-N582 WeakPolarHBondContact O-CB 3.47Å; E579-N582 VanDerWaalsContact O-CG 3.26Å; E579-N582 PolarHBondContact O-N 2.98Å; E579-N582 PolarHBondContact O-ND2 2.75Å
580	A	85.8	Confident	74	Confident	82 Å²	82	71.2 Å²	71.2	68%	0.678	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.8	172.2	0	0	0	0	0	113.7	E576 C578	E576-A580 PolarHBondContact O-N 3.3Å; C578-A580 PolarHBondContact O-N 3.2Å
581	F	83.8	Confident	74.1	Confident	64 Å²	64	68.5 Å²	68.5	28%	0.281	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	8.3	177.9	-63.8	-91.8	0	0	0	113.4	Q577 C578 E579 G583 L584 W597 L612 L625	Q577-F581 VanDerWaalsContact O-CD2 3.29Å; Q577-F581 WeakPolarHBondContact O-CD2 3.42Å; C578-F581 PolarHBondContact O-N 3.44Å; E579-F581 PolarHBondContact O-N 3.16Å; F581-G583 PolarHBondContact O-N 3.02Å; F581-L584 HydrophobicContact CD1-CD2 4.4Å; F581-L584 VanDerWaalsContact O-CB 3.24Å; F581-L584 WeakPolarHBondContact O-CB 3.12Å; F581-L584 PolarHBondContact O-N 3.15Å; F581-L584 VanDerWaalsContact O-N 3.13Å; F581-W597 PolarHBondContact O-NE1 2.81Å; F581-L612 HydrophobicContact CD2-CD2 4.24Å; F581-L612 HydrophobicContact CE2-CD2 3.73Å; F581-L625 HydrophobicContact CB-CD1 3.64Å; F581-L625 HydrophobicContact CD1-CB 4.4Å; F581-L625 HydrophobicContact CD2-CB 4.15Å; F581-L625 HydrophobicContact CD2-CD1 4.02Å; F581-L625 HydrophobicContact CE1-CB 4.49Å; F581-L625 HydrophobicContact CE2-CB 4.27Å; F581-L625 HydrophobicContact CG-CB 4.22Å; F581-L625 HydrophobicContact CG-CD1 3.85Å; F581-L625 HydrophobicContact CZ-CB 4.43Å
582	N	83.9	Confident	73.8	Confident	65 Å²	65	66.7 Å²	66.7	35%	0.348	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	138.3	174.6	-73.5	-16.9	0	0	0	110.6	E579 L584 W597	E579-N582 VanDerWaalsContact O-CB 3.28Å; E579-N582 WeakPolarHBondContact O-CB 3.47Å; E579-N582 VanDerWaalsContact O-CG 3.26Å; E579-N582 PolarHBondContact O-N 2.98Å; E579-N582 PolarHBondContact O-ND2 2.75Å; N582-L584 VanDerWaalsContact C-N 3.27Å; N582-L584 PolarHBondContact O-N 2.98Å; N582-W597 PolarHBondContact OD1-N 3.11Å
583	G	71.7	Confident	72.9	Confident	44 Å²	44	69.5 Å²	69.5	45%	0.454	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-8.3	-175.1	0	0	0	0	0	115.4	F581 N585 V595	F581-G583 PolarHBondContact O-N 3.02Å; G583-N585 PolarHBondContact O-N 3.11Å; G583-V595 PolarHBondContact N-O 3.36Å
584	L	69.4	Low	72	Confident	84 Å²	84	71.9 Å²	71.9	44%	0.44	42%	0.422	S	S	.	.			trans	-78	108.3	173.5	-161.6	97.6	0	0	0	110.6	F581 N582 L586	F581-L584 HydrophobicContact CD1-CD2 4.4Å; F581-L584 VanDerWaalsContact O-CB 3.24Å; F581-L584 WeakPolarHBondContact O-CB 3.12Å; F581-L584 PolarHBondContact O-N 3.15Å; F581-L584 VanDerWaalsContact O-N 3.13Å; N582-L584 VanDerWaalsContact C-N 3.27Å; N582-L584 PolarHBondContact O-N 2.98Å; L584-L586 HydrophobicContact CD2-CD2 3.73Å; L584-L586 HydrophobicContact CD2-CG 4.3Å
585	N	63.2	Low	71.5	Confident	64 Å²	64	72.2 Å²	72.2	34%	0.342	42%	0.424	S	S	.	.			trans	-89.6	111.9	171.8	-65.8	-44.8	0	0	0	109.1	G583 N587 G592 V595	G583-N585 PolarHBondContact O-N 3.11Å; N585-N587 PolarHBondContact O-N 3.43Å; N585-G592 PolarHBondContact OD1-O 3Å; N585-V595 WeakPolarHBondContact OD1-CG2 3.28Å
586	L	61.8	Low	71.4	Confident	63 Å²	63	73.9 Å²	73.9	33%	0.33	44%	0.436	S	S	.	.			trans	-72.9	48.1	178.7	-66.6	166.7	0	0	0	112.3	L584 T588 W597 S623 L625	L584-L586 HydrophobicContact CD2-CD2 3.73Å; L584-L586 HydrophobicContact CD2-CG 4.3Å; L586-T588 PolarHBondContact O-N 2.85Å; L586-T588 PolarHBondContact O-OG1 2.99Å; L586-W597 HydrophobicContact CD1-CH2 4.22Å; L586-W597 HydrophobicContact CD1-CZ2 4.2Å; L586-S623 WeakPolarHBondContact CD1-OG 3.3Å; L586-L625 HydrophobicContact CD1-CD2 4.09Å
587	N	53.4	Low	71.3	Confident	168 Å²	168	71.1 Å²	71.1	90%	0.898	42%	0.423	S	S	*	.	S	Bend	trans	46.3	37.1	178.9	-69.8	-19.9	0	0	0	114.7	N585	N585-N587 PolarHBondContact O-N 3.43Å
588	T	53.1	Low	71.2	Confident	44 Å²	44	72 Å²	72	27%	0.27	43%	0.428	S	S	.	.			trans	-113.7	120	179.5	-46.9	0	0	0	0	109.3	L586 R590 L591	L586-T588 PolarHBondContact O-N 2.85Å; L586-T588 PolarHBondContact O-OG1 2.99Å; T588-R590 HydrophobicContact CG2-CB 4.21Å; T588-R590 HydrophobicContact CG2-CG 4.32Å; T588-R590 PolarHBondContact O-N 2.94Å; T588-L591 PolarHBondContact O-N 3.22Å
589	S	53.3	Low	71.3	Confident	135 Å²	135	72.7 Å²	72.7	94%	0.944	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	5.4	-178.2	-17.1	0	0	0	0	115.2
590	R	56.8	Low	71.2	Confident	226 Å²	226	72 Å²	72	85%	0.853	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-3.9	-176.2	-60	-174	-173.5	-178.9	2.7	113.7	T588	T588-R590 HydrophobicContact CG2-CB 4.21Å; T588-R590 HydrophobicContact CG2-CG 4.32Å; T588-R590 PolarHBondContact O-N 2.94Å
591	L	60.3	Low	71.1	Confident	29 Å²	29	69.4 Å²	69.4	15%	0.152	40%	0.402	C	S	.	.	S	Bend	trans	-117.8	130.9	-177.7	-75.4	150.9	0	0	0	109.5	T588 V595 A616 Y621	T588-L591 PolarHBondContact O-N 3.22Å; L591-V595 HydrophobicContact CB-CG2 3.82Å; L591-V595 HydrophobicContact CD2-CG1 4.14Å; L591-V595 HydrophobicContact CD2-CG2 3.74Å; L591-V595 HydrophobicContact CG-CG2 4.29Å; L591-A616 HydrophobicContact CD2-CB 3.73Å; L591-Y621 HydrophobicContact CD1-CD1 3.67Å; L591-Y621 HydrophobicContact CD1-CE1 3.61Å; L591-Y621 HydrophobicContact CD1-CG 4.23Å; L591-Y621 HydrophobicContact CD2-CD1 4.4Å
592	G	60.3	Low	71	Confident	56 Å²	56	67 Å²	67	58%	0.577	39%	0.393	S	S	*	.			trans	-72.1	165.1	176.6	0	0	0	0	0	112.1	N585 S594 V595	N585-G592 PolarHBondContact OD1-O 3Å; G592-S594 PolarHBondContact O-N 3.43Å; G592-V595 WeakPolarHBondContact O-CG2 3.45Å
593	S	59.3	Low	70.5	Confident	109 Å²	109	67.2 Å²	67.2	76%	0.762	41%	0.41	S	S	*	.	S	Bend	trans	-64	-6.2	-172.9	46.4	0	0	0	0	116.3
594	S	66.4	Low	71	Confident	105 Å²	105	66.2 Å²	66.2	73%	0.734	39%	0.394	S	S	*	.			trans	-130	73.5	178.4	-168.8	0	0	0	0	111.2	G592	G592-S594 PolarHBondContact O-N 3.43Å
595	V	78.3	Confident	71.5	Confident	11 Å²	11	64.5 Å²	64.5	7%	0.067	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-81.1	127	175.5	-175.7	0	0	0	0	110.2	G583 N585 L591 G592 W597 A616	G583-V595 PolarHBondContact N-O 3.36Å; N585-V595 WeakPolarHBondContact OD1-CG2 3.28Å; L591-V595 HydrophobicContact CB-CG2 3.82Å; L591-V595 HydrophobicContact CD2-CG1 4.14Å; L591-V595 HydrophobicContact CD2-CG2 3.74Å; L591-V595 HydrophobicContact CG-CG2 4.29Å; G592-V595 WeakPolarHBondContact O-CG2 3.45Å; V595-W597 HydrophobicContact CG1-CD2 4.07Å; V595-W597 HydrophobicContact CG1-CG 4.41Å; V595-W597 HydrophobicContact CG1-CZ2 4Å; V595-A616 HydrophobicContact CG1-CB 3.56Å
596	V	84.9	Confident	72.3	Confident	61 Å²	61	66.3 Å²	66.3	37%	0.37	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-99.9	117.5	170	-179.9	0	0	0	0	109.1	N617	V596-N617 HydrophobicContact CB-CB 4.08Å; V596-N617 HydrophobicContact CG1-CB 4.34Å; V596-N617 WeakPolarHBondContact O-CB 3.3Å; V596-N617 PolarHBondContact O-N 3.01Å
597	W	86.1	Confident	72.9	Confident	1 Å²	1	70.7 Å²	70.7	0%	0.004	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130.2	-179.6	-67.5	104.2	0	0	0	111.5	C578 F581 N582 L586 V595 C614 A616 Y621 L625	C578-W597 HydrophobicContact CB-CB 4.15Å; F581-W597 PolarHBondContact O-NE1 2.81Å; N582-W597 PolarHBondContact OD1-N 3.11Å; L586-W597 HydrophobicContact CD1-CH2 4.22Å; L586-W597 HydrophobicContact CD1-CZ2 4.2Å; V595-W597 HydrophobicContact CG1-CD2 4.07Å; V595-W597 HydrophobicContact CG1-CG 4.41Å; V595-W597 HydrophobicContact CG1-CZ2 4Å; W597-C614 HydrophobicContact CB-CB 4.06Å; W597-C614 HydrophobicContact CD2-CB 4.41Å; W597-C614 HydrophobicContact CE3-CB 3.83Å; W597-C614 WeakPolarHBondContact CZ3-O 3.25Å; W597-A616 HydrophobicContact CE3-CB 4.46Å; W597-A616 HydrophobicContact CZ3-CB 4.28Å; W597-Y621 HydrophobicContact CH2-CD1 4.01Å; W597-Y621 AromaticContact CH2-CE1 3.92Å; W597-Y621 HydrophobicContact CH2-CE1 3.92Å; W597-Y621 HydrophobicContact CZ3-CD1 4.38Å; W597-L625 HydrophobicContact CB-CD1 4.27Å; W597-L625 HydrophobicContact CD2-CD1 3.92Å; W597-L625 HydrophobicContact CE3-CD1 4.26Å; W597-L625 HydrophobicContact CG-CD1 3.92Å; W597-L625 HydrophobicContact CH2-CD2 4.46Å; W597-L625 HydrophobicContact CZ2-CD2 4.37Å
598	I	87.4	Confident	74.3	Confident	41 Å²	41	65.9 Å²	65.9	21%	0.21	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	147.5	176.2	59.5	178.8	0	0	0	110.6	K600 C614 R615 N617	I598-K600 PolarHBondContact O-N 2.99Å; I598-C614 CarbonylContact O-C 3.55Å; I598-C614 VanDerWaalsContact O-CA 3.31Å; I598-C614 WeakPolarHBondContact O-CA 3.23Å; I598-R615 HydrophobicContact CD1-CG 4.01Å; I598-R615 VanDerWaalsContact CD1-NE 3.27Å; I598-R615 HydrophobicContact CG1-CG 3.45Å; I598-R615 VanDerWaalsContact CG1-CG 3.45Å; I598-R615 WeakPolarHBondContact CG1-O 3.31Å; I598-R615 PolarHBondContact N-O 3.44Å; I598-R615 PolarHBondContact O-N 3.16Å; I598-N617 HydrophobicContact CD1-CB 4.36Å
599	P	88.9	Confident	75.9	Confident	16 Å²	16	66.7 Å²	66.7	10%	0.104	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	139.8	-179.6	-24.4	34.2	0	0	0	112.6	R574 E575 Y601	R574-P599 HydrophobicContact CB-CG 4.5Å; R574-P599 HydrophobicContact CG-CB 4.46Å; R574-P599 HydrophobicContact CG-CG 4.38Å; E575-P599 HydrophobicContact CB-CG 4.23Å; E575-P599 HydrophobicContact CG-CG 3.6Å; P599-Y601 HydrophobicContact CB-CD2 4.47Å; P599-Y601 HydrophobicContact CB-CE2 3.69Å
600	K	87.3	Confident	77.7	Confident	43 Å²	43	60.3 Å²	60.3	19%	0.187	35%	0.348	C	S	.	.			trans	-104.9	134.1	169.3	-175.7	-178.6	169.7	71.9	0	108.2	I598 S602 I604 I613 F622	I598-K600 PolarHBondContact O-N 2.99Å; K600-S602 VanDerWaalsContact CE-O 3.28Å; K600-S602 WeakPolarHBondContact CE-O 3.4Å; K600-S602 PolarHBondContact NZ-O 3.44Å; K600-I604 HydrophobicContact CB-CD1 4.26Å; K600-I604 HydrophobicContact CG-CD1 4.17Å; K600-I604 WeakPolarHBondContact O-CD1 3.39Å; K600-I613 HydrophobicContact CB-CG2 4.2Å; K600-I613 HydrophobicContact CD-CG2 4.17Å; K600-I613 PolarHBondContact N-O 2.83Å; K600-F622 HydrophobicContact CD-CB 3.86Å; K600-F622 HydrophobicContact CD-CD1 4.38Å; K600-F622 HydrophobicContact CD-CD2 4.11Å; K600-F622 HydrophobicContact CD-CG 3.86Å
601	Y	84.2	Confident	79.1	Confident	29 Å²	29	51.9 Å²	51.9	11%	0.114	32%	0.317	C	S	.	.			trans	-121.9	-33.4	173.4	-56.1	-82.3	0	0	0	112	R574 P599 P637 D743	R574-Y601 WeakPolarHBondContact CD-OH 3.41Å; P599-Y601 HydrophobicContact CB-CD2 4.47Å; P599-Y601 HydrophobicContact CB-CE2 3.69Å; Y601-P637 HydrophobicContact CD2-CG 4.04Å; Y601-P637 VanDerWaalsContact CE1-CD 3.5Å; Y601-P637 HydrophobicContact CE1-CG 4.21Å; Y601-P637 HydrophobicContact CE2-CG 3.64Å; Y601-P637 HydrophobicContact CG-CG 4.48Å; Y601-D743 WeakPolarHBondContact CB-OD2 3.21Å
602	S	80.1	Confident	80.4	Confident	14 Å²	14	50.6 Å²	50.6	10%	0.098	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	143.2	176.9	64.4	0	0	0	0	113.7	K600 I604 D743	K600-S602 VanDerWaalsContact CE-O 3.28Å; K600-S602 WeakPolarHBondContact CE-O 3.4Å; K600-S602 PolarHBondContact NZ-O 3.44Å; S602-I604 PolarHBondContact O-N 3.28Å; S602-D743 WeakPolarHBondContact CB-OD2 3.27Å; S602-D743 PolarHBondContact N-OD2 3.48Å
603	G	75.1	Confident	81.8	Confident	68 Å²	68	48.4 Å²	48.4	70%	0.701	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	16.8	-179	0	0	0	0	0	115.6	E741	G603-E741 PolarHBondContact N-OE2 2.95Å
604	I	82.2	Confident	83.2	Confident	24 Å²	24	43.2 Å²	43.2	12%	0.123	25%	0.249	C	C	.	.			trans	-98.7	129.8	177.7	-64.3	170.5	0	0	0	110.1	K600 S602 E608 K609 I613	K600-I604 HydrophobicContact CB-CD1 4.26Å; K600-I604 HydrophobicContact CG-CD1 4.17Å; K600-I604 WeakPolarHBondContact O-CD1 3.39Å; S602-I604 PolarHBondContact O-N 3.28Å; I604-E608 HydrophobicContact CG2-CB 3.87Å; I604-K609 HydrophobicContact CG2-CG 4.28Å; I604-I613 HydrophobicContact CD1-CB 3.89Å; I604-I613 HydrophobicContact CD1-CD1 3.84Å; I604-I613 HydrophobicContact CD1-CG1 4.32Å; I604-I613 HydrophobicContact CD1-CG2 4.09Å; I604-I613 HydrophobicContact CG1-CD1 3.99Å; I604-I613 HydrophobicContact CG2-CD1 3.96Å
605	S	79.1	Confident	84.2	Confident	47 Å²	47	42.2 Å²	42.2	33%	0.329	23%	0.23	S	C	.	.			trans	-60.9	145.9	177.8	74.4	0	0	0	0	111.3	K607 E608 K609	S605-K607 PolarHBondContact O-N 3.06Å; S605-K607 VanDerWaalsContact O-N 3.08Å; S605-E608 PolarHBondContact O-N 3.06Å; S605-E608 WeakPolarHBondContact OG-CB 3.4Å; S605-E608 WeakPolarHBondContact OG-CG 3.48Å; S605-E608 PolarHBondContact OG-OE2 3.41Å; S605-K609 PolarHBondContact O-N 2.92Å
606	P	80.1	Confident	84.5	Confident	102 Å²	102	41.8 Å²	41.8	66%	0.662	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.3	179.5	-27.9	35.2	0	0	0	114.6	E608	P606-E608 VanDerWaalsContact C-N 3.31Å
607	K	74.6	Confident	84.3	Confident	155 Å²	155	43.7 Å²	43.7	67%	0.674	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.1	177.4	-65.9	-168.2	178.9	-168.4	0	112.5	D412 S605	D412-K607 IonicContact OD2-NZ 2.86Å; D412-K607 PolarHBondContact OD2-NZ 3.48Å; S605-K607 PolarHBondContact O-N 3.06Å; S605-K607 VanDerWaalsContact O-N 3.08Å
608	E	81.9	Confident	83.7	Confident	68 Å²	68	47.6 Å²	47.6	32%	0.318	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-0.5	-174.3	-64.8	-179.3	126.2	0	0	114	I604 S605 P606 C610 K611 I613	I604-E608 HydrophobicContact CG2-CB 3.87Å; S605-E608 PolarHBondContact O-N 3.06Å; S605-E608 WeakPolarHBondContact OG-CB 3.4Å; S605-E608 WeakPolarHBondContact OG-CG 3.48Å; S605-E608 PolarHBondContact OG-OE2 3.41Å; P606-E608 VanDerWaalsContact C-N 3.31Å; E608-C610 PolarHBondContact O-N 3.38Å; E608-K611 HydrophobicContact CB-CD 4.06Å; E608-K611 HydrophobicContact CB-CG 4.43Å; E608-K611 HydrophobicContact CG-CD 4.05Å; E608-K611 WeakPolarHBondContact O-CB 3.46Å; E608-K611 PolarHBondContact O-N 2.96Å; E608-K611 IonicContact OE1-NZ 3.77Å; E608-K611 PolarHBondContact OE1-NZ 2.69Å; E608-I613 HydrophobicContact CB-CD1 4.47Å
609	K	87.7	Confident	83	Confident	61 Å²	61	48.8 Å²	48.8	27%	0.265	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-16.4	-179.8	-73.6	-172.2	176.8	-171.1	0	114.8	R574 I604 S605	R574-K609 VanDerWaalsContact CZ-O 3.26Å; R574-K609 PolarHBondContact NH1-O 3.12Å; R574-K609 PolarHBondContact NH2-O 3.17Å; I604-K609 HydrophobicContact CG2-CG 4.28Å; S605-K609 PolarHBondContact O-N 2.92Å
610	C	90.5	Very high	82.1	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.007	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	10.9	177.7	-69.1	0	0	0	0	114	E608 K628 V629 C643 G646 C648	E608-C610 PolarHBondContact O-N 3.38Å; C610-K628 CarbonylContact O-C 3.45Å; C610-K628 WeakPolarHBondContact O-CA 3Å; C610-V629 HydrophobicContact CB-CG2 4.39Å; C610-V629 PolarHBondContact O-N 2.88Å; C610-C643 WeakPolarHBondContact CA-SG 3.28Å; C610-C643 HydrophobicContact CB-CB 3.71Å; C610-C643 WeakPolarHBondContact CB-SG 3.37Å; C610-C643 WeakPolarHBondContact SG-CA 3.3Å; C610-C643 WeakPolarHBondContact SG-CB 3.37Å; C610-C643 CovalentContact SG-SG 2.04Å; C610-C643 PolarHBondContact SG-SG 3.33Å; C610-G646 VanDerWaalsContact CB-C 3.46Å; C610-G646 VanDerWaalsContact CB-O 3.28Å; C610-G646 WeakPolarHBondContact CB-O 3.45Å; C610-C648 PolarHBondContact SG-N 3Å; C610-C648 VanDerWaalsContact SG-N 3.41Å
611	K	87.1	Confident	81.6	Confident	48 Å²	48	53.4 Å²	53.4	21%	0.209	32%	0.323	C	S	.	.	S	Bend	trans	-81.1	151.7	162.4	-61.1	-176.9	178.1	174.7	0	109.8	R574 E608 I613 V624	R574-K611 PolarHBondContact NH2-O 2.94Å; E608-K611 HydrophobicContact CB-CD 4.06Å; E608-K611 HydrophobicContact CB-CG 4.43Å; E608-K611 HydrophobicContact CG-CD 4.05Å; E608-K611 WeakPolarHBondContact O-CB 3.46Å; E608-K611 PolarHBondContact O-N 2.96Å; E608-K611 IonicContact OE1-NZ 3.77Å; E608-K611 PolarHBondContact OE1-NZ 2.69Å; K611-I613 HydrophobicContact CB-CD1 4.28Å; K611-I613 HydrophobicContact CB-CG1 3.96Å; K611-I613 PolarHBondContact O-N 2.87Å; K611-V624 HydrophobicContact CB-CG1 4.22Å; K611-V624 HydrophobicContact CD-CG1 4.36Å
612	L	87.3	Confident	81.6	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	85.4	174.9	-173.7	66.3	0	0	0	109.6	R574 Q577 F581 L625 S626 V629	R574-L612 HydrophobicContact CG-CD1 4.27Å; Q577-L612 HydrophobicContact CB-CD1 3.7Å; Q577-L612 HydrophobicContact CB-CD2 4.11Å; F581-L612 HydrophobicContact CD2-CD2 4.24Å; F581-L612 HydrophobicContact CE2-CD2 3.73Å; L612-L625 HydrophobicContact CD2-CB 4.2Å; L612-L625 HydrophobicContact CG-CB 4.47Å; L612-L625 PolarHBondContact O-N 3.03Å; L612-S626 PolarHBondContact N-O 3.4Å; L612-V629 HydrophobicContact CB-CG1 4.08Å; L612-V629 HydrophobicContact CD1-CG1 4.01Å
613	I	89.2	Confident	81.6	Confident	9 Å²	9	58 Å²	58	5%	0.046	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.3	178.5	-51.9	-176.9	0	0	0	108.8	K600 I604 E608 K611 F622 V624	K600-I613 HydrophobicContact CB-CG2 4.2Å; K600-I613 HydrophobicContact CD-CG2 4.17Å; K600-I613 PolarHBondContact N-O 2.83Å; I604-I613 HydrophobicContact CD1-CB 3.89Å; I604-I613 HydrophobicContact CD1-CD1 3.84Å; I604-I613 HydrophobicContact CD1-CG1 4.32Å; I604-I613 HydrophobicContact CD1-CG2 4.09Å; I604-I613 HydrophobicContact CG1-CD1 3.99Å; I604-I613 HydrophobicContact CG2-CD1 3.96Å; E608-I613 HydrophobicContact CB-CD1 4.47Å; K611-I613 HydrophobicContact CB-CD1 4.28Å; K611-I613 HydrophobicContact CB-CG1 3.96Å; K611-I613 PolarHBondContact O-N 2.87Å; I613-F622 HydrophobicContact CG2-CD2 4.16Å; I613-V624 HydrophobicContact CD1-CG2 4.49Å; I613-V624 HydrophobicContact CG1-CG2 4.17Å
614	C	88.6	Confident	82	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.1	-177.1	-49.8	0	0	0	0	109.8	C578 W597 I598 F622 S623 L625	C578-C614 HydrophobicContact CB-CB 3.95Å; C578-C614 WeakPolarHBondContact CB-SG 3.35Å; C578-C614 WeakPolarHBondContact SG-CB 3.3Å; C578-C614 CovalentContact SG-SG 2.04Å; C578-C614 PolarHBondContact SG-SG 3.09Å; W597-C614 HydrophobicContact CB-CB 4.06Å; W597-C614 HydrophobicContact CD2-CB 4.41Å; W597-C614 HydrophobicContact CE3-CB 3.83Å; W597-C614 WeakPolarHBondContact CZ3-O 3.25Å; I598-C614 CarbonylContact O-C 3.55Å; I598-C614 VanDerWaalsContact O-CA 3.31Å; I598-C614 WeakPolarHBondContact O-CA 3.23Å; C614-F622 CarbonylContact O-C 3.37Å; C614-F622 VanDerWaalsContact O-CA 3.3Å; C614-F622 WeakPolarHBondContact O-CA 3.26Å; C614-S623 PolarHBondContact N-O 3.43Å; C614-S623 PolarHBondContact O-N 3.47Å; C614-L625 HydrophobicContact CB-CD1 3.64Å; C614-L625 HydrophobicContact CB-CG 4.09Å; C614-L625 VanDerWaalsContact SG-CD1 3.55Å
615	R	87.9	Confident	81.9	Confident	85 Å²	85	58.1 Å²	58.1	32%	0.321	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	146.4	173.2	66.5	175.3	179.2	166.9	1.4	110.2	I598 N617 Y621 F622	I598-R615 HydrophobicContact CD1-CG 4.01Å; I598-R615 VanDerWaalsContact CD1-NE 3.27Å; I598-R615 HydrophobicContact CG1-CG 3.45Å; I598-R615 VanDerWaalsContact CG1-CG 3.45Å; I598-R615 WeakPolarHBondContact CG1-O 3.31Å; I598-R615 PolarHBondContact N-O 3.44Å; I598-R615 PolarHBondContact O-N 3.16Å; R615-N617 PolarHBondContact O-N 2.9Å; R615-Y621 CarbonylContact C-O 3.51Å; R615-Y621 VanDerWaalsContact CA-O 3.31Å; R615-Y621 WeakPolarHBondContact CA-O 3.42Å; R615-F622 HydrophobicContact CB-CB 4.01Å
616	A	84	Confident	81.8	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123.9	173.7	0	0	0	0	0	109.5	L591 V595 W597 G618 T619 Y621	L591-A616 HydrophobicContact CD2-CB 3.73Å; V595-A616 HydrophobicContact CG1-CB 3.56Å; W597-A616 HydrophobicContact CE3-CB 4.46Å; W597-A616 HydrophobicContact CZ3-CB 4.28Å; A616-G618 PolarHBondContact O-N 2.84Å; A616-T619 VanDerWaalsContact CB-OG1 3.3Å; A616-T619 WeakPolarHBondContact CB-OG1 3.33Å; A616-T619 PolarHBondContact O-N 3.2Å; A616-T619 PolarHBondContact O-OG1 2.92Å; A616-Y621 PolarHBondContact N-O 3.13Å
617	N	82	Confident	81.3	Confident	101 Å²	101	53.6 Å²	53.6	54%	0.54	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	135.8	-175.7	-170.8	23.1	0	0	0	111.3	V596 I598 R615 T619	V596-N617 HydrophobicContact CB-CB 4.08Å; V596-N617 HydrophobicContact CG1-CB 4.34Å; V596-N617 WeakPolarHBondContact O-CB 3.3Å; V596-N617 PolarHBondContact O-N 3.01Å; I598-N617 HydrophobicContact CD1-CB 4.36Å; R615-N617 PolarHBondContact O-N 2.9Å; N617-T619 PolarHBondContact O-N 2.9Å
618	G	72	Confident	81.6	Confident	82 Å²	82	47.9 Å²	47.9	85%	0.845	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	-1.7	-177.2	0	0	0	0	0	115.6	A616	A616-G618 PolarHBondContact O-N 2.84Å
619	T	73.4	Confident	81.9	Confident	67 Å²	67	44.6 Å²	44.6	41%	0.411	26%	0.263	S	S	.	.	S	Bend	trans	-122.7	165.8	178.1	78.5	0	0	0	0	112.1	A616 N617 Y621	A616-T619 VanDerWaalsContact CB-OG1 3.3Å; A616-T619 WeakPolarHBondContact CB-OG1 3.33Å; A616-T619 PolarHBondContact O-N 3.2Å; A616-T619 PolarHBondContact O-OG1 2.92Å; N617-T619 PolarHBondContact O-N 2.9Å; T619-Y621 VanDerWaalsContact C-N 3.3Å; T619-Y621 PolarHBondContact OG1-N 3.2Å
620	G	69	Low	82	Confident	75 Å²	75	44.5 Å²	44.5	77%	0.773	27%	0.267	S	S	*	.	S	Bend	trans	-83	-3.9	170.4	0	0	0	0	0	114.1
621	Y	77.7	Confident	82	Confident	80 Å²	80	45.1 Å²	45.1	31%	0.314	27%	0.271	S	S	.	.			trans	-76.4	133.8	-174.6	-171.8	-91.9	0	0	0	111.1	L591 W597 R615 A616 T619	L591-Y621 HydrophobicContact CD1-CD1 3.67Å; L591-Y621 HydrophobicContact CD1-CE1 3.61Å; L591-Y621 HydrophobicContact CD1-CG 4.23Å; L591-Y621 HydrophobicContact CD2-CD1 4.4Å; W597-Y621 HydrophobicContact CH2-CD1 4.01Å; W597-Y621 AromaticContact CH2-CE1 3.92Å; W597-Y621 HydrophobicContact CH2-CE1 3.92Å; W597-Y621 HydrophobicContact CZ3-CD1 4.38Å; R615-Y621 CarbonylContact C-O 3.51Å; R615-Y621 VanDerWaalsContact CA-O 3.31Å; R615-Y621 WeakPolarHBondContact CA-O 3.42Å; A616-Y621 PolarHBondContact N-O 3.13Å; T619-Y621 VanDerWaalsContact C-N 3.3Å; T619-Y621 PolarHBondContact OG1-N 3.2Å
622	F	83.9	Confident	82.1	Confident	111 Å²	111	43 Å²	43	49%	0.487	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	151.5	176.9	68.5	-85.8	0	0	0	111	K600 I613 C614 R615	K600-F622 HydrophobicContact CD-CB 3.86Å; K600-F622 HydrophobicContact CD-CD1 4.38Å; K600-F622 HydrophobicContact CD-CD2 4.11Å; K600-F622 HydrophobicContact CD-CG 3.86Å; I613-F622 HydrophobicContact CG2-CD2 4.16Å; C614-F622 CarbonylContact O-C 3.37Å; C614-F622 VanDerWaalsContact O-CA 3.3Å; C614-F622 WeakPolarHBondContact O-CA 3.26Å; R615-F622 HydrophobicContact CB-CB 4.01Å
623	S	80.7	Confident	82.3	Confident	28 Å²	28	42.9 Å²	42.9	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.6	179.1	-168.4	0	0	0	0	111.1	L586 C614	L586-S623 WeakPolarHBondContact CD1-OG 3.3Å; C614-S623 PolarHBondContact N-O 3.43Å; C614-S623 PolarHBondContact O-N 3.47Å
624	V	82.9	Confident	82.3	Confident	73 Å²	73	44.9 Å²	44.9	44%	0.442	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	103.7	172	-172.5	0	0	0	0	107.4	K611 I613	K611-V624 HydrophobicContact CB-CG1 4.22Å; K611-V624 HydrophobicContact CD-CG1 4.36Å; I613-V624 HydrophobicContact CD1-CG2 4.49Å; I613-V624 HydrophobicContact CG1-CG2 4.17Å
625	L	80	Confident	82.4	Confident	22 Å²	22	45 Å²	45	12%	0.115	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-24.9	-174.1	-58.5	-173	0	0	0	113.1	F581 L586 W597 L612 C614	F581-L625 HydrophobicContact CB-CD1 3.64Å; F581-L625 HydrophobicContact CD1-CB 4.4Å; F581-L625 HydrophobicContact CD2-CB 4.15Å; F581-L625 HydrophobicContact CD2-CD1 4.02Å; F581-L625 HydrophobicContact CE1-CB 4.49Å; F581-L625 HydrophobicContact CE2-CB 4.27Å; F581-L625 HydrophobicContact CG-CB 4.22Å; F581-L625 HydrophobicContact CG-CD1 3.85Å; F581-L625 HydrophobicContact CZ-CB 4.43Å; L586-L625 HydrophobicContact CD1-CD2 4.09Å; W597-L625 HydrophobicContact CB-CD1 4.27Å; W597-L625 HydrophobicContact CD2-CD1 3.92Å; W597-L625 HydrophobicContact CE3-CD1 4.26Å; W597-L625 HydrophobicContact CG-CD1 3.92Å; W597-L625 HydrophobicContact CH2-CD2 4.46Å; W597-L625 HydrophobicContact CZ2-CD2 4.37Å; L612-L625 HydrophobicContact CD2-CB 4.2Å; L612-L625 HydrophobicContact CG-CB 4.47Å; L612-L625 PolarHBondContact O-N 3.03Å; C614-L625 HydrophobicContact CB-CD1 3.64Å; C614-L625 HydrophobicContact CB-CG 4.09Å; C614-L625 VanDerWaalsContact SG-CD1 3.55Å
626	S	78.1	Confident	82.2	Confident	28 Å²	28	41.1 Å²	41.1	20%	0.196	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143.1	173	167.9	0	0	0	0	110.3	L612 K628	L612-S626 PolarHBondContact N-O 3.4Å; S626-K628 PolarHBondContact O-N 3.08Å; S626-K628 PolarHBondContact OG-N 3.5Å; S626-K628 PolarHBondContact OG-O 3.05Å
627	P	68.4	Low	82	Confident	27 Å²	27	41.1 Å²	41.1	18%	0.175	26%	0.261	C	S	.	.	S	Bend	trans	-67.6	-18	-179.2	29.8	-39.1	0	0	0	113.8	S173	S173-P627 WeakPolarHBondContact O-CG 3.42Å
628	K	82	Confident	81.7	Confident	34 Å²	34	38.5 Å²	38.5	15%	0.148	25%	0.247	C	C	.	.	S	Bend	trans	-146.5	143.9	173.3	69.6	-173.4	179.2	-159.9	0	110.9	C610 S626	C610-K628 CarbonylContact O-C 3.45Å; C610-K628 WeakPolarHBondContact O-CA 3Å; S626-K628 PolarHBondContact O-N 3.08Å; S626-K628 PolarHBondContact OG-N 3.5Å; S626-K628 PolarHBondContact OG-O 3.05Å
629	V	88.8	Confident	82.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-74.3	157.3	162.5	-59.2	0	0	0	0	109.8	R574 Q577 C610 L612 D631 T633 C643	R574-V629 HydrophobicContact CG-CG1 4.4Å; Q577-V629 VanDerWaalsContact OE1-CA 3.32Å; C610-V629 HydrophobicContact CB-CG2 4.39Å; C610-V629 PolarHBondContact O-N 2.88Å; L612-V629 HydrophobicContact CB-CG1 4.08Å; L612-V629 HydrophobicContact CD1-CG1 4.01Å; V629-D631 PolarHBondContact O-N 2.85Å; V629-T633 HydrophobicContact CB-CG2 4.21Å; V629-T633 HydrophobicContact CG2-CG2 4.08Å; V629-C643 HydrophobicContact CG2-CB 3.49Å; V629-C643 VanDerWaalsContact CG2-CB 3.49Å; V629-C643 WeakPolarHBondContact CG2-SG 3.49Å
630	V	89.8	Confident	82.7	Confident	59 Å²	59	35.4 Å²	35.4	36%	0.358	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-58.2	136.1	174.6	175.2	0	0	0	0	110	R523 F573 G632 T633	R523-V630 HydrophobicContact CG-CG1 4.39Å; F573-V630 HydrophobicContact CE1-CB 3.78Å; F573-V630 HydrophobicContact CE1-CG1 3.91Å; F573-V630 HydrophobicContact CZ-CB 4.09Å; F573-V630 HydrophobicContact CZ-CG1 4.02Å; F573-V630 HydrophobicContact CZ-CG2 4.45Å; V630-G632 PolarHBondContact O-N 3.41Å; V630-T633 VanDerWaalsContact O-CB 3.24Å; V630-T633 WeakPolarHBondContact O-CB 3.21Å; V630-T633 PolarHBondContact O-N 3.49Å; V630-T633 VanDerWaalsContact O-N 3.09Å; V630-T633 PolarHBondContact O-OG1 2.82Å
631	D	90.2	Very high	83.7	Confident	14 Å²	14	32.5 Å²	32.5	8%	0.075	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	139.9	-177.7	-72.6	-9.3	0	0	0	111	S522 V529 V629 T633 C643 Q645	S522-D631 WeakPolarHBondContact CB-O 3.47Å; S522-D631 PolarHBondContact OG-O 2.93Å; V529-D631 HydrophobicContact CB-CB 3.99Å; V529-D631 HydrophobicContact CG2-CB 4.22Å; V629-D631 PolarHBondContact O-N 2.85Å; D631-T633 VanDerWaalsContact C-N 3.34Å; D631-C643 CarbonylContact C-O 3.57Å; D631-C643 WeakPolarHBondContact CA-O 3.41Å; D631-Q645 VanDerWaalsContact CG-N 3.35Å; D631-Q645 PolarHBondContact OD1-N 3.41Å; D631-Q645 PolarHBondContact OD2-N 3.36Å; D631-Q645 PolarHBondContact OD2-NE2 3.06Å
632	G	89.4	Confident	84.4	Confident	3 Å²	3	29.5 Å²	29.5	3%	0.031	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-9.8	-171.9	0	0	0	0	0	114.2	R523 V630 C643	R523-G632 PolarHBondContact NH1-O 3.36Å; V630-G632 PolarHBondContact O-N 3.41Å; G632-C643 PolarHBondContact N-O 2.98Å
633	T	90.8	Very high	84.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.149	C	C	.	.			trans	-63.5	130.5	170.5	-56.5	0	0	0	0	110	F573 R574 Q577 V629 V630 D631 C635 C643	F573-T633 HydrophobicContact CD1-CG2 4.46Å; F573-T633 WeakPolarHBondContact CD1-OG1 3.33Å; F573-T633 WeakPolarHBondContact CE1-OG1 3.37Å; R574-T633 HydrophobicContact CB-CG2 3.82Å; R574-T633 HydrophobicContact CG-CG2 4.07Å; Q577-T633 PolarHBondContact NE2-OG1 3.48Å; V629-T633 HydrophobicContact CB-CG2 4.21Å; V629-T633 HydrophobicContact CG2-CG2 4.08Å; V630-T633 VanDerWaalsContact O-CB 3.24Å; V630-T633 WeakPolarHBondContact O-CB 3.21Å; V630-T633 PolarHBondContact O-N 3.49Å; V630-T633 VanDerWaalsContact O-N 3.09Å; V630-T633 PolarHBondContact O-OG1 2.82Å; D631-T633 VanDerWaalsContact C-N 3.34Å; T633-C635 PolarHBondContact O-N 2.98Å; T633-C643 WeakPolarHBondContact O-CB 3.22Å; T633-C643 PolarHBondContact O-N 3.16Å
634	P	89.6	Confident	85	Confident	52 Å²	52	22.9 Å²	22.9	34%	0.338	14%	0.14	S	C	.	.	B	Isolated β-bridge	trans	-58.3	135.4	174.3	-25.5	34.7	0	0	0	112.3	S636 A641	P634-S636 PolarHBondContact O-N 3.47Å; P634-A641 WeakPolarHBondContact CA-O 3.2Å
635	C	89.5	Confident	84.9	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.014	13%	0.125	C	C	.	.	S	Bend	trans	-62.5	-35.3	-179.1	-55.1	0	0	0	0	112.4	R574 T633 A641 V642 C648	R574-C635 PolarHBondContact NH1-O 2.88Å; T633-C635 PolarHBondContact O-N 2.98Å; C635-A641 HydrophobicContact CB-CB 4.41Å; C635-A641 PolarHBondContact N-O 3.29Å; C635-A641 VanDerWaalsContact SG-C 3.51Å; C635-A641 PolarHBondContact SG-O 3Å; C635-V642 VanDerWaalsContact SG-C 3.59Å; C635-C648 HydrophobicContact CB-CB 3.97Å; C635-C648 WeakPolarHBondContact CB-SG 3.46Å; C635-C648 WeakPolarHBondContact SG-CA 3.45Å; C635-C648 WeakPolarHBondContact SG-CB 3.42Å; C635-C648 CovalentContact SG-SG 2.03Å; C635-C648 PolarHBondContact SG-SG 3.08Å
636	S	84.3	Confident	84.9	Confident	3 Å²	3	20.4 Å²	20.4	2%	0.021	13%	0.127	C	C	.	.	S	Bend	trans	-155.6	148.6	178.5	-167.5	0	0	0	0	109	P634 D638 T639	P634-S636 PolarHBondContact O-N 3.47Å; S636-D638 WeakPolarHBondContact CB-OD1 3.34Å; S636-D638 PolarHBondContact O-N 3.04Å; S636-D638 VanDerWaalsContact O-N 3.1Å; S636-D638 PolarHBondContact OG-OD1 2.97Å; S636-T639 PolarHBondContact O-N 2.87Å; S636-T639 PolarHBondContact O-OG1 3.19Å
637	P	80.1	Confident	85.1	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.013	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.9	-179.1	-38.6	42.6	0	0	0	117.7	Y601 L750 R767	Y601-P637 HydrophobicContact CD2-CG 4.04Å; Y601-P637 VanDerWaalsContact CE1-CD 3.5Å; Y601-P637 HydrophobicContact CE1-CG 4.21Å; Y601-P637 HydrophobicContact CE2-CG 3.64Å; Y601-P637 HydrophobicContact CG-CG 4.48Å; P637-L750 HydrophobicContact CB-CB 3.6Å; P637-L750 HydrophobicContact CB-CD2 3.82Å; P637-L750 HydrophobicContact CB-CG 4.26Å; P637-L750 HydrophobicContact CG-CB 4.31Å; P637-L750 HydrophobicContact CG-CD2 3.9Å; P637-R767 PolarHBondContact O-NE 3.3Å; P637-R767 PolarHBondContact O-NH2 2.89Å
638	D	76.2	Confident	86.1	Confident	46 Å²	46	22 Å²	22	25%	0.246	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-7.9	-172.1	57.8	-40.6	0	0	0	113.4	S636 R752	S636-D638 WeakPolarHBondContact CB-OD1 3.34Å; S636-D638 PolarHBondContact O-N 3.04Å; S636-D638 VanDerWaalsContact O-N 3.1Å; S636-D638 PolarHBondContact OG-OD1 2.97Å; D638-R752 IonicContact OD1-NH1 2.67Å; D638-R752 IonicContact OD2-NH1 2.84Å; D638-R752 PolarHBondContact OD2-NH1 3.15Å
639	T	81.9	Confident	86.4	Confident	46 Å²	46	20.8 Å²	20.8	28%	0.282	13%	0.127	S	C	.	.			trans	-114	146.9	-178.3	67.8	0	0	0	0	111.1	S636 A641	S636-T639 PolarHBondContact O-N 2.87Å; S636-T639 PolarHBondContact O-OG1 3.19Å; T639-A641 PolarHBondContact O-N 3.12Å
640	S	84.2	Confident	86.4	Confident	39 Å²	39	26 Å²	26	27%	0.273	15%	0.149	S	C	.	.			trans	-77.8	-5.1	168.2	58	0	0	0	0	113.3	A651 G652	S640-A651 VanDerWaalsContact CB-O 3.29Å; S640-A651 WeakPolarHBondContact CB-O 3.36Å; S640-A651 VanDerWaalsContact O-CB 3.26Å; S640-A651 WeakPolarHBondContact O-CB 3.14Å; S640-A651 PolarHBondContact OG-O 3.29Å; S640-G652 WeakPolarHBondContact CB-O 3.3Å
641	A	89.2	Confident	86.4	Confident	14 Å²	14	23.2 Å²	23.2	12%	0.116	13%	0.133	C	C	.	.			trans	-69.1	141.2	-180	0	0	0	0	0	111.3	P634 C635 T639 C648 I649	P634-A641 WeakPolarHBondContact CA-O 3.2Å; C635-A641 HydrophobicContact CB-CB 4.41Å; C635-A641 PolarHBondContact N-O 3.29Å; C635-A641 VanDerWaalsContact SG-C 3.51Å; C635-A641 PolarHBondContact SG-O 3Å; T639-A641 PolarHBondContact O-N 3.12Å; A641-C648 WeakPolarHBondContact CB-SG 3.23Å; A641-I649 CarbonylContact C-O 3.37Å; A641-I649 VanDerWaalsContact CA-O 3.23Å; A641-I649 WeakPolarHBondContact CA-O 3.45Å; A641-I649 WeakPolarHBondContact CB-O 3.1Å
642	V	91.7	Very high	86.2	Confident	16 Å²	16	22.6 Å²	22.6	10%	0.097	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.3	-177.1	-62	0	0	0	0	110.6	C635 V644 I649 A651 L657	C635-V642 VanDerWaalsContact SG-C 3.59Å; V642-V644 HydrophobicContact CG2-CG2 4.33Å; V642-I649 PolarHBondContact N-O 2.73Å; V642-I649 PolarHBondContact O-N 3.05Å; V642-A651 HydrophobicContact CG1-CB 4.29Å; V642-A651 HydrophobicContact CG2-CB 3.97Å; V642-L657 HydrophobicContact CG2-CD1 4.43Å; V642-L657 HydrophobicContact CG2-CD2 3.52Å; V642-L657 HydrophobicContact CG2-CG 4Å
643	C	91.1	Very high	86.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	126.4	176.6	-67	0	0	0	0	110.2	C610 V629 D631 G632 T633 K647	C610-C643 WeakPolarHBondContact CA-SG 3.28Å; C610-C643 HydrophobicContact CB-CB 3.71Å; C610-C643 WeakPolarHBondContact CB-SG 3.37Å; C610-C643 WeakPolarHBondContact SG-CA 3.3Å; C610-C643 WeakPolarHBondContact SG-CB 3.37Å; C610-C643 CovalentContact SG-SG 2.04Å; C610-C643 PolarHBondContact SG-SG 3.33Å; V629-C643 HydrophobicContact CG2-CB 3.49Å; V629-C643 VanDerWaalsContact CG2-CB 3.49Å; V629-C643 WeakPolarHBondContact CG2-SG 3.49Å; D631-C643 CarbonylContact C-O 3.57Å; D631-C643 WeakPolarHBondContact CA-O 3.41Å; G632-C643 PolarHBondContact N-O 2.98Å; T633-C643 WeakPolarHBondContact O-CB 3.22Å; T633-C643 PolarHBondContact O-N 3.16Å; C643-K647 CarbonylContact C-O 3.43Å; C643-K647 WeakPolarHBondContact CA-O 3.33Å
644	V	87.9	Confident	85.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	118.3	172.3	-176	0	0	0	0	106.6	F204 V529 L531 Y555 V642 G646 K647 I649 L657	F204-V644 WeakPolarHBondContact CZ-O 3.47Å; V529-V644 HydrophobicContact CG1-CG1 4.09Å; V529-V644 HydrophobicContact CG1-CG2 4.28Å; V529-V644 HydrophobicContact CG2-CG2 4.14Å; L531-V644 HydrophobicContact CD2-CG1 4.07Å; Y555-V644 HydrophobicContact CD1-CG1 4.08Å; Y555-V644 HydrophobicContact CG-CG1 4.09Å; V642-V644 HydrophobicContact CG2-CG2 4.33Å; V644-G646 VanDerWaalsContact C-N 3.3Å; V644-G646 PolarHBondContact O-N 3.39Å; V644-K647 PolarHBondContact N-O 3.05Å; V644-K647 PolarHBondContact O-N 2.87Å; V644-I649 HydrophobicContact CB-CG1 3.75Å; V644-I649 HydrophobicContact CG2-CB 4.08Å; V644-I649 HydrophobicContact CG2-CG1 3.82Å; V644-L657 HydrophobicContact CG2-CD1 4.14Å; V644-L657 HydrophobicContact CG2-CD2 4.01Å
645	Q	79.7	Confident	85.3	Confident	28 Å²	28	25.1 Å²	25.1	13%	0.131	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	47	178.6	-67.8	-61	-61.9	0	0	113.2	F204 L531 D631 K647	F204-Q645 HydrophobicContact CD1-CB 4.28Å; F204-Q645 HydrophobicContact CE1-CB 3.45Å; F204-Q645 VanDerWaalsContact CE1-CB 3.45Å; F204-Q645 HydrophobicContact CE1-CG 4.35Å; F204-Q645 HydrophobicContact CZ-CB 3.8Å; L531-Q645 HydrophobicContact CD1-CG 3.93Å; L531-Q645 VanDerWaalsContact CD1-NE2 3.26Å; L531-Q645 HydrophobicContact CD2-CG 4.44Å; D631-Q645 VanDerWaalsContact CG-N 3.35Å; D631-Q645 PolarHBondContact OD1-N 3.41Å; D631-Q645 PolarHBondContact OD2-N 3.36Å; D631-Q645 PolarHBondContact OD2-NE2 3.06Å; Q645-K647 PolarHBondContact O-N 3.41Å; Q645-K647 VanDerWaalsContact O-N 3.17Å
646	G	79.9	Confident	85.2	Confident	15 Å²	15	30.5 Å²	30.5	16%	0.155	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	6.1	179.6	0	0	0	0	0	114.7	C610 V644	C610-G646 VanDerWaalsContact CB-C 3.46Å; C610-G646 VanDerWaalsContact CB-O 3.28Å; C610-G646 WeakPolarHBondContact CB-O 3.45Å; V644-G646 VanDerWaalsContact C-N 3.3Å; V644-G646 PolarHBondContact O-N 3.39Å
647	K	83.4	Confident	85.2	Confident	51 Å²	51	30.8 Å²	30.8	22%	0.222	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.4	174.3	-69.1	-170.1	174.9	173.6	0	112	F204 D407 C643 V644 Q645 I649	F204-K647 HydrophobicContact CE1-CD 4.08Å; F204-K647 HydrophobicContact CE1-CG 4.42Å; F204-K647 HydrophobicContact CZ-CB 4.06Å; F204-K647 HydrophobicContact CZ-CD 3.9Å; F204-K647 HydrophobicContact CZ-CG 4.19Å; D407-K647 WeakPolarHBondContact O-CE 3.38Å; D407-K647 PolarHBondContact O-NZ 3.49Å; C643-K647 CarbonylContact C-O 3.43Å; C643-K647 WeakPolarHBondContact CA-O 3.33Å; V644-K647 PolarHBondContact N-O 3.05Å; V644-K647 PolarHBondContact O-N 2.87Å; Q645-K647 PolarHBondContact O-N 3.41Å; Q645-K647 VanDerWaalsContact O-N 3.17Å; K647-I649 HydrophobicContact CB-CD1 4.19Å; K647-I649 PolarHBondContact O-N 2.81Å
648	C	88.5	Confident	85.3	Confident	37 Å²	37	36.2 Å²	36.2	25%	0.25	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	112.1	172.7	-170.9	0	0	0	0	110.8	R203 C610 C635 A641	R203-C648 PolarHBondContact NH1-O 2.93Å; C610-C648 PolarHBondContact SG-N 3Å; C610-C648 VanDerWaalsContact SG-N 3.41Å; C635-C648 HydrophobicContact CB-CB 3.97Å; C635-C648 WeakPolarHBondContact CB-SG 3.46Å; C635-C648 WeakPolarHBondContact SG-CA 3.45Å; C635-C648 WeakPolarHBondContact SG-CB 3.42Å; C635-C648 CovalentContact SG-SG 2.03Å; C635-C648 PolarHBondContact SG-SG 3.08Å; A641-C648 WeakPolarHBondContact CB-SG 3.23Å
649	I	87.7	Confident	85.8	Confident	9 Å²	9	34.9 Å²	34.9	5%	0.046	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.5	179.7	-55.2	-55.7	0	0	0	109.4	F204 Y555 A641 V642 V644 K647 A651 L657	F204-I649 HydrophobicContact CE2-CD1 4.11Å; Y555-I649 HydrophobicContact CE2-CG2 4.16Å; A641-I649 CarbonylContact C-O 3.37Å; A641-I649 VanDerWaalsContact CA-O 3.23Å; A641-I649 WeakPolarHBondContact CA-O 3.45Å; A641-I649 WeakPolarHBondContact CB-O 3.1Å; V642-I649 PolarHBondContact N-O 2.73Å; V642-I649 PolarHBondContact O-N 3.05Å; V644-I649 HydrophobicContact CB-CG1 3.75Å; V644-I649 HydrophobicContact CG2-CB 4.08Å; V644-I649 HydrophobicContact CG2-CG1 3.82Å; K647-I649 HydrophobicContact CB-CD1 4.19Å; K647-I649 PolarHBondContact O-N 2.81Å; I649-A651 PolarHBondContact O-N 2.95Å; I649-L657 HydrophobicContact CB-CD2 4.13Å; I649-L657 HydrophobicContact CG2-CD2 3.7Å
650	K	88.7	Confident	86	Confident	109 Å²	109	38.6 Å²	38.6	47%	0.474	21%	0.214	S	C	.	.			trans	-64.9	127.3	176.8	-175.1	-167.8	169.5	-150.8	0	108.6	D660	K650-D660 IonicContact NZ-OD1 2.84Å; K650-D660 PolarHBondContact NZ-OD1 3.31Å
651	A	90.1	Very high	86.1	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-124.4	157.2	169.4	0	0	0	0	0	109	S640 V642 I649 L657	S640-A651 VanDerWaalsContact CB-O 3.29Å; S640-A651 WeakPolarHBondContact CB-O 3.36Å; S640-A651 VanDerWaalsContact O-CB 3.26Å; S640-A651 WeakPolarHBondContact O-CB 3.14Å; S640-A651 PolarHBondContact OG-O 3.29Å; V642-A651 HydrophobicContact CG1-CB 4.29Å; V642-A651 HydrophobicContact CG2-CB 3.97Å; I649-A651 PolarHBondContact O-N 2.95Å; A651-L657 HydrophobicContact CB-CD2 4.35Å
652	G	87.1	Confident	85.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	25%	0.248	C	C	.	.			trans	-68.6	162.9	175.9	0	0	0	0	0	111.4	S640 D654 G655 K656 S659 K661	S640-G652 WeakPolarHBondContact CB-O 3.3Å; G652-D654 VanDerWaalsContact C-OD1 3.29Å; G652-D654 VanDerWaalsContact CA-OD1 3.3Å; G652-D654 WeakPolarHBondContact CA-OD1 3.49Å; G652-D654 PolarHBondContact O-N 3.2Å; G652-D654 VanDerWaalsContact O-N 3.11Å; G652-G655 PolarHBondContact O-N 3.11Å; G652-K656 PolarHBondContact N-O 3.29Å; G652-S659 VanDerWaalsContact CA-O 3.29Å; G652-S659 WeakPolarHBondContact CA-O 3.47Å; G652-S659 PolarHBondContact N-O 2.86Å; G652-K661 CarbonylContact C-O 3.44Å; G652-K661 WeakPolarHBondContact CA-O 3.16Å
653	C	85.4	Confident	85.6	Confident	18 Å²	18	50.9 Å²	50.9	12%	0.122	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.7	173.9	53	0	0	0	0	113.7	K661 K662 F663 C669	C653-K661 PolarHBondContact N-O 3.37Å; C653-K661 PolarHBondContact SG-O 3.29Å; C653-K661 VanDerWaalsContact SG-O 3.41Å; C653-K662 PolarHBondContact SG-O 3.23Å; C653-F663 HydrophobicContact CB-CD1 3.92Å; C653-F663 HydrophobicContact CB-CD2 3.51Å; C653-F663 HydrophobicContact CB-CE1 3.78Å; C653-F663 HydrophobicContact CB-CE2 3.34Å; C653-F663 HydrophobicContact CB-CG 3.8Å; C653-F663 HydrophobicContact CB-CZ 3.48Å; C653-F663 VanDerWaalsContact CB-CZ 3.48Å; C653-C669 HydrophobicContact CB-CB 3.62Å; C653-C669 WeakPolarHBondContact CB-SG 3.49Å; C653-C669 WeakPolarHBondContact SG-CA 3.43Å; C653-C669 WeakPolarHBondContact SG-CB 3.35Å; C653-C669 CovalentContact SG-SG 2.02Å; C653-C669 PolarHBondContact SG-SG 3.22Å
654	D	84.6	Confident	85.3	Confident	59 Å²	59	51.7 Å²	51.7	32%	0.316	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2.3	173	56.8	-0.3	0	0	0	113	G652 K656 S659 C669	G652-D654 VanDerWaalsContact C-OD1 3.29Å; G652-D654 VanDerWaalsContact CA-OD1 3.3Å; G652-D654 WeakPolarHBondContact CA-OD1 3.49Å; G652-D654 PolarHBondContact O-N 3.2Å; G652-D654 VanDerWaalsContact O-N 3.11Å; D654-K656 PolarHBondContact O-N 3.43Å; D654-K656 PolarHBondContact OD1-N 2.89Å; D654-K656 VanDerWaalsContact OD1-N 3.15Å; D654-S659 VanDerWaalsContact CG-OG 3.3Å; D654-S659 VanDerWaalsContact OD1-CB 3.29Å; D654-S659 WeakPolarHBondContact OD1-CB 2.98Å; D654-S659 PolarHBondContact OD1-OG 3.14Å; D654-S659 VanDerWaalsContact OD1-OG 3.14Å; D654-S659 WeakPolarHBondContact OD2-CB 3.44Å; D654-S659 PolarHBondContact OD2-OG 2.78Å; D654-C669 PolarHBondContact N-SG 3.23Å
655	G	80.6	Confident	85.1	Confident	31 Å²	31	56.6 Å²	56.6	32%	0.32	29%	0.285	S	S	.	.	S	Bend	trans	75.6	3.8	-178.4	0	0	0	0	0	114	S557 L560 G652	S557-G655 PolarHBondContact OG-O 2.96Å; L560-G655 WeakPolarHBondContact CD2-O 3.48Å; G652-G655 PolarHBondContact O-N 3.11Å
656	K	86.8	Confident	85.3	Confident	116 Å²	116	56 Å²	56	50%	0.504	28%	0.283	S	S	.	.			trans	-91.3	129.5	-178.1	-168	177.8	178.1	-179	0	111.1	G652 D654 S659	G652-K656 PolarHBondContact N-O 3.29Å; D654-K656 PolarHBondContact O-N 3.43Å; D654-K656 PolarHBondContact OD1-N 2.89Å; D654-K656 VanDerWaalsContact OD1-N 3.15Å; K656-S659 VanDerWaalsContact O-CB 3.3Å; K656-S659 WeakPolarHBondContact O-CB 3.36Å; K656-S659 PolarHBondContact O-N 3.44Å
657	L	85.2	Confident	85.2	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-63.2	141.2	170.6	-76.5	159.8	0	0	0	109.5	V529 Y555 S557 V642 V644 I649 A651 S659	V529-L657 HydrophobicContact CG1-CD1 4.03Å; V529-L657 HydrophobicContact CG2-CD1 3.85Å; Y555-L657 HydrophobicContact CD2-CB 4.37Å; Y555-L657 HydrophobicContact CD2-CD1 3.87Å; Y555-L657 HydrophobicContact CD2-CD2 4.3Å; Y555-L657 HydrophobicContact CD2-CG 4.42Å; Y555-L657 HydrophobicContact CE2-CB 4.38Å; Y555-L657 HydrophobicContact CE2-CD1 4.43Å; Y555-L657 HydrophobicContact CE2-CD2 4.04Å; S557-L657 WeakPolarHBondContact OG-CB 3.43Å; S557-L657 PolarHBondContact OG-N 3.1Å; V642-L657 HydrophobicContact CG2-CD1 4.43Å; V642-L657 HydrophobicContact CG2-CD2 3.52Å; V642-L657 HydrophobicContact CG2-CG 4Å; V644-L657 HydrophobicContact CG2-CD1 4.14Å; V644-L657 HydrophobicContact CG2-CD2 4.01Å; I649-L657 HydrophobicContact CB-CD2 4.13Å; I649-L657 HydrophobicContact CG2-CD2 3.7Å; A651-L657 HydrophobicContact CB-CD2 4.35Å; L657-S659 PolarHBondContact O-N 3.08Å; L657-S659 VanDerWaalsContact O-N 3.15Å
658	D	82.2	Confident	85.2	Confident	116 Å²	116	57.1 Å²	57.1	62%	0.62	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	10.1	-174.2	-52.2	-44.3	0	0	0	115.5
659	S	86	Confident	85.1	Confident	18 Å²	18	57.6 Å²	57.6	13%	0.126	30%	0.298	C	S	.	.			trans	-80.3	129.4	168	-178	0	0	0	0	110.6	G652 D654 K656 L657 K661	G652-S659 VanDerWaalsContact CA-O 3.29Å; G652-S659 WeakPolarHBondContact CA-O 3.47Å; G652-S659 PolarHBondContact N-O 2.86Å; D654-S659 VanDerWaalsContact CG-OG 3.3Å; D654-S659 VanDerWaalsContact OD1-CB 3.29Å; D654-S659 WeakPolarHBondContact OD1-CB 2.98Å; D654-S659 PolarHBondContact OD1-OG 3.14Å; D654-S659 VanDerWaalsContact OD1-OG 3.14Å; D654-S659 WeakPolarHBondContact OD2-CB 3.44Å; D654-S659 PolarHBondContact OD2-OG 2.78Å; K656-S659 VanDerWaalsContact O-CB 3.3Å; K656-S659 WeakPolarHBondContact O-CB 3.36Å; K656-S659 PolarHBondContact O-N 3.44Å; L657-S659 PolarHBondContact O-N 3.08Å; L657-S659 VanDerWaalsContact O-N 3.15Å; S659-K661 VanDerWaalsContact C-N 3.32Å; S659-K661 PolarHBondContact OG-N 3.36Å
660	D	86.1	Confident	85	Confident	125 Å²	125	59.6 Å²	59.6	67%	0.668	32%	0.321	S	S	*	.			trans	-89	2.8	176.7	-81.5	-43.7	0	0	0	113.8	K650 K662	K650-D660 IonicContact NZ-OD1 2.84Å; K650-D660 PolarHBondContact NZ-OD1 3.31Å; D660-K662 PolarHBondContact O-N 3.4Å
661	K	86.8	Confident	84.8	Confident	117 Å²	117	55.7 Å²	55.7	51%	0.509	31%	0.312	S	S	.	.			trans	-62.4	129.8	175.5	-66.2	-170.6	179.9	-178.1	0	110.5	G652 C653 S659	G652-K661 CarbonylContact C-O 3.44Å; G652-K661 WeakPolarHBondContact CA-O 3.16Å; C653-K661 PolarHBondContact N-O 3.37Å; C653-K661 PolarHBondContact SG-O 3.29Å; C653-K661 VanDerWaalsContact SG-O 3.41Å; S659-K661 VanDerWaalsContact C-N 3.32Å; S659-K661 PolarHBondContact OG-N 3.36Å
662	K	85.4	Confident	84.6	Confident	137 Å²	137	60.2 Å²	60.2	60%	0.596	34%	0.336	S	S	*	.			trans	-119.5	156.3	176.6	-65.9	178.1	-173.7	172.4	0	110	C653 D660 D664 G670	C653-K662 PolarHBondContact SG-O 3.23Å; D660-K662 PolarHBondContact O-N 3.4Å; K662-D664 PolarHBondContact O-N 2.99Å; K662-G670 PolarHBondContact O-N 2.97Å
663	F	83.7	Confident	84.4	Confident	73 Å²	73	63.5 Å²	63.5	32%	0.32	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-63.8	133.1	164.7	-67.5	-73.5	0	0	0	108.9	C653 G667 V668 C669	C653-F663 HydrophobicContact CB-CD1 3.92Å; C653-F663 HydrophobicContact CB-CD2 3.51Å; C653-F663 HydrophobicContact CB-CE1 3.78Å; C653-F663 HydrophobicContact CB-CE2 3.34Å; C653-F663 HydrophobicContact CB-CG 3.8Å; C653-F663 HydrophobicContact CB-CZ 3.48Å; C653-F663 VanDerWaalsContact CB-CZ 3.48Å; F663-G667 WeakPolarHBondContact CD1-O 3.18Å; F663-V668 WeakPolarHBondContact CA-O 3.46Å; F663-C669 HydrophobicContact CD1-CB 4.18Å; F663-C669 HydrophobicContact CE1-CB 3.98Å
664	D	85.9	Confident	84.3	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.091	38%	0.376	C	S	.	.			trans	-74.1	178.3	168.8	77.6	-6	0	0	0	110.4	K662 C666 G667 V668 G671 N673	K662-D664 PolarHBondContact O-N 2.99Å; D664-C666 PolarHBondContact O-N 3.42Å; D664-C666 VanDerWaalsContact O-N 3.12Å; D664-C666 VanDerWaalsContact OD1-CA 3.27Å; D664-C666 WeakPolarHBondContact OD1-CA 3.18Å; D664-C666 WeakPolarHBondContact OD1-CB 3.46Å; D664-C666 PolarHBondContact OD1-N 3.24Å; D664-G667 PolarHBondContact O-N 3.22Å; D664-G667 VanDerWaalsContact O-N 3.07Å; D664-G667 PolarHBondContact OD1-N 2.85Å; D664-V668 PolarHBondContact N-O 2.74Å; D664-V668 PolarHBondContact OD1-N 3.49Å; D664-G671 WeakPolarHBondContact CB-O 3.24Å; D664-G671 WeakPolarHBondContact OD2-CA 3.32Å; D664-N673 WeakPolarHBondContact CB-OD1 3.34Å; D664-N673 PolarHBondContact OD2-N 2.52Å; D664-N673 VanDerWaalsContact OD2-N 3.16Å
665	K	84.1	Confident	84.2	Confident	103 Å²	103	68.2 Å²	68.2	45%	0.448	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.5	177.7	-70.1	164.5	175	176.2	0	113.1	N673 S701 Y793	K665-N673 VanDerWaalsContact CB-OD1 3.27Å; K665-N673 WeakPolarHBondContact CB-OD1 3.26Å; K665-N673 HydrophobicContact CD-CB 4.47Å; K665-N673 WeakPolarHBondContact CD-OD1 3.22Å; K665-N673 VanDerWaalsContact CG-OD1 3.27Å; K665-N673 WeakPolarHBondContact CG-OD1 3.4Å; K665-N673 PolarHBondContact N-OD1 2.95Å; K665-S701 PolarHBondContact O-OG 2.86Å; K665-Y793 HydrophobicContact CB-CD1 3.96Å; K665-Y793 HydrophobicContact CB-CD2 4.35Å; K665-Y793 HydrophobicContact CB-CE1 3.7Å; K665-Y793 HydrophobicContact CB-CE2 4.13Å; K665-Y793 HydrophobicContact CB-CG 4.28Å; K665-Y793 HydrophobicContact CD-CE1 3.96Å; K665-Y793 WeakPolarHBondContact CD-OH 3.27Å; K665-Y793 HydrophobicContact CG-CE1 4.26Å; K665-Y793 HydrophobicContact CG-CE2 4.43Å; K665-Y793 WeakPolarHBondContact O-CB 3.37Å; K665-Y793 VanDerWaalsContact O-CG 3.29Å
666	C	82.2	Confident	84.5	Confident	15 Å²	15	67.2 Å²	67.2	10%	0.101	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.5	179.6	-49	0	0	0	0	112.2	D664 V668 S675 C676 S701	D664-C666 PolarHBondContact O-N 3.42Å; D664-C666 VanDerWaalsContact O-N 3.12Å; D664-C666 VanDerWaalsContact OD1-CA 3.27Å; D664-C666 WeakPolarHBondContact OD1-CA 3.18Å; D664-C666 WeakPolarHBondContact OD1-CB 3.46Å; D664-C666 PolarHBondContact OD1-N 3.24Å; C666-V668 HydrophobicContact CB-CG2 4.26Å; C666-S675 WeakPolarHBondContact CB-OG 2.99Å; C666-S675 PolarHBondContact SG-OG 2.93Å; C666-S675 VanDerWaalsContact SG-OG 3.34Å; C666-C676 WeakPolarHBondContact CA-SG 3.49Å; C666-C676 HydrophobicContact CB-CB 3.46Å; C666-C676 VanDerWaalsContact CB-CB 3.46Å; C666-C676 WeakPolarHBondContact CB-SG 3.38Å; C666-C676 PolarHBondContact N-SG 3.39Å; C666-C676 WeakPolarHBondContact SG-CB 3.32Å; C666-C676 PolarHBondContact SG-N 2.93Å; C666-C676 CovalentContact SG-SG 2.01Å; C666-C676 PolarHBondContact SG-SG 3.42Å; C666-S701 VanDerWaalsContact C-OG 3.3Å; C666-S701 PolarHBondContact O-OG 2.79Å
667	G	78.2	Confident	84.5	Confident	19 Å²	19	68.4 Å²	68.4	20%	0.196	37%	0.37	C	S	.	.	S	Bend	trans	86.9	13.6	-174.6	0	0	0	0	0	113.2	F663 D664	F663-G667 WeakPolarHBondContact CD1-O 3.18Å; D664-G667 PolarHBondContact O-N 3.22Å; D664-G667 VanDerWaalsContact O-N 3.07Å; D664-G667 PolarHBondContact OD1-N 2.85Å
668	V	84	Confident	84.7	Confident	70 Å²	70	73.2 Å²	73.2	42%	0.424	39%	0.391	S	S	.	.			trans	-93.2	131.3	176.7	-177.2	0	0	0	0	109.7	F663 D664 C666 G670 G671	F663-V668 WeakPolarHBondContact CA-O 3.46Å; D664-V668 PolarHBondContact N-O 2.74Å; D664-V668 PolarHBondContact OD1-N 3.49Å; C666-V668 HydrophobicContact CB-CG2 4.26Å; V668-G670 PolarHBondContact O-N 2.51Å; V668-G671 PolarHBondContact O-N 2.04Å
669	C	86.8	Confident	85.1	Confident	47 Å²	47	70.8 Å²	70.8	32%	0.318	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-72.2	118.2	179.8	178.7	0	0	0	0	111.5	C653 D654 F663 G671	C653-C669 HydrophobicContact CB-CB 3.62Å; C653-C669 WeakPolarHBondContact CB-SG 3.49Å; C653-C669 WeakPolarHBondContact SG-CA 3.43Å; C653-C669 WeakPolarHBondContact SG-CB 3.35Å; C653-C669 CovalentContact SG-SG 2.02Å; C653-C669 PolarHBondContact SG-SG 3.22Å; D654-C669 PolarHBondContact N-SG 3.23Å; F663-C669 HydrophobicContact CD1-CB 4.18Å; F663-C669 HydrophobicContact CE1-CB 3.98Å; C669-G671 PolarHBondContact O-N 2.97Å
670	G	85.3	Confident	85.4	Confident	51 Å²	51	73.7 Å²	73.7	53%	0.526	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	19.1	-176	0	0	0	0	0	113.7	K662 V668	K662-G670 PolarHBondContact O-N 2.97Å; V668-G670 PolarHBondContact O-N 2.51Å
671	G	83.7	Confident	85.5	Confident	28 Å²	28	68.9 Å²	68.9	29%	0.289	38%	0.377	S	S	.	.			trans	-73.2	165.7	177.8	0	0	0	0	0	113.4	D664 V668 C669	D664-G671 WeakPolarHBondContact CB-O 3.24Å; D664-G671 WeakPolarHBondContact OD2-CA 3.32Å; V668-G671 PolarHBondContact O-N 2.04Å; C669-G671 PolarHBondContact O-N 2.97Å
672	D	86.1	Confident	85.6	Confident	95 Å²	95	68.9 Å²	68.9	51%	0.508	38%	0.38	S	S	.	.			trans	-101	6	-175.1	65.7	-7.9	0	0	0	113.3	Q674	D672-Q674 HydrophobicContact CB-CG 4.42Å; D672-Q674 PolarHBondContact O-N 3.44Å; D672-Q674 WeakPolarHBondContact OD1-CB 3.05Å; D672-Q674 PolarHBondContact OD1-N 3.49Å; D672-Q674 VanDerWaalsContact OD2-CG 3.29Å; D672-Q674 WeakPolarHBondContact OD2-CG 3.05Å; D672-Q674 PolarHBondContact OD2-NE2 2.96Å
673	N	83.9	Confident	85.9	Confident	71 Å²	71	64.1 Å²	64.1	38%	0.38	36%	0.36	S	S	.	.	S	Bend	trans	66.1	12.9	-172.6	-45.2	-84	0	0	0	115.4	D664 K665	D664-N673 WeakPolarHBondContact CB-OD1 3.34Å; D664-N673 PolarHBondContact OD2-N 2.52Å; D664-N673 VanDerWaalsContact OD2-N 3.16Å; K665-N673 VanDerWaalsContact CB-OD1 3.27Å; K665-N673 WeakPolarHBondContact CB-OD1 3.26Å; K665-N673 HydrophobicContact CD-CB 4.47Å; K665-N673 WeakPolarHBondContact CD-OD1 3.22Å; K665-N673 VanDerWaalsContact CG-OD1 3.27Å; K665-N673 WeakPolarHBondContact CG-OD1 3.4Å; K665-N673 PolarHBondContact N-OD1 2.95Å
674	Q	83	Confident	86.1	Confident	129 Å²	129	63.5 Å²	63.5	60%	0.603	36%	0.362	S	S	*	.			trans	-88.6	-23.4	-178.7	-63.3	-169.1	53.9	0	0	113.4	D672 C676 K796	D672-Q674 HydrophobicContact CB-CG 4.42Å; D672-Q674 PolarHBondContact O-N 3.44Å; D672-Q674 WeakPolarHBondContact OD1-CB 3.05Å; D672-Q674 PolarHBondContact OD1-N 3.49Å; D672-Q674 VanDerWaalsContact OD2-CG 3.29Å; D672-Q674 WeakPolarHBondContact OD2-CG 3.05Å; D672-Q674 PolarHBondContact OD2-NE2 2.96Å; Q674-C676 PolarHBondContact O-N 2.81Å; Q674-K796 WeakPolarHBondContact O-CD 3.24Å; Q674-K796 VanDerWaalsContact O-CE 3.28Å; Q674-K796 WeakPolarHBondContact O-CE 3.33Å; Q674-K796 PolarHBondContact O-NZ 3.12Å
675	S	83.3	Confident	86	Confident	47 Å²	47	70.5 Å²	70.5	33%	0.329	39%	0.392	S	S	.	.	S	Bend	trans	-75.3	-2.7	-174.8	59.3	0	0	0	0	114.7	C666 S795 K796	C666-S675 WeakPolarHBondContact CB-OG 2.99Å; C666-S675 PolarHBondContact SG-OG 2.93Å; C666-S675 VanDerWaalsContact SG-OG 3.34Å; S675-S795 CarbonylContact O-C 3.49Å; S675-S795 WeakPolarHBondContact O-CA 3.35Å; S675-K796 PolarHBondContact O-N 2.74Å
676	C	85.3	Confident	85.9	Confident	9 Å²	9	67.4 Å²	67.4	6%	0.061	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	159.8	-179.1	66	0	0	0	0	113.7	C666 Q674 Y793 M794 K796	C666-C676 WeakPolarHBondContact CA-SG 3.49Å; C666-C676 HydrophobicContact CB-CB 3.46Å; C666-C676 VanDerWaalsContact CB-CB 3.46Å; C666-C676 WeakPolarHBondContact CB-SG 3.38Å; C666-C676 PolarHBondContact N-SG 3.39Å; C666-C676 WeakPolarHBondContact SG-CB 3.32Å; C666-C676 PolarHBondContact SG-N 2.93Å; C666-C676 CovalentContact SG-SG 2.01Å; C666-C676 PolarHBondContact SG-SG 3.42Å; Q674-C676 PolarHBondContact O-N 2.81Å; C676-Y793 VanDerWaalsContact SG-CD1 3.58Å; C676-M794 CarbonylContact C-O 3.6Å; C676-M794 WeakPolarHBondContact CA-O 3.26Å; C676-M794 WeakPolarHBondContact CB-O 3.27Å; C676-K796 WeakPolarHBondContact O-CE 3.32Å
677	K	88.2	Confident	86.1	Confident	142 Å²	142	71.4 Å²	71.4	62%	0.617	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.5	173.6	-176.8	-180	177.5	-176.9	0	109.7	Y793 M794 K796	K677-Y793 WeakPolarHBondContact O-CA 3.38Å; K677-M794 PolarHBondContact N-O 3.31Å; K677-M794 PolarHBondContact O-N 3.23Å; K677-K796 HydrophobicContact CB-CG 4.43Å
678	K	88.9	Confident	86.6	Confident	109 Å²	109	76.2 Å²	76.2	47%	0.474	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.2	171.8	-169.9	-177.9	179	-176.3	0	110.3	Y793	K678-Y793 HydrophobicContact CB-CD1 3.96Å; K678-Y793 HydrophobicContact CB-CE1 3.62Å; K678-Y793 HydrophobicContact CD-CE1 4.39Å; K678-Y793 HydrophobicContact CG-CD1 4.45Å; K678-Y793 HydrophobicContact CG-CE1 3.97Å; K678-Y793 HydrophobicContact CG-CE2 4.28Å
679	I	89.9	Confident	86.9	Confident	65 Å²	65	73.1 Å²	73.1	33%	0.333	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.3	170	-59.2	176.2	0	0	0	107.1	S791 F792 M794	I679-S791 CarbonylContact O-C 3.52Å; I679-S791 WeakPolarHBondContact O-CA 2.98Å; I679-F792 HydrophobicContact CB-CD1 4.42Å; I679-F792 HydrophobicContact CB-CD2 4.32Å; I679-F792 HydrophobicContact CB-CE1 4.02Å; I679-F792 HydrophobicContact CB-CE2 3.94Å; I679-F792 HydrophobicContact CB-CZ 3.78Å; I679-F792 HydrophobicContact CD1-CE2 3.68Å; I679-F792 HydrophobicContact CD1-CZ 3.96Å; I679-F792 HydrophobicContact CG1-CE2 4.3Å; I679-F792 HydrophobicContact CG1-CZ 4.46Å; I679-F792 HydrophobicContact CG2-CE1 3.75Å; I679-F792 HydrophobicContact CG2-CE2 4.25Å; I679-F792 HydrophobicContact CG2-CZ 3.59Å; I679-F792 PolarHBondContact N-O 3.06Å; I679-F792 PolarHBondContact O-N 2.81Å; I679-M794 HydrophobicContact CD1-CB 4.08Å; I679-M794 HydrophobicContact CD1-CG 3.64Å
680	S	91.9	Very high	87.1	Confident	79 Å²	79	73.2 Å²	73.2	55%	0.552	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.3	178.7	57.2	0	0	0	0	111.5	Y790	S680-Y790 WeakPolarHBondContact CA-O 3.42Å; S680-Y790 WeakPolarHBondContact CB-O 3.18Å
681	G	88.8	Confident	87.3	Confident	24 Å²	24	71.4 Å²	71.4	25%	0.247	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	-177.9	176.9	0	0	0	0	0	112.4	Y790	G681-Y790 VanDerWaalsContact CA-CZ 3.46Å; G681-Y790 PolarHBondContact N-O 2.88Å; G681-Y790 PolarHBondContact O-N 3.47Å
682	M	89.9	Confident	87.7	Confident	116 Å²	116	75.6 Å²	75.6	57%	0.571	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.7	-178.4	-169.3	175.4	63.8	0	0	110.1	T684 I788 R789	M682-T684 HydrophobicContact CE-CG2 3.83Å; M682-T684 HydrophobicContact CG-CG2 3.93Å; M682-T684 HydrophobicContact SD-CG2 4.04Å; M682-I788 CarbonylContact C-O 3.4Å; M682-I788 WeakPolarHBondContact CA-O 3.49Å; M682-I788 VanDerWaalsContact CG-O 3.24Å; M682-I788 WeakPolarHBondContact CG-O 3.43Å; M682-R789 HydrophobicContact CG-CG 4.21Å
683	F	90.1	Very high	87.9	Confident	37 Å²	37	71.5 Å²	71.5	16%	0.162	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.1	175.1	-177	-88.5	0	0	0	110	K685 N691 F692 V693 V777 P786 I788	F683-K685 VanDerWaalsContact CE1-O 3.23Å; F683-K685 WeakPolarHBondContact CE1-O 3.47Å; F683-K685 WeakPolarHBondContact CZ-O 3.13Å; F683-N691 HydrophobicContact CE1-CB 3.95Å; F683-N691 HydrophobicContact CE2-CB 4.47Å; F683-N691 HydrophobicContact CZ-CB 3.57Å; F683-F692 VanDerWaalsContact CE2-O 3.32Å; F683-F692 WeakPolarHBondContact CE2-O 2.99Å; F683-V693 HydrophobicContact CB-CG1 4.06Å; F683-V693 HydrophobicContact CB-CG2 4.42Å; F683-V693 HydrophobicContact CD1-CG2 4.27Å; F683-V693 HydrophobicContact CG-CG2 4.17Å; F683-V777 HydrophobicContact CD1-CG1 3.88Å; F683-V777 HydrophobicContact CE1-CG1 3.59Å; F683-V777 HydrophobicContact CZ-CG1 4.46Å; F683-P786 HydrophobicContact CD1-CB 4.46Å; F683-P786 HydrophobicContact CD1-CG 3.81Å; F683-P786 HydrophobicContact CE1-CG 3.75Å; F683-I788 HydrophobicContact CB-CB 4.23Å; F683-I788 HydrophobicContact CD1-CD1 4.19Å; F683-I788 PolarHBondContact N-O 3.27Å; F683-I788 PolarHBondContact O-N 3.18Å; F683-I788 VanDerWaalsContact O-N 3.13Å
684	T	87.9	Confident	88.2	Confident	61 Å²	61	68.8 Å²	68.8	37%	0.374	36%	0.356	S	S	.	.			trans	-137.4	-4.2	-173.4	61.6	0	0	0	0	116.2	M682 P686 P786	M682-T684 HydrophobicContact CE-CG2 3.83Å; M682-T684 HydrophobicContact CG-CG2 3.93Å; M682-T684 HydrophobicContact SD-CG2 4.04Å; T684-P686 WeakPolarHBondContact O-CD 3.48Å; T684-P786 VanDerWaalsContact CA-O 3.24Å; T684-P786 WeakPolarHBondContact CA-O 3.46Å
685	K	84	Confident	88.6	Confident	164 Å²	164	65.7 Å²	65.7	71%	0.713	35%	0.346	S	S	*	.			trans	-104.7	108.9	-172.6	-66.1	-175.3	179.3	-177.5	0	109.7	F683	F683-K685 VanDerWaalsContact CE1-O 3.23Å; F683-K685 WeakPolarHBondContact CE1-O 3.47Å; F683-K685 WeakPolarHBondContact CZ-O 3.13Å
686	P	82.9	Confident	89	Confident	38 Å²	38	63.5 Å²	63.5	25%	0.247	33%	0.331	C	S	.	.			trans	-82.6	133.8	-179	30.8	-28.7	0	0	0	111.5	T684 M783 P786	T684-P686 WeakPolarHBondContact O-CD 3.48Å; P686-M783 HydrophobicContact CB-CE 3.77Å; P686-M783 HydrophobicContact CG-CE 4.25Å; P686-M783 WeakPolarHBondContact O-CE 3.24Å; P686-P786 HydrophobicContact CB-CG 4.42Å
687	V	87	Confident	89.2	Confident	98 Å²	98	65 Å²	65	59%	0.594	34%	0.341	S	S	*	.			trans	-113.4	144	158.9	-174.3	0	0	0	0	107.4	G689 N691 M783	V687-G689 PolarHBondContact O-N 3.37Å; V687-N691 VanDerWaalsContact CA-OD1 3.32Å; V687-N691 WeakPolarHBondContact CA-OD1 3.17Å; V687-N691 WeakPolarHBondContact CB-OD1 3.39Å; V687-N691 PolarHBondContact N-OD1 3.22Å; V687-N691 PolarHBondContact O-ND2 2.94Å; V687-N691 PolarHBondContact O-OD1 2.85Å; V687-M783 VanDerWaalsContact C-CE 3.41Å
688	N	87.3	Confident	89.2	Confident	121 Å²	121	61.8 Å²	61.8	65%	0.647	33%	0.333	S	S	*	.	S	Bend	trans	-61.6	128.6	-176.8	-172.6	24.1	0	0	0	110	M783	N688-M783 HydrophobicContact CB-CE 4.2Å; N688-M783 HydrophobicContact CB-SD 3.95Å
689	G	90.3	Very high	89.1	Confident	5 Å²	5	58.2 Å²	58.2	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97.9	-149.2	-175.3	0	0	0	0	0	113.7	V687 N691 L778 S779	V687-G689 PolarHBondContact O-N 3.37Å; G689-N691 PolarHBondContact O-ND2 3.12Å; G689-L778 WeakPolarHBondContact O-CA 3.47Å; G689-S779 PolarHBondContact N-O 3.17Å; G689-S779 PolarHBondContact O-N 2.66Å
690	Y	91.4	Very high	89	Confident	49 Å²	49	55.1 Å²	55.1	19%	0.192	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.4	-176.6	-67.1	-89.8	0	0	0	111.3	A721 Y729 N732 N734 Y735 L778	Y690-A721 HydrophobicContact CD1-CB 3.99Å; Y690-A721 HydrophobicContact CE1-CB 3.81Å; Y690-Y729 AromaticContact CD1-CE1 3.72Å; Y690-Y729 HydrophobicContact CD1-CE1 3.72Å; Y690-Y729 AromaticContact CD1-CZ 3.88Å; Y690-Y729 WeakPolarHBondContact CD1-OH 3.33Å; Y690-Y729 VanDerWaalsContact CD2-OH 3.26Å; Y690-Y729 WeakPolarHBondContact CD2-OH 3.42Å; Y690-Y729 HydrophobicContact CE1-CD1 4.46Å; Y690-Y729 AromaticContact CE1-CE1 3.5Å; Y690-Y729 HydrophobicContact CE1-CE1 3.5Å; Y690-Y729 AromaticContact CE1-CZ 3.74Å; Y690-Y729 HydrophobicContact CG-CE1 4.41Å; Y690-Y729 AromaticContact CZ-CZ 3.88Å; Y690-N732 WeakPolarHBondContact CE1-O 3.07Å; Y690-N732 PolarHBondContact OH-O 3.29Å; Y690-N734 PolarHBondContact OH-N 3.42Å; Y690-Y735 HydrophobicContact CE2-CD2 4.47Å; Y690-Y735 HydrophobicContact CE2-CE1 4.3Å; Y690-Y735 HydrophobicContact CE2-CE2 4.25Å; Y690-Y735 PolarHBondContact OH-N 3.01Å; Y690-L778 HydrophobicContact CD1-CB 4.14Å; Y690-L778 HydrophobicContact CD1-CD1 4.42Å; Y690-L778 HydrophobicContact CD2-CD1 4.17Å; Y690-L778 HydrophobicContact CE1-CB 3.94Å; Y690-L778 HydrophobicContact CE1-CD1 4.22Å; Y690-L778 HydrophobicContact CE1-CD2 4.44Å; Y690-L778 HydrophobicContact CE1-CG 4.43Å; Y690-L778 HydrophobicContact CE2-CD1 3.93Å; Y690-L778 HydrophobicContact CG-CD1 4.39Å
691	N	89.9	Confident	88.9	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.064	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.9	-179.9	-61.8	-95.8	0	0	0	110.4	F683 V687 G689 V693 E776 V777	F683-N691 HydrophobicContact CE1-CB 3.95Å; F683-N691 HydrophobicContact CE2-CB 4.47Å; F683-N691 HydrophobicContact CZ-CB 3.57Å; V687-N691 VanDerWaalsContact CA-OD1 3.32Å; V687-N691 WeakPolarHBondContact CA-OD1 3.17Å; V687-N691 WeakPolarHBondContact CB-OD1 3.39Å; V687-N691 PolarHBondContact N-OD1 3.22Å; V687-N691 PolarHBondContact O-ND2 2.94Å; V687-N691 PolarHBondContact O-OD1 2.85Å; G689-N691 PolarHBondContact O-ND2 3.12Å; N691-V693 PolarHBondContact O-N 3.36Å; N691-E776 CarbonylContact O-C 3.42Å; N691-E776 WeakPolarHBondContact O-CA 3.38Å; N691-E776 VanDerWaalsContact O-CB 3.26Å; N691-E776 WeakPolarHBondContact O-CB 3.48Å; N691-V777 HydrophobicContact CB-CG1 3.75Å; N691-V777 PolarHBondContact N-O 2.7Å; N691-V777 PolarHBondContact ND2-O 2.84Å; N691-V777 PolarHBondContact O-N 2.03Å
692	F	91.8	Very high	88.9	Confident	117 Å²	117	53.3 Å²	53.3	51%	0.513	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	126.9	173.6	177.9	-95.7	0	0	0	111.5	F683 T695 T774	F683-F692 VanDerWaalsContact CE2-O 3.32Å; F683-F692 WeakPolarHBondContact CE2-O 2.99Å; F692-T695 VanDerWaalsContact CE2-OG1 3.28Å; F692-T695 WeakPolarHBondContact CE2-OG1 3.34Å; F692-T695 WeakPolarHBondContact CZ-OG1 3.46Å; F692-T774 HydrophobicContact CD2-CG2 3.79Å; F692-T774 HydrophobicContact CE2-CG2 3.78Å
693	V	90.4	Very high	89	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.055	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-58.6	176.5	179.3	0	0	0	0	110.8	F683 N691 V775 V777 I788 Y790	F683-V693 HydrophobicContact CB-CG1 4.06Å; F683-V693 HydrophobicContact CB-CG2 4.42Å; F683-V693 HydrophobicContact CD1-CG2 4.27Å; F683-V693 HydrophobicContact CG-CG2 4.17Å; N691-V693 PolarHBondContact O-N 3.36Å; V693-V775 WeakPolarHBondContact CB-O 3.12Å; V693-V775 PolarHBondContact N-O 3.32Å; V693-V777 HydrophobicContact CG2-CB 4.14Å; V693-V777 HydrophobicContact CG2-CG1 3.85Å; V693-I788 HydrophobicContact CG1-CG2 4.02Å; V693-I788 HydrophobicContact CG2-CD1 3.8Å; V693-Y790 HydrophobicContact CG1-CD1 3.88Å; V693-Y790 HydrophobicContact CG1-CE1 4.18Å
694	V	91	Very high	89.2	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	146.6	-177.9	64.8	0	0	0	0	111.5	L696 I705 V775 Y790 F792	V694-L696 HydrophobicContact CG1-CD2 4.33Å; V694-I705 HydrophobicContact CG1-CD1 4.15Å; V694-V775 HydrophobicContact CG1-CB 4.07Å; V694-V775 HydrophobicContact CG1-CG2 4.4Å; V694-V775 PolarHBondContact N-O 3.42Å; V694-V775 PolarHBondContact O-N 3.05Å; V694-Y790 HydrophobicContact CB-CD1 4.36Å; V694-Y790 HydrophobicContact CB-CD2 4.27Å; V694-Y790 HydrophobicContact CB-CE1 4.16Å; V694-Y790 HydrophobicContact CB-CE2 4.1Å; V694-Y790 HydrophobicContact CB-CG 4.4Å; V694-Y790 HydrophobicContact CG1-CD1 4.28Å; V694-Y790 HydrophobicContact CG1-CD2 4.2Å; V694-Y790 HydrophobicContact CG1-CG 4.07Å; V694-Y790 HydrophobicContact CG2-CD2 4.11Å; V694-Y790 HydrophobicContact CG2-CE2 3.75Å; V694-F792 HydrophobicContact CG2-CE1 4Å
695	T	91.4	Very high	89.6	Confident	65 Å²	65	44.9 Å²	44.9	40%	0.399	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.7	165.5	-53.6	0	0	0	0	109.2	F692 P697 L773	F692-T695 VanDerWaalsContact CE2-OG1 3.28Å; F692-T695 WeakPolarHBondContact CE2-OG1 3.34Å; F692-T695 WeakPolarHBondContact CZ-OG1 3.46Å; T695-P697 WeakPolarHBondContact O-CD 3.36Å; T695-L773 CarbonylContact C-O 3.51Å; T695-L773 WeakPolarHBondContact CA-O 3.47Å
696	L	90.4	Very high	90.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	110.6	173	-58.9	172.7	0	0	0	108.4	V694 I703 I705 L769 P772 L773 V775 F792	V694-L696 HydrophobicContact CG1-CD2 4.33Å; L696-I703 HydrophobicContact CD1-CD1 4.06Å; L696-I703 HydrophobicContact CD1-CG1 4.45Å; L696-I703 HydrophobicContact CD1-CG2 3.84Å; L696-I703 HydrophobicContact CD2-CG1 4.4Å; L696-I703 HydrophobicContact CD2-CG2 4.22Å; L696-I705 HydrophobicContact CD1-CD1 4.28Å; L696-L769 HydrophobicContact CB-CD1 3.62Å; L696-L769 HydrophobicContact CD1-CD1 4.23Å; L696-P772 CarbonylContact O-C 3.54Å; L696-P772 WeakPolarHBondContact O-CA 3.1Å; L696-L773 HydrophobicContact CB-CB 4.42Å; L696-L773 PolarHBondContact N-O 3.25Å; L696-L773 PolarHBondContact O-N 2.96Å; L696-V775 HydrophobicContact CD1-CG2 3.8Å; L696-V775 HydrophobicContact CG-CG2 4.17Å; L696-F792 HydrophobicContact CD2-CB 4.5Å; L696-F792 HydrophobicContact CD2-CD1 3.63Å; L696-F792 HydrophobicContact CD2-CE1 3.89Å; L696-F792 HydrophobicContact CD2-CG 4.01Å; L696-F792 HydrophobicContact CD2-CZ 4.44Å
697	P	90	Very high	90.5	Very high	42 Å²	42	39.8 Å²	39.8	27%	0.273	22%	0.218	S	C	.	.			trans	-73.4	164.6	-179.5	31.6	-37.2	0	0	0	112.3	T695 G699 A700 F792 M794	T695-P697 WeakPolarHBondContact O-CD 3.36Å; P697-G699 PolarHBondContact O-N 3.4Å; P697-A700 HydrophobicContact CG-CB 4.34Å; P697-A700 WeakPolarHBondContact O-CB 3.46Å; P697-A700 PolarHBondContact O-N 3.08Å; P697-A700 VanDerWaalsContact O-N 3.15Å; P697-F792 HydrophobicContact CG-CE2 4.34Å; P697-M794 HydrophobicContact CB-CE 4.28Å; P697-M794 HydrophobicContact CG-CE 3.67Å; P697-M794 HydrophobicContact CG-CG 4.37Å; P697-M794 HydrophobicContact CG-SD 3.49Å; P697-M794 WeakPolarHBondContact CG-SD 3.19Å
698	T	88.5	Confident	90.7	Very high	74 Å²	74	40.7 Å²	40.7	45%	0.454	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	137.7	168.1	-52.1	0	0	0	0	109.9	A700 L769 P772	T698-A700 VanDerWaalsContact C-N 3.32Å; T698-L769 WeakPolarHBondContact CG2-O 3.49Å; T698-P772 WeakPolarHBondContact OG1-CD 3.4Å
699	G	85.4	Confident	90.6	Very high	34 Å²	34	35 Å²	35	35%	0.351	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	-8.8	-175.7	0	0	0	0	0	114.7	P697 S701 L769	P697-G699 PolarHBondContact O-N 3.4Å; G699-S701 PolarHBondContact O-N 3.49Å; G699-L769 PolarHBondContact N-O 3.38Å
700	A	89.4	Confident	90.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.			trans	-61.7	122.2	175.6	0	0	0	0	0	110.7	P697 T698 I703 P768 L769 F792 Y793 M794	P697-A700 HydrophobicContact CG-CB 4.34Å; P697-A700 WeakPolarHBondContact O-CB 3.46Å; P697-A700 PolarHBondContact O-N 3.08Å; P697-A700 VanDerWaalsContact O-N 3.15Å; T698-A700 VanDerWaalsContact C-N 3.32Å; A700-I703 HydrophobicContact CB-CD1 4.26Å; A700-I703 HydrophobicContact CB-CG1 4.42Å; A700-P768 CarbonylContact O-C 3.56Å; A700-P768 VanDerWaalsContact O-CA 3.32Å; A700-P768 WeakPolarHBondContact O-CA 3.33Å; A700-L769 HydrophobicContact CB-CD1 4.38Å; A700-L769 PolarHBondContact O-N 2.84Å; A700-F792 HydrophobicContact CB-CD2 3.79Å; A700-F792 HydrophobicContact CB-CE2 4.33Å; A700-F792 HydrophobicContact CB-CG 4.49Å; A700-Y793 WeakPolarHBondContact CA-O 3.33Å; A700-M794 HydrophobicContact CB-SD 4.06Å
701	S	89.1	Confident	89.7	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.014	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	160.4	-177	63.1	0	0	0	0	111.9	K665 C666 G699 I703 Y793	K665-S701 PolarHBondContact O-OG 2.86Å; C666-S701 VanDerWaalsContact C-OG 3.3Å; C666-S701 PolarHBondContact O-OG 2.79Å; G699-S701 PolarHBondContact O-N 3.49Å; S701-I703 VanDerWaalsContact C-N 3.32Å; S701-I703 PolarHBondContact O-N 2.71Å; S701-Y793 PolarHBondContact N-O 3.2Å; S701-Y793 PolarHBondContact O-N 3.48Å
702	N	88.9	Confident	88.9	Confident	62 Å²	62	47.9 Å²	47.9	33%	0.332	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48	52.9	177.9	-160.3	34.5	0	0	0	113.1	A765 T766 Y793	N702-A765 CarbonylContact C-O 3.53Å; N702-A765 VanDerWaalsContact CA-O 3.25Å; N702-A765 WeakPolarHBondContact CA-O 3.45Å; N702-A765 PolarHBondContact N-O 2.94Å; N702-T766 PolarHBondContact N-O 3.13Å; N702-Y793 HydrophobicContact CB-CD2 3.9Å; N702-Y793 HydrophobicContact CB-CE2 4.34Å
703	I	92.3	Very high	88.3	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.6	-179	-62.7	153.7	0	0	0	108.9	L696 A700 S701 I705 Q764 A765 L769 S791 F792	L696-I703 HydrophobicContact CD1-CD1 4.06Å; L696-I703 HydrophobicContact CD1-CG1 4.45Å; L696-I703 HydrophobicContact CD1-CG2 3.84Å; L696-I703 HydrophobicContact CD2-CG1 4.4Å; L696-I703 HydrophobicContact CD2-CG2 4.22Å; A700-I703 HydrophobicContact CB-CD1 4.26Å; A700-I703 HydrophobicContact CB-CG1 4.42Å; S701-I703 VanDerWaalsContact C-N 3.32Å; S701-I703 PolarHBondContact O-N 2.71Å; I703-I705 HydrophobicContact CG2-CD1 4.26Å; I703-I705 HydrophobicContact CG2-CG1 4.03Å; I703-Q764 VanDerWaalsContact O-CA 3.27Å; I703-Q764 WeakPolarHBondContact O-CA 3.22Å; I703-A765 HydrophobicContact CB-CB 4.31Å; I703-A765 HydrophobicContact CD1-CB 4.16Å; I703-A765 PolarHBondContact N-O 3.33Å; I703-A765 PolarHBondContact O-N 2.89Å; I703-L769 HydrophobicContact CD1-CD1 3.59Å; I703-L769 HydrophobicContact CD1-CD2 4.15Å; I703-L769 HydrophobicContact CD1-CG 3.62Å; I703-S791 WeakPolarHBondContact CA-O 2.93Å; I703-F792 HydrophobicContact CB-CB 4.37Å; I703-F792 HydrophobicContact CG1-CB 3.75Å
704	D	94.1	Very high	87.5	Confident	35 Å²	35	50.4 Å²	50.4	19%	0.187	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	111.5	173.6	-174.6	26.8	0	0	0	108.9	R706 Q764 Y790 S791	D704-R706 IonicContact OD1-CZ 2.91Å; D704-R706 IonicContact OD1-NE 3.33Å; D704-R706 PolarHBondContact OD1-NE 2.83Å; D704-R706 IonicContact OD1-NH2 3.65Å; D704-R706 IonicContact OD2-CZ 3.28Å; D704-R706 IonicContact OD2-NE 2.76Å; D704-R706 PolarHBondContact OD2-NE 3.16Å; D704-R706 IonicContact OD2-NH2 2.87Å; D704-R706 PolarHBondContact OD2-NH2 2.97Å; D704-Q764 HydrophobicContact CB-CG 4.4Å; D704-Q764 WeakPolarHBondContact OD1-CG 3.35Å; D704-Q764 PolarHBondContact OD1-NE2 3.23Å; D704-Y790 CarbonylContact O-C 3.58Å; D704-Y790 WeakPolarHBondContact O-CA 3.45Å; D704-S791 PolarHBondContact N-O 3.47Å; D704-S791 PolarHBondContact O-N 2.82Å
705	I	95.9	Very high	86.7	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.8	176.6	-51.5	-173	0	0	0	108	V694 L696 I703 L720 I762 L763 V775 I788 R789	V694-I705 HydrophobicContact CG1-CD1 4.15Å; L696-I705 HydrophobicContact CD1-CD1 4.28Å; I703-I705 HydrophobicContact CG2-CD1 4.26Å; I703-I705 HydrophobicContact CG2-CG1 4.03Å; I705-L720 HydrophobicContact CG2-CD1 4.39Å; I705-L720 HydrophobicContact CG2-CD2 4.21Å; I705-I762 CarbonylContact O-C 3.55Å; I705-I762 WeakPolarHBondContact O-CA 3.28Å; I705-L763 HydrophobicContact CB-CB 4.23Å; I705-L763 HydrophobicContact CD1-CD2 4.36Å; I705-L763 PolarHBondContact N-O 2.78Å; I705-L763 PolarHBondContact O-N 3.28Å; I705-V775 HydrophobicContact CD1-CB 4.16Å; I705-V775 HydrophobicContact CD1-CG1 3.92Å; I705-V775 HydrophobicContact CD1-CG2 3.71Å; I705-I788 HydrophobicContact CG2-CG2 3.77Å; I705-R789 WeakPolarHBondContact CA-O 3.35Å
706	R	94.8	Very high	86.1	Confident	91 Å²	91	50.3 Å²	50.3	34%	0.343	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	119.9	-177	-54.9	-171.7	-169.4	-155.5	6.2	110.3	D704 V760 E761 I762 I788 R789	D704-R706 IonicContact OD1-CZ 2.91Å; D704-R706 IonicContact OD1-NE 3.33Å; D704-R706 PolarHBondContact OD1-NE 2.83Å; D704-R706 IonicContact OD1-NH2 3.65Å; D704-R706 IonicContact OD2-CZ 3.28Å; D704-R706 IonicContact OD2-NE 2.76Å; D704-R706 PolarHBondContact OD2-NE 3.16Å; D704-R706 IonicContact OD2-NH2 2.87Å; D704-R706 PolarHBondContact OD2-NH2 2.97Å; R706-V760 HydrophobicContact CB-CG1 4.3Å; R706-E761 CarbonylContact C-O 3.53Å; R706-E761 VanDerWaalsContact CA-O 3.29Å; R706-E761 WeakPolarHBondContact CA-O 3.29Å; R706-I762 HydrophobicContact CG-CG1 4.34Å; R706-I788 CarbonylContact O-C 3.55Å; R706-I788 VanDerWaalsContact O-CA 3.29Å; R706-I788 WeakPolarHBondContact O-CA 3.32Å; R706-R789 PolarHBondContact N-O 2.01Å; R706-R789 PolarHBondContact O-N 3.47Å
707	Q	92.3	Very high	86	Confident	3 Å²	3	52.9 Å²	52.9	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.6	163.7	176.3	-81.1	-11.5	0	0	107.1	D716 N718 L720 V760 E761 I788	Q707-D716 PolarHBondContact NE2-OD1 2.91Å; Q707-D716 PolarHBondContact NE2-OD2 3.11Å; Q707-N718 PolarHBondContact NE2-O 3.16Å; Q707-L720 HydrophobicContact CB-CD1 4.15Å; Q707-L720 HydrophobicContact CB-CD2 4.16Å; Q707-L720 HydrophobicContact CB-CG 3.97Å; Q707-V760 CarbonylContact O-C 3.52Å; Q707-V760 VanDerWaalsContact O-CA 3.27Å; Q707-V760 WeakPolarHBondContact O-CA 3.42Å; Q707-V760 WeakPolarHBondContact O-CG1 3.28Å; Q707-E761 HydrophobicContact CB-CB 4.21Å; Q707-E761 PolarHBondContact N-O 2.9Å; Q707-E761 PolarHBondContact O-N 2.97Å; Q707-I788 HydrophobicContact CB-CG1 3.94Å; Q707-I788 HydrophobicContact CG-CG1 4.04Å
708	R	90.9	Very high	86	Confident	117 Å²	117	50.9 Å²	50.9	44%	0.442	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.8	173.6	-69.4	-172.9	178.3	-169.4	-1	108.9	Y710 V760 R787	R708-Y710 PolarHBondContact O-N 3.46Å; R708-V760 HydrophobicContact CG-CG1 4.12Å; R708-V760 HydrophobicContact CG-CG2 4.11Å; R708-R787 HydrophobicContact CB-CB 4.32Å; R708-R787 PolarHBondContact N-O 2.73Å; R708-R787 VanDerWaalsContact N-O 3.15Å; R708-R787 WeakPolarHBondContact O-CB 3.21Å
709	G	84.3	Confident	86.2	Confident	3 Å²	3	48.9 Å²	48.9	3%	0.031	25%	0.247	C	C	.	.			trans	-53	137.7	173.8	0	0	0	0	0	112.5	R711 G712 M713 Y759	G709-R711 PolarHBondContact O-N 3.28Å; G709-G712 PolarHBondContact O-N 3.12Å; G709-G712 VanDerWaalsContact O-N 3.17Å; G709-M713 VanDerWaalsContact CA-O 3.3Å; G709-M713 WeakPolarHBondContact CA-O 3.41Å; G709-Y759 PolarHBondContact N-O 3.15Å
710	Y	82.4	Confident	86.6	Confident	81 Å²	81	47.2 Å²	47.2	32%	0.318	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-57.6	123.9	174.4	-173.5	-103.1	0	0	0	110.3	R708 G712 M713 D716 P785	R708-Y710 PolarHBondContact O-N 3.46Å; Y710-G712 PolarHBondContact O-N 3.45Å; Y710-M713 WeakPolarHBondContact O-CB 3.03Å; Y710-M713 VanDerWaalsContact O-CG 3.24Å; Y710-M713 WeakPolarHBondContact O-CG 3.15Å; Y710-M713 PolarHBondContact O-N 2.76Å; Y710-D716 PolarHBondContact N-OD2 2.79Å; Y710-P785 HydrophobicContact CE2-CG 4.49Å
711	R	80	Confident	86.9	Confident	207 Å²	207	47.2 Å²	47.2	78%	0.781	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	49.4	28.8	-175.6	-62	-177	177.8	-168.1	-2	115.2	G709	G709-R711 PolarHBondContact O-N 3.28Å
712	G	74.2	Confident	87.1	Confident	48 Å²	48	47.1 Å²	47.1	50%	0.495	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	81.8	11.8	179.2	0	0	0	0	0	114.9	G709 Y710	G709-G712 PolarHBondContact O-N 3.12Å; G709-G712 VanDerWaalsContact O-N 3.17Å; Y710-G712 PolarHBondContact O-N 3.45Å
713	M	78.5	Confident	87.3	Confident	103 Å²	103	46 Å²	46	51%	0.507	22%	0.221	S	C	.	.			trans	-67	136.2	173.2	-65	177.2	94.4	0	0	110.8	G709 Y710 D716	G709-M713 VanDerWaalsContact CA-O 3.3Å; G709-M713 WeakPolarHBondContact CA-O 3.41Å; Y710-M713 WeakPolarHBondContact O-CB 3.03Å; Y710-M713 VanDerWaalsContact O-CG 3.24Å; Y710-M713 WeakPolarHBondContact O-CG 3.15Å; Y710-M713 PolarHBondContact O-N 2.76Å; M713-D716 HydrophobicContact CB-CB 4.45Å
714	V	74.3	Confident	87.2	Confident	76 Å²	76	46.9 Å²	46.9	46%	0.461	23%	0.227	S	C	.	.	S	Bend	trans	-76.2	-29.9	177	179.6	0	0	0	0	111.7
715	S	73.3	Confident	86.8	Confident	71 Å²	71	53 Å²	53	50%	0.497	25%	0.247	S	C	.	.			trans	-120.6	76.1	177.7	177.9	0	0	0	0	109.2	E717 Y719	S715-E717 PolarHBondContact O-N 2.84Å; S715-Y719 PolarHBondContact OG-OH 2.6Å
716	D	80.2	Confident	86.3	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	28%	0.276	C	S	.	.			trans	-83.7	7.5	173.4	75.1	-31.8	0	0	0	112.6	Q707 Y710 M713 N718 T784	Q707-D716 PolarHBondContact NE2-OD1 2.91Å; Q707-D716 PolarHBondContact NE2-OD2 3.11Å; Y710-D716 PolarHBondContact N-OD2 2.79Å; M713-D716 HydrophobicContact CB-CB 4.45Å; D716-N718 PolarHBondContact O-N 3.46Å; D716-N718 PolarHBondContact O-ND2 3.12Å; D716-N718 PolarHBondContact OD1-N 2.81Å; D716-N718 PolarHBondContact OD2-ND2 3.43Å; D716-T784 PolarHBondContact O-OG1 3.07Å
717	E	86.6	Confident	85.8	Confident	54 Å²	54	57.2 Å²	57.2	25%	0.252	28%	0.283	S	S	.	.	S	Bend	trans	63	22.1	178.9	-55.7	176.6	149	0	0	113.6	S715 V780 G781 K782	S715-E717 PolarHBondContact O-N 2.84Å; E717-V780 HydrophobicContact CB-CG2 4.06Å; E717-V780 WeakPolarHBondContact CB-O 3.48Å; E717-V780 PolarHBondContact O-N 3Å; E717-G781 WeakPolarHBondContact OE2-CA 3.31Å; E717-K782 PolarHBondContact OE2-N 3.41Å
718	N	90.1	Very high	85.6	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115	174.3	-65.8	-60.1	0	0	0	110.5	Q707 D716 V777 L778 S779 T784 P786	Q707-N718 PolarHBondContact NE2-O 3.16Å; D716-N718 PolarHBondContact O-N 3.46Å; D716-N718 PolarHBondContact O-ND2 3.12Å; D716-N718 PolarHBondContact OD1-N 2.81Å; D716-N718 PolarHBondContact OD2-ND2 3.43Å; N718-V777 HydrophobicContact CB-CG2 4.04Å; N718-L778 CarbonylContact C-O 3.58Å; N718-L778 VanDerWaalsContact CA-O 3.31Å; N718-L778 WeakPolarHBondContact CA-O 3.21Å; N718-S779 WeakPolarHBondContact OD1-CB 3.44Å; N718-S779 PolarHBondContact OD1-OG 2.59Å; N718-T784 PolarHBondContact ND2-O 2.97Å; N718-T784 PolarHBondContact ND2-OG1 3.09Å; N718-T784 PolarHBondContact OD1-O 2.9Å; N718-P786 HydrophobicContact CB-CB 4.24Å
719	Y	92.6	Very high	85.6	Confident	32 Å²	32	61.3 Å²	61.3	13%	0.125	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.8	-172.5	-52.5	-76.2	0	0	0	112	S715 V737 T756 E761 V777 L778 V780	S715-Y719 PolarHBondContact OG-OH 2.6Å; Y719-V737 HydrophobicContact CD1-CG1 4.21Å; Y719-V737 HydrophobicContact CD2-CG1 3.83Å; Y719-V737 HydrophobicContact CE2-CG1 4.46Å; Y719-V737 HydrophobicContact CG-CB 4.44Å; Y719-V737 HydrophobicContact CG-CG1 3.67Å; Y719-T756 HydrophobicContact CD1-CG2 3.4Å; Y719-T756 HydrophobicContact CE1-CG2 3.88Å; Y719-T756 HydrophobicContact CG-CG2 4.39Å; Y719-E761 VanDerWaalsContact CD1-OE1 3.26Å; Y719-E761 WeakPolarHBondContact CD1-OE1 3.46Å; Y719-V777 CarbonylContact O-C 3.43Å; Y719-V777 WeakPolarHBondContact O-CA 3.43Å; Y719-L778 PolarHBondContact N-O 3.04Å; Y719-L778 PolarHBondContact O-N 3.35Å; Y719-V780 HydrophobicContact CE2-CG2 4.2Å
720	L	94.6	Very high	85.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	136.4	178.5	-69.6	173.7	0	0	0	111.6	I705 Q707 N732 Y753 E761 L763 I788	I705-L720 HydrophobicContact CG2-CD1 4.39Å; I705-L720 HydrophobicContact CG2-CD2 4.21Å; Q707-L720 HydrophobicContact CB-CD1 4.15Å; Q707-L720 HydrophobicContact CB-CD2 4.16Å; Q707-L720 HydrophobicContact CB-CG 3.97Å; L720-N732 VanDerWaalsContact O-CB 3.3Å; L720-N732 WeakPolarHBondContact O-CB 3.05Å; L720-N732 PolarHBondContact O-ND2 2.7Å; L720-Y753 HydrophobicContact CB-CE2 4.15Å; L720-E761 HydrophobicContact CD1-CB 3.99Å; L720-E761 HydrophobicContact CG-CB 4.41Å; L720-E761 PolarHBondContact N-OE2 3.17Å; L720-L763 HydrophobicContact CD1-CB 4.26Å; L720-I788 HydrophobicContact CD2-CD1 4Å; L720-I788 HydrophobicContact CD2-CG1 4.49Å; L720-I788 HydrophobicContact CD2-CG2 4.31Å
721	A	94.9	Very high	86.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.3	176.7	0	0	0	0	0	111.1	Y690 Y729 N732 E776	Y690-A721 HydrophobicContact CD1-CB 3.99Å; Y690-A721 HydrophobicContact CE1-CB 3.81Å; A721-Y729 HydrophobicContact CB-CD1 4.42Å; A721-Y729 HydrophobicContact CB-CE1 4.22Å; A721-N732 HydrophobicContact CB-CB 4.2Å; A721-N732 VanDerWaalsContact CB-O 3.32Å; A721-N732 WeakPolarHBondContact CB-O 3.37Å; A721-E776 HydrophobicContact CB-CB 4.31Å; A721-E776 PolarHBondContact N-O 2.97Å; A721-E776 PolarHBondContact O-N 2.03Å
722	V	95.3	Very high	86.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.3	-177.9	-176	0	0	0	0	110.5	Y729 L730 L731 L751 L763 L773 T774	V722-Y729 CarbonylContact O-C 3.56Å; V722-Y729 WeakPolarHBondContact O-CA 3.06Å; V722-L730 PolarHBondContact O-N 2.79Å; V722-L731 HydrophobicContact CB-CB 4Å; V722-L731 HydrophobicContact CG2-CB 4.16Å; V722-L731 HydrophobicContact CG2-CD2 4.06Å; V722-L731 PolarHBondContact N-O 3.26Å; V722-L731 VanDerWaalsContact N-O 3.08Å; V722-L731 PolarHBondContact O-N 3.07Å; V722-L751 HydrophobicContact CG1-CD2 4.44Å; V722-L763 HydrophobicContact CG2-CD1 4.34Å; V722-L763 HydrophobicContact CG2-CD2 3.53Å; V722-L773 HydrophobicContact CG1-CB 4.27Å; V722-L773 HydrophobicContact CG1-CD1 4.45Å; V722-T774 CarbonylContact C-O 3.51Å; V722-T774 WeakPolarHBondContact CA-O 3.47Å
723	K	92.2	Very high	87.5	Confident	37 Å²	37	48.5 Å²	48.5	16%	0.161	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.5	174.8	-66.6	174.7	179.3	161.4	0	111.4	K728 Y729 T774 E776	K723-K728 WeakPolarHBondContact CA-O 3.04Å; K723-Y729 HydrophobicContact CD-CD1 4.38Å; K723-Y729 HydrophobicContact CD-CE1 4.04Å; K723-Y729 VanDerWaalsContact CE-CE2 3.47Å; K723-Y729 WeakPolarHBondContact CE-OH 3.46Å; K723-Y729 HydrophobicContact CG-CD1 3.59Å; K723-Y729 HydrophobicContact CG-CE1 3.72Å; K723-Y729 HydrophobicContact CG-CG 4.02Å; K723-Y729 PolarHBondContact NZ-OH 3.22Å; K723-T774 PolarHBondContact N-O 2.87Å; K723-T774 PolarHBondContact O-N 2.03Å; K723-E776 WeakPolarHBondContact CE-OE2 3.5Å; K723-E776 IonicContact NZ-OE1 2.87Å; K723-E776 PolarHBondContact NZ-OE1 3.5Å; K723-E776 IonicContact NZ-OE2 3.41Å; K723-E776 PolarHBondContact NZ-OE2 3.37Å
724	N	89.5	Confident	87.9	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.118	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	176.5	168	73.3	6.2	0	0	0	111.9	H726 G727 K728 L730	N724-H726 PolarHBondContact O-N 2.95Å; N724-H726 VanDerWaalsContact O-N 3.09Å; N724-H726 WeakPolarHBondContact OD1-CA 3.4Å; N724-H726 PolarHBondContact OD1-N 3.15Å; N724-G727 PolarHBondContact O-N 3.01Å; N724-G727 PolarHBondContact OD1-N 2.85Å; N724-K728 PolarHBondContact N-O 3.06Å; N724-K728 PolarHBondContact OD1-N 2.84Å; N724-K728 PolarHBondContact OD1-O 3.25Å; N724-L730 HydrophobicContact CB-CD1 4.03Å; N724-L730 HydrophobicContact CB-CG 4.31Å
725	R	85.2	Confident	88.4	Confident	163 Å²	163	53.9 Å²	53.9	62%	0.615	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-21.7	177.2	76.9	-178.9	-170.6	-171.2	-0.6	115.6	P772	R725-P772 HydrophobicContact CB-CG 4.14Å
726	H	86.6	Confident	89	Confident	133 Å²	133	55.3 Å²	55.3	62%	0.616	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	6.7	-179.8	-49	105.8	0	0	0	112.2	N724 K728	N724-H726 PolarHBondContact O-N 2.95Å; N724-H726 VanDerWaalsContact O-N 3.09Å; N724-H726 WeakPolarHBondContact OD1-CA 3.4Å; N724-H726 PolarHBondContact OD1-N 3.15Å; H726-K728 VanDerWaalsContact C-N 3.33Å; H726-K728 PolarHBondContact O-N 3.42Å
727	G	83.3	Confident	89.4	Confident	47 Å²	47	57.7 Å²	57.7	49%	0.485	28%	0.284	S	S	.	.	S	Bend	trans	80.7	3.7	179.8	0	0	0	0	0	115.4	N724	N724-G727 PolarHBondContact O-N 3.01Å; N724-G727 PolarHBondContact OD1-N 2.85Å
728	K	89.4	Confident	89.3	Confident	147 Å²	147	56.3 Å²	56.3	64%	0.639	28%	0.28	S	S	*	.			trans	-79.1	128	176.9	-177.4	-179.8	179.1	178.5	0	110.3	K723 N724 H726 L730	K723-K728 WeakPolarHBondContact CA-O 3.04Å; N724-K728 PolarHBondContact N-O 3.06Å; N724-K728 PolarHBondContact OD1-N 2.84Å; N724-K728 PolarHBondContact OD1-O 3.25Å; H726-K728 VanDerWaalsContact C-N 3.33Å; H726-K728 PolarHBondContact O-N 3.42Å; K728-L730 PolarHBondContact O-N 3.37Å
729	Y	90.7	Very high	89	Confident	59 Å²	59	58.8 Å²	58.8	23%	0.231	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	126.9	174	-71.3	-85	0	0	0	111.6	Y690 A721 V722 K723	Y690-Y729 AromaticContact CD1-CE1 3.72Å; Y690-Y729 HydrophobicContact CD1-CE1 3.72Å; Y690-Y729 AromaticContact CD1-CZ 3.88Å; Y690-Y729 WeakPolarHBondContact CD1-OH 3.33Å; Y690-Y729 VanDerWaalsContact CD2-OH 3.26Å; Y690-Y729 WeakPolarHBondContact CD2-OH 3.42Å; Y690-Y729 HydrophobicContact CE1-CD1 4.46Å; Y690-Y729 AromaticContact CE1-CE1 3.5Å; Y690-Y729 HydrophobicContact CE1-CE1 3.5Å; Y690-Y729 AromaticContact CE1-CZ 3.74Å; Y690-Y729 HydrophobicContact CG-CE1 4.41Å; Y690-Y729 AromaticContact CZ-CZ 3.88Å; A721-Y729 HydrophobicContact CB-CD1 4.42Å; A721-Y729 HydrophobicContact CB-CE1 4.22Å; V722-Y729 CarbonylContact O-C 3.56Å; V722-Y729 WeakPolarHBondContact O-CA 3.06Å; K723-Y729 HydrophobicContact CD-CD1 4.38Å; K723-Y729 HydrophobicContact CD-CE1 4.04Å; K723-Y729 VanDerWaalsContact CE-CE2 3.47Å; K723-Y729 WeakPolarHBondContact CE-OH 3.46Å; K723-Y729 HydrophobicContact CG-CD1 3.59Å; K723-Y729 HydrophobicContact CG-CE1 3.72Å; K723-Y729 HydrophobicContact CG-CG 4.02Å; K723-Y729 PolarHBondContact NZ-OH 3.22Å
730	L	89.7	Confident	88.6	Confident	42 Å²	42	61.9 Å²	61.9	22%	0.22	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-30.2	172.5	-59.2	173.4	0	0	0	111	V722 N724 K728 L744 L746 L773	V722-L730 PolarHBondContact O-N 2.79Å; N724-L730 HydrophobicContact CB-CD1 4.03Å; N724-L730 HydrophobicContact CB-CG 4.31Å; K728-L730 PolarHBondContact O-N 3.37Å; L730-L744 VanDerWaalsContact O-CD2 3.29Å; L730-L744 WeakPolarHBondContact O-CD2 3.3Å; L730-L746 HydrophobicContact CD1-CD2 3.69Å; L730-L773 HydrophobicContact CD1-CD2 3.83Å
731	L	91	Very high	88.1	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	137.9	179.1	-177.9	68.6	0	0	0	110.3	V722 G733 R742 L744 Y753 L763	V722-L731 HydrophobicContact CB-CB 4Å; V722-L731 HydrophobicContact CG2-CB 4.16Å; V722-L731 HydrophobicContact CG2-CD2 4.06Å; V722-L731 PolarHBondContact N-O 3.26Å; V722-L731 VanDerWaalsContact N-O 3.08Å; V722-L731 PolarHBondContact O-N 3.07Å; L731-G733 PolarHBondContact O-N 3.33Å; L731-R742 HydrophobicContact CD1-CB 4.27Å; L731-L744 HydrophobicContact CB-CD1 3.92Å; L731-L744 HydrophobicContact CD2-CD1 4.38Å; L731-Y753 HydrophobicContact CD1-CD1 3.64Å; L731-Y753 HydrophobicContact CD1-CE1 4.06Å; L731-Y753 HydrophobicContact CD1-CG 4Å; L731-Y753 HydrophobicContact CD2-CD1 3.98Å; L731-Y753 HydrophobicContact CD2-CD2 3.61Å; L731-Y753 HydrophobicContact CD2-CE1 4.39Å; L731-Y753 HydrophobicContact CD2-CE2 4.07Å; L731-Y753 HydrophobicContact CD2-CG 3.53Å; L731-Y753 HydrophobicContact CG-CD1 4.38Å; L731-Y753 HydrophobicContact CG-CG 4.38Å; L731-L763 HydrophobicContact CD2-CD1 4.09Å
732	N	91.3	Very high	87.7	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.053	36%	0.358	C	S	.	.	S	Bend	trans	44.8	60.2	173.5	-62.1	-13.6	0	0	0	114.1	Y690 L720 A721 V736 S738 Y753	Y690-N732 WeakPolarHBondContact CE1-O 3.07Å; Y690-N732 PolarHBondContact OH-O 3.29Å; L720-N732 VanDerWaalsContact O-CB 3.3Å; L720-N732 WeakPolarHBondContact O-CB 3.05Å; L720-N732 PolarHBondContact O-ND2 2.7Å; A721-N732 HydrophobicContact CB-CB 4.2Å; A721-N732 VanDerWaalsContact CB-O 3.32Å; A721-N732 WeakPolarHBondContact CB-O 3.37Å; N732-V736 CarbonylContact C-O 3.52Å; N732-V736 VanDerWaalsContact CA-O 3.25Å; N732-V736 WeakPolarHBondContact CA-O 3.39Å; N732-S738 PolarHBondContact OD1-N 3Å; N732-Y753 PolarHBondContact ND2-OH 3.38Å; N732-Y753 VanDerWaalsContact ND2-OH 3.16Å
733	G	88.3	Confident	87.1	Confident	14 Å²	14	71.3 Å²	71.3	14%	0.144	36%	0.363	C	S	.	.			trans	-104.8	170.5	175.4	0	0	0	0	0	112.6	L731 Y735 V736	L731-G733 PolarHBondContact O-N 3.33Å; G733-Y735 PolarHBondContact O-N 3.31Å; G733-Y735 VanDerWaalsContact O-N 3.11Å; G733-V736 PolarHBondContact O-N 3.15Å
734	N	87.3	Confident	86.8	Confident	137 Å²	137	70.2 Å²	70.2	73%	0.733	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	29	176.9	-58.6	-27.1	0	0	0	114.6	Y690 V736	Y690-N734 PolarHBondContact OH-N 3.42Å; N734-V736 PolarHBondContact O-N 3.26Å
735	Y	85.2	Confident	86.2	Confident	155 Å²	155	73.2 Å²	73.2	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	21.1	-177	-58.1	-93.3	0	0	0	113.5	Y690 G733 L778 V780	Y690-Y735 HydrophobicContact CE2-CD2 4.47Å; Y690-Y735 HydrophobicContact CE2-CE1 4.3Å; Y690-Y735 HydrophobicContact CE2-CE2 4.25Å; Y690-Y735 PolarHBondContact OH-N 3.01Å; G733-Y735 PolarHBondContact O-N 3.31Å; G733-Y735 VanDerWaalsContact O-N 3.11Å; Y735-L778 HydrophobicContact CD1-CD1 3.78Å; Y735-L778 HydrophobicContact CD1-CD2 4.29Å; Y735-L778 HydrophobicContact CE1-CD1 3.79Å; Y735-V780 HydrophobicContact CD1-CG1 4.46Å
736	V	85.6	Confident	85.9	Confident	101 Å²	101	66 Å²	66	61%	0.612	35%	0.347	S	S	*	.			trans	-105.6	121.6	175.2	-178.2	0	0	0	0	108.9	N732 G733 N734	N732-V736 CarbonylContact C-O 3.52Å; N732-V736 VanDerWaalsContact CA-O 3.25Å; N732-V736 WeakPolarHBondContact CA-O 3.39Å; G733-V736 PolarHBondContact O-N 3.15Å; N734-V736 PolarHBondContact O-N 3.26Å
737	V	88.3	Confident	85.2	Confident	55 Å²	55	66.9 Å²	66.9	33%	0.333	35%	0.35	S	S	.	.			trans	-107.3	144.2	-178	-63.2	0	0	0	0	111.8	Y719 T756 L778	Y719-V737 HydrophobicContact CD1-CG1 4.21Å; Y719-V737 HydrophobicContact CD2-CG1 3.83Å; Y719-V737 HydrophobicContact CE2-CG1 4.46Å; Y719-V737 HydrophobicContact CG-CB 4.44Å; Y719-V737 HydrophobicContact CG-CG1 3.67Å; V737-T756 HydrophobicContact CB-CG2 4.22Å; V737-L778 HydrophobicContact CG1-CD2 4.21Å
738	S	85.5	Confident	84.4	Confident	24 Å²	24	66.5 Å²	66.5	17%	0.168	35%	0.346	C	S	.	.			trans	-95.6	111.5	178.2	-159.8	0	0	0	0	111.3	N732 V740 G755 T756	N732-S738 PolarHBondContact OD1-N 3Å; S738-V740 PolarHBondContact O-N 3.23Å; S738-G755 WeakPolarHBondContact O-CA 3.25Å; S738-T756 WeakPolarHBondContact O-CG2 3.35Å; S738-T756 PolarHBondContact O-N 2.67Å
739	A	83.6	Confident	83.8	Confident	52 Å²	52	59.7 Å²	59.7	43%	0.43	32%	0.316	S	S	.	.			trans	-70.6	-19.7	178.6	0	0	0	0	0	114.2	T756 S757	A739-T756 WeakPolarHBondContact CA-OG1 3.27Å; A739-S757 VanDerWaalsContact O-CB 3.29Å; A739-S757 WeakPolarHBondContact O-CB 3.45Å; A739-S757 PolarHBondContact O-N 3.39Å; A739-S757 PolarHBondContact O-OG 3.03Å
740	V	83.5	Confident	83.4	Confident	97 Å²	97	57.3 Å²	57.3	59%	0.588	31%	0.308	S	S	*	.	S	Bend	trans	-111	162.7	-173.5	-61.9	0	0	0	0	111.9	S738 R742 G755	S738-V740 PolarHBondContact O-N 3.23Å; V740-R742 PolarHBondContact O-N 3.11Å; V740-G755 WeakPolarHBondContact O-CA 3.24Å
741	E	85	Confident	83.4	Confident	72 Å²	72	55.3 Å²	55.3	34%	0.336	30%	0.297	S	S	.	.			trans	-57.8	130.9	175.7	-170	-173.5	-159.3	0	0	111.8	G603 R752 Y753	G603-E741 PolarHBondContact N-OE2 2.95Å; E741-R752 HydrophobicContact CG-CG 4.42Å; E741-R752 WeakPolarHBondContact OE1-CD 3.45Å; E741-R752 IonicContact OE1-NE 3.05Å; E741-Y753 CarbonylContact C-O 3.45Å; E741-Y753 VanDerWaalsContact CA-O 3.24Å; E741-Y753 WeakPolarHBondContact CA-O 2.95Å; E741-Y753 VanDerWaalsContact CG-O 3.31Å; E741-Y753 WeakPolarHBondContact CG-O 3.42Å
742	R	84.5	Confident	83.3	Confident	109 Å²	109	57.4 Å²	57.4	41%	0.411	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.2	-176.2	-107.6	-91.9	-171.9	132.1	0.6	110.5	L731 V740 Y753	L731-R742 HydrophobicContact CD1-CB 4.27Å; V740-R742 PolarHBondContact O-N 3.11Å; R742-Y753 HydrophobicContact CB-CD1 4.14Å; R742-Y753 PolarHBondContact N-O 3.04Å; R742-Y753 PolarHBondContact O-N 3.33Å
743	D	84	Confident	83.3	Confident	18 Å²	18	57 Å²	57	10%	0.096	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.3	173	-80.5	-14.8	0	0	0	109.8	Y601 S602 L750 R752	Y601-D743 WeakPolarHBondContact CB-OD2 3.21Å; S602-D743 WeakPolarHBondContact CB-OD2 3.27Å; S602-D743 PolarHBondContact N-OD2 3.48Å; D743-L750 HydrophobicContact CB-CD1 3.89Å; D743-R752 IonicContact OD1-CZ 3.77Å; D743-R752 IonicContact OD1-NE 2.74Å; D743-R752 PolarHBondContact OD1-NE 3.41Å; D743-R752 IonicContact OD1-NH2 3.85Å; D743-R752 PolarHBondContact OD1-NH2 2.85Å; D743-R752 IonicContact OD2-NH2 2.76Å; D743-R752 PolarHBondContact OD2-NH2 2.98Å; D743-R752 VanDerWaalsContact OD2-NH2 3.11Å
744	L	85.1	Confident	83.4	Confident	13 Å²	13	57.9 Å²	57.9	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	108.4	177.8	-55.5	165.7	0	0	0	108.2	L730 L731 L751	L730-L744 VanDerWaalsContact O-CD2 3.29Å; L730-L744 WeakPolarHBondContact O-CD2 3.3Å; L731-L744 HydrophobicContact CB-CD1 3.92Å; L731-L744 HydrophobicContact CD2-CD1 4.38Å; L744-L751 HydrophobicContact CB-CB 4.19Å; L744-L751 WeakPolarHBondContact CB-O 2.97Å; L744-L751 HydrophobicContact CD1-CD2 3.98Å; L744-L751 HydrophobicContact CD1-CG 4.41Å; L744-L751 PolarHBondContact N-O 3.15Å; L744-L751 PolarHBondContact O-N 3.16Å
745	L	77.6	Confident	83.4	Confident	85 Å²	85	51.4 Å²	51.4	45%	0.445	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.3	179	-169.2	71.5	0	0	0	109.5	E575 L750	E575-L745 WeakPolarHBondContact OE1-CD2 3.09Å; L745-L750 HydrophobicContact CD1-CD1 4.33Å
746	L	77.6	Confident	83.5	Confident	11 Å²	11	45 Å²	45	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	106.2	-172.4	-55.1	174.1	0	0	0	109.3	L730 G748 T749 L751 L773	L730-L746 HydrophobicContact CD1-CD2 3.69Å; L746-G748 VanDerWaalsContact C-N 3.32Å; L746-G748 PolarHBondContact O-N 3.37Å; L746-T749 PolarHBondContact N-O 2.86Å; L746-T749 WeakPolarHBondContact O-CA 3.22Å; L746-T749 PolarHBondContact O-N 3.47Å; L746-T749 VanDerWaalsContact O-O 3.12Å; L746-L751 HydrophobicContact CD1-CB 4.13Å; L746-L751 HydrophobicContact CD1-CD2 4.16Å; L746-L773 HydrophobicContact CD1-CD1 3.41Å; L746-L773 VanDerWaalsContact CD1-CD1 3.41Å; L746-L773 HydrophobicContact CD1-CD2 4.01Å; L746-L773 HydrophobicContact CD1-CG 4.27Å
747	K	72.9	Confident	83.3	Confident	153 Å²	153	43.9 Å²	43.9	67%	0.665	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	23.6	63.2	177.5	-69.2	-168.6	176.3	-171.4	0	114.8	Q770	K747-Q770 HydrophobicContact CB-CB 4.13Å; K747-Q770 WeakPolarHBondContact O-CB 3.35Å; K747-Q770 WeakPolarHBondContact O-CG 3.29Å
748	G	65.4	Low	83	Confident	39 Å²	39	44.3 Å²	44.3	40%	0.402	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-0.3	177.6	0	0	0	0	0	117	R572 L746	R572-G748 PolarHBondContact NH2-O 2.9Å; L746-G748 VanDerWaalsContact C-N 3.32Å; L746-G748 PolarHBondContact O-N 3.37Å
749	T	77.4	Confident	82.9	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.5	174.5	-64.8	0	0	0	0	110.9	L746 A765 R767 P768 L769	L746-T749 PolarHBondContact N-O 2.86Å; L746-T749 WeakPolarHBondContact O-CA 3.22Å; L746-T749 PolarHBondContact O-N 3.47Å; L746-T749 VanDerWaalsContact O-O 3.12Å; T749-A765 HydrophobicContact CG2-CB 4.26Å; T749-R767 HydrophobicContact CG2-CB 4.25Å; T749-R767 WeakPolarHBondContact CG2-O 2.85Å; T749-P768 PolarHBondContact OG1-O 3.19Å; T749-L769 HydrophobicContact CG2-CD2 4.02Å
750	L	83.5	Confident	83.1	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.9	177.2	-179.5	71.2	0	0	0	109.1	P637 D743 L745	P637-L750 HydrophobicContact CB-CB 3.6Å; P637-L750 HydrophobicContact CB-CD2 3.82Å; P637-L750 HydrophobicContact CB-CG 4.26Å; P637-L750 HydrophobicContact CG-CB 4.31Å; P637-L750 HydrophobicContact CG-CD2 3.9Å; D743-L750 HydrophobicContact CB-CD1 3.89Å; L745-L750 HydrophobicContact CD1-CD1 4.33Å
751	L	88.7	Confident	83.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.4	174.4	-175.3	72.9	0	0	0	108.5	V722 L744 L746 L763 A765 L773	V722-L751 HydrophobicContact CG1-CD2 4.44Å; L744-L751 HydrophobicContact CB-CB 4.19Å; L744-L751 WeakPolarHBondContact CB-O 2.97Å; L744-L751 HydrophobicContact CD1-CD2 3.98Å; L744-L751 HydrophobicContact CD1-CG 4.41Å; L744-L751 PolarHBondContact N-O 3.15Å; L744-L751 PolarHBondContact O-N 3.16Å; L746-L751 HydrophobicContact CD1-CB 4.13Å; L746-L751 HydrophobicContact CD1-CD2 4.16Å; L751-L763 HydrophobicContact CD1-CD1 4.13Å; L751-L763 HydrophobicContact CD1-CD2 4.44Å; L751-L763 HydrophobicContact CD1-CG 3.92Å; L751-L763 HydrophobicContact CD2-CD1 3.9Å; L751-L763 HydrophobicContact CD2-CD2 4.23Å; L751-L763 HydrophobicContact CD2-CG 4.23Å; L751-L763 HydrophobicContact CG-CD1 3.7Å; L751-L763 HydrophobicContact CG-CG 4.06Å; L751-A765 HydrophobicContact CD1-CB 3.64Å; L751-L773 HydrophobicContact CD2-CD1 3.89Å
752	R	89	Confident	84	Confident	49 Å²	49	42.3 Å²	42.3	19%	0.185	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128	-174	-178	160.2	-78.8	151.1	-3.5	110.7	D638 E741 D743 L763 Q764	D638-R752 IonicContact OD1-NH1 2.67Å; D638-R752 IonicContact OD2-NH1 2.84Å; D638-R752 PolarHBondContact OD2-NH1 3.15Å; E741-R752 HydrophobicContact CG-CG 4.42Å; E741-R752 WeakPolarHBondContact OE1-CD 3.45Å; E741-R752 IonicContact OE1-NE 3.05Å; D743-R752 IonicContact OD1-CZ 3.77Å; D743-R752 IonicContact OD1-NE 2.74Å; D743-R752 PolarHBondContact OD1-NE 3.41Å; D743-R752 IonicContact OD1-NH2 3.85Å; D743-R752 PolarHBondContact OD1-NH2 2.85Å; D743-R752 IonicContact OD2-NH2 2.76Å; D743-R752 PolarHBondContact OD2-NH2 2.98Å; D743-R752 VanDerWaalsContact OD2-NH2 3.11Å; R752-L763 WeakPolarHBondContact O-CA 3.47Å; R752-Q764 PolarHBondContact N-O 2.04Å; R752-Q764 PolarHBondContact O-N 3.41Å
753	Y	91.8	Very high	84.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.2	177.7	173.8	-112.6	0	0	0	110.3	L720 L731 N732 E741 R742 G755 T756 E761 I762 L763	L720-Y753 HydrophobicContact CB-CE2 4.15Å; L731-Y753 HydrophobicContact CD1-CD1 3.64Å; L731-Y753 HydrophobicContact CD1-CE1 4.06Å; L731-Y753 HydrophobicContact CD1-CG 4Å; L731-Y753 HydrophobicContact CD2-CD1 3.98Å; L731-Y753 HydrophobicContact CD2-CD2 3.61Å; L731-Y753 HydrophobicContact CD2-CE1 4.39Å; L731-Y753 HydrophobicContact CD2-CE2 4.07Å; L731-Y753 HydrophobicContact CD2-CG 3.53Å; L731-Y753 HydrophobicContact CG-CD1 4.38Å; L731-Y753 HydrophobicContact CG-CG 4.38Å; N732-Y753 PolarHBondContact ND2-OH 3.38Å; N732-Y753 VanDerWaalsContact ND2-OH 3.16Å; E741-Y753 CarbonylContact C-O 3.45Å; E741-Y753 VanDerWaalsContact CA-O 3.24Å; E741-Y753 WeakPolarHBondContact CA-O 2.95Å; E741-Y753 VanDerWaalsContact CG-O 3.31Å; E741-Y753 WeakPolarHBondContact CG-O 3.42Å; R742-Y753 HydrophobicContact CB-CD1 4.14Å; R742-Y753 PolarHBondContact N-O 3.04Å; R742-Y753 PolarHBondContact O-N 3.33Å; Y753-G755 PolarHBondContact O-N 2.99Å; Y753-T756 WeakPolarHBondContact OH-CG2 3.21Å; Y753-E761 HydrophobicContact CE2-CB 4.22Å; Y753-E761 PolarHBondContact OH-OE2 3.29Å; Y753-E761 VanDerWaalsContact OH-OE2 3.09Å; Y753-I762 CarbonylContact C-O 3.54Å; Y753-I762 VanDerWaalsContact CA-O 3.31Å; Y753-I762 WeakPolarHBondContact CA-O 3.48Å; Y753-L763 HydrophobicContact CD2-CD1 4.34Å
754	S	89.4	Confident	84.8	Confident	34 Å²	34	39.9 Å²	39.9	24%	0.238	21%	0.211	C	C	.	.			trans	-72.9	-20.5	-174.3	61	0	0	0	0	115.2	E761 I762	S754-E761 WeakPolarHBondContact OG-CA 3.35Å; S754-I762 PolarHBondContact N-O 3.35Å; S754-I762 PolarHBondContact OG-N 3.1Å
755	G	88.1	Confident	85	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.209	C	C	.	.			trans	90.1	161.7	-169.8	0	0	0	0	0	113.1	S738 V740 Y753 S757	S738-G755 WeakPolarHBondContact O-CA 3.25Å; V740-G755 WeakPolarHBondContact O-CA 3.24Å; Y753-G755 PolarHBondContact O-N 2.99Å; G755-S757 VanDerWaalsContact C-N 3.32Å
756	T	86.9	Confident	85.3	Confident	20 Å²	20	38.4 Å²	38.4	12%	0.123	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	2.1	-178.9	71.5	0	0	0	0	114	Y719 V737 S738 A739 Y753 T758 E761	Y719-T756 HydrophobicContact CD1-CG2 3.4Å; Y719-T756 HydrophobicContact CE1-CG2 3.88Å; Y719-T756 HydrophobicContact CG-CG2 4.39Å; V737-T756 HydrophobicContact CB-CG2 4.22Å; S738-T756 WeakPolarHBondContact O-CG2 3.35Å; S738-T756 PolarHBondContact O-N 2.67Å; A739-T756 WeakPolarHBondContact CA-OG1 3.27Å; Y753-T756 WeakPolarHBondContact OH-CG2 3.21Å; T756-T758 PolarHBondContact O-N 3.36Å; T756-E761 WeakPolarHBondContact CG2-OE1 2.9Å
757	S	81.6	Confident	85.5	Confident	78 Å²	78	42.5 Å²	42.5	55%	0.545	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.2	-175.8	46.9	0	0	0	0	114.2	A739 G755	A739-S757 VanDerWaalsContact O-CB 3.29Å; A739-S757 WeakPolarHBondContact O-CB 3.45Å; A739-S757 PolarHBondContact O-N 3.39Å; A739-S757 PolarHBondContact O-OG 3.03Å; G755-S757 VanDerWaalsContact C-N 3.32Å
758	T	81.1	Confident	86.1	Confident	64 Å²	64	37 Å²	37	39%	0.393	20%	0.201	S	C	.	.	S	Bend	trans	-122.8	154	179.7	68.4	0	0	0	0	110.2	T756 V760	T756-T758 PolarHBondContact O-N 3.36Å; T758-V760 PolarHBondContact O-N 2.81Å; T758-V760 PolarHBondContact OG1-O 2.72Å
759	Y	83.7	Confident	87.1	Confident	142 Å²	142	35.2 Å²	35.2	56%	0.557	18%	0.182	S	C	*	.	S	Bend	trans	-66.7	-4.3	179.8	70.3	-85.4	0	0	0	114.5	G709	G709-Y759 PolarHBondContact N-O 3.15Å
760	V	89.5	Confident	87.4	Confident	17 Å²	17	40.6 Å²	40.6	10%	0.103	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	109.8	173	-172.2	0	0	0	0	109.2	R706 Q707 R708 T758 I762	R706-V760 HydrophobicContact CB-CG1 4.3Å; Q707-V760 CarbonylContact O-C 3.52Å; Q707-V760 VanDerWaalsContact O-CA 3.27Å; Q707-V760 WeakPolarHBondContact O-CA 3.42Å; Q707-V760 WeakPolarHBondContact O-CG1 3.28Å; R708-V760 HydrophobicContact CG-CG1 4.12Å; R708-V760 HydrophobicContact CG-CG2 4.11Å; T758-V760 PolarHBondContact O-N 2.81Å; T758-V760 PolarHBondContact OG1-O 2.72Å; V760-I762 HydrophobicContact CG1-CD1 4.24Å; V760-I762 HydrophobicContact CG1-CG1 3.78Å
761	E	92.6	Very high	87.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.5	167.1	-61.9	-179.8	-166.6	0	0	110.2	R706 Q707 Y719 L720 Y753 S754 T756	R706-E761 CarbonylContact C-O 3.53Å; R706-E761 VanDerWaalsContact CA-O 3.29Å; R706-E761 WeakPolarHBondContact CA-O 3.29Å; Q707-E761 HydrophobicContact CB-CB 4.21Å; Q707-E761 PolarHBondContact N-O 2.9Å; Q707-E761 PolarHBondContact O-N 2.97Å; Y719-E761 VanDerWaalsContact CD1-OE1 3.26Å; Y719-E761 WeakPolarHBondContact CD1-OE1 3.46Å; L720-E761 HydrophobicContact CD1-CB 3.99Å; L720-E761 HydrophobicContact CG-CB 4.41Å; L720-E761 PolarHBondContact N-OE2 3.17Å; Y753-E761 HydrophobicContact CE2-CB 4.22Å; Y753-E761 PolarHBondContact OH-OE2 3.29Å; Y753-E761 VanDerWaalsContact OH-OE2 3.09Å; S754-E761 WeakPolarHBondContact OG-CA 3.35Å; T756-E761 WeakPolarHBondContact CG2-OE1 2.9Å
762	I	93.3	Very high	87.6	Confident	42 Å²	42	43.6 Å²	43.6	22%	0.215	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.8	-175.9	-58.8	178.2	0	0	0	108.7	I705 R706 Y753 S754 V760 Q764	I705-I762 CarbonylContact O-C 3.55Å; I705-I762 WeakPolarHBondContact O-CA 3.28Å; R706-I762 HydrophobicContact CG-CG1 4.34Å; Y753-I762 CarbonylContact C-O 3.54Å; Y753-I762 VanDerWaalsContact CA-O 3.31Å; Y753-I762 WeakPolarHBondContact CA-O 3.48Å; S754-I762 PolarHBondContact N-O 3.35Å; S754-I762 PolarHBondContact OG-N 3.1Å; V760-I762 HydrophobicContact CG1-CD1 4.24Å; V760-I762 HydrophobicContact CG1-CG1 3.78Å; I762-Q764 HydrophobicContact CG2-CB 4.43Å; I762-Q764 HydrophobicContact CG2-CG 3.52Å; I762-Q764 VanDerWaalsContact CG2-NE2 3.32Å
763	L	94.1	Very high	87.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116	170.4	-174.3	75.7	0	0	0	108.9	I705 L720 V722 L731 L751 R752 Y753 V775	I705-L763 HydrophobicContact CB-CB 4.23Å; I705-L763 HydrophobicContact CD1-CD2 4.36Å; I705-L763 PolarHBondContact N-O 2.78Å; I705-L763 PolarHBondContact O-N 3.28Å; L720-L763 HydrophobicContact CD1-CB 4.26Å; V722-L763 HydrophobicContact CG2-CD1 4.34Å; V722-L763 HydrophobicContact CG2-CD2 3.53Å; L731-L763 HydrophobicContact CD2-CD1 4.09Å; L751-L763 HydrophobicContact CD1-CD1 4.13Å; L751-L763 HydrophobicContact CD1-CD2 4.44Å; L751-L763 HydrophobicContact CD1-CG 3.92Å; L751-L763 HydrophobicContact CD2-CD1 3.9Å; L751-L763 HydrophobicContact CD2-CD2 4.23Å; L751-L763 HydrophobicContact CD2-CG 4.23Å; L751-L763 HydrophobicContact CG-CD1 3.7Å; L751-L763 HydrophobicContact CG-CG 4.06Å; R752-L763 WeakPolarHBondContact O-CA 3.47Å; Y753-L763 HydrophobicContact CD2-CD1 4.34Å; L763-V775 HydrophobicContact CD2-CG1 4.45Å; L763-V775 HydrophobicContact CD2-CG2 4.24Å
764	Q	92.3	Very high	87.9	Confident	77 Å²	77	42.8 Å²	42.8	36%	0.36	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143	-171.1	-78.7	174.6	-3.2	0	0	113.8	I703 D704 R752 I762	I703-Q764 VanDerWaalsContact O-CA 3.27Å; I703-Q764 WeakPolarHBondContact O-CA 3.22Å; D704-Q764 HydrophobicContact CB-CG 4.4Å; D704-Q764 WeakPolarHBondContact OD1-CG 3.35Å; D704-Q764 PolarHBondContact OD1-NE2 3.23Å; R752-Q764 PolarHBondContact N-O 2.04Å; R752-Q764 PolarHBondContact O-N 3.41Å; I762-Q764 HydrophobicContact CG2-CB 4.43Å; I762-Q764 HydrophobicContact CG2-CG 3.52Å; I762-Q764 VanDerWaalsContact CG2-NE2 3.32Å
765	A	89.1	Confident	88.2	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.033	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	127.8	170.1	0	0	0	0	0	111.2	N702 I703 T749 L751	N702-A765 CarbonylContact C-O 3.53Å; N702-A765 VanDerWaalsContact CA-O 3.25Å; N702-A765 WeakPolarHBondContact CA-O 3.45Å; N702-A765 PolarHBondContact N-O 2.94Å; I703-A765 HydrophobicContact CB-CB 4.31Å; I703-A765 HydrophobicContact CD1-CB 4.16Å; I703-A765 PolarHBondContact N-O 3.33Å; I703-A765 PolarHBondContact O-N 2.89Å; T749-A765 HydrophobicContact CG2-CB 4.26Å; L751-A765 HydrophobicContact CD1-CB 3.64Å
766	T	83.6	Confident	88.5	Confident	63 Å²	63	42.1 Å²	42.1	39%	0.387	22%	0.218	S	C	.	.			trans	-82.2	-40	-179.2	-41	0	0	0	0	112.3	N702	N702-T766 PolarHBondContact N-O 3.13Å
767	R	81.7	Confident	88.8	Confident	96 Å²	96	41.1 Å²	41.1	36%	0.362	21%	0.212	S	C	.	.	S	Bend	trans	-87.2	153.3	-173.3	-66.8	-129.9	-117.7	-166.6	-1.8	112.3	P637 T749	P637-R767 PolarHBondContact O-NE 3.3Å; P637-R767 PolarHBondContact O-NH2 2.89Å; T749-R767 HydrophobicContact CG2-CB 4.25Å; T749-R767 WeakPolarHBondContact CG2-O 2.85Å
768	P	86.1	Confident	89.4	Confident	38 Å²	38	37.6 Å²	37.6	25%	0.247	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-55.9	137.5	175.7	-22.6	31.6	0	0	0	112.5	A700 T749	A700-P768 CarbonylContact O-C 3.56Å; A700-P768 VanDerWaalsContact O-CA 3.32Å; A700-P768 WeakPolarHBondContact O-CA 3.33Å; T749-P768 PolarHBondContact OG1-O 3.19Å
769	L	86.6	Confident	89.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-69	138.8	172.8	-69	178.2	0	0	0	111.6	L696 T698 G699 A700 I703 T749 L773	L696-L769 HydrophobicContact CB-CD1 3.62Å; L696-L769 HydrophobicContact CD1-CD1 4.23Å; T698-L769 WeakPolarHBondContact CG2-O 3.49Å; G699-L769 PolarHBondContact N-O 3.38Å; A700-L769 HydrophobicContact CB-CD1 4.38Å; A700-L769 PolarHBondContact O-N 2.84Å; I703-L769 HydrophobicContact CD1-CD1 3.59Å; I703-L769 HydrophobicContact CD1-CD2 4.15Å; I703-L769 HydrophobicContact CD1-CG 3.62Å; T749-L769 HydrophobicContact CG2-CD2 4.02Å; L769-L773 HydrophobicContact CD1-CD1 3.9Å; L769-L773 HydrophobicContact CD1-CG 4.18Å; L769-L773 HydrophobicContact CD2-CD1 3.83Å
770	Q	83.7	Confident	90	Very high	117 Å²	117	29.7 Å²	29.7	55%	0.547	15%	0.154	S	C	.	.	S	Bend	trans	-93.4	-10.1	173.4	-61.4	-58.6	-29.1	0	0	113	K747	K747-Q770 HydrophobicContact CB-CB 4.13Å; K747-Q770 WeakPolarHBondContact O-CB 3.35Å; K747-Q770 WeakPolarHBondContact O-CG 3.29Å
771	E	85.9	Confident	89.7	Confident	32 Å²	32	31.6 Å²	31.6	15%	0.15	18%	0.176	C	C	.	.	S	Bend	trans	-144.2	150.8	176	63.9	-177.2	172.5	0	0	110.3
772	P	89.9	Confident	89	Confident	40 Å²	40	39.9 Å²	39.9	26%	0.26	21%	0.212	S	C	.	.			trans	-75.9	143.6	-179.1	30.8	-33.1	0	0	0	111.3	L696 T698 R725	L696-P772 CarbonylContact O-C 3.54Å; L696-P772 WeakPolarHBondContact O-CA 3.1Å; T698-P772 WeakPolarHBondContact OG1-CD 3.4Å; R725-P772 HydrophobicContact CB-CG 4.14Å
773	L	93.5	Very high	88.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	142.7	-179.6	-59	174.5	0	0	0	110.7	T695 L696 V722 L730 L746 L751 L769	T695-L773 CarbonylContact C-O 3.51Å; T695-L773 WeakPolarHBondContact CA-O 3.47Å; L696-L773 HydrophobicContact CB-CB 4.42Å; L696-L773 PolarHBondContact N-O 3.25Å; L696-L773 PolarHBondContact O-N 2.96Å; V722-L773 HydrophobicContact CG1-CB 4.27Å; V722-L773 HydrophobicContact CG1-CD1 4.45Å; L730-L773 HydrophobicContact CD1-CD2 3.83Å; L746-L773 HydrophobicContact CD1-CD1 3.41Å; L746-L773 VanDerWaalsContact CD1-CD1 3.41Å; L746-L773 HydrophobicContact CD1-CD2 4.01Å; L746-L773 HydrophobicContact CD1-CG 4.27Å; L751-L773 HydrophobicContact CD2-CD1 3.89Å; L769-L773 HydrophobicContact CD1-CD1 3.9Å; L769-L773 HydrophobicContact CD1-CG 4.18Å; L769-L773 HydrophobicContact CD2-CD1 3.83Å
774	T	93.8	Very high	88	Confident	31 Å²	31	41.9 Å²	41.9	19%	0.19	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.3	172.9	-57.2	0	0	0	0	109.1	F692 V722 K723 E776	F692-T774 HydrophobicContact CD2-CG2 3.79Å; F692-T774 HydrophobicContact CE2-CG2 3.78Å; V722-T774 CarbonylContact C-O 3.51Å; V722-T774 WeakPolarHBondContact CA-O 3.47Å; K723-T774 PolarHBondContact N-O 2.87Å; K723-T774 PolarHBondContact O-N 2.03Å; T774-E776 HydrophobicContact CG2-CG 4.23Å
775	V	94.8	Very high	87.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.2	176.5	-176.7	0	0	0	0	108.7	V693 V694 L696 I705 L763	V693-V775 WeakPolarHBondContact CB-O 3.12Å; V693-V775 PolarHBondContact N-O 3.32Å; V694-V775 HydrophobicContact CG1-CB 4.07Å; V694-V775 HydrophobicContact CG1-CG2 4.4Å; V694-V775 PolarHBondContact N-O 3.42Å; V694-V775 PolarHBondContact O-N 3.05Å; L696-V775 HydrophobicContact CD1-CG2 3.8Å; L696-V775 HydrophobicContact CG-CG2 4.17Å; I705-V775 HydrophobicContact CD1-CB 4.16Å; I705-V775 HydrophobicContact CD1-CG1 3.92Å; I705-V775 HydrophobicContact CD1-CG2 3.71Å; L763-V775 HydrophobicContact CD2-CG1 4.45Å; L763-V775 HydrophobicContact CD2-CG2 4.24Å
776	E	94.8	Very high	87.6	Confident	20 Å²	20	40.8 Å²	40.8	9%	0.093	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	166.3	-180	-67.1	179.9	162	0	0	110.5	N691 A721 K723 T774	N691-E776 CarbonylContact O-C 3.42Å; N691-E776 WeakPolarHBondContact O-CA 3.38Å; N691-E776 VanDerWaalsContact O-CB 3.26Å; N691-E776 WeakPolarHBondContact O-CB 3.48Å; A721-E776 HydrophobicContact CB-CB 4.31Å; A721-E776 PolarHBondContact N-O 2.97Å; A721-E776 PolarHBondContact O-N 2.03Å; K723-E776 WeakPolarHBondContact CE-OE2 3.5Å; K723-E776 IonicContact NZ-OE1 2.87Å; K723-E776 PolarHBondContact NZ-OE1 3.5Å; K723-E776 IonicContact NZ-OE2 3.41Å; K723-E776 PolarHBondContact NZ-OE2 3.37Å; T774-E776 HydrophobicContact CG2-CG 4.23Å
777	V	93.5	Very high	88	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.4	166.8	59.6	0	0	0	0	110.2	F683 N691 V693 N718 Y719 S779 I788	F683-V777 HydrophobicContact CD1-CG1 3.88Å; F683-V777 HydrophobicContact CE1-CG1 3.59Å; F683-V777 HydrophobicContact CZ-CG1 4.46Å; N691-V777 HydrophobicContact CB-CG1 3.75Å; N691-V777 PolarHBondContact N-O 2.7Å; N691-V777 PolarHBondContact ND2-O 2.84Å; N691-V777 PolarHBondContact O-N 2.03Å; V693-V777 HydrophobicContact CG2-CB 4.14Å; V693-V777 HydrophobicContact CG2-CG1 3.85Å; N718-V777 HydrophobicContact CB-CG2 4.04Å; Y719-V777 CarbonylContact O-C 3.43Å; Y719-V777 WeakPolarHBondContact O-CA 3.43Å; V777-S779 PolarHBondContact O-N 2.89Å; V777-I788 HydrophobicContact CB-CD1 3.45Å; V777-I788 VanDerWaalsContact CB-CD1 3.45Å; V777-I788 HydrophobicContact CG1-CD1 3.61Å; V777-I788 HydrophobicContact CG2-CD1 3.79Å
778	L	93	Very high	88.5	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	107.8	169.4	175.7	61.3	0	0	0	108.6	G689 Y690 N718 Y719 Y735 V737 V780	G689-L778 WeakPolarHBondContact O-CA 3.47Å; Y690-L778 HydrophobicContact CD1-CB 4.14Å; Y690-L778 HydrophobicContact CD1-CD1 4.42Å; Y690-L778 HydrophobicContact CD2-CD1 4.17Å; Y690-L778 HydrophobicContact CE1-CB 3.94Å; Y690-L778 HydrophobicContact CE1-CD1 4.22Å; Y690-L778 HydrophobicContact CE1-CD2 4.44Å; Y690-L778 HydrophobicContact CE1-CG 4.43Å; Y690-L778 HydrophobicContact CE2-CD1 3.93Å; Y690-L778 HydrophobicContact CG-CD1 4.39Å; N718-L778 CarbonylContact C-O 3.58Å; N718-L778 VanDerWaalsContact CA-O 3.31Å; N718-L778 WeakPolarHBondContact CA-O 3.21Å; Y719-L778 PolarHBondContact N-O 3.04Å; Y719-L778 PolarHBondContact O-N 3.35Å; Y735-L778 HydrophobicContact CD1-CD1 3.78Å; Y735-L778 HydrophobicContact CD1-CD2 4.29Å; Y735-L778 HydrophobicContact CE1-CD1 3.79Å; V737-L778 HydrophobicContact CG1-CD2 4.21Å; L778-V780 HydrophobicContact CD1-CG1 3.68Å; L778-V780 HydrophobicContact CG-CG1 3.93Å
779	S	91.8	Very high	88.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.1	173.3	-66.2	0	0	0	0	109	G689 N718 V777	G689-S779 PolarHBondContact N-O 3.17Å; G689-S779 PolarHBondContact O-N 2.66Å; N718-S779 WeakPolarHBondContact OD1-CB 3.44Å; N718-S779 PolarHBondContact OD1-OG 2.59Å; V777-S779 PolarHBondContact O-N 2.89Å
780	V	87	Confident	89.2	Confident	40 Å²	40	46.1 Å²	46.1	24%	0.242	23%	0.231	C	C	.	.			trans	-130.2	169.5	-179.3	-65.3	0	0	0	0	111.5	E717 Y719 Y735 L778 K782	E717-V780 HydrophobicContact CB-CG2 4.06Å; E717-V780 WeakPolarHBondContact CB-O 3.48Å; E717-V780 PolarHBondContact O-N 3Å; Y719-V780 HydrophobicContact CE2-CG2 4.2Å; Y735-V780 HydrophobicContact CD1-CG1 4.46Å; L778-V780 HydrophobicContact CD1-CG1 3.68Å; L778-V780 HydrophobicContact CG-CG1 3.93Å; V780-K782 PolarHBondContact O-N 2.71Å
781	G	83.1	Confident	89.7	Confident	56 Å²	56	41.7 Å²	41.7	58%	0.577	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	-119.4	171.8	0	0	0	0	0	114.2	E717 M783	E717-G781 WeakPolarHBondContact OE2-CA 3.31Å; G781-M783 PolarHBondContact O-N 2.86Å; G781-M783 VanDerWaalsContact O-N 3.15Å
782	K	77.7	Confident	90	Very high	177 Å²	177	40.5 Å²	40.5	77%	0.77	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	4.6	-173.7	-65	-177.4	-179.5	178.4	0	114.1	E717 V780 T784	E717-K782 PolarHBondContact OE2-N 3.41Å; V780-K782 PolarHBondContact O-N 2.71Å; K782-T784 HydrophobicContact CB-CG2 4.15Å; K782-T784 PolarHBondContact O-N 3.25Å; K782-T784 VanDerWaalsContact O-N 3.16Å
783	M	81.8	Confident	90	Very high	62 Å²	62	40 Å²	40	31%	0.305	20%	0.2	S	C	.	.			trans	52.8	40.3	175.3	-65.9	-61.3	-69.4	0	0	112.4	P686 V687 N688 G781	P686-M783 HydrophobicContact CB-CE 3.77Å; P686-M783 HydrophobicContact CG-CE 4.25Å; P686-M783 WeakPolarHBondContact O-CE 3.24Å; V687-M783 VanDerWaalsContact C-CE 3.41Å; N688-M783 HydrophobicContact CB-CE 4.2Å; N688-M783 HydrophobicContact CB-SD 3.95Å; G781-M783 PolarHBondContact O-N 2.86Å; G781-M783 VanDerWaalsContact O-N 3.15Å
784	T	84.4	Confident	89.9	Confident	22 Å²	22	42.2 Å²	42.2	14%	0.135	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-65.4	140.5	-179.6	79.6	0	0	0	0	109.7	D716 N718 K782 P786	D716-T784 PolarHBondContact O-OG1 3.07Å; N718-T784 PolarHBondContact ND2-O 2.97Å; N718-T784 PolarHBondContact ND2-OG1 3.09Å; N718-T784 PolarHBondContact OD1-O 2.9Å; K782-T784 HydrophobicContact CB-CG2 4.15Å; K782-T784 PolarHBondContact O-N 3.25Å; K782-T784 VanDerWaalsContact O-N 3.16Å; T784-P786 VanDerWaalsContact O-CD 3.29Å; T784-P786 WeakPolarHBondContact O-CD 3.11Å
785	P	85.6	Confident	89.4	Confident	57 Å²	57	45.3 Å²	45.3	37%	0.37	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-62.4	119.8	-177.2	-24.8	34.3	0	0	0	112	Y710	Y710-P785 HydrophobicContact CE2-CG 4.49Å
786	P	88	Confident	88.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-64.5	150.8	176.9	24.4	-32.4	0	0	0	109.9	F683 T684 P686 N718 T784 I788	F683-P786 HydrophobicContact CD1-CB 4.46Å; F683-P786 HydrophobicContact CD1-CG 3.81Å; F683-P786 HydrophobicContact CE1-CG 3.75Å; T684-P786 VanDerWaalsContact CA-O 3.24Å; T684-P786 WeakPolarHBondContact CA-O 3.46Å; P686-P786 HydrophobicContact CB-CG 4.42Å; N718-P786 HydrophobicContact CB-CB 4.24Å; T784-P786 VanDerWaalsContact O-CD 3.29Å; T784-P786 WeakPolarHBondContact O-CD 3.11Å; P786-I788 HydrophobicContact CB-CD1 4.28Å; P786-I788 HydrophobicContact CB-CG1 4.2Å
787	R	90.9	Very high	87	Confident	115 Å²	115	58 Å²	58	43%	0.434	29%	0.291	S	S	.	.			trans	-124	67.7	177.4	-56.6	177.2	68.5	-173.3	6.4	110.1	R708	R708-R787 HydrophobicContact CB-CB 4.32Å; R708-R787 PolarHBondContact N-O 2.73Å; R708-R787 VanDerWaalsContact N-O 3.15Å; R708-R787 WeakPolarHBondContact O-CB 3.21Å
788	I	92.4	Very high	84.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	126	-174.4	-52	175.1	0	0	0	109.6	M682 F683 V693 I705 R706 Q707 L720 V777 P786	M682-I788 CarbonylContact C-O 3.4Å; M682-I788 WeakPolarHBondContact CA-O 3.49Å; M682-I788 VanDerWaalsContact CG-O 3.24Å; M682-I788 WeakPolarHBondContact CG-O 3.43Å; F683-I788 HydrophobicContact CB-CB 4.23Å; F683-I788 HydrophobicContact CD1-CD1 4.19Å; F683-I788 PolarHBondContact N-O 3.27Å; F683-I788 PolarHBondContact O-N 3.18Å; F683-I788 VanDerWaalsContact O-N 3.13Å; V693-I788 HydrophobicContact CG1-CG2 4.02Å; V693-I788 HydrophobicContact CG2-CD1 3.8Å; I705-I788 HydrophobicContact CG2-CG2 3.77Å; R706-I788 CarbonylContact O-C 3.55Å; R706-I788 VanDerWaalsContact O-CA 3.29Å; R706-I788 WeakPolarHBondContact O-CA 3.32Å; Q707-I788 HydrophobicContact CB-CG1 3.94Å; Q707-I788 HydrophobicContact CG-CG1 4.04Å; L720-I788 HydrophobicContact CD2-CD1 4Å; L720-I788 HydrophobicContact CD2-CG1 4.49Å; L720-I788 HydrophobicContact CD2-CG2 4.31Å; V777-I788 HydrophobicContact CB-CD1 3.45Å; V777-I788 VanDerWaalsContact CB-CD1 3.45Å; V777-I788 HydrophobicContact CG1-CD1 3.61Å; V777-I788 HydrophobicContact CG2-CD1 3.79Å; P786-I788 HydrophobicContact CB-CD1 4.28Å; P786-I788 HydrophobicContact CB-CG1 4.2Å
789	R	93.4	Very high	82.6	Confident	150 Å²	150	73.3 Å²	73.3	57%	0.566	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	128	169.7	-67.9	-178.8	175.9	178.7	-2.4	108.4	M682 I705 R706	M682-R789 HydrophobicContact CG-CG 4.21Å; I705-R789 WeakPolarHBondContact CA-O 3.35Å; R706-R789 PolarHBondContact N-O 2.01Å; R706-R789 PolarHBondContact O-N 3.47Å
790	Y	94.2	Very high	80.1	Confident	46 Å²	46	78.1 Å²	78.1	18%	0.18	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147	176	63.4	-96.2	0	0	0	110.9	S680 G681 V693 V694 D704 F792	S680-Y790 WeakPolarHBondContact CA-O 3.42Å; S680-Y790 WeakPolarHBondContact CB-O 3.18Å; G681-Y790 VanDerWaalsContact CA-CZ 3.46Å; G681-Y790 PolarHBondContact N-O 2.88Å; G681-Y790 PolarHBondContact O-N 3.47Å; V693-Y790 HydrophobicContact CG1-CD1 3.88Å; V693-Y790 HydrophobicContact CG1-CE1 4.18Å; V694-Y790 HydrophobicContact CB-CD1 4.36Å; V694-Y790 HydrophobicContact CB-CD2 4.27Å; V694-Y790 HydrophobicContact CB-CE1 4.16Å; V694-Y790 HydrophobicContact CB-CE2 4.1Å; V694-Y790 HydrophobicContact CB-CG 4.4Å; V694-Y790 HydrophobicContact CG1-CD1 4.28Å; V694-Y790 HydrophobicContact CG1-CD2 4.2Å; V694-Y790 HydrophobicContact CG1-CG 4.07Å; V694-Y790 HydrophobicContact CG2-CD2 4.11Å; V694-Y790 HydrophobicContact CG2-CE2 3.75Å; D704-Y790 CarbonylContact O-C 3.58Å; D704-Y790 WeakPolarHBondContact O-CA 3.45Å; Y790-F792 HydrophobicContact CD2-CD1 4.39Å; Y790-F792 HydrophobicContact CD2-CE1 4.18Å; Y790-F792 HydrophobicContact CE2-CE1 4.32Å
791	S	93.9	Very high	78	Confident	23 Å²	23	83.4 Å²	83.4	16%	0.161	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	146.2	167.8	64.3	0	0	0	0	111.9	I679 I703 D704	I679-S791 CarbonylContact O-C 3.52Å; I679-S791 WeakPolarHBondContact O-CA 2.98Å; I703-S791 WeakPolarHBondContact CA-O 2.93Å; D704-S791 PolarHBondContact N-O 3.47Å; D704-S791 PolarHBondContact O-N 2.82Å
792	F	93	Very high	76	Confident	7 Å²	7	88.4 Å²	88.4	3%	0.031	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	170.5	175.6	60.2	-84.6	0	0	0	109.8	I679 V694 L696 P697 A700 I703 Y790 M794	I679-F792 HydrophobicContact CB-CD1 4.42Å; I679-F792 HydrophobicContact CB-CD2 4.32Å; I679-F792 HydrophobicContact CB-CE1 4.02Å; I679-F792 HydrophobicContact CB-CE2 3.94Å; I679-F792 HydrophobicContact CB-CZ 3.78Å; I679-F792 HydrophobicContact CD1-CE2 3.68Å; I679-F792 HydrophobicContact CD1-CZ 3.96Å; I679-F792 HydrophobicContact CG1-CE2 4.3Å; I679-F792 HydrophobicContact CG1-CZ 4.46Å; I679-F792 HydrophobicContact CG2-CE1 3.75Å; I679-F792 HydrophobicContact CG2-CE2 4.25Å; I679-F792 HydrophobicContact CG2-CZ 3.59Å; I679-F792 PolarHBondContact N-O 3.06Å; I679-F792 PolarHBondContact O-N 2.81Å; V694-F792 HydrophobicContact CG2-CE1 4Å; L696-F792 HydrophobicContact CD2-CB 4.5Å; L696-F792 HydrophobicContact CD2-CD1 3.63Å; L696-F792 HydrophobicContact CD2-CE1 3.89Å; L696-F792 HydrophobicContact CD2-CG 4.01Å; L696-F792 HydrophobicContact CD2-CZ 4.44Å; P697-F792 HydrophobicContact CG-CE2 4.34Å; A700-F792 HydrophobicContact CB-CD2 3.79Å; A700-F792 HydrophobicContact CB-CE2 4.33Å; A700-F792 HydrophobicContact CB-CG 4.49Å; I703-F792 HydrophobicContact CB-CB 4.37Å; I703-F792 HydrophobicContact CG1-CB 3.75Å; Y790-F792 HydrophobicContact CD2-CD1 4.39Å; Y790-F792 HydrophobicContact CD2-CE1 4.18Å; Y790-F792 HydrophobicContact CE2-CE1 4.32Å; F792-M794 HydrophobicContact CD2-CG 4.05Å; F792-M794 HydrophobicContact CE2-CG 3.79Å; F792-M794 HydrophobicContact CE2-SD 4.48Å
793	Y	90.1	Very high	74.1	Confident	29 Å²	29	83.8 Å²	83.8	11%	0.114	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	-179.5	-67.3	-101.6	0	0	0	111.1	K665 C676 K677 K678 A700 S701 N702	K665-Y793 HydrophobicContact CB-CD1 3.96Å; K665-Y793 HydrophobicContact CB-CD2 4.35Å; K665-Y793 HydrophobicContact CB-CE1 3.7Å; K665-Y793 HydrophobicContact CB-CE2 4.13Å; K665-Y793 HydrophobicContact CB-CG 4.28Å; K665-Y793 HydrophobicContact CD-CE1 3.96Å; K665-Y793 WeakPolarHBondContact CD-OH 3.27Å; K665-Y793 HydrophobicContact CG-CE1 4.26Å; K665-Y793 HydrophobicContact CG-CE2 4.43Å; K665-Y793 WeakPolarHBondContact O-CB 3.37Å; K665-Y793 VanDerWaalsContact O-CG 3.29Å; C676-Y793 VanDerWaalsContact SG-CD1 3.58Å; K677-Y793 WeakPolarHBondContact O-CA 3.38Å; K678-Y793 HydrophobicContact CB-CD1 3.96Å; K678-Y793 HydrophobicContact CB-CE1 3.62Å; K678-Y793 HydrophobicContact CD-CE1 4.39Å; K678-Y793 HydrophobicContact CG-CD1 4.45Å; K678-Y793 HydrophobicContact CG-CE1 3.97Å; K678-Y793 HydrophobicContact CG-CE2 4.28Å; A700-Y793 WeakPolarHBondContact CA-O 3.33Å; S701-Y793 PolarHBondContact N-O 3.2Å; S701-Y793 PolarHBondContact O-N 3.48Å; N702-Y793 HydrophobicContact CB-CD2 3.9Å; N702-Y793 HydrophobicContact CB-CE2 4.34Å
794	M	90	Very high	72.2	Confident	47 Å²	47	87.4 Å²	87.4	23%	0.232	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141	180	-79.1	-63.9	-70.4	0	0	110.8	C676 K677 I679 P697 A700 F792	C676-M794 CarbonylContact C-O 3.6Å; C676-M794 WeakPolarHBondContact CA-O 3.26Å; C676-M794 WeakPolarHBondContact CB-O 3.27Å; K677-M794 PolarHBondContact N-O 3.31Å; K677-M794 PolarHBondContact O-N 3.23Å; I679-M794 HydrophobicContact CD1-CB 4.08Å; I679-M794 HydrophobicContact CD1-CG 3.64Å; P697-M794 HydrophobicContact CB-CE 4.28Å; P697-M794 HydrophobicContact CG-CE 3.67Å; P697-M794 HydrophobicContact CG-CG 4.37Å; P697-M794 HydrophobicContact CG-SD 3.49Å; P697-M794 WeakPolarHBondContact CG-SD 3.19Å; A700-M794 HydrophobicContact CB-SD 4.06Å; F792-M794 HydrophobicContact CD2-CG 4.05Å; F792-M794 HydrophobicContact CE2-CG 3.79Å; F792-M794 HydrophobicContact CE2-SD 4.48Å
795	S	83.3	Confident	70.3	Confident	96 Å²	96	92.7 Å²	92.7	67%	0.671	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.9	139.8	176.9	-170.9	0	0	0	0	111.8	S675	S675-S795 CarbonylContact O-C 3.49Å; S675-S795 WeakPolarHBondContact O-CA 3.35Å
796	K	77.1	Confident	68	Low	110 Å²	110	97.5 Å²	97.5	48%	0.478	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-80.5	120.6	169	-70.3	-178.4	-171.2	159.4	0	107.8	Q674 S675 C676 K677 H798	Q674-K796 WeakPolarHBondContact O-CD 3.24Å; Q674-K796 VanDerWaalsContact O-CE 3.28Å; Q674-K796 WeakPolarHBondContact O-CE 3.33Å; Q674-K796 PolarHBondContact O-NZ 3.12Å; S675-K796 PolarHBondContact O-N 2.74Å; C676-K796 WeakPolarHBondContact O-CE 3.32Å; K677-K796 HydrophobicContact CB-CG 4.43Å; K796-H798 PolarHBondContact O-N 3.28Å
797	E	62.4	Low	65.7	Low	178 Å²	178	105.2 Å²	105.2	83%	0.832	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-58.8	126.2	166.6	-68.5	171.7	179	0	0	108.9
798	H	50	Low	63.3	Low	149 Å²	149	107.6 Å²	107.6	69%	0.69	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-63.2	133.8	175.7	-106.6	-101.8	0	0	0	109.3	K796 D800	K796-H798 PolarHBondContact O-N 3.28Å; H798-D800 IonicContact CE1-OD2 3.57Å; H798-D800 IonicContact CG-OD2 3.76Å; H798-D800 IonicContact ND1-OD2 3.62Å; H798-D800 PolarHBondContact ND1-OD2 3.1Å; H798-D800 PolarHBondContact O-N 3.23Å; H798-D800 VanDerWaalsContact O-N 3.07Å
799	K	43.6	Very low	61.1	Low	176 Å²	176	117.7 Å²	117.7	77%	0.765	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.4	175.5	-88.1	-176.5	172.5	-178.1	0	113.3	E801 K802 T803	K799-E801 VanDerWaalsContact C-N 3.34Å; K799-E801 PolarHBondContact O-N 3.46Å; K799-K802 PolarHBondContact O-N 3.44Å; K799-T803 PolarHBondContact O-OG1 3.31Å
800	D	41.2	Very low	58.6	Low	100 Å²	100	115.1 Å²	115.1	54%	0.535	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-22.5	-175.9	-55.8	-46.4	0	0	0	113.3	H798 K802 T803	H798-D800 IonicContact CE1-OD2 3.57Å; H798-D800 IonicContact CG-OD2 3.76Å; H798-D800 IonicContact ND1-OD2 3.62Å; H798-D800 PolarHBondContact ND1-OD2 3.1Å; H798-D800 PolarHBondContact O-N 3.23Å; H798-D800 VanDerWaalsContact O-N 3.07Å; D800-K802 VanDerWaalsContact C-N 3.27Å; D800-K802 PolarHBondContact O-N 3.48Å; D800-T803 PolarHBondContact O-N 3.32Å
801	E	41.2	Very low	56.3	Low	151 Å²	151	121.3 Å²	121.3	71%	0.706	58%	0.584	S	S	*	*	H	α-helix	trans	-78	-14.8	173.9	-139.2	173.7	-169.2	0	0	112.5	K799	K799-E801 VanDerWaalsContact C-N 3.34Å; K799-E801 PolarHBondContact O-N 3.46Å
802	K	40.9	Very low	53.5	Low	162 Å²	162	129.8 Å²	129.8	70%	0.704	62%	0.617	S	S	*	*	H	α-helix	trans	-85	-12.5	171.7	-77.4	-173.6	176.2	178.7	0	113.5	K799 D800	K799-K802 PolarHBondContact O-N 3.44Å; D800-K802 VanDerWaalsContact C-N 3.27Å; D800-K802 PolarHBondContact O-N 3.48Å
803	T	39.1	Very low	51.3	Low	80 Å²	80	137.6 Å²	137.6	49%	0.491	66%	0.659	S	S	.	*	H	α-helix	trans	-96.5	-31.8	-177.6	-21.5	0	0	0	0	111.9	K799 D800 Q805 K806	K799-T803 PolarHBondContact O-OG1 3.31Å; D800-T803 PolarHBondContact O-N 3.32Å; T803-Q805 VanDerWaalsContact C-N 3.32Å; T803-Q805 PolarHBondContact O-N 3.32Å; T803-K806 PolarHBondContact O-N 2.94Å
804	L	42.3	Very low	49.1	Very low	138 Å²	138	144.9 Å²	144.9	72%	0.723	69%	0.694	S	S	*	*	H	α-helix	trans	-69.6	-26.4	171.5	-76.7	160.9	0	0	0	113.1
805	Q	43.6	Very low	46.5	Very low	132 Å²	132	150.1 Å²	150.1	62%	0.617	72%	0.723	S	S	*	*	H	α-helix	trans	-86.3	-2.5	174	-74.5	-172.5	1.8	0	0	114.5	T803	T803-Q805 VanDerWaalsContact C-N 3.32Å; T803-Q805 PolarHBondContact O-N 3.32Å
806	K	38	Very low	44.5	Very low	159 Å²	159	151.2 Å²	151.2	69%	0.691	73%	0.73	S	S	*	*	H	α-helix	trans	-101.9	-15.1	-176	-148.3	177.6	-179.5	-171.4	0	113.7	T803	T803-K806 PolarHBondContact O-N 2.94Å
807	E	38.2	Very low	43.3	Very low	161 Å²	161	149.7 Å²	149.7	75%	0.752	73%	0.73	S	S	*	*	H	α-helix	trans	-93.3	-21.7	175.2	-69.8	-172.9	161	0	0	113.6	R809	E807-R809 VanDerWaalsContact C-N 3.32Å; E807-R809 PolarHBondContact O-N 3.19Å
808	E	41.5	Very low	43	Very low	166 Å²	166	147.7 Å²	147.7	78%	0.776	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-80.9	-6.3	174.2	-74	-170.2	150.6	0	0	114.4
809	R	45.6	Very low	43.8	Very low	212 Å²	212	143.2 Å²	143.2	80%	0.8	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-90.5	3.3	-178.1	-80.6	-176.3	173.8	-173.4	-0.4	115.1	E807	E807-R809 VanDerWaalsContact C-N 3.32Å; E807-R809 PolarHBondContact O-N 3.19Å
810	S	40.5	Very low	45.3	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-101.6	-6.6	-178.8	-52.5	0	0	0	0	114.1
811	H	47.1	Very low	47.2	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.815	68%	0.675	S	S	*	*	S	Bend	trans	-130.9	63.6	177.5	-83.5	-79.5	0	0	0	112.3
812	K	35.5	Very low	49.1	Very low	200 Å²	200	136.1 Å²	136.1	87%	0.87	67%	0.667	S	S	*	*			trans	-164.1	63	155.1	-112.4	168.1	-172.8	-178.8	0	110.8
813	L	46.8	Very low	51	Low	172 Å²	172	131.2 Å²	131.2	90%	0.901	65%	0.65	S	S	*	*			trans	-98.3	76.7	159.8	-157.2	91	0	0	0	108.1
814	Q	43.9	Very low	53	Low	181 Å²	181	129.7 Å²	129.7	85%	0.846	65%	0.646	S	S	*	*	S	Bend	trans	-171.4	128.7	155	-108.1	160.4	-0.6	0	0	110.4
815	N	35.7	Very low	54.7	Low	158 Å²	158	125.9 Å²	125.9	85%	0.845	64%	0.64	S	S	*	*			trans	92.9	84.7	-178.7	-67.3	-2.2	0	0	0	117	V817	N815-V817 PolarHBondContact O-N 2.78Å
816	S	40.6	Very low	56.7	Low	118 Å²	118	122.9 Å²	122.9	83%	0.825	62%	0.623	S	S	*	*			trans	-80.9	95.7	169.6	-166.8	0	0	0	0	110.3
817	V	50.9	Low	58.8	Low	79 Å²	79	120 Å²	120	48%	0.479	62%	0.615	S	S	.	*			trans	-85.9	121.1	161.5	179.5	0	0	0	0	107.3	N815 I819	N815-V817 PolarHBondContact O-N 2.78Å; V817-I819 HydrophobicContact CG1-CG1 4.27Å; V817-I819 PolarHBondContact O-N 3.5Å
818	L	56.2	Low	60.8	Low	135 Å²	135	117.5 Å²	117.5	71%	0.707	62%	0.616	S	S	*	*			trans	-76	119.4	174.5	-96	142.5	0	0	0	109.5
819	I	68.5	Low	62.7	Low	56 Å²	56	111.4 Å²	111.4	29%	0.287	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	134.8	-176.3	-49.9	174.9	0	0	0	108.8	V817 C844 Q845 T852 D854 C855	V817-I819 HydrophobicContact CG1-CG1 4.27Å; V817-I819 PolarHBondContact O-N 3.5Å; I819-C844 WeakPolarHBondContact CG2-SG 3.49Å; I819-Q845 WeakPolarHBondContact CG2-O 3.43Å; I819-T852 HydrophobicContact CD1-CG2 4.29Å; I819-T852 HydrophobicContact CG2-CG2 3.39Å; I819-D854 HydrophobicContact CD1-CB 3.86Å; I819-C855 VanDerWaalsContact CG2-SG 3.53Å
820	H	74.2	Confident	64.2	Low	102 Å²	102	105.9 Å²	105.9	47%	0.472	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.6	157.2	-176.4	69.7	-68.4	0	0	0	113.3	Q845	H820-Q845 PolarHBondContact N-O 2.85Å; H820-Q845 VanDerWaalsContact N-O 3.15Å; H820-Q845 PolarHBondContact O-N 3.13Å; H820-Q845 VanDerWaalsContact O-N 3.11Å
821	W	81.4	Confident	65.5	Low	55 Å²	55	103.7 Å²	103.7	21%	0.208	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.3	127.3	176.7	-71.2	110.1	0	0	0	111	V842 C844 C855 D856 R860 P861	W821-V842 HydrophobicContact CD2-CG1 4.49Å; W821-V842 HydrophobicContact CE3-CG1 3.78Å; W821-V842 HydrophobicContact CZ3-CG1 4.22Å; W821-C844 HydrophobicContact CD2-CB 4.41Å; W821-C844 HydrophobicContact CE3-CB 3.78Å; W821-C844 HydrophobicContact CH2-CB 4.02Å; W821-C844 HydrophobicContact CZ3-CB 3.57Å; W821-C855 HydrophobicContact CD2-CB 3.8Å; W821-C855 HydrophobicContact CE3-CB 4.37Å; W821-C855 HydrophobicContact CG-CB 4.3Å; W821-C855 HydrophobicContact CH2-CB 3.98Å; W821-C855 HydrophobicContact CZ2-CB 3.36Å; W821-C855 HydrophobicContact CZ3-CB 4.46Å; W821-D856 PolarHBondContact NE1-O 2.86Å; W821-R860 HydrophobicContact CD2-CB 4.47Å; W821-R860 HydrophobicContact CD2-CG 4.29Å; W821-R860 HydrophobicContact CE3-CG 4.29Å; W821-R860 HydrophobicContact CH2-CB 4.31Å; W821-R860 HydrophobicContact CH2-CG 3.88Å; W821-R860 HydrophobicContact CZ2-CB 3.76Å; W821-R860 HydrophobicContact CZ2-CG 3.84Å; W821-R860 HydrophobicContact CZ3-CG 4.09Å; W821-P861 HydrophobicContact CB-CG 4.04Å; W821-P861 HydrophobicContact CG-CG 4.46Å
822	K	80.4	Confident	66.4	Low	121 Å²	121	102.1 Å²	102.1	53%	0.526	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.6	133.4	171.8	-166.8	175.4	-177.8	178.2	0	109.9	Q843	K822-Q843 PolarHBondContact N-O 2.92Å; K822-Q843 PolarHBondContact O-N 3.09Å; K822-Q843 VanDerWaalsContact O-O 3.13Å
823	T	81.9	Confident	68	Low	58 Å²	58	94.5 Å²	94.5	36%	0.356	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136	178.4	65.2	0	0	0	0	110.9	R840 L841 V842 P861	T823-R840 PolarHBondContact OG1-NH1 3.43Å; T823-L841 WeakPolarHBondContact CA-O 3.27Å; T823-V842 HydrophobicContact CG2-CG1 4.32Å; T823-V842 HydrophobicContact CG2-CG2 4.1Å; T823-P861 HydrophobicContact CG2-CB 3.72Å; T823-P861 HydrophobicContact CG2-CG 3.79Å
824	A	80.4	Confident	68.9	Low	49 Å²	49	87.1 Å²	87.1	41%	0.405	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-75.7	172.8	167.3	0	0	0	0	0	111.6	L841	A824-L841 HydrophobicContact CB-CB 3.84Å; A824-L841 PolarHBondContact N-O 3Å
825	G	77.9	Confident	70.1	Confident	58 Å²	58	86.6 Å²	86.6	60%	0.598	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-59.6	159.2	167.5	0	0	0	0	0	111.8	R840	G825-R840 WeakPolarHBondContact O-CB 3.45Å
826	W	85.7	Confident	71.9	Confident	69 Å²	69	79.1 Å²	79.1	26%	0.261	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-76.3	137.8	173.3	-66.9	100.4	0	0	0	110.4	Q838 R840 A862 R865	W826-Q838 HydrophobicContact CB-CB 4.33Å; W826-Q838 HydrophobicContact CD2-CB 4.46Å; W826-Q838 HydrophobicContact CE3-CB 3.9Å; W826-Q838 VanDerWaalsContact CZ3-O 3.29Å; W826-Q838 WeakPolarHBondContact CZ3-O 3.37Å; W826-R840 HydrophobicContact CD2-CB 3.99Å; W826-R840 HydrophobicContact CD2-CG 4.07Å; W826-R840 HydrophobicContact CE3-CB 3.67Å; W826-R840 HydrophobicContact CE3-CG 3.75Å; W826-R840 HydrophobicContact CH2-CG 3.82Å; W826-R840 HydrophobicContact CZ2-CG 4.13Å; W826-R840 VanDerWaalsContact CZ2-NE 3.28Å; W826-R840 HydrophobicContact CZ3-CB 4.02Å; W826-R840 HydrophobicContact CZ3-CG 3.6Å; W826-A862 WeakPolarHBondContact CH2-O 3.22Å; W826-R865 HydrophobicContact CD2-CG 4.02Å; W826-R865 HydrophobicContact CE3-CG 3.86Å; W826-R865 HydrophobicContact CH2-CB 3.74Å; W826-R865 HydrophobicContact CH2-CG 3.76Å; W826-R865 HydrophobicContact CZ2-CB 4.1Å; W826-R865 HydrophobicContact CZ2-CG 3.91Å; W826-R865 HydrophobicContact CZ3-CB 4.07Å; W826-R865 HydrophobicContact CZ3-CG 3.74Å
827	D	82.9	Confident	73.7	Confident	97 Å²	97	77.6 Å²	77.6	52%	0.519	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-70.1	171.4	173.1	-61.4	-32.6	0	0	0	111.4	Q838 Q839	D827-Q838 VanDerWaalsContact O-CD 3.32Å; D827-Q838 VanDerWaalsContact O-CG 3.24Å; D827-Q838 WeakPolarHBondContact O-CG 3.14Å; D827-Q838 PolarHBondContact O-NE2 3.24Å; D827-Q839 PolarHBondContact N-O 2.79Å
828	S	80	Confident	74.9	Confident	109 Å²	109	75.4 Å²	75.4	76%	0.762	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-60.7	146	174.6	48.4	0	0	0	0	111.6	T830	S828-T830 PolarHBondContact O-N 2.72Å
829	C	80.2	Confident	76.1	Confident	38 Å²	38	74.2 Å²	74.2	26%	0.257	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-63.3	135.1	-179.2	-173.1	0	0	0	0	110.6	V831 Q838 C867	C829-V831 PolarHBondContact O-N 2.76Å; C829-V831 PolarHBondContact SG-O 3.45Å; C829-Q838 HydrophobicContact CB-CG 4.06Å; C829-C867 VanDerWaalsContact CA-SG 3.52Å; C829-C867 HydrophobicContact CB-CB 3.86Å; C829-C867 WeakPolarHBondContact CB-SG 3.17Å; C829-C867 VanDerWaalsContact SG-C 3.52Å; C829-C867 WeakPolarHBondContact SG-CB 3.45Å; C829-C867 CovalentContact SG-SG 2.02Å; C829-C867 PolarHBondContact SG-SG 2.77Å
830	T	77.8	Confident	76.7	Confident	97 Å²	97	74 Å²	74	60%	0.595	42%	0.42	S	S	*	.	S	Bend	trans	-63.9	-12.9	-178.3	56	0	0	0	0	114.2	S828 L837	S828-T830 PolarHBondContact O-N 2.72Å; T830-L837 WeakPolarHBondContact CG2-O 3.4Å; T830-L837 PolarHBondContact N-O 3.1Å; T830-L837 VanDerWaalsContact N-O 3.11Å; T830-L837 PolarHBondContact OG1-N 2.96Å; T830-L837 PolarHBondContact OG1-O 2.63Å
831	V	68.4	Low	76.9	Confident	50 Å²	50	73.7 Å²	73.7	30%	0.303	42%	0.421	S	S	.	.			trans	-134.1	152.8	177.7	-51.8	0	0	0	0	109.9	C829 C833	C829-V831 PolarHBondContact O-N 2.76Å; C829-V831 PolarHBondContact SG-O 3.45Å; V831-C833 WeakPolarHBondContact CG2-O 3.37Å
832	T	65.9	Low	77.1	Confident	143 Å²	143	71.7 Å²	71.7	88%	0.877	42%	0.415	S	S	*	.	S	Bend	trans	-84.9	-20.6	174.3	48.6	0	0	0	0	112.9
833	C	67.6	Low	77.1	Confident	39 Å²	39	69.9 Å²	69.9	26%	0.264	41%	0.408	S	S	.	.	S	Bend	trans	-153.6	156	168	71.8	0	0	0	0	109.5	V831 D869 C871	V831-C833 WeakPolarHBondContact CG2-O 3.37Å; C833-D869 CarbonylContact C-O 3.39Å; C833-D869 WeakPolarHBondContact CA-O 3.49Å; C833-D869 VanDerWaalsContact CB-O 3.25Å; C833-D869 WeakPolarHBondContact CB-O 3.41Å; C833-C871 HydrophobicContact CB-CB 4.02Å; C833-C871 WeakPolarHBondContact CB-SG 3.22Å; C833-C871 PolarHBondContact O-SG 3.28Å; C833-C871 WeakPolarHBondContact SG-CA 3.24Å; C833-C871 WeakPolarHBondContact SG-CB 3.33Å; C833-C871 CovalentContact SG-SG 2.06Å; C833-C871 PolarHBondContact SG-SG 3.08Å
834	G	65.5	Low	77	Confident	18 Å²	18	67.4 Å²	67.4	19%	0.186	39%	0.393	C	S	.	.	S	Bend	trans	95	-159.9	178.2	0	0	0	0	0	112.6	G836 C867 G868 D869 C871	G834-G836 PolarHBondContact O-N 2.94Å; G834-C867 VanDerWaalsContact O-O 3.08Å; G834-G868 CarbonylContact O-C 3.46Å; G834-G868 VanDerWaalsContact O-CA 3.32Å; G834-G868 WeakPolarHBondContact O-CA 3.01Å; G834-D869 PolarHBondContact N-O 2.83Å; G834-C871 PolarHBondContact N-SG 2.91Å; G834-C871 VanDerWaalsContact N-SG 3.37Å
835	N	69.5	Low	76.9	Confident	170 Å²	170	67 Å²	67	91%	0.909	38%	0.383	S	S	*	.	S	Bend	trans	-82.8	81.4	-176.9	-62.2	-26.9	0	0	0	110.7
836	G	73.9	Confident	76.6	Confident	1 Å²	1	65 Å²	65	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	170.5	171.1	0	0	0	0	0	113.3	G834 A866 C867	G834-G836 PolarHBondContact O-N 2.94Å; G836-A866 CarbonylContact O-C 3.56Å; G836-A866 WeakPolarHBondContact O-CA 3.24Å; G836-C867 CarbonylContact C-O 3.52Å; G836-C867 WeakPolarHBondContact CA-O 3.23Å; G836-C867 PolarHBondContact N-O 2.76Å; G836-C867 PolarHBondContact O-N 2.99Å
837	L	78.3	Confident	75.5	Confident	86 Å²	86	66.6 Å²	66.6	45%	0.45	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.5	173.4	-62.3	170.2	0	0	0	109.1	T830 V864 R865 C867	T830-L837 WeakPolarHBondContact CG2-O 3.4Å; T830-L837 PolarHBondContact N-O 3.1Å; T830-L837 VanDerWaalsContact N-O 3.11Å; T830-L837 PolarHBondContact OG1-N 2.96Å; T830-L837 PolarHBondContact OG1-O 2.63Å; L837-V864 HydrophobicContact CB-CG1 3.97Å; L837-V864 HydrophobicContact CD1-CG1 4.3Å; L837-V864 HydrophobicContact CD2-CG1 3.94Å; L837-V864 HydrophobicContact CG-CG1 4.29Å; L837-R865 CarbonylContact C-O 3.55Å; L837-R865 VanDerWaalsContact CA-O 3.3Å; L837-R865 WeakPolarHBondContact CA-O 3.12Å; L837-C867 PolarHBondContact N-SG 3.14Å; L837-C867 VanDerWaalsContact N-SG 3.36Å
838	Q	77.2	Confident	74.6	Confident	33 Å²	33	69.4 Å²	69.4	15%	0.154	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139.9	163.8	-78.3	179.3	-45.3	0	0	108.3	W826 D827 C829 V864 R865 C867	W826-Q838 HydrophobicContact CB-CB 4.33Å; W826-Q838 HydrophobicContact CD2-CB 4.46Å; W826-Q838 HydrophobicContact CE3-CB 3.9Å; W826-Q838 VanDerWaalsContact CZ3-O 3.29Å; W826-Q838 WeakPolarHBondContact CZ3-O 3.37Å; D827-Q838 VanDerWaalsContact O-CD 3.32Å; D827-Q838 VanDerWaalsContact O-CG 3.24Å; D827-Q838 WeakPolarHBondContact O-CG 3.14Å; D827-Q838 PolarHBondContact O-NE2 3.24Å; C829-Q838 HydrophobicContact CB-CG 4.06Å; Q838-V864 WeakPolarHBondContact O-CA 3.35Å; Q838-R865 HydrophobicContact CB-CG 4.01Å; Q838-R865 PolarHBondContact N-O 3.1Å; Q838-R865 PolarHBondContact O-N 2.88Å; Q838-R865 VanDerWaalsContact OE1-CZ 3.29Å; Q838-C867 HydrophobicContact CG-CB 3.9Å
839	Q	80.8	Confident	73.7	Confident	110 Å²	110	66.1 Å²	66.1	51%	0.514	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	153.5	175.7	-59.5	-169.6	-21.7	0	0	109.4	D827 A863 V864	D827-Q839 PolarHBondContact N-O 2.79Å; Q839-A863 WeakPolarHBondContact CA-O 3.01Å; Q839-V864 HydrophobicContact CG-CG1 4.41Å; Q839-V864 HydrophobicContact CG-CG2 4.19Å
840	R	81.7	Confident	73.1	Confident	51 Å²	51	70.6 Å²	70.6	19%	0.192	39%	0.388	C	S	.	.			trans	-142.4	150.4	170.8	68.7	177.3	173.6	174.7	-3.7	110.2	T823 G825 W826 V842 A862 A863	T823-R840 PolarHBondContact OG1-NH1 3.43Å; G825-R840 WeakPolarHBondContact O-CB 3.45Å; W826-R840 HydrophobicContact CD2-CB 3.99Å; W826-R840 HydrophobicContact CD2-CG 4.07Å; W826-R840 HydrophobicContact CE3-CB 3.67Å; W826-R840 HydrophobicContact CE3-CG 3.75Å; W826-R840 HydrophobicContact CH2-CG 3.82Å; W826-R840 HydrophobicContact CZ2-CG 4.13Å; W826-R840 VanDerWaalsContact CZ2-NE 3.28Å; W826-R840 HydrophobicContact CZ3-CB 4.02Å; W826-R840 HydrophobicContact CZ3-CG 3.6Å; R840-V842 HydrophobicContact CG-CG2 4.1Å; R840-V842 PolarHBondContact O-N 2.85Å; R840-A862 PolarHBondContact NE-O 2.86Å; R840-A862 PolarHBondContact NH2-O 3.34Å; R840-A863 PolarHBondContact N-O 3.09Å
841	L	77.5	Confident	72.4	Confident	95 Å²	95	71.5 Å²	71.5	50%	0.497	39%	0.388	S	S	.	.			trans	-73.2	126.4	174.9	-169.6	64	0	0	0	110.2	T823 A824 Q843	T823-L841 WeakPolarHBondContact CA-O 3.27Å; A824-L841 HydrophobicContact CB-CB 3.84Å; A824-L841 PolarHBondContact N-O 3Å; L841-Q843 HydrophobicContact CD1-CG 4.15Å; L841-Q843 HydrophobicContact CD2-CG 4.32Å; L841-Q843 HydrophobicContact CG-CG 3.93Å
842	V	85.1	Confident	72.3	Confident	13 Å²	13	70.8 Å²	70.8	8%	0.079	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	107.8	176.8	-178	0	0	0	0	108	W821 T823 R840 R860 P861 A863	W821-V842 HydrophobicContact CD2-CG1 4.49Å; W821-V842 HydrophobicContact CE3-CG1 3.78Å; W821-V842 HydrophobicContact CZ3-CG1 4.22Å; T823-V842 HydrophobicContact CG2-CG1 4.32Å; T823-V842 HydrophobicContact CG2-CG2 4.1Å; R840-V842 HydrophobicContact CG-CG2 4.1Å; R840-V842 PolarHBondContact O-N 2.85Å; V842-R860 HydrophobicContact CG1-CG 4.04Å; V842-P861 HydrophobicContact CG1-CB 4.45Å; V842-P861 HydrophobicContact CG1-CG 4.41Å; V842-A863 HydrophobicContact CG2-CB 3.97Å
843	Q	81.1	Confident	72.3	Confident	83 Å²	83	70.1 Å²	70.1	39%	0.388	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.3	-174.6	-76.2	173.6	-31.5	0	0	110.3	K822 L841 L851	K822-Q843 PolarHBondContact N-O 2.92Å; K822-Q843 PolarHBondContact O-N 3.09Å; K822-Q843 VanDerWaalsContact O-O 3.13Å; L841-Q843 HydrophobicContact CD1-CG 4.15Å; L841-Q843 HydrophobicContact CD2-CG 4.32Å; L841-Q843 HydrophobicContact CG-CG 3.93Å; Q843-L851 HydrophobicContact CB-CD2 3.8Å; Q843-L851 HydrophobicContact CG-CD2 3.84Å
844	C	80.7	Confident	72.2	Confident	6 Å²	6	74.2 Å²	74.2	4%	0.041	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.2	176.5	171.6	0	0	0	0	108.7	I819 W821 T852 C855	I819-C844 WeakPolarHBondContact CG2-SG 3.49Å; W821-C844 HydrophobicContact CD2-CB 4.41Å; W821-C844 HydrophobicContact CE3-CB 3.78Å; W821-C844 HydrophobicContact CH2-CB 4.02Å; W821-C844 HydrophobicContact CZ3-CB 3.57Å; C844-T852 WeakPolarHBondContact CB-O 3.47Å; C844-T852 PolarHBondContact O-N 3.49Å; C844-T852 VanDerWaalsContact O-O 3.07Å; C844-T852 PolarHBondContact SG-O 3.27Å; C844-C855 VanDerWaalsContact CA-SG 3.58Å; C844-C855 HydrophobicContact CB-CB 3.64Å; C844-C855 WeakPolarHBondContact CB-SG 3.13Å; C844-C855 VanDerWaalsContact SG-CA 3.56Å; C844-C855 WeakPolarHBondContact SG-CB 2.73Å; C844-C855 PolarHBondContact SG-N 2.91Å; C844-C855 CovalentContact SG-SG 2.01Å; C844-C855 PolarHBondContact SG-SG 2.97Å
845	Q	78.3	Confident	72.5	Confident	41 Å²	41	73.8 Å²	73.8	19%	0.192	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.8	-171.2	-155.3	171.9	22.9	0	0	110.8	I819 H820 G849 H850	I819-Q845 WeakPolarHBondContact CG2-O 3.43Å; H820-Q845 PolarHBondContact N-O 2.85Å; H820-Q845 VanDerWaalsContact N-O 3.15Å; H820-Q845 PolarHBondContact O-N 3.13Å; H820-Q845 VanDerWaalsContact O-N 3.11Å; Q845-G849 VanDerWaalsContact NE2-C 3.26Å; Q845-G849 VanDerWaalsContact NE2-CA 3.34Å; Q845-G849 PolarHBondContact NE2-O 2.87Å; Q845-H850 WeakPolarHBondContact CA-O 3.24Å; Q845-H850 WeakPolarHBondContact CG-O 3.36Å
846	S	71.3	Confident	72.7	Confident	15 Å²	15	69.5 Å²	69.5	11%	0.105	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	166.1	168.8	75.9	0	0	0	0	110.8	E848 G849 H850	S846-E848 PolarHBondContact O-N 3.36Å; S846-E848 VanDerWaalsContact O-N 3.12Å; S846-E848 PolarHBondContact OG-N 2.97Å; S846-G849 PolarHBondContact O-N 3.19Å; S846-H850 PolarHBondContact N-O 3.47Å
847	T	62.4	Low	72.3	Confident	103 Å²	103	75.9 Å²	75.9	63%	0.632	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.5	174.9	42.8	0	0	0	0	114	G849	T847-G849 VanDerWaalsContact C-N 3.32Å
848	E	64	Low	71.6	Confident	156 Å²	156	77.7 Å²	77.7	73%	0.729	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	9	177.6	-65.7	172.7	-178.9	0	0	113.1	S846 H850	S846-E848 PolarHBondContact O-N 3.36Å; S846-E848 VanDerWaalsContact O-N 3.12Å; S846-E848 PolarHBondContact OG-N 2.97Å; E848-H850 VanDerWaalsContact C-N 3.27Å; E848-H850 PolarHBondContact O-N 3.43Å
849	G	60.7	Low	71.3	Confident	40 Å²	40	83.5 Å²	83.5	41%	0.412	44%	0.443	S	S	.	.	S	Bend	trans	78.8	5.6	176.2	0	0	0	0	0	114.7	Q845 S846 T847	Q845-G849 VanDerWaalsContact NE2-C 3.26Å; Q845-G849 VanDerWaalsContact NE2-CA 3.34Å; Q845-G849 PolarHBondContact NE2-O 2.87Å; S846-G849 PolarHBondContact O-N 3.19Å; T847-G849 VanDerWaalsContact C-N 3.32Å
850	H	67.7	Low	71.3	Confident	132 Å²	132	84.7 Å²	84.7	61%	0.611	44%	0.442	S	S	*	.			trans	-82.3	134.3	176.5	-79.9	83.2	0	0	0	111.7	Q845 S846 E848 T852	Q845-H850 WeakPolarHBondContact CA-O 3.24Å; Q845-H850 WeakPolarHBondContact CG-O 3.36Å; S846-H850 PolarHBondContact N-O 3.47Å; E848-H850 VanDerWaalsContact C-N 3.27Å; E848-H850 PolarHBondContact O-N 3.43Å; H850-T852 PolarHBondContact O-N 3.5Å
851	L	63.7	Low	71.3	Confident	117 Å²	117	84.1 Å²	84.1	61%	0.613	45%	0.445	S	S	*	.	B	Isolated β-bridge	trans	-67.2	123.9	173.2	-83.1	146.8	0	0	0	109.5	Q843	Q843-L851 HydrophobicContact CB-CD2 3.8Å; Q843-L851 HydrophobicContact CG-CD2 3.84Å
852	T	66.4	Low	71.2	Confident	34 Å²	34	82.6 Å²	82.6	21%	0.209	45%	0.446	C	S	.	.			trans	-132.1	161.9	178.9	170	0	0	0	0	110	I819 C844 H850 D854	I819-T852 HydrophobicContact CD1-CG2 4.29Å; I819-T852 HydrophobicContact CG2-CG2 3.39Å; C844-T852 WeakPolarHBondContact CB-O 3.47Å; C844-T852 PolarHBondContact O-N 3.49Å; C844-T852 VanDerWaalsContact O-O 3.07Å; C844-T852 PolarHBondContact SG-O 3.27Å; H850-T852 PolarHBondContact O-N 3.5Å; T852-D854 PolarHBondContact OG1-N 2.89Å
853	T	64.2	Low	71	Confident	129 Å²	129	83.6 Å²	83.6	79%	0.791	46%	0.456	S	S	*	.	S	Bend	trans	-104.6	0.7	178.1	45.3	0	0	0	0	113.4	C855	T853-C855 VanDerWaalsContact C-N 3.32Å; T853-C855 PolarHBondContact O-N 3.18Å
854	D	66.4	Low	70.9	Confident	125 Å²	125	82.8 Å²	82.8	67%	0.668	46%	0.457	S	S	*	.			trans	-87.7	15.7	-167.9	-65.9	-30.4	0	0	0	115.2	I819 T852	I819-D854 HydrophobicContact CD1-CB 3.86Å; T852-D854 PolarHBondContact OG1-N 2.89Å
855	C	72.6	Confident	70.8	Confident	10 Å²	10	88 Å²	88	7%	0.068	48%	0.476	C	S	.	.	S	Bend	trans	-77.5	144.7	174.8	-68.8	0	0	0	0	111.9	I819 W821 C844 T853 I857	I819-C855 VanDerWaalsContact CG2-SG 3.53Å; W821-C855 HydrophobicContact CD2-CB 3.8Å; W821-C855 HydrophobicContact CE3-CB 4.37Å; W821-C855 HydrophobicContact CG-CB 4.3Å; W821-C855 HydrophobicContact CH2-CB 3.98Å; W821-C855 HydrophobicContact CZ2-CB 3.36Å; W821-C855 HydrophobicContact CZ3-CB 4.46Å; C844-C855 VanDerWaalsContact CA-SG 3.58Å; C844-C855 HydrophobicContact CB-CB 3.64Å; C844-C855 WeakPolarHBondContact CB-SG 3.13Å; C844-C855 VanDerWaalsContact SG-CA 3.56Å; C844-C855 WeakPolarHBondContact SG-CB 2.73Å; C844-C855 PolarHBondContact SG-N 2.91Å; C844-C855 CovalentContact SG-SG 2.01Å; C844-C855 PolarHBondContact SG-SG 2.97Å; T853-C855 VanDerWaalsContact C-N 3.32Å; T853-C855 PolarHBondContact O-N 3.18Å; C855-I857 PolarHBondContact O-N 2.88Å
856	D	72	Confident	70.5	Confident	80 Å²	80	90.1 Å²	90.1	43%	0.428	50%	0.5	S	S	.	.			trans	-58.1	112.4	173.1	-176.3	-5.2	0	0	0	111.4	W821 T858 K859	W821-D856 PolarHBondContact NE1-O 2.86Å; D856-T858 PolarHBondContact O-N 2.77Å; D856-T858 WeakPolarHBondContact OD1-CB 3.3Å; D856-T858 PolarHBondContact OD1-N 3.3Å; D856-T858 PolarHBondContact OD1-OG1 3.2Å; D856-T858 PolarHBondContact OD2-OG1 2.02Å; D856-T858 VanDerWaalsContact OD2-OG1 3.09Å; D856-K859 PolarHBondContact O-N 2.91Å; D856-K859 VanDerWaalsContact O-N 3.14Å
857	I	65.5	Low	70.7	Confident	135 Å²	135	90.5 Å²	90.5	69%	0.692	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-63.9	-28	-177.7	-57.6	171.3	0	0	0	111	C855 K859 R860	C855-I857 PolarHBondContact O-N 2.88Å; I857-K859 PolarHBondContact O-N 2.99Å; I857-R860 VanDerWaalsContact O-CB 3.23Å; I857-R860 WeakPolarHBondContact O-CB 3.28Å; I857-R860 PolarHBondContact O-N 2.76Å; I857-R860 VanDerWaalsContact O-N 3.14Å
858	T	63.8	Low	71	Confident	124 Å²	124	87.6 Å²	87.6	76%	0.761	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-68.5	-22.8	179	69.1	0	0	0	0	112.6	D856	D856-T858 PolarHBondContact O-N 2.77Å; D856-T858 WeakPolarHBondContact OD1-CB 3.3Å; D856-T858 PolarHBondContact OD1-N 3.3Å; D856-T858 PolarHBondContact OD1-OG1 3.2Å; D856-T858 PolarHBondContact OD2-OG1 2.02Å; D856-T858 VanDerWaalsContact OD2-OG1 3.09Å
859	K	71.6	Confident	71.1	Confident	155 Å²	155	86 Å²	86	67%	0.674	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-99.8	7.8	175.9	-62.2	-175.2	-176.5	177.7	0	113.1	D856 I857 P861	D856-K859 PolarHBondContact O-N 2.91Å; D856-K859 VanDerWaalsContact O-N 3.14Å; I857-K859 PolarHBondContact O-N 2.99Å; K859-P861 VanDerWaalsContact O-CD 3.23Å; K859-P861 WeakPolarHBondContact O-CD 3.27Å
860	R	80.7	Confident	71.2	Confident	135 Å²	135	88.3 Å²	88.3	51%	0.509	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-63.8	118.9	-178.9	-173.5	177.4	-178.6	-178.2	2.5	110.3	W821 V842 I857	W821-R860 HydrophobicContact CD2-CB 4.47Å; W821-R860 HydrophobicContact CD2-CG 4.29Å; W821-R860 HydrophobicContact CE3-CG 4.29Å; W821-R860 HydrophobicContact CH2-CB 4.31Å; W821-R860 HydrophobicContact CH2-CG 3.88Å; W821-R860 HydrophobicContact CZ2-CB 3.76Å; W821-R860 HydrophobicContact CZ2-CG 3.84Å; W821-R860 HydrophobicContact CZ3-CG 4.09Å; V842-R860 HydrophobicContact CG1-CG 4.04Å; I857-R860 VanDerWaalsContact O-CB 3.23Å; I857-R860 WeakPolarHBondContact O-CB 3.28Å; I857-R860 PolarHBondContact O-N 2.76Å; I857-R860 VanDerWaalsContact O-N 3.14Å
861	P	81.9	Confident	71.4	Confident	38 Å²	38	83.9 Å²	83.9	25%	0.247	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-61.7	147.4	177.5	-23.5	34.3	0	0	0	112	W821 T823 V842 K859 A863	W821-P861 HydrophobicContact CB-CG 4.04Å; W821-P861 HydrophobicContact CG-CG 4.46Å; T823-P861 HydrophobicContact CG2-CB 3.72Å; T823-P861 HydrophobicContact CG2-CG 3.79Å; V842-P861 HydrophobicContact CG1-CB 4.45Å; V842-P861 HydrophobicContact CG1-CG 4.41Å; K859-P861 VanDerWaalsContact O-CD 3.23Å; K859-P861 WeakPolarHBondContact O-CD 3.27Å; P861-A863 PolarHBondContact O-N 3Å
862	A	75.8	Confident	71.8	Confident	64 Å²	64	79.1 Å²	79.1	53%	0.529	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-58.3	127.2	178.3	0	0	0	0	0	111.1	W826 R840	W826-A862 WeakPolarHBondContact CH2-O 3.22Å; R840-A862 PolarHBondContact NE-O 2.86Å; R840-A862 PolarHBondContact NH2-O 3.34Å
863	A	79.9	Confident	72.3	Confident	34 Å²	34	82 Å²	82	28%	0.281	47%	0.469	S	S	.	.	S	Bend	trans	-87	-10.8	178.8	0	0	0	0	0	113	Q839 R840 V842 P861	Q839-A863 WeakPolarHBondContact CA-O 3.01Å; R840-A863 PolarHBondContact N-O 3.09Å; V842-A863 HydrophobicContact CG2-CB 3.97Å; P861-A863 PolarHBondContact O-N 3Å
864	V	79.2	Confident	73.2	Confident	66 Å²	66	77.6 Å²	77.6	40%	0.4	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	136.7	-178.3	-171	0	0	0	0	109.4	L837 Q838 Q839	L837-V864 HydrophobicContact CB-CG1 3.97Å; L837-V864 HydrophobicContact CD1-CG1 4.3Å; L837-V864 HydrophobicContact CD2-CG1 3.94Å; L837-V864 HydrophobicContact CG-CG1 4.29Å; Q838-V864 WeakPolarHBondContact O-CA 3.35Å; Q839-V864 HydrophobicContact CG-CG1 4.41Å; Q839-V864 HydrophobicContact CG-CG2 4.19Å
865	R	78.2	Confident	73.8	Confident	116 Å²	116	76.1 Å²	76.1	44%	0.438	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.8	171.4	71.8	174.7	-177.6	-177.6	0.9	111.5	W826 L837 Q838	W826-R865 HydrophobicContact CD2-CG 4.02Å; W826-R865 HydrophobicContact CE3-CG 3.86Å; W826-R865 HydrophobicContact CH2-CB 3.74Å; W826-R865 HydrophobicContact CH2-CG 3.76Å; W826-R865 HydrophobicContact CZ2-CB 4.1Å; W826-R865 HydrophobicContact CZ2-CG 3.91Å; W826-R865 HydrophobicContact CZ3-CB 4.07Å; W826-R865 HydrophobicContact CZ3-CG 3.74Å; L837-R865 CarbonylContact C-O 3.55Å; L837-R865 VanDerWaalsContact CA-O 3.3Å; L837-R865 WeakPolarHBondContact CA-O 3.12Å; Q838-R865 HydrophobicContact CB-CG 4.01Å; Q838-R865 PolarHBondContact N-O 3.1Å; Q838-R865 PolarHBondContact O-N 2.88Å; Q838-R865 VanDerWaalsContact OE1-CZ 3.29Å
866	A	73.1	Confident	74.3	Confident	84 Å²	84	78 Å²	78	69%	0.694	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	146.6	172.3	0	0	0	0	0	111.6	G836	G836-A866 CarbonylContact O-C 3.56Å; G836-A866 WeakPolarHBondContact O-CA 3.24Å
867	C	75.2	Confident	74.8	Confident	23 Å²	23	75.6 Å²	75.6	16%	0.155	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	164.2	177.7	62.9	0	0	0	0	110.6	C829 G834 G836 L837 Q838	C829-C867 VanDerWaalsContact CA-SG 3.52Å; C829-C867 HydrophobicContact CB-CB 3.86Å; C829-C867 WeakPolarHBondContact CB-SG 3.17Å; C829-C867 VanDerWaalsContact SG-C 3.52Å; C829-C867 WeakPolarHBondContact SG-CB 3.45Å; C829-C867 CovalentContact SG-SG 2.02Å; C829-C867 PolarHBondContact SG-SG 2.77Å; G834-C867 VanDerWaalsContact O-O 3.08Å; G836-C867 CarbonylContact C-O 3.52Å; G836-C867 WeakPolarHBondContact CA-O 3.23Å; G836-C867 PolarHBondContact N-O 2.76Å; G836-C867 PolarHBondContact O-N 2.99Å; L837-C867 PolarHBondContact N-SG 3.14Å; L837-C867 VanDerWaalsContact N-SG 3.36Å; Q838-C867 HydrophobicContact CG-CB 3.9Å
868	G	69.2	Low	75.7	Confident	42 Å²	42	75.4 Å²	75.4	43%	0.433	44%	0.441	S	S	.	.			trans	111.9	141.2	171.1	0	0	0	0	0	114	G834	G834-G868 CarbonylContact O-C 3.46Å; G834-G868 VanDerWaalsContact O-CA 3.32Å; G834-G868 WeakPolarHBondContact O-CA 3.01Å
869	D	65	Low	76.8	Confident	124 Å²	124	73.1 Å²	73.1	66%	0.663	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-86.7	154.1	-177.6	-64.9	-40.9	0	0	0	112.2	C833 G834 C871	C833-D869 CarbonylContact C-O 3.39Å; C833-D869 WeakPolarHBondContact CA-O 3.49Å; C833-D869 VanDerWaalsContact CB-O 3.25Å; C833-D869 WeakPolarHBondContact CB-O 3.41Å; G834-D869 PolarHBondContact N-O 2.83Å; D869-C871 PolarHBondContact O-N 3.13Å
870	P	64.3	Low	77.5	Confident	87 Å²	87	68.6 Å²	68.6	57%	0.565	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-54	124.6	179.9	-25	34.1	0	0	0	113.2	E900	P870-E900 WeakPolarHBondContact CB-OE2 3.43Å; P870-E900 WeakPolarHBondContact CG-OE2 3.49Å
871	C	70.2	Confident	77.8	Confident	39 Å²	39	70.6 Å²	70.6	26%	0.264	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-73	146.8	-179.5	-73.8	0	0	0	0	112.6	C833 G834 D869	C833-C871 HydrophobicContact CB-CB 4.02Å; C833-C871 WeakPolarHBondContact CB-SG 3.22Å; C833-C871 PolarHBondContact O-SG 3.28Å; C833-C871 WeakPolarHBondContact SG-CA 3.24Å; C833-C871 WeakPolarHBondContact SG-CB 3.33Å; C833-C871 CovalentContact SG-SG 2.06Å; C833-C871 PolarHBondContact SG-SG 3.08Å; G834-C871 PolarHBondContact N-SG 2.91Å; G834-C871 VanDerWaalsContact N-SG 3.37Å; D869-C871 PolarHBondContact O-N 3.13Å
872	P	73.1	Confident	78.1	Confident	18 Å²	18	70.2 Å²	70.2	12%	0.117	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-59	152.2	174.7	24.9	-33.2	0	0	0	112.9	T898 T899 L905 H909 K913	P872-T898 CarbonylContact C-O 3.16Å; P872-T898 VanDerWaalsContact CA-O 3.29Å; P872-T898 WeakPolarHBondContact CA-O 3.18Å; P872-T898 WeakPolarHBondContact CB-O 3.38Å; P872-T899 HydrophobicContact CB-CG2 4.43Å; P872-L905 HydrophobicContact CB-CD1 3.86Å; P872-L905 HydrophobicContact CG-CD1 3.99Å; P872-H909 HydrophobicContact CG-CB 4.48Å; P872-K913 PolarHBondContact O-NZ 2.93Å
873	I	76.2	Confident	78.7	Confident	93 Å²	93	70 Å²	70	48%	0.477	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	154.3	-174.8	54.7	168.5	0	0	0	111.1	N875 T898	I873-N875 PolarHBondContact O-N 2.96Å; I873-T898 PolarHBondContact N-O 3.23Å; I873-T898 PolarHBondContact O-N 3.33Å
874	W	82.6	Confident	78.8	Confident	37 Å²	37	74 Å²	74	14%	0.14	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	114.8	172.2	-70.4	114.2	0	0	0	109.6	V895 C897 R907 C910 K913 K915 P916	W874-V895 HydrophobicContact CB-CG1 4.41Å; W874-V895 HydrophobicContact CD2-CG1 4.1Å; W874-V895 HydrophobicContact CE3-CG1 3.48Å; W874-V895 VanDerWaalsContact CE3-CG1 3.48Å; W874-V895 HydrophobicContact CZ3-CG1 4.05Å; W874-C897 HydrophobicContact CE3-CB 4.27Å; W874-C897 HydrophobicContact CZ3-CB 4.12Å; W874-R907 HydrophobicContact CH2-CB 4.22Å; W874-R907 HydrophobicContact CH2-CG 4.34Å; W874-R907 HydrophobicContact CZ3-CG 4.31Å; W874-C910 HydrophobicContact CD2-CB 3.7Å; W874-C910 HydrophobicContact CE3-CB 4.11Å; W874-C910 HydrophobicContact CG-CB 4.29Å; W874-C910 HydrophobicContact CH2-CB 3.86Å; W874-C910 HydrophobicContact CZ2-CB 3.41Å; W874-C910 VanDerWaalsContact CZ2-CB 3.41Å; W874-C910 HydrophobicContact CZ3-CB 4.19Å; W874-C910 PolarHBondContact NE1-O 2.79Å; W874-K913 PolarHBondContact NE1-O 3.1Å; W874-K915 HydrophobicContact CZ2-CG 4.25Å; W874-P916 HydrophobicContact CB-CG 3.79Å; W874-P916 HydrophobicContact CG-CG 4.22Å
875	N	80.1	Confident	79	Confident	94 Å²	94	76.3 Å²	76.3	50%	0.503	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.8	167.7	-165.7	7	0	0	0	110	I873 V895 C896 T898	I873-N875 PolarHBondContact O-N 2.96Å; N875-V895 WeakPolarHBondContact O-CA 3.32Å; N875-C896 PolarHBondContact N-O 2.97Å; N875-C896 PolarHBondContact O-N 3.18Å; N875-T898 HydrophobicContact CB-CG2 4.03Å; N875-T898 WeakPolarHBondContact CB-OG1 3.36Å
876	V	83.5	Confident	79.1	Confident	50 Å²	50	72.7 Å²	72.7	30%	0.303	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	120	-167.8	-173.8	0	0	0	0	109.5	R893 V895 P916	V876-R893 VanDerWaalsContact CG1-CD 3.4Å; V876-R893 HydrophobicContact CG1-CG 4.31Å; V876-R893 VanDerWaalsContact CG1-CZ 3.42Å; V876-R893 VanDerWaalsContact CG1-NE 3.33Å; V876-V895 HydrophobicContact CG1-CG2 4.37Å; V876-P916 HydrophobicContact CG2-CB 3.79Å; V876-P916 HydrophobicContact CG2-CG 3.68Å
877	G	81.3	Confident	79.5	Confident	29 Å²	29	69.5 Å²	69.5	30%	0.299	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	173.3	176.8	0	0	0	0	0	113.5	S894	G877-S894 PolarHBondContact N-O 2.84Å
878	T	86	Confident	79.9	Confident	132 Å²	132	77.4 Å²	77.4	81%	0.81	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	152.7	176.2	51.8	0	0	0	0	111.8	R893	T878-R893 WeakPolarHBondContact O-CB 3.45Å
879	W	86.9	Confident	80.7	Confident	76 Å²	76	75.6 Å²	75.6	29%	0.288	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	143.1	173.3	-69.6	108.9	0	0	0	111.7	K891 R892 R893 E918 D920	W879-K891 HydrophobicContact CB-CD 4.01Å; W879-K891 HydrophobicContact CB-CG 4.47Å; W879-K891 HydrophobicContact CD2-CD 4.01Å; W879-K891 HydrophobicContact CD2-CG 4.05Å; W879-K891 HydrophobicContact CE3-CB 4.2Å; W879-K891 HydrophobicContact CE3-CD 4.19Å; W879-K891 HydrophobicContact CE3-CG 3.7Å; W879-K891 HydrophobicContact CG-CD 3.94Å; W879-K891 HydrophobicContact CG-CG 4.4Å; W879-K891 HydrophobicContact CZ3-CG 4.26Å; W879-K891 WeakPolarHBondContact CZ3-O 3.44Å; W879-R892 CarbonylContact C-O 3.59Å; W879-R892 WeakPolarHBondContact CA-O 3.3Å; W879-R892 VanDerWaalsContact CE3-C 3.41Å; W879-R893 HydrophobicContact CD2-CB 3.93Å; W879-R893 HydrophobicContact CD2-CG 4.04Å; W879-R893 VanDerWaalsContact CE2-CD 3.5Å; W879-R893 HydrophobicContact CE3-CB 3.65Å; W879-R893 HydrophobicContact CE3-CG 3.76Å; W879-R893 HydrophobicContact CG-CB 4.45Å; W879-R893 HydrophobicContact CH2-CG 3.77Å; W879-R893 VanDerWaalsContact CZ2-CD 3.48Å; W879-R893 HydrophobicContact CZ2-CG 4.08Å; W879-R893 VanDerWaalsContact CZ2-CZ 3.45Å; W879-R893 VanDerWaalsContact CZ2-NE 3.31Å; W879-R893 HydrophobicContact CZ3-CB 4Å; W879-R893 HydrophobicContact CZ3-CG 3.62Å; W879-E918 WeakPolarHBondContact CZ3-O 3.31Å; W879-D920 HydrophobicContact CH2-CB 3.5Å; W879-D920 HydrophobicContact CZ2-CB 3.87Å; W879-D920 HydrophobicContact CZ3-CB 3.89Å
880	S	86.1	Confident	81.6	Confident	59 Å²	59	73.5 Å²	73.5	41%	0.413	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-68.3	166.1	168.1	73.7	0	0	0	0	111	K891 R892	S880-K891 WeakPolarHBondContact O-CB 3.26Å; S880-R892 WeakPolarHBondContact CB-O 3.16Å; S880-R892 PolarHBondContact N-O 2.81Å; S880-R892 PolarHBondContact OG-N 2.69Å; S880-R892 PolarHBondContact OG-O 2.82Å
881	Q	85.8	Confident	82.6	Confident	178 Å²	178	72.1 Å²	72.1	83%	0.832	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-58.8	156.2	163.4	-65.1	-168	2.5	0	0	110.7
882	C	88.6	Confident	83.4	Confident	30 Å²	30	77.2 Å²	77.2	20%	0.203	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-62.2	138.2	177.7	-164.8	0	0	0	0	109.4	K884 C922 L924	C882-K884 PolarHBondContact O-N 3.11Å; C882-C922 WeakPolarHBondContact CA-SG 3.47Å; C882-C922 HydrophobicContact CB-CB 3.96Å; C882-C922 WeakPolarHBondContact CB-SG 3.41Å; C882-C922 WeakPolarHBondContact SG-CB 3.33Å; C882-C922 CovalentContact SG-SG 2.03Å; C882-C922 PolarHBondContact SG-SG 2.8Å; C882-L924 HydrophobicContact CB-CD1 4.01Å; C882-L924 HydrophobicContact CB-CG 4.4Å
883	S	88.4	Confident	84	Confident	58 Å²	58	79.3 Å²	79.3	41%	0.406	41%	0.409	S	S	.	.	S	Bend	trans	-64.3	-10.4	-177.9	60.4	0	0	0	0	114.5	F890	S883-F890 VanDerWaalsContact CB-O 3.29Å; S883-F890 WeakPolarHBondContact CB-O 3.41Å; S883-F890 PolarHBondContact N-O 2.86Å; S883-F890 VanDerWaalsContact OG-CD1 3.24Å; S883-F890 WeakPolarHBondContact OG-CD1 3.45Å; S883-F890 VanDerWaalsContact OG-CE1 3.31Å; S883-F890 WeakPolarHBondContact OG-CE1 3.27Å; S883-F890 WeakPolarHBondContact OG-CG 3.19Å; S883-F890 PolarHBondContact OG-N 3.2Å; S883-F890 PolarHBondContact OG-O 2.81Å
884	K	82.1	Confident	84.2	Confident	120 Å²	120	78.4 Å²	78.4	52%	0.522	41%	0.411	S	S	.	.	S	Bend	trans	-130.4	155.4	174.3	-60	-170.6	-173.8	169.1	0	109.4	C882 R888 L924	C882-K884 PolarHBondContact O-N 3.11Å; K884-R888 WeakPolarHBondContact CD-O 3.42Å; K884-R888 WeakPolarHBondContact CE-O 3.31Å; K884-R888 PolarHBondContact NZ-O 2.76Å; K884-R888 VanDerWaalsContact NZ-O 3.17Å; K884-L924 WeakPolarHBondContact O-CD1 3.39Å
885	S	83.9	Confident	84.3	Confident	113 Å²	113	76.7 Å²	76.7	79%	0.79	40%	0.404	S	S	*	.	S	Bend	trans	-90.4	-15.7	175.8	49.6	0	0	0	0	114.1	L924	S885-L924 VanDerWaalsContact C-CD1 3.45Å; S885-L924 WeakPolarHBondContact O-CD1 3.45Å
886	C	80	Confident	84.3	Confident	41 Å²	41	74.8 Å²	74.8	28%	0.277	40%	0.398	S	S	.	.	S	Bend	trans	-144.9	161	171.2	64.3	0	0	0	0	110.6	C927	C886-C927 HydrophobicContact CB-CB 4.03Å; C886-C927 WeakPolarHBondContact CB-SG 3.32Å; C886-C927 PolarHBondContact O-SG 2.67Å; C886-C927 WeakPolarHBondContact SG-CB 3.21Å; C886-C927 CovalentContact SG-SG 2.04Å; C886-C927 PolarHBondContact SG-SG 3.3Å
887	G	81.1	Confident	84.2	Confident	17 Å²	17	72.4 Å²	72.4	18%	0.175	38%	0.383	C	S	.	.	S	Bend	trans	69.4	-154	179.6	0	0	0	0	0	114.5	L924 T925	G887-L924 PolarHBondContact O-N 3.39Å; G887-T925 PolarHBondContact N-O 3.03Å
888	R	82.9	Confident	84.1	Confident	188 Å²	188	71.5 Å²	71.5	71%	0.709	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.1	-178.2	-53.2	-162.8	178	160	-0.8	111.8	K884 N923	K884-R888 WeakPolarHBondContact CD-O 3.42Å; K884-R888 WeakPolarHBondContact CE-O 3.31Å; K884-R888 PolarHBondContact NZ-O 2.76Å; K884-R888 VanDerWaalsContact NZ-O 3.17Å; R888-N923 WeakPolarHBondContact CG-OD1 3.39Å
889	G	85.6	Confident	83.4	Confident	5 Å²	5	67.1 Å²	67.1	5%	0.052	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	-170.5	174.8	0	0	0	0	0	112.5	C922	G889-C922 CarbonylContact C-O 3.58Å; G889-C922 PolarHBondContact N-O 2.88Å; G889-C922 PolarHBondContact O-N 3Å; G889-C922 VanDerWaalsContact O-O 3.12Å
890	F	84.3	Confident	82.3	Confident	80 Å²	80	70.5 Å²	70.5	35%	0.351	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.7	176.6	56.1	-92.9	0	0	0	110.7	S883 R892 L919 D920 C922	S883-F890 VanDerWaalsContact CB-O 3.29Å; S883-F890 WeakPolarHBondContact CB-O 3.41Å; S883-F890 PolarHBondContact N-O 2.86Å; S883-F890 VanDerWaalsContact OG-CD1 3.24Å; S883-F890 WeakPolarHBondContact OG-CD1 3.45Å; S883-F890 VanDerWaalsContact OG-CE1 3.31Å; S883-F890 WeakPolarHBondContact OG-CE1 3.27Å; S883-F890 WeakPolarHBondContact OG-CG 3.19Å; S883-F890 PolarHBondContact OG-N 3.2Å; S883-F890 PolarHBondContact OG-O 2.81Å; F890-R892 HydrophobicContact CD2-CG 4.25Å; F890-L919 HydrophobicContact CB-CD2 3.87Å; F890-L919 HydrophobicContact CB-CG 4.35Å; F890-L919 HydrophobicContact CD2-CD1 4.14Å; F890-L919 HydrophobicContact CD2-CG 4.38Å; F890-L919 HydrophobicContact CG-CD2 4.32Å; F890-D920 CarbonylContact C-O 3.59Å; F890-D920 VanDerWaalsContact CA-O 3.26Å; F890-D920 WeakPolarHBondContact CA-O 3.43Å; F890-C922 VanDerWaalsContact CA-SG 3.58Å; F890-C922 PolarHBondContact N-SG 2.97Å; F890-C922 VanDerWaalsContact N-SG 3.4Å
891	K	86	Confident	81.3	Confident	57 Å²	57	74.8 Å²	74.8	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.8	171.8	58.3	-176.5	-175.9	-173.4	0	109.4	W879 S880 L919 D920	W879-K891 HydrophobicContact CB-CD 4.01Å; W879-K891 HydrophobicContact CB-CG 4.47Å; W879-K891 HydrophobicContact CD2-CD 4.01Å; W879-K891 HydrophobicContact CD2-CG 4.05Å; W879-K891 HydrophobicContact CE3-CB 4.2Å; W879-K891 HydrophobicContact CE3-CD 4.19Å; W879-K891 HydrophobicContact CE3-CG 3.7Å; W879-K891 HydrophobicContact CG-CD 3.94Å; W879-K891 HydrophobicContact CG-CG 4.4Å; W879-K891 HydrophobicContact CZ3-CG 4.26Å; W879-K891 WeakPolarHBondContact CZ3-O 3.44Å; S880-K891 WeakPolarHBondContact O-CB 3.26Å; K891-L919 WeakPolarHBondContact O-CA 3.26Å; K891-D920 VanDerWaalsContact CE-OD2 3.25Å; K891-D920 WeakPolarHBondContact CE-OD2 3.38Å; K891-D920 HydrophobicContact CG-CB 4.2Å; K891-D920 PolarHBondContact N-O 3.49Å; K891-D920 IonicContact NZ-OD2 3.94Å; K891-D920 PolarHBondContact O-N 2.81Å
892	R	86.8	Confident	80.3	Confident	146 Å²	146	69 Å²	69	55%	0.551	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	149.7	-178	-63.5	-175.1	179.1	-178.6	0.1	110.8	W879 S880 F890 E918 L919	W879-R892 CarbonylContact C-O 3.59Å; W879-R892 WeakPolarHBondContact CA-O 3.3Å; W879-R892 VanDerWaalsContact CE3-C 3.41Å; S880-R892 WeakPolarHBondContact CB-O 3.16Å; S880-R892 PolarHBondContact N-O 2.81Å; S880-R892 PolarHBondContact OG-N 2.69Å; S880-R892 PolarHBondContact OG-O 2.82Å; F890-R892 HydrophobicContact CD2-CG 4.25Å; R892-E918 CarbonylContact C-O 3.31Å; R892-E918 VanDerWaalsContact CA-O 3.27Å; R892-E918 WeakPolarHBondContact CA-O 3.02Å; R892-L919 HydrophobicContact CG-CD1 3.85Å; R892-L919 HydrophobicContact CG-CG 4.21Å
893	R	85	Confident	79.6	Confident	62 Å²	62	73 Å²	73	23%	0.234	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.8	170.7	66.9	-179.3	176.2	-174.7	-4.9	111.2	V876 T878 W879 Q917 E918	V876-R893 VanDerWaalsContact CG1-CD 3.4Å; V876-R893 HydrophobicContact CG1-CG 4.31Å; V876-R893 VanDerWaalsContact CG1-CZ 3.42Å; V876-R893 VanDerWaalsContact CG1-NE 3.33Å; T878-R893 WeakPolarHBondContact O-CB 3.45Å; W879-R893 HydrophobicContact CD2-CB 3.93Å; W879-R893 HydrophobicContact CD2-CG 4.04Å; W879-R893 VanDerWaalsContact CE2-CD 3.5Å; W879-R893 HydrophobicContact CE3-CB 3.65Å; W879-R893 HydrophobicContact CE3-CG 3.76Å; W879-R893 HydrophobicContact CG-CB 4.45Å; W879-R893 HydrophobicContact CH2-CG 3.77Å; W879-R893 VanDerWaalsContact CZ2-CD 3.48Å; W879-R893 HydrophobicContact CZ2-CG 4.08Å; W879-R893 VanDerWaalsContact CZ2-CZ 3.45Å; W879-R893 VanDerWaalsContact CZ2-NE 3.31Å; W879-R893 HydrophobicContact CZ3-CB 4Å; W879-R893 HydrophobicContact CZ3-CG 3.62Å; R893-Q917 VanDerWaalsContact CZ-O 3.23Å; R893-Q917 PolarHBondContact NE-O 2.81Å; R893-Q917 PolarHBondContact NH2-O 2.86Å; R893-E918 PolarHBondContact N-O 2.91Å
894	S	80.4	Confident	79	Confident	75 Å²	75	75.7 Å²	75.7	52%	0.524	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	143.1	174.5	55.9	0	0	0	0	111	G877	G877-S894 PolarHBondContact N-O 2.84Å
895	V	85.1	Confident	78.7	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	120.1	174.7	178.2	0	0	0	0	108	W874 N875 V876 P916 E918	W874-V895 HydrophobicContact CB-CG1 4.41Å; W874-V895 HydrophobicContact CD2-CG1 4.1Å; W874-V895 HydrophobicContact CE3-CG1 3.48Å; W874-V895 VanDerWaalsContact CE3-CG1 3.48Å; W874-V895 HydrophobicContact CZ3-CG1 4.05Å; N875-V895 WeakPolarHBondContact O-CA 3.32Å; V876-V895 HydrophobicContact CG1-CG2 4.37Å; V895-P916 HydrophobicContact CG1-CB 4.49Å; V895-P916 HydrophobicContact CG1-CG 4.31Å; V895-P916 HydrophobicContact CG2-CB 4.31Å; V895-E918 HydrophobicContact CB-CG 4.04Å; V895-E918 HydrophobicContact CG2-CG 3.62Å
896	C	79.4	Confident	78.3	Confident	53 Å²	53	71 Å²	71	36%	0.358	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.6	-176.3	-64.2	0	0	0	0	110.1	N875	N875-C896 PolarHBondContact N-O 2.97Å; N875-C896 PolarHBondContact O-N 3.18Å
897	C	82.4	Confident	77.8	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.6	174.5	-177.9	0	0	0	0	107.7	W874 L905 C910	W874-C897 HydrophobicContact CE3-CB 4.27Å; W874-C897 HydrophobicContact CZ3-CB 4.12Å; C897-L905 HydrophobicContact CB-CB 4.49Å; C897-L905 PolarHBondContact O-N 2.87Å; C897-C910 HydrophobicContact CB-CB 3.75Å; C897-C910 WeakPolarHBondContact CB-SG 3.49Å; C897-C910 WeakPolarHBondContact SG-CB 3.1Å; C897-C910 PolarHBondContact SG-N 3.21Å; C897-C910 CovalentContact SG-SG 2.03Å; C897-C910 PolarHBondContact SG-SG 3Å
898	T	79.6	Confident	77.2	Confident	10 Å²	10	80.4 Å²	80.4	6%	0.061	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.9	-179.3	57.4	0	0	0	0	111.6	P872 I873 N875 L903 N904	P872-T898 CarbonylContact C-O 3.16Å; P872-T898 VanDerWaalsContact CA-O 3.29Å; P872-T898 WeakPolarHBondContact CA-O 3.18Å; P872-T898 WeakPolarHBondContact CB-O 3.38Å; I873-T898 PolarHBondContact N-O 3.23Å; I873-T898 PolarHBondContact O-N 3.33Å; N875-T898 HydrophobicContact CB-CG2 4.03Å; N875-T898 WeakPolarHBondContact CB-OG1 3.36Å; T898-L903 VanDerWaalsContact CA-O 3.27Å; T898-L903 WeakPolarHBondContact CA-O 3.37Å; T898-N904 WeakPolarHBondContact CG2-OD1 3.07Å
899	T	70.2	Confident	76.6	Confident	40 Å²	40	76.8 Å²	76.8	25%	0.245	40%	0.398	C	S	.	.			trans	-74.1	168.4	164.4	60.9	0	0	0	0	110.5	P872 N901 G902 L903 L905	P872-T899 HydrophobicContact CB-CG2 4.43Å; T899-N901 PolarHBondContact O-N 2.6Å; T899-N901 VanDerWaalsContact O-N 3.15Å; T899-G902 PolarHBondContact O-N 3.04Å; T899-L903 PolarHBondContact N-O 2.87Å; T899-L903 VanDerWaalsContact N-O 3.09Å; T899-L903 WeakPolarHBondContact OG1-CB 3.36Å; T899-L903 PolarHBondContact OG1-N 2.9Å; T899-L905 HydrophobicContact CG2-CD1 3.47Å; T899-L905 VanDerWaalsContact CG2-CD1 3.47Å; T899-L905 HydrophobicContact CG2-CD2 4.44Å; T899-L905 HydrophobicContact CG2-CG 3.93Å
900	E	64.6	Low	76.1	Confident	147 Å²	147	76.7 Å²	76.7	69%	0.687	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23	177.2	-160	167.3	-163.8	0	0	112.6	P870 G902	P870-E900 WeakPolarHBondContact CB-OE2 3.43Å; P870-E900 WeakPolarHBondContact CG-OE2 3.49Å; E900-G902 VanDerWaalsContact C-N 3.28Å; E900-G902 PolarHBondContact O-N 3.26Å
901	N	65.9	Low	74.9	Confident	149 Å²	149	77.2 Å²	77.2	80%	0.797	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	10.4	176.5	-60.6	-7.4	0	0	0	113.6	T899 L903	T899-N901 PolarHBondContact O-N 2.6Å; T899-N901 VanDerWaalsContact O-N 3.15Å; N901-L903 VanDerWaalsContact C-N 3.33Å; N901-L903 PolarHBondContact O-N 3.05Å
902	G	64.5	Low	73.8	Confident	56 Å²	56	78.6 Å²	78.6	58%	0.577	44%	0.441	S	S	*	.			trans	78.3	8.7	176	0	0	0	0	0	115.6	T899 E900	T899-G902 PolarHBondContact O-N 3.04Å; E900-G902 VanDerWaalsContact C-N 3.28Å; E900-G902 PolarHBondContact O-N 3.26Å
903	L	73.6	Confident	72.7	Confident	115 Å²	115	76.1 Å²	76.1	60%	0.602	43%	0.434	S	S	*	.			trans	-81.1	125.6	-178.3	-121.6	141	0	0	0	110.7	T898 T899 N901 L905	T898-L903 VanDerWaalsContact CA-O 3.27Å; T898-L903 WeakPolarHBondContact CA-O 3.37Å; T899-L903 PolarHBondContact N-O 2.87Å; T899-L903 VanDerWaalsContact N-O 3.09Å; T899-L903 WeakPolarHBondContact OG1-CB 3.36Å; T899-L903 PolarHBondContact OG1-N 2.9Å; N901-L903 VanDerWaalsContact C-N 3.33Å; N901-L903 PolarHBondContact O-N 3.05Å; L903-L905 PolarHBondContact O-N 2.78Å
904	N	76.1	Confident	72	Confident	114 Å²	114	84.9 Å²	84.9	61%	0.61	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.6	179.6	-76.3	-39.1	0	0	0	110.9	T898	T898-N904 WeakPolarHBondContact CG2-OD1 3.07Å
905	L	75.7	Confident	71.8	Confident	52 Å²	52	86.4 Å²	86.4	27%	0.272	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	156.6	175.7	-66.8	-179.2	0	0	0	111.8	P872 C897 T899 L903 H909	P872-L905 HydrophobicContact CB-CD1 3.86Å; P872-L905 HydrophobicContact CG-CD1 3.99Å; C897-L905 HydrophobicContact CB-CB 4.49Å; C897-L905 PolarHBondContact O-N 2.87Å; T899-L905 HydrophobicContact CG2-CD1 3.47Å; T899-L905 VanDerWaalsContact CG2-CD1 3.47Å; T899-L905 HydrophobicContact CG2-CD2 4.44Å; T899-L905 HydrophobicContact CG2-CG 3.93Å; L903-L905 PolarHBondContact O-N 2.78Å; L905-H909 HydrophobicContact CB-CB 4.36Å; L905-H909 HydrophobicContact CD1-CB 4.24Å
906	P	76	Confident	71.5	Confident	82 Å²	82	87.9 Å²	87.9	53%	0.532	47%	0.474	S	S	.	.			trans	-58.9	144.8	171.2	-20.8	33.1	0	0	0	111.8	N908 H909	P906-N908 VanDerWaalsContact CB-OD1 3.29Å; P906-N908 WeakPolarHBondContact CB-OD1 2.71Å; P906-N908 PolarHBondContact O-N 3.18Å; P906-N908 PolarHBondContact O-OD1 3.49Å; P906-H909 PolarHBondContact O-N 3.39Å; P906-H909 VanDerWaalsContact O-N 3.09Å
907	R	68.7	Low	71.4	Confident	148 Å²	148	90.7 Å²	90.7	56%	0.558	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-57.7	-27	-169.9	-75.2	178.9	173.6	163	-2.8	114.6	W874 H909 C910	W874-R907 HydrophobicContact CH2-CB 4.22Å; W874-R907 HydrophobicContact CH2-CG 4.34Å; W874-R907 HydrophobicContact CZ3-CG 4.31Å; R907-H909 PolarHBondContact O-N 3.26Å; R907-C910 PolarHBondContact O-N 2.97Å
908	N	68.8	Low	71.4	Confident	108 Å²	108	93.6 Å²	93.6	58%	0.578	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-62.6	-24.6	179	58.7	-19.6	0	0	0	113.6	P906 C910 S911	P906-N908 VanDerWaalsContact CB-OD1 3.29Å; P906-N908 WeakPolarHBondContact CB-OD1 2.71Å; P906-N908 PolarHBondContact O-N 3.18Å; P906-N908 PolarHBondContact O-OD1 3.49Å; N908-C910 VanDerWaalsContact C-N 3.26Å; N908-C910 PolarHBondContact O-N 2.86Å; N908-S911 VanDerWaalsContact CA-OG 3.28Å; N908-S911 WeakPolarHBondContact CA-OG 3.3Å; N908-S911 WeakPolarHBondContact O-CB 3.21Å; N908-S911 PolarHBondContact O-N 3.29Å; N908-S911 PolarHBondContact O-OG 3.25Å
909	H	69.1	Low	71.5	Confident	113 Å²	113	96.9 Å²	96.9	52%	0.523	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-72.4	-15.5	177.9	-74.8	-99.3	0	0	0	114	P872 L905 P906 R907	P872-H909 HydrophobicContact CG-CB 4.48Å; L905-H909 HydrophobicContact CB-CB 4.36Å; L905-H909 HydrophobicContact CD1-CB 4.24Å; P906-H909 PolarHBondContact O-N 3.39Å; P906-H909 VanDerWaalsContact O-N 3.09Å; R907-H909 PolarHBondContact O-N 3.26Å
910	C	76.1	Confident	72	Confident	3 Å²	3	97.4 Å²	97.4	2%	0.02	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-111	6.2	175.4	-71.8	0	0	0	0	113.4	W874 C897 R907 N908 G912 K913	W874-C910 HydrophobicContact CD2-CB 3.7Å; W874-C910 HydrophobicContact CE3-CB 4.11Å; W874-C910 HydrophobicContact CG-CB 4.29Å; W874-C910 HydrophobicContact CH2-CB 3.86Å; W874-C910 HydrophobicContact CZ2-CB 3.41Å; W874-C910 VanDerWaalsContact CZ2-CB 3.41Å; W874-C910 HydrophobicContact CZ3-CB 4.19Å; W874-C910 PolarHBondContact NE1-O 2.79Å; C897-C910 HydrophobicContact CB-CB 3.75Å; C897-C910 WeakPolarHBondContact CB-SG 3.49Å; C897-C910 WeakPolarHBondContact SG-CB 3.1Å; C897-C910 PolarHBondContact SG-N 3.21Å; C897-C910 CovalentContact SG-SG 2.03Å; C897-C910 PolarHBondContact SG-SG 3Å; R907-C910 PolarHBondContact O-N 2.97Å; N908-C910 VanDerWaalsContact C-N 3.26Å; N908-C910 PolarHBondContact O-N 2.86Å; C910-G912 PolarHBondContact O-N 2.69Å; C910-G912 VanDerWaalsContact O-N 3.1Å; C910-K913 PolarHBondContact O-N 3.24Å; C910-K913 VanDerWaalsContact O-N 3.07Å
911	S	59.6	Low	72.7	Confident	90 Å²	90	96.3 Å²	96.3	63%	0.629	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.6	-173.6	-67.8	0	0	0	0	115.5	N908	N908-S911 VanDerWaalsContact CA-OG 3.28Å; N908-S911 WeakPolarHBondContact CA-OG 3.3Å; N908-S911 WeakPolarHBondContact O-CB 3.21Å; N908-S911 PolarHBondContact O-N 3.29Å; N908-S911 PolarHBondContact O-OG 3.25Å
912	G	61.4	Low	73.5	Confident	86 Å²	86	90 Å²	90	89%	0.887	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.1	177.9	0	0	0	0	0	115.2	C910	C910-G912 PolarHBondContact O-N 2.69Å; C910-G912 VanDerWaalsContact O-N 3.1Å
913	K	63.8	Low	74.3	Confident	94 Å²	94	92.6 Å²	92.6	41%	0.409	48%	0.48	S	S	.	.	S	Bend	trans	-110.4	146.2	178.9	-68.4	-175.4	-179.8	172	0	110.7	P872 W874 C910 K915	P872-K913 PolarHBondContact O-NZ 2.93Å; W874-K913 PolarHBondContact NE1-O 3.1Å; C910-K913 PolarHBondContact O-N 3.24Å; C910-K913 VanDerWaalsContact O-N 3.07Å; K913-K915 PolarHBondContact O-N 2.98Å
914	R	70.1	Confident	74.3	Confident	246 Å²	246	90.6 Å²	90.6	93%	0.928	47%	0.469	S	S	*	.			trans	-54.3	109.9	-177.9	-171.4	176.8	-176	179.9	1.1	110.8	P916	R914-P916 WeakPolarHBondContact O-CD 3.2Å
915	K	76.8	Confident	74.3	Confident	108 Å²	108	90.2 Å²	90.2	47%	0.47	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-65.9	125.6	-177.6	-170.7	-176.4	177.6	-169.6	0	110.7	W874 K913 E918	W874-K915 HydrophobicContact CZ2-CG 4.25Å; K913-K915 PolarHBondContact O-N 2.98Å; K915-E918 WeakPolarHBondContact CE-OE1 3.31Å; K915-E918 VanDerWaalsContact NZ-CD 3.34Å; K915-E918 IonicContact NZ-OE1 2.97Å; K915-E918 PolarHBondContact NZ-OE1 2.75Å; K915-E918 IonicContact NZ-OE2 3.15Å
916	P	79.1	Confident	73.9	Confident	32 Å²	32	93.1 Å²	93.1	21%	0.208	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-61.7	146.8	173	-24.1	34.5	0	0	0	112.5	W874 V876 V895 R914 E918	W874-P916 HydrophobicContact CB-CG 3.79Å; W874-P916 HydrophobicContact CG-CG 4.22Å; V876-P916 HydrophobicContact CG2-CB 3.79Å; V876-P916 HydrophobicContact CG2-CG 3.68Å; V895-P916 HydrophobicContact CG1-CB 4.49Å; V895-P916 HydrophobicContact CG1-CG 4.31Å; V895-P916 HydrophobicContact CG2-CB 4.31Å; R914-P916 WeakPolarHBondContact O-CD 3.2Å; P916-E918 PolarHBondContact O-N 2.78Å
917	Q	77.1	Confident	73.4	Confident	112 Å²	112	96 Å²	96	52%	0.523	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-65.8	127.4	179.8	-176.9	175.7	10.1	0	0	111.2	R893 L919	R893-Q917 VanDerWaalsContact CZ-O 3.23Å; R893-Q917 PolarHBondContact NE-O 2.81Å; R893-Q917 PolarHBondContact NH2-O 2.86Å; Q917-L919 VanDerWaalsContact CD-O 3.3Å; Q917-L919 WeakPolarHBondContact CG-O 3.36Å; Q917-L919 PolarHBondContact NE2-O 2.74Å
918	E	83.1	Confident	73.6	Confident	60 Å²	60	93.4 Å²	93.4	28%	0.28	51%	0.511	S	S	.	.	S	Bend	trans	-92	-17.2	-179.7	-74.3	175	-171.7	0	0	113.3	W879 R892 R893 V895 K915 P916	W879-E918 WeakPolarHBondContact CZ3-O 3.31Å; R892-E918 CarbonylContact C-O 3.31Å; R892-E918 VanDerWaalsContact CA-O 3.27Å; R892-E918 WeakPolarHBondContact CA-O 3.02Å; R893-E918 PolarHBondContact N-O 2.91Å; V895-E918 HydrophobicContact CB-CG 4.04Å; V895-E918 HydrophobicContact CG2-CG 3.62Å; K915-E918 WeakPolarHBondContact CE-OE1 3.31Å; K915-E918 VanDerWaalsContact NZ-CD 3.34Å; K915-E918 IonicContact NZ-OE1 2.97Å; K915-E918 PolarHBondContact NZ-OE1 2.75Å; K915-E918 IonicContact NZ-OE2 3.15Å; P916-E918 PolarHBondContact O-N 2.78Å
919	L	80.7	Confident	73.9	Confident	80 Å²	80	92.6 Å²	92.6	42%	0.419	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	125	-173.5	-161.7	140.1	0	0	0	110.1	F890 K891 R892 Q917	F890-L919 HydrophobicContact CB-CD2 3.87Å; F890-L919 HydrophobicContact CB-CG 4.35Å; F890-L919 HydrophobicContact CD2-CD1 4.14Å; F890-L919 HydrophobicContact CD2-CG 4.38Å; F890-L919 HydrophobicContact CG-CD2 4.32Å; K891-L919 WeakPolarHBondContact O-CA 3.26Å; R892-L919 HydrophobicContact CG-CD1 3.85Å; R892-L919 HydrophobicContact CG-CG 4.21Å; Q917-L919 VanDerWaalsContact CD-O 3.3Å; Q917-L919 WeakPolarHBondContact CG-O 3.36Å; Q917-L919 PolarHBondContact NE2-O 2.74Å
920	D	81.8	Confident	74.2	Confident	50 Å²	50	91.4 Å²	91.4	27%	0.267	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.2	-177.2	-172	25.3	0	0	0	110.6	W879 F890 K891	W879-D920 HydrophobicContact CH2-CB 3.5Å; W879-D920 HydrophobicContact CZ2-CB 3.87Å; W879-D920 HydrophobicContact CZ3-CB 3.89Å; F890-D920 CarbonylContact C-O 3.59Å; F890-D920 VanDerWaalsContact CA-O 3.26Å; F890-D920 WeakPolarHBondContact CA-O 3.43Å; K891-D920 VanDerWaalsContact CE-OD2 3.25Å; K891-D920 WeakPolarHBondContact CE-OD2 3.38Å; K891-D920 HydrophobicContact CG-CB 4.2Å; K891-D920 PolarHBondContact N-O 3.49Å; K891-D920 IonicContact NZ-OD2 3.94Å; K891-D920 PolarHBondContact O-N 2.81Å
921	L	80	Confident	74.1	Confident	125 Å²	125	96.6 Å²	96.6	65%	0.654	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	137	179.7	-76.7	108.8	0	0	0	110.8
922	C	82.1	Confident	75	Confident	17 Å²	17	97.1 Å²	97.1	12%	0.115	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.4	170.6	41.7	0	0	0	0	108.8	C882 G889 F890	C882-C922 WeakPolarHBondContact CA-SG 3.47Å; C882-C922 HydrophobicContact CB-CB 3.96Å; C882-C922 WeakPolarHBondContact CB-SG 3.41Å; C882-C922 WeakPolarHBondContact SG-CB 3.33Å; C882-C922 CovalentContact SG-SG 2.03Å; C882-C922 PolarHBondContact SG-SG 2.8Å; G889-C922 CarbonylContact C-O 3.58Å; G889-C922 PolarHBondContact N-O 2.88Å; G889-C922 PolarHBondContact O-N 3Å; G889-C922 VanDerWaalsContact O-O 3.12Å; F890-C922 VanDerWaalsContact CA-SG 3.58Å; F890-C922 PolarHBondContact N-SG 2.97Å; F890-C922 VanDerWaalsContact N-SG 3.4Å
923	N	80.6	Confident	75.9	Confident	110 Å²	110	97.8 Å²	97.8	59%	0.588	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	115	171.1	-70.1	-17.1	0	0	0	107.7	R888	R888-N923 WeakPolarHBondContact CG-OD1 3.39Å
924	L	73.8	Confident	76.7	Confident	72 Å²	72	98.1 Å²	98.1	38%	0.377	51%	0.512	S	S	.	.			trans	-93.6	175.6	170.8	-60.9	-177.7	0	0	0	109.7	C882 K884 S885 G887	C882-L924 HydrophobicContact CB-CD1 4.01Å; C882-L924 HydrophobicContact CB-CG 4.4Å; K884-L924 WeakPolarHBondContact O-CD1 3.39Å; S885-L924 VanDerWaalsContact C-CD1 3.45Å; S885-L924 WeakPolarHBondContact O-CD1 3.45Å; G887-L924 PolarHBondContact O-N 3.39Å
925	T	75.5	Confident	77.2	Confident	107 Å²	107	86.7 Å²	86.7	66%	0.656	48%	0.48	S	S	*	.	S	Bend	trans	-50	146.2	175.3	48.3	0	0	0	0	110.6	G887 C927	G887-T925 PolarHBondContact N-O 3.03Å; T925-C927 PolarHBondContact O-N 2.96Å
926	P	68.4	Low	77.3	Confident	113 Å²	113	84.9 Å²	84.9	73%	0.734	48%	0.481	S	S	*	.			trans	-50.3	133.8	177	-22.1	31.4	0	0	0	110.3
927	C	65.3	Low	77.1	Confident	141 Å²	141	89.7 Å²	89.7	95%	0.953	51%	0.506	S	S	*	.			trans	-70.1	0	150	-41.8	0	0	0	0	105.9	C886 T925	C886-C927 HydrophobicContact CB-CB 4.03Å; C886-C927 WeakPolarHBondContact CB-SG 3.32Å; C886-C927 PolarHBondContact O-SG 2.67Å; C886-C927 WeakPolarHBondContact SG-CB 3.21Å; C886-C927 CovalentContact SG-SG 2.04Å; C886-C927 PolarHBondContact SG-SG 3.3Å; T925-C927 PolarHBondContact O-N 2.96Å

Retrieved 927 of 927 residues in 506.4 ms (Link to these results)

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