A0A087XAQ1_POEFO Loading...

Multifunctional ROCO family signaling regulator 1

AlphaFold DB , UniProt , Accession A0A087XAQ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,025 aa.

						>A0A087XAQ1_POEFO|A0A087XAQ1
MKTLNENNEEEEEKEGSGCNAMEETENNLKTARLWRDAALRSRKLRSNLRQLTLCSKNNQIILPDDISDIEVLNLGNNSLQELPDGLQSTLNNLRILILRRNRFSSVPRVVFELGQLVELDMSHNCVRSLPDGVGQLRGLKKLCISHNKLQNLPAQIGALQTLEELDISFNDLHDFPRSFTSLCKLRTLDADHNKLNRFPAEILALGELEELDLSGNKFQALPADILRLKSTKILWLSSLHMSSLPDTFCHLHNLESVMLDGNNLTVLPSSFAQLQRLKMINLSSNEFNEFPQAVLSITGLEELYLSRNKLTNIPEGIAQLVKLVNLWLDNNNITHLPDSIVELEKLEELVLQGNQIAILPDHFGKLSRVNIWKVKDNPLIQPPYEVCMKGIPYIAVYQKELAQSQLAVKPWLKLVLMGTKNAGKTKLRQSLVPTEQDVRGTQGNKGIEVTNWVADSDRHLMFLVYDLSGNLNYDLIKPFFLSPGALYVLVVNLKAYSPKNFYAHIGYFLHLLCAKVPHAVVCLVGTHADLCGEMEVEEKTLDIHRQIGLQERSDIQCLRSLVQQVDLALEQGYKVRTSSPHVLFYGVSDKNLRRKKAQLQYMLNQRLQILSPVLNISCTETQKNIQRLREKLMSVADHREIFPNLHRVLPKSWQMLEELHFKSKDLWLSWWSSARLGLQAGLTEDRLQSALSYLHESGKLLYFEDSITLKEYVFHNLPRFIAILNVFFQRDKSTLLDRLLSEGERGDKGRVSLVIEDEKGENLRVTHLQQHLEGFLHDGLLPSNVIRLLLRPHIETQQDLHLIMELLEKMGVCYCINKPRTKPLNGATVWYKFPSYVSSEEAQFEDSVGGNSLNLSPLFSVEQLYIQYSFPFLFPPGLFARFSVQINNHVVQRSDGRHQIFAYRGKVPVVISHQPSKGKLFMETLSIVSHASLPNIWTAWQAVTPLVEELNMLLQEWPGLHYNVHILCSKCLKRGSSNPHAFPGELLSQLRPDGLTEIICPKNGSERVDVALVYPPTPTATSPK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.4	Very low	25	Very low	239 Å²	239	172.4 Å²	172.4	100%	1.177	86%	0.858	S	S	*	*				0	77.3	0	-76.3	173.6	168.8	0	0	106.9
2	K	24	Very low	24.9	Very low	212 Å²	212	174.9 Å²	174.9	92%	0.922	87%	0.866	S	S	*	*				53.7	84.5	105.4	-79.9	-166.4	176.5	-173.9	0	113.1
3	T	24.1	Very low	24.8	Very low	136 Å²	136	173.5 Å²	173.5	83%	0.834	86%	0.855	S	S	*	*			trans	-80.4	120.4	156.7	42.9	0	0	0	0	108.2
4	L	23.4	Very low	24.8	Very low	151 Å²	151	172.8 Å²	172.8	79%	0.791	85%	0.845	S	S	*	*			trans	-79.3	115	171.8	-87.8	148.3	0	0	0	108.6
5	N	27.9	Very low	24.6	Very low	148 Å²	148	175 Å²	175	79%	0.791	85%	0.853	S	S	*	*			trans	-88.8	118.4	156.2	-82.5	-10.9	0	0	0	107.1
6	E	25.4	Very low	24.5	Very low	169 Å²	169	168.3 Å²	168.3	79%	0.79	84%	0.843	S	S	*	*			trans	-144.4	101.1	157.4	-73.9	-179.3	169.2	0	0	104.6
7	N	26	Very low	24.6	Very low	141 Å²	141	165.9 Å²	165.9	75%	0.754	85%	0.846	S	S	*	*				52.7	98.5	79.5	-72	-0.2	0	0	0	112.8
8	N	23.2	Very low	24.7	Very low	160 Å²	160	160.6 Å²	160.6	86%	0.856	84%	0.839	S	S	*	*			trans	-136.6	70.4	147.2	-91.8	-9	0	0	0	106.7
9	E	26.9	Very low	24.8	Very low	190 Å²	190	157.1 Å²	157.1	89%	0.888	83%	0.829	S	S	*	*			trans	-103	98.4	153.4	-76.4	-178.9	168.3	0	0	105.1
10	E	23	Very low	25	Very low	171 Å²	171	155.1 Å²	155.1	80%	0.799	82%	0.818	S	S	*	*			trans	-109.7	115.3	163.6	-84.8	-175.7	167.3	0	0	108.2
11	E	22.7	Very low	25.2	Very low	179 Å²	179	151.1 Å²	151.1	84%	0.836	81%	0.808	S	S	*	*			trans	66.5	90.9	141.1	-57.4	-171.7	164.8	0	0	119.8
12	E	23.9	Very low	25.2	Very low	203 Å²	203	145.4 Å²	145.4	95%	0.949	78%	0.78	S	S	*	*			trans	-127.5	94.2	139.8	-81.4	-171.2	166.7	0	0	109.5
13	E	23.5	Very low	25.4	Very low	156 Å²	156	140.3 Å²	140.3	73%	0.729	76%	0.759	S	S	*	*			trans	-109.3	130	160.4	-106.1	-156.7	166.8	0	0	109.9
14	K	24.2	Very low	25.5	Very low	164 Å²	164	136.4 Å²	136.4	71%	0.713	73%	0.731	S	S	*	*			trans	70	97.7	148.5	-63.4	175.2	179.8	130	0	119.4
15	E	22.1	Very low	25.8	Very low	206 Å²	206	132.2 Å²	132.2	96%	0.963	71%	0.712	S	S	*	*				-136.1	127.4	127.8	-79.7	-164.3	158	0	0	110.2
16	G	22.5	Very low	25.9	Very low	68 Å²	68	130.4 Å²	130.4	70%	0.701	70%	0.699	S	S	*	*			trans	-107.6	142.2	-176.7	0	0	0	0	0	113.2
17	S	26.3	Very low	26.1	Very low	128 Å²	128	125.7 Å²	125.7	90%	0.895	68%	0.679	S	S	*	*			trans	80.1	122.1	155.6	87	0	0	0	0	118.8
18	G	27.8	Very low	26.4	Very low	70 Å²	70	121.9 Å²	121.9	72%	0.722	66%	0.659	S	S	*	*	S	Bend	trans	159	13.3	160.2	0	0	0	0	0	120.9
19	C	26	Very low	26.9	Very low	94 Å²	94	119 Å²	119	64%	0.635	64%	0.643	S	S	*	*			trans	-157.8	55.1	172.7	-113.8	0	0	0	0	115.7	A21	C19-A21 VanDerWaalsContact C-N 3.28Å; C19-A21 PolarHBondContact O-N 3.02Å
20	N	28.3	Very low	27.1	Very low	116 Å²	116	114.1 Å²	114.1	62%	0.62	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-3.5	-170.3	-74.4	7.8	0	0	0	117.4	E24	N20-E24 VanDerWaalsContact O-CD 3.25Å; N20-E24 WeakPolarHBondContact O-CG 3.47Å
21	A	29.9	Very low	27.5	Very low	73 Å²	73	108.4 Å²	108.4	60%	0.603	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-20	-175.9	0	0	0	0	0	114.8	C19	C19-A21 VanDerWaalsContact C-N 3.28Å; C19-A21 PolarHBondContact O-N 3.02Å
22	M	27.1	Very low	28	Very low	119 Å²	119	102.6 Å²	102.6	59%	0.586	58%	0.578	S	S	*	*	H	α-helix	trans	-98.5	-30.2	177.6	-135.8	157.8	156.3	0	0	111.1	E24 T25 E26 K591	M22-E24 VanDerWaalsContact C-N 3.28Å; M22-E24 PolarHBondContact O-N 2.94Å; M22-T25 PolarHBondContact O-OG1 2.84Å; M22-E26 VanDerWaalsContact O-CB 3.26Å; M22-E26 WeakPolarHBondContact O-CB 3.48Å; M22-E26 PolarHBondContact O-N 2.84Å; M22-E26 VanDerWaalsContact O-N 3.1Å; M22-K591 PolarHBondContact SD-NZ 3.38Å; M22-K591 VanDerWaalsContact SD-NZ 3.43Å
23	E	28.4	Very low	28.7	Very low	105 Å²	105	99.3 Å²	99.3	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-62.3	-33.1	163.3	-81.8	-175.3	148.1	0	0	111.7	N27	E23-N27 VanDerWaalsContact O-CA 3.26Å; E23-N27 WeakPolarHBondContact O-CA 3.41Å; E23-N27 WeakPolarHBondContact O-CB 3.23Å; E23-N27 PolarHBondContact O-N 2.99Å; E23-N27 PolarHBondContact O-ND2 3.31Å
24	E	28	Very low	29.2	Very low	53 Å²	53	96.7 Å²	96.7	25%	0.248	55%	0.547	C	S	.	.	H	α-helix	trans	-72.9	-40.7	179	-83.1	177.3	166	0	0	114.3	N20 M22 N27 N28 K374	N20-E24 VanDerWaalsContact O-CD 3.25Å; N20-E24 WeakPolarHBondContact O-CG 3.47Å; M22-E24 VanDerWaalsContact C-N 3.28Å; M22-E24 PolarHBondContact O-N 2.94Å; E24-N27 PolarHBondContact O-N 3.34Å; E24-N28 WeakPolarHBondContact O-CB 3.23Å; E24-N28 PolarHBondContact O-N 3.06Å; E24-N28 PolarHBondContact O-ND2 3.21Å; E24-N28 PolarHBondContact O-OD1 2.78Å; E24-K374 WeakPolarHBondContact OE1-CE 3.41Å; E24-K374 IonicContact OE1-NZ 3.89Å; E24-K374 PolarHBondContact OE1-NZ 3.31Å
25	T	29.5	Very low	29.9	Very low	63 Å²	63	95.7 Å²	95.7	39%	0.387	54%	0.539	S	S	.	.	H	α-helix	trans	-71.3	-34.6	174.7	43.3	0	0	0	0	112	M22 L29	M22-T25 PolarHBondContact O-OG1 2.84Å; T25-L29 VanDerWaalsContact O-CB 3.32Å; T25-L29 WeakPolarHBondContact O-CB 3.3Å; T25-L29 WeakPolarHBondContact O-CD1 3.35Å; T25-L29 PolarHBondContact O-N 3.12Å
26	E	28.9	Very low	30.8	Very low	110 Å²	110	88.3 Å²	88.3	51%	0.514	50%	0.503	S	S	.	.	H	α-helix	trans	-77.9	-28.9	175.8	-149.2	179.4	-134.8	0	0	111.2	M22 K30	M22-E26 VanDerWaalsContact O-CB 3.26Å; M22-E26 WeakPolarHBondContact O-CB 3.48Å; M22-E26 PolarHBondContact O-N 2.84Å; M22-E26 VanDerWaalsContact O-N 3.1Å; E26-K30 WeakPolarHBondContact O-CA 3.25Å; E26-K30 WeakPolarHBondContact O-CB 3.44Å; E26-K30 VanDerWaalsContact O-CD 3.27Å; E26-K30 WeakPolarHBondContact O-CD 3.41Å; E26-K30 WeakPolarHBondContact O-CG 3.49Å; E26-K30 PolarHBondContact O-N 2.92Å; E26-K30 IonicContact OE2-NZ 3.15Å; E26-K30 PolarHBondContact OE2-NZ 3.48Å
27	N	29.8	Very low	31.4	Very low	71 Å²	71	88.1 Å²	88.1	38%	0.38	49%	0.485	S	S	.	.	H	α-helix	trans	-78.8	-30.4	173.7	-72.2	-16.7	0	0	0	112.6	E23 E24 K30 T31	E23-N27 VanDerWaalsContact O-CA 3.26Å; E23-N27 WeakPolarHBondContact O-CA 3.41Å; E23-N27 WeakPolarHBondContact O-CB 3.23Å; E23-N27 PolarHBondContact O-N 2.99Å; E23-N27 PolarHBondContact O-ND2 3.31Å; E24-N27 PolarHBondContact O-N 3.34Å; N27-K30 CarbonylContact O-C 3.49Å; N27-K30 PolarHBondContact O-N 3.16Å; N27-K30 WeakPolarHBondContact OD1-CD 3.41Å; N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 2.98Å; N27-T31 PolarHBondContact O-OG1 3.01Å
28	N	32.9	Very low	31.7	Very low	60 Å²	60	84.7 Å²	84.7	32%	0.321	47%	0.465	S	S	.	.	H	α-helix	trans	-75.7	-39	173.2	-70.3	-2.1	0	0	0	111.4	E24 T31 A32 W328	E24-N28 WeakPolarHBondContact O-CB 3.23Å; E24-N28 PolarHBondContact O-N 3.06Å; E24-N28 PolarHBondContact O-ND2 3.21Å; E24-N28 PolarHBondContact O-OD1 2.78Å; N28-T31 VanDerWaalsContact CA-OG1 3.26Å; N28-T31 WeakPolarHBondContact CA-OG1 3.38Å; N28-T31 PolarHBondContact O-N 3.21Å; N28-T31 PolarHBondContact O-OG1 3.38Å; N28-A32 WeakPolarHBondContact O-CB 3.42Å; N28-A32 PolarHBondContact O-N 3.13Å; N28-W328 HydrophobicContact CB-CH2 4.39Å; N28-W328 HydrophobicContact CB-CZ3 4.23Å; N28-W328 WeakPolarHBondContact ND2-CZ3 3.49Å; N28-W328 VanDerWaalsContact OD1-CH2 3.29Å; N28-W328 WeakPolarHBondContact OD1-CH2 3.28Å
29	L	33.2	Very low	32	Very low	99 Å²	99	83.2 Å²	83.2	52%	0.518	45%	0.446	S	S	.	.	H	α-helix	trans	-69.9	-32	166.3	-86.1	151.8	0	0	0	111.7	T25 R33	T25-L29 VanDerWaalsContact O-CB 3.32Å; T25-L29 WeakPolarHBondContact O-CB 3.3Å; T25-L29 WeakPolarHBondContact O-CD1 3.35Å; T25-L29 PolarHBondContact O-N 3.12Å; L29-R33 WeakPolarHBondContact O-CA 3.12Å; L29-R33 WeakPolarHBondContact O-CB 3.12Å; L29-R33 WeakPolarHBondContact O-CD 3.31Å; L29-R33 WeakPolarHBondContact O-CG 3.49Å; L29-R33 PolarHBondContact O-N 3.15Å
30	K	30.7	Very low	32.6	Very low	88 Å²	88	83.1 Å²	83.1	38%	0.383	44%	0.438	S	S	.	.	H	α-helix	trans	-71.9	-31.8	172	-78.9	160.3	-174.2	166.1	0	111.4	E26 N27 R33 L34	E26-K30 WeakPolarHBondContact O-CA 3.25Å; E26-K30 WeakPolarHBondContact O-CB 3.44Å; E26-K30 VanDerWaalsContact O-CD 3.27Å; E26-K30 WeakPolarHBondContact O-CD 3.41Å; E26-K30 WeakPolarHBondContact O-CG 3.49Å; E26-K30 PolarHBondContact O-N 2.92Å; E26-K30 IonicContact OE2-NZ 3.15Å; E26-K30 PolarHBondContact OE2-NZ 3.48Å; N27-K30 CarbonylContact O-C 3.49Å; N27-K30 PolarHBondContact O-N 3.16Å; N27-K30 WeakPolarHBondContact OD1-CD 3.41Å; K30-R33 CarbonylContact O-C 3.46Å; K30-L34 HydrophobicContact CB-CD1 4.43Å; K30-L34 WeakPolarHBondContact O-CA 3.28Å; K30-L34 WeakPolarHBondContact O-CB 3.38Å; K30-L34 WeakPolarHBondContact O-CD1 3.15Å; K30-L34 WeakPolarHBondContact O-CG 3.33Å; K30-L34 PolarHBondContact O-N 3.01Å
31	T	32.2	Very low	33	Very low	52 Å²	52	85.4 Å²	85.4	32%	0.319	44%	0.439	S	S	.	.	H	α-helix	trans	-74	-49.9	174.8	24.6	0	0	0	0	109.9	N27 N28 R33 L34 W35	N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 2.98Å; N27-T31 PolarHBondContact O-OG1 3.01Å; N28-T31 VanDerWaalsContact CA-OG1 3.26Å; N28-T31 WeakPolarHBondContact CA-OG1 3.38Å; N28-T31 PolarHBondContact O-N 3.21Å; N28-T31 PolarHBondContact O-OG1 3.38Å; T31-R33 PolarHBondContact O-N 3.35Å; T31-L34 CarbonylContact O-C 3.58Å; T31-L34 WeakPolarHBondContact O-CA 3.25Å; T31-L34 WeakPolarHBondContact O-CB 3.49Å; T31-L34 PolarHBondContact O-N 2.98Å; T31-W35 PolarHBondContact O-N 3.14Å
32	A	33	Very low	33	Very low	56 Å²	56	86.2 Å²	86.2	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-57.6	-37.2	171	0	0	0	0	0	112.3	N28 R36	N28-A32 WeakPolarHBondContact O-CB 3.42Å; N28-A32 PolarHBondContact O-N 3.13Å; A32-R36 VanDerWaalsContact O-CB 3.28Å; A32-R36 WeakPolarHBondContact O-CB 3.46Å; A32-R36 PolarHBondContact O-N 3.43Å
33	R	37.7	Very low	33.6	Very low	134 Å²	134	85.9 Å²	85.9	51%	0.506	43%	0.432	S	S	.	.	H	α-helix	trans	-72.6	-31.1	171	-76.2	169.8	176.2	175.3	-0.6	113.7	L29 K30 T31 W35 R36 D37	L29-R33 WeakPolarHBondContact O-CA 3.12Å; L29-R33 WeakPolarHBondContact O-CB 3.12Å; L29-R33 WeakPolarHBondContact O-CD 3.31Å; L29-R33 WeakPolarHBondContact O-CG 3.49Å; L29-R33 PolarHBondContact O-N 3.15Å; K30-R33 CarbonylContact O-C 3.46Å; T31-R33 PolarHBondContact O-N 3.35Å; R33-W35 VanDerWaalsContact C-N 3.33Å; R33-R36 PolarHBondContact O-N 3.35Å; R33-D37 WeakPolarHBondContact O-CA 3.48Å; R33-D37 WeakPolarHBondContact O-CB 3.46Å; R33-D37 PolarHBondContact O-N 3.49Å
34	L	34.8	Very low	34.1	Very low	101 Å²	101	90.6 Å²	90.6	53%	0.529	45%	0.451	S	S	.	.	H	α-helix	trans	-72.5	-30.9	176.9	-87.6	155.8	0	0	0	110	K30 T31 A38	K30-L34 HydrophobicContact CB-CD1 4.43Å; K30-L34 WeakPolarHBondContact O-CA 3.28Å; K30-L34 WeakPolarHBondContact O-CB 3.38Å; K30-L34 WeakPolarHBondContact O-CD1 3.15Å; K30-L34 WeakPolarHBondContact O-CG 3.33Å; K30-L34 PolarHBondContact O-N 3.01Å; T31-L34 CarbonylContact O-C 3.58Å; T31-L34 WeakPolarHBondContact O-CA 3.25Å; T31-L34 WeakPolarHBondContact O-CB 3.49Å; T31-L34 PolarHBondContact O-N 2.98Å; L34-A38 WeakPolarHBondContact O-CA 3.46Å; L34-A38 WeakPolarHBondContact O-CB 3.49Å; L34-A38 PolarHBondContact O-N 3.4Å
35	W	39.5	Very low	34.5	Very low	143 Å²	143	93.8 Å²	93.8	54%	0.542	47%	0.469	S	S	.	.	H	α-helix	trans	-78.7	-39.2	170.1	-75.6	76	0	0	0	111.6	T31 R33 D37 A38 A39 E303	T31-W35 PolarHBondContact O-N 3.14Å; R33-W35 VanDerWaalsContact C-N 3.33Å; W35-D37 VanDerWaalsContact C-N 3.31Å; W35-D37 PolarHBondContact O-N 3.29Å; W35-A38 PolarHBondContact O-N 3.19Å; W35-A39 WeakPolarHBondContact O-CB 3.34Å; W35-A39 PolarHBondContact O-N 2.96Å; W35-E303 VanDerWaalsContact CH2-OE1 3.26Å; W35-E303 WeakPolarHBondContact CH2-OE1 3.46Å; W35-E303 WeakPolarHBondContact CZ2-OE1 3.22Å
36	R	39.5	Very low	35.3	Very low	52 Å²	52	100.5 Å²	100.5	20%	0.196	49%	0.487	C	S	.	.	H	α-helix	trans	-57.7	-44.9	168.6	-170.9	165.6	-178.2	-177.4	-5.4	110.7	A32 R33 L40 D190 D192 D213 W236	A32-R36 VanDerWaalsContact O-CB 3.28Å; A32-R36 WeakPolarHBondContact O-CB 3.46Å; A32-R36 PolarHBondContact O-N 3.43Å; R33-R36 PolarHBondContact O-N 3.35Å; R36-L40 HydrophobicContact CG-CD1 4.09Å; R36-L40 WeakPolarHBondContact O-CB 3.19Å; R36-L40 VanDerWaalsContact O-CD1 3.31Å; R36-L40 WeakPolarHBondContact O-CD1 3.27Å; R36-L40 WeakPolarHBondContact O-CG 3.29Å; R36-L40 PolarHBondContact O-N 2.93Å; R36-D190 IonicContact CZ-OD2 3.32Å; R36-D190 IonicContact NE-OD2 2.72Å; R36-D190 IonicContact NH2-OD1 3.83Å; R36-D190 PolarHBondContact NH2-OD1 3.39Å; R36-D190 IonicContact NH2-OD2 3.48Å; R36-D190 PolarHBondContact NH2-OD2 2.87Å; R36-D192 IonicContact CZ-OD1 2.85Å; R36-D192 IonicContact CZ-OD2 3.65Å; R36-D192 IonicContact NH1-OD1 3.37Å; R36-D192 IonicContact NH1-OD2 3.78Å; R36-D192 PolarHBondContact NH1-OD2 2.74Å; R36-D192 IonicContact NH2-OD1 2.65Å; R36-D192 PolarHBondContact NH2-OD1 3.07Å; R36-D192 IonicContact NH2-OD2 2.8Å; R36-D192 PolarHBondContact NH2-OD2 3.2Å; R36-D213 IonicContact CZ-OD2 3.92Å; R36-D213 IonicContact NH1-OD2 2.96Å; R36-D213 IonicContact NH2-OD2 3.38Å; R36-W236 HydrophobicContact CB-CH2 3.95Å; R36-W236 HydrophobicContact CB-CZ3 4.32Å; R36-W236 HydrophobicContact CG-CH2 3.76Å; R36-W236 HydrophobicContact CG-CZ3 3.69Å
37	D	35.5	Very low	36.2	Very low	63 Å²	63	101 Å²	101	34%	0.337	50%	0.502	S	S	.	.	H	α-helix	trans	-74.1	-36.1	176	-92.5	-50.7	0	0	0	112.5	R33 W35 R41	R33-D37 WeakPolarHBondContact O-CA 3.48Å; R33-D37 WeakPolarHBondContact O-CB 3.46Å; R33-D37 PolarHBondContact O-N 3.49Å; W35-D37 VanDerWaalsContact C-N 3.31Å; W35-D37 PolarHBondContact O-N 3.29Å; D37-R41 VanDerWaalsContact CB-NE 3.33Å; D37-R41 WeakPolarHBondContact O-CA 3.41Å; D37-R41 WeakPolarHBondContact O-CB 3.39Å; D37-R41 WeakPolarHBondContact O-CD 3.49Å; D37-R41 WeakPolarHBondContact O-CG 3.37Å; D37-R41 PolarHBondContact O-N 2.84Å; D37-R41 IonicContact OD1-CZ 3.99Å; D37-R41 IonicContact OD1-NE 3.11Å; D37-R41 PolarHBondContact OD1-NE 3.17Å; D37-R41 IonicContact OD1-NH2 3.39Å; D37-R41 PolarHBondContact OD1-NH2 2.96Å; D37-R41 VanDerWaalsContact OD1-NH2 3.13Å; D37-R41 IonicContact OD2-CZ 2.92Å; D37-R41 IonicContact OD2-NE 3.42Å; D37-R41 IonicContact OD2-NH2 2.66Å; D37-R41 PolarHBondContact OD2-NH2 3.42Å
38	A	33.1	Very low	37.4	Very low	56 Å²	56	104.6 Å²	104.6	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-73.2	-37.3	177.5	0	0	0	0	0	111.7	L34 W35 S42	L34-A38 WeakPolarHBondContact O-CA 3.46Å; L34-A38 WeakPolarHBondContact O-CB 3.49Å; L34-A38 PolarHBondContact O-N 3.4Å; W35-A38 PolarHBondContact O-N 3.19Å; A38-S42 WeakPolarHBondContact O-CB 3.38Å; A38-S42 PolarHBondContact O-N 3.21Å; A38-S42 PolarHBondContact O-OG 3.43Å
39	A	35	Very low	38.9	Very low	39 Å²	39	104.5 Å²	104.5	32%	0.322	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-49.4	172.2	0	0	0	0	0	110.5	W35 S42	W35-A39 WeakPolarHBondContact O-CB 3.34Å; W35-A39 PolarHBondContact O-N 2.96Å; A39-S42 PolarHBondContact O-N 3.07Å; A39-S42 PolarHBondContact O-OG 2.82Å
40	L	37.7	Very low	41	Very low	92 Å²	92	107 Å²	107	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-69	-31	176.5	-73	164.6	0	0	0	113.5	R36	R36-L40 HydrophobicContact CG-CD1 4.09Å; R36-L40 WeakPolarHBondContact O-CB 3.19Å; R36-L40 VanDerWaalsContact O-CD1 3.31Å; R36-L40 WeakPolarHBondContact O-CD1 3.27Å; R36-L40 WeakPolarHBondContact O-CG 3.29Å; R36-L40 PolarHBondContact O-N 2.93Å
41	R	35.8	Very low	43.4	Very low	165 Å²	165	108.7 Å²	108.7	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-86.6	-8.7	178.7	-65.6	166.2	-160.5	-164.7	14.7	113.4	D37 R43	D37-R41 VanDerWaalsContact CB-NE 3.33Å; D37-R41 WeakPolarHBondContact O-CA 3.41Å; D37-R41 WeakPolarHBondContact O-CB 3.39Å; D37-R41 WeakPolarHBondContact O-CD 3.49Å; D37-R41 WeakPolarHBondContact O-CG 3.37Å; D37-R41 PolarHBondContact O-N 2.84Å; D37-R41 IonicContact OD1-CZ 3.99Å; D37-R41 IonicContact OD1-NE 3.11Å; D37-R41 PolarHBondContact OD1-NE 3.17Å; D37-R41 IonicContact OD1-NH2 3.39Å; D37-R41 PolarHBondContact OD1-NH2 2.96Å; D37-R41 VanDerWaalsContact OD1-NH2 3.13Å; D37-R41 IonicContact OD2-CZ 2.92Å; D37-R41 IonicContact OD2-NE 3.42Å; D37-R41 IonicContact OD2-NH2 2.66Å; D37-R41 PolarHBondContact OD2-NH2 3.42Å; R41-R43 VanDerWaalsContact C-N 3.32Å; R41-R43 PolarHBondContact O-N 3.34Å
42	S	30.4	Very low	45.7	Very low	90 Å²	90	108 Å²	108	63%	0.629	53%	0.527	S	S	*	.	S	Bend	trans	-78.5	-9.5	-179.5	70.3	0	0	0	0	114.6	A38 A39 K44	A38-S42 WeakPolarHBondContact O-CB 3.38Å; A38-S42 PolarHBondContact O-N 3.21Å; A38-S42 PolarHBondContact O-OG 3.43Å; A39-S42 PolarHBondContact O-N 3.07Å; A39-S42 PolarHBondContact O-OG 2.82Å; S42-K44 PolarHBondContact O-N 3.02Å
43	R	40.4	Very low	47.9	Very low	112 Å²	112	108.8 Å²	108.8	42%	0.423	53%	0.526	S	S	.	.			trans	-94.4	71.1	169.2	-71.8	-176.5	-177.7	174.8	3.4	111.3	R41 L45 E165	R41-R43 VanDerWaalsContact C-N 3.32Å; R41-R43 PolarHBondContact O-N 3.34Å; R43-L45 VanDerWaalsContact C-N 3.26Å; R43-L45 PolarHBondContact O-N 3.05Å; R43-E165 IonicContact NH1-OE1 3.92Å; R43-E165 PolarHBondContact NH1-OE1 3.5Å
44	K	39.2	Very low	49.8	Very low	203 Å²	203	103.6 Å²	103.6	88%	0.883	51%	0.509	S	S	*	.			trans	-63.6	88.5	159.3	-88.8	-178.3	176	175.4	0	109.1	S42 R46	S42-K44 PolarHBondContact O-N 3.02Å; K44-R46 PolarHBondContact O-N 3.12Å
45	L	36.6	Very low	51.7	Low	121 Å²	121	103.9 Å²	103.9	63%	0.634	52%	0.517	S	S	*	.			trans	-86	99.6	164	-106.7	117.8	0	0	0	110.2	R43	R43-L45 VanDerWaalsContact C-N 3.26Å; R43-L45 PolarHBondContact O-N 3.05Å
46	R	45.8	Very low	53.2	Low	204 Å²	204	98.4 Å²	98.4	77%	0.77	50%	0.501	S	S	*	.			trans	77.7	104.9	134.6	-56.5	-174.7	-168	177.6	3.5	118.4	K44 N48	K44-R46 PolarHBondContact O-N 3.12Å; R46-N48 PolarHBondContact O-N 3.05Å
47	S	48.3	Very low	54.1	Low	119 Å²	119	104.7 Å²	104.7	83%	0.832	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	30.8	-176.9	53.6	0	0	0	0	117
48	N	54.4	Low	55.1	Low	148 Å²	148	109.2 Å²	109.2	79%	0.791	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	5.7	-174.5	-69.2	3.1	0	0	0	115.7	R46	R46-N48 PolarHBondContact O-N 3.05Å
49	L	63.7	Low	56.4	Low	58 Å²	58	111.1 Å²	111.1	30%	0.304	56%	0.557	S	S	.	*	S	Bend	trans	-90.1	146.1	-178.9	-57.7	176.1	0	0	0	111.5	Q51 E71 V72 I96	L49-Q51 PolarHBondContact O-N 2.82Å; L49-E71 VanDerWaalsContact CA-OE2 3.28Å; L49-E71 WeakPolarHBondContact CA-OE2 3.2Å; L49-E71 HydrophobicContact CB-CB 4.2Å; L49-E71 WeakPolarHBondContact CB-OE2 3.05Å; L49-E71 HydrophobicContact CD2-CB 4.44Å; L49-E71 WeakPolarHBondContact CD2-OE2 3.38Å; L49-V72 HydrophobicContact CB-CG2 3.84Å; L49-V72 HydrophobicContact CD1-CG2 3.85Å; L49-I96 HydrophobicContact CD1-CD1 4.18Å
50	R	76.9	Confident	57.9	Low	152 Å²	152	116.5 Å²	116.5	57%	0.574	58%	0.575	S	S	*	*			trans	-74.5	114.8	174.9	-69.4	-174.2	-179	-176	9.1	110	D69 E71 V72	R50-D69 IonicContact CZ-OD2 2.78Å; R50-D69 IonicContact NH1-OD2 2.85Å; R50-D69 PolarHBondContact NH1-OD2 2.99Å; R50-E71 PolarHBondContact N-OE2 3.2Å; R50-E71 PolarHBondContact O-N 3.4Å; R50-V72 PolarHBondContact O-N 2.86Å; R50-V72 VanDerWaalsContact O-N 3.08Å
51	Q	81.4	Confident	59.7	Low	122 Å²	122	113.1 Å²	113.1	57%	0.57	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.7	139	-174.5	179.7	174.1	-3.9	0	0	112.6	L49 T53 V72	L49-Q51 PolarHBondContact O-N 2.82Å; Q51-T53 PolarHBondContact NE2-OG1 3.26Å; Q51-V72 CarbonylContact C-O 3.29Å; Q51-V72 WeakPolarHBondContact CA-O 3.42Å; Q51-V72 HydrophobicContact CB-CB 3.91Å; Q51-V72 HydrophobicContact CB-CG1 4.28Å; Q51-V72 HydrophobicContact CG-CB 3.91Å; Q51-V72 HydrophobicContact CG-CG1 3.75Å
52	L	80.8	Confident	61.5	Low	37 Å²	37	112.3 Å²	112.3	19%	0.194	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.2	129.4	169.9	-178.3	65.6	0	0	0	110.2	L54 I67 I70 V72 L73 N74	L52-L54 HydrophobicContact CD1-CD2 3.99Å; L52-L54 HydrophobicContact CD2-CD1 4.11Å; L52-L54 HydrophobicContact CD2-CD2 4.16Å; L52-L54 HydrophobicContact CD2-CG 4.14Å; L52-L54 HydrophobicContact CG-CD2 4.05Å; L52-L54 HydrophobicContact CG-CG 4.06Å; L52-I67 HydrophobicContact CD2-CG2 3.76Å; L52-I70 HydrophobicContact CB-CD1 3.45Å; L52-I70 VanDerWaalsContact CB-CD1 3.45Å; L52-I70 HydrophobicContact CB-CG1 4.11Å; L52-I70 HydrophobicContact CB-CG2 4.08Å; L52-I70 HydrophobicContact CD2-CD1 3.51Å; L52-I70 HydrophobicContact CG-CD1 4.02Å; L52-V72 PolarHBondContact N-O 3.07Å; L52-L73 HydrophobicContact CB-CD1 4.28Å; L52-L73 HydrophobicContact CD2-CD1 4.17Å; L52-L73 HydrophobicContact CG-CD1 4.3Å; L52-L73 WeakPolarHBondContact O-CA 3.29Å; L52-N74 PolarHBondContact O-N 3.43Å
53	T	79.8	Confident	63.6	Low	73 Å²	73	109.1 Å²	109.1	45%	0.448	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.9	173.4	-57.6	0	0	0	0	108.3	Q51 N74	Q51-T53 PolarHBondContact NE2-OG1 3.26Å; T53-N74 WeakPolarHBondContact CA-O 3.42Å; T53-N74 HydrophobicContact CG2-CB 4.08Å
54	L	78.4	Confident	65.1	Low	26 Å²	26	106.6 Å²	106.6	14%	0.136	54%	0.538	C	S	.	.			trans	-115.9	133.3	179.2	-59.5	174.9	0	0	0	109.9	L52 I61 L63 L73 N74 L75 N78	L52-L54 HydrophobicContact CD1-CD2 3.99Å; L52-L54 HydrophobicContact CD2-CD1 4.11Å; L52-L54 HydrophobicContact CD2-CD2 4.16Å; L52-L54 HydrophobicContact CD2-CG 4.14Å; L52-L54 HydrophobicContact CG-CD2 4.05Å; L52-L54 HydrophobicContact CG-CG 4.06Å; L54-I61 HydrophobicContact CB-CG2 3.94Å; L54-I61 HydrophobicContact CD1-CG2 3.6Å; L54-I61 HydrophobicContact CG-CG2 4.38Å; L54-L63 HydrophobicContact CD1-CD2 3.79Å; L54-L73 HydrophobicContact CD1-CD1 4.49Å; L54-N74 PolarHBondContact N-O 2.86Å; L54-L75 HydrophobicContact CB-CD2 3.74Å; L54-L75 HydrophobicContact CD1-CD2 3.95Å; L54-L75 HydrophobicContact CG-CD2 4.19Å; L54-N78 PolarHBondContact O-ND2 3.45Å
55	C	74	Confident	66.4	Low	106 Å²	106	104.7 Å²	104.7	72%	0.716	54%	0.537	S	S	*	.			trans	-110.5	130.2	174.4	-64.1	0	0	0	0	109.3	N78	C55-N78 WeakPolarHBondContact CA-OD1 3.3Å
56	S	71.3	Confident	67.9	Low	29 Å²	29	106.6 Å²	106.6	20%	0.203	55%	0.548	C	S	.	.			trans	-71.1	131	-178.6	178.4	0	0	0	0	110.8	N59 Q60 N78	S56-N59 WeakPolarHBondContact OG-CA 3.41Å; S56-N59 PolarHBondContact OG-N 3.34Å; S56-Q60 PolarHBondContact OG-N 3.18Å; S56-N78 WeakPolarHBondContact CB-OD1 3.48Å; S56-N78 PolarHBondContact N-OD1 3.13Å
57	K	57.1	Low	69.3	Low	184 Å²	184	97.1 Å²	97.1	80%	0.8	51%	0.513	S	S	*	.	B	Isolated β-bridge	trans	-106.8	116.3	161.6	-69.5	-177.1	179.4	178.9	0	106.1
58	N	57.3	Low	70.5	Confident	158 Å²	158	94.6 Å²	94.6	85%	0.845	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	41.2	180	-55.1	-21.2	0	0	0	116.1	Q60	N58-Q60 PolarHBondContact O-N 3.44Å; N58-Q60 VanDerWaalsContact O-N 3.14Å
59	N	60.4	Low	71.7	Confident	96 Å²	96	91.6 Å²	91.6	51%	0.513	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	15.1	177.7	-67.8	-11.4	0	0	0	115.6	S56	S56-N59 WeakPolarHBondContact OG-CA 3.41Å; S56-N59 PolarHBondContact OG-N 3.34Å
60	Q	65.8	Low	72.6	Confident	151 Å²	151	89.8 Å²	89.8	71%	0.706	47%	0.469	S	S	*	.	B	Isolated β-bridge	trans	-123.3	134.4	174	-69.7	-177.5	-6.8	0	0	109.9	S56 N58	S56-Q60 PolarHBondContact OG-N 3.18Å; N58-Q60 PolarHBondContact O-N 3.44Å; N58-Q60 VanDerWaalsContact O-N 3.14Å
61	I	76.3	Confident	73	Confident	21 Å²	21	85 Å²	85	11%	0.108	45%	0.454	C	S	.	.			trans	-117.6	123	173.3	-64.2	179.7	0	0	0	107.1	L54 L75 N78 L80 P84	L54-I61 HydrophobicContact CB-CG2 3.94Å; L54-I61 HydrophobicContact CD1-CG2 3.6Å; L54-I61 HydrophobicContact CG-CG2 4.38Å; I61-L75 HydrophobicContact CD1-CB 4.48Å; I61-L75 HydrophobicContact CD1-CD2 4.01Å; I61-L75 HydrophobicContact CG2-CD2 4.39Å; I61-N78 HydrophobicContact CD1-CB 4Å; I61-N78 WeakPolarHBondContact CD1-ND2 3.24Å; I61-L80 HydrophobicContact CD1-CD1 3.71Å; I61-L80 HydrophobicContact CD1-CD2 3.86Å; I61-L80 HydrophobicContact CD1-CG 4.23Å; I61-L80 HydrophobicContact CG1-CD2 4.11Å; I61-P84 HydrophobicContact CB-CG 3.98Å; I61-P84 HydrophobicContact CG2-CG 4.09Å
62	I	73.8	Confident	73.2	Confident	148 Å²	148	79.7 Å²	79.7	76%	0.759	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-100.7	124.8	172.8	-56.9	174.6	0	0	0	107
63	L	73.8	Confident	73.6	Confident	23 Å²	23	78 Å²	78	12%	0.12	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-74.9	133.6	175.9	-68.2	174.9	0	0	0	109.5	L54 I67 P84 L87	L54-L63 HydrophobicContact CD1-CD2 3.79Å; L63-I67 HydrophobicContact CB-CD1 3.81Å; L63-I67 HydrophobicContact CD1-CD1 4.15Å; L63-I67 HydrophobicContact CD2-CD1 3.92Å; L63-I67 HydrophobicContact CG-CD1 4.17Å; L63-P84 HydrophobicContact CD1-CB 4.13Å; L63-P84 HydrophobicContact CG-CB 4.06Å; L63-L87 HydrophobicContact CD1-CB 4.2Å; L63-L87 HydrophobicContact CD1-CD1 4.35Å; L63-L87 HydrophobicContact CD1-CG 4.39Å
64	P	72.6	Confident	73.8	Confident	60 Å²	60	76.3 Å²	76.3	39%	0.39	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-64.1	152.8	171	-16.5	28	0	0	0	112	D66 I67	P64-D66 VanDerWaalsContact C-N 3.32Å; P64-D66 PolarHBondContact O-N 3.05Å; P64-I67 HydrophobicContact CB-CG2 3.92Å; P64-I67 HydrophobicContact CG-CG2 4.04Å; P64-I67 WeakPolarHBondContact O-CG1 3.39Å
65	D	66.5	Low	74.2	Confident	163 Å²	163	75 Å²	75	87%	0.872	40%	0.402	S	S	*	.	S	Bend	trans	-69.3	-24.1	-175.6	-63.2	-43.7	0	0	0	113.9
66	D	67.8	Low	74.6	Confident	161 Å²	161	70.4 Å²	70.4	86%	0.861	37%	0.372	S	S	*	.			trans	-108.3	62.1	-176.3	-72.8	-30.5	0	0	0	113.4	P64	P64-D66 VanDerWaalsContact C-N 3.32Å; P64-D66 PolarHBondContact O-N 3.05Å
67	I	74.5	Confident	75.1	Confident	5 Å²	5	74.3 Å²	74.3	3%	0.026	39%	0.391	C	S	.	.			trans	-114.7	4.8	-176.1	61.1	173.4	0	0	0	116.3	L52 L63 P64 D69 I70 L91	L52-I67 HydrophobicContact CD2-CG2 3.76Å; L63-I67 HydrophobicContact CB-CD1 3.81Å; L63-I67 HydrophobicContact CD1-CD1 4.15Å; L63-I67 HydrophobicContact CD2-CD1 3.92Å; L63-I67 HydrophobicContact CG-CD1 4.17Å; P64-I67 HydrophobicContact CB-CG2 3.92Å; P64-I67 HydrophobicContact CG-CG2 4.04Å; P64-I67 WeakPolarHBondContact O-CG1 3.39Å; I67-D69 PolarHBondContact O-N 3.3Å; I67-D69 VanDerWaalsContact O-N 3.12Å; I67-I70 HydrophobicContact CB-CD1 3.57Å; I67-I70 HydrophobicContact CG2-CD1 3.59Å; I67-I70 WeakPolarHBondContact O-CB 3.42Å; I67-I70 PolarHBondContact O-N 3.32Å; I67-I70 VanDerWaalsContact O-N 3.11Å; I67-L91 HydrophobicContact CB-CD2 3.96Å; I67-L91 HydrophobicContact CD1-CD1 4.34Å; I67-L91 HydrophobicContact CD1-CD2 3.9Å; I67-L91 HydrophobicContact CD1-CG 4.1Å; I67-L91 HydrophobicContact CG1-CD2 3.83Å; I67-L91 HydrophobicContact CG1-CG 4.43Å; I67-L91 WeakPolarHBondContact O-CD2 3.4Å
68	S	73.6	Confident	76.3	Confident	66 Å²	66	66 Å²	66	46%	0.462	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23	-171.9	52.4	0	0	0	0	116.6	T90 N93	S68-T90 VanDerWaalsContact CA-O 3.23Å; S68-T90 WeakPolarHBondContact CA-O 3.08Å; S68-N93 PolarHBondContact O-ND2 3.48Å
69	D	80.4	Confident	77.6	Confident	85 Å²	85	60.3 Å²	60.3	46%	0.455	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	3.3	-179.8	-67.1	-16.4	0	0	0	113.5	R50 I67	R50-D69 IonicContact CZ-OD2 2.78Å; R50-D69 IonicContact NH1-OD2 2.85Å; R50-D69 PolarHBondContact NH1-OD2 2.99Å; I67-D69 PolarHBondContact O-N 3.3Å; I67-D69 VanDerWaalsContact O-N 3.12Å
70	I	82.9	Confident	78.9	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.097	31%	0.305	C	S	.	.			trans	-77	130.3	-177.8	-75.2	156.8	0	0	0	111.2	L52 I67 V72 L91 L94	L52-I70 HydrophobicContact CB-CD1 3.45Å; L52-I70 VanDerWaalsContact CB-CD1 3.45Å; L52-I70 HydrophobicContact CB-CG1 4.11Å; L52-I70 HydrophobicContact CB-CG2 4.08Å; L52-I70 HydrophobicContact CD2-CD1 3.51Å; L52-I70 HydrophobicContact CG-CD1 4.02Å; I67-I70 HydrophobicContact CB-CD1 3.57Å; I67-I70 HydrophobicContact CG2-CD1 3.59Å; I67-I70 WeakPolarHBondContact O-CB 3.42Å; I67-I70 PolarHBondContact O-N 3.32Å; I67-I70 VanDerWaalsContact O-N 3.11Å; I70-V72 VanDerWaalsContact CG2-O 3.24Å; I70-V72 WeakPolarHBondContact CG2-O 3.17Å; I70-L91 HydrophobicContact CB-CD2 4.14Å; I70-L94 HydrophobicContact CG2-CD1 4.22Å
71	E	84.1	Confident	79.9	Confident	53 Å²	53	55.1 Å²	55.1	25%	0.248	30%	0.301	C	S	.	.	S	Bend	trans	-104.6	-20.3	179.3	-64.5	175.7	127.9	0	0	111.9	L49 R50 R95 I96	L49-E71 VanDerWaalsContact CA-OE2 3.28Å; L49-E71 WeakPolarHBondContact CA-OE2 3.2Å; L49-E71 HydrophobicContact CB-CB 4.2Å; L49-E71 WeakPolarHBondContact CB-OE2 3.05Å; L49-E71 HydrophobicContact CD2-CB 4.44Å; L49-E71 WeakPolarHBondContact CD2-OE2 3.38Å; R50-E71 PolarHBondContact N-OE2 3.2Å; R50-E71 PolarHBondContact O-N 3.4Å; E71-R95 HydrophobicContact CB-CG 4.33Å; E71-R95 WeakPolarHBondContact O-CA 3.2Å; E71-R95 PolarHBondContact O-N 3Å; E71-I96 PolarHBondContact O-N 3.4Å
72	V	87.3	Confident	80.4	Confident	10 Å²	10	61.7 Å²	61.7	6%	0.061	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117.7	179.4	-177.2	0	0	0	0	110.2	L49 R50 Q51 L52 I70 I96	L49-V72 HydrophobicContact CB-CG2 3.84Å; L49-V72 HydrophobicContact CD1-CG2 3.85Å; R50-V72 PolarHBondContact O-N 2.86Å; R50-V72 VanDerWaalsContact O-N 3.08Å; Q51-V72 CarbonylContact C-O 3.29Å; Q51-V72 WeakPolarHBondContact CA-O 3.42Å; Q51-V72 HydrophobicContact CB-CB 3.91Å; Q51-V72 HydrophobicContact CB-CG1 4.28Å; Q51-V72 HydrophobicContact CG-CB 3.91Å; Q51-V72 HydrophobicContact CG-CG1 3.75Å; L52-V72 PolarHBondContact N-O 3.07Å; I70-V72 VanDerWaalsContact CG2-O 3.24Å; I70-V72 WeakPolarHBondContact CG2-O 3.17Å; V72-I96 WeakPolarHBondContact CA-O 3.46Å; V72-I96 HydrophobicContact CB-CB 4.25Å; V72-I96 HydrophobicContact CG1-CB 3.96Å; V72-I96 HydrophobicContact CG1-CG2 4.05Å; V72-I96 HydrophobicContact CG2-CB 3.99Å; V72-I96 HydrophobicContact CG2-CD1 3.9Å; V72-I96 HydrophobicContact CG2-CG1 4.09Å
73	L	87.6	Confident	81	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.9	177.3	179.7	64.8	0	0	0	110.1	L52 L54 L75 L87 L91 L94 I96 L97 I98	L52-L73 HydrophobicContact CB-CD1 4.28Å; L52-L73 HydrophobicContact CD2-CD1 4.17Å; L52-L73 HydrophobicContact CG-CD1 4.3Å; L52-L73 WeakPolarHBondContact O-CA 3.29Å; L54-L73 HydrophobicContact CD1-CD1 4.49Å; L73-L75 HydrophobicContact CD1-CD2 3.94Å; L73-L75 HydrophobicContact CD1-CG 4.33Å; L73-L75 HydrophobicContact CD2-CD1 4.08Å; L73-L75 HydrophobicContact CD2-CD2 4.47Å; L73-L75 HydrophobicContact CD2-CG 4.17Å; L73-L75 HydrophobicContact CG-CD1 4.48Å; L73-L75 HydrophobicContact CG-CD2 4.19Å; L73-L75 HydrophobicContact CG-CG 4.02Å; L73-L87 HydrophobicContact CD2-CD1 3.99Å; L73-L87 HydrophobicContact CD2-CG 4.42Å; L73-L91 HydrophobicContact CD2-CD1 3.52Å; L73-L94 HydrophobicContact CB-CD1 3.57Å; L73-L94 HydrophobicContact CB-CD2 4.16Å; L73-I96 PolarHBondContact N-O 3.36Å; L73-L97 HydrophobicContact CB-CD1 4.22Å; L73-L97 HydrophobicContact CD2-CD1 4Å; L73-L97 HydrophobicContact CG-CD1 4.24Å; L73-I98 PolarHBondContact O-N 3.3Å
74	N	84.4	Confident	81.1	Confident	38 Å²	38	55.7 Å²	55.7	20%	0.203	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.1	176	-173.7	-4.7	0	0	0	111.2	L52 T53 L54 G76 I98	L52-N74 PolarHBondContact O-N 3.43Å; T53-N74 WeakPolarHBondContact CA-O 3.42Å; T53-N74 HydrophobicContact CG2-CB 4.08Å; L54-N74 PolarHBondContact N-O 2.86Å; N74-G76 PolarHBondContact OD1-N 3.14Å; N74-I98 HydrophobicContact CB-CB 4.24Å; N74-I98 HydrophobicContact CB-CD1 4.33Å; N74-I98 WeakPolarHBondContact OD1-CG2 3.49Å
75	L	86.1	Confident	80.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.325	C	S	.	.			trans	-116.8	24.7	174.7	-52.4	179.7	0	0	0	111.6	L54 I61 L73 N78 L80 L83 L87 I98 L99 N102	L54-L75 HydrophobicContact CB-CD2 3.74Å; L54-L75 HydrophobicContact CD1-CD2 3.95Å; L54-L75 HydrophobicContact CG-CD2 4.19Å; I61-L75 HydrophobicContact CD1-CB 4.48Å; I61-L75 HydrophobicContact CD1-CD2 4.01Å; I61-L75 HydrophobicContact CG2-CD2 4.39Å; L73-L75 HydrophobicContact CD1-CD2 3.94Å; L73-L75 HydrophobicContact CD1-CG 4.33Å; L73-L75 HydrophobicContact CD2-CD1 4.08Å; L73-L75 HydrophobicContact CD2-CD2 4.47Å; L73-L75 HydrophobicContact CD2-CG 4.17Å; L73-L75 HydrophobicContact CG-CD1 4.48Å; L73-L75 HydrophobicContact CG-CD2 4.19Å; L73-L75 HydrophobicContact CG-CG 4.02Å; L75-N78 WeakPolarHBondContact CA-ND2 3.37Å; L75-N78 PolarHBondContact O-ND2 2.94Å; L75-L80 HydrophobicContact CB-CD1 4.01Å; L75-L80 HydrophobicContact CD1-CD1 4.48Å; L75-L83 HydrophobicContact CD1-CD2 4.04Å; L75-L87 HydrophobicContact CD1-CD1 4.2Å; L75-I98 CarbonylContact C-O 3.3Å; L75-I98 PolarHBondContact N-O 3.04Å; L75-L99 HydrophobicContact CB-CD2 3.93Å; L75-L99 HydrophobicContact CD1-CD2 4.02Å; L75-L99 HydrophobicContact CG-CD2 4.34Å; L75-N102 PolarHBondContact O-ND2 2.96Å
76	G	83.1	Confident	81	Confident	9 Å²	9	54.7 Å²	54.7	9%	0.093	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	157.8	179.4	0	0	0	0	0	113.9	N74 N78 I98 R100	N74-G76 PolarHBondContact OD1-N 3.14Å; G76-N78 VanDerWaalsContact C-N 3.34Å; G76-N78 PolarHBondContact O-N 3.31Å; G76-N78 PolarHBondContact O-ND2 3.48Å; G76-I98 PolarHBondContact N-O 3.18Å; G76-R100 CarbonylContact C-O 3.5Å; G76-R100 WeakPolarHBondContact CA-O 3.31Å
77	N	82.9	Confident	81.2	Confident	110 Å²	110	47.1 Å²	47.1	59%	0.588	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	30.7	177.2	-59.3	-55.1	0	0	0	115.7	R100 R101	N77-R100 PolarHBondContact N-O 3.33Å; N77-R101 WeakPolarHBondContact CA-O 3.41Å; N77-R101 PolarHBondContact N-O 3Å; N77-R101 WeakPolarHBondContact OD1-CB 3.42Å; N77-R101 WeakPolarHBondContact OD1-CD 3.4Å
78	N	82.3	Confident	80.8	Confident	9 Å²	9	52 Å²	52	5%	0.048	28%	0.284	C	S	.	.	S	Bend	trans	-110.5	6.1	-171	-76	-42.1	0	0	0	114.7	L54 C55 S56 I61 L75 G76 L80 N102	L54-N78 PolarHBondContact O-ND2 3.45Å; C55-N78 WeakPolarHBondContact CA-OD1 3.3Å; S56-N78 WeakPolarHBondContact CB-OD1 3.48Å; S56-N78 PolarHBondContact N-OD1 3.13Å; I61-N78 HydrophobicContact CD1-CB 4Å; I61-N78 WeakPolarHBondContact CD1-ND2 3.24Å; L75-N78 WeakPolarHBondContact CA-ND2 3.37Å; L75-N78 PolarHBondContact O-ND2 2.94Å; G76-N78 VanDerWaalsContact C-N 3.34Å; G76-N78 PolarHBondContact O-N 3.31Å; G76-N78 PolarHBondContact O-ND2 3.48Å; N78-L80 HydrophobicContact CB-CD1 3.88Å; N78-L80 HydrophobicContact CB-CD2 4.18Å; N78-L80 HydrophobicContact CB-CG 3.61Å; N78-L80 PolarHBondContact O-N 3.33Å; N78-L80 VanDerWaalsContact O-N 3.09Å; N78-N102 VanDerWaalsContact C-OD1 3.28Å; N78-N102 WeakPolarHBondContact CA-OD1 3.33Å; N78-N102 WeakPolarHBondContact CB-OD1 3.37Å; N78-N102 PolarHBondContact N-OD1 3.08Å
79	S	84.4	Confident	80.4	Confident	39 Å²	39	53.3 Å²	53.3	27%	0.273	29%	0.293	S	S	.	.			trans	52.9	25.1	-175.3	-69	0	0	0	0	114.4	N102	S79-N102 PolarHBondContact N-OD1 3.03Å
80	L	85.9	Confident	79.7	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.042	29%	0.285	C	S	.	.			trans	-68.2	140.9	-176.2	-60.2	171.1	0	0	0	111.6	I61 L75 N78 N102 R103 F104	I61-L80 HydrophobicContact CD1-CD1 3.71Å; I61-L80 HydrophobicContact CD1-CD2 3.86Å; I61-L80 HydrophobicContact CD1-CG 4.23Å; I61-L80 HydrophobicContact CG1-CD2 4.11Å; L75-L80 HydrophobicContact CB-CD1 4.01Å; L75-L80 HydrophobicContact CD1-CD1 4.48Å; N78-L80 HydrophobicContact CB-CD1 3.88Å; N78-L80 HydrophobicContact CB-CD2 4.18Å; N78-L80 HydrophobicContact CB-CG 3.61Å; N78-L80 PolarHBondContact O-N 3.33Å; N78-L80 VanDerWaalsContact O-N 3.09Å; L80-N102 HydrophobicContact CB-CB 4.25Å; L80-N102 WeakPolarHBondContact CB-OD1 3.31Å; L80-N102 WeakPolarHBondContact CG-OD1 3.49Å; L80-N102 PolarHBondContact N-OD1 2.92Å; L80-R103 CarbonylContact O-C 3.49Å; L80-R103 WeakPolarHBondContact O-CA 3.4Å; L80-R103 PolarHBondContact O-N 3.31Å; L80-F104 HydrophobicContact CB-CE2 4.05Å; L80-F104 HydrophobicContact CB-CZ 3.8Å; L80-F104 HydrophobicContact CD1-CZ 4.45Å; L80-F104 PolarHBondContact O-N 2.94Å
81	Q	88.2	Confident	79.2	Confident	131 Å²	131	50.5 Å²	50.5	61%	0.612	28%	0.28	S	S	*	.	S	Bend	trans	-105.7	-26.2	169.7	-67.6	-179.5	53.5	0	0	112	R103 F104	Q81-R103 HydrophobicContact CG-CB 3.9Å; Q81-F104 WeakPolarHBondContact O-CD1 3.35Å; Q81-F104 WeakPolarHBondContact O-CE1 3.39Å
82	E	86.4	Confident	78.8	Confident	158 Å²	158	53.2 Å²	53.2	74%	0.738	30%	0.297	S	S	*	.	S	Bend	trans	-136.1	158.4	179.9	-64.3	-175.9	169.4	0	0	109
83	L	85.4	Confident	78.6	Confident	23 Å²	23	56 Å²	56	12%	0.12	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-81.5	151	173.9	-71.1	172.7	0	0	0	109.8	L75 L87 L99 F104 P108 V111	L75-L83 HydrophobicContact CD1-CD2 4.04Å; L83-L87 HydrophobicContact CB-CD1 4.46Å; L83-L87 HydrophobicContact CD2-CD1 4.45Å; L83-L99 HydrophobicContact CD2-CD1 4.01Å; L83-L99 HydrophobicContact CD2-CD2 3.57Å; L83-L99 HydrophobicContact CD2-CG 4.46Å; L83-F104 HydrophobicContact CD2-CE1 4.43Å; L83-F104 HydrophobicContact CD2-CZ 3.89Å; L83-F104 HydrophobicContact CG-CE1 4.25Å; L83-F104 HydrophobicContact CG-CZ 4.21Å; L83-P108 HydrophobicContact CD1-CB 3.76Å; L83-P108 HydrophobicContact CD1-CG 3.86Å; L83-P108 HydrophobicContact CG-CB 4.22Å; L83-P108 HydrophobicContact CG-CG 3.95Å; L83-V111 HydrophobicContact CD1-CG2 3.88Å
84	P	77.4	Confident	78.6	Confident	22 Å²	22	56.1 Å²	56.1	14%	0.143	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-57.8	143.1	174.5	-22.1	32.8	0	0	0	112.3	I61 L63	I61-P84 HydrophobicContact CB-CG 3.98Å; I61-P84 HydrophobicContact CG2-CG 4.09Å; L63-P84 HydrophobicContact CD1-CB 4.13Å; L63-P84 HydrophobicContact CG-CB 4.06Å
85	D	68.6	Low	78.8	Confident	164 Å²	164	59 Å²	59	88%	0.877	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	143.1	173.6	-66.9	-36.5	0	0	0	110.9
86	G	68.1	Low	79.1	Confident	38 Å²	38	60.4 Å²	60.4	39%	0.392	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	0	177.3	0	0	0	0	0	116.1	Q88 S89 T90	G86-Q88 PolarHBondContact O-N 3.26Å; G86-S89 PolarHBondContact O-N 3.01Å; G86-S89 PolarHBondContact O-OG 2.99Å; G86-S89 VanDerWaalsContact O-OG 3.12Å; G86-T90 PolarHBondContact O-N 3.45Å; G86-T90 PolarHBondContact O-OG1 3.28Å
87	L	71.7	Confident	79.5	Confident	3 Å²	3	60 Å²	60	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-31.6	177.7	-153.1	134.8	0	0	0	112.8	L63 L73 L75 L83 L91 V110 L114	L63-L87 HydrophobicContact CD1-CB 4.2Å; L63-L87 HydrophobicContact CD1-CD1 4.35Å; L63-L87 HydrophobicContact CD1-CG 4.39Å; L73-L87 HydrophobicContact CD2-CD1 3.99Å; L73-L87 HydrophobicContact CD2-CG 4.42Å; L75-L87 HydrophobicContact CD1-CD1 4.2Å; L83-L87 HydrophobicContact CB-CD1 4.46Å; L83-L87 HydrophobicContact CD2-CD1 4.45Å; L87-L91 HydrophobicContact CD2-CD1 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.1Å; L87-L91 PolarHBondContact O-N 2.79Å; L87-V110 HydrophobicContact CD2-CG1 4.44Å; L87-L114 HydrophobicContact CD2-CD1 4.38Å
88	Q	66.1	Low	79.8	Confident	106 Å²	106	56.4 Å²	56.4	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-70.1	-45.9	176.9	-176.1	-173.5	3.7	0	0	113.3	G86 T90 V110 E113	G86-Q88 PolarHBondContact O-N 3.26Å; Q88-T90 VanDerWaalsContact C-N 3.3Å; Q88-T90 PolarHBondContact O-N 3.14Å; Q88-V110 HydrophobicContact CB-CG1 3.99Å; Q88-E113 PolarHBondContact NE2-OE2 3.47Å
89	S	64.9	Low	80.2	Confident	94 Å²	94	56 Å²	56	66%	0.657	30%	0.301	S	S	*	.	H	α-helix	trans	-77.7	-18.9	-173.2	50.7	0	0	0	0	113	G86	G86-S89 PolarHBondContact O-N 3.01Å; G86-S89 PolarHBondContact O-OG 2.99Å; G86-S89 VanDerWaalsContact O-OG 3.12Å
90	T	65.9	Low	80.3	Confident	45 Å²	45	58.7 Å²	58.7	28%	0.276	31%	0.305	S	S	.	.	H	α-helix	trans	-102.5	-32.8	-173.1	47.6	0	0	0	0	114.1	S68 G86 Q88	S68-T90 VanDerWaalsContact CA-O 3.23Å; S68-T90 WeakPolarHBondContact CA-O 3.08Å; G86-T90 PolarHBondContact O-N 3.45Å; G86-T90 PolarHBondContact O-OG1 3.28Å; Q88-T90 VanDerWaalsContact C-N 3.3Å; Q88-T90 PolarHBondContact O-N 3.14Å
91	L	72.2	Confident	80.2	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.327	C	S	.	.			trans	-112.3	58.5	-167.8	-64	179.6	0	0	0	115.2	I67 I70 L73 L87 N93 L94	I67-L91 HydrophobicContact CB-CD2 3.96Å; I67-L91 HydrophobicContact CD1-CD1 4.34Å; I67-L91 HydrophobicContact CD1-CD2 3.9Å; I67-L91 HydrophobicContact CD1-CG 4.1Å; I67-L91 HydrophobicContact CG1-CD2 3.83Å; I67-L91 HydrophobicContact CG1-CG 4.43Å; I67-L91 WeakPolarHBondContact O-CD2 3.4Å; I70-L91 HydrophobicContact CB-CD2 4.14Å; L73-L91 HydrophobicContact CD2-CD1 3.52Å; L87-L91 HydrophobicContact CD2-CD1 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.1Å; L87-L91 PolarHBondContact O-N 2.79Å; L91-N93 VanDerWaalsContact C-N 3.29Å; L91-N93 PolarHBondContact O-N 2.83Å; L91-L94 HydrophobicContact CB-CB 4.31Å; L91-L94 PolarHBondContact O-N 3.3Å
92	N	76.1	Confident	80.2	Confident	110 Å²	110	58.9 Å²	58.9	59%	0.588	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.5	-178.1	-69.6	-38.4	0	0	0	115.1
93	N	82.5	Confident	80.5	Confident	68 Å²	68	57.8 Å²	57.8	36%	0.364	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	10.1	-178.6	-63.9	-45	0	0	0	113	S68 L91 R95	S68-N93 PolarHBondContact O-ND2 3.48Å; L91-N93 VanDerWaalsContact C-N 3.29Å; L91-N93 PolarHBondContact O-N 2.83Å; N93-R95 WeakPolarHBondContact O-CG 3.27Å; N93-R95 PolarHBondContact O-N 3.05Å
94	L	87.6	Confident	80.8	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.016	28%	0.284	C	S	.	.			trans	-69.6	124.9	-172.6	-163.9	71.1	0	0	0	111.6	I70 L73 L91 L97 L114 Q116 L117	I70-L94 HydrophobicContact CG2-CD1 4.22Å; L73-L94 HydrophobicContact CB-CD1 3.57Å; L73-L94 HydrophobicContact CB-CD2 4.16Å; L91-L94 HydrophobicContact CB-CB 4.31Å; L91-L94 PolarHBondContact O-N 3.3Å; L94-L97 HydrophobicContact CD2-CB 4.01Å; L94-L97 HydrophobicContact CD2-CD1 4.12Å; L94-L97 HydrophobicContact CD2-CG 4.43Å; L94-L114 HydrophobicContact CD2-CD1 4.14Å; L94-Q116 CarbonylContact O-C 3.37Å; L94-L117 HydrophobicContact CD2-CD2 4.26Å; L94-L117 HydrophobicContact CG-CD2 4.19Å
95	R	89.3	Confident	81.5	Confident	97 Å²	97	59.2 Å²	59.2	37%	0.366	30%	0.302	S	S	.	.			trans	-109.4	-31	-179.4	-58.9	-175.3	65.2	-168.4	-0.4	112.4	E71 N93 V118 E119	E71-R95 HydrophobicContact CB-CG 4.33Å; E71-R95 WeakPolarHBondContact O-CA 3.2Å; E71-R95 PolarHBondContact O-N 3Å; N93-R95 WeakPolarHBondContact O-CG 3.27Å; N93-R95 PolarHBondContact O-N 3.05Å; R95-V118 HydrophobicContact CB-CG2 4.27Å; R95-V118 WeakPolarHBondContact O-CA 3.33Å; R95-V118 PolarHBondContact O-N 3.41Å; R95-E119 PolarHBondContact O-N 3.13Å
96	I	91.1	Very high	82.6	Confident	31 Å²	31	54.5 Å²	54.5	16%	0.159	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.1	-178.2	-53.6	-175	0	0	0	109.1	L49 E71 V72 L73 I98 E119	L49-I96 HydrophobicContact CD1-CD1 4.18Å; E71-I96 PolarHBondContact O-N 3.4Å; V72-I96 WeakPolarHBondContact CA-O 3.46Å; V72-I96 HydrophobicContact CB-CB 4.25Å; V72-I96 HydrophobicContact CG1-CB 3.96Å; V72-I96 HydrophobicContact CG1-CG2 4.05Å; V72-I96 HydrophobicContact CG2-CB 3.99Å; V72-I96 HydrophobicContact CG2-CD1 3.9Å; V72-I96 HydrophobicContact CG2-CG1 4.09Å; L73-I96 PolarHBondContact N-O 3.36Å; I96-I98 HydrophobicContact CG2-CD1 4.41Å; I96-I98 HydrophobicContact CG2-CG1 4.14Å; I96-E119 WeakPolarHBondContact CA-O 3.27Å; I96-E119 HydrophobicContact CB-CB 4.41Å; I96-E119 HydrophobicContact CG1-CB 4.1Å; I96-E119 HydrophobicContact CG2-CB 4.05Å; I96-E119 HydrophobicContact CG2-CG 4.15Å
97	L	92.2	Very high	83.7	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	119.1	176.5	179.5	58.8	0	0	0	110.5	L73 L94 L99 V111 L114 L117 E119 L120 D121	L73-L97 HydrophobicContact CB-CD1 4.22Å; L73-L97 HydrophobicContact CD2-CD1 4Å; L73-L97 HydrophobicContact CG-CD1 4.24Å; L94-L97 HydrophobicContact CD2-CB 4.01Å; L94-L97 HydrophobicContact CD2-CD1 4.12Å; L94-L97 HydrophobicContact CD2-CG 4.43Å; L97-L99 HydrophobicContact CD1-CD2 3.9Å; L97-L99 HydrophobicContact CD1-CG 4.2Å; L97-L99 HydrophobicContact CD2-CD1 4.12Å; L97-L99 HydrophobicContact CD2-CG 4.37Å; L97-L99 HydrophobicContact CG-CD1 4.28Å; L97-L99 HydrophobicContact CG-CD2 4.25Å; L97-L99 HydrophobicContact CG-CG 3.99Å; L97-V111 HydrophobicContact CD2-CG2 4.2Å; L97-L114 HydrophobicContact CD2-CD1 3.97Å; L97-L117 HydrophobicContact CB-CD1 4.5Å; L97-L117 HydrophobicContact CB-CD2 3.86Å; L97-E119 PolarHBondContact N-O 3.33Å; L97-L120 HydrophobicContact CB-CD1 4.09Å; L97-L120 HydrophobicContact CD2-CD1 4.08Å; L97-L120 HydrophobicContact CG-CD1 4.13Å; L97-L120 WeakPolarHBondContact O-CA 3.41Å; L97-D121 PolarHBondContact O-N 3.38Å
98	I	89	Confident	84.5	Confident	34 Å²	34	54 Å²	54	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114.2	179.8	-56	171.1	0	0	0	109.4	L73 N74 L75 G76 I96 R100 D121	L73-I98 PolarHBondContact O-N 3.3Å; N74-I98 HydrophobicContact CB-CB 4.24Å; N74-I98 HydrophobicContact CB-CD1 4.33Å; N74-I98 WeakPolarHBondContact OD1-CG2 3.49Å; L75-I98 CarbonylContact C-O 3.3Å; L75-I98 PolarHBondContact N-O 3.04Å; G76-I98 PolarHBondContact N-O 3.18Å; I96-I98 HydrophobicContact CG2-CD1 4.41Å; I96-I98 HydrophobicContact CG2-CG1 4.14Å; I98-R100 HydrophobicContact CG2-CB 4.23Å; I98-D121 HydrophobicContact CG1-CB 4.5Å; I98-D121 HydrophobicContact CG2-CB 4.33Å
99	L	90.8	Very high	85.4	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.286	C	S	.	.			trans	-120.4	17.6	179.7	-57.7	180	0	0	0	112.4	L75 L83 L97 N102 F104 V111 D121 M122 N125	L75-L99 HydrophobicContact CB-CD2 3.93Å; L75-L99 HydrophobicContact CD1-CD2 4.02Å; L75-L99 HydrophobicContact CG-CD2 4.34Å; L83-L99 HydrophobicContact CD2-CD1 4.01Å; L83-L99 HydrophobicContact CD2-CD2 3.57Å; L83-L99 HydrophobicContact CD2-CG 4.46Å; L97-L99 HydrophobicContact CD1-CD2 3.9Å; L97-L99 HydrophobicContact CD1-CG 4.2Å; L97-L99 HydrophobicContact CD2-CD1 4.12Å; L97-L99 HydrophobicContact CD2-CG 4.37Å; L97-L99 HydrophobicContact CG-CD1 4.28Å; L97-L99 HydrophobicContact CG-CD2 4.25Å; L97-L99 HydrophobicContact CG-CG 3.99Å; L99-N102 PolarHBondContact O-ND2 3.2Å; L99-F104 HydrophobicContact CB-CE2 4.07Å; L99-F104 HydrophobicContact CD1-CE2 4.38Å; L99-F104 HydrophobicContact CD2-CE2 4.45Å; L99-V111 HydrophobicContact CD1-CG2 4.33Å; L99-D121 CarbonylContact C-O 3.59Å; L99-D121 WeakPolarHBondContact CA-O 3.45Å; L99-D121 PolarHBondContact N-O 3.48Å; L99-M122 HydrophobicContact CB-CE 4.43Å; L99-M122 HydrophobicContact CB-CG 4.23Å; L99-M122 HydrophobicContact CD1-CE 3.9Å; L99-M122 HydrophobicContact CD1-CG 4.19Å; L99-M122 HydrophobicContact CD1-SD 4.14Å; L99-N125 PolarHBondContact O-ND2 3.39Å
100	R	87.4	Confident	86.5	Confident	97 Å²	97	56.4 Å²	56.4	37%	0.366	27%	0.266	S	S	.	.			trans	-58.2	147.6	-177.2	173.4	172.6	-172.4	-178.2	7.6	113.6	G76 N77 I98 N102 D121 S123 H124	G76-R100 CarbonylContact C-O 3.5Å; G76-R100 WeakPolarHBondContact CA-O 3.31Å; N77-R100 PolarHBondContact N-O 3.33Å; I98-R100 HydrophobicContact CG2-CB 4.23Å; R100-N102 PolarHBondContact O-N 3.28Å; R100-N102 PolarHBondContact O-ND2 3.42Å; R100-D121 PolarHBondContact N-O 2.93Å; R100-S123 CarbonylContact C-O 3.13Å; R100-S123 WeakPolarHBondContact CA-O 3.27Å; R100-S123 WeakPolarHBondContact CD-OG 3.26Å; R100-S123 WeakPolarHBondContact CG-OG 3.09Å; R100-S123 PolarHBondContact NE-OG 3Å; R100-H124 PolarHBondContact NE-CD2 3.03Å; R100-H124 VanDerWaalsContact NE-CD2 3.28Å; R100-H124 PolarHBondContact NH2-CD2 3.35Å; R100-H124 PolarHBondContact NH2-NE2 3.26Å
101	R	83.3	Confident	87.6	Confident	131 Å²	131	54.3 Å²	54.3	49%	0.494	25%	0.253	S	S	.	.	S	Bend	trans	56.7	50.8	174.1	-73	175.7	177.3	-172.7	2.4	112.5	N77 S123 H124	N77-R101 WeakPolarHBondContact CA-O 3.41Å; N77-R101 PolarHBondContact N-O 3Å; N77-R101 WeakPolarHBondContact OD1-CB 3.42Å; N77-R101 WeakPolarHBondContact OD1-CD 3.4Å; R101-S123 PolarHBondContact N-O 2.97Å; R101-H124 WeakPolarHBondContact CA-O 3.45Å; R101-H124 HydrophobicContact CB-CB 4.36Å; R101-H124 HydrophobicContact CG-CB 3.59Å; R101-H124 PolarHBondContact N-O 3.09Å
102	N	89.1	Confident	88.3	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.064	26%	0.256	C	S	.	.	S	Bend	trans	-117.2	-160.5	172.1	-79.8	-60.7	0	0	0	109.4	L75 N78 S79 L80 L99 R100 F104 H124 N125	L75-N102 PolarHBondContact O-ND2 2.96Å; N78-N102 VanDerWaalsContact C-OD1 3.28Å; N78-N102 WeakPolarHBondContact CA-OD1 3.33Å; N78-N102 WeakPolarHBondContact CB-OD1 3.37Å; N78-N102 PolarHBondContact N-OD1 3.08Å; S79-N102 PolarHBondContact N-OD1 3.03Å; L80-N102 HydrophobicContact CB-CB 4.25Å; L80-N102 WeakPolarHBondContact CB-OD1 3.31Å; L80-N102 WeakPolarHBondContact CG-OD1 3.49Å; L80-N102 PolarHBondContact N-OD1 2.92Å; L99-N102 PolarHBondContact O-ND2 3.2Å; R100-N102 PolarHBondContact O-N 3.28Å; R100-N102 PolarHBondContact O-ND2 3.42Å; N102-F104 HydrophobicContact CB-CD2 3.61Å; N102-F104 HydrophobicContact CB-CE2 3.62Å; N102-H124 PolarHBondContact N-O 3.13Å; N102-N125 VanDerWaalsContact CA-OD1 3.24Å; N102-N125 WeakPolarHBondContact CA-OD1 3.45Å; N102-N125 WeakPolarHBondContact CB-OD1 3.49Å; N102-N125 PolarHBondContact N-OD1 3.34Å; N102-N125 PolarHBondContact O-OD1 3.38Å
103	R	91.1	Very high	88.8	Confident	135 Å²	135	54.3 Å²	54.3	51%	0.509	25%	0.249	S	C	.	.			trans	-123.5	25.8	-178.2	-59.9	-177.9	-172.6	-165.8	3.4	112.1	L80 Q81 S105 N125	L80-R103 CarbonylContact O-C 3.49Å; L80-R103 WeakPolarHBondContact O-CA 3.4Å; L80-R103 PolarHBondContact O-N 3.31Å; Q81-R103 HydrophobicContact CG-CB 3.9Å; R103-S105 PolarHBondContact O-N 2.98Å; R103-N125 PolarHBondContact N-OD1 3.17Å
104	F	91.9	Very high	88.9	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	24%	0.236	C	C	.	.			trans	-61.9	125.4	179.6	-69.1	-73.9	0	0	0	110.9	L80 Q81 L83 L99 N102 P108 M122 N125 C126 V127	L80-F104 HydrophobicContact CB-CE2 4.05Å; L80-F104 HydrophobicContact CB-CZ 3.8Å; L80-F104 HydrophobicContact CD1-CZ 4.45Å; L80-F104 PolarHBondContact O-N 2.94Å; Q81-F104 WeakPolarHBondContact O-CD1 3.35Å; Q81-F104 WeakPolarHBondContact O-CE1 3.39Å; L83-F104 HydrophobicContact CD2-CE1 4.43Å; L83-F104 HydrophobicContact CD2-CZ 3.89Å; L83-F104 HydrophobicContact CG-CE1 4.25Å; L83-F104 HydrophobicContact CG-CZ 4.21Å; L99-F104 HydrophobicContact CB-CE2 4.07Å; L99-F104 HydrophobicContact CD1-CE2 4.38Å; L99-F104 HydrophobicContact CD2-CE2 4.45Å; N102-F104 HydrophobicContact CB-CD2 3.61Å; N102-F104 HydrophobicContact CB-CE2 3.62Å; F104-P108 HydrophobicContact CD1-CG 3.85Å; F104-P108 HydrophobicContact CE1-CG 3.78Å; F104-M122 HydrophobicContact CB-CE 4.09Å; F104-M122 HydrophobicContact CD2-CE 3.99Å; F104-M122 HydrophobicContact CG-CE 4.01Å; F104-N125 HydrophobicContact CB-CB 4.33Å; F104-N125 WeakPolarHBondContact CD2-OD1 3.45Å; F104-N125 PolarHBondContact N-OD1 2.79Å; F104-N125 VanDerWaalsContact N-OD1 3.09Å; F104-C126 CarbonylContact O-C 3.22Å; F104-C126 VanDerWaalsContact O-CA 3.25Å; F104-C126 WeakPolarHBondContact O-CA 3.37Å; F104-C126 WeakPolarHBondContact O-CB 3.39Å; F104-C126 PolarHBondContact O-N 2.72Å; F104-V127 HydrophobicContact CB-CG2 4.38Å; F104-V127 PolarHBondContact O-N 2.66Å
105	S	92.1	Very high	88.6	Confident	74 Å²	74	53.8 Å²	53.8	52%	0.517	26%	0.257	S	S	.	.	S	Bend	trans	-89.6	-19.9	176.4	61.3	0	0	0	0	113.1	R103 V127 R128	R103-S105 PolarHBondContact O-N 2.98Å; S105-V127 WeakPolarHBondContact O-CA 3.34Å; S105-R128 PolarHBondContact O-N 3.04Å
106	S	92.1	Very high	88.5	Confident	64 Å²	64	54.6 Å²	54.6	45%	0.448	27%	0.265	S	S	.	.	S	Bend	trans	-147.5	161.4	175.6	63	0	0	0	0	109.3	P108	S106-P108 WeakPolarHBondContact O-CD 3.4Å
107	V	91.1	Very high	88.6	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.048	26%	0.258	C	S	.	.			trans	-74.9	121.4	173.6	-178.9	0	0	0	0	109	V111 F112 M122 V127 L130 I145	V107-V111 HydrophobicContact CG1-CB 4.13Å; V107-V111 HydrophobicContact CG1-CG1 4.3Å; V107-V111 HydrophobicContact CG1-CG2 4.36Å; V107-F112 HydrophobicContact CB-CE1 4.48Å; V107-F112 HydrophobicContact CB-CE2 4.36Å; V107-F112 HydrophobicContact CB-CZ 3.67Å; V107-F112 HydrophobicContact CG1-CE1 3.75Å; V107-F112 HydrophobicContact CG1-CE2 4.02Å; V107-F112 HydrophobicContact CG1-CZ 3.28Å; V107-M122 HydrophobicContact CB-SD 4.19Å; V107-M122 HydrophobicContact CG1-SD 3.72Å; V107-M122 HydrophobicContact CG2-SD 3.85Å; V107-V127 HydrophobicContact CG2-CG1 3.95Å; V107-L130 HydrophobicContact CG2-CD1 3.91Å; V107-I145 HydrophobicContact CG2-CD1 4.26Å
108	P	89	Confident	88.7	Confident	24 Å²	24	54.8 Å²	54.8	16%	0.156	27%	0.268	C	S	.	.			trans	-61	138.9	-179.2	-23.3	33.7	0	0	0	112.1	L83 F104 S106 V110 V111	L83-P108 HydrophobicContact CD1-CB 3.76Å; L83-P108 HydrophobicContact CD1-CG 3.86Å; L83-P108 HydrophobicContact CG-CB 4.22Å; L83-P108 HydrophobicContact CG-CG 3.95Å; F104-P108 HydrophobicContact CD1-CG 3.85Å; F104-P108 HydrophobicContact CE1-CG 3.78Å; S106-P108 WeakPolarHBondContact O-CD 3.4Å; P108-V110 PolarHBondContact O-N 3.43Å; P108-V111 HydrophobicContact CB-CG2 4.29Å; P108-V111 HydrophobicContact CG-CG2 4.48Å; P108-V111 WeakPolarHBondContact O-CB 3.43Å; P108-V111 WeakPolarHBondContact O-CG2 3.35Å; P108-V111 PolarHBondContact O-N 3.35Å
109	R	85.8	Confident	88.9	Confident	209 Å²	209	55.3 Å²	55.3	79%	0.789	27%	0.269	S	S	*	.	H	α-helix	trans	-56.9	-37.4	-176.3	-69.3	-175.3	179.7	-177.9	0.2	113.4	V111 F112	R109-V111 PolarHBondContact O-N 2.93Å; R109-V111 VanDerWaalsContact O-N 3.11Å; R109-F112 WeakPolarHBondContact O-CD2 3.28Å; R109-F112 PolarHBondContact O-N 2.65Å
110	V	86.8	Confident	89.2	Confident	41 Å²	41	55.6 Å²	55.6	25%	0.248	27%	0.271	C	S	.	.	H	α-helix	trans	-53.4	-32.3	177.8	-179.9	0	0	0	0	112	L87 Q88 P108 F112 E113	L87-V110 HydrophobicContact CD2-CG1 4.44Å; Q88-V110 HydrophobicContact CB-CG1 3.99Å; P108-V110 PolarHBondContact O-N 3.43Å; V110-F112 VanDerWaalsContact C-N 3.27Å; V110-F112 PolarHBondContact O-N 3.42Å; V110-E113 PolarHBondContact O-N 3.29Å
111	V	89.4	Confident	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-37.6	178.6	178.1	0	0	0	0	111.6	L83 L97 L99 V107 P108 R109 E113 L114 L117 L120 L137	L83-V111 HydrophobicContact CD1-CG2 3.88Å; L97-V111 HydrophobicContact CD2-CG2 4.2Å; L99-V111 HydrophobicContact CD1-CG2 4.33Å; V107-V111 HydrophobicContact CG1-CB 4.13Å; V107-V111 HydrophobicContact CG1-CG1 4.3Å; V107-V111 HydrophobicContact CG1-CG2 4.36Å; P108-V111 HydrophobicContact CB-CG2 4.29Å; P108-V111 HydrophobicContact CG-CG2 4.48Å; P108-V111 WeakPolarHBondContact O-CB 3.43Å; P108-V111 WeakPolarHBondContact O-CG2 3.35Å; P108-V111 PolarHBondContact O-N 3.35Å; R109-V111 PolarHBondContact O-N 2.93Å; R109-V111 VanDerWaalsContact O-N 3.11Å; V111-E113 VanDerWaalsContact C-N 3.28Å; V111-E113 PolarHBondContact O-N 2.96Å; V111-L114 PolarHBondContact O-N 2.54Å; V111-L117 HydrophobicContact CG1-CD1 4.38Å; V111-L120 HydrophobicContact CG1-CD1 3.96Å; V111-L120 HydrophobicContact CG1-CD2 3.62Å; V111-L120 HydrophobicContact CG1-CG 4.47Å; V111-L137 WeakPolarHBondContact O-CD2 3.34Å
112	F	87.6	Confident	89.9	Confident	13 Å²	13	45.9 Å²	45.9	6%	0.057	24%	0.236	C	C	.	.	H	α-helix	trans	-73.7	-21.7	-177.5	-53.3	-55.2	0	0	0	113.4	V107 R109 V110 L114 P131 G133 V134 Q136 L137	V107-F112 HydrophobicContact CB-CE1 4.48Å; V107-F112 HydrophobicContact CB-CE2 4.36Å; V107-F112 HydrophobicContact CB-CZ 3.67Å; V107-F112 HydrophobicContact CG1-CE1 3.75Å; V107-F112 HydrophobicContact CG1-CE2 4.02Å; V107-F112 HydrophobicContact CG1-CZ 3.28Å; R109-F112 WeakPolarHBondContact O-CD2 3.28Å; R109-F112 PolarHBondContact O-N 2.65Å; V110-F112 VanDerWaalsContact C-N 3.27Å; V110-F112 PolarHBondContact O-N 3.42Å; F112-L114 VanDerWaalsContact C-N 3.29Å; F112-P131 HydrophobicContact CE1-CG 4.3Å; F112-P131 HydrophobicContact CE2-CG 3.39Å; F112-P131 HydrophobicContact CZ-CG 3.24Å; F112-G133 WeakPolarHBondContact CD1-O 3.32Å; F112-V134 HydrophobicContact CE1-CB 4.16Å; F112-Q136 PolarHBondContact O-OE1 2.87Å; F112-L137 HydrophobicContact CD1-CD1 4.42Å
113	E	84.9	Confident	89.9	Confident	98 Å²	98	45.5 Å²	45.5	46%	0.458	23%	0.234	S	C	.	.	H	α-helix	trans	-81.1	-13.6	179.5	-61.3	175	-174.7	0	0	111.7	Q88 V110 V111 G115	Q88-E113 PolarHBondContact NE2-OE2 3.47Å; V110-E113 PolarHBondContact O-N 3.29Å; V111-E113 VanDerWaalsContact C-N 3.28Å; V111-E113 PolarHBondContact O-N 2.96Å; E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 3.18Å
114	L	86.3	Confident	89.8	Confident	15 Å²	15	41.6 Å²	41.6	8%	0.079	22%	0.222	C	C	.	.			trans	-80.7	66.7	176.2	-59.3	170.3	0	0	0	111.4	L87 L94 L97 V111 F112 Q116 L117 L137	L87-L114 HydrophobicContact CD2-CD1 4.38Å; L94-L114 HydrophobicContact CD2-CD1 4.14Å; L97-L114 HydrophobicContact CD2-CD1 3.97Å; V111-L114 PolarHBondContact O-N 2.54Å; F112-L114 VanDerWaalsContact C-N 3.29Å; L114-Q116 PolarHBondContact O-N 3.38Å; L114-L117 HydrophobicContact CB-CD1 3.66Å; L114-L117 HydrophobicContact CB-CG 3.76Å; L114-L117 HydrophobicContact CD1-CD1 4.03Å; L114-L117 WeakPolarHBondContact O-CB 3.43Å; L114-L117 WeakPolarHBondContact O-CG 3.42Å; L114-L117 PolarHBondContact O-N 3.04Å; L114-L117 VanDerWaalsContact O-N 3.1Å; L114-L137 WeakPolarHBondContact O-CD2 3.33Å
115	G	80.6	Confident	89.8	Confident	45 Å²	45	42.1 Å²	42.1	46%	0.464	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-10.8	-172.8	0	0	0	0	0	116.7	E113	E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 3.18Å
116	Q	87.4	Confident	89.9	Confident	114 Å²	114	41 Å²	41	53%	0.533	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.1	176.7	-60.8	-165.5	11.4	0	0	113.9	L94 L114 V118	L94-Q116 CarbonylContact O-C 3.37Å; L114-Q116 PolarHBondContact O-N 3.38Å; Q116-V118 PolarHBondContact O-N 3.38Å
117	L	91.9	Very high	90	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.195	C	C	.	.			trans	-60.5	132.3	179.5	-76.6	175.5	0	0	0	111.9	L94 L97 V111 L114 L137 G139 L140	L94-L117 HydrophobicContact CD2-CD2 4.26Å; L94-L117 HydrophobicContact CG-CD2 4.19Å; L97-L117 HydrophobicContact CB-CD1 4.5Å; L97-L117 HydrophobicContact CB-CD2 3.86Å; V111-L117 HydrophobicContact CG1-CD1 4.38Å; L114-L117 HydrophobicContact CB-CD1 3.66Å; L114-L117 HydrophobicContact CB-CG 3.76Å; L114-L117 HydrophobicContact CD1-CD1 4.03Å; L114-L117 WeakPolarHBondContact O-CB 3.43Å; L114-L117 WeakPolarHBondContact O-CG 3.42Å; L114-L117 PolarHBondContact O-N 3.04Å; L114-L117 VanDerWaalsContact O-N 3.1Å; L117-L137 HydrophobicContact CD1-CD2 4.29Å; L117-G139 CarbonylContact O-C 3.56Å; L117-L140 HydrophobicContact CB-CD1 3.97Å; L117-L140 WeakPolarHBondContact O-CA 3.31Å; L117-L140 PolarHBondContact O-N 2.79Å
118	V	94.4	Very high	90.2	Very high	34 Å²	34	46 Å²	46	21%	0.206	22%	0.224	C	C	.	.	S	Bend	trans	-106.4	-35.6	175.2	-178.9	0	0	0	0	110.3	R95 Q116 K141 K142	R95-V118 HydrophobicContact CB-CG2 4.27Å; R95-V118 WeakPolarHBondContact O-CA 3.33Å; R95-V118 PolarHBondContact O-N 3.41Å; Q116-V118 PolarHBondContact O-N 3.38Å; V118-K141 HydrophobicContact CG1-CB 3.9Å; V118-K141 HydrophobicContact CG1-CD 3.79Å; V118-K141 HydrophobicContact CG1-CG 3.94Å; V118-K141 PolarHBondContact O-N 2.86Å; V118-K142 PolarHBondContact O-N 3.44Å
119	E	94.8	Very high	90.4	Very high	45 Å²	45	48.1 Å²	48.1	21%	0.21	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133	177.5	177.9	170.2	-176.7	0	0	111.4	R95 I96 L97 K142	R95-E119 PolarHBondContact O-N 3.13Å; I96-E119 WeakPolarHBondContact CA-O 3.27Å; I96-E119 HydrophobicContact CB-CB 4.41Å; I96-E119 HydrophobicContact CG1-CB 4.1Å; I96-E119 HydrophobicContact CG2-CB 4.05Å; I96-E119 HydrophobicContact CG2-CG 4.15Å; L97-E119 PolarHBondContact N-O 3.33Å; E119-K142 WeakPolarHBondContact CA-O 3.46Å; E119-K142 HydrophobicContact CB-CB 4.22Å; E119-K142 HydrophobicContact CG-CB 4.02Å; E119-K142 HydrophobicContact CG-CD 4.07Å; E119-K142 HydrophobicContact CG-CG 4.12Å; E119-K142 WeakPolarHBondContact OE1-CD 3.25Å; E119-K142 WeakPolarHBondContact OE1-CE 3.49Å; E119-K142 IonicContact OE1-NZ 2.65Å; E119-K142 PolarHBondContact OE1-NZ 2.96Å
120	L	95.3	Very high	90.7	Very high	7 Å²	7	38.7 Å²	38.7	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.1	175.3	176.4	62.7	0	0	0	109.7	L97 V111 M122 L137 L140 K142 L143 C144	L97-L120 HydrophobicContact CB-CD1 4.09Å; L97-L120 HydrophobicContact CD2-CD1 4.08Å; L97-L120 HydrophobicContact CG-CD1 4.13Å; L97-L120 WeakPolarHBondContact O-CA 3.41Å; V111-L120 HydrophobicContact CG1-CD1 3.96Å; V111-L120 HydrophobicContact CG1-CD2 3.62Å; V111-L120 HydrophobicContact CG1-CG 4.47Å; L120-M122 HydrophobicContact CD1-CG 3.99Å; L120-M122 HydrophobicContact CG-CG 4.18Å; L120-L137 HydrophobicContact CD2-CD1 4.13Å; L120-L140 HydrophobicContact CB-CD1 4.03Å; L120-L140 HydrophobicContact CB-CD2 4.48Å; L120-K142 PolarHBondContact N-O 3.44Å; L120-L143 HydrophobicContact CB-CD1 4.08Å; L120-L143 HydrophobicContact CD2-CD1 3.93Å; L120-L143 HydrophobicContact CG-CD1 4.11Å; L120-L143 WeakPolarHBondContact O-CA 3.32Å; L120-C144 PolarHBondContact O-N 3.42Å
121	D	91.6	Very high	91	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.118	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	111.8	173.4	-178.4	3	0	0	0	110.6	L97 I98 L99 R100 S123 C144	L97-D121 PolarHBondContact O-N 3.38Å; I98-D121 HydrophobicContact CG1-CB 4.5Å; I98-D121 HydrophobicContact CG2-CB 4.33Å; L99-D121 CarbonylContact C-O 3.59Å; L99-D121 WeakPolarHBondContact CA-O 3.45Å; L99-D121 PolarHBondContact N-O 3.48Å; R100-D121 PolarHBondContact N-O 2.93Å; D121-S123 WeakPolarHBondContact OD1-CB 3.4Å; D121-S123 PolarHBondContact OD1-N 3.26Å; D121-S123 PolarHBondContact OD1-OG 3.36Å; D121-C144 HydrophobicContact CB-CB 4.22Å
122	M	94.6	Very high	91.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.233	C	C	.	.			trans	-117.9	23.5	173.1	-67.3	-153.7	69.4	0	0	112.3	L99 F104 V107 L120 N125 V127 C144 I145 N148	L99-M122 HydrophobicContact CB-CE 4.43Å; L99-M122 HydrophobicContact CB-CG 4.23Å; L99-M122 HydrophobicContact CD1-CE 3.9Å; L99-M122 HydrophobicContact CD1-CG 4.19Å; L99-M122 HydrophobicContact CD1-SD 4.14Å; F104-M122 HydrophobicContact CB-CE 4.09Å; F104-M122 HydrophobicContact CD2-CE 3.99Å; F104-M122 HydrophobicContact CG-CE 4.01Å; V107-M122 HydrophobicContact CB-SD 4.19Å; V107-M122 HydrophobicContact CG1-SD 3.72Å; V107-M122 HydrophobicContact CG2-SD 3.85Å; L120-M122 HydrophobicContact CD1-CG 3.99Å; L120-M122 HydrophobicContact CG-CG 4.18Å; M122-N125 PolarHBondContact O-ND2 3.02Å; M122-V127 HydrophobicContact CE-CG2 4.48Å; M122-C144 PolarHBondContact N-O 2.96Å; M122-I145 HydrophobicContact CB-CG1 4.35Å; M122-N148 PolarHBondContact O-ND2 3.45Å
123	S	90.1	Very high	91.2	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.028	24%	0.239	C	C	.	.			trans	-64.8	157	-177.6	61.9	0	0	0	0	113.5	R100 R101 D121 N125 S146	R100-S123 CarbonylContact C-O 3.13Å; R100-S123 WeakPolarHBondContact CA-O 3.27Å; R100-S123 WeakPolarHBondContact CD-OG 3.26Å; R100-S123 WeakPolarHBondContact CG-OG 3.09Å; R100-S123 PolarHBondContact NE-OG 3Å; R101-S123 PolarHBondContact N-O 2.97Å; D121-S123 WeakPolarHBondContact OD1-CB 3.4Å; D121-S123 PolarHBondContact OD1-N 3.26Å; D121-S123 PolarHBondContact OD1-OG 3.36Å; S123-N125 PolarHBondContact O-ND2 3.35Å; S123-S146 CarbonylContact C-O 3.49Å; S123-S146 WeakPolarHBondContact CA-O 3.41Å; S123-S146 WeakPolarHBondContact CB-O 3.44Å; S123-S146 VanDerWaalsContact CB-OG 3.27Å; S123-S146 WeakPolarHBondContact CB-OG 3.36Å
124	H	87.9	Confident	91.6	Very high	54 Å²	54	39.2 Å²	39.2	25%	0.25	22%	0.217	C	C	.	.	S	Bend	trans	52.4	58.7	-177.7	-60.3	-94.2	0	0	0	113	R100 R101 N102 S146 H147	R100-H124 PolarHBondContact NE-CD2 3.03Å; R100-H124 VanDerWaalsContact NE-CD2 3.28Å; R100-H124 PolarHBondContact NH2-CD2 3.35Å; R100-H124 PolarHBondContact NH2-NE2 3.26Å; R101-H124 WeakPolarHBondContact CA-O 3.45Å; R101-H124 HydrophobicContact CB-CB 4.36Å; R101-H124 HydrophobicContact CG-CB 3.59Å; R101-H124 PolarHBondContact N-O 3.09Å; N102-H124 PolarHBondContact N-O 3.13Å; H124-S146 PolarHBondContact N-O 3.41Å; H124-H147 VanDerWaalsContact CA-O 3.28Å; H124-H147 WeakPolarHBondContact CA-O 3.46Å; H124-H147 HydrophobicContact CB-CB 4.34Å; H124-H147 AromaticContact CE1-CD2 3.2Å; H124-H147 PolarHBondContact CE1-CD2 3.49Å; H124-H147 AromaticContact CE1-CG 3.49Å; H124-H147 VanDerWaalsContact CE1-CG 3.49Å; H124-H147 AromaticContact CE1-NE2 3.58Å; H124-H147 PolarHBondContact N-O 2.96Å; H124-H147 AromaticContact ND1-CD2 3.79Å; H124-H147 AromaticContact ND1-CG 3.62Å; H124-H147 AromaticContact NE2-CD2 3.42Å; H124-H147 PolarHBondContact NE2-CD2 3.16Å; H124-H147 AromaticContact NE2-NE2 3.99Å
125	N	91.5	Very high	91.9	Very high	11 Å²	11	39 Å²	39	6%	0.059	22%	0.219	C	C	.	.	S	Bend	trans	-127	-164.1	173.7	-84.7	-75.1	0	0	0	109.4	L99 N102 R103 F104 M122 S123 V127 H147 N148	L99-N125 PolarHBondContact O-ND2 3.39Å; N102-N125 VanDerWaalsContact CA-OD1 3.24Å; N102-N125 WeakPolarHBondContact CA-OD1 3.45Å; N102-N125 WeakPolarHBondContact CB-OD1 3.49Å; N102-N125 PolarHBondContact N-OD1 3.34Å; N102-N125 PolarHBondContact O-OD1 3.38Å; R103-N125 PolarHBondContact N-OD1 3.17Å; F104-N125 HydrophobicContact CB-CB 4.33Å; F104-N125 WeakPolarHBondContact CD2-OD1 3.45Å; F104-N125 PolarHBondContact N-OD1 2.79Å; F104-N125 VanDerWaalsContact N-OD1 3.09Å; M122-N125 PolarHBondContact O-ND2 3.02Å; S123-N125 PolarHBondContact O-ND2 3.35Å; N125-V127 HydrophobicContact CB-CG2 4.08Å; N125-H147 PolarHBondContact N-O 3.03Å; N125-N148 VanDerWaalsContact CA-OD1 3.27Å; N125-N148 WeakPolarHBondContact CA-OD1 3.43Å; N125-N148 WeakPolarHBondContact CB-OD1 3.46Å; N125-N148 PolarHBondContact N-OD1 2.81Å; N125-N148 PolarHBondContact O-OD1 2.99Å
126	C	94.4	Very high	92.4	Very high	52 Å²	52	42.3 Å²	42.3	35%	0.351	22%	0.222	S	C	.	.			trans	-115.5	25.8	177.5	-72.8	0	0	0	0	112.1	F104 R128 N148	F104-C126 CarbonylContact O-C 3.22Å; F104-C126 VanDerWaalsContact O-CA 3.25Å; F104-C126 WeakPolarHBondContact O-CA 3.37Å; F104-C126 WeakPolarHBondContact O-CB 3.39Å; F104-C126 PolarHBondContact O-N 2.72Å; C126-R128 PolarHBondContact O-N 3.27Å; C126-N148 PolarHBondContact N-OD1 2.97Å
127	V	95.5	Very high	92.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.			trans	-66.6	123.7	-173.6	-178.2	0	0	0	0	110.2	F104 S105 V107 M122 N125 S129 I145 N148 K149 L150	F104-V127 HydrophobicContact CB-CG2 4.38Å; F104-V127 PolarHBondContact O-N 2.66Å; S105-V127 WeakPolarHBondContact O-CA 3.34Å; V107-V127 HydrophobicContact CG2-CG1 3.95Å; M122-V127 HydrophobicContact CE-CG2 4.48Å; N125-V127 HydrophobicContact CB-CG2 4.08Å; V127-S129 VanDerWaalsContact CG1-O 3.3Å; V127-S129 WeakPolarHBondContact CG1-O 3.3Å; V127-I145 HydrophobicContact CG1-CD1 4.45Å; V127-N148 HydrophobicContact CB-CB 4.25Å; V127-N148 VanDerWaalsContact CB-OD1 3.31Å; V127-N148 WeakPolarHBondContact CB-OD1 3.28Å; V127-N148 WeakPolarHBondContact CG2-OD1 3.4Å; V127-N148 PolarHBondContact N-OD1 3.34Å; V127-K149 CarbonylContact O-C 3.51Å; V127-K149 VanDerWaalsContact O-C 3.31Å; V127-K149 WeakPolarHBondContact O-CA 3.41Å; V127-K149 PolarHBondContact O-N 2.98Å; V127-L150 HydrophobicContact CG1-CD2 3.88Å; V127-L150 PolarHBondContact O-N 3.46Å
128	R	93.9	Very high	92.7	Very high	175 Å²	175	45.4 Å²	45.4	66%	0.66	23%	0.229	S	C	*	.			trans	-95	-26.4	-177.8	-61.3	-175.8	-175.5	-178.1	1	114.2	S105 C126 K149	S105-R128 PolarHBondContact O-N 3.04Å; C126-R128 PolarHBondContact O-N 3.27Å; R128-K149 HydrophobicContact CG-CB 4.41Å
129	S	92.9	Very high	92.6	Very high	70 Å²	70	45.4 Å²	45.4	49%	0.49	24%	0.235	S	C	.	.			trans	-150.2	149.4	178.5	57.4	0	0	0	0	110.9	V127	V127-S129 VanDerWaalsContact CG1-O 3.3Å; V127-S129 WeakPolarHBondContact CG1-O 3.3Å
130	L	93.1	Very high	92.6	Very high	11 Å²	11	43.2 Å²	43.2	6%	0.058	23%	0.225	C	C	.	.			trans	-99.7	116.4	170.1	-174.3	66.1	0	0	0	107.5	V107 V134 I145 L150 L153 P154 I157	V107-L130 HydrophobicContact CG2-CD1 3.91Å; L130-V134 HydrophobicContact CD1-CB 4.24Å; L130-V134 HydrophobicContact CD1-CG2 4.22Å; L130-V134 HydrophobicContact CD2-CB 4.27Å; L130-V134 HydrophobicContact CD2-CG1 4.2Å; L130-V134 HydrophobicContact CD2-CG2 4.03Å; L130-V134 HydrophobicContact CG-CB 4.07Å; L130-V134 HydrophobicContact CG-CG1 4.2Å; L130-V134 HydrophobicContact CG-CG2 4.26Å; L130-I145 HydrophobicContact CD1-CD1 4Å; L130-L150 HydrophobicContact CB-CD2 4.33Å; L130-L153 HydrophobicContact CD2-CD2 4.38Å; L130-P154 HydrophobicContact CB-CG 4.29Å; L130-P154 HydrophobicContact CD2-CG 4.3Å; L130-P154 HydrophobicContact CG-CG 4.2Å; L130-P154 WeakPolarHBondContact O-CD 3.39Å; L130-P154 VanDerWaalsContact O-CG 3.26Å; L130-P154 WeakPolarHBondContact O-CG 3.47Å; L130-I157 HydrophobicContact CD2-CD1 3.95Å
131	P	92.4	Very high	92.7	Very high	49 Å²	49	47 Å²	47	32%	0.318	24%	0.241	S	C	.	.			trans	-78.8	162.7	-175.9	32.4	-36.8	0	0	0	112.4	F112 G133 V134	F112-P131 HydrophobicContact CE1-CG 4.3Å; F112-P131 HydrophobicContact CE2-CG 3.39Å; F112-P131 HydrophobicContact CZ-CG 3.24Å; P131-G133 PolarHBondContact O-N 3.2Å; P131-V134 WeakPolarHBondContact O-CG1 3.48Å; P131-V134 PolarHBondContact O-N 3.28Å
132	D	91.8	Very high	92.9	Very high	96 Å²	96	48.8 Å²	48.8	51%	0.513	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-54.3	-24.7	-178.7	-66.7	18.2	0	0	0	114.1	V134 G135 Q156	D132-V134 PolarHBondContact O-N 3.34Å; D132-V134 VanDerWaalsContact O-N 3.09Å; D132-G135 PolarHBondContact O-N 3.39Å; D132-Q156 HydrophobicContact CB-CG 4.08Å; D132-Q156 VanDerWaalsContact CG-CD 3.44Å; D132-Q156 VanDerWaalsContact CG-NE2 3.27Å; D132-Q156 WeakPolarHBondContact O-CB 3.27Å; D132-Q156 PolarHBondContact OD1-OE1 3.43Å; D132-Q156 PolarHBondContact OD2-NE2 3.36Å
133	G	90.1	Very high	93	Very high	17 Å²	17	48.9 Å²	48.9	18%	0.175	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-56.5	-21.2	175.4	0	0	0	0	0	114.1	F112 P131 G135 Q136	F112-G133 WeakPolarHBondContact CD1-O 3.32Å; P131-G133 PolarHBondContact O-N 3.2Å; G133-G135 PolarHBondContact O-N 3.06Å; G133-G135 VanDerWaalsContact O-N 3.09Å; G133-Q136 WeakPolarHBondContact O-CB 3.22Å; G133-Q136 WeakPolarHBondContact O-CG 3.34Å; G133-Q136 PolarHBondContact O-N 2.88Å
134	V	93.4	Very high	93.2	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-54.2	-31.6	175.5	71.8	0	0	0	0	112.6	F112 L130 P131 D132 Q136 L137 P154 Q156 I157 L160	F112-V134 HydrophobicContact CE1-CB 4.16Å; L130-V134 HydrophobicContact CD1-CB 4.24Å; L130-V134 HydrophobicContact CD1-CG2 4.22Å; L130-V134 HydrophobicContact CD2-CB 4.27Å; L130-V134 HydrophobicContact CD2-CG1 4.2Å; L130-V134 HydrophobicContact CD2-CG2 4.03Å; L130-V134 HydrophobicContact CG-CB 4.07Å; L130-V134 HydrophobicContact CG-CG1 4.2Å; L130-V134 HydrophobicContact CG-CG2 4.26Å; P131-V134 WeakPolarHBondContact O-CG1 3.48Å; P131-V134 PolarHBondContact O-N 3.28Å; D132-V134 PolarHBondContact O-N 3.34Å; D132-V134 VanDerWaalsContact O-N 3.09Å; V134-Q136 PolarHBondContact O-N 2.95Å; V134-L137 PolarHBondContact O-N 2.95Å; V134-L137 VanDerWaalsContact O-N 3.12Å; V134-P154 HydrophobicContact CG1-CG 3.75Å; V134-Q156 HydrophobicContact CG1-CB 4.35Å; V134-I157 HydrophobicContact CG1-CD1 4.5Å; V134-I157 HydrophobicContact CG2-CD1 4.26Å; V134-L160 HydrophobicContact CG2-CD1 4.17Å; V134-L160 WeakPolarHBondContact O-CD2 3.5Å
135	G	91.4	Very high	93.6	Very high	10 Å²	10	47 Å²	47	10%	0.103	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-66.7	-7.6	179.4	0	0	0	0	0	115.1	D132 G133 Q156	D132-G135 PolarHBondContact O-N 3.39Å; G133-G135 PolarHBondContact O-N 3.06Å; G133-G135 VanDerWaalsContact O-N 3.09Å; G135-Q156 WeakPolarHBondContact CA-O 3.42Å
136	Q	92.1	Very high	93.6	Very high	114 Å²	114	46.8 Å²	46.8	53%	0.533	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-77.9	-22.6	174.4	-62.6	178.7	2.4	0	0	112.3	F112 G133 V134 R138	F112-Q136 PolarHBondContact O-OE1 2.87Å; G133-Q136 WeakPolarHBondContact O-CB 3.22Å; G133-Q136 WeakPolarHBondContact O-CG 3.34Å; G133-Q136 PolarHBondContact O-N 2.88Å; V134-Q136 PolarHBondContact O-N 2.95Å; Q136-R138 PolarHBondContact O-N 3.42Å
137	L	93.1	Very high	93.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.239	C	C	.	.			trans	-80.1	49.9	-177.1	-58.1	178.9	0	0	0	112.9	V111 F112 L114 L117 L120 V134 G139 L140 L160	V111-L137 WeakPolarHBondContact O-CD2 3.34Å; F112-L137 HydrophobicContact CD1-CD1 4.42Å; L114-L137 WeakPolarHBondContact O-CD2 3.33Å; L117-L137 HydrophobicContact CD1-CD2 4.29Å; L120-L137 HydrophobicContact CD2-CD1 4.13Å; V134-L137 PolarHBondContact O-N 2.95Å; V134-L137 VanDerWaalsContact O-N 3.12Å; L137-G139 PolarHBondContact O-N 3.09Å; L137-L140 HydrophobicContact CB-CB 4.24Å; L137-L140 HydrophobicContact CD1-CD2 4.47Å; L137-L140 WeakPolarHBondContact O-CB 3.46Å; L137-L140 PolarHBondContact O-N 3.15Å; L137-L160 HydrophobicContact CB-CD2 4.03Å; L137-L160 WeakPolarHBondContact O-CD2 3.3Å
138	R	91.4	Very high	93.4	Very high	180 Å²	180	48.1 Å²	48.1	68%	0.679	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.5	-170.1	-62.8	-176.5	-178.7	-175.5	0.8	115.6	Q136 T162	Q136-R138 PolarHBondContact O-N 3.42Å; R138-T162 WeakPolarHBondContact O-CG2 3.48Å; R138-T162 PolarHBondContact O-OG1 2.88Å
139	G	92.4	Very high	93.4	Very high	33 Å²	33	44.8 Å²	44.8	34%	0.34	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-2.9	175.7	0	0	0	0	0	114.3	L117 L137 K141 T162	L117-G139 CarbonylContact O-C 3.56Å; L137-G139 PolarHBondContact O-N 3.09Å; G139-K141 PolarHBondContact O-N 3.43Å; G139-T162 VanDerWaalsContact C-OG1 3.3Å
140	L	95.9	Very high	93.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.			trans	-67.6	129.5	-173.8	-158.1	74.6	0	0	0	110.7	L117 L120 L137 L143 L160 T162 L163	L117-L140 HydrophobicContact CB-CD1 3.97Å; L117-L140 WeakPolarHBondContact O-CA 3.31Å; L117-L140 PolarHBondContact O-N 2.79Å; L120-L140 HydrophobicContact CB-CD1 4.03Å; L120-L140 HydrophobicContact CB-CD2 4.48Å; L137-L140 HydrophobicContact CB-CB 4.24Å; L137-L140 HydrophobicContact CD1-CD2 4.47Å; L137-L140 WeakPolarHBondContact O-CB 3.46Å; L137-L140 PolarHBondContact O-N 3.15Å; L140-L143 HydrophobicContact CD2-CB 3.77Å; L140-L143 HydrophobicContact CD2-CD1 4.1Å; L140-L143 HydrophobicContact CD2-CD2 4.35Å; L140-L143 HydrophobicContact CD2-CG 4.29Å; L140-L160 HydrophobicContact CD2-CD1 4.36Å; L140-T162 PolarHBondContact N-OG1 3.45Å; L140-T162 CarbonylContact O-C 3.56Å; L140-T162 VanDerWaalsContact O-C 3.27Å; L140-T162 PolarHBondContact O-OG1 2.74Å; L140-L163 HydrophobicContact CB-CD1 4.41Å; L140-L163 HydrophobicContact CD2-CD1 4.17Å; L140-L163 HydrophobicContact CG-CD1 4.21Å; L140-L163 WeakPolarHBondContact O-CA 3.45Å; L140-L163 PolarHBondContact O-N 3.27Å
141	K	96.1	Very high	93.7	Very high	87 Å²	87	46.1 Å²	46.1	38%	0.378	23%	0.23	S	C	.	.			trans	-104.4	-31.5	175.3	-70.9	-177	168.7	-118.2	0	112.2	V118 G139 E164 E165	V118-K141 HydrophobicContact CG1-CB 3.9Å; V118-K141 HydrophobicContact CG1-CD 3.79Å; V118-K141 HydrophobicContact CG1-CG 3.94Å; V118-K141 PolarHBondContact O-N 2.86Å; G139-K141 PolarHBondContact O-N 3.43Å; K141-E164 IonicContact NZ-OE1 3.56Å; K141-E164 PolarHBondContact NZ-OE1 3.15Å; K141-E164 IonicContact NZ-OE2 3.2Å; K141-E164 PolarHBondContact O-N 2.78Å; K141-E165 PolarHBondContact O-N 3.37Å
142	K	96.3	Very high	93.8	Very high	58 Å²	58	48.5 Å²	48.5	25%	0.252	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.6	-178.9	-177.3	171.3	174.2	-151.9	0	111.7	V118 E119 L120 E165	V118-K142 PolarHBondContact O-N 3.44Å; E119-K142 WeakPolarHBondContact CA-O 3.46Å; E119-K142 HydrophobicContact CB-CB 4.22Å; E119-K142 HydrophobicContact CG-CB 4.02Å; E119-K142 HydrophobicContact CG-CD 4.07Å; E119-K142 HydrophobicContact CG-CG 4.12Å; E119-K142 WeakPolarHBondContact OE1-CD 3.25Å; E119-K142 WeakPolarHBondContact OE1-CE 3.49Å; E119-K142 IonicContact OE1-NZ 2.65Å; E119-K142 PolarHBondContact OE1-NZ 2.96Å; L120-K142 PolarHBondContact N-O 3.44Å; K142-E165 WeakPolarHBondContact CA-O 3.22Å; K142-E165 HydrophobicContact CB-CB 4.33Å; K142-E165 HydrophobicContact CD-CB 4.45Å; K142-E165 WeakPolarHBondContact CD-OE2 3.42Å; K142-E165 HydrophobicContact CG-CB 4.02Å
143	L	97	Very high	94	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	117.2	176.6	178.8	57.6	0	0	0	109.8	L120 L140 I157 L160 L163 E165 L166 D167	L120-L143 HydrophobicContact CB-CD1 4.08Å; L120-L143 HydrophobicContact CD2-CD1 3.93Å; L120-L143 HydrophobicContact CG-CD1 4.11Å; L120-L143 WeakPolarHBondContact O-CA 3.32Å; L140-L143 HydrophobicContact CD2-CB 3.77Å; L140-L143 HydrophobicContact CD2-CD1 4.1Å; L140-L143 HydrophobicContact CD2-CD2 4.35Å; L140-L143 HydrophobicContact CD2-CG 4.29Å; L143-I157 HydrophobicContact CD2-CD1 4.05Å; L143-L160 HydrophobicContact CD2-CD1 4.21Å; L143-L163 HydrophobicContact CB-CD1 3.95Å; L143-E165 PolarHBondContact N-O 3.14Å; L143-L166 HydrophobicContact CB-CD1 3.87Å; L143-L166 HydrophobicContact CD2-CD1 3.88Å; L143-L166 HydrophobicContact CG-CD1 3.93Å; L143-L166 WeakPolarHBondContact O-CA 3.36Å; L143-D167 PolarHBondContact O-N 2.89Å
144	C	95.5	Very high	94.2	Very high	16 Å²	16	44.6 Å²	44.6	11%	0.108	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.2	173.1	-63.2	0	0	0	0	109.4	L120 D121 M122 D167	L120-C144 PolarHBondContact O-N 3.42Å; D121-C144 HydrophobicContact CB-CB 4.22Å; M122-C144 PolarHBondContact N-O 2.96Å; C144-D167 HydrophobicContact CB-CB 4.37Å
145	I	95.4	Very high	94.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.238	C	C	.	.			trans	-135.8	27.7	176.2	-160.2	160.6	0	0	0	111.4	V107 M122 V127 L130 N148 L150 D167 I168 N171	V107-I145 HydrophobicContact CG2-CD1 4.26Å; M122-I145 HydrophobicContact CB-CG1 4.35Å; V127-I145 HydrophobicContact CG1-CD1 4.45Å; L130-I145 HydrophobicContact CD1-CD1 4Å; I145-N148 PolarHBondContact O-ND2 3.25Å; I145-L150 HydrophobicContact CB-CD1 4.47Å; I145-L150 HydrophobicContact CD1-CD1 4.01Å; I145-L150 HydrophobicContact CG1-CD1 4.01Å; I145-L150 HydrophobicContact CG2-CD1 3.68Å; I145-D167 PolarHBondContact N-O 3.33Å; I145-I168 HydrophobicContact CG2-CB 4.46Å; I145-I168 HydrophobicContact CG2-CG2 3.63Å; I145-N171 PolarHBondContact O-ND2 3.46Å; I145-N171 VanDerWaalsContact O-ND2 3.11Å
146	S	92.4	Very high	94.5	Very high	7 Å²	7	50 Å²	50	5%	0.049	25%	0.248	C	C	.	.			trans	-65.8	161.1	179.7	47.1	0	0	0	0	114.4	S123 H124 N148 D167 S169	S123-S146 CarbonylContact C-O 3.49Å; S123-S146 WeakPolarHBondContact CA-O 3.41Å; S123-S146 WeakPolarHBondContact CB-O 3.44Å; S123-S146 VanDerWaalsContact CB-OG 3.27Å; S123-S146 WeakPolarHBondContact CB-OG 3.36Å; H124-S146 PolarHBondContact N-O 3.41Å; S146-N148 PolarHBondContact O-N 2.79Å; S146-N148 PolarHBondContact O-ND2 2.63Å; S146-N148 VanDerWaalsContact O-ND2 3.16Å; S146-D167 WeakPolarHBondContact CB-OD1 3.3Å; S146-D167 WeakPolarHBondContact CB-OD2 3.26Å; S146-D167 PolarHBondContact OG-OD2 2.93Å; S146-S169 CarbonylContact C-O 3.47Å; S146-S169 WeakPolarHBondContact CA-O 3.49Å; S146-S169 WeakPolarHBondContact CB-O 3.46Å; S146-S169 WeakPolarHBondContact CB-OG 3.28Å
147	H	90.3	Very high	94.7	Very high	68 Å²	68	44.6 Å²	44.6	32%	0.315	22%	0.223	S	C	.	.	S	Bend	trans	52.9	54.9	-178.3	-67.9	-80.6	0	0	0	112.6	H124 N125 S169 F170	H124-H147 VanDerWaalsContact CA-O 3.28Å; H124-H147 WeakPolarHBondContact CA-O 3.46Å; H124-H147 HydrophobicContact CB-CB 4.34Å; H124-H147 AromaticContact CE1-CD2 3.2Å; H124-H147 PolarHBondContact CE1-CD2 3.49Å; H124-H147 AromaticContact CE1-CG 3.49Å; H124-H147 VanDerWaalsContact CE1-CG 3.49Å; H124-H147 AromaticContact CE1-NE2 3.58Å; H124-H147 PolarHBondContact N-O 2.96Å; H124-H147 AromaticContact ND1-CD2 3.79Å; H124-H147 AromaticContact ND1-CG 3.62Å; H124-H147 AromaticContact NE2-CD2 3.42Å; H124-H147 PolarHBondContact NE2-CD2 3.16Å; H124-H147 AromaticContact NE2-NE2 3.99Å; N125-H147 PolarHBondContact N-O 3.03Å; H147-S169 PolarHBondContact N-O 2.92Å; H147-F170 VanDerWaalsContact CA-O 3.26Å; H147-F170 WeakPolarHBondContact CA-O 3.28Å; H147-F170 HydrophobicContact CB-CB 4.37Å; H147-F170 AromaticContact CE1-CD1 3.65Å; H147-F170 AromaticContact CE1-CD2 3.38Å; H147-F170 WeakPolarHBondContact CE1-CD2 3.47Å; H147-F170 AromaticContact CE1-CE2 3.87Å; H147-F170 AromaticContact CE1-CG 3.27Å; H147-F170 WeakPolarHBondContact CE1-CG 3.43Å; H147-F170 PolarHBondContact N-O 3.29Å; H147-F170 WeakPolarHBondContact ND1-CB 3.44Å; H147-F170 AromaticContact ND1-CD1 3.95Å; H147-F170 AromaticContact ND1-CD2 3.99Å; H147-F170 AromaticContact ND1-CG 3.51Å; H147-F170 AromaticContact NE2-CD2 3.51Å; H147-F170 AromaticContact NE2-CE2 3.97Å; H147-F170 AromaticContact NE2-CG 3.85Å
148	N	93.8	Very high	94.8	Very high	12 Å²	12	44.8 Å²	44.8	6%	0.064	23%	0.226	C	C	.	.	S	Bend	trans	-127.6	-159.2	175.7	-85.6	-72.4	0	0	0	109.2	M122 N125 C126 V127 I145 S146 L150 F170 N171	M122-N148 PolarHBondContact O-ND2 3.45Å; N125-N148 VanDerWaalsContact CA-OD1 3.27Å; N125-N148 WeakPolarHBondContact CA-OD1 3.43Å; N125-N148 WeakPolarHBondContact CB-OD1 3.46Å; N125-N148 PolarHBondContact N-OD1 2.81Å; N125-N148 PolarHBondContact O-OD1 2.99Å; C126-N148 PolarHBondContact N-OD1 2.97Å; V127-N148 HydrophobicContact CB-CB 4.25Å; V127-N148 VanDerWaalsContact CB-OD1 3.31Å; V127-N148 WeakPolarHBondContact CB-OD1 3.28Å; V127-N148 WeakPolarHBondContact CG2-OD1 3.4Å; V127-N148 PolarHBondContact N-OD1 3.34Å; I145-N148 PolarHBondContact O-ND2 3.25Å; S146-N148 PolarHBondContact O-N 2.79Å; S146-N148 PolarHBondContact O-ND2 2.63Å; S146-N148 VanDerWaalsContact O-ND2 3.16Å; N148-L150 HydrophobicContact CB-CG 4.45Å; N148-F170 PolarHBondContact N-O 2.83Å; N148-N171 VanDerWaalsContact CA-OD1 3.31Å; N148-N171 WeakPolarHBondContact CA-OD1 3.48Å; N148-N171 WeakPolarHBondContact CB-OD1 3.48Å; N148-N171 PolarHBondContact N-OD1 2.94Å; N148-N171 PolarHBondContact O-OD1 2.95Å
149	K	95.5	Very high	94.9	Very high	104 Å²	104	37.9 Å²	37.9	45%	0.452	21%	0.207	S	C	.	.			trans	-126.8	32.7	-179.2	-60.4	-177.2	179.8	178.8	0	111.4	V127 R128 Q151 N171	V127-K149 CarbonylContact O-C 3.51Å; V127-K149 VanDerWaalsContact O-C 3.31Å; V127-K149 WeakPolarHBondContact O-CA 3.41Å; V127-K149 PolarHBondContact O-N 2.98Å; R128-K149 HydrophobicContact CG-CB 4.41Å; K149-Q151 PolarHBondContact O-N 2.96Å; K149-N171 PolarHBondContact N-OD1 3.32Å
150	L	96.2	Very high	95.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.			trans	-67.5	126.6	-178.7	-63.5	176.8	0	0	0	110.5	V127 L130 I145 N148 N171 D172 L173	V127-L150 HydrophobicContact CG1-CD2 3.88Å; V127-L150 PolarHBondContact O-N 3.46Å; L130-L150 HydrophobicContact CB-CD2 4.33Å; I145-L150 HydrophobicContact CB-CD1 4.47Å; I145-L150 HydrophobicContact CD1-CD1 4.01Å; I145-L150 HydrophobicContact CG1-CD1 4.01Å; I145-L150 HydrophobicContact CG2-CD1 3.68Å; N148-L150 HydrophobicContact CB-CG 4.45Å; L150-N171 HydrophobicContact CB-CB 4.12Å; L150-N171 VanDerWaalsContact CB-OD1 3.32Å; L150-N171 WeakPolarHBondContact CB-OD1 3.35Å; L150-N171 WeakPolarHBondContact CG-OD1 3.31Å; L150-N171 PolarHBondContact N-OD1 2.81Å; L150-D172 CarbonylContact O-C 3.58Å; L150-D172 VanDerWaalsContact O-CA 3.24Å; L150-D172 WeakPolarHBondContact O-CA 3.47Å; L150-D172 WeakPolarHBondContact O-CB 3.47Å; L150-D172 PolarHBondContact O-N 3.01Å; L150-L173 HydrophobicContact CB-CD2 4.05Å; L150-L173 PolarHBondContact O-N 3.45Å
151	Q	94.8	Very high	95	Very high	109 Å²	109	42.1 Å²	42.1	51%	0.509	22%	0.218	S	C	.	.			trans	-96.3	-29.7	176	-64.8	-179.8	11.4	0	0	113.1	K149 D172 L173 H174	K149-Q151 PolarHBondContact O-N 2.96Å; Q151-D172 HydrophobicContact CG-CB 4.2Å; Q151-L173 WeakPolarHBondContact O-CA 3.34Å; Q151-H174 PolarHBondContact O-N 3.33Å
152	N	94.9	Very high	95	Very high	100 Å²	100	39.9 Å²	39.9	54%	0.535	21%	0.212	S	C	.	.			trans	-147.2	155.8	179.9	-61.2	-66.7	0	0	0	110.3
153	L	95.9	Very high	95.1	Very high	15 Å²	15	37.1 Å²	37.1	8%	0.079	20%	0.2	C	C	.	.			trans	-97.6	140.4	167.3	-62.2	176.2	0	0	0	110.5	L130 I168 L173 F176 P177 F180	L130-L153 HydrophobicContact CD2-CD2 4.38Å; L153-I168 HydrophobicContact CD1-CD1 4.18Å; L153-I168 HydrophobicContact CD2-CG2 4.45Å; L153-L173 HydrophobicContact CD2-CD2 4.37Å; L153-L173 HydrophobicContact CG-CD1 4.34Å; L153-L173 HydrophobicContact CG-CD2 4.12Å; L153-F176 HydrophobicContact CD1-CD1 4.19Å; L153-F176 HydrophobicContact CD1-CE1 4.29Å; L153-P177 HydrophobicContact CB-CG 4.13Å; L153-F180 HydrophobicContact CD1-CD2 4.44Å; L153-F180 HydrophobicContact CD1-CE2 4.22Å
154	P	95.3	Very high	95.1	Very high	15 Å²	15	39.6 Å²	39.6	10%	0.097	21%	0.211	C	C	.	.			trans	-70.7	153.8	176.1	32.1	-37.3	0	0	0	110.9	L130 V134 Q156 I157	L130-P154 HydrophobicContact CB-CG 4.29Å; L130-P154 HydrophobicContact CD2-CG 4.3Å; L130-P154 HydrophobicContact CG-CG 4.2Å; L130-P154 WeakPolarHBondContact O-CD 3.39Å; L130-P154 VanDerWaalsContact O-CG 3.26Å; L130-P154 WeakPolarHBondContact O-CG 3.47Å; V134-P154 HydrophobicContact CG1-CG 3.75Å; P154-Q156 PolarHBondContact O-N 2.83Å; P154-Q156 VanDerWaalsContact O-N 3.16Å; P154-I157 WeakPolarHBondContact O-CB 3.35Å; P154-I157 VanDerWaalsContact O-CG2 3.23Å; P154-I157 WeakPolarHBondContact O-CG2 3.39Å; P154-I157 PolarHBondContact O-N 2.95Å; P154-I157 VanDerWaalsContact O-N 3.13Å
155	A	95	Very high	95.2	Very high	57 Å²	57	40.6 Å²	40.6	47%	0.471	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-61	-27.6	178.3	0	0	0	0	0	112.4	I157 G158 S179	A155-I157 PolarHBondContact O-N 3.48Å; A155-I157 VanDerWaalsContact O-N 3.16Å; A155-G158 PolarHBondContact O-N 3Å; A155-S179 VanDerWaalsContact C-OG 3.32Å; A155-S179 WeakPolarHBondContact CA-OG 3.36Å; A155-S179 WeakPolarHBondContact O-CB 3.31Å; A155-S179 PolarHBondContact O-OG 3.36Å
156	Q	95.9	Very high	95.3	Very high	67 Å²	67	40.7 Å²	40.7	31%	0.313	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-67.2	-11.9	-179.9	-67.8	79.8	-2.8	0	0	113.2	D132 V134 G135 P154 G158 A159	D132-Q156 HydrophobicContact CB-CG 4.08Å; D132-Q156 VanDerWaalsContact CG-CD 3.44Å; D132-Q156 VanDerWaalsContact CG-NE2 3.27Å; D132-Q156 WeakPolarHBondContact O-CB 3.27Å; D132-Q156 PolarHBondContact OD1-OE1 3.43Å; D132-Q156 PolarHBondContact OD2-NE2 3.36Å; V134-Q156 HydrophobicContact CG1-CB 4.35Å; G135-Q156 WeakPolarHBondContact CA-O 3.42Å; P154-Q156 PolarHBondContact O-N 2.83Å; P154-Q156 VanDerWaalsContact O-N 3.16Å; Q156-G158 PolarHBondContact O-N 3.44Å; Q156-A159 VanDerWaalsContact O-CB 3.27Å; Q156-A159 WeakPolarHBondContact O-CB 3.41Å; Q156-A159 PolarHBondContact O-N 2.93Å
157	I	95.9	Very high	95.4	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-56.1	-33.3	170.5	-161	72.4	0	0	0	111.5	L130 V134 L143 P154 A155 A159 L160 P177 F180 L183	L130-I157 HydrophobicContact CD2-CD1 3.95Å; V134-I157 HydrophobicContact CG1-CD1 4.5Å; V134-I157 HydrophobicContact CG2-CD1 4.26Å; L143-I157 HydrophobicContact CD2-CD1 4.05Å; P154-I157 WeakPolarHBondContact O-CB 3.35Å; P154-I157 VanDerWaalsContact O-CG2 3.23Å; P154-I157 WeakPolarHBondContact O-CG2 3.39Å; P154-I157 PolarHBondContact O-N 2.95Å; P154-I157 VanDerWaalsContact O-N 3.13Å; A155-I157 PolarHBondContact O-N 3.48Å; A155-I157 VanDerWaalsContact O-N 3.16Å; I157-A159 PolarHBondContact O-N 3.42Å; I157-A159 VanDerWaalsContact O-N 3.13Å; I157-L160 HydrophobicContact CD1-CD1 3.67Å; I157-L160 HydrophobicContact CG1-CD1 4.4Å; I157-L160 WeakPolarHBondContact O-CB 3.35Å; I157-L160 WeakPolarHBondContact O-CG 3.47Å; I157-L160 PolarHBondContact O-N 3.08Å; I157-L160 VanDerWaalsContact O-N 3.12Å; I157-P177 HydrophobicContact CG2-CG 3.76Å; I157-F180 HydrophobicContact CG2-CD2 4.11Å; I157-L183 WeakPolarHBondContact O-CD2 3.49Å
158	G	94.1	Very high	95.8	Very high	6 Å²	6	38.7 Å²	38.7	6%	0.062	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-67	-10.2	177.5	0	0	0	0	0	114.7	A155 Q156 L160 S179 S182	A155-G158 PolarHBondContact O-N 3Å; Q156-G158 PolarHBondContact O-N 3.44Å; G158-L160 VanDerWaalsContact C-N 3.26Å; G158-S179 WeakPolarHBondContact CA-O 3.33Å; G158-S182 WeakPolarHBondContact O-CB 3.25Å
159	A	95.5	Very high	95.7	Very high	35 Å²	35	38.3 Å²	38.3	29%	0.289	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-75.9	-14.6	173.2	0	0	0	0	0	112.9	Q156 I157 Q161	Q156-A159 VanDerWaalsContact O-CB 3.27Å; Q156-A159 WeakPolarHBondContact O-CB 3.41Å; Q156-A159 PolarHBondContact O-N 2.93Å; I157-A159 PolarHBondContact O-N 3.42Å; I157-A159 VanDerWaalsContact O-N 3.13Å; A159-Q161 PolarHBondContact O-N 3.31Å
160	L	95.8	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.			trans	-79.2	56.2	179.7	-54.6	-177.3	0	0	0	112	V134 L137 L140 L143 I157 G158 T162 L163 L183	V134-L160 HydrophobicContact CG2-CD1 4.17Å; V134-L160 WeakPolarHBondContact O-CD2 3.5Å; L137-L160 HydrophobicContact CB-CD2 4.03Å; L137-L160 WeakPolarHBondContact O-CD2 3.3Å; L140-L160 HydrophobicContact CD2-CD1 4.36Å; L143-L160 HydrophobicContact CD2-CD1 4.21Å; I157-L160 HydrophobicContact CD1-CD1 3.67Å; I157-L160 HydrophobicContact CG1-CD1 4.4Å; I157-L160 WeakPolarHBondContact O-CB 3.35Å; I157-L160 WeakPolarHBondContact O-CG 3.47Å; I157-L160 PolarHBondContact O-N 3.08Å; I157-L160 VanDerWaalsContact O-N 3.12Å; G158-L160 VanDerWaalsContact C-N 3.26Å; L160-T162 PolarHBondContact O-N 3.03Å; L160-L163 HydrophobicContact CB-CB 4.11Å; L160-L163 HydrophobicContact CB-CD2 4.47Å; L160-L163 HydrophobicContact CD1-CD2 4.28Å; L160-L163 WeakPolarHBondContact O-CB 3.5Å; L160-L163 PolarHBondContact O-N 2.84Å; L160-L183 HydrophobicContact CB-CD2 4.06Å; L160-L183 WeakPolarHBondContact O-CD2 3.45Å
161	Q	94.4	Very high	95.6	Very high	121 Å²	121	36.4 Å²	36.4	57%	0.565	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.9	-172.2	-64	178.5	-6.2	0	0	114.5	A159	A159-Q161 PolarHBondContact O-N 3.31Å
162	T	95.8	Very high	95.6	Very high	40 Å²	40	33.4 Å²	33.4	25%	0.245	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-3.1	173.9	56.6	0	0	0	0	113.7	R138 G139 L140 L160 E164	R138-T162 WeakPolarHBondContact O-CG2 3.48Å; R138-T162 PolarHBondContact O-OG1 2.88Å; G139-T162 VanDerWaalsContact C-OG1 3.3Å; L140-T162 PolarHBondContact N-OG1 3.45Å; L140-T162 CarbonylContact O-C 3.56Å; L140-T162 VanDerWaalsContact O-C 3.27Å; L140-T162 PolarHBondContact O-OG1 2.74Å; L160-T162 PolarHBondContact O-N 3.03Å; T162-E164 PolarHBondContact O-N 3.38Å
163	L	97.2	Very high	95.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.			trans	-67.3	125.1	-175.1	-159.8	72.8	0	0	0	110.3	L140 L143 L160 L166 L183 K185 L186	L140-L163 HydrophobicContact CB-CD1 4.41Å; L140-L163 HydrophobicContact CD2-CD1 4.17Å; L140-L163 HydrophobicContact CG-CD1 4.21Å; L140-L163 WeakPolarHBondContact O-CA 3.45Å; L140-L163 PolarHBondContact O-N 3.27Å; L143-L163 HydrophobicContact CB-CD1 3.95Å; L160-L163 HydrophobicContact CB-CB 4.11Å; L160-L163 HydrophobicContact CB-CD2 4.47Å; L160-L163 HydrophobicContact CD1-CD2 4.28Å; L160-L163 WeakPolarHBondContact O-CB 3.5Å; L160-L163 PolarHBondContact O-N 2.84Å; L163-L166 HydrophobicContact CD2-CB 3.91Å; L163-L166 HydrophobicContact CD2-CD1 4.19Å; L163-L166 HydrophobicContact CD2-CD2 4.21Å; L163-L166 HydrophobicContact CD2-CG 4.33Å; L163-L183 HydrophobicContact CB-CD2 4.45Å; L163-L183 HydrophobicContact CD2-CD1 4.44Å; L163-K185 CarbonylContact O-C 3.32Å; L163-K185 VanDerWaalsContact O-C 3.24Å; L163-L186 HydrophobicContact CB-CD1 4.35Å; L163-L186 HydrophobicContact CD2-CD1 4.05Å; L163-L186 HydrophobicContact CG-CD1 4Å; L163-L186 WeakPolarHBondContact O-CA 3.49Å; L163-L186 PolarHBondContact O-N 3.11Å
164	E	96.9	Very high	95.6	Very high	56 Å²	56	31.4 Å²	31.4	26%	0.262	17%	0.17	S	C	.	.			trans	-107.7	-33.3	-179.4	-70.1	169.8	-158.8	0	0	110.6	K141 T162 R187 T188	K141-E164 IonicContact NZ-OE1 3.56Å; K141-E164 PolarHBondContact NZ-OE1 3.15Å; K141-E164 IonicContact NZ-OE2 3.2Å; K141-E164 PolarHBondContact O-N 2.78Å; T162-E164 PolarHBondContact O-N 3.38Å; E164-R187 PolarHBondContact O-N 3.46Å; E164-T188 PolarHBondContact O-N 3.04Å
165	E	97.4	Very high	95.6	Very high	37 Å²	37	33.2 Å²	33.2	17%	0.173	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.5	-177.9	-59.7	-178.6	-172.9	0	0	110.9	R43 K141 K142 L143 T188	R43-E165 IonicContact NH1-OE1 3.92Å; R43-E165 PolarHBondContact NH1-OE1 3.5Å; K141-E165 PolarHBondContact O-N 3.37Å; K142-E165 WeakPolarHBondContact CA-O 3.22Å; K142-E165 HydrophobicContact CB-CB 4.33Å; K142-E165 HydrophobicContact CD-CB 4.45Å; K142-E165 WeakPolarHBondContact CD-OE2 3.42Å; K142-E165 HydrophobicContact CG-CB 4.02Å; L143-E165 PolarHBondContact N-O 3.14Å; E165-T188 WeakPolarHBondContact CA-O 3.41Å
166	L	97.8	Very high	95.7	Very high	4 Å²	4	31 Å²	31	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119.6	178.2	178.5	59.4	0	0	0	110.6	L143 L163 I168 F180 L186 T188 L189 D190	L143-L166 HydrophobicContact CB-CD1 3.87Å; L143-L166 HydrophobicContact CD2-CD1 3.88Å; L143-L166 HydrophobicContact CG-CD1 3.93Å; L143-L166 WeakPolarHBondContact O-CA 3.36Å; L163-L166 HydrophobicContact CD2-CB 3.91Å; L163-L166 HydrophobicContact CD2-CD1 4.19Å; L163-L166 HydrophobicContact CD2-CD2 4.21Å; L163-L166 HydrophobicContact CD2-CG 4.33Å; L166-I168 HydrophobicContact CD1-CG2 3.76Å; L166-I168 HydrophobicContact CD2-CG2 4.47Å; L166-I168 HydrophobicContact CG-CG2 4.05Å; L166-F180 HydrophobicContact CD2-CE2 3.64Å; L166-F180 HydrophobicContact CD2-CZ 3.82Å; L166-L186 HydrophobicContact CB-CD1 3.83Å; L166-L186 HydrophobicContact CB-CD2 4.45Å; L166-T188 PolarHBondContact N-O 2.7Å; L166-L189 HydrophobicContact CB-CD1 4.1Å; L166-L189 HydrophobicContact CD2-CD1 3.96Å; L166-L189 HydrophobicContact CG-CD1 4.04Å; L166-L189 WeakPolarHBondContact O-CA 3.27Å; L166-D190 PolarHBondContact O-N 3.13Å
167	D	96.1	Very high	95.7	Very high	32 Å²	32	28.9 Å²	28.9	17%	0.171	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	112.5	172.9	176	17.5	0	0	0	110.4	L143 C144 I145 S146 S169 D190	L143-D167 PolarHBondContact O-N 2.89Å; C144-D167 HydrophobicContact CB-CB 4.37Å; I145-D167 PolarHBondContact N-O 3.33Å; S146-D167 WeakPolarHBondContact CB-OD1 3.3Å; S146-D167 WeakPolarHBondContact CB-OD2 3.26Å; S146-D167 PolarHBondContact OG-OD2 2.93Å; D167-S169 VanDerWaalsContact OD1-CB 3.29Å; D167-S169 WeakPolarHBondContact OD1-CB 3.46Å; D167-S169 PolarHBondContact OD1-N 3.47Å; D167-S169 PolarHBondContact OD1-OG 3.47Å; D167-D190 HydrophobicContact CB-CB 4.31Å
168	I	96.7	Very high	95.6	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.19	C	C	.	.			trans	-124.4	19.9	178.6	51.2	164.2	0	0	0	111	I145 L153 L166 N171 L173 F176 L189 D190 A191 N194	I145-I168 HydrophobicContact CG2-CB 4.46Å; I145-I168 HydrophobicContact CG2-CG2 3.63Å; L153-I168 HydrophobicContact CD1-CD1 4.18Å; L153-I168 HydrophobicContact CD2-CG2 4.45Å; L166-I168 HydrophobicContact CD1-CG2 3.76Å; L166-I168 HydrophobicContact CD2-CG2 4.47Å; L166-I168 HydrophobicContact CG-CG2 4.05Å; I168-N171 PolarHBondContact O-ND2 3.09Å; I168-N171 VanDerWaalsContact O-ND2 3.08Å; I168-L173 HydrophobicContact CB-CD1 4.1Å; I168-L173 HydrophobicContact CD1-CD1 3.47Å; I168-L173 VanDerWaalsContact CD1-CD1 3.47Å; I168-L173 HydrophobicContact CG1-CD1 4.21Å; I168-F176 HydrophobicContact CD1-CE1 3.63Å; I168-F176 HydrophobicContact CD1-CZ 3.61Å; I168-L189 HydrophobicContact CD1-CD1 4.4Å; I168-L189 HydrophobicContact CG1-CD1 4.39Å; I168-D190 WeakPolarHBondContact CG1-O 3.12Å; I168-D190 PolarHBondContact N-O 3.18Å; I168-A191 HydrophobicContact CD1-CB 3.76Å; I168-A191 HydrophobicContact CG1-CB 3.78Å; I168-N194 PolarHBondContact O-ND2 2.96Å
169	S	93.1	Very high	95.7	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.028	20%	0.197	C	C	.	.			trans	-60.1	159.1	-179.9	55.4	0	0	0	0	114.1	S146 H147 D167 N171 D190 D192	S146-S169 CarbonylContact C-O 3.47Å; S146-S169 WeakPolarHBondContact CA-O 3.49Å; S146-S169 WeakPolarHBondContact CB-O 3.46Å; S146-S169 WeakPolarHBondContact CB-OG 3.28Å; H147-S169 PolarHBondContact N-O 2.92Å; D167-S169 VanDerWaalsContact OD1-CB 3.29Å; D167-S169 WeakPolarHBondContact OD1-CB 3.46Å; D167-S169 PolarHBondContact OD1-N 3.47Å; D167-S169 PolarHBondContact OD1-OG 3.47Å; S169-N171 PolarHBondContact O-N 3.32Å; S169-N171 PolarHBondContact O-ND2 2.95Å; S169-N171 VanDerWaalsContact O-ND2 3.09Å; S169-D190 PolarHBondContact N-O 3.29Å; S169-D192 CarbonylContact C-O 3.55Å; S169-D192 VanDerWaalsContact CA-O 3.25Å; S169-D192 WeakPolarHBondContact CA-O 3.21Å; S169-D192 WeakPolarHBondContact CB-OD1 3.38Å
170	F	92.9	Very high	95.7	Very high	58 Å²	58	38.6 Å²	38.6	25%	0.254	18%	0.183	S	C	.	.	S	Bend	trans	50.9	55.2	177.1	-67.5	-89.5	0	0	0	112.7	H147 N148 D192 H193	H147-F170 VanDerWaalsContact CA-O 3.26Å; H147-F170 WeakPolarHBondContact CA-O 3.28Å; H147-F170 HydrophobicContact CB-CB 4.37Å; H147-F170 AromaticContact CE1-CD1 3.65Å; H147-F170 AromaticContact CE1-CD2 3.38Å; H147-F170 WeakPolarHBondContact CE1-CD2 3.47Å; H147-F170 AromaticContact CE1-CE2 3.87Å; H147-F170 AromaticContact CE1-CG 3.27Å; H147-F170 WeakPolarHBondContact CE1-CG 3.43Å; H147-F170 PolarHBondContact N-O 3.29Å; H147-F170 WeakPolarHBondContact ND1-CB 3.44Å; H147-F170 AromaticContact ND1-CD1 3.95Å; H147-F170 AromaticContact ND1-CD2 3.99Å; H147-F170 AromaticContact ND1-CG 3.51Å; H147-F170 AromaticContact NE2-CD2 3.51Å; H147-F170 AromaticContact NE2-CE2 3.97Å; H147-F170 AromaticContact NE2-CG 3.85Å; N148-F170 PolarHBondContact N-O 2.83Å; F170-D192 PolarHBondContact N-O 3.38Å; F170-H193 WeakPolarHBondContact CA-O 3.47Å; F170-H193 HydrophobicContact CD1-CB 3.56Å; F170-H193 AromaticContact CD1-CG 3.88Å; F170-H193 HydrophobicContact CD2-CB 4.29Å; F170-H193 HydrophobicContact CE1-CB 3.65Å; F170-H193 AromaticContact CE1-CD2 3.7Å; F170-H193 AromaticContact CE1-CG 3.39Å; F170-H193 AromaticContact CE1-ND1 3.67Å; F170-H193 HydrophobicContact CE2-CB 4.35Å; F170-H193 AromaticContact CE2-ND1 3.83Å; F170-H193 HydrophobicContact CG-CB 3.89Å; F170-H193 HydrophobicContact CZ-CB 4.05Å; F170-H193 AromaticContact CZ-CE1 3.73Å; F170-H193 AromaticContact CZ-CG 3.58Å; F170-H193 AromaticContact CZ-ND1 3.31Å; F170-H193 VanDerWaalsContact CZ-ND1 3.31Å; F170-H193 WeakPolarHBondContact CZ-ND1 3.46Å
171	N	95.4	Very high	95.7	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.032	20%	0.2	C	C	.	.	S	Bend	trans	-127.5	-168.7	173.9	-84.9	-74.9	0	0	0	109.4	I145 N148 K149 L150 I168 S169 L173 H193 N194	I145-N171 PolarHBondContact O-ND2 3.46Å; I145-N171 VanDerWaalsContact O-ND2 3.11Å; N148-N171 VanDerWaalsContact CA-OD1 3.31Å; N148-N171 WeakPolarHBondContact CA-OD1 3.48Å; N148-N171 WeakPolarHBondContact CB-OD1 3.48Å; N148-N171 PolarHBondContact N-OD1 2.94Å; N148-N171 PolarHBondContact O-OD1 2.95Å; K149-N171 PolarHBondContact N-OD1 3.32Å; L150-N171 HydrophobicContact CB-CB 4.12Å; L150-N171 VanDerWaalsContact CB-OD1 3.32Å; L150-N171 WeakPolarHBondContact CB-OD1 3.35Å; L150-N171 WeakPolarHBondContact CG-OD1 3.31Å; L150-N171 PolarHBondContact N-OD1 2.81Å; I168-N171 PolarHBondContact O-ND2 3.09Å; I168-N171 VanDerWaalsContact O-ND2 3.08Å; S169-N171 PolarHBondContact O-N 3.32Å; S169-N171 PolarHBondContact O-ND2 2.95Å; S169-N171 VanDerWaalsContact O-ND2 3.09Å; N171-L173 HydrophobicContact CB-CG 4.28Å; N171-H193 PolarHBondContact N-O 2.93Å; N171-H193 VanDerWaalsContact O-O 3.13Å; N171-N194 WeakPolarHBondContact CA-OD1 3.47Å; N171-N194 WeakPolarHBondContact CB-OD1 3.31Å; N171-N194 PolarHBondContact O-OD1 2.87Å
172	D	96.5	Very high	95.8	Very high	47 Å²	47	37.7 Å²	37.7	25%	0.251	19%	0.188	S	C	.	.			trans	-112.6	28	-179.6	-70.6	-49	0	0	0	112	L150 Q151 H174 N194 K195	L150-D172 CarbonylContact O-C 3.58Å; L150-D172 VanDerWaalsContact O-CA 3.24Å; L150-D172 WeakPolarHBondContact O-CA 3.47Å; L150-D172 WeakPolarHBondContact O-CB 3.47Å; L150-D172 PolarHBondContact O-N 3.01Å; Q151-D172 HydrophobicContact CG-CB 4.2Å; D172-H174 PolarHBondContact O-CD2 3.06Å; D172-N194 PolarHBondContact N-OD1 3.16Å; D172-K195 HydrophobicContact CB-CD 4.26Å; D172-K195 WeakPolarHBondContact OD1-CE 3.47Å; D172-K195 IonicContact OD1-NZ 2.76Å; D172-K195 PolarHBondContact OD1-NZ 2.91Å; D172-K195 IonicContact OD2-NZ 3.82Å
173	L	96.8	Very high	95.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.			trans	-66.8	137	-172.4	-63.7	174.7	0	0	0	112.7	L150 Q151 L153 I168 N171 N194 K195 L196	L150-L173 HydrophobicContact CB-CD2 4.05Å; L150-L173 PolarHBondContact O-N 3.45Å; Q151-L173 WeakPolarHBondContact O-CA 3.34Å; L153-L173 HydrophobicContact CD2-CD2 4.37Å; L153-L173 HydrophobicContact CG-CD1 4.34Å; L153-L173 HydrophobicContact CG-CD2 4.12Å; I168-L173 HydrophobicContact CB-CD1 4.1Å; I168-L173 HydrophobicContact CD1-CD1 3.47Å; I168-L173 VanDerWaalsContact CD1-CD1 3.47Å; I168-L173 HydrophobicContact CG1-CD1 4.21Å; N171-L173 HydrophobicContact CB-CG 4.28Å; L173-N194 HydrophobicContact CB-CB 4.19Å; L173-N194 VanDerWaalsContact CB-OD1 3.25Å; L173-N194 WeakPolarHBondContact CB-OD1 3.34Å; L173-N194 WeakPolarHBondContact CG-OD1 3.42Å; L173-N194 PolarHBondContact N-OD1 3.02Å; L173-K195 CarbonylContact O-C 3.42Å; L173-K195 WeakPolarHBondContact O-CA 3.16Å; L173-K195 WeakPolarHBondContact O-CB 3.5Å; L173-K195 PolarHBondContact O-N 3.33Å; L173-L196 PolarHBondContact O-N 2.88Å
174	H	94.1	Very high	95.5	Very high	72 Å²	72	39.4 Å²	39.4	33%	0.333	20%	0.201	S	C	.	.			trans	-105.6	-30.6	-178.4	-72.7	-65.7	0	0	0	115.2	Q151 D172 K195	Q151-H174 PolarHBondContact O-N 3.33Å; D172-H174 PolarHBondContact O-CD2 3.06Å; H174-K195 PolarHBondContact ND1-O 3.38Å
175	D	95	Very high	95.4	Very high	53 Å²	53	41.9 Å²	41.9	28%	0.283	21%	0.21	S	C	.	.			trans	-158.7	169.2	178.9	-102.4	-35.6	0	0	0	109.3	R198	D175-R198 IonicContact OD1-NE 3.72Å; D175-R198 PolarHBondContact OD1-NE 2.89Å; D175-R198 IonicContact OD2-CZ 2.84Å; D175-R198 IonicContact OD2-NE 3.77Å; D175-R198 PolarHBondContact OD2-NE 3.18Å; D175-R198 IonicContact OD2-NH2 3.6Å; D175-R198 PolarHBondContact OD2-NH2 2.86Å
176	F	96.1	Very high	95.4	Very high	11 Å²	11	40.1 Å²	40.1	5%	0.048	20%	0.202	C	C	.	.			trans	-102.5	145	173	-74.6	-105.7	0	0	0	110.9	L153 I168 F180 L189 A191 L196 P200 I203	L153-F176 HydrophobicContact CD1-CD1 4.19Å; L153-F176 HydrophobicContact CD1-CE1 4.29Å; I168-F176 HydrophobicContact CD1-CE1 3.63Å; I168-F176 HydrophobicContact CD1-CZ 3.61Å; F176-F180 HydrophobicContact CB-CB 4.41Å; F176-F180 HydrophobicContact CB-CG 4.4Å; F176-F180 AromaticContact CD1-CD1 3.73Å; F176-F180 HydrophobicContact CD1-CD1 3.73Å; F176-F180 AromaticContact CD1-CD2 3.63Å; F176-F180 HydrophobicContact CD1-CD2 3.63Å; F176-F180 AromaticContact CD1-CE1 3.65Å; F176-F180 HydrophobicContact CD1-CE1 3.65Å; F176-F180 AromaticContact CD1-CE2 3.55Å; F176-F180 HydrophobicContact CD1-CE2 3.55Å; F176-F180 AromaticContact CD1-CG 3.71Å; F176-F180 HydrophobicContact CD1-CG 3.71Å; F176-F180 AromaticContact CD1-CZ 3.57Å; F176-F180 HydrophobicContact CD1-CZ 3.57Å; F176-F180 HydrophobicContact CE1-CD1 4.32Å; F176-F180 HydrophobicContact CE1-CD2 4.25Å; F176-F180 AromaticContact CE1-CE1 3.76Å; F176-F180 HydrophobicContact CE1-CE1 3.76Å; F176-F180 AromaticContact CE1-CE2 3.68Å; F176-F180 HydrophobicContact CE1-CE2 3.68Å; F176-F180 AromaticContact CE1-CZ 3.41Å; F176-F180 HydrophobicContact CE1-CZ 3.41Å; F176-F180 VanDerWaalsContact CE1-CZ 3.41Å; F176-L189 HydrophobicContact CE1-CD2 4.49Å; F176-A191 HydrophobicContact CZ-CB 3.98Å; F176-L196 HydrophobicContact CD2-CD2 4.03Å; F176-L196 HydrophobicContact CE2-CD1 3.73Å; F176-L196 HydrophobicContact CE2-CD2 3.84Å; F176-L196 HydrophobicContact CE2-CG 4.44Å; F176-P200 HydrophobicContact CB-CB 4.3Å; F176-P200 HydrophobicContact CD2-CB 3.52Å; F176-P200 HydrophobicContact CD2-CG 3.43Å; F176-P200 VanDerWaalsContact CD2-CG 3.43Å; F176-P200 HydrophobicContact CE2-CB 4.13Å; F176-P200 HydrophobicContact CE2-CG 3.57Å; F176-P200 HydrophobicContact CG-CB 4.12Å; F176-P200 HydrophobicContact CG-CG 4.45Å; F176-I203 HydrophobicContact CE2-CD1 4.46Å; F176-I203 HydrophobicContact CZ-CD1 4.48Å
177	P	95.6	Very high	95.4	Very high	22 Å²	22	44.2 Å²	44.2	14%	0.143	22%	0.218	C	C	.	.			trans	-71.9	147.9	176.6	29.2	-33.8	0	0	0	110.8	L153 I157 S179 F180	L153-P177 HydrophobicContact CB-CG 4.13Å; I157-P177 HydrophobicContact CG2-CG 3.76Å; P177-S179 PolarHBondContact O-N 3.43Å; P177-F180 HydrophobicContact CG-CB 4.4Å; P177-F180 WeakPolarHBondContact O-CB 3.49Å; P177-F180 PolarHBondContact O-N 3.22Å
178	R	95.3	Very high	95.4	Very high	216 Å²	216	43.3 Å²	43.3	82%	0.815	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-53.7	-33.7	-179.7	-68.9	-175.2	179.3	177.7	0.1	114.1	F180 T181	R178-F180 PolarHBondContact O-N 3.44Å; R178-T181 WeakPolarHBondContact O-CG2 3.24Å; R178-T181 PolarHBondContact O-N 3.27Å; R178-T181 PolarHBondContact O-OG1 3.25Å
179	S	95.4	Very high	95.5	Very high	30 Å²	30	43.3 Å²	43.3	21%	0.21	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-66	-13.6	177.7	53.9	0	0	0	0	113.7	A155 G158 P177 T181 S182	A155-S179 VanDerWaalsContact C-OG 3.32Å; A155-S179 WeakPolarHBondContact CA-OG 3.36Å; A155-S179 WeakPolarHBondContact O-CB 3.31Å; A155-S179 PolarHBondContact O-OG 3.36Å; G158-S179 WeakPolarHBondContact CA-O 3.33Å; P177-S179 PolarHBondContact O-N 3.43Å; S179-T181 PolarHBondContact O-N 2.96Å; S179-S182 VanDerWaalsContact O-CB 3.27Å; S179-S182 WeakPolarHBondContact O-CB 3.44Å; S179-S182 PolarHBondContact O-N 3.07Å; S179-S182 PolarHBondContact O-OG 2.78Å
180	F	96.1	Very high	95.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-58.8	-26.4	174.8	-160.1	-97.6	0	0	0	112.4	L153 I157 L166 F176 P177 R178 S182 L183 L186 L189 E202 I203 L206	L153-F180 HydrophobicContact CD1-CD2 4.44Å; L153-F180 HydrophobicContact CD1-CE2 4.22Å; I157-F180 HydrophobicContact CG2-CD2 4.11Å; L166-F180 HydrophobicContact CD2-CE2 3.64Å; L166-F180 HydrophobicContact CD2-CZ 3.82Å; F176-F180 HydrophobicContact CB-CB 4.41Å; F176-F180 HydrophobicContact CB-CG 4.4Å; F176-F180 AromaticContact CD1-CD1 3.73Å; F176-F180 HydrophobicContact CD1-CD1 3.73Å; F176-F180 AromaticContact CD1-CD2 3.63Å; F176-F180 HydrophobicContact CD1-CD2 3.63Å; F176-F180 AromaticContact CD1-CE1 3.65Å; F176-F180 HydrophobicContact CD1-CE1 3.65Å; F176-F180 AromaticContact CD1-CE2 3.55Å; F176-F180 HydrophobicContact CD1-CE2 3.55Å; F176-F180 AromaticContact CD1-CG 3.71Å; F176-F180 HydrophobicContact CD1-CG 3.71Å; F176-F180 AromaticContact CD1-CZ 3.57Å; F176-F180 HydrophobicContact CD1-CZ 3.57Å; F176-F180 HydrophobicContact CE1-CD1 4.32Å; F176-F180 HydrophobicContact CE1-CD2 4.25Å; F176-F180 AromaticContact CE1-CE1 3.76Å; F176-F180 HydrophobicContact CE1-CE1 3.76Å; F176-F180 AromaticContact CE1-CE2 3.68Å; F176-F180 HydrophobicContact CE1-CE2 3.68Å; F176-F180 AromaticContact CE1-CZ 3.41Å; F176-F180 HydrophobicContact CE1-CZ 3.41Å; F176-F180 VanDerWaalsContact CE1-CZ 3.41Å; P177-F180 HydrophobicContact CG-CB 4.4Å; P177-F180 WeakPolarHBondContact O-CB 3.49Å; P177-F180 PolarHBondContact O-N 3.22Å; R178-F180 PolarHBondContact O-N 3.44Å; F180-S182 PolarHBondContact O-N 3.17Å; F180-S182 VanDerWaalsContact O-N 3.08Å; F180-L183 HydrophobicContact CD2-CD1 3.7Å; F180-L183 HydrophobicContact CE1-CD1 4.4Å; F180-L183 HydrophobicContact CE2-CD1 3.56Å; F180-L183 HydrophobicContact CG-CD1 4.19Å; F180-L183 HydrophobicContact CZ-CD1 3.94Å; F180-L183 PolarHBondContact O-N 3.18Å; F180-L186 HydrophobicContact CZ-CD2 4.32Å; F180-L189 HydrophobicContact CE1-CD2 3.89Å; F180-L189 HydrophobicContact CZ-CD1 4.07Å; F180-L189 HydrophobicContact CZ-CD2 3.95Å; F180-E202 HydrophobicContact CB-CB 4.21Å; F180-E202 HydrophobicContact CD1-CB 4.44Å; F180-I203 HydrophobicContact CE1-CG1 4.34Å; F180-L206 HydrophobicContact CD1-CD1 4.23Å; F180-L206 HydrophobicContact CE1-CD1 3.8Å
181	T	95.6	Very high	95.8	Very high	57 Å²	57	41.1 Å²	41.1	35%	0.35	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-58.5	-17.7	171.7	56.3	0	0	0	0	114.4	R178 S179 L183 E202 A205	R178-T181 WeakPolarHBondContact O-CG2 3.24Å; R178-T181 PolarHBondContact O-N 3.27Å; R178-T181 PolarHBondContact O-OG1 3.25Å; S179-T181 PolarHBondContact O-N 2.96Å; T181-L183 VanDerWaalsContact C-N 3.34Å; T181-E202 HydrophobicContact CG2-CB 3.92Å; T181-E202 HydrophobicContact CG2-CG 4.05Å; T181-A205 HydrophobicContact CG2-CB 3.89Å
182	S	95.7	Very high	95.7	Very high	46 Å²	46	40.9 Å²	40.9	32%	0.322	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-82.2	-6.8	-179.7	-58.2	0	0	0	0	114.1	G158 S179 F180 C184	G158-S182 WeakPolarHBondContact O-CB 3.25Å; S179-S182 VanDerWaalsContact O-CB 3.27Å; S179-S182 WeakPolarHBondContact O-CB 3.44Å; S179-S182 PolarHBondContact O-N 3.07Å; S179-S182 PolarHBondContact O-OG 2.78Å; F180-S182 PolarHBondContact O-N 3.17Å; F180-S182 VanDerWaalsContact O-N 3.08Å; S182-C184 PolarHBondContact O-N 3.24Å
183	L	96	Very high	95.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.21	C	C	.	.			trans	-80.1	52.5	-179.5	-59.9	-179.7	0	0	0	112	I157 L160 L163 F180 T181 K185 L186 L206	I157-L183 WeakPolarHBondContact O-CD2 3.49Å; L160-L183 HydrophobicContact CB-CD2 4.06Å; L160-L183 WeakPolarHBondContact O-CD2 3.45Å; L163-L183 HydrophobicContact CB-CD2 4.45Å; L163-L183 HydrophobicContact CD2-CD1 4.44Å; F180-L183 HydrophobicContact CD2-CD1 3.7Å; F180-L183 HydrophobicContact CE1-CD1 4.4Å; F180-L183 HydrophobicContact CE2-CD1 3.56Å; F180-L183 HydrophobicContact CG-CD1 4.19Å; F180-L183 HydrophobicContact CZ-CD1 3.94Å; F180-L183 PolarHBondContact O-N 3.18Å; T181-L183 VanDerWaalsContact C-N 3.34Å; L183-K185 PolarHBondContact O-N 3.33Å; L183-L186 HydrophobicContact CB-CB 4.23Å; L183-L186 VanDerWaalsContact O-CB 3.27Å; L183-L186 WeakPolarHBondContact O-CB 3.38Å; L183-L186 PolarHBondContact O-N 3.19Å; L183-L206 HydrophobicContact CB-CD2 4.21Å; L183-L206 WeakPolarHBondContact O-CD2 3.43Å
184	C	91.1	Very high	95.5	Very high	76 Å²	76	43.2 Å²	43.2	51%	0.514	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.6	-167.2	-52	0	0	0	0	115.2	S182	S182-C184 PolarHBondContact O-N 3.24Å
185	K	95.5	Very high	95.6	Very high	107 Å²	107	42.9 Å²	42.9	47%	0.465	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	0.7	176.7	-65.9	-170.1	179	-179.5	0	113.8	L163 L183 R187	L163-K185 CarbonylContact O-C 3.32Å; L163-K185 VanDerWaalsContact O-C 3.24Å; L183-K185 PolarHBondContact O-N 3.33Å; K185-R187 PolarHBondContact O-N 3.05Å
186	L	97.3	Very high	95.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.			trans	-68	123.8	-177.2	-162.3	73.6	0	0	0	109.9	L163 L166 F180 L183 L189 L206 E208 L209	L163-L186 HydrophobicContact CB-CD1 4.35Å; L163-L186 HydrophobicContact CD2-CD1 4.05Å; L163-L186 HydrophobicContact CG-CD1 4Å; L163-L186 WeakPolarHBondContact O-CA 3.49Å; L163-L186 PolarHBondContact O-N 3.11Å; L166-L186 HydrophobicContact CB-CD1 3.83Å; L166-L186 HydrophobicContact CB-CD2 4.45Å; F180-L186 HydrophobicContact CZ-CD2 4.32Å; L183-L186 HydrophobicContact CB-CB 4.23Å; L183-L186 VanDerWaalsContact O-CB 3.27Å; L183-L186 WeakPolarHBondContact O-CB 3.38Å; L183-L186 PolarHBondContact O-N 3.19Å; L186-L189 HydrophobicContact CD2-CB 3.96Å; L186-L189 HydrophobicContact CD2-CD1 4.33Å; L186-L189 HydrophobicContact CD2-CD2 4.37Å; L186-L189 HydrophobicContact CD2-CG 4.45Å; L186-L206 HydrophobicContact CD2-CD1 3.88Å; L186-E208 CarbonylContact O-C 3.47Å; L186-L209 HydrophobicContact CD2-CD1 4.27Å; L186-L209 HydrophobicContact CG-CD1 4.23Å; L186-L209 WeakPolarHBondContact O-CA 3.41Å; L186-L209 PolarHBondContact O-N 3.25Å
187	R	96.5	Very high	95.5	Very high	91 Å²	91	44.6 Å²	44.6	34%	0.343	22%	0.219	S	C	.	.			trans	-108.6	-36.1	-179.2	-67.6	-178.8	178.3	-134.4	2.5	112.1	E164 K185 E208 E210 E211	E164-R187 PolarHBondContact O-N 3.46Å; K185-R187 PolarHBondContact O-N 3.05Å; R187-E208 IonicContact NH2-OE2 3.31Å; R187-E210 HydrophobicContact CB-CG 4.49Å; R187-E210 IonicContact CZ-OE1 3.6Å; R187-E210 IonicContact NE-OE1 2.71Å; R187-E210 IonicContact NH1-OE1 3.65Å; R187-E210 PolarHBondContact NH1-OE1 3.07Å; R187-E210 WeakPolarHBondContact O-CA 3.28Å; R187-E210 PolarHBondContact O-N 3.01Å; R187-E211 PolarHBondContact O-N 3.45Å
188	T	97.4	Very high	95.4	Very high	13 Å²	13	51 Å²	51	8%	0.08	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.5	178.9	-58.2	0	0	0	0	109.7	E164 E165 L166 E211	E164-T188 PolarHBondContact O-N 3.04Å; E165-T188 WeakPolarHBondContact CA-O 3.41Å; L166-T188 PolarHBondContact N-O 2.7Å; T188-E211 WeakPolarHBondContact CA-O 3.43Å; T188-E211 HydrophobicContact CG2-CB 4Å; T188-E211 WeakPolarHBondContact CG2-OE2 3.41Å; T188-E211 PolarHBondContact OG1-OE2 3.32Å
189	L	98	Very high	95.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	115.7	173.8	176.3	57.9	0	0	0	110	L166 I168 F176 F180 L186 I203 L209 E211 L212 D213	L166-L189 HydrophobicContact CB-CD1 4.1Å; L166-L189 HydrophobicContact CD2-CD1 3.96Å; L166-L189 HydrophobicContact CG-CD1 4.04Å; L166-L189 WeakPolarHBondContact O-CA 3.27Å; I168-L189 HydrophobicContact CD1-CD1 4.4Å; I168-L189 HydrophobicContact CG1-CD1 4.39Å; F176-L189 HydrophobicContact CE1-CD2 4.49Å; F180-L189 HydrophobicContact CE1-CD2 3.89Å; F180-L189 HydrophobicContact CZ-CD1 4.07Å; F180-L189 HydrophobicContact CZ-CD2 3.95Å; L186-L189 HydrophobicContact CD2-CB 3.96Å; L186-L189 HydrophobicContact CD2-CD1 4.33Å; L186-L189 HydrophobicContact CD2-CD2 4.37Å; L186-L189 HydrophobicContact CD2-CG 4.45Å; L189-I203 HydrophobicContact CD2-CD1 3.84Å; L189-I203 HydrophobicContact CD2-CG1 3.99Å; L189-L209 HydrophobicContact CB-CD1 3.88Å; L189-E211 PolarHBondContact N-O 3.04Å; L189-L212 HydrophobicContact CB-CD1 4.12Å; L189-L212 HydrophobicContact CD2-CD1 3.97Å; L189-L212 HydrophobicContact CG-CD1 4.09Å; L189-L212 WeakPolarHBondContact O-CA 3.44Å; L189-D213 PolarHBondContact O-N 3.11Å
190	D	96.4	Very high	95.4	Very high	15 Å²	15	40.4 Å²	40.4	8%	0.08	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.7	171.7	-167.4	-18.5	0	0	0	109.7	R36 L166 D167 I168 S169 D192	R36-D190 IonicContact CZ-OD2 3.32Å; R36-D190 IonicContact NE-OD2 2.72Å; R36-D190 IonicContact NH2-OD1 3.83Å; R36-D190 PolarHBondContact NH2-OD1 3.39Å; R36-D190 IonicContact NH2-OD2 3.48Å; R36-D190 PolarHBondContact NH2-OD2 2.87Å; L166-D190 PolarHBondContact O-N 3.13Å; D167-D190 HydrophobicContact CB-CB 4.31Å; I168-D190 WeakPolarHBondContact CG1-O 3.12Å; I168-D190 PolarHBondContact N-O 3.18Å; S169-D190 PolarHBondContact N-O 3.29Å; D190-D192 PolarHBondContact OD1-N 2.82Å
191	A	96.6	Very high	95.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.			trans	-133.2	30.6	177.5	0	0	0	0	0	111.9	I168 F176 N194 D213 L214 N217	I168-A191 HydrophobicContact CD1-CB 3.76Å; I168-A191 HydrophobicContact CG1-CB 3.78Å; F176-A191 HydrophobicContact CZ-CB 3.98Å; A191-N194 PolarHBondContact O-ND2 3.17Å; A191-N194 VanDerWaalsContact O-ND2 3.1Å; A191-D213 CarbonylContact C-O 3.24Å; A191-D213 PolarHBondContact N-O 3.12Å; A191-L214 HydrophobicContact CB-CD2 4.06Å; A191-N217 PolarHBondContact O-ND2 3.43Å
192	D	92.9	Very high	95.3	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.011	21%	0.213	C	C	.	.			trans	-66.9	159	178.7	90.6	-47.5	0	0	0	112.9	R36 S169 F170 D190 N194 D213 S215	R36-D192 IonicContact CZ-OD1 2.85Å; R36-D192 IonicContact CZ-OD2 3.65Å; R36-D192 IonicContact NH1-OD1 3.37Å; R36-D192 IonicContact NH1-OD2 3.78Å; R36-D192 PolarHBondContact NH1-OD2 2.74Å; R36-D192 IonicContact NH2-OD1 2.65Å; R36-D192 PolarHBondContact NH2-OD1 3.07Å; R36-D192 IonicContact NH2-OD2 2.8Å; R36-D192 PolarHBondContact NH2-OD2 3.2Å; S169-D192 CarbonylContact C-O 3.55Å; S169-D192 VanDerWaalsContact CA-O 3.25Å; S169-D192 WeakPolarHBondContact CA-O 3.21Å; S169-D192 WeakPolarHBondContact CB-OD1 3.38Å; F170-D192 PolarHBondContact N-O 3.38Å; D190-D192 PolarHBondContact OD1-N 2.82Å; D192-N194 PolarHBondContact O-N 2.81Å; D192-N194 PolarHBondContact O-ND2 3.18Å; D192-D213 WeakPolarHBondContact CB-OD2 3.45Å; D192-S215 CarbonylContact C-O 3.12Å; D192-S215 WeakPolarHBondContact CA-O 3.42Å; D192-S215 WeakPolarHBondContact CB-O 3.25Å
193	H	92.9	Very high	95.3	Very high	88 Å²	88	40.3 Å²	40.3	41%	0.407	20%	0.198	S	C	.	.	S	Bend	trans	50.2	52.1	179.8	-67.2	83.3	0	0	0	113.7	F170 N171 S215	F170-H193 WeakPolarHBondContact CA-O 3.47Å; F170-H193 HydrophobicContact CD1-CB 3.56Å; F170-H193 AromaticContact CD1-CG 3.88Å; F170-H193 HydrophobicContact CD2-CB 4.29Å; F170-H193 HydrophobicContact CE1-CB 3.65Å; F170-H193 AromaticContact CE1-CD2 3.7Å; F170-H193 AromaticContact CE1-CG 3.39Å; F170-H193 AromaticContact CE1-ND1 3.67Å; F170-H193 HydrophobicContact CE2-CB 4.35Å; F170-H193 AromaticContact CE2-ND1 3.83Å; F170-H193 HydrophobicContact CG-CB 3.89Å; F170-H193 HydrophobicContact CZ-CB 4.05Å; F170-H193 AromaticContact CZ-CE1 3.73Å; F170-H193 AromaticContact CZ-CG 3.58Å; F170-H193 AromaticContact CZ-ND1 3.31Å; F170-H193 VanDerWaalsContact CZ-ND1 3.31Å; F170-H193 WeakPolarHBondContact CZ-ND1 3.46Å; N171-H193 PolarHBondContact N-O 2.93Å; N171-H193 VanDerWaalsContact O-O 3.13Å; H193-S215 PolarHBondContact N-O 3.27Å
194	N	96.1	Very high	95.2	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.037	20%	0.203	C	C	.	.	S	Bend	trans	-113.5	-165.6	171.5	-85.5	-76.4	0	0	0	110.9	I168 N171 D172 L173 A191 D192 L196 N217	I168-N194 PolarHBondContact O-ND2 2.96Å; N171-N194 WeakPolarHBondContact CA-OD1 3.47Å; N171-N194 WeakPolarHBondContact CB-OD1 3.31Å; N171-N194 PolarHBondContact O-OD1 2.87Å; D172-N194 PolarHBondContact N-OD1 3.16Å; L173-N194 HydrophobicContact CB-CB 4.19Å; L173-N194 VanDerWaalsContact CB-OD1 3.25Å; L173-N194 WeakPolarHBondContact CB-OD1 3.34Å; L173-N194 WeakPolarHBondContact CG-OD1 3.42Å; L173-N194 PolarHBondContact N-OD1 3.02Å; A191-N194 PolarHBondContact O-ND2 3.17Å; A191-N194 VanDerWaalsContact O-ND2 3.1Å; D192-N194 PolarHBondContact O-N 2.81Å; D192-N194 PolarHBondContact O-ND2 3.18Å; N194-L196 HydrophobicContact CB-CG 4.37Å; N194-N217 WeakPolarHBondContact CA-OD1 3.19Å; N194-N217 WeakPolarHBondContact CB-OD1 3.31Å; N194-N217 PolarHBondContact N-OD1 3.19Å; N194-N217 PolarHBondContact O-OD1 2.79Å
195	K	95.5	Very high	95.3	Very high	65 Å²	65	40.1 Å²	40.1	28%	0.283	20%	0.199	S	C	.	.			trans	-117.9	32.1	-179.2	-63.3	178.4	-175.7	157.8	0	112.3	D172 L173 H174 N197 N217	D172-K195 HydrophobicContact CB-CD 4.26Å; D172-K195 WeakPolarHBondContact OD1-CE 3.47Å; D172-K195 IonicContact OD1-NZ 2.76Å; D172-K195 PolarHBondContact OD1-NZ 2.91Å; D172-K195 IonicContact OD2-NZ 3.82Å; L173-K195 CarbonylContact O-C 3.42Å; L173-K195 WeakPolarHBondContact O-CA 3.16Å; L173-K195 WeakPolarHBondContact O-CB 3.5Å; L173-K195 PolarHBondContact O-N 3.33Å; H174-K195 PolarHBondContact ND1-O 3.38Å; K195-N197 PolarHBondContact O-N 2.81Å; K195-N217 PolarHBondContact N-OD1 2.67Å
196	L	95.8	Very high	95.3	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.177	C	C	.	.			trans	-67.4	115.4	178.2	-56	170.7	0	0	0	109.3	L173 F176 N194 P200 L214 N217 K218 F219	L173-L196 PolarHBondContact O-N 2.88Å; F176-L196 HydrophobicContact CD2-CD2 4.03Å; F176-L196 HydrophobicContact CE2-CD1 3.73Å; F176-L196 HydrophobicContact CE2-CD2 3.84Å; F176-L196 HydrophobicContact CE2-CG 4.44Å; N194-L196 HydrophobicContact CB-CG 4.37Å; L196-P200 HydrophobicContact CD1-CG 4.12Å; L196-L214 HydrophobicContact CD1-CD2 4.15Å; L196-N217 HydrophobicContact CB-CB 4.1Å; L196-N217 VanDerWaalsContact CB-OD1 3.31Å; L196-N217 WeakPolarHBondContact CB-OD1 3.43Å; L196-N217 VanDerWaalsContact CG-OD1 3.23Å; L196-N217 WeakPolarHBondContact CG-OD1 3.32Å; L196-N217 PolarHBondContact N-OD1 3.48Å; L196-K218 CarbonylContact O-C 3.45Å; L196-K218 WeakPolarHBondContact O-CA 3.42Å; L196-K218 WeakPolarHBondContact O-CB 3.41Å; L196-K218 PolarHBondContact O-N 3.01Å; L196-F219 HydrophobicContact CB-CD1 4.36Å; L196-F219 PolarHBondContact O-N 2.8Å
197	N	93.3	Very high	94.8	Very high	99 Å²	99	36.8 Å²	36.8	53%	0.529	20%	0.195	S	C	.	.	S	Bend	trans	-86.2	-13.2	-178.2	-62.3	-45.5	0	0	0	113.1	K195	K195-N197 PolarHBondContact O-N 2.81Å
198	R	94.6	Very high	94.6	Very high	158 Å²	158	36.7 Å²	36.7	60%	0.596	20%	0.199	S	C	*	.	S	Bend	trans	-144.1	156.2	179.9	47.6	-179.7	170.6	-171.3	-5.6	109.3	D175 F219	D175-R198 IonicContact OD1-NE 3.72Å; D175-R198 PolarHBondContact OD1-NE 2.89Å; D175-R198 IonicContact OD2-CZ 2.84Å; D175-R198 IonicContact OD2-NE 3.77Å; D175-R198 PolarHBondContact OD2-NE 3.18Å; D175-R198 IonicContact OD2-NH2 3.6Å; D175-R198 PolarHBondContact OD2-NH2 2.86Å; R198-F219 VanDerWaalsContact CA-CB 3.47Å
199	F	95.4	Very high	94.6	Very high	21 Å²	21	36 Å²	36	9%	0.092	20%	0.195	C	C	.	.			trans	-62.2	129.6	172.3	-173.4	-82.1	0	0	0	109.7	A201 I203 L204 L214 F219 L222 P223 I226	F199-A201 PolarHBondContact O-N 2.95Å; F199-I203 HydrophobicContact CE1-CB 4.38Å; F199-I203 HydrophobicContact CZ-CB 4.47Å; F199-I203 HydrophobicContact CZ-CG2 4.39Å; F199-L204 HydrophobicContact CE1-CD2 3.63Å; F199-L204 HydrophobicContact CE1-CG 3.88Å; F199-L204 HydrophobicContact CZ-CD2 4.1Å; F199-L214 HydrophobicContact CD2-CD1 3.97Å; F199-L214 HydrophobicContact CE2-CD1 3.57Å; F199-L214 HydrophobicContact CZ-CD1 4.31Å; F199-F219 HydrophobicContact CB-CD2 4.39Å; F199-F219 HydrophobicContact CD2-CE2 4.12Å; F199-F219 HydrophobicContact CD2-CZ 4.35Å; F199-L222 HydrophobicContact CD2-CD2 3.74Å; F199-L222 HydrophobicContact CE2-CD2 4.04Å; F199-P223 HydrophobicContact CB-CG 4.35Å; F199-P223 HydrophobicContact CD1-CG 3.57Å; F199-P223 HydrophobicContact CE1-CG 3.99Å; F199-P223 VanDerWaalsContact CG-CD 3.47Å; F199-P223 HydrophobicContact CG-CG 3.91Å; F199-I226 HydrophobicContact CE1-CD1 4.32Å; F199-I226 HydrophobicContact CE2-CD1 3.75Å; F199-I226 HydrophobicContact CZ-CD1 3.53Å
200	P	94.2	Very high	94.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.2	C	C	.	.			trans	-72.2	112	179.6	-11	25.6	0	0	0	111.1	F176 L196 E202 I203	F176-P200 HydrophobicContact CB-CB 4.3Å; F176-P200 HydrophobicContact CD2-CB 3.52Å; F176-P200 HydrophobicContact CD2-CG 3.43Å; F176-P200 VanDerWaalsContact CD2-CG 3.43Å; F176-P200 HydrophobicContact CE2-CB 4.13Å; F176-P200 HydrophobicContact CE2-CG 3.57Å; F176-P200 HydrophobicContact CG-CB 4.12Å; F176-P200 HydrophobicContact CG-CG 4.45Å; L196-P200 HydrophobicContact CD1-CG 4.12Å; P200-E202 PolarHBondContact O-N 3.06Å; P200-I203 HydrophobicContact CB-CD1 3.9Å; P200-I203 HydrophobicContact CB-CG1 4.08Å; P200-I203 HydrophobicContact CG-CD1 3.66Å; P200-I203 HydrophobicContact CG-CG1 4.39Å; P200-I203 PolarHBondContact O-N 2.91Å; P200-I203 VanDerWaalsContact O-N 3.16Å
201	A	93.8	Very high	94.6	Very high	64 Å²	64	38.7 Å²	38.7	53%	0.529	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-62.7	-25	-178.8	0	0	0	0	0	112.3	F199 I203 L204	F199-A201 PolarHBondContact O-N 2.95Å; A201-I203 PolarHBondContact O-N 2.85Å; A201-L204 VanDerWaalsContact O-CB 3.29Å; A201-L204 WeakPolarHBondContact O-CB 3.36Å; A201-L204 PolarHBondContact O-N 3.13Å; A201-L204 VanDerWaalsContact O-N 3.12Å
202	E	95.8	Very high	94.6	Very high	37 Å²	37	38.8 Å²	38.8	17%	0.173	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.3	-32.8	177.6	-65.6	71	-158.6	0	0	112.4	F180 T181 P200 L204 A205	F180-E202 HydrophobicContact CB-CB 4.21Å; F180-E202 HydrophobicContact CD1-CB 4.44Å; T181-E202 HydrophobicContact CG2-CB 3.92Å; T181-E202 HydrophobicContact CG2-CG 4.05Å; P200-E202 PolarHBondContact O-N 3.06Å; E202-L204 PolarHBondContact O-N 2.9Å; E202-A205 WeakPolarHBondContact O-CB 3.31Å; E202-A205 PolarHBondContact O-N 2.88Å
203	I	96.2	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-64.6	-30	178.4	-66.1	173.3	0	0	0	110.8	F176 F180 L189 F199 P200 A201 A205 L206 L209 L212 L214 L229	F176-I203 HydrophobicContact CE2-CD1 4.46Å; F176-I203 HydrophobicContact CZ-CD1 4.48Å; F180-I203 HydrophobicContact CE1-CG1 4.34Å; L189-I203 HydrophobicContact CD2-CD1 3.84Å; L189-I203 HydrophobicContact CD2-CG1 3.99Å; F199-I203 HydrophobicContact CE1-CB 4.38Å; F199-I203 HydrophobicContact CZ-CB 4.47Å; F199-I203 HydrophobicContact CZ-CG2 4.39Å; P200-I203 HydrophobicContact CB-CD1 3.9Å; P200-I203 HydrophobicContact CB-CG1 4.08Å; P200-I203 HydrophobicContact CG-CD1 3.66Å; P200-I203 HydrophobicContact CG-CG1 4.39Å; P200-I203 PolarHBondContact O-N 2.91Å; P200-I203 VanDerWaalsContact O-N 3.16Å; A201-I203 PolarHBondContact O-N 2.85Å; I203-A205 PolarHBondContact O-N 2.84Å; I203-A205 VanDerWaalsContact O-N 3.09Å; I203-L206 WeakPolarHBondContact O-CB 3.46Å; I203-L206 PolarHBondContact O-N 2.77Å; I203-L209 HydrophobicContact CG2-CD2 3.93Å; I203-L212 HydrophobicContact CD1-CD1 4.33Å; I203-L212 HydrophobicContact CG2-CD1 4.41Å; I203-L212 HydrophobicContact CG2-CD2 3.92Å; I203-L214 HydrophobicContact CD1-CD1 4.33Å; I203-L214 HydrophobicContact CD1-CD2 4.05Å; I203-L229 HydrophobicContact CG2-CD1 4.39Å; I203-L229 HydrophobicContact CG2-CD2 4.27Å; I203-L229 WeakPolarHBondContact O-CD2 3.46Å
204	L	94.7	Very high	95	Very high	19 Å²	19	34.8 Å²	34.8	10%	0.099	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-65.5	-14.4	-179.9	-56.5	175.1	0	0	0	113.6	F199 A201 E202 P223 D225 I226 L229	F199-L204 HydrophobicContact CE1-CD2 3.63Å; F199-L204 HydrophobicContact CE1-CG 3.88Å; F199-L204 HydrophobicContact CZ-CD2 4.1Å; A201-L204 VanDerWaalsContact O-CB 3.29Å; A201-L204 WeakPolarHBondContact O-CB 3.36Å; A201-L204 PolarHBondContact O-N 3.13Å; A201-L204 VanDerWaalsContact O-N 3.12Å; E202-L204 PolarHBondContact O-N 2.9Å; L204-P223 HydrophobicContact CD1-CB 4.5Å; L204-P223 HydrophobicContact CD1-CG 4.08Å; L204-P223 HydrophobicContact CD2-CG 4.28Å; L204-D225 HydrophobicContact CD1-CB 3.84Å; L204-I226 HydrophobicContact CD2-CD1 4.12Å; L204-L229 HydrophobicContact CD2-CG 4.41Å
205	A	93.5	Very high	94.9	Very high	54 Å²	54	35 Å²	35	45%	0.446	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-82.5	-13.1	174	0	0	0	0	0	113	T181 E202 I203 G207	T181-A205 HydrophobicContact CG2-CB 3.89Å; E202-A205 WeakPolarHBondContact O-CB 3.31Å; E202-A205 PolarHBondContact O-N 2.88Å; I203-A205 PolarHBondContact O-N 2.84Å; I203-A205 VanDerWaalsContact O-N 3.09Å; A205-G207 PolarHBondContact O-N 2.85Å; A205-G207 VanDerWaalsContact O-N 3.1Å
206	L	94.3	Very high	94.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.			trans	-87.7	76	-173.8	-52.3	-176.2	0	0	0	111	F180 L183 L186 I203 E208 L209	F180-L206 HydrophobicContact CD1-CD1 4.23Å; F180-L206 HydrophobicContact CE1-CD1 3.8Å; L183-L206 HydrophobicContact CB-CD2 4.21Å; L183-L206 WeakPolarHBondContact O-CD2 3.43Å; L186-L206 HydrophobicContact CD2-CD1 3.88Å; I203-L206 WeakPolarHBondContact O-CB 3.46Å; I203-L206 PolarHBondContact O-N 2.77Å; L206-E208 VanDerWaalsContact C-N 3.26Å; L206-E208 PolarHBondContact O-N 2.81Å; L206-L209 HydrophobicContact CB-CB 4.24Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.43Å; L206-L209 PolarHBondContact O-N 3.23Å
207	G	86.2	Confident	94.6	Very high	37 Å²	37	33.1 Å²	33.1	38%	0.381	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.9	-174.3	0	0	0	0	0	115.8	A205 S231	A205-G207 PolarHBondContact O-N 2.85Å; A205-G207 VanDerWaalsContact O-N 3.1Å; G207-S231 VanDerWaalsContact O-CB 3.28Å; G207-S231 WeakPolarHBondContact O-CB 3.15Å; G207-S231 PolarHBondContact O-OG 3.4Å
208	E	93.8	Very high	94.6	Very high	88 Å²	88	33.9 Å²	33.9	41%	0.411	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	1.8	177	-66.2	-159.7	-174.1	0	0	113.7	L186 R187 L206 E210	L186-E208 CarbonylContact O-C 3.47Å; R187-E208 IonicContact NH2-OE2 3.31Å; L206-E208 VanDerWaalsContact C-N 3.26Å; L206-E208 PolarHBondContact O-N 2.81Å; E208-E210 PolarHBondContact O-N 2.95Å; E208-E210 VanDerWaalsContact O-N 3.14Å
209	L	96.8	Very high	94.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.16	C	C	.	.			trans	-68	113.7	-175.3	-162	72.5	0	0	0	111.3	L186 L189 I203 L206 L212 S231 T232	L186-L209 HydrophobicContact CD2-CD1 4.27Å; L186-L209 HydrophobicContact CG-CD1 4.23Å; L186-L209 WeakPolarHBondContact O-CA 3.41Å; L186-L209 PolarHBondContact O-N 3.25Å; L189-L209 HydrophobicContact CB-CD1 3.88Å; I203-L209 HydrophobicContact CG2-CD2 3.93Å; L206-L209 HydrophobicContact CB-CB 4.24Å; L206-L209 VanDerWaalsContact O-CB 3.29Å; L206-L209 WeakPolarHBondContact O-CB 3.43Å; L206-L209 PolarHBondContact O-N 3.23Å; L209-L212 HydrophobicContact CD2-CB 3.85Å; L209-L212 HydrophobicContact CD2-CD1 4.07Å; L209-L212 HydrophobicContact CD2-CD2 4.05Å; L209-L212 HydrophobicContact CD2-CG 4.2Å; L209-S231 CarbonylContact O-C 3.04Å; L209-S231 VanDerWaalsContact O-C 3.25Å; L209-T232 WeakPolarHBondContact O-CA 3.41Å; L209-T232 PolarHBondContact O-N 2.75Å; L209-T232 VanDerWaalsContact O-N 3.08Å; L209-T232 PolarHBondContact O-OG1 3.28Å
210	E	96.5	Very high	94.4	Very high	26 Å²	26	31.8 Å²	31.8	12%	0.121	19%	0.185	C	C	.	.			trans	-93	-33.9	-179.7	-61.9	-172.9	-142.8	0	0	111.6	R187 E208 K233 I234	R187-E210 HydrophobicContact CB-CG 4.49Å; R187-E210 IonicContact CZ-OE1 3.6Å; R187-E210 IonicContact NE-OE1 2.71Å; R187-E210 IonicContact NH1-OE1 3.65Å; R187-E210 PolarHBondContact NH1-OE1 3.07Å; R187-E210 WeakPolarHBondContact O-CA 3.28Å; R187-E210 PolarHBondContact O-N 3.01Å; E208-E210 PolarHBondContact O-N 2.95Å; E208-E210 VanDerWaalsContact O-N 3.14Å; E210-K233 PolarHBondContact O-N 2.92Å; E210-K233 IonicContact OE2-NZ 3.91Å; E210-K233 PolarHBondContact OE2-NZ 3.03Å; E210-I234 PolarHBondContact O-N 3.33Å
211	E	97.3	Very high	94.3	Very high	46 Å²	46	34.8 Å²	34.8	22%	0.215	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126	-175.3	-58.1	176.9	176.8	0	0	110.4	R187 T188 L189 I234	R187-E211 PolarHBondContact O-N 3.45Å; T188-E211 WeakPolarHBondContact CA-O 3.43Å; T188-E211 HydrophobicContact CG2-CB 4Å; T188-E211 WeakPolarHBondContact CG2-OE2 3.41Å; T188-E211 PolarHBondContact OG1-OE2 3.32Å; L189-E211 PolarHBondContact N-O 3.04Å; E211-I234 WeakPolarHBondContact CA-O 3.35Å; E211-I234 HydrophobicContact CB-CB 4.39Å; E211-I234 HydrophobicContact CG-CB 4.08Å; E211-I234 HydrophobicContact CG-CD1 4.07Å; E211-I234 HydrophobicContact CG-CG1 4.23Å
212	L	97.6	Very high	94.3	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	119.8	-179.5	176.5	58.6	0	0	0	110.8	L189 I203 L209 L214 L229 I234 L235 W236	L189-L212 HydrophobicContact CB-CD1 4.12Å; L189-L212 HydrophobicContact CD2-CD1 3.97Å; L189-L212 HydrophobicContact CG-CD1 4.09Å; L189-L212 WeakPolarHBondContact O-CA 3.44Å; I203-L212 HydrophobicContact CD1-CD1 4.33Å; I203-L212 HydrophobicContact CG2-CD1 4.41Å; I203-L212 HydrophobicContact CG2-CD2 3.92Å; L209-L212 HydrophobicContact CD2-CB 3.85Å; L209-L212 HydrophobicContact CD2-CD1 4.07Å; L209-L212 HydrophobicContact CD2-CD2 4.05Å; L209-L212 HydrophobicContact CD2-CG 4.2Å; L212-L214 HydrophobicContact CD1-CD1 4.18Å; L212-L214 HydrophobicContact CD1-CD2 4.1Å; L212-L214 HydrophobicContact CD1-CG 3.8Å; L212-L214 HydrophobicContact CD2-CD1 4.05Å; L212-L214 HydrophobicContact CD2-CG 4.46Å; L212-L214 HydrophobicContact CG-CD1 4.22Å; L212-L214 HydrophobicContact CG-CG 4.08Å; L212-L229 HydrophobicContact CD2-CD1 3.9Å; L212-I234 PolarHBondContact N-O 3.03Å; L212-L235 HydrophobicContact CB-CD1 3.94Å; L212-L235 HydrophobicContact CD2-CD1 3.85Å; L212-L235 HydrophobicContact CG-CD1 3.96Å; L212-L235 WeakPolarHBondContact O-CA 3.25Å; L212-W236 PolarHBondContact O-N 2.84Å
213	D	97	Very high	94.2	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.032	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.9	168.9	-168.8	2.3	0	0	0	111.1	R36 L189 A191 D192 S215 W236	R36-D213 IonicContact CZ-OD2 3.92Å; R36-D213 IonicContact NH1-OD2 2.96Å; R36-D213 IonicContact NH2-OD2 3.38Å; L189-D213 PolarHBondContact O-N 3.11Å; A191-D213 CarbonylContact C-O 3.24Å; A191-D213 PolarHBondContact N-O 3.12Å; D192-D213 WeakPolarHBondContact CB-OD2 3.45Å; D213-S215 WeakPolarHBondContact OD1-CB 3.1Å; D213-S215 PolarHBondContact OD1-N 2.96Å; D213-S215 PolarHBondContact OD1-OG 2.95Å; D213-W236 HydrophobicContact CB-CB 4.08Å; D213-W236 HydrophobicContact CB-CD2 4.49Å; D213-W236 HydrophobicContact CB-CE3 3.77Å; D213-W236 WeakPolarHBondContact OD1-CB 3.29Å; D213-W236 VanDerWaalsContact OD2-CE3 3.29Å
214	L	97.1	Very high	94	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.218	C	C	.	.			trans	-124.1	16	173.7	-63.8	172.8	0	0	0	112	A191 L196 F199 I203 L212 N217 F219 W236 L237	A191-L214 HydrophobicContact CB-CD2 4.06Å; L196-L214 HydrophobicContact CD1-CD2 4.15Å; F199-L214 HydrophobicContact CD2-CD1 3.97Å; F199-L214 HydrophobicContact CE2-CD1 3.57Å; F199-L214 HydrophobicContact CZ-CD1 4.31Å; I203-L214 HydrophobicContact CD1-CD1 4.33Å; I203-L214 HydrophobicContact CD1-CD2 4.05Å; L212-L214 HydrophobicContact CD1-CD1 4.18Å; L212-L214 HydrophobicContact CD1-CD2 4.1Å; L212-L214 HydrophobicContact CD1-CG 3.8Å; L212-L214 HydrophobicContact CD2-CD1 4.05Å; L212-L214 HydrophobicContact CD2-CG 4.46Å; L212-L214 HydrophobicContact CG-CD1 4.22Å; L212-L214 HydrophobicContact CG-CG 4.08Å; L214-N217 PolarHBondContact O-ND2 3.33Å; L214-F219 HydrophobicContact CB-CE1 4.04Å; L214-F219 HydrophobicContact CB-CZ 3.79Å; L214-F219 HydrophobicContact CD1-CE1 4.47Å; L214-F219 HydrophobicContact CD1-CZ 4Å; L214-W236 PolarHBondContact N-O 3.4Å; L214-L237 HydrophobicContact CB-CD2 4.07Å; L214-L237 HydrophobicContact CD1-CD2 4.4Å
215	S	94.1	Very high	93.8	Very high	11 Å²	11	38.2 Å²	38.2	8%	0.077	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	153.5	-175.2	-53.8	0	0	0	0	112.6	D192 H193 D213 N217 L237 S238	D192-S215 CarbonylContact C-O 3.12Å; D192-S215 WeakPolarHBondContact CA-O 3.42Å; D192-S215 WeakPolarHBondContact CB-O 3.25Å; H193-S215 PolarHBondContact N-O 3.27Å; D213-S215 WeakPolarHBondContact OD1-CB 3.1Å; D213-S215 PolarHBondContact OD1-N 2.96Å; D213-S215 PolarHBondContact OD1-OG 2.95Å; S215-N217 PolarHBondContact O-N 3.19Å; S215-N217 PolarHBondContact O-ND2 3.5Å; S215-L237 PolarHBondContact OG-N 2.82Å; S215-S238 CarbonylContact C-O 3.21Å; S215-S238 WeakPolarHBondContact CA-O 3.36Å; S215-S238 WeakPolarHBondContact CB-O 3.46Å; S215-S238 PolarHBondContact OG-N 2.89Å; S215-S238 VanDerWaalsContact OG-N 3.08Å
216	G	89.8	Confident	93.8	Very high	22 Å²	22	35.7 Å²	35.7	23%	0.227	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	18.7	175.4	0	0	0	0	0	115.4	S238	G216-S238 PolarHBondContact N-O 3.3Å
217	N	95.5	Very high	93.7	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	23%	0.226	C	C	.	.			trans	-90.6	-168.9	169.5	-79.3	-76	0	0	0	111.6	A191 N194 K195 L196 L214 S215 F219 L240	A191-N217 PolarHBondContact O-ND2 3.43Å; N194-N217 WeakPolarHBondContact CA-OD1 3.19Å; N194-N217 WeakPolarHBondContact CB-OD1 3.31Å; N194-N217 PolarHBondContact N-OD1 3.19Å; N194-N217 PolarHBondContact O-OD1 2.79Å; K195-N217 PolarHBondContact N-OD1 2.67Å; L196-N217 HydrophobicContact CB-CB 4.1Å; L196-N217 VanDerWaalsContact CB-OD1 3.31Å; L196-N217 WeakPolarHBondContact CB-OD1 3.43Å; L196-N217 VanDerWaalsContact CG-OD1 3.23Å; L196-N217 WeakPolarHBondContact CG-OD1 3.32Å; L196-N217 PolarHBondContact N-OD1 3.48Å; L214-N217 PolarHBondContact O-ND2 3.33Å; S215-N217 PolarHBondContact O-N 3.19Å; S215-N217 PolarHBondContact O-ND2 3.5Å; N217-F219 HydrophobicContact CB-CD1 3.84Å; N217-F219 HydrophobicContact CB-CE1 3.7Å; N217-L240 HydrophobicContact CB-CD2 3.68Å
218	K	92.1	Very high	94	Very high	116 Å²	116	43.2 Å²	43.2	50%	0.504	23%	0.232	S	C	.	.	S	Bend	trans	-118.5	7.1	-169.6	-61.1	-176.3	178.2	-176.8	0	115.1	L196	L196-K218 CarbonylContact O-C 3.45Å; L196-K218 WeakPolarHBondContact O-CA 3.42Å; L196-K218 WeakPolarHBondContact O-CB 3.41Å; L196-K218 PolarHBondContact O-N 3.01Å
219	F	93.7	Very high	94	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	21%	0.213	C	C	.	.			trans	-88.2	138.2	178.6	63.1	-91.3	0	0	0	111.2	L196 R198 F199 L214 N217 L222 L237 L240	L196-F219 HydrophobicContact CB-CD1 4.36Å; L196-F219 PolarHBondContact O-N 2.8Å; R198-F219 VanDerWaalsContact CA-CB 3.47Å; F199-F219 HydrophobicContact CB-CD2 4.39Å; F199-F219 HydrophobicContact CD2-CE2 4.12Å; F199-F219 HydrophobicContact CD2-CZ 4.35Å; L214-F219 HydrophobicContact CB-CE1 4.04Å; L214-F219 HydrophobicContact CB-CZ 3.79Å; L214-F219 HydrophobicContact CD1-CE1 4.47Å; L214-F219 HydrophobicContact CD1-CZ 4Å; N217-F219 HydrophobicContact CB-CD1 3.84Å; N217-F219 HydrophobicContact CB-CE1 3.7Å; F219-L222 HydrophobicContact CE2-CD2 4.01Å; F219-L237 HydrophobicContact CZ-CD2 4.29Å; F219-L240 HydrophobicContact CD1-CD2 4.07Å; F219-L240 HydrophobicContact CD2-CD1 4.28Å; F219-L240 HydrophobicContact CE1-CD1 4.2Å; F219-L240 HydrophobicContact CE1-CD2 3.71Å; F219-L240 HydrophobicContact CE2-CD1 3.47Å; F219-L240 VanDerWaalsContact CE2-CD1 3.47Å; F219-L240 HydrophobicContact CE2-CD2 4.25Å; F219-L240 HydrophobicContact CE2-CG 4.43Å; F219-L240 HydrophobicContact CG-CD2 4.47Å; F219-L240 HydrophobicContact CZ-CD1 3.41Å; F219-L240 VanDerWaalsContact CZ-CD1 3.41Å; F219-L240 HydrophobicContact CZ-CD2 3.81Å; F219-L240 HydrophobicContact CZ-CG 4.27Å
220	Q	91.9	Very high	93.6	Very high	131 Å²	131	45.8 Å²	45.8	61%	0.612	24%	0.242	S	C	*	.			trans	-104.9	-2	-172.5	-63.2	177.1	5	0	0	113.8	H241 M242	Q220-H241 HydrophobicContact CG-CB 4.44Å; Q220-M242 WeakPolarHBondContact O-CA 3.18Å; Q220-M242 WeakPolarHBondContact O-CG 3.39Å
221	A	92.7	Very high	93.5	Very high	64 Å²	64	46.5 Å²	46.5	53%	0.529	25%	0.25	S	C	.	.			trans	-144.9	144.3	-177.9	0	0	0	0	0	111.7
222	L	94.6	Very high	93.5	Very high	16 Å²	16	44.3 Å²	44.3	8%	0.084	24%	0.239	C	C	.	.			trans	-89.8	146.4	169.7	-63.6	176.4	0	0	0	110.6	F199 F219 L237 M242 L245 P246 F249	F199-L222 HydrophobicContact CD2-CD2 3.74Å; F199-L222 HydrophobicContact CE2-CD2 4.04Å; F219-L222 HydrophobicContact CE2-CD2 4.01Å; L222-L237 HydrophobicContact CD1-CD1 3.76Å; L222-L237 HydrophobicContact CD2-CD1 4.04Å; L222-L237 HydrophobicContact CD2-CD2 4.26Å; L222-L237 HydrophobicContact CG-CD1 4.44Å; L222-M242 HydrophobicContact CD2-SD 4.42Å; L222-M242 HydrophobicContact CG-SD 4.05Å; L222-L245 HydrophobicContact CD1-CD2 3.9Å; L222-P246 HydrophobicContact CB-CG 4.01Å; L222-F249 HydrophobicContact CD1-CD2 3.86Å; L222-F249 HydrophobicContact CD1-CE2 4.19Å
223	P	93.9	Very high	93.4	Very high	36 Å²	36	47.9 Å²	47.9	23%	0.234	26%	0.255	C	S	.	.			trans	-72.6	151.1	176.6	30.9	-35	0	0	0	111.6	F199 L204 D225 I226	F199-P223 HydrophobicContact CB-CG 4.35Å; F199-P223 HydrophobicContact CD1-CG 3.57Å; F199-P223 HydrophobicContact CE1-CG 3.99Å; F199-P223 VanDerWaalsContact CG-CD 3.47Å; F199-P223 HydrophobicContact CG-CG 3.91Å; L204-P223 HydrophobicContact CD1-CB 4.5Å; L204-P223 HydrophobicContact CD1-CG 4.08Å; L204-P223 HydrophobicContact CD2-CG 4.28Å; P223-D225 PolarHBondContact O-N 3.24Å; P223-I226 WeakPolarHBondContact O-CB 3.43Å; P223-I226 PolarHBondContact O-N 3.19Å; P223-I226 VanDerWaalsContact O-N 3.14Å
224	A	90.1	Very high	93.4	Very high	67 Å²	67	49.2 Å²	49.2	55%	0.554	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-60.4	-31.9	175.6	0	0	0	0	0	112.5	I226 T248	A224-I226 PolarHBondContact O-N 3.45Å; A224-I226 VanDerWaalsContact O-N 3.13Å; A224-T248 WeakPolarHBondContact O-CB 3.33Å; A224-T248 WeakPolarHBondContact O-CG2 3.48Å; A224-T248 PolarHBondContact O-OG1 3.29Å
225	D	91.6	Very high	93.4	Very high	73 Å²	73	49.2 Å²	49.2	39%	0.39	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-72.3	5.8	177.5	-79.3	-69.7	0	0	0	114.7	L204 P223 L227 R228	L204-D225 HydrophobicContact CD1-CB 3.84Å; P223-D225 PolarHBondContact O-N 3.24Å; D225-L227 PolarHBondContact O-N 3.33Å; D225-R228 WeakPolarHBondContact O-CB 3.48Å; D225-R228 WeakPolarHBondContact O-CG 3.28Å; D225-R228 PolarHBondContact O-N 3.06Å; D225-R228 IonicContact OD1-CZ 3.53Å; D225-R228 IonicContact OD1-NE 2.61Å; D225-R228 PolarHBondContact OD1-NE 3.2Å; D225-R228 VanDerWaalsContact OD1-NE 3.11Å; D225-R228 IonicContact OD1-NH2 3.77Å; D225-R228 PolarHBondContact OD1-NH2 3.42Å; D225-R228 IonicContact OD2-NH2 2.69Å
226	I	93.6	Very high	93.6	Very high	1 Å²	1	51 Å²	51	1%	0.005	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-54.9	-26.8	179.6	-163.9	67.3	0	0	0	113.1	F199 L204 P223 A224 R228 L229 P246 F249 L252	F199-I226 HydrophobicContact CE1-CD1 4.32Å; F199-I226 HydrophobicContact CE2-CD1 3.75Å; F199-I226 HydrophobicContact CZ-CD1 3.53Å; L204-I226 HydrophobicContact CD2-CD1 4.12Å; P223-I226 WeakPolarHBondContact O-CB 3.43Å; P223-I226 PolarHBondContact O-N 3.19Å; P223-I226 VanDerWaalsContact O-N 3.14Å; A224-I226 PolarHBondContact O-N 3.45Å; A224-I226 VanDerWaalsContact O-N 3.13Å; I226-R228 PolarHBondContact O-N 3.4Å; I226-L229 HydrophobicContact CD1-CD1 3.67Å; I226-L229 HydrophobicContact CD1-CG 4.45Å; I226-L229 HydrophobicContact CG1-CD1 4.5Å; I226-L229 PolarHBondContact O-N 2.93Å; I226-L229 VanDerWaalsContact O-N 3.08Å; I226-P246 HydrophobicContact CG2-CG 4.34Å; I226-F249 HydrophobicContact CG2-CB 4.49Å; I226-L252 HydrophobicContact CG1-CD1 4.39Å
227	L	91.7	Very high	93.9	Very high	61 Å²	61	50 Å²	50	32%	0.319	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-56.5	-14.5	175.6	74.6	100.2	0	0	0	114.6	D225 L229 K230 T248 H251	D225-L227 PolarHBondContact O-N 3.33Å; L227-L229 PolarHBondContact O-N 3.17Å; L227-K230 WeakPolarHBondContact O-CG 3.48Å; L227-T248 HydrophobicContact CD2-CG2 3.89Å; L227-H251 HydrophobicContact CB-CB 4.12Å
228	R	93.1	Very high	93.7	Very high	135 Å²	135	50.4 Å²	50.4	51%	0.509	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-67.7	-22.5	175.5	-67.8	-179.1	-171	-156.5	5.7	113	D225 I226 K230	D225-R228 WeakPolarHBondContact O-CB 3.48Å; D225-R228 WeakPolarHBondContact O-CG 3.28Å; D225-R228 PolarHBondContact O-N 3.06Å; D225-R228 IonicContact OD1-CZ 3.53Å; D225-R228 IonicContact OD1-NE 2.61Å; D225-R228 PolarHBondContact OD1-NE 3.2Å; D225-R228 VanDerWaalsContact OD1-NE 3.11Å; D225-R228 IonicContact OD1-NH2 3.77Å; D225-R228 PolarHBondContact OD1-NH2 3.42Å; D225-R228 IonicContact OD2-NH2 2.69Å; I226-R228 PolarHBondContact O-N 3.4Å; R228-K230 PolarHBondContact O-N 3.06Å
229	L	93.8	Very high	93.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.254	C	S	.	.			trans	-78.1	53.1	178.2	-59.1	-176.1	0	0	0	112.3	I203 L204 L212 I226 L227 S231 T232 L252	I203-L229 HydrophobicContact CG2-CD1 4.39Å; I203-L229 HydrophobicContact CG2-CD2 4.27Å; I203-L229 WeakPolarHBondContact O-CD2 3.46Å; L204-L229 HydrophobicContact CD2-CG 4.41Å; L212-L229 HydrophobicContact CD2-CD1 3.9Å; I226-L229 HydrophobicContact CD1-CD1 3.67Å; I226-L229 HydrophobicContact CD1-CG 4.45Å; I226-L229 HydrophobicContact CG1-CD1 4.5Å; I226-L229 PolarHBondContact O-N 2.93Å; I226-L229 VanDerWaalsContact O-N 3.08Å; L227-L229 PolarHBondContact O-N 3.17Å; L229-S231 PolarHBondContact O-N 3.22Å; L229-S231 VanDerWaalsContact O-N 3.13Å; L229-T232 WeakPolarHBondContact CB-OG1 3.46Å; L229-T232 WeakPolarHBondContact O-CB 3.24Å; L229-T232 PolarHBondContact O-N 3.49Å; L229-T232 VanDerWaalsContact O-N 3.16Å; L229-T232 PolarHBondContact O-OG1 3.19Å; L229-L252 HydrophobicContact CB-CD2 4.15Å; L229-L252 WeakPolarHBondContact O-CD2 3.36Å
230	K	88.1	Confident	93.6	Very high	140 Å²	140	47.4 Å²	47.4	61%	0.609	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.1	-168.7	-63.9	-177.8	-178.8	-178.4	0	114.1	L227 R228 N254	L227-K230 WeakPolarHBondContact O-CG 3.48Å; R228-K230 PolarHBondContact O-N 3.06Å; K230-N254 PolarHBondContact O-ND2 2.79Å
231	S	94.8	Very high	93.6	Very high	42 Å²	42	46.5 Å²	46.5	29%	0.294	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-5.7	-177.6	-55.5	0	0	0	0	113.5	G207 L209 L229 K233	G207-S231 VanDerWaalsContact O-CB 3.28Å; G207-S231 WeakPolarHBondContact O-CB 3.15Å; G207-S231 PolarHBondContact O-OG 3.4Å; L209-S231 CarbonylContact O-C 3.04Å; L209-S231 VanDerWaalsContact O-C 3.25Å; L229-S231 PolarHBondContact O-N 3.22Å; L229-S231 VanDerWaalsContact O-N 3.13Å; S231-K233 PolarHBondContact O-N 3.04Å
232	T	96.9	Very high	93.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.			trans	-69.4	126.7	-172.9	-55.4	0	0	0	0	111.6	L209 L229 I234 L235 N254 L255	L209-T232 WeakPolarHBondContact O-CA 3.41Å; L209-T232 PolarHBondContact O-N 2.75Å; L209-T232 VanDerWaalsContact O-N 3.08Å; L209-T232 PolarHBondContact O-OG1 3.28Å; L229-T232 WeakPolarHBondContact CB-OG1 3.46Å; L229-T232 WeakPolarHBondContact O-CB 3.24Å; L229-T232 PolarHBondContact O-N 3.49Å; L229-T232 VanDerWaalsContact O-N 3.16Å; L229-T232 PolarHBondContact O-OG1 3.19Å; T232-I234 WeakPolarHBondContact CG2-O 3.42Å; T232-L235 HydrophobicContact CG2-CB 4.11Å; T232-N254 CarbonylContact O-C 3.5Å; T232-N254 VanDerWaalsContact O-C 3.3Å; T232-L255 HydrophobicContact CG2-CD2 3.94Å; T232-L255 PolarHBondContact O-N 2.9Å
233	K	96.4	Very high	93.6	Very high	76 Å²	76	46.3 Å²	46.3	33%	0.33	25%	0.245	S	C	.	.	S	Bend	trans	-107.5	-37.1	177.1	-62.3	174.2	-174.6	160.3	0	111.3	E210 S231 N254 E256 S257	E210-K233 PolarHBondContact O-N 2.92Å; E210-K233 IonicContact OE2-NZ 3.91Å; E210-K233 PolarHBondContact OE2-NZ 3.03Å; S231-K233 PolarHBondContact O-N 3.04Å; K233-N254 WeakPolarHBondContact CA-O 3.47Å; K233-E256 HydrophobicContact CB-CG 4.5Å; K233-E256 PolarHBondContact O-N 3.36Å; K233-S257 PolarHBondContact O-N 3.16Å
234	I	96.6	Very high	93.6	Very high	34 Å²	34	48 Å²	48	17%	0.174	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.9	-178.4	-53.9	-177.7	0	0	0	108.6	E210 E211 L212 T232 W236 S257	E210-I234 PolarHBondContact O-N 3.33Å; E211-I234 WeakPolarHBondContact CA-O 3.35Å; E211-I234 HydrophobicContact CB-CB 4.39Å; E211-I234 HydrophobicContact CG-CB 4.08Å; E211-I234 HydrophobicContact CG-CD1 4.07Å; E211-I234 HydrophobicContact CG-CG1 4.23Å; L212-I234 PolarHBondContact N-O 3.03Å; T232-I234 WeakPolarHBondContact CG2-O 3.42Å; I234-W236 HydrophobicContact CG2-CD2 4.23Å; I234-W236 VanDerWaalsContact CG2-CE2 3.5Å; I234-W236 HydrophobicContact CG2-CG 4.4Å; I234-W236 HydrophobicContact CG2-CZ2 3.84Å; I234-S257 WeakPolarHBondContact CA-O 3.46Å
235	L	96.9	Very high	93.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	114.4	-179.7	-178.4	57.8	0	0	0	110.8	L212 T232 L237 F249 L252 L255 S257 V258 M259	L212-L235 HydrophobicContact CB-CD1 3.94Å; L212-L235 HydrophobicContact CD2-CD1 3.85Å; L212-L235 HydrophobicContact CG-CD1 3.96Å; L212-L235 WeakPolarHBondContact O-CA 3.25Å; T232-L235 HydrophobicContact CG2-CB 4.11Å; L235-L237 HydrophobicContact CD1-CD1 4.23Å; L235-L237 HydrophobicContact CD1-CD2 4.26Å; L235-L237 HydrophobicContact CD1-CG 4.05Å; L235-L237 HydrophobicContact CD2-CD1 3.95Å; L235-L237 HydrophobicContact CG-CD1 3.88Å; L235-L237 HydrophobicContact CG-CG 3.99Å; L235-F249 HydrophobicContact CD2-CE2 3.58Å; L235-F249 HydrophobicContact CD2-CZ 4.12Å; L235-L252 HydrophobicContact CD2-CD1 4.1Å; L235-L255 HydrophobicContact CB-CD2 3.77Å; L235-S257 PolarHBondContact N-O 3.43Å; L235-V258 WeakPolarHBondContact O-CA 3.25Å; L235-M259 PolarHBondContact O-N 2.9Å
236	W	96.9	Very high	93.9	Very high	48 Å²	48	43.3 Å²	43.3	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.7	-179	-60.3	-16.2	0	0	0	111	R36 L212 D213 L214 I234 M259	R36-W236 HydrophobicContact CB-CH2 3.95Å; R36-W236 HydrophobicContact CB-CZ3 4.32Å; R36-W236 HydrophobicContact CG-CH2 3.76Å; R36-W236 HydrophobicContact CG-CZ3 3.69Å; L212-W236 PolarHBondContact O-N 2.84Å; D213-W236 HydrophobicContact CB-CB 4.08Å; D213-W236 HydrophobicContact CB-CD2 4.49Å; D213-W236 HydrophobicContact CB-CE3 3.77Å; D213-W236 WeakPolarHBondContact OD1-CB 3.29Å; D213-W236 VanDerWaalsContact OD2-CE3 3.29Å; L214-W236 PolarHBondContact N-O 3.4Å; I234-W236 HydrophobicContact CG2-CD2 4.23Å; I234-W236 VanDerWaalsContact CG2-CE2 3.5Å; I234-W236 HydrophobicContact CG2-CG 4.4Å; I234-W236 HydrophobicContact CG2-CZ2 3.84Å; W236-M259 HydrophobicContact CB-CB 4.15Å; W236-M259 HydrophobicContact CB-CG 4.42Å; W236-M259 HydrophobicContact CD2-CG 4.44Å; W236-M259 HydrophobicContact CG-CB 4.03Å; W236-M259 HydrophobicContact CG-CG 3.77Å
237	L	96.6	Very high	93.8	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.25	C	S	.	.			trans	-139.5	36.9	-170.2	-66.9	176.6	0	0	0	110.5	L214 S215 F219 L222 L235 L240 M242 F249 M259 L260 N263	L214-L237 HydrophobicContact CB-CD2 4.07Å; L214-L237 HydrophobicContact CD1-CD2 4.4Å; S215-L237 PolarHBondContact OG-N 2.82Å; F219-L237 HydrophobicContact CZ-CD2 4.29Å; L222-L237 HydrophobicContact CD1-CD1 3.76Å; L222-L237 HydrophobicContact CD2-CD1 4.04Å; L222-L237 HydrophobicContact CD2-CD2 4.26Å; L222-L237 HydrophobicContact CG-CD1 4.44Å; L235-L237 HydrophobicContact CD1-CD1 4.23Å; L235-L237 HydrophobicContact CD1-CD2 4.26Å; L235-L237 HydrophobicContact CD1-CG 4.05Å; L235-L237 HydrophobicContact CD2-CD1 3.95Å; L235-L237 HydrophobicContact CG-CD1 3.88Å; L235-L237 HydrophobicContact CG-CG 3.99Å; L237-L240 HydrophobicContact CB-CD1 3.83Å; L237-L240 HydrophobicContact CD2-CD1 3.85Å; L237-L240 HydrophobicContact CG-CD1 4.45Å; L237-L240 WeakPolarHBondContact O-CD1 3.23Å; L237-M242 HydrophobicContact CB-CE 3.85Å; L237-M242 HydrophobicContact CD1-CE 4.4Å; L237-F249 HydrophobicContact CD1-CE2 4.4Å; L237-M259 CarbonylContact C-O 3.49Å; L237-M259 WeakPolarHBondContact CA-O 3.38Å; L237-M259 PolarHBondContact N-O 3.39Å; L237-L260 HydrophobicContact CB-CD2 4Å; L237-L260 HydrophobicContact CD1-CD2 4.27Å; L237-N263 PolarHBondContact O-ND2 3.17Å
238	S	92.8	Very high	93.8	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.084	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	149.5	-174.9	-50.8	0	0	0	0	111.6	S215 G216 L240 M259 D261	S215-S238 CarbonylContact C-O 3.21Å; S215-S238 WeakPolarHBondContact CA-O 3.36Å; S215-S238 WeakPolarHBondContact CB-O 3.46Å; S215-S238 PolarHBondContact OG-N 2.89Å; S215-S238 VanDerWaalsContact OG-N 3.08Å; G216-S238 PolarHBondContact N-O 3.3Å; S238-L240 PolarHBondContact O-N 3.13Å; S238-M259 WeakPolarHBondContact OG-CB 3.5Å; S238-D261 CarbonylContact C-O 3.01Å; S238-D261 WeakPolarHBondContact CA-O 3.19Å; S238-D261 WeakPolarHBondContact CB-O 3.37Å; S238-D261 VanDerWaalsContact CB-OD1 3.29Å; S238-D261 WeakPolarHBondContact CB-OD1 3.43Å; S238-D261 PolarHBondContact OG-OD1 2.9Å
239	S	92.3	Very high	93.9	Very high	56 Å²	56	40.4 Å²	40.4	39%	0.392	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	38.1	174.2	-58.8	0	0	0	0	115.6	D261 G262	S239-D261 PolarHBondContact N-O 2.97Å; S239-G262 VanDerWaalsContact CA-O 3.3Å; S239-G262 WeakPolarHBondContact CA-O 3.3Å
240	L	91.2	Very high	93.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-100.7	-5.6	-179.7	-69.9	177	0	0	0	114	N217 F219 L237 S238 M242 N263	N217-L240 HydrophobicContact CB-CD2 3.68Å; F219-L240 HydrophobicContact CD1-CD2 4.07Å; F219-L240 HydrophobicContact CD2-CD1 4.28Å; F219-L240 HydrophobicContact CE1-CD1 4.2Å; F219-L240 HydrophobicContact CE1-CD2 3.71Å; F219-L240 HydrophobicContact CE2-CD1 3.47Å; F219-L240 VanDerWaalsContact CE2-CD1 3.47Å; F219-L240 HydrophobicContact CE2-CD2 4.25Å; F219-L240 HydrophobicContact CE2-CG 4.43Å; F219-L240 HydrophobicContact CG-CD2 4.47Å; F219-L240 HydrophobicContact CZ-CD1 3.41Å; F219-L240 VanDerWaalsContact CZ-CD1 3.41Å; F219-L240 HydrophobicContact CZ-CD2 3.81Å; F219-L240 HydrophobicContact CZ-CG 4.27Å; L237-L240 HydrophobicContact CB-CD1 3.83Å; L237-L240 HydrophobicContact CD2-CD1 3.85Å; L237-L240 HydrophobicContact CG-CD1 4.45Å; L237-L240 WeakPolarHBondContact O-CD1 3.23Å; S238-L240 PolarHBondContact O-N 3.13Å; L240-M242 HydrophobicContact CB-CE 4.29Å; L240-M242 HydrophobicContact CB-CG 3.78Å; L240-M242 HydrophobicContact CB-SD 4.36Å; L240-M242 HydrophobicContact CD1-CE 3.95Å; L240-M242 HydrophobicContact CD1-SD 4.09Å; L240-M242 PolarHBondContact O-N 3.25Å; L240-N263 WeakPolarHBondContact CA-OD1 3.46Å; L240-N263 WeakPolarHBondContact CB-OD1 3.24Å; L240-N263 PolarHBondContact N-OD1 3.28Å
241	H	91.1	Very high	94	Very high	112 Å²	112	37.9 Å²	37.9	52%	0.519	21%	0.211	S	C	.	.			trans	59.7	32.2	-174.9	-48.8	73	0	0	0	112.9	Q220 N263 N264	Q220-H241 HydrophobicContact CG-CB 4.44Å; H241-N263 PolarHBondContact N-OD1 3.45Å; H241-N264 VanDerWaalsContact CA-OD1 3.26Å; H241-N264 WeakPolarHBondContact CA-OD1 3.5Å; H241-N264 WeakPolarHBondContact CB-OD1 3.5Å
242	M	93.4	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.			trans	-73.7	136.3	178.2	-63.6	-173.4	-65.8	0	0	111.1	Q220 L222 L237 L240 L245 L260 N263 N264 L265	Q220-M242 WeakPolarHBondContact O-CA 3.18Å; Q220-M242 WeakPolarHBondContact O-CG 3.39Å; L222-M242 HydrophobicContact CD2-SD 4.42Å; L222-M242 HydrophobicContact CG-SD 4.05Å; L237-M242 HydrophobicContact CB-CE 3.85Å; L237-M242 HydrophobicContact CD1-CE 4.4Å; L240-M242 HydrophobicContact CB-CE 4.29Å; L240-M242 HydrophobicContact CB-CG 3.78Å; L240-M242 HydrophobicContact CB-SD 4.36Å; L240-M242 HydrophobicContact CD1-CE 3.95Å; L240-M242 HydrophobicContact CD1-SD 4.09Å; L240-M242 PolarHBondContact O-N 3.25Å; M242-L245 HydrophobicContact CE-CD2 4.45Å; M242-L260 HydrophobicContact CE-CD2 3.91Å; M242-N263 HydrophobicContact CB-CB 4.48Å; M242-N263 PolarHBondContact N-OD1 3.32Å; M242-N263 VanDerWaalsContact N-OD1 3.11Å; M242-N264 CarbonylContact O-C 3.48Å; M242-N264 VanDerWaalsContact O-CA 3.32Å; M242-N264 WeakPolarHBondContact O-CA 3.38Å; M242-N264 PolarHBondContact O-N 3.05Å; M242-L265 PolarHBondContact O-N 3.06Å
243	S	93.3	Very high	93.8	Very high	76 Å²	76	40.4 Å²	40.4	53%	0.531	22%	0.218	S	C	.	.			trans	-95.9	-20.3	177.5	58.5	0	0	0	0	114.1
244	S	94.1	Very high	93.8	Very high	72 Å²	72	39.3 Å²	39.3	50%	0.503	22%	0.216	S	C	.	.			trans	-155.6	161.9	180	58.1	0	0	0	0	112.2
245	L	95.1	Very high	93.8	Very high	11 Å²	11	37.7 Å²	37.7	6%	0.058	21%	0.208	C	C	.	.			trans	-109.1	141.3	170.2	-64.5	174.9	0	0	0	109.7	L222 M242 F249 L260 L265 L268 P269 F272	L222-L245 HydrophobicContact CD1-CD2 3.9Å; M242-L245 HydrophobicContact CE-CD2 4.45Å; L245-F249 HydrophobicContact CD1-CD1 4.35Å; L245-F249 HydrophobicContact CD1-CE1 4.39Å; L245-L260 HydrophobicContact CD1-CD1 3.81Å; L245-L260 HydrophobicContact CD1-CD2 4.48Å; L245-L260 HydrophobicContact CD2-CD2 4.06Å; L245-L265 HydrophobicContact CG-CD2 4.36Å; L245-L268 HydrophobicContact CD1-CD2 4.04Å; L245-P269 HydrophobicContact CB-CG 4.1Å; L245-F272 HydrophobicContact CD1-CE2 4.18Å
246	P	93.7	Very high	93.7	Very high	30 Å²	30	40.8 Å²	40.8	20%	0.195	22%	0.222	C	C	.	.			trans	-71.1	147.6	175.5	29.7	-33.8	0	0	0	111.2	L222 I226 T248 F249	L222-P246 HydrophobicContact CB-CG 4.01Å; I226-P246 HydrophobicContact CG2-CG 4.34Å; P246-T248 PolarHBondContact O-N 3.34Å; P246-T248 VanDerWaalsContact O-N 3.12Å; P246-F249 HydrophobicContact CG-CB 4.29Å; P246-F249 WeakPolarHBondContact O-CB 3.35Å; P246-F249 PolarHBondContact O-N 3.13Å
247	D	90.3	Very high	93.7	Very high	102 Å²	102	39.2 Å²	39.2	55%	0.545	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-57.1	-31.3	177.7	-71.4	-34.5	0	0	0	112.8	F249 C250	D247-F249 PolarHBondContact O-N 3.28Å; D247-C250 WeakPolarHBondContact O-CB 3.4Å; D247-C250 PolarHBondContact O-N 3.05Å; D247-C250 VanDerWaalsContact O-N 3.12Å
248	T	92.9	Very high	93.8	Very high	34 Å²	34	39.1 Å²	39.1	21%	0.209	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-64	-20.7	177.1	54.4	0	0	0	0	113.5	A224 L227 P246 C250 H251	A224-T248 WeakPolarHBondContact O-CB 3.33Å; A224-T248 WeakPolarHBondContact O-CG2 3.48Å; A224-T248 PolarHBondContact O-OG1 3.29Å; L227-T248 HydrophobicContact CD2-CG2 3.89Å; P246-T248 PolarHBondContact O-N 3.34Å; P246-T248 VanDerWaalsContact O-N 3.12Å; T248-C250 PolarHBondContact O-N 3.3Å; T248-H251 WeakPolarHBondContact O-CB 3.22Å; T248-H251 PolarHBondContact O-N 3.12Å; T248-H251 PolarHBondContact O-ND1 3.36Å
249	F	94.6	Very high	93.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-55.5	-35.4	171.9	-176.8	-89.8	0	0	0	112.1	L222 I226 L235 L237 L245 P246 D247 H251 L252 L255 V258 F272 L275	L222-F249 HydrophobicContact CD1-CD2 3.86Å; L222-F249 HydrophobicContact CD1-CE2 4.19Å; I226-F249 HydrophobicContact CG2-CB 4.49Å; L235-F249 HydrophobicContact CD2-CE2 3.58Å; L235-F249 HydrophobicContact CD2-CZ 4.12Å; L237-F249 HydrophobicContact CD1-CE2 4.4Å; L245-F249 HydrophobicContact CD1-CD1 4.35Å; L245-F249 HydrophobicContact CD1-CE1 4.39Å; P246-F249 HydrophobicContact CG-CB 4.29Å; P246-F249 WeakPolarHBondContact O-CB 3.35Å; P246-F249 PolarHBondContact O-N 3.13Å; D247-F249 PolarHBondContact O-N 3.28Å; F249-H251 PolarHBondContact O-N 2.79Å; F249-H251 VanDerWaalsContact O-N 3.09Å; F249-L252 HydrophobicContact CD2-CD1 4.23Å; F249-L252 HydrophobicContact CE2-CD1 4.29Å; F249-L252 WeakPolarHBondContact O-CB 2.95Å; F249-L252 WeakPolarHBondContact O-CG 3.44Å; F249-L252 PolarHBondContact O-N 3.4Å; F249-L255 HydrophobicContact CE1-CD1 4.17Å; F249-L255 HydrophobicContact CZ-CD1 4Å; F249-V258 HydrophobicContact CZ-CG2 3.94Å; F249-F272 HydrophobicContact CD1-CD2 4.33Å; F249-F272 HydrophobicContact CD1-CE2 4.1Å; F249-F272 HydrophobicContact CE1-CD2 4.36Å; F249-F272 AromaticContact CE1-CE2 3.69Å; F249-F272 HydrophobicContact CE1-CE2 3.69Å; F249-L275 HydrophobicContact CD1-CD1 4.29Å; F249-L275 HydrophobicContact CE1-CD1 3.98Å
250	C	93.1	Very high	94.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-69.6	-8.7	-176.2	-51.5	0	0	0	0	113.7	D247 T248 L252 S271 F272 L275	D247-C250 WeakPolarHBondContact O-CB 3.4Å; D247-C250 PolarHBondContact O-N 3.05Å; D247-C250 VanDerWaalsContact O-N 3.12Å; T248-C250 PolarHBondContact O-N 3.3Å; C250-L252 VanDerWaalsContact C-N 3.3Å; C250-S271 WeakPolarHBondContact CB-O 3.24Å; C250-F272 PolarHBondContact SG-N 3.33Å; C250-F272 VanDerWaalsContact SG-N 3.38Å; C250-L275 WeakPolarHBondContact O-CD2 3.49Å
251	H	92.1	Very high	94.3	Very high	89 Å²	89	38.8 Å²	38.8	41%	0.412	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-85.5	-1.4	177.4	-63.3	77.6	0	0	0	113.2	L227 T248 F249 H253	L227-H251 HydrophobicContact CB-CB 4.12Å; T248-H251 WeakPolarHBondContact O-CB 3.22Å; T248-H251 PolarHBondContact O-N 3.12Å; T248-H251 PolarHBondContact O-ND1 3.36Å; F249-H251 PolarHBondContact O-N 2.79Å; F249-H251 VanDerWaalsContact O-N 3.09Å; H251-H253 PolarHBondContact O-CD2 3.48Å; H251-H253 PolarHBondContact O-N 3.36Å
252	L	94.3	Very high	94.2	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	20%	0.197	C	C	.	.			trans	-78.5	61.9	174.4	-59.9	177.3	0	0	0	110.7	I226 L229 L235 F249 C250 N254 L255 L275	I226-L252 HydrophobicContact CG1-CD1 4.39Å; L229-L252 HydrophobicContact CB-CD2 4.15Å; L229-L252 WeakPolarHBondContact O-CD2 3.36Å; L235-L252 HydrophobicContact CD2-CD1 4.1Å; F249-L252 HydrophobicContact CD2-CD1 4.23Å; F249-L252 HydrophobicContact CE2-CD1 4.29Å; F249-L252 WeakPolarHBondContact O-CB 2.95Å; F249-L252 WeakPolarHBondContact O-CG 3.44Å; F249-L252 PolarHBondContact O-N 3.4Å; C250-L252 VanDerWaalsContact C-N 3.3Å; L252-N254 PolarHBondContact O-N 2.85Å; L252-L255 HydrophobicContact CB-CD1 3.57Å; L252-L255 HydrophobicContact CB-CG 3.77Å; L252-L255 HydrophobicContact CD1-CD1 3.93Å; L252-L255 HydrophobicContact CG-CD1 4.41Å; L252-L255 WeakPolarHBondContact O-CB 3.38Å; L252-L255 WeakPolarHBondContact O-CG 2.98Å; L252-L255 PolarHBondContact O-N 3.26Å; L252-L275 VanDerWaalsContact O-CD2 3.28Å; L252-L275 WeakPolarHBondContact O-CD2 3.36Å
253	H	92.6	Very high	94.3	Very high	93 Å²	93	34.8 Å²	34.8	43%	0.431	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.4	-170.1	-56.5	-59.4	0	0	0	115.4	H251 R277	H251-H253 PolarHBondContact O-CD2 3.48Å; H251-H253 PolarHBondContact O-N 3.36Å; H253-R277 WeakPolarHBondContact O-CD 3.49Å
254	N	95.1	Very high	94.4	Very high	53 Å²	53	34.2 Å²	34.2	28%	0.283	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.2	177.9	-72.3	-29.2	0	0	0	113.8	K230 T232 K233 L252 E256 R277	K230-N254 PolarHBondContact O-ND2 2.79Å; T232-N254 CarbonylContact O-C 3.5Å; T232-N254 VanDerWaalsContact O-C 3.3Å; K233-N254 WeakPolarHBondContact CA-O 3.47Å; L252-N254 PolarHBondContact O-N 2.85Å; N254-E256 PolarHBondContact O-N 3.1Å; N254-R277 PolarHBondContact OD1-NH1 2.79Å
255	L	96.5	Very high	94.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.166	C	C	.	.			trans	-60.4	127.3	179	-75.8	174.9	0	0	0	111.4	T232 L235 F249 L252 L275 R277 L278	T232-L255 HydrophobicContact CG2-CD2 3.94Å; T232-L255 PolarHBondContact O-N 2.9Å; L235-L255 HydrophobicContact CB-CD2 3.77Å; F249-L255 HydrophobicContact CE1-CD1 4.17Å; F249-L255 HydrophobicContact CZ-CD1 4Å; L252-L255 HydrophobicContact CB-CD1 3.57Å; L252-L255 HydrophobicContact CB-CG 3.77Å; L252-L255 HydrophobicContact CD1-CD1 3.93Å; L252-L255 HydrophobicContact CG-CD1 4.41Å; L252-L255 WeakPolarHBondContact O-CB 3.38Å; L252-L255 WeakPolarHBondContact O-CG 2.98Å; L252-L255 PolarHBondContact O-N 3.26Å; L255-L275 HydrophobicContact CD1-CD1 4.41Å; L255-L275 HydrophobicContact CD1-CD2 4.42Å; L255-R277 CarbonylContact O-C 3.57Å; L255-R277 WeakPolarHBondContact O-CB 3.36Å; L255-L278 HydrophobicContact CB-CD2 3.83Å; L255-L278 HydrophobicContact CB-CG 4.38Å; L255-L278 WeakPolarHBondContact O-CA 3.33Å; L255-L278 PolarHBondContact O-N 2.8Å; L255-L278 VanDerWaalsContact O-N 3.11Å
256	E	96.6	Very high	94.5	Very high	66 Å²	66	34 Å²	34	31%	0.308	19%	0.186	S	C	.	.			trans	-109.4	-32.8	173.7	-62.8	-169	-145.1	0	0	111.3	K233 N254 K279 M280	K233-E256 HydrophobicContact CB-CG 4.5Å; K233-E256 PolarHBondContact O-N 3.36Å; N254-E256 PolarHBondContact O-N 3.1Å; E256-K279 PolarHBondContact O-N 3.16Å; E256-K279 IonicContact OE2-NZ 2.65Å; E256-K279 PolarHBondContact OE2-NZ 2.96Å; E256-M280 PolarHBondContact O-N 3.21Å; E256-M280 VanDerWaalsContact O-N 3.1Å
257	S	97.1	Very high	94.6	Very high	15 Å²	15	37.2 Å²	37.2	11%	0.105	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	133.4	179.6	-179.7	0	0	0	0	111.5	K233 I234 L235 M280	K233-S257 PolarHBondContact O-N 3.16Å; I234-S257 WeakPolarHBondContact CA-O 3.46Å; L235-S257 PolarHBondContact N-O 3.43Å; S257-M280 WeakPolarHBondContact CA-O 3.26Å
258	V	97.1	Very high	94.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.9	176.5	68.6	0	0	0	0	111.5	L235 F249 L260 L278 M280 I281 N282	L235-V258 WeakPolarHBondContact O-CA 3.25Å; F249-V258 HydrophobicContact CZ-CG2 3.94Å; V258-L260 HydrophobicContact CG2-CD1 3.96Å; V258-L260 HydrophobicContact CG2-CG 3.92Å; V258-L278 HydrophobicContact CB-CD2 4.31Å; V258-L278 HydrophobicContact CG1-CD1 4.43Å; V258-L278 HydrophobicContact CG1-CD2 4Å; V258-M280 PolarHBondContact N-O 2.93Å; V258-I281 HydrophobicContact CG1-CB 4.26Å; V258-I281 HydrophobicContact CG1-CG1 3.93Å; V258-I281 HydrophobicContact CG1-CG2 4.09Å; V258-N282 PolarHBondContact O-N 2.85Å
259	M	95.9	Very high	94.9	Very high	19 Å²	19	32 Å²	32	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119	174	-58	-69	140.2	0	0	109.7	L235 W236 L237 S238 M280 N282	L235-M259 PolarHBondContact O-N 2.9Å; W236-M259 HydrophobicContact CB-CB 4.15Å; W236-M259 HydrophobicContact CB-CG 4.42Å; W236-M259 HydrophobicContact CD2-CG 4.44Å; W236-M259 HydrophobicContact CG-CB 4.03Å; W236-M259 HydrophobicContact CG-CG 3.77Å; L237-M259 CarbonylContact C-O 3.49Å; L237-M259 WeakPolarHBondContact CA-O 3.38Å; L237-M259 PolarHBondContact N-O 3.39Å; S238-M259 WeakPolarHBondContact OG-CB 3.5Å; M259-M280 HydrophobicContact CE-CE 3.27Å; M259-M280 HydrophobicContact CE-CG 3.73Å; M259-M280 HydrophobicContact CE-SD 3.21Å; M259-M280 WeakPolarHBondContact CE-SD 3.43Å; M259-M280 HydrophobicContact SD-CE 4.43Å; M259-N282 HydrophobicContact CE-CB 4.26Å; M259-N282 HydrophobicContact SD-CB 3.36Å; M259-N282 WeakPolarHBondContact SD-CB 3.44Å
260	L	96.9	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.			trans	-130.6	18.7	-178.6	-69.1	165.1	0	0	0	111.3	L237 M242 L245 V258 N263 L265 N282 L283 N286	L237-L260 HydrophobicContact CB-CD2 4Å; L237-L260 HydrophobicContact CD1-CD2 4.27Å; M242-L260 HydrophobicContact CE-CD2 3.91Å; L245-L260 HydrophobicContact CD1-CD1 3.81Å; L245-L260 HydrophobicContact CD1-CD2 4.48Å; L245-L260 HydrophobicContact CD2-CD2 4.06Å; V258-L260 HydrophobicContact CG2-CD1 3.96Å; V258-L260 HydrophobicContact CG2-CG 3.92Å; L260-N263 PolarHBondContact O-ND2 2.72Å; L260-L265 HydrophobicContact CB-CD1 4.11Å; L260-L265 HydrophobicContact CD1-CD1 4.38Å; L260-N282 CarbonylContact C-O 3.25Å; L260-N282 WeakPolarHBondContact CA-O 3.37Å; L260-N282 WeakPolarHBondContact CB-O 3.43Å; L260-N282 PolarHBondContact N-O 3.4Å; L260-L283 HydrophobicContact CB-CD2 4.04Å; L260-L283 HydrophobicContact CD1-CD2 3.92Å; L260-N286 PolarHBondContact O-ND2 3.2Å
261	D	94.3	Very high	94.6	Very high	41 Å²	41	38.8 Å²	38.8	22%	0.219	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	152.4	-176.9	63.3	-72.2	0	0	0	113.2	S238 S239 N263 N282 S284	S238-D261 CarbonylContact C-O 3.01Å; S238-D261 WeakPolarHBondContact CA-O 3.19Å; S238-D261 WeakPolarHBondContact CB-O 3.37Å; S238-D261 VanDerWaalsContact CB-OD1 3.29Å; S238-D261 WeakPolarHBondContact CB-OD1 3.43Å; S238-D261 PolarHBondContact OG-OD1 2.9Å; S239-D261 PolarHBondContact N-O 2.97Å; D261-N263 VanDerWaalsContact C-N 3.34Å; D261-N263 PolarHBondContact O-N 2.98Å; D261-N282 PolarHBondContact N-O 3.02Å; D261-S284 CarbonylContact C-O 3.57Å; D261-S284 WeakPolarHBondContact CA-O 3.36Å; D261-S284 WeakPolarHBondContact CB-O 3.41Å
262	G	90.1	Very high	94.8	Very high	24 Å²	24	34.6 Å²	34.6	25%	0.247	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	27	179.7	0	0	0	0	0	114	S239 S284 S285	S239-G262 VanDerWaalsContact CA-O 3.3Å; S239-G262 WeakPolarHBondContact CA-O 3.3Å; G262-S284 PolarHBondContact N-O 3.37Å; G262-S285 CarbonylContact C-O 3.31Å; G262-S285 WeakPolarHBondContact CA-O 3.41Å; G262-S285 PolarHBondContact N-O 2.95Å
263	N	94.3	Very high	94.7	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.027	21%	0.213	C	C	.	.	S	Bend	trans	-105.4	-170.3	175.1	-75.3	-60.8	0	0	0	110.9	L237 L240 H241 M242 L260 D261 L265 S285 N286	L237-N263 PolarHBondContact O-ND2 3.17Å; L240-N263 WeakPolarHBondContact CA-OD1 3.46Å; L240-N263 WeakPolarHBondContact CB-OD1 3.24Å; L240-N263 PolarHBondContact N-OD1 3.28Å; H241-N263 PolarHBondContact N-OD1 3.45Å; M242-N263 HydrophobicContact CB-CB 4.48Å; M242-N263 PolarHBondContact N-OD1 3.32Å; M242-N263 VanDerWaalsContact N-OD1 3.11Å; L260-N263 PolarHBondContact O-ND2 2.72Å; D261-N263 VanDerWaalsContact C-N 3.34Å; D261-N263 PolarHBondContact O-N 2.98Å; N263-L265 HydrophobicContact CB-CG 4.15Å; N263-S285 PolarHBondContact N-O 3.05Å; N263-N286 WeakPolarHBondContact CA-OD1 3.31Å; N263-N286 WeakPolarHBondContact CB-OD1 3.35Å; N263-N286 PolarHBondContact O-OD1 3.33Å
264	N	95.2	Very high	94.7	Very high	64 Å²	64	35.5 Å²	35.5	34%	0.342	21%	0.213	S	C	.	.			trans	-115.5	32	178.4	-63	100	0	0	0	111.2	H241 M242 N286	H241-N264 VanDerWaalsContact CA-OD1 3.26Å; H241-N264 WeakPolarHBondContact CA-OD1 3.5Å; H241-N264 WeakPolarHBondContact CB-OD1 3.5Å; M242-N264 CarbonylContact O-C 3.48Å; M242-N264 VanDerWaalsContact O-CA 3.32Å; M242-N264 WeakPolarHBondContact O-CA 3.38Å; M242-N264 PolarHBondContact O-N 3.05Å; N264-N286 PolarHBondContact N-OD1 2.95Å
265	L	96.1	Very high	94.7	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.199	C	C	.	.			trans	-70.7	134.9	-178.9	-60	174	0	0	0	110.4	M242 L245 L260 N263 L283 N286 E287 F288	M242-L265 PolarHBondContact O-N 3.06Å; L245-L265 HydrophobicContact CG-CD2 4.36Å; L260-L265 HydrophobicContact CB-CD1 4.11Å; L260-L265 HydrophobicContact CD1-CD1 4.38Å; N263-L265 HydrophobicContact CB-CG 4.15Å; L265-L283 HydrophobicContact CD1-CD2 4.43Å; L265-N286 HydrophobicContact CB-CB 4.41Å; L265-N286 VanDerWaalsContact CB-OD1 3.3Å; L265-N286 WeakPolarHBondContact CB-OD1 3.28Å; L265-N286 WeakPolarHBondContact CG-OD1 3.28Å; L265-N286 PolarHBondContact N-OD1 3.5Å; L265-E287 CarbonylContact O-C 3.42Å; L265-E287 WeakPolarHBondContact O-CA 3.34Å; L265-E287 PolarHBondContact O-N 3.24Å; L265-F288 HydrophobicContact CB-CE2 3.88Å; L265-F288 HydrophobicContact CB-CZ 3.81Å
266	T	95.1	Very high	94.6	Very high	78 Å²	78	37.5 Å²	37.5	48%	0.479	22%	0.22	S	C	.	.			trans	-112.4	-22.3	174.8	56.5	0	0	0	0	112.7	E287 F288	T266-E287 HydrophobicContact CG2-CB 3.85Å; T266-F288 VanDerWaalsContact O-CD1 3.22Å; T266-F288 WeakPolarHBondContact O-CD1 3.3Å
267	V	95.5	Very high	94.6	Very high	97 Å²	97	41.5 Å²	41.5	59%	0.588	23%	0.232	S	C	*	.			trans	-150.6	153	-178	71.4	0	0	0	0	110.5
268	L	96.1	Very high	94.6	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.063	23%	0.227	C	C	.	.			trans	-101.8	147.5	168	-64.2	-178.8	0	0	0	110.4	L245 F272 L283 F288 P292 V295	L245-L268 HydrophobicContact CD1-CD2 4.04Å; L268-F272 HydrophobicContact CB-CB 4.35Å; L268-F272 HydrophobicContact CB-CD2 4.45Å; L268-F272 HydrophobicContact CB-CG 4.32Å; L268-F272 HydrophobicContact CD1-CD1 3.94Å; L268-F272 HydrophobicContact CD1-CD2 4.37Å; L268-F272 HydrophobicContact CD1-CE1 3.98Å; L268-F272 HydrophobicContact CD1-CE2 4.39Å; L268-F272 HydrophobicContact CD1-CG 4.15Å; L268-F272 HydrophobicContact CD1-CZ 4.2Å; L268-F272 HydrophobicContact CD2-CD2 4.43Å; L268-F272 HydrophobicContact CD2-CE2 4.32Å; L268-L283 HydrophobicContact CD1-CD1 3.95Å; L268-L283 HydrophobicContact CD1-CD2 4.48Å; L268-L283 HydrophobicContact CD2-CD2 4.07Å; L268-F288 HydrophobicContact CD2-CZ 4.09Å; L268-F288 HydrophobicContact CG-CE1 4.21Å; L268-F288 HydrophobicContact CG-CZ 4.09Å; L268-P292 HydrophobicContact CD1-CB 3.93Å; L268-P292 HydrophobicContact CG-CB 4.25Å; L268-V295 HydrophobicContact CD1-CG2 3.81Å
269	P	94.2	Very high	94.6	Very high	16 Å²	16	45 Å²	45	10%	0.104	25%	0.246	C	C	.	.			trans	-52.8	143.9	172.7	-27	35.4	0	0	0	112.3	L245 S271 F272	L245-P269 HydrophobicContact CB-CG 4.1Å; P269-S271 PolarHBondContact O-N 3.01Å; P269-F272 WeakPolarHBondContact O-CB 3.09Å; P269-F272 PolarHBondContact O-N 3.21Å
270	S	88.3	Confident	94.7	Very high	106 Å²	106	45.4 Å²	45.4	74%	0.741	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-60.6	-32.2	178.4	55.2	0	0	0	0	112.5	F272	S270-F272 PolarHBondContact O-N 3.44Å
271	S	93.7	Very high	94.7	Very high	36 Å²	36	45.4 Å²	45.4	25%	0.252	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-71.9	-5.7	176.2	-60.1	0	0	0	0	113.7	C250 P269 A273 Q274	C250-S271 WeakPolarHBondContact CB-O 3.24Å; P269-S271 PolarHBondContact O-N 3.01Å; S271-A273 PolarHBondContact O-N 3.03Å; S271-A273 VanDerWaalsContact O-N 3.12Å; S271-Q274 VanDerWaalsContact O-CB 3.25Å; S271-Q274 WeakPolarHBondContact O-CB 3.38Å; S271-Q274 VanDerWaalsContact O-CG 3.27Å; S271-Q274 WeakPolarHBondContact O-CG 3.41Å; S271-Q274 PolarHBondContact O-N 3.27Å
272	F	95.8	Very high	94.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-59.7	-27.1	-179.7	-163.5	-85.7	0	0	0	112.3	L245 F249 C250 L268 P269 S270 Q274 L275 L278 I281 A294 I298	L245-F272 HydrophobicContact CD1-CE2 4.18Å; F249-F272 HydrophobicContact CD1-CD2 4.33Å; F249-F272 HydrophobicContact CD1-CE2 4.1Å; F249-F272 HydrophobicContact CE1-CD2 4.36Å; F249-F272 AromaticContact CE1-CE2 3.69Å; F249-F272 HydrophobicContact CE1-CE2 3.69Å; C250-F272 PolarHBondContact SG-N 3.33Å; C250-F272 VanDerWaalsContact SG-N 3.38Å; L268-F272 HydrophobicContact CB-CB 4.35Å; L268-F272 HydrophobicContact CB-CD2 4.45Å; L268-F272 HydrophobicContact CB-CG 4.32Å; L268-F272 HydrophobicContact CD1-CD1 3.94Å; L268-F272 HydrophobicContact CD1-CD2 4.37Å; L268-F272 HydrophobicContact CD1-CE1 3.98Å; L268-F272 HydrophobicContact CD1-CE2 4.39Å; L268-F272 HydrophobicContact CD1-CG 4.15Å; L268-F272 HydrophobicContact CD1-CZ 4.2Å; L268-F272 HydrophobicContact CD2-CD2 4.43Å; L268-F272 HydrophobicContact CD2-CE2 4.32Å; P269-F272 WeakPolarHBondContact O-CB 3.09Å; P269-F272 PolarHBondContact O-N 3.21Å; S270-F272 PolarHBondContact O-N 3.44Å; F272-Q274 PolarHBondContact O-N 2.92Å; F272-L275 HydrophobicContact CD1-CD1 4.44Å; F272-L275 HydrophobicContact CD2-CD1 4.09Å; F272-L275 HydrophobicContact CE1-CD1 4.31Å; F272-L275 HydrophobicContact CE2-CD1 3.97Å; F272-L275 HydrophobicContact CG-CD1 4.34Å; F272-L275 HydrophobicContact CZ-CD1 4.07Å; F272-L275 PolarHBondContact O-N 3.45Å; F272-L278 HydrophobicContact CE1-CD1 3.98Å; F272-L278 HydrophobicContact CZ-CD1 4.19Å; F272-I281 HydrophobicContact CE1-CD1 4.1Å; F272-A294 HydrophobicContact CB-CB 4.07Å; F272-I298 HydrophobicContact CD1-CD1 4.11Å; F272-I298 HydrophobicContact CE1-CD1 4.12Å
273	A	92.6	Very high	95.2	Very high	23 Å²	23	43.4 Å²	43.4	19%	0.19	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-57.7	-16	171.4	0	0	0	0	0	114.1	S271 L275 Q276	S271-A273 PolarHBondContact O-N 3.03Å; S271-A273 VanDerWaalsContact O-N 3.12Å; A273-L275 VanDerWaalsContact C-N 3.26Å; A273-L275 PolarHBondContact O-N 3.44Å; A273-Q276 PolarHBondContact O-NE2 2.91Å
274	Q	93.3	Very high	95.3	Very high	91 Å²	91	43.8 Å²	43.8	43%	0.425	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-73.2	-14.7	178.1	-66.1	177.3	-2.7	0	0	113.8	S271 F272 Q276	S271-Q274 VanDerWaalsContact O-CB 3.25Å; S271-Q274 WeakPolarHBondContact O-CB 3.38Å; S271-Q274 VanDerWaalsContact O-CG 3.27Å; S271-Q274 WeakPolarHBondContact O-CG 3.41Å; S271-Q274 PolarHBondContact O-N 3.27Å; F272-Q274 PolarHBondContact O-N 2.92Å; Q274-Q276 PolarHBondContact O-N 2.81Å
275	L	95.3	Very high	95.2	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.			trans	-80.4	59.8	-176.9	-61.5	175.6	0	0	0	111.8	F249 C250 L252 L255 F272 A273 R277 L278	F249-L275 HydrophobicContact CD1-CD1 4.29Å; F249-L275 HydrophobicContact CE1-CD1 3.98Å; C250-L275 WeakPolarHBondContact O-CD2 3.49Å; L252-L275 VanDerWaalsContact O-CD2 3.28Å; L252-L275 WeakPolarHBondContact O-CD2 3.36Å; L255-L275 HydrophobicContact CD1-CD1 4.41Å; L255-L275 HydrophobicContact CD1-CD2 4.42Å; F272-L275 HydrophobicContact CD1-CD1 4.44Å; F272-L275 HydrophobicContact CD2-CD1 4.09Å; F272-L275 HydrophobicContact CE1-CD1 4.31Å; F272-L275 HydrophobicContact CE2-CD1 3.97Å; F272-L275 HydrophobicContact CG-CD1 4.34Å; F272-L275 HydrophobicContact CZ-CD1 4.07Å; F272-L275 PolarHBondContact O-N 3.45Å; A273-L275 VanDerWaalsContact C-N 3.26Å; A273-L275 PolarHBondContact O-N 3.44Å; L275-R277 PolarHBondContact O-N 3.14Å; L275-R277 VanDerWaalsContact O-N 3.09Å; L275-L278 HydrophobicContact CB-CD1 3.46Å; L275-L278 VanDerWaalsContact CB-CD1 3.46Å; L275-L278 HydrophobicContact CB-CG 3.86Å; L275-L278 HydrophobicContact CD1-CD1 3.75Å; L275-L278 HydrophobicContact CG-CD1 4.25Å; L275-L278 WeakPolarHBondContact O-CB 3.4Å; L275-L278 PolarHBondContact O-N 3.19Å; L275-L278 VanDerWaalsContact O-N 3.1Å
276	Q	94.3	Very high	95.2	Very high	95 Å²	95	43.2 Å²	43.2	44%	0.444	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-7.4	-170.9	-68.3	-67.5	-42	0	0	115.2	A273 Q274 S297	A273-Q276 PolarHBondContact O-NE2 2.91Å; Q274-Q276 PolarHBondContact O-N 2.81Å; Q276-S297 PolarHBondContact NE2-O 3.29Å
277	R	96.1	Very high	95.2	Very high	149 Å²	149	42.7 Å²	42.7	56%	0.562	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-7	174.4	-69.5	-171	175.4	175.1	-1.8	113.6	H253 N254 L255 L275 K279	H253-R277 WeakPolarHBondContact O-CD 3.49Å; N254-R277 PolarHBondContact OD1-NH1 2.79Å; L255-R277 CarbonylContact O-C 3.57Å; L255-R277 WeakPolarHBondContact O-CB 3.36Å; L275-R277 PolarHBondContact O-N 3.14Å; L275-R277 VanDerWaalsContact O-N 3.09Å; R277-K279 PolarHBondContact O-N 3.32Å
278	L	97.1	Very high	95.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.2	C	C	.	.			trans	-62.5	129	178.5	-79	174.6	0	0	0	110.7	L255 V258 F272 L275 I281 I298 G300 L301	L255-L278 HydrophobicContact CB-CD2 3.83Å; L255-L278 HydrophobicContact CB-CG 4.38Å; L255-L278 WeakPolarHBondContact O-CA 3.33Å; L255-L278 PolarHBondContact O-N 2.8Å; L255-L278 VanDerWaalsContact O-N 3.11Å; V258-L278 HydrophobicContact CB-CD2 4.31Å; V258-L278 HydrophobicContact CG1-CD1 4.43Å; V258-L278 HydrophobicContact CG1-CD2 4Å; F272-L278 HydrophobicContact CE1-CD1 3.98Å; F272-L278 HydrophobicContact CZ-CD1 4.19Å; L275-L278 HydrophobicContact CB-CD1 3.46Å; L275-L278 VanDerWaalsContact CB-CD1 3.46Å; L275-L278 HydrophobicContact CB-CG 3.86Å; L275-L278 HydrophobicContact CD1-CD1 3.75Å; L275-L278 HydrophobicContact CG-CD1 4.25Å; L275-L278 WeakPolarHBondContact O-CB 3.4Å; L275-L278 PolarHBondContact O-N 3.19Å; L275-L278 VanDerWaalsContact O-N 3.1Å; L278-I281 HydrophobicContact CB-CD1 4.45Å; L278-I281 HydrophobicContact CB-CG1 4.43Å; L278-I281 HydrophobicContact CD1-CD1 3.9Å; L278-I281 HydrophobicContact CD1-CG1 4.02Å; L278-I298 HydrophobicContact CB-CG2 3.99Å; L278-I298 HydrophobicContact CD1-CD1 4.08Å; L278-G300 CarbonylContact O-C 3.46Å; L278-L301 HydrophobicContact CB-CD1 4.48Å
279	K	96.6	Very high	95.2	Very high	88 Å²	88	42 Å²	42	38%	0.383	22%	0.22	S	C	.	.			trans	-110.7	-33.8	173.1	-63.8	177	-174	155.6	0	111.4	E256 R277 L301 E302 E303	E256-K279 PolarHBondContact O-N 3.16Å; E256-K279 IonicContact OE2-NZ 2.65Å; E256-K279 PolarHBondContact OE2-NZ 2.96Å; R277-K279 PolarHBondContact O-N 3.32Å; K279-L301 WeakPolarHBondContact O-CD1 3.5Å; K279-E302 WeakPolarHBondContact O-CA 3.44Å; K279-E302 PolarHBondContact O-N 3.35Å; K279-E303 PolarHBondContact O-N 3.08Å
280	M	97.6	Very high	95.2	Very high	28 Å²	28	48.4 Å²	48.4	14%	0.138	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.9	-176.4	-175.7	-172.8	-165.7	0	0	111.1	E256 S257 V258 M259 E303 Y305	E256-M280 PolarHBondContact O-N 3.21Å; E256-M280 VanDerWaalsContact O-N 3.1Å; S257-M280 WeakPolarHBondContact CA-O 3.26Å; V258-M280 PolarHBondContact N-O 2.93Å; M259-M280 HydrophobicContact CE-CE 3.27Å; M259-M280 HydrophobicContact CE-CG 3.73Å; M259-M280 HydrophobicContact CE-SD 3.21Å; M259-M280 WeakPolarHBondContact CE-SD 3.43Å; M259-M280 HydrophobicContact SD-CE 4.43Å; M280-E303 WeakPolarHBondContact CA-O 3.39Å; M280-E303 HydrophobicContact CB-CB 4.25Å; M280-E303 VanDerWaalsContact CE-OE2 3.23Å; M280-E303 WeakPolarHBondContact CE-OE2 3.06Å; M280-E303 HydrophobicContact CG-CB 3.97Å; M280-E303 WeakPolarHBondContact CG-OE2 3.07Å; M280-Y305 HydrophobicContact CE-CD2 4.45Å; M280-Y305 HydrophobicContact CE-CE2 3.63Å; M280-Y305 HydrophobicContact CG-CE2 4.24Å
281	I	97.9	Very high	95.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.4	176	-60.3	169.2	0	0	0	109.1	V258 F272 L278 L283 V295 I298 L301 E303 L304 Y305	V258-I281 HydrophobicContact CG1-CB 4.26Å; V258-I281 HydrophobicContact CG1-CG1 3.93Å; V258-I281 HydrophobicContact CG1-CG2 4.09Å; F272-I281 HydrophobicContact CE1-CD1 4.1Å; L278-I281 HydrophobicContact CB-CD1 4.45Å; L278-I281 HydrophobicContact CB-CG1 4.43Å; L278-I281 HydrophobicContact CD1-CD1 3.9Å; L278-I281 HydrophobicContact CD1-CG1 4.02Å; I281-L283 HydrophobicContact CG2-CD1 3.86Å; I281-L283 HydrophobicContact CG2-CD2 4.42Å; I281-L283 HydrophobicContact CG2-CG 3.74Å; I281-V295 HydrophobicContact CD1-CG1 4.19Å; I281-I298 HydrophobicContact CD1-CD1 3.94Å; I281-L301 HydrophobicContact CB-CD1 4.31Å; I281-L301 HydrophobicContact CD1-CD1 3.54Å; I281-L301 HydrophobicContact CD1-CD2 4.1Å; I281-L301 HydrophobicContact CG1-CD1 3.63Å; I281-E303 PolarHBondContact N-O 3.04Å; I281-L304 HydrophobicContact CB-CD1 4.23Å; I281-L304 HydrophobicContact CG2-CD1 4.35Å; I281-Y305 PolarHBondContact O-N 2.78Å
282	N	97.5	Very high	95.7	Very high	24 Å²	24	42.6 Å²	42.6	13%	0.128	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.6	169.7	-167.6	-5.4	0	0	0	112.1	V258 M259 L260 D261 S284 Y305	V258-N282 PolarHBondContact O-N 2.85Å; M259-N282 HydrophobicContact CE-CB 4.26Å; M259-N282 HydrophobicContact SD-CB 3.36Å; M259-N282 WeakPolarHBondContact SD-CB 3.44Å; L260-N282 CarbonylContact C-O 3.25Å; L260-N282 WeakPolarHBondContact CA-O 3.37Å; L260-N282 WeakPolarHBondContact CB-O 3.43Å; L260-N282 PolarHBondContact N-O 3.4Å; D261-N282 PolarHBondContact N-O 3.02Å; N282-S284 WeakPolarHBondContact OD1-CB 3.27Å; N282-S284 PolarHBondContact OD1-N 2.88Å; N282-S284 PolarHBondContact OD1-OG 3.4Å; N282-Y305 HydrophobicContact CB-CD2 4.1Å; N282-Y305 WeakPolarHBondContact OD1-CB 3.29Å
283	L	97.9	Very high	95.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.			trans	-119.2	17	178.2	-65	165.9	0	0	0	111.4	L260 L265 L268 I281 N286 F288 P292 Y305 L306 N309	L260-L283 HydrophobicContact CB-CD2 4.04Å; L260-L283 HydrophobicContact CD1-CD2 3.92Å; L265-L283 HydrophobicContact CD1-CD2 4.43Å; L268-L283 HydrophobicContact CD1-CD1 3.95Å; L268-L283 HydrophobicContact CD1-CD2 4.48Å; L268-L283 HydrophobicContact CD2-CD2 4.07Å; I281-L283 HydrophobicContact CG2-CD1 3.86Å; I281-L283 HydrophobicContact CG2-CD2 4.42Å; I281-L283 HydrophobicContact CG2-CG 3.74Å; L283-N286 PolarHBondContact O-ND2 3.4Å; L283-F288 HydrophobicContact CB-CE2 4.11Å; L283-F288 HydrophobicContact CD2-CE2 4.13Å; L283-F288 HydrophobicContact CD2-CZ 4.22Å; L283-F288 HydrophobicContact CG-CE2 4.49Å; L283-P292 HydrophobicContact CD1-CG 4.15Å; L283-Y305 CarbonylContact C-O 3.55Å; L283-Y305 WeakPolarHBondContact CA-O 3.2Å; L283-Y305 PolarHBondContact N-O 3.41Å; L283-L306 HydrophobicContact CB-CD2 3.71Å; L283-L306 HydrophobicContact CB-CG 4.44Å; L283-L306 HydrophobicContact CD1-CD2 3.96Å; L283-L306 HydrophobicContact CG-CD2 4.5Å; L283-N309 PolarHBondContact O-ND2 2.93Å
284	S	95.7	Very high	95.7	Very high	12 Å²	12	47.6 Å²	47.6	8%	0.084	23%	0.229	C	C	.	.			trans	-64.6	155.3	-176.6	-55.1	0	0	0	0	112.3	D261 G262 N282 N286 Y305 S307	D261-S284 CarbonylContact C-O 3.57Å; D261-S284 WeakPolarHBondContact CA-O 3.36Å; D261-S284 WeakPolarHBondContact CB-O 3.41Å; G262-S284 PolarHBondContact N-O 3.37Å; N282-S284 WeakPolarHBondContact OD1-CB 3.27Å; N282-S284 PolarHBondContact OD1-N 2.88Å; N282-S284 PolarHBondContact OD1-OG 3.4Å; S284-N286 PolarHBondContact O-N 2.83Å; S284-N286 PolarHBondContact O-ND2 3.37Å; S284-Y305 PolarHBondContact N-O 2.86Å; S284-Y305 WeakPolarHBondContact OG-CB 3.46Å; S284-S307 CarbonylContact C-O 3.46Å; S284-S307 WeakPolarHBondContact CA-O 3.48Å; S284-S307 WeakPolarHBondContact CB-O 3.25Å; S284-S307 PolarHBondContact OG-N 3.23Å
285	S	93.6	Very high	95.8	Very high	48 Å²	48	43.3 Å²	43.3	34%	0.336	21%	0.209	S	C	.	.	S	Bend	trans	53.9	52.8	178.9	-51.6	0	0	0	0	112.7	G262 N263 S307 R308	G262-S285 CarbonylContact C-O 3.31Å; G262-S285 WeakPolarHBondContact CA-O 3.41Å; G262-S285 PolarHBondContact N-O 2.95Å; N263-S285 PolarHBondContact N-O 3.05Å; S285-S307 PolarHBondContact N-O 3.25Å; S285-R308 VanDerWaalsContact CA-O 3.3Å; S285-R308 WeakPolarHBondContact CA-O 3.4Å; S285-R308 PolarHBondContact N-O 2.93Å; S285-R308 WeakPolarHBondContact OG-CD 3.08Å
286	N	96	Very high	95.8	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.027	21%	0.211	C	C	.	.	S	Bend	trans	-123.4	-164.5	173.3	-85	-77.8	0	0	0	109.5	L260 N263 N264 L265 L283 S284 F288 N309	L260-N286 PolarHBondContact O-ND2 3.2Å; N263-N286 WeakPolarHBondContact CA-OD1 3.31Å; N263-N286 WeakPolarHBondContact CB-OD1 3.35Å; N263-N286 PolarHBondContact O-OD1 3.33Å; N264-N286 PolarHBondContact N-OD1 2.95Å; L265-N286 HydrophobicContact CB-CB 4.41Å; L265-N286 VanDerWaalsContact CB-OD1 3.3Å; L265-N286 WeakPolarHBondContact CB-OD1 3.28Å; L265-N286 WeakPolarHBondContact CG-OD1 3.28Å; L265-N286 PolarHBondContact N-OD1 3.5Å; L283-N286 PolarHBondContact O-ND2 3.4Å; S284-N286 PolarHBondContact O-N 2.83Å; S284-N286 PolarHBondContact O-ND2 3.37Å; N286-F288 HydrophobicContact CB-CD2 3.67Å; N286-F288 HydrophobicContact CB-CE2 3.76Å; N286-N309 VanDerWaalsContact CA-OD1 3.29Å; N286-N309 WeakPolarHBondContact CA-OD1 3.46Å; N286-N309 VanDerWaalsContact CB-OD1 3.23Å; N286-N309 WeakPolarHBondContact CB-OD1 3.26Å; N286-N309 PolarHBondContact N-OD1 2.82Å; N286-N309 PolarHBondContact O-OD1 3.03Å; N286-N309 VanDerWaalsContact O-OD1 3.08Å
287	E	95.1	Very high	95.8	Very high	67 Å²	67	41.9 Å²	41.9	31%	0.313	21%	0.209	S	C	.	.			trans	-118	29.4	-174.3	-62.3	-68.9	167.2	0	0	112.1	L265 T266 N289 N309 K310	L265-E287 CarbonylContact O-C 3.42Å; L265-E287 WeakPolarHBondContact O-CA 3.34Å; L265-E287 PolarHBondContact O-N 3.24Å; T266-E287 HydrophobicContact CG2-CB 3.85Å; E287-N289 PolarHBondContact O-N 2.84Å; E287-N309 PolarHBondContact N-OD1 3.07Å; E287-K310 WeakPolarHBondContact OE2-CE 3.4Å; E287-K310 IonicContact OE2-NZ 3.13Å; E287-K310 PolarHBondContact OE2-NZ 2.95Å
288	F	96.4	Very high	95.8	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.009	18%	0.182	C	C	.	.			trans	-69.8	117	179.1	-69.9	-81.7	0	0	0	111.3	L265 T266 L268 L283 N286 P292 N309 K310 L311	L265-F288 HydrophobicContact CB-CE2 3.88Å; L265-F288 HydrophobicContact CB-CZ 3.81Å; T266-F288 VanDerWaalsContact O-CD1 3.22Å; T266-F288 WeakPolarHBondContact O-CD1 3.3Å; L268-F288 HydrophobicContact CD2-CZ 4.09Å; L268-F288 HydrophobicContact CG-CE1 4.21Å; L268-F288 HydrophobicContact CG-CZ 4.09Å; L283-F288 HydrophobicContact CB-CE2 4.11Å; L283-F288 HydrophobicContact CD2-CE2 4.13Å; L283-F288 HydrophobicContact CD2-CZ 4.22Å; L283-F288 HydrophobicContact CG-CE2 4.49Å; N286-F288 HydrophobicContact CB-CD2 3.67Å; N286-F288 HydrophobicContact CB-CE2 3.76Å; F288-P292 HydrophobicContact CE1-CB 4.4Å; F288-N309 HydrophobicContact CB-CB 4.31Å; F288-N309 WeakPolarHBondContact CD2-OD1 3.41Å; F288-N309 PolarHBondContact N-OD1 2.9Å; F288-N309 VanDerWaalsContact N-OD1 3.15Å; F288-K310 CarbonylContact O-C 3.56Å; F288-K310 VanDerWaalsContact O-C 3.24Å; F288-K310 VanDerWaalsContact O-CA 3.31Å; F288-K310 WeakPolarHBondContact O-CA 3.36Å; F288-K310 WeakPolarHBondContact O-CB 3.27Å; F288-K310 PolarHBondContact O-N 3.34Å; F288-L311 HydrophobicContact CB-CD2 3.97Å; F288-L311 PolarHBondContact O-N 3.33Å
289	N	93.8	Very high	95.6	Very high	92 Å²	92	38.2 Å²	38.2	49%	0.492	20%	0.203	S	C	.	.	S	Bend	trans	-86.5	-28.1	172.5	-61.3	-48.9	0	0	0	112.4	E287 K310	E287-N289 PolarHBondContact O-N 2.84Å; N289-K310 WeakPolarHBondContact OD1-CB 3.36Å; N289-K310 WeakPolarHBondContact OD1-CD 3.28Å
290	E	95.2	Very high	95.5	Very high	151 Å²	151	34.6 Å²	34.6	71%	0.706	19%	0.191	S	C	*	.	S	Bend	trans	-124	152.6	179.7	-66.8	-176	-176.1	0	0	110.5	L311	E290-L311 VanDerWaalsContact O-CD2 3.23Å; E290-L311 WeakPolarHBondContact O-CD2 3.36Å
291	F	96.1	Very high	95.5	Very high	9 Å²	9	33.3 Å²	33.3	4%	0.039	19%	0.185	C	C	.	.			trans	-65.5	132.5	178.7	-170	-79.5	0	0	0	110.4	Q293 L296 L304 L306 I314 P315 I318	F291-Q293 PolarHBondContact O-N 3.34Å; F291-L296 HydrophobicContact CD1-CD2 4.18Å; F291-L296 HydrophobicContact CD1-CG 4.38Å; F291-L296 HydrophobicContact CE1-CD2 3.4Å; F291-L296 VanDerWaalsContact CE1-CD2 3.4Å; F291-L296 HydrophobicContact CE1-CG 3.89Å; F291-L296 HydrophobicContact CZ-CD2 3.99Å; F291-L304 HydrophobicContact CE2-CD2 4.32Å; F291-L304 HydrophobicContact CZ-CD2 3.81Å; F291-L306 HydrophobicContact CD2-CD1 4.02Å; F291-L306 HydrophobicContact CE2-CD1 3.51Å; F291-L306 HydrophobicContact CZ-CD1 4.03Å; F291-I314 HydrophobicContact CD2-CG2 4.26Å; F291-I314 HydrophobicContact CE2-CG2 4.3Å; F291-P315 VanDerWaalsContact CB-CD 3.49Å; F291-P315 HydrophobicContact CB-CG 4.1Å; F291-P315 HydrophobicContact CD1-CG 3.73Å; F291-P315 HydrophobicContact CE1-CG 4.38Å; F291-P315 VanDerWaalsContact CG-CD 3.44Å; F291-P315 HydrophobicContact CG-CG 3.92Å; F291-I318 HydrophobicContact CE1-CD1 4.48Å; F291-I318 HydrophobicContact CE2-CD1 4.02Å; F291-I318 HydrophobicContact CZ-CD1 3.62Å
292	P	95.6	Very high	95.4	Very high	11 Å²	11	36.9 Å²	36.9	7%	0.071	20%	0.201	C	C	.	.			trans	-71.1	96.5	-177	29.1	-35.1	0	0	0	111.6	L268 L283 F288 A294 V295 L306	L268-P292 HydrophobicContact CD1-CB 3.93Å; L268-P292 HydrophobicContact CG-CB 4.25Å; L283-P292 HydrophobicContact CD1-CG 4.15Å; F288-P292 HydrophobicContact CE1-CB 4.4Å; P292-A294 PolarHBondContact O-N 3.46Å; P292-A294 VanDerWaalsContact O-N 3.1Å; P292-V295 HydrophobicContact CB-CG2 4.06Å; P292-V295 HydrophobicContact CG-CG2 3.84Å; P292-V295 WeakPolarHBondContact O-CB 3.07Å; P292-V295 PolarHBondContact O-N 3.16Å; P292-L306 HydrophobicContact CG-CD2 4.3Å
293	Q	94.4	Very high	95.5	Very high	111 Å²	111	36.4 Å²	36.4	52%	0.519	20%	0.198	S	C	.	.	H	α-helix	trans	-54.6	-33.6	-174.8	-64.4	-62.3	-39	0	0	113.9	F291 V295 L296	F291-Q293 PolarHBondContact O-N 3.34Å; Q293-V295 PolarHBondContact O-N 3.23Å; Q293-V295 VanDerWaalsContact O-N 3.15Å; Q293-L296 WeakPolarHBondContact O-CB 3.23Å; Q293-L296 PolarHBondContact O-N 3.34Å; Q293-L296 VanDerWaalsContact O-N 3.1Å
294	A	93.9	Very high	95.5	Very high	17 Å²	17	36.4 Å²	36.4	14%	0.14	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-25	179.1	0	0	0	0	0	113.6	F272 P292 L296	F272-A294 HydrophobicContact CB-CB 4.07Å; P292-A294 PolarHBondContact O-N 3.46Å; P292-A294 VanDerWaalsContact O-N 3.1Å; A294-L296 VanDerWaalsContact C-N 3.34Å
295	V	96.4	Very high	95.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.3	-31.1	178.4	177.5	0	0	0	0	111.8	L268 I281 P292 Q293 S297 I298 L301 L304	L268-V295 HydrophobicContact CD1-CG2 3.81Å; I281-V295 HydrophobicContact CD1-CG1 4.19Å; P292-V295 HydrophobicContact CB-CG2 4.06Å; P292-V295 HydrophobicContact CG-CG2 3.84Å; P292-V295 WeakPolarHBondContact O-CB 3.07Å; P292-V295 PolarHBondContact O-N 3.16Å; Q293-V295 PolarHBondContact O-N 3.23Å; Q293-V295 VanDerWaalsContact O-N 3.15Å; V295-S297 PolarHBondContact O-N 2.98Å; V295-S297 VanDerWaalsContact O-N 3.17Å; V295-I298 WeakPolarHBondContact O-CB 3.36Å; V295-I298 PolarHBondContact O-N 2.89Å; V295-L301 HydrophobicContact CG1-CD2 3.76Å; V295-L304 HydrophobicContact CG1-CD1 4.07Å; V295-L304 HydrophobicContact CG1-CD2 4.06Å
296	L	94.9	Very high	95.8	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-26.8	-175.8	-58.6	177.9	0	0	0	113	F291 Q293 A294 I298 P315 I318 Q320	F291-L296 HydrophobicContact CD1-CD2 4.18Å; F291-L296 HydrophobicContact CD1-CG 4.38Å; F291-L296 HydrophobicContact CE1-CD2 3.4Å; F291-L296 VanDerWaalsContact CE1-CD2 3.4Å; F291-L296 HydrophobicContact CE1-CG 3.89Å; F291-L296 HydrophobicContact CZ-CD2 3.99Å; Q293-L296 WeakPolarHBondContact O-CB 3.23Å; Q293-L296 PolarHBondContact O-N 3.34Å; Q293-L296 VanDerWaalsContact O-N 3.1Å; A294-L296 VanDerWaalsContact C-N 3.34Å; L296-I298 VanDerWaalsContact C-N 3.26Å; L296-I298 PolarHBondContact O-N 3.17Å; L296-P315 HydrophobicContact CD1-CB 4.27Å; L296-P315 HydrophobicContact CD1-CG 3.67Å; L296-P315 HydrophobicContact CD2-CG 4.36Å; L296-I318 HydrophobicContact CD2-CB 4.45Å; L296-I318 HydrophobicContact CD2-CD1 4.11Å; L296-Q320 PolarHBondContact O-OE1 2.97Å
297	S	94.1	Very high	95.7	Very high	57 Å²	57	34.5 Å²	34.5	40%	0.399	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-5.7	177.9	-59.4	0	0	0	0	113.9	Q276 V295 T299	Q276-S297 PolarHBondContact NE2-O 3.29Å; V295-S297 PolarHBondContact O-N 2.98Å; V295-S297 VanDerWaalsContact O-N 3.17Å; S297-T299 PolarHBondContact O-N 3.1Å
298	I	95.7	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.			trans	-91.7	73.5	-179.2	-51.3	175.2	0	0	0	108.6	F272 L278 I281 V295 L296 G300 L301 L321	F272-I298 HydrophobicContact CD1-CD1 4.11Å; F272-I298 HydrophobicContact CE1-CD1 4.12Å; L278-I298 HydrophobicContact CB-CG2 3.99Å; L278-I298 HydrophobicContact CD1-CD1 4.08Å; I281-I298 HydrophobicContact CD1-CD1 3.94Å; V295-I298 WeakPolarHBondContact O-CB 3.36Å; V295-I298 PolarHBondContact O-N 2.89Å; L296-I298 VanDerWaalsContact C-N 3.26Å; L296-I298 PolarHBondContact O-N 3.17Å; I298-G300 PolarHBondContact O-N 3.15Å; I298-L301 HydrophobicContact CG2-CB 4.29Å; I298-L301 VanDerWaalsContact O-CB 3.26Å; I298-L301 WeakPolarHBondContact O-CB 3.35Å; I298-L301 PolarHBondContact O-N 2.99Å; I298-L321 VanDerWaalsContact O-CD2 3.28Å; I298-L321 WeakPolarHBondContact O-CD2 3.39Å
299	T	92.5	Very high	95.5	Very high	72 Å²	72	38 Å²	38	44%	0.442	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.5	-174.9	61.9	0	0	0	0	114.4	S297 L301	S297-T299 PolarHBondContact O-N 3.1Å; T299-L301 VanDerWaalsContact C-N 3.32Å
300	G	94.4	Very high	95.6	Very high	13 Å²	13	38 Å²	38	13%	0.134	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.3	173.8	0	0	0	0	0	115.1	L278 I298	L278-G300 CarbonylContact O-C 3.46Å; I298-G300 PolarHBondContact O-N 3.15Å
301	L	97.6	Very high	95.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.			trans	-69.1	132	-170.6	-162.8	71.5	0	0	0	112.3	L278 K279 I281 V295 I298 T299 L304 L321 K323 L324	L278-L301 HydrophobicContact CB-CD1 4.48Å; K279-L301 WeakPolarHBondContact O-CD1 3.5Å; I281-L301 HydrophobicContact CB-CD1 4.31Å; I281-L301 HydrophobicContact CD1-CD1 3.54Å; I281-L301 HydrophobicContact CD1-CD2 4.1Å; I281-L301 HydrophobicContact CG1-CD1 3.63Å; V295-L301 HydrophobicContact CG1-CD2 3.76Å; I298-L301 HydrophobicContact CG2-CB 4.29Å; I298-L301 VanDerWaalsContact O-CB 3.26Å; I298-L301 WeakPolarHBondContact O-CB 3.35Å; I298-L301 PolarHBondContact O-N 2.99Å; T299-L301 VanDerWaalsContact C-N 3.32Å; L301-L304 HydrophobicContact CD2-CB 3.89Å; L301-L304 HydrophobicContact CD2-CD1 4.24Å; L301-L304 HydrophobicContact CD2-CD2 4.34Å; L301-L304 HydrophobicContact CD2-CG 4.38Å; L301-L321 HydrophobicContact CB-CD2 4.33Å; L301-L321 HydrophobicContact CD2-CD1 4.21Å; L301-K323 CarbonylContact O-C 3.6Å; L301-K323 VanDerWaalsContact O-C 3.31Å; L301-K323 WeakPolarHBondContact O-CB 3.37Å; L301-L324 HydrophobicContact CD2-CD1 4.21Å; L301-L324 HydrophobicContact CG-CD1 4.2Å; L301-L324 PolarHBondContact O-N 3.2Å
302	E	97.5	Very high	95.5	Very high	75 Å²	75	33.5 Å²	33.5	35%	0.35	17%	0.173	S	C	.	.			trans	-109.2	-32	-179.6	-67.3	173.1	-174.1	0	0	110.8	K279 K323 V325 N326	K279-E302 WeakPolarHBondContact O-CA 3.44Å; K279-E302 PolarHBondContact O-N 3.35Å; E302-K323 HydrophobicContact CG-CB 4.42Å; E302-V325 PolarHBondContact O-N 3.31Å; E302-N326 PolarHBondContact O-N 3.48Å; E302-N326 VanDerWaalsContact O-N 3.09Å
303	E	97.9	Very high	95.4	Very high	14 Å²	14	36.1 Å²	36.1	7%	0.065	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.3	-176.1	-56.6	-178.5	-172.1	0	0	111.9	W35 K279 M280 I281 Y305 N326	W35-E303 VanDerWaalsContact CH2-OE1 3.26Å; W35-E303 WeakPolarHBondContact CH2-OE1 3.46Å; W35-E303 WeakPolarHBondContact CZ2-OE1 3.22Å; K279-E303 PolarHBondContact O-N 3.08Å; M280-E303 WeakPolarHBondContact CA-O 3.39Å; M280-E303 HydrophobicContact CB-CB 4.25Å; M280-E303 VanDerWaalsContact CE-OE2 3.23Å; M280-E303 WeakPolarHBondContact CE-OE2 3.06Å; M280-E303 HydrophobicContact CG-CB 3.97Å; M280-E303 WeakPolarHBondContact CG-OE2 3.07Å; I281-E303 PolarHBondContact N-O 3.04Å; E303-Y305 HydrophobicContact CB-CE2 3.8Å; E303-Y305 PolarHBondContact OE2-OH 2.86Å; E303-Y305 VanDerWaalsContact OE2-OH 3.1Å; E303-N326 HydrophobicContact CB-CB 4.19Å; E303-N326 HydrophobicContact CG-CB 4.03Å
304	L	98.3	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	116.5	178.9	-178.7	58	0	0	0	111.2	I281 F291 V295 L301 L306 L321 L324 N326 L327 W328	I281-L304 HydrophobicContact CB-CD1 4.23Å; I281-L304 HydrophobicContact CG2-CD1 4.35Å; F291-L304 HydrophobicContact CE2-CD2 4.32Å; F291-L304 HydrophobicContact CZ-CD2 3.81Å; V295-L304 HydrophobicContact CG1-CD1 4.07Å; V295-L304 HydrophobicContact CG1-CD2 4.06Å; L301-L304 HydrophobicContact CD2-CB 3.89Å; L301-L304 HydrophobicContact CD2-CD1 4.24Å; L301-L304 HydrophobicContact CD2-CD2 4.34Å; L301-L304 HydrophobicContact CD2-CG 4.38Å; L304-L306 HydrophobicContact CD1-CD1 4.1Å; L304-L306 HydrophobicContact CD1-CG 4.23Å; L304-L306 HydrophobicContact CD2-CD1 3.92Å; L304-L306 HydrophobicContact CG-CD1 3.97Å; L304-L306 HydrophobicContact CG-CG 4.37Å; L304-L321 HydrophobicContact CD2-CD1 4.33Å; L304-L324 HydrophobicContact CB-CD1 3.9Å; L304-N326 PolarHBondContact N-O 2.99Å; L304-L327 HydrophobicContact CB-CD1 4.24Å; L304-L327 HydrophobicContact CD2-CD1 4.15Å; L304-L327 HydrophobicContact CG-CD1 4.27Å; L304-L327 WeakPolarHBondContact O-CA 3.47Å; L304-W328 PolarHBondContact O-N 3.18Å
305	Y	98	Very high	95.5	Very high	20 Å²	20	31.6 Å²	31.6	8%	0.078	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.2	178.3	-52.4	-82.3	0	0	0	110.6	M280 I281 N282 L283 S284 E303 N326 W328	M280-Y305 HydrophobicContact CE-CD2 4.45Å; M280-Y305 HydrophobicContact CE-CE2 3.63Å; M280-Y305 HydrophobicContact CG-CE2 4.24Å; I281-Y305 PolarHBondContact O-N 2.78Å; N282-Y305 HydrophobicContact CB-CD2 4.1Å; N282-Y305 WeakPolarHBondContact OD1-CB 3.29Å; L283-Y305 CarbonylContact C-O 3.55Å; L283-Y305 WeakPolarHBondContact CA-O 3.2Å; L283-Y305 PolarHBondContact N-O 3.41Å; S284-Y305 PolarHBondContact N-O 2.86Å; S284-Y305 WeakPolarHBondContact OG-CB 3.46Å; E303-Y305 HydrophobicContact CB-CE2 3.8Å; E303-Y305 PolarHBondContact OE2-OH 2.86Å; E303-Y305 VanDerWaalsContact OE2-OH 3.1Å; Y305-N326 HydrophobicContact CE1-CB 4.43Å; Y305-N326 PolarHBondContact OH-ND2 2.91Å; Y305-W328 HydrophobicContact CD1-CB 3.78Å; Y305-W328 AromaticContact CD1-CD2 3.4Å; Y305-W328 HydrophobicContact CD1-CD2 3.4Å; Y305-W328 AromaticContact CD1-CE3 3.49Å; Y305-W328 HydrophobicContact CD1-CE3 3.49Å; Y305-W328 VanDerWaalsContact CD1-CE3 3.49Å; Y305-W328 AromaticContact CD1-CG 3.53Å; Y305-W328 HydrophobicContact CD1-CG 3.53Å; Y305-W328 HydrophobicContact CD1-CZ3 4.16Å; Y305-W328 HydrophobicContact CE1-CB 4.48Å; Y305-W328 AromaticContact CE1-CD2 3.43Å; Y305-W328 HydrophobicContact CE1-CD2 3.43Å; Y305-W328 VanDerWaalsContact CE1-CD2 3.43Å; Y305-W328 AromaticContact CE1-CE2 3.54Å; Y305-W328 AromaticContact CE1-CE3 3.75Å; Y305-W328 HydrophobicContact CE1-CE3 3.75Å; Y305-W328 AromaticContact CE1-CG 3.77Å; Y305-W328 HydrophobicContact CE1-CG 3.77Å; Y305-W328 HydrophobicContact CE1-CH2 4.22Å; Y305-W328 AromaticContact CE1-CZ2 3.95Å; Y305-W328 HydrophobicContact CE1-CZ2 3.95Å; Y305-W328 HydrophobicContact CE1-CZ3 4.12Å; Y305-W328 AromaticContact CE1-NE1 3.87Å
306	L	97.8	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.			trans	-134	18.2	-176.9	-84.2	164.3	0	0	0	111.9	L283 F291 P292 L304 N309 L311 W328 L329 N332	L283-L306 HydrophobicContact CB-CD2 3.71Å; L283-L306 HydrophobicContact CB-CG 4.44Å; L283-L306 HydrophobicContact CD1-CD2 3.96Å; L283-L306 HydrophobicContact CG-CD2 4.5Å; F291-L306 HydrophobicContact CD2-CD1 4.02Å; F291-L306 HydrophobicContact CE2-CD1 3.51Å; F291-L306 HydrophobicContact CZ-CD1 4.03Å; P292-L306 HydrophobicContact CG-CD2 4.3Å; L304-L306 HydrophobicContact CD1-CD1 4.1Å; L304-L306 HydrophobicContact CD1-CG 4.23Å; L304-L306 HydrophobicContact CD2-CD1 3.92Å; L304-L306 HydrophobicContact CG-CD1 3.97Å; L304-L306 HydrophobicContact CG-CG 4.37Å; L306-N309 PolarHBondContact O-ND2 3.46Å; L306-L311 HydrophobicContact CB-CD1 4.16Å; L306-L311 HydrophobicContact CD1-CD1 4.34Å; L306-L311 HydrophobicContact CD2-CD1 4.43Å; L306-W328 CarbonylContact C-O 3.48Å; L306-W328 WeakPolarHBondContact CA-O 3.44Å; L306-W328 PolarHBondContact N-O 3.31Å; L306-L329 HydrophobicContact CB-CD2 3.69Å; L306-L329 HydrophobicContact CD1-CD2 4.12Å; L306-N332 PolarHBondContact O-ND2 2.89Å
307	S	94.9	Very high	95.3	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.042	20%	0.197	C	C	.	.			trans	-58.7	151.5	-179.4	-52.8	0	0	0	0	112.5	S284 S285 N309 W328 D330	S284-S307 CarbonylContact C-O 3.46Å; S284-S307 WeakPolarHBondContact CA-O 3.48Å; S284-S307 WeakPolarHBondContact CB-O 3.25Å; S284-S307 PolarHBondContact OG-N 3.23Å; S285-S307 PolarHBondContact N-O 3.25Å; S307-N309 PolarHBondContact O-N 3.1Å; S307-N309 PolarHBondContact O-ND2 3.29Å; S307-W328 PolarHBondContact N-O 3.47Å; S307-W328 WeakPolarHBondContact OG-CB 3.37Å; S307-D330 CarbonylContact C-O 3.11Å; S307-D330 WeakPolarHBondContact CA-O 3.37Å; S307-D330 WeakPolarHBondContact CB-OD1 3.44Å; S307-D330 PolarHBondContact OG-OD1 2.6Å
308	R	91.6	Very high	95.5	Very high	131 Å²	131	34.6 Å²	34.6	49%	0.494	18%	0.178	S	C	.	.	S	Bend	trans	57.3	48.9	175.2	-56.5	171.7	-176.3	-92.5	-4.3	113	S285 D330 N331	S285-R308 VanDerWaalsContact CA-O 3.3Å; S285-R308 WeakPolarHBondContact CA-O 3.4Å; S285-R308 PolarHBondContact N-O 2.93Å; S285-R308 WeakPolarHBondContact OG-CD 3.08Å; R308-D330 PolarHBondContact N-O 3.27Å; R308-N331 VanDerWaalsContact CA-O 3.26Å; R308-N331 WeakPolarHBondContact CA-O 3.43Å; R308-N331 HydrophobicContact CG-CB 3.85Å
309	N	95.6	Very high	95.4	Very high	11 Å²	11	35.1 Å²	35.1	6%	0.059	18%	0.182	C	C	.	.	S	Bend	trans	-116.6	-162.1	171.2	-83.2	-76	0	0	0	109.4	L283 N286 E287 F288 L306 S307 L311 N332	L283-N309 PolarHBondContact O-ND2 2.93Å; N286-N309 VanDerWaalsContact CA-OD1 3.29Å; N286-N309 WeakPolarHBondContact CA-OD1 3.46Å; N286-N309 VanDerWaalsContact CB-OD1 3.23Å; N286-N309 WeakPolarHBondContact CB-OD1 3.26Å; N286-N309 PolarHBondContact N-OD1 2.82Å; N286-N309 PolarHBondContact O-OD1 3.03Å; N286-N309 VanDerWaalsContact O-OD1 3.08Å; E287-N309 PolarHBondContact N-OD1 3.07Å; F288-N309 HydrophobicContact CB-CB 4.31Å; F288-N309 WeakPolarHBondContact CD2-OD1 3.41Å; F288-N309 PolarHBondContact N-OD1 2.9Å; F288-N309 VanDerWaalsContact N-OD1 3.15Å; L306-N309 PolarHBondContact O-ND2 3.46Å; S307-N309 PolarHBondContact O-N 3.1Å; S307-N309 PolarHBondContact O-ND2 3.29Å; N309-L311 HydrophobicContact CB-CG 4.16Å; N309-N332 WeakPolarHBondContact CA-OD1 3.43Å; N309-N332 WeakPolarHBondContact CB-OD1 3.24Å; N309-N332 PolarHBondContact N-OD1 2.98Å; N309-N332 PolarHBondContact O-OD1 3.38Å
310	K	94.8	Very high	95.5	Very high	93 Å²	93	36.6 Å²	36.6	40%	0.404	18%	0.184	S	C	.	.			trans	-118.4	24.4	179	-66.1	173	175.7	166.7	0	112	E287 F288 N289 T312 N332	E287-K310 WeakPolarHBondContact OE2-CE 3.4Å; E287-K310 IonicContact OE2-NZ 3.13Å; E287-K310 PolarHBondContact OE2-NZ 2.95Å; F288-K310 CarbonylContact O-C 3.56Å; F288-K310 VanDerWaalsContact O-C 3.24Å; F288-K310 VanDerWaalsContact O-CA 3.31Å; F288-K310 WeakPolarHBondContact O-CA 3.36Å; F288-K310 WeakPolarHBondContact O-CB 3.27Å; F288-K310 PolarHBondContact O-N 3.34Å; N289-K310 WeakPolarHBondContact OD1-CB 3.36Å; N289-K310 WeakPolarHBondContact OD1-CD 3.28Å; K310-T312 PolarHBondContact O-N 2.72Å; K310-N332 PolarHBondContact N-OD1 3.1Å
311	L	96.8	Very high	95.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.			trans	-61.5	134.1	-175.8	-60.2	178.1	0	0	0	110.8	F288 E290 L306 N309 L329 N332 N333 I334	F288-L311 HydrophobicContact CB-CD2 3.97Å; F288-L311 PolarHBondContact O-N 3.33Å; E290-L311 VanDerWaalsContact O-CD2 3.23Å; E290-L311 WeakPolarHBondContact O-CD2 3.36Å; L306-L311 HydrophobicContact CB-CD1 4.16Å; L306-L311 HydrophobicContact CD1-CD1 4.34Å; L306-L311 HydrophobicContact CD2-CD1 4.43Å; N309-L311 HydrophobicContact CB-CG 4.16Å; L311-L329 HydrophobicContact CD1-CD2 4.01Å; L311-N332 HydrophobicContact CB-CB 4.22Å; L311-N332 WeakPolarHBondContact CB-OD1 3.19Å; L311-N332 WeakPolarHBondContact CG-OD1 3.26Å; L311-N332 PolarHBondContact N-OD1 3.13Å; L311-N333 CarbonylContact O-C 3.56Å; L311-N333 WeakPolarHBondContact O-CA 3.4Å; L311-N333 WeakPolarHBondContact O-CB 3.39Å; L311-N333 PolarHBondContact O-N 3.3Å; L311-I334 HydrophobicContact CB-CG1 4.17Å; L311-I334 PolarHBondContact O-N 2.94Å; L311-I334 VanDerWaalsContact O-N 3.13Å
312	T	92.6	Very high	95.4	Very high	64 Å²	64	39.9 Å²	39.9	39%	0.393	20%	0.201	S	C	.	.			trans	-101.6	-31.2	179.1	50.6	0	0	0	0	113.5	K310 N333 I334 T335	K310-T312 PolarHBondContact O-N 2.72Å; T312-N333 WeakPolarHBondContact CA-O 3.4Å; T312-N333 HydrophobicContact CG2-CB 4.33Å; T312-I334 CarbonylContact O-C 3.55Å; T312-I334 VanDerWaalsContact O-CA 3.23Å; T312-I334 WeakPolarHBondContact O-CA 3.4Å; T312-T335 PolarHBondContact O-N 3.46Å
313	N	93.3	Very high	95.3	Very high	66 Å²	66	41 Å²	41	35%	0.353	21%	0.205	S	C	.	.			trans	-146.3	159.4	-178.7	-56.3	-43.7	0	0	0	110.4	T335 H336	N313-T335 PolarHBondContact OD1-OG1 3.1Å; N313-H336 PolarHBondContact OD1-CE1 2.75Å; N313-H336 PolarHBondContact OD1-ND1 3.25Å; N313-H336 VanDerWaalsContact OD1-ND1 3.16Å
314	I	95.8	Very high	95.3	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.031	20%	0.202	C	C	.	.			trans	-111.4	132.8	170.9	-51.6	165.6	0	0	0	108	F291 I318 L329 I334 L337 P338 I341	F291-I314 HydrophobicContact CD2-CG2 4.26Å; F291-I314 HydrophobicContact CE2-CG2 4.3Å; I314-I318 HydrophobicContact CG2-CB 4.01Å; I314-I318 HydrophobicContact CG2-CD1 4.38Å; I314-I318 HydrophobicContact CG2-CG1 4.17Å; I314-I318 HydrophobicContact CG2-CG2 4.19Å; I314-L329 HydrophobicContact CD1-CD1 3.42Å; I314-L329 VanDerWaalsContact CD1-CD1 3.42Å; I314-L329 HydrophobicContact CG1-CD1 4.23Å; I314-I334 HydrophobicContact CD1-CD1 4.19Å; I314-I334 HydrophobicContact CG1-CD1 4.09Å; I314-I334 HydrophobicContact CG1-CG2 4.42Å; I314-L337 HydrophobicContact CD1-CD2 3.49Å; I314-L337 VanDerWaalsContact CD1-CD2 3.49Å; I314-P338 HydrophobicContact CB-CG 4.15Å; I314-P338 HydrophobicContact CG2-CG 4.13Å; I314-P338 WeakPolarHBondContact O-CD 3.48Å; I314-P338 WeakPolarHBondContact O-CG 3.33Å; I314-I341 HydrophobicContact CD1-CD1 4.44Å
315	P	95.7	Very high	95.2	Very high	28 Å²	28	42 Å²	42	18%	0.182	21%	0.212	C	C	.	.			trans	-75.6	150.6	-177.9	30.4	-35.8	0	0	0	112.7	F291 L296 G317 I318	F291-P315 VanDerWaalsContact CB-CD 3.49Å; F291-P315 HydrophobicContact CB-CG 4.1Å; F291-P315 HydrophobicContact CD1-CG 3.73Å; F291-P315 HydrophobicContact CE1-CG 4.38Å; F291-P315 VanDerWaalsContact CG-CD 3.44Å; F291-P315 HydrophobicContact CG-CG 3.92Å; L296-P315 HydrophobicContact CD1-CB 4.27Å; L296-P315 HydrophobicContact CD1-CG 3.67Å; L296-P315 HydrophobicContact CD2-CG 4.36Å; P315-G317 PolarHBondContact O-N 3.01Å; P315-I318 WeakPolarHBondContact O-CB 3.31Å; P315-I318 WeakPolarHBondContact O-CG2 3.34Å; P315-I318 PolarHBondContact O-N 3.39Å
316	E	93.9	Very high	95.2	Very high	108 Å²	108	41.6 Å²	41.6	51%	0.505	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-54.5	-27.4	174.7	-69.9	-65.4	156.5	0	0	113.4	I318 A319 P338 D339 S340	E316-I318 PolarHBondContact O-N 3.38Å; E316-A319 PolarHBondContact O-N 3.2Å; E316-P338 VanDerWaalsContact CD-CB 3.49Å; E316-P338 HydrophobicContact CG-CB 4.26Å; E316-P338 VanDerWaalsContact OE1-CB 3.27Å; E316-P338 WeakPolarHBondContact OE1-CB 3.22Å; E316-D339 PolarHBondContact OE1-N 3.06Å; E316-S340 WeakPolarHBondContact CA-OG 3.49Å; E316-S340 PolarHBondContact O-OG 3.21Å; E316-S340 WeakPolarHBondContact OE2-CB 3.48Å; E316-S340 PolarHBondContact OE2-N 3.2Å; E316-S340 PolarHBondContact OE2-OG 3.2Å
317	G	93.9	Very high	95.2	Very high	20 Å²	20	41.6 Å²	41.6	21%	0.206	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-64.3	-8.7	177.3	0	0	0	0	0	114.7	P315 A319 Q320	P315-G317 PolarHBondContact O-N 3.01Å; G317-A319 PolarHBondContact O-N 2.9Å; G317-Q320 VanDerWaalsContact O-CB 3.31Å; G317-Q320 WeakPolarHBondContact O-CB 3.37Å; G317-Q320 WeakPolarHBondContact O-CG 3.43Å; G317-Q320 PolarHBondContact O-N 2.88Å
318	I	96.2	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-55.8	-31.9	175.7	-164.4	71.1	0	0	0	112.4	F291 L296 I314 P315 E316 Q320 L321 P338 L344	F291-I318 HydrophobicContact CE1-CD1 4.48Å; F291-I318 HydrophobicContact CE2-CD1 4.02Å; F291-I318 HydrophobicContact CZ-CD1 3.62Å; L296-I318 HydrophobicContact CD2-CB 4.45Å; L296-I318 HydrophobicContact CD2-CD1 4.11Å; I314-I318 HydrophobicContact CG2-CB 4.01Å; I314-I318 HydrophobicContact CG2-CD1 4.38Å; I314-I318 HydrophobicContact CG2-CG1 4.17Å; I314-I318 HydrophobicContact CG2-CG2 4.19Å; P315-I318 WeakPolarHBondContact O-CB 3.31Å; P315-I318 WeakPolarHBondContact O-CG2 3.34Å; P315-I318 PolarHBondContact O-N 3.39Å; E316-I318 PolarHBondContact O-N 3.38Å; I318-Q320 PolarHBondContact O-N 2.74Å; I318-Q320 VanDerWaalsContact O-N 3.11Å; I318-L321 HydrophobicContact CD1-CD1 3.86Å; I318-L321 WeakPolarHBondContact O-CB 3.44Å; I318-L321 PolarHBondContact O-N 3.03Å; I318-P338 HydrophobicContact CG2-CG 3.92Å; I318-L344 HydrophobicContact CG1-CD1 4.2Å
319	A	93.6	Very high	95.6	Very high	10 Å²	10	36.5 Å²	36.5	8%	0.083	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-62.3	-17.5	177.7	0	0	0	0	0	114.5	E316 G317 L321 V322 E343	E316-A319 PolarHBondContact O-N 3.2Å; G317-A319 PolarHBondContact O-N 2.9Å; A319-L321 PolarHBondContact O-N 3.13Å; A319-V322 VanDerWaalsContact O-CG1 3.3Å; A319-V322 WeakPolarHBondContact O-CG1 3.34Å; A319-E343 HydrophobicContact CB-CB 4.08Å; A319-E343 VanDerWaalsContact CB-OE2 3.28Å; A319-E343 WeakPolarHBondContact CB-OE2 3.35Å
320	Q	94.6	Very high	95.6	Very high	104 Å²	104	36.8 Å²	36.8	49%	0.486	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-65.3	-22.2	174.1	-63.6	178.7	-0.1	0	0	112.4	L296 G317 I318 V322	L296-Q320 PolarHBondContact O-OE1 2.97Å; G317-Q320 VanDerWaalsContact O-CB 3.31Å; G317-Q320 WeakPolarHBondContact O-CB 3.37Å; G317-Q320 WeakPolarHBondContact O-CG 3.43Å; G317-Q320 PolarHBondContact O-N 2.88Å; I318-Q320 PolarHBondContact O-N 2.74Å; I318-Q320 VanDerWaalsContact O-N 3.11Å; Q320-V322 PolarHBondContact O-N 2.99Å
321	L	96.2	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.			trans	-82.5	54.1	179.4	-53.7	-178.1	0	0	0	111.2	I298 L301 L304 I318 A319 K323 L324 L344	I298-L321 VanDerWaalsContact O-CD2 3.28Å; I298-L321 WeakPolarHBondContact O-CD2 3.39Å; L301-L321 HydrophobicContact CB-CD2 4.33Å; L301-L321 HydrophobicContact CD2-CD1 4.21Å; L304-L321 HydrophobicContact CD2-CD1 4.33Å; I318-L321 HydrophobicContact CD1-CD1 3.86Å; I318-L321 WeakPolarHBondContact O-CB 3.44Å; I318-L321 PolarHBondContact O-N 3.03Å; A319-L321 PolarHBondContact O-N 3.13Å; L321-K323 PolarHBondContact O-N 3.22Å; L321-L324 HydrophobicContact CB-CB 4.17Å; L321-L324 WeakPolarHBondContact O-CB 3.26Å; L321-L324 PolarHBondContact O-N 3.07Å; L321-L344 WeakPolarHBondContact O-CD2 3.39Å
322	V	94	Very high	95.4	Very high	82 Å²	82	35.8 Å²	35.8	50%	0.497	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.8	-174.4	-62.1	0	0	0	0	115	A319 Q320	A319-V322 VanDerWaalsContact O-CG1 3.3Å; A319-V322 WeakPolarHBondContact O-CG1 3.34Å; Q320-V322 PolarHBondContact O-N 2.99Å
323	K	96.1	Very high	95.4	Very high	97 Å²	97	36 Å²	36	42%	0.422	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-4.1	174.8	-67.9	-170.9	-175.8	177.6	0	113.5	L301 E302 L321 V325	L301-K323 CarbonylContact O-C 3.6Å; L301-K323 VanDerWaalsContact O-C 3.31Å; L301-K323 WeakPolarHBondContact O-CB 3.37Å; E302-K323 HydrophobicContact CG-CB 4.42Å; L321-K323 PolarHBondContact O-N 3.22Å; K323-V325 WeakPolarHBondContact O-CG2 3.49Å; K323-V325 PolarHBondContact O-N 2.84Å
324	L	97.6	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.			trans	-63.8	126.1	-175.5	-156.6	73.6	0	0	0	110.7	L301 L304 L321 L327 L344 K346 L347	L301-L324 HydrophobicContact CD2-CD1 4.21Å; L301-L324 HydrophobicContact CG-CD1 4.2Å; L301-L324 PolarHBondContact O-N 3.2Å; L304-L324 HydrophobicContact CB-CD1 3.9Å; L321-L324 HydrophobicContact CB-CB 4.17Å; L321-L324 WeakPolarHBondContact O-CB 3.26Å; L321-L324 PolarHBondContact O-N 3.07Å; L324-L327 HydrophobicContact CD2-CB 3.83Å; L324-L327 HydrophobicContact CD2-CD1 4.18Å; L324-L327 HydrophobicContact CD2-CD2 4.19Å; L324-L327 HydrophobicContact CD2-CG 4.28Å; L324-L344 HydrophobicContact CD2-CD1 4.22Å; L324-K346 CarbonylContact O-C 3.49Å; L324-L347 HydrophobicContact CB-CD1 4.4Å; L324-L347 HydrophobicContact CD2-CD1 4.14Å; L324-L347 HydrophobicContact CG-CD1 4.14Å; L324-L347 PolarHBondContact O-N 2.62Å
325	V	97.1	Very high	95.2	Very high	36 Å²	36	35.3 Å²	35.3	22%	0.218	19%	0.189	C	C	.	.			trans	-105.8	-42.4	177.3	-175.3	0	0	0	0	109.3	E302 K323 L347 E348 E349	E302-V325 PolarHBondContact O-N 3.31Å; K323-V325 WeakPolarHBondContact O-CG2 3.49Å; K323-V325 PolarHBondContact O-N 2.84Å; V325-L347 WeakPolarHBondContact O-CD1 3.49Å; V325-E348 HydrophobicContact CG1-CB 3.76Å; V325-E348 HydrophobicContact CG1-CG 3.79Å; V325-E348 PolarHBondContact O-N 2.8Å; V325-E349 PolarHBondContact O-N 3.05Å
326	N	97.6	Very high	94.9	Very high	11 Å²	11	38.4 Å²	38.4	6%	0.059	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.5	-177.8	-61	-11.4	0	0	0	111.6	E302 E303 L304 Y305 E349	E302-N326 PolarHBondContact O-N 3.48Å; E302-N326 VanDerWaalsContact O-N 3.09Å; E303-N326 HydrophobicContact CB-CB 4.19Å; E303-N326 HydrophobicContact CG-CB 4.03Å; L304-N326 PolarHBondContact N-O 2.99Å; Y305-N326 HydrophobicContact CE1-CB 4.43Å; Y305-N326 PolarHBondContact OH-ND2 2.91Å; N326-E349 HydrophobicContact CB-CB 4.35Å; N326-E349 VanDerWaalsContact OD1-CG 3.25Å; N326-E349 WeakPolarHBondContact OD1-CG 3.27Å
327	L	98.1	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	108.1	173.1	-178.9	56.2	0	0	0	110.8	L304 L324 L329 I341 L344 L347 E349 L350 V351	L304-L327 HydrophobicContact CB-CD1 4.24Å; L304-L327 HydrophobicContact CD2-CD1 4.15Å; L304-L327 HydrophobicContact CG-CD1 4.27Å; L304-L327 WeakPolarHBondContact O-CA 3.47Å; L324-L327 HydrophobicContact CD2-CB 3.83Å; L324-L327 HydrophobicContact CD2-CD1 4.18Å; L324-L327 HydrophobicContact CD2-CD2 4.19Å; L324-L327 HydrophobicContact CD2-CG 4.28Å; L327-L329 HydrophobicContact CD1-CD1 3.9Å; L327-L329 HydrophobicContact CD1-CD2 4.41Å; L327-L329 HydrophobicContact CD1-CG 3.95Å; L327-L329 HydrophobicContact CD2-CD1 3.9Å; L327-L329 HydrophobicContact CG-CD1 3.76Å; L327-L329 HydrophobicContact CG-CG 4.13Å; L327-I341 HydrophobicContact CD2-CD1 4.41Å; L327-L344 HydrophobicContact CD2-CD1 4.46Å; L327-L347 HydrophobicContact CB-CD1 3.83Å; L327-L347 HydrophobicContact CB-CD2 4.47Å; L327-E349 PolarHBondContact N-O 2.78Å; L327-L350 HydrophobicContact CB-CD1 4.22Å; L327-L350 HydrophobicContact CD2-CD1 4.09Å; L327-L350 HydrophobicContact CG-CD1 4.19Å; L327-L350 WeakPolarHBondContact O-CA 3.48Å; L327-V351 PolarHBondContact O-N 3.28Å
328	W	98	Very high	95	Very high	31 Å²	31	32.9 Å²	32.9	12%	0.117	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.5	177.4	-62.6	10.1	0	0	0	111.5	N28 L304 Y305 L306 S307 E349 V351	N28-W328 HydrophobicContact CB-CH2 4.39Å; N28-W328 HydrophobicContact CB-CZ3 4.23Å; N28-W328 WeakPolarHBondContact ND2-CZ3 3.49Å; N28-W328 VanDerWaalsContact OD1-CH2 3.29Å; N28-W328 WeakPolarHBondContact OD1-CH2 3.28Å; L304-W328 PolarHBondContact O-N 3.18Å; Y305-W328 HydrophobicContact CD1-CB 3.78Å; Y305-W328 AromaticContact CD1-CD2 3.4Å; Y305-W328 HydrophobicContact CD1-CD2 3.4Å; Y305-W328 AromaticContact CD1-CE3 3.49Å; Y305-W328 HydrophobicContact CD1-CE3 3.49Å; Y305-W328 VanDerWaalsContact CD1-CE3 3.49Å; Y305-W328 AromaticContact CD1-CG 3.53Å; Y305-W328 HydrophobicContact CD1-CG 3.53Å; Y305-W328 HydrophobicContact CD1-CZ3 4.16Å; Y305-W328 HydrophobicContact CE1-CB 4.48Å; Y305-W328 AromaticContact CE1-CD2 3.43Å; Y305-W328 HydrophobicContact CE1-CD2 3.43Å; Y305-W328 VanDerWaalsContact CE1-CD2 3.43Å; Y305-W328 AromaticContact CE1-CE2 3.54Å; Y305-W328 AromaticContact CE1-CE3 3.75Å; Y305-W328 HydrophobicContact CE1-CE3 3.75Å; Y305-W328 AromaticContact CE1-CG 3.77Å; Y305-W328 HydrophobicContact CE1-CG 3.77Å; Y305-W328 HydrophobicContact CE1-CH2 4.22Å; Y305-W328 AromaticContact CE1-CZ2 3.95Å; Y305-W328 HydrophobicContact CE1-CZ2 3.95Å; Y305-W328 HydrophobicContact CE1-CZ3 4.12Å; Y305-W328 AromaticContact CE1-NE1 3.87Å; L306-W328 CarbonylContact C-O 3.48Å; L306-W328 WeakPolarHBondContact CA-O 3.44Å; L306-W328 PolarHBondContact N-O 3.31Å; S307-W328 PolarHBondContact N-O 3.47Å; S307-W328 WeakPolarHBondContact OG-CB 3.37Å; W328-E349 WeakPolarHBondContact CZ2-OE2 3.48Å; W328-E349 PolarHBondContact NE1-OE2 2.91Å; W328-V351 HydrophobicContact CB-CB 4.18Å; W328-V351 HydrophobicContact CD2-CG2 4.4Å; W328-V351 HydrophobicContact CG-CB 3.94Å; W328-V351 HydrophobicContact CG-CG2 4.05Å
329	L	97.3	Very high	94.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.			trans	-139.7	16.2	-173	-67.9	163.9	0	0	0	111.5	L306 L311 I314 L327 N332 I334 V351 L352 N355	L306-L329 HydrophobicContact CB-CD2 3.69Å; L306-L329 HydrophobicContact CD1-CD2 4.12Å; L311-L329 HydrophobicContact CD1-CD2 4.01Å; I314-L329 HydrophobicContact CD1-CD1 3.42Å; I314-L329 VanDerWaalsContact CD1-CD1 3.42Å; I314-L329 HydrophobicContact CG1-CD1 4.23Å; L327-L329 HydrophobicContact CD1-CD1 3.9Å; L327-L329 HydrophobicContact CD1-CD2 4.41Å; L327-L329 HydrophobicContact CD1-CG 3.95Å; L327-L329 HydrophobicContact CD2-CD1 3.9Å; L327-L329 HydrophobicContact CG-CD1 3.76Å; L327-L329 HydrophobicContact CG-CG 4.13Å; L329-N332 PolarHBondContact O-ND2 2.93Å; L329-I334 HydrophobicContact CB-CD1 3.95Å; L329-I334 HydrophobicContact CD1-CD1 4.35Å; L329-I334 HydrophobicContact CD2-CD1 4.27Å; L329-I334 HydrophobicContact CG-CD1 4.45Å; L329-V351 CarbonylContact C-O 3.56Å; L329-V351 WeakPolarHBondContact CA-O 3.43Å; L329-V351 PolarHBondContact N-O 3.01Å; L329-L352 HydrophobicContact CB-CD2 4.04Å; L329-L352 HydrophobicContact CD1-CD2 3.96Å; L329-N355 PolarHBondContact O-ND2 2.97Å
330	D	94.4	Very high	94.8	Very high	16 Å²	16	38 Å²	38	9%	0.086	20%	0.197	C	C	.	.			trans	-61.2	155.4	179.7	58.5	-74.2	0	0	0	112.8	S307 R308 N332 V351 Q353	S307-D330 CarbonylContact C-O 3.11Å; S307-D330 WeakPolarHBondContact CA-O 3.37Å; S307-D330 WeakPolarHBondContact CB-OD1 3.44Å; S307-D330 PolarHBondContact OG-OD1 2.6Å; R308-D330 PolarHBondContact N-O 3.27Å; D330-N332 PolarHBondContact O-ND2 2.93Å; D330-V351 HydrophobicContact CB-CG1 3.75Å; D330-V351 PolarHBondContact N-O 3.01Å; D330-V351 WeakPolarHBondContact OD1-CG1 3.46Å; D330-Q353 CarbonylContact C-O 3.56Å; D330-Q353 WeakPolarHBondContact CA-O 3.22Å; D330-Q353 HydrophobicContact CB-CB 4.22Å; D330-Q353 WeakPolarHBondContact CB-O 3.3Å
331	N	91.4	Very high	94.8	Very high	68 Å²	68	33.1 Å²	33.1	36%	0.364	17%	0.174	S	C	.	.	S	Bend	trans	56.7	51	176.9	-60.2	-68.2	0	0	0	112.2	R308 Q353 G354	R308-N331 VanDerWaalsContact CA-O 3.26Å; R308-N331 WeakPolarHBondContact CA-O 3.43Å; R308-N331 HydrophobicContact CG-CB 3.85Å; N331-Q353 PolarHBondContact N-O 2.78Å; N331-G354 WeakPolarHBondContact CA-O 3.47Å
332	N	95.8	Very high	94.7	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.027	18%	0.177	C	C	.	.	S	Bend	trans	-120.4	-170.1	172.2	-84.8	-80.1	0	0	0	109.6	L306 N309 K310 L311 L329 D330 I334 G354 N355	L306-N332 PolarHBondContact O-ND2 2.89Å; N309-N332 WeakPolarHBondContact CA-OD1 3.43Å; N309-N332 WeakPolarHBondContact CB-OD1 3.24Å; N309-N332 PolarHBondContact N-OD1 2.98Å; N309-N332 PolarHBondContact O-OD1 3.38Å; K310-N332 PolarHBondContact N-OD1 3.1Å; L311-N332 HydrophobicContact CB-CB 4.22Å; L311-N332 WeakPolarHBondContact CB-OD1 3.19Å; L311-N332 WeakPolarHBondContact CG-OD1 3.26Å; L311-N332 PolarHBondContact N-OD1 3.13Å; L329-N332 PolarHBondContact O-ND2 2.93Å; D330-N332 PolarHBondContact O-ND2 2.93Å; N332-I334 HydrophobicContact CB-CD1 4.1Å; N332-I334 HydrophobicContact CB-CG1 3.98Å; N332-G354 PolarHBondContact N-O 2.86Å; N332-G354 VanDerWaalsContact O-O 3.08Å; N332-N355 VanDerWaalsContact CA-OD1 3.29Å; N332-N355 WeakPolarHBondContact CA-OD1 3.17Å; N332-N355 WeakPolarHBondContact CB-OD1 3.13Å; N332-N355 PolarHBondContact N-OD1 3.44Å; N332-N355 PolarHBondContact O-OD1 3.35Å
333	N	93.6	Very high	94.7	Very high	68 Å²	68	35 Å²	35	36%	0.364	18%	0.178	S	C	.	.			trans	-110.4	30.8	175.8	-66.1	-30.5	0	0	0	111.8	L311 T312 T335	L311-N333 CarbonylContact O-C 3.56Å; L311-N333 WeakPolarHBondContact O-CA 3.4Å; L311-N333 WeakPolarHBondContact O-CB 3.39Å; L311-N333 PolarHBondContact O-N 3.3Å; T312-N333 WeakPolarHBondContact CA-O 3.4Å; T312-N333 HydrophobicContact CG2-CB 4.33Å; N333-T335 PolarHBondContact O-N 3.38Å
334	I	96.1	Very high	94.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.			trans	-68.2	123.1	-171.2	-61.5	166.7	0	0	0	109.9	L311 T312 I314 L329 N332 H336 L337 N355 Q356 I357	L311-I334 HydrophobicContact CB-CG1 4.17Å; L311-I334 PolarHBondContact O-N 2.94Å; L311-I334 VanDerWaalsContact O-N 3.13Å; T312-I334 CarbonylContact O-C 3.55Å; T312-I334 VanDerWaalsContact O-CA 3.23Å; T312-I334 WeakPolarHBondContact O-CA 3.4Å; I314-I334 HydrophobicContact CD1-CD1 4.19Å; I314-I334 HydrophobicContact CG1-CD1 4.09Å; I314-I334 HydrophobicContact CG1-CG2 4.42Å; L329-I334 HydrophobicContact CB-CD1 3.95Å; L329-I334 HydrophobicContact CD1-CD1 4.35Å; L329-I334 HydrophobicContact CD2-CD1 4.27Å; L329-I334 HydrophobicContact CG-CD1 4.45Å; N332-I334 HydrophobicContact CB-CD1 4.1Å; N332-I334 HydrophobicContact CB-CG1 3.98Å; I334-H336 VanDerWaalsContact CG2-O 3.24Å; I334-H336 WeakPolarHBondContact CG2-O 3.4Å; I334-L337 HydrophobicContact CG2-CD2 4.41Å; I334-N355 HydrophobicContact CB-CB 4.23Å; I334-N355 VanDerWaalsContact CB-OD1 3.29Å; I334-N355 WeakPolarHBondContact CB-OD1 3.43Å; I334-N355 WeakPolarHBondContact CG1-OD1 3.11Å; I334-N355 PolarHBondContact N-OD1 2.92Å; I334-Q356 CarbonylContact O-C 3.57Å; I334-Q356 VanDerWaalsContact O-CA 3.24Å; I334-Q356 WeakPolarHBondContact O-CA 3.44Å; I334-Q356 PolarHBondContact O-N 3.12Å; I334-I357 HydrophobicContact CB-CG1 4.44Å; I334-I357 HydrophobicContact CG2-CD1 4.31Å; I334-I357 HydrophobicContact CG2-CG1 4.1Å; I334-I357 WeakPolarHBondContact O-CG1 3.34Å; I334-I357 PolarHBondContact O-N 2.88Å
335	T	88.7	Confident	94.4	Very high	58 Å²	58	35.9 Å²	35.9	36%	0.356	18%	0.184	S	C	.	.			trans	-92.9	-30.9	-177.4	62.4	0	0	0	0	113.4	T312 N313 N333 Q356	T312-T335 PolarHBondContact O-N 3.46Å; N313-T335 PolarHBondContact OD1-OG1 3.1Å; N333-T335 PolarHBondContact O-N 3.38Å; T335-Q356 HydrophobicContact CG2-CB 4.37Å
336	H	89.8	Confident	94.3	Very high	93 Å²	93	39 Å²	39	43%	0.431	20%	0.195	S	C	.	.			trans	-150	155.5	178.2	59.9	-79.6	0	0	0	111.1	N313 I334	N313-H336 PolarHBondContact OD1-CE1 2.75Å; N313-H336 PolarHBondContact OD1-ND1 3.25Å; N313-H336 VanDerWaalsContact OD1-ND1 3.16Å; I334-H336 VanDerWaalsContact CG2-O 3.24Å; I334-H336 WeakPolarHBondContact CG2-O 3.4Å
337	L	94.4	Very high	94.3	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.042	19%	0.192	C	C	.	.			trans	-97.9	144.1	168.7	-56.2	174.5	0	0	0	108.8	I314 I334 I341 L352 I357 L360 P361 F364	I314-L337 HydrophobicContact CD1-CD2 3.49Å; I314-L337 VanDerWaalsContact CD1-CD2 3.49Å; I334-L337 HydrophobicContact CG2-CD2 4.41Å; L337-I341 HydrophobicContact CB-CD1 4.46Å; L337-I341 HydrophobicContact CB-CG2 4.31Å; L337-I341 HydrophobicContact CD1-CD1 4.38Å; L337-I341 HydrophobicContact CD2-CD1 4.13Å; L337-L352 HydrophobicContact CD1-CD1 3.69Å; L337-L352 HydrophobicContact CD2-CD1 4.18Å; L337-L352 HydrophobicContact CD2-CD2 4.01Å; L337-I357 HydrophobicContact CD1-CD1 4.46Å; L337-I357 HydrophobicContact CD2-CD1 3.86Å; L337-I357 HydrophobicContact CG-CD1 4.07Å; L337-L360 HydrophobicContact CD1-CD2 3.84Å; L337-P361 HydrophobicContact CB-CG 3.93Å; L337-F364 HydrophobicContact CD1-CE2 3.9Å; L337-F364 HydrophobicContact CD1-CZ 4.27Å
338	P	94.6	Very high	94.2	Very high	4 Å²	4	42.9 Å²	42.9	3%	0.026	21%	0.212	C	C	.	.			trans	-68.4	151.1	173.6	27.8	-34	0	0	0	110.6	I314 E316 I318 S340 I341 P361	I314-P338 HydrophobicContact CB-CG 4.15Å; I314-P338 HydrophobicContact CG2-CG 4.13Å; I314-P338 WeakPolarHBondContact O-CD 3.48Å; I314-P338 WeakPolarHBondContact O-CG 3.33Å; E316-P338 VanDerWaalsContact CD-CB 3.49Å; E316-P338 HydrophobicContact CG-CB 4.26Å; E316-P338 VanDerWaalsContact OE1-CB 3.27Å; E316-P338 WeakPolarHBondContact OE1-CB 3.22Å; I318-P338 HydrophobicContact CG2-CG 3.92Å; P338-S340 PolarHBondContact O-N 2.82Å; P338-I341 HydrophobicContact CG-CB 4.36Å; P338-I341 WeakPolarHBondContact O-CB 3.42Å; P338-I341 WeakPolarHBondContact O-CG2 3.25Å; P338-I341 PolarHBondContact O-N 3.33Å; P338-P361 WeakPolarHBondContact O-CG 3.28Å
339	D	91.1	Very high	94.1	Very high	107 Å²	107	43.2 Å²	43.2	57%	0.572	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-63.9	-32	-179.6	-74.3	-26.1	0	0	0	111.3	E316 I341 V342	E316-D339 PolarHBondContact OE1-N 3.06Å; D339-I341 PolarHBondContact O-N 3.49Å; D339-I341 VanDerWaalsContact O-N 3.17Å; D339-V342 WeakPolarHBondContact O-CG2 3.39Å
340	S	94.3	Very high	94.1	Very high	11 Å²	11	43.2 Å²	43.2	8%	0.077	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-66	-13.6	178.9	75.5	0	0	0	0	114.7	E316 P338 V342 E343	E316-S340 WeakPolarHBondContact CA-OG 3.49Å; E316-S340 PolarHBondContact O-OG 3.21Å; E316-S340 WeakPolarHBondContact OE2-CB 3.48Å; E316-S340 PolarHBondContact OE2-N 3.2Å; E316-S340 PolarHBondContact OE2-OG 3.2Å; P338-S340 PolarHBondContact O-N 2.82Å; S340-V342 PolarHBondContact O-N 3.46Å; S340-E343 VanDerWaalsContact O-CB 3.27Å; S340-E343 WeakPolarHBondContact O-CB 3.34Å; S340-E343 WeakPolarHBondContact O-CG 3.28Å; S340-E343 PolarHBondContact O-N 3.33Å
341	I	95.3	Very high	94.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-58.9	-26.8	179.6	-158	170.1	0	0	0	112.3	I314 L327 L337 P338 D339 E343 L344 P361 F364	I314-I341 HydrophobicContact CD1-CD1 4.44Å; L327-I341 HydrophobicContact CD2-CD1 4.41Å; L337-I341 HydrophobicContact CB-CD1 4.46Å; L337-I341 HydrophobicContact CB-CG2 4.31Å; L337-I341 HydrophobicContact CD1-CD1 4.38Å; L337-I341 HydrophobicContact CD2-CD1 4.13Å; P338-I341 HydrophobicContact CG-CB 4.36Å; P338-I341 WeakPolarHBondContact O-CB 3.42Å; P338-I341 WeakPolarHBondContact O-CG2 3.25Å; P338-I341 PolarHBondContact O-N 3.33Å; D339-I341 PolarHBondContact O-N 3.49Å; D339-I341 VanDerWaalsContact O-N 3.17Å; I341-E343 PolarHBondContact O-N 2.8Å; I341-L344 HydrophobicContact CG1-CD1 4.13Å; I341-L344 WeakPolarHBondContact O-CB 3.24Å; I341-L344 WeakPolarHBondContact O-CG 3.47Å; I341-L344 PolarHBondContact O-N 3.19Å; I341-P361 HydrophobicContact CG2-CG 4.03Å; I341-F364 HydrophobicContact CG2-CE2 4.26Å
342	V	93.9	Very high	94.4	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-71.4	-9.9	179.1	-51.2	0	0	0	0	113.3	D339 S340 L344 P361 F364 K366	D339-V342 WeakPolarHBondContact O-CG2 3.39Å; S340-V342 PolarHBondContact O-N 3.46Å; V342-L344 VanDerWaalsContact C-N 3.28Å; V342-P361 HydrophobicContact CG1-CB 4.08Å; V342-F364 HydrophobicContact CG1-CD2 4.13Å; V342-K366 HydrophobicContact CB-CB 4.4Å; V342-K366 HydrophobicContact CB-CD 4.35Å; V342-K366 HydrophobicContact CG2-CD 4.03Å; V342-K366 WeakPolarHBondContact O-CB 3.48Å
343	E	94.4	Very high	94.3	Very high	111 Å²	111	41 Å²	41	52%	0.519	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-79.2	-10.6	175.5	-58.2	-174.9	170.3	0	0	112.6	A319 S340 I341 E345	A319-E343 HydrophobicContact CB-CB 4.08Å; A319-E343 VanDerWaalsContact CB-OE2 3.28Å; A319-E343 WeakPolarHBondContact CB-OE2 3.35Å; S340-E343 VanDerWaalsContact O-CB 3.27Å; S340-E343 WeakPolarHBondContact O-CB 3.34Å; S340-E343 WeakPolarHBondContact O-CG 3.28Å; S340-E343 PolarHBondContact O-N 3.33Å; I341-E343 PolarHBondContact O-N 2.8Å; E343-E345 PolarHBondContact O-N 3.37Å
344	L	95.4	Very high	94	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.195	C	C	.	.			trans	-78	60.5	176.7	-58.2	178.4	0	0	0	111.7	I318 L321 L324 L327 I341 V342 K346 L347 L367	I318-L344 HydrophobicContact CG1-CD1 4.2Å; L321-L344 WeakPolarHBondContact O-CD2 3.39Å; L324-L344 HydrophobicContact CD2-CD1 4.22Å; L327-L344 HydrophobicContact CD2-CD1 4.46Å; I341-L344 HydrophobicContact CG1-CD1 4.13Å; I341-L344 WeakPolarHBondContact O-CB 3.24Å; I341-L344 WeakPolarHBondContact O-CG 3.47Å; I341-L344 PolarHBondContact O-N 3.19Å; V342-L344 VanDerWaalsContact C-N 3.28Å; L344-K346 PolarHBondContact O-N 3.09Å; L344-L347 HydrophobicContact CB-CB 4.33Å; L344-L347 VanDerWaalsContact O-CB 3.24Å; L344-L347 WeakPolarHBondContact O-CB 3.47Å; L344-L347 PolarHBondContact O-N 3.07Å; L344-L367 HydrophobicContact CB-CD2 4.26Å; L344-L367 VanDerWaalsContact O-CD2 3.25Å; L344-L367 WeakPolarHBondContact O-CD2 3.45Å
345	E	91.6	Very high	93.9	Very high	116 Å²	116	39.1 Å²	39.1	54%	0.542	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.2	-172.5	-64	-176.2	-172.8	0	0	114.8	E343 R369	E343-E345 PolarHBondContact O-N 3.37Å; E345-R369 VanDerWaalsContact O-CD 3.3Å; E345-R369 WeakPolarHBondContact O-CD 3.33Å
346	K	94.9	Very high	93.9	Very high	102 Å²	102	41.1 Å²	41.1	44%	0.443	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-4	176.8	-68.3	-169.2	-176.8	177.7	0	114.1	L324 L344 E348	L324-K346 CarbonylContact O-C 3.49Å; L344-K346 PolarHBondContact O-N 3.09Å; K346-E348 PolarHBondContact O-N 2.82Å
347	L	96.7	Very high	94	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.			trans	-64.7	126	-176.5	-157.2	73.6	0	0	0	110.4	L324 V325 L327 L344 L350 R369 V370	L324-L347 HydrophobicContact CB-CD1 4.4Å; L324-L347 HydrophobicContact CD2-CD1 4.14Å; L324-L347 HydrophobicContact CG-CD1 4.14Å; L324-L347 PolarHBondContact O-N 2.62Å; V325-L347 WeakPolarHBondContact O-CD1 3.49Å; L327-L347 HydrophobicContact CB-CD1 3.83Å; L327-L347 HydrophobicContact CB-CD2 4.47Å; L344-L347 HydrophobicContact CB-CB 4.33Å; L344-L347 VanDerWaalsContact O-CB 3.24Å; L344-L347 WeakPolarHBondContact O-CB 3.47Å; L344-L347 PolarHBondContact O-N 3.07Å; L347-L350 HydrophobicContact CD2-CB 3.71Å; L347-L350 HydrophobicContact CD2-CD1 4.06Å; L347-L350 HydrophobicContact CD2-CD2 4.04Å; L347-L350 HydrophobicContact CD2-CG 4.14Å; L347-R369 CarbonylContact O-C 3.49Å; L347-R369 VanDerWaalsContact O-C 3.25Å; L347-R369 WeakPolarHBondContact O-CB 3.15Å; L347-V370 HydrophobicContact CB-CG2 4.06Å; L347-V370 HydrophobicContact CD2-CG2 4.17Å; L347-V370 HydrophobicContact CG-CG2 4.23Å; L347-V370 VanDerWaalsContact O-CG2 3.28Å; L347-V370 WeakPolarHBondContact O-CG2 3.46Å; L347-V370 PolarHBondContact O-N 3.26Å
348	E	95.9	Very high	93.6	Very high	92 Å²	92	37.5 Å²	37.5	43%	0.43	19%	0.189	S	C	.	.			trans	-108.2	-27.5	176.9	-65.6	-177.8	-169.6	0	0	111.3	V325 K346 V370 N371 I372	V325-E348 HydrophobicContact CG1-CB 3.76Å; V325-E348 HydrophobicContact CG1-CG 3.79Å; V325-E348 PolarHBondContact O-N 2.8Å; K346-E348 PolarHBondContact O-N 2.82Å; E348-V370 CarbonylContact O-C 3.5Å; E348-V370 WeakPolarHBondContact O-CA 3.12Å; E348-N371 PolarHBondContact O-N 3.48Å; E348-I372 PolarHBondContact O-N 2.79Å; E348-I372 VanDerWaalsContact O-N 3.09Å
349	E	96.9	Very high	93.2	Very high	37 Å²	37	41.7 Å²	41.7	17%	0.173	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.2	176.7	-50.4	-169.5	179.4	0	0	111.8	V325 N326 L327 W328 I372	V325-E349 PolarHBondContact O-N 3.05Å; N326-E349 HydrophobicContact CB-CB 4.35Å; N326-E349 VanDerWaalsContact OD1-CG 3.25Å; N326-E349 WeakPolarHBondContact OD1-CG 3.27Å; L327-E349 PolarHBondContact N-O 2.78Å; W328-E349 WeakPolarHBondContact CZ2-OE2 3.48Å; W328-E349 PolarHBondContact NE1-OE2 2.91Å; E349-I372 WeakPolarHBondContact CA-O 3.26Å; E349-I372 HydrophobicContact CB-CB 4.13Å; E349-I372 HydrophobicContact CG-CB 3.91Å; E349-I372 HydrophobicContact CG-CD1 3.8Å; E349-I372 HydrophobicContact CG-CG1 4.27Å; E349-I372 VanDerWaalsContact OE1-CD1 3.29Å; E349-I372 WeakPolarHBondContact OE1-CD1 3.44Å
350	L	97.3	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	110.1	173.7	-177.6	53.6	0	0	0	110.3	L327 L347 L352 F364 L367 V370 I372 W373 K374	L327-L350 HydrophobicContact CB-CD1 4.22Å; L327-L350 HydrophobicContact CD2-CD1 4.09Å; L327-L350 HydrophobicContact CG-CD1 4.19Å; L327-L350 WeakPolarHBondContact O-CA 3.48Å; L347-L350 HydrophobicContact CD2-CB 3.71Å; L347-L350 HydrophobicContact CD2-CD1 4.06Å; L347-L350 HydrophobicContact CD2-CD2 4.04Å; L347-L350 HydrophobicContact CD2-CG 4.14Å; L350-L352 HydrophobicContact CD1-CD1 4.29Å; L350-L352 HydrophobicContact CD1-CD2 4.02Å; L350-L352 HydrophobicContact CD1-CG 3.96Å; L350-L352 HydrophobicContact CD2-CD1 4.23Å; L350-L352 HydrophobicContact CG-CD1 4.13Å; L350-L352 HydrophobicContact CG-CG 4.07Å; L350-F364 HydrophobicContact CD2-CZ 3.93Å; L350-L367 HydrophobicContact CD2-CD1 4.08Å; L350-V370 HydrophobicContact CB-CG1 3.97Å; L350-V370 HydrophobicContact CB-CG2 4.37Å; L350-I372 PolarHBondContact N-O 3.13Å; L350-W373 HydrophobicContact CB-CE3 4.18Å; L350-W373 HydrophobicContact CB-CZ3 4.45Å; L350-W373 HydrophobicContact CD2-CE3 4.15Å; L350-W373 HydrophobicContact CD2-CZ3 3.68Å; L350-W373 HydrophobicContact CG-CE3 4.1Å; L350-W373 HydrophobicContact CG-CZ3 3.87Å; L350-K374 PolarHBondContact O-N 3.3Å; L350-K374 VanDerWaalsContact O-N 3.14Å
351	V	96.8	Very high	93.1	Very high	8 Å²	8	36.6 Å²	36.6	5%	0.048	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	111.9	-175.3	176.2	0	0	0	0	109.5	L327 W328 L329 D330 I372 K374	L327-V351 PolarHBondContact O-N 3.28Å; W328-V351 HydrophobicContact CB-CB 4.18Å; W328-V351 HydrophobicContact CD2-CG2 4.4Å; W328-V351 HydrophobicContact CG-CB 3.94Å; W328-V351 HydrophobicContact CG-CG2 4.05Å; L329-V351 CarbonylContact C-O 3.56Å; L329-V351 WeakPolarHBondContact CA-O 3.43Å; L329-V351 PolarHBondContact N-O 3.01Å; D330-V351 HydrophobicContact CB-CG1 3.75Å; D330-V351 PolarHBondContact N-O 3.01Å; D330-V351 WeakPolarHBondContact OD1-CG1 3.46Å; V351-I372 HydrophobicContact CG2-CG2 4.33Å; V351-K374 HydrophobicContact CB-CB 4.49Å; V351-K374 HydrophobicContact CG1-CB 4.15Å; V351-K374 HydrophobicContact CG1-CD 4.37Å; V351-K374 HydrophobicContact CG2-CB 4.32Å; V351-K374 HydrophobicContact CG2-CD 4.28Å; V351-K374 HydrophobicContact CG2-CG 4.39Å
352	L	96	Very high	92.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.			trans	-125.7	7.4	-173.4	-64.2	177.1	0	0	0	113.3	L329 L337 L350 N355 I357 W373 K374 V375 N378	L329-L352 HydrophobicContact CB-CD2 4.04Å; L329-L352 HydrophobicContact CD1-CD2 3.96Å; L337-L352 HydrophobicContact CD1-CD1 3.69Å; L337-L352 HydrophobicContact CD2-CD1 4.18Å; L337-L352 HydrophobicContact CD2-CD2 4.01Å; L350-L352 HydrophobicContact CD1-CD1 4.29Å; L350-L352 HydrophobicContact CD1-CD2 4.02Å; L350-L352 HydrophobicContact CD1-CG 3.96Å; L350-L352 HydrophobicContact CD2-CD1 4.23Å; L350-L352 HydrophobicContact CG-CD1 4.13Å; L350-L352 HydrophobicContact CG-CG 4.07Å; L352-N355 PolarHBondContact O-ND2 2.52Å; L352-I357 HydrophobicContact CB-CD1 4.17Å; L352-I357 HydrophobicContact CD1-CD1 4.05Å; L352-I357 HydrophobicContact CD2-CD1 4.27Å; L352-I357 HydrophobicContact CG-CD1 4.42Å; L352-W373 HydrophobicContact CD1-CH2 3.91Å; L352-W373 HydrophobicContact CD1-CZ3 3.7Å; L352-W373 HydrophobicContact CG-CZ3 4.41Å; L352-K374 CarbonylContact C-O 3.57Å; L352-K374 WeakPolarHBondContact CA-O 3.44Å; L352-K374 PolarHBondContact N-O 2.74Å; L352-V375 HydrophobicContact CB-CG2 4.37Å; L352-N378 PolarHBondContact O-ND2 3.14Å
353	Q	92.1	Very high	92.4	Very high	36 Å²	36	47.6 Å²	47.6	17%	0.168	24%	0.237	C	C	.	.			trans	-56.9	143.2	-174.7	171.2	171.9	4.4	0	0	112.8	D330 N331 K374 K376 D377	D330-Q353 CarbonylContact C-O 3.56Å; D330-Q353 WeakPolarHBondContact CA-O 3.22Å; D330-Q353 HydrophobicContact CB-CB 4.22Å; D330-Q353 WeakPolarHBondContact CB-O 3.3Å; N331-Q353 PolarHBondContact N-O 2.78Å; Q353-K374 PolarHBondContact N-O 2.82Å; Q353-K374 VanDerWaalsContact N-O 3.14Å; Q353-K376 CarbonylContact C-O 3.58Å; Q353-K376 WeakPolarHBondContact CA-O 3.22Å; Q353-K376 HydrophobicContact CG-CB 4.08Å; Q353-K376 WeakPolarHBondContact CG-O 3.36Å; Q353-D377 HydrophobicContact CG-CB 4.47Å; Q353-D377 PolarHBondContact NE2-OD2 2.9Å
354	G	87.7	Confident	92.3	Very high	19 Å²	19	42.3 Å²	42.3	20%	0.196	21%	0.212	C	C	.	.	S	Bend	trans	70.2	45.7	173.7	0	0	0	0	0	112.9	N331 N332 K376 D377	N331-G354 WeakPolarHBondContact CA-O 3.47Å; N332-G354 PolarHBondContact N-O 2.86Å; N332-G354 VanDerWaalsContact O-O 3.08Å; G354-K376 PolarHBondContact N-O 3.27Å; G354-D377 WeakPolarHBondContact CA-O 3.29Å; G354-D377 PolarHBondContact N-O 3.4Å
355	N	93.9	Very high	91.9	Very high	9 Å²	9	43.2 Å²	43.2	5%	0.048	22%	0.222	C	C	.	.	S	Bend	trans	-121.6	-170.2	174.5	-82.9	-73.4	0	0	0	109.9	L329 N332 I334 L352 I357 D377 N378	L329-N355 PolarHBondContact O-ND2 2.97Å; N332-N355 VanDerWaalsContact CA-OD1 3.29Å; N332-N355 WeakPolarHBondContact CA-OD1 3.17Å; N332-N355 WeakPolarHBondContact CB-OD1 3.13Å; N332-N355 PolarHBondContact N-OD1 3.44Å; N332-N355 PolarHBondContact O-OD1 3.35Å; I334-N355 HydrophobicContact CB-CB 4.23Å; I334-N355 VanDerWaalsContact CB-OD1 3.29Å; I334-N355 WeakPolarHBondContact CB-OD1 3.43Å; I334-N355 WeakPolarHBondContact CG1-OD1 3.11Å; I334-N355 PolarHBondContact N-OD1 2.92Å; L352-N355 PolarHBondContact O-ND2 2.52Å; N355-I357 HydrophobicContact CB-CD1 4.16Å; N355-I357 HydrophobicContact CB-CG1 4.09Å; N355-D377 PolarHBondContact N-O 3.2Å; N355-D377 VanDerWaalsContact O-O 3.14Å; N355-N378 VanDerWaalsContact CA-OD1 3.31Å; N355-N378 WeakPolarHBondContact CA-OD1 3.23Å; N355-N378 WeakPolarHBondContact CB-OD1 3.1Å; N355-N378 PolarHBondContact N-OD1 3.01Å; N355-N378 PolarHBondContact O-OD1 3.03Å
356	Q	88.7	Confident	91.9	Very high	99 Å²	99	42.5 Å²	42.5	46%	0.463	22%	0.217	S	C	.	.			trans	-114.6	29.2	-179.8	-61	176.9	37.8	0	0	111.5	I334 T335 A358 N378	I334-Q356 CarbonylContact O-C 3.57Å; I334-Q356 VanDerWaalsContact O-CA 3.24Å; I334-Q356 WeakPolarHBondContact O-CA 3.44Å; I334-Q356 PolarHBondContact O-N 3.12Å; T335-Q356 HydrophobicContact CG2-CB 4.37Å; Q356-A358 PolarHBondContact O-N 3.29Å; Q356-N378 PolarHBondContact N-OD1 2.93Å
357	I	91.8	Very high	91.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.			trans	-74.6	119.7	-175.5	-57.8	167.4	0	0	0	109.6	I334 L337 L352 N355 L360 N378 P379 L380	I334-I357 HydrophobicContact CB-CG1 4.44Å; I334-I357 HydrophobicContact CG2-CD1 4.31Å; I334-I357 HydrophobicContact CG2-CG1 4.1Å; I334-I357 WeakPolarHBondContact O-CG1 3.34Å; I334-I357 PolarHBondContact O-N 2.88Å; L337-I357 HydrophobicContact CD1-CD1 4.46Å; L337-I357 HydrophobicContact CD2-CD1 3.86Å; L337-I357 HydrophobicContact CG-CD1 4.07Å; L352-I357 HydrophobicContact CB-CD1 4.17Å; L352-I357 HydrophobicContact CD1-CD1 4.05Å; L352-I357 HydrophobicContact CD2-CD1 4.27Å; L352-I357 HydrophobicContact CG-CD1 4.42Å; N355-I357 HydrophobicContact CB-CD1 4.16Å; N355-I357 HydrophobicContact CB-CG1 4.09Å; I357-L360 HydrophobicContact CG2-CD2 3.97Å; I357-N378 HydrophobicContact CB-CB 4.48Å; I357-N378 WeakPolarHBondContact CB-OD1 3.45Å; I357-N378 PolarHBondContact N-OD1 3.49Å; I357-P379 CarbonylContact O-C 3.52Å; I357-P379 WeakPolarHBondContact O-CD 3.24Å; I357-L380 HydrophobicContact CG2-CD2 4.21Å; I357-L380 PolarHBondContact O-N 2.98Å
358	A	85.4	Confident	91.4	Very high	25 Å²	25	41.6 Å²	41.6	21%	0.207	22%	0.224	C	C	.	.			trans	-99.6	-32.8	177.7	0	0	0	0	0	113.1	Q356 P379 I381 Q382	Q356-A358 PolarHBondContact O-N 3.29Å; A358-P379 WeakPolarHBondContact CA-O 3.45Å; A358-I381 HydrophobicContact CB-CD1 3.84Å; A358-I381 HydrophobicContact CB-CG1 4.13Å; A358-I381 WeakPolarHBondContact O-CA 3.46Å; A358-I381 WeakPolarHBondContact O-CB 3.35Å; A358-I381 PolarHBondContact O-N 3.48Å; A358-Q382 PolarHBondContact O-N 2.91Å; A358-Q382 VanDerWaalsContact O-N 3.17Å
359	I	87.4	Confident	91.3	Very high	93 Å²	93	43.9 Å²	43.9	48%	0.477	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-132.7	133.4	-174.9	-57.5	175.5	0	0	0	108.9	Q382	I359-Q382 CarbonylContact C-O 3.53Å; I359-Q382 VanDerWaalsContact CA-O 3.32Å; I359-Q382 WeakPolarHBondContact CA-O 3.26Å; I359-Q382 HydrophobicContact CG1-CB 4.43Å; I359-Q382 HydrophobicContact CG2-CB 4.38Å
360	L	91.3	Very high	91.1	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-91.5	142.3	169.4	-58.8	-177.4	0	0	0	110.1	L337 I357 F364 W373 L380 Q382 I395	L337-L360 HydrophobicContact CD1-CD2 3.84Å; I357-L360 HydrophobicContact CG2-CD2 3.97Å; L360-F364 HydrophobicContact CB-CD2 4.14Å; L360-F364 HydrophobicContact CB-CE2 4.4Å; L360-F364 HydrophobicContact CB-CG 4.41Å; L360-F364 HydrophobicContact CD1-CD1 4.28Å; L360-F364 HydrophobicContact CD1-CE1 4.2Å; L360-F364 HydrophobicContact CD1-CZ 4.41Å; L360-F364 HydrophobicContact CD2-CE2 4.39Å; L360-F364 HydrophobicContact CD2-CZ 4.39Å; L360-W373 HydrophobicContact CD1-CH2 4.23Å; L360-W373 HydrophobicContact CD1-CZ2 4.21Å; L360-W373 HydrophobicContact CD2-CH2 4.48Å; L360-L380 HydrophobicContact CD2-CD2 4.25Å; L360-L380 HydrophobicContact CG-CD2 4.28Å; L360-Q382 PolarHBondContact N-O 3.46Å; L360-I395 HydrophobicContact CD1-CD1 3.83Å
361	P	91.4	Very high	90.8	Very high	7 Å²	7	49.2 Å²	49.2	5%	0.045	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-53.2	154.6	177.3	-30.6	36.3	0	0	0	114.5	L337 P338 I341 V342 F364 Q399	L337-P361 HydrophobicContact CB-CG 3.93Å; P338-P361 WeakPolarHBondContact O-CG 3.28Å; I341-P361 HydrophobicContact CG2-CG 4.03Å; V342-P361 HydrophobicContact CG1-CB 4.08Å; P361-F364 HydrophobicContact CB-CD2 4.46Å; P361-F364 HydrophobicContact CG-CD2 4.48Å; P361-F364 WeakPolarHBondContact O-CB 3.49Å; P361-Q399 PolarHBondContact O-NE2 3.24Å
362	D	86.4	Confident	90.5	Very high	109 Å²	109	52.2 Å²	52.2	58%	0.583	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	153.6	172.4	-75.3	-29.1	0	0	0	111.6	F364	D362-F364 PolarHBondContact O-N 2.93Å
363	H	88.6	Confident	90.3	Very high	132 Å²	132	54 Å²	54	61%	0.611	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	25.8	-177.6	-52.6	-71.1	0	0	0	114.6	G365 K366	H363-G365 PolarHBondContact O-N 3.31Å; H363-K366 HydrophobicContact CB-CD 4.42Å; H363-K366 HydrophobicContact CB-CG 4.44Å; H363-K366 WeakPolarHBondContact O-CB 3.47Å; H363-K366 WeakPolarHBondContact O-CG 3.13Å; H363-K366 PolarHBondContact O-N 2.9Å
364	F	91.9	Very high	90.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.5	-24.7	177.8	-153	-99.5	0	0	0	112.9	L337 I341 V342 L350 L360 P361 D362 K366 L367 W373 I392 I395	L337-F364 HydrophobicContact CD1-CE2 3.9Å; L337-F364 HydrophobicContact CD1-CZ 4.27Å; I341-F364 HydrophobicContact CG2-CE2 4.26Å; V342-F364 HydrophobicContact CG1-CD2 4.13Å; L350-F364 HydrophobicContact CD2-CZ 3.93Å; L360-F364 HydrophobicContact CB-CD2 4.14Å; L360-F364 HydrophobicContact CB-CE2 4.4Å; L360-F364 HydrophobicContact CB-CG 4.41Å; L360-F364 HydrophobicContact CD1-CD1 4.28Å; L360-F364 HydrophobicContact CD1-CE1 4.2Å; L360-F364 HydrophobicContact CD1-CZ 4.41Å; L360-F364 HydrophobicContact CD2-CE2 4.39Å; L360-F364 HydrophobicContact CD2-CZ 4.39Å; P361-F364 HydrophobicContact CB-CD2 4.46Å; P361-F364 HydrophobicContact CG-CD2 4.48Å; P361-F364 WeakPolarHBondContact O-CB 3.49Å; D362-F364 PolarHBondContact O-N 2.93Å; F364-K366 PolarHBondContact O-N 2.73Å; F364-K366 VanDerWaalsContact O-N 3.09Å; F364-L367 HydrophobicContact CD2-CD1 4.47Å; F364-L367 HydrophobicContact CE1-CD1 4.19Å; F364-L367 HydrophobicContact CE2-CD1 4.11Å; F364-L367 HydrophobicContact CZ-CD1 3.96Å; F364-L367 WeakPolarHBondContact O-CB 3.22Å; F364-L367 PolarHBondContact O-N 2.73Å; F364-L367 VanDerWaalsContact O-N 3.13Å; F364-W373 AromaticContact CE1-CH2 3.82Å; F364-W373 HydrophobicContact CE1-CH2 3.82Å; F364-W373 HydrophobicContact CE1-CZ2 4.46Å; F364-W373 AromaticContact CE1-CZ3 3.98Å; F364-W373 HydrophobicContact CE1-CZ3 3.98Å; F364-W373 AromaticContact CZ-CH2 3.93Å; F364-W373 HydrophobicContact CZ-CH2 3.93Å; F364-W373 HydrophobicContact CZ-CZ3 4.01Å; F364-I392 HydrophobicContact CD1-CD1 4.2Å; F364-I392 HydrophobicContact CD1-CG1 4.34Å; F364-I392 HydrophobicContact CD1-CG2 4.32Å; F364-I392 HydrophobicContact CE1-CD1 3.81Å; F364-I392 HydrophobicContact CE1-CG1 4.18Å; F364-I392 WeakPolarHBondContact O-CG2 3.24Å; F364-I395 HydrophobicContact CB-CG2 3.83Å; F364-I395 HydrophobicContact CD1-CD1 4.21Å; F364-I395 HydrophobicContact CD1-CG2 4.04Å; F364-I395 HydrophobicContact CE1-CD1 4.49Å; F364-I395 HydrophobicContact CG-CG2 4.29Å
365	G	87.8	Confident	90.6	Very high	20 Å²	20	54.3 Å²	54.3	21%	0.206	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-55.7	-17.6	171.3	0	0	0	0	0	116.5	H363 L367 S368 A396	H363-G365 PolarHBondContact O-N 3.31Å; G365-L367 PolarHBondContact O-N 2.98Å; G365-S368 PolarHBondContact O-N 3.45Å; G365-A396 VanDerWaalsContact CA-CB 3.44Å
366	K	91.4	Very high	90.1	Very high	101 Å²	101	58.6 Å²	58.6	44%	0.439	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-59.6	-29.7	173.1	-74.7	-178.6	177.6	-177.6	0	112.3	V342 H363 F364 S368	V342-K366 HydrophobicContact CB-CB 4.4Å; V342-K366 HydrophobicContact CB-CD 4.35Å; V342-K366 HydrophobicContact CG2-CD 4.03Å; V342-K366 WeakPolarHBondContact O-CB 3.48Å; H363-K366 HydrophobicContact CB-CD 4.42Å; H363-K366 HydrophobicContact CB-CG 4.44Å; H363-K366 WeakPolarHBondContact O-CB 3.47Å; H363-K366 WeakPolarHBondContact O-CG 3.13Å; H363-K366 PolarHBondContact O-N 2.9Å; F364-K366 PolarHBondContact O-N 2.73Å; F364-K366 VanDerWaalsContact O-N 3.09Å; K366-S368 PolarHBondContact O-N 3.05Å
367	L	93.2	Very high	89.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	30%	0.295	C	S	.	.			trans	-75	38.9	175.7	-58.2	179.8	0	0	0	112.6	L344 L350 F364 G365 R369 V370 I392	L344-L367 HydrophobicContact CB-CD2 4.26Å; L344-L367 VanDerWaalsContact O-CD2 3.25Å; L344-L367 WeakPolarHBondContact O-CD2 3.45Å; L350-L367 HydrophobicContact CD2-CD1 4.08Å; F364-L367 HydrophobicContact CD2-CD1 4.47Å; F364-L367 HydrophobicContact CE1-CD1 4.19Å; F364-L367 HydrophobicContact CE2-CD1 4.11Å; F364-L367 HydrophobicContact CZ-CD1 3.96Å; F364-L367 WeakPolarHBondContact O-CB 3.22Å; F364-L367 PolarHBondContact O-N 2.73Å; F364-L367 VanDerWaalsContact O-N 3.13Å; G365-L367 PolarHBondContact O-N 2.98Å; L367-R369 PolarHBondContact O-N 3.43Å; L367-R369 VanDerWaalsContact O-N 3.12Å; L367-V370 HydrophobicContact CB-CG2 3.96Å; L367-V370 WeakPolarHBondContact O-CG2 3.07Å; L367-V370 PolarHBondContact O-N 3.18Å; L367-V370 VanDerWaalsContact O-N 3.17Å; L367-I392 HydrophobicContact CB-CD1 3.73Å; L367-I392 HydrophobicContact CB-CG2 4.32Å; L367-I392 WeakPolarHBondContact O-CD1 3.22Å
368	S	88.1	Confident	89.4	Confident	83 Å²	83	59 Å²	59	58%	0.58	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.8	-174.8	58.7	0	0	0	0	114.8	G365 K366	G365-S368 PolarHBondContact O-N 3.45Å; K366-S368 PolarHBondContact O-N 3.05Å
369	R	92.4	Very high	89.1	Confident	140 Å²	140	61.4 Å²	61.4	53%	0.528	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-9.5	177.5	-62.8	-167.4	-176.1	177.3	0.7	113.9	E345 L347 L367 N371	E345-R369 VanDerWaalsContact O-CD 3.3Å; E345-R369 WeakPolarHBondContact O-CD 3.33Å; L347-R369 CarbonylContact O-C 3.49Å; L347-R369 VanDerWaalsContact O-C 3.25Å; L347-R369 WeakPolarHBondContact O-CB 3.15Å; L367-R369 PolarHBondContact O-N 3.43Å; L367-R369 VanDerWaalsContact O-N 3.12Å; R369-N371 PolarHBondContact O-N 3.05Å; R369-N371 PolarHBondContact O-ND2 3.14Å
370	V	93.9	Very high	88.8	Confident	14 Å²	14	57.1 Å²	57.1	9%	0.085	29%	0.291	C	S	.	.			trans	-69.7	108.1	179.7	179.2	0	0	0	0	109.3	L347 E348 L350 L367 I372 W373 I392	L347-V370 HydrophobicContact CB-CG2 4.06Å; L347-V370 HydrophobicContact CD2-CG2 4.17Å; L347-V370 HydrophobicContact CG-CG2 4.23Å; L347-V370 VanDerWaalsContact O-CG2 3.28Å; L347-V370 WeakPolarHBondContact O-CG2 3.46Å; L347-V370 PolarHBondContact O-N 3.26Å; E348-V370 CarbonylContact O-C 3.5Å; E348-V370 WeakPolarHBondContact O-CA 3.12Å; L350-V370 HydrophobicContact CB-CG1 3.97Å; L350-V370 HydrophobicContact CB-CG2 4.37Å; L367-V370 HydrophobicContact CB-CG2 3.96Å; L367-V370 WeakPolarHBondContact O-CG2 3.07Å; L367-V370 PolarHBondContact O-N 3.18Å; L367-V370 VanDerWaalsContact O-N 3.17Å; V370-I372 WeakPolarHBondContact CG1-O 3.36Å; V370-W373 HydrophobicContact CG1-CB 4.08Å; V370-I392 HydrophobicContact CB-CD1 3.65Å; V370-I392 HydrophobicContact CG1-CD1 4.06Å; V370-I392 HydrophobicContact CG2-CD1 3.85Å
371	N	89.9	Confident	88	Confident	135 Å²	135	58.5 Å²	58.5	72%	0.722	30%	0.298	S	S	*	.			trans	-91.4	-35.1	176.5	-61.6	-44	0	0	0	110.8	E348 R369	E348-N371 PolarHBondContact O-N 3.48Å; R369-N371 PolarHBondContact O-N 3.05Å; R369-N371 PolarHBondContact O-ND2 3.14Å
372	I	90.6	Very high	87.4	Confident	71 Å²	71	60.4 Å²	60.4	36%	0.364	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	97.5	176.9	-62.5	168.7	0	0	0	108.2	E348 E349 L350 V351 V370	E348-I372 PolarHBondContact O-N 2.79Å; E348-I372 VanDerWaalsContact O-N 3.09Å; E349-I372 WeakPolarHBondContact CA-O 3.26Å; E349-I372 HydrophobicContact CB-CB 4.13Å; E349-I372 HydrophobicContact CG-CB 3.91Å; E349-I372 HydrophobicContact CG-CD1 3.8Å; E349-I372 HydrophobicContact CG-CG1 4.27Å; E349-I372 VanDerWaalsContact OE1-CD1 3.29Å; E349-I372 WeakPolarHBondContact OE1-CD1 3.44Å; L350-I372 PolarHBondContact N-O 3.13Å; V351-I372 HydrophobicContact CG2-CG2 4.33Å; V370-I372 WeakPolarHBondContact CG1-O 3.36Å
373	W	93.5	Very high	87.1	Confident	37 Å²	37	55.2 Å²	55.2	14%	0.14	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.8	177.5	167.2	-114.2	0	0	0	110.2	L350 L352 L360 F364 V370 V375 C388 I392 I395	L350-W373 HydrophobicContact CB-CE3 4.18Å; L350-W373 HydrophobicContact CB-CZ3 4.45Å; L350-W373 HydrophobicContact CD2-CE3 4.15Å; L350-W373 HydrophobicContact CD2-CZ3 3.68Å; L350-W373 HydrophobicContact CG-CE3 4.1Å; L350-W373 HydrophobicContact CG-CZ3 3.87Å; L352-W373 HydrophobicContact CD1-CH2 3.91Å; L352-W373 HydrophobicContact CD1-CZ3 3.7Å; L352-W373 HydrophobicContact CG-CZ3 4.41Å; L360-W373 HydrophobicContact CD1-CH2 4.23Å; L360-W373 HydrophobicContact CD1-CZ2 4.21Å; L360-W373 HydrophobicContact CD2-CH2 4.48Å; F364-W373 AromaticContact CE1-CH2 3.82Å; F364-W373 HydrophobicContact CE1-CH2 3.82Å; F364-W373 HydrophobicContact CE1-CZ2 4.46Å; F364-W373 AromaticContact CE1-CZ3 3.98Å; F364-W373 HydrophobicContact CE1-CZ3 3.98Å; F364-W373 AromaticContact CZ-CH2 3.93Å; F364-W373 HydrophobicContact CZ-CH2 3.93Å; F364-W373 HydrophobicContact CZ-CZ3 4.01Å; V370-W373 HydrophobicContact CG1-CB 4.08Å; W373-V375 HydrophobicContact CD2-CB 4.39Å; W373-V375 HydrophobicContact CH2-CB 3.74Å; W373-V375 HydrophobicContact CH2-CG1 4.4Å; W373-V375 HydrophobicContact CH2-CG2 3.62Å; W373-V375 HydrophobicContact CZ2-CB 3.32Å; W373-V375 HydrophobicContact CZ2-CG1 3.5Å; W373-V375 HydrophobicContact CZ2-CG2 3.54Å; W373-V375 HydrophobicContact CZ3-CB 4.4Å; W373-C388 PolarHBondContact NE1-O 3.04Å; W373-I392 HydrophobicContact CD2-CG1 4.44Å; W373-I392 HydrophobicContact CE3-CD1 4.47Å; W373-I395 HydrophobicContact CZ2-CD1 4.12Å
374	K	91.2	Very high	86.6	Confident	60 Å²	60	49 Å²	49	26%	0.261	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	112.1	176.9	-63.4	-173.8	-175.3	-179.1	0	110.6	E24 L350 V351 L352 Q353	E24-K374 WeakPolarHBondContact OE1-CE 3.41Å; E24-K374 IonicContact OE1-NZ 3.89Å; E24-K374 PolarHBondContact OE1-NZ 3.31Å; L350-K374 PolarHBondContact O-N 3.3Å; L350-K374 VanDerWaalsContact O-N 3.14Å; V351-K374 HydrophobicContact CB-CB 4.49Å; V351-K374 HydrophobicContact CG1-CB 4.15Å; V351-K374 HydrophobicContact CG1-CD 4.37Å; V351-K374 HydrophobicContact CG2-CB 4.32Å; V351-K374 HydrophobicContact CG2-CD 4.28Å; V351-K374 HydrophobicContact CG2-CG 4.39Å; L352-K374 CarbonylContact C-O 3.57Å; L352-K374 WeakPolarHBondContact CA-O 3.44Å; L352-K374 PolarHBondContact N-O 2.74Å; Q353-K374 PolarHBondContact N-O 2.82Å; Q353-K374 VanDerWaalsContact N-O 3.14Å
375	V	92.9	Very high	85.8	Confident	2 Å²	2	52 Å²	52	1%	0.012	26%	0.261	C	S	.	.			trans	-130.2	9.7	-176.3	75.6	0	0	0	0	113.4	L352 W373 N378 L380 C388	L352-V375 HydrophobicContact CB-CG2 4.37Å; W373-V375 HydrophobicContact CD2-CB 4.39Å; W373-V375 HydrophobicContact CH2-CB 3.74Å; W373-V375 HydrophobicContact CH2-CG1 4.4Å; W373-V375 HydrophobicContact CH2-CG2 3.62Å; W373-V375 HydrophobicContact CZ2-CB 3.32Å; W373-V375 HydrophobicContact CZ2-CG1 3.5Å; W373-V375 HydrophobicContact CZ2-CG2 3.54Å; W373-V375 HydrophobicContact CZ3-CB 4.4Å; V375-N378 PolarHBondContact O-ND2 2.9Å; V375-L380 HydrophobicContact CG1-CD1 3.92Å; V375-L380 HydrophobicContact CG2-CD1 3.85Å; V375-L380 HydrophobicContact CG2-CD2 4.42Å; V375-C388 HydrophobicContact CG1-CB 3.95Å
376	K	85.3	Confident	85.3	Confident	99 Å²	99	51.7 Å²	51.7	43%	0.43	26%	0.255	S	S	.	.			trans	-54.5	158.4	-179.2	-174.2	171.6	176.1	-179.8	0	111.6	Q353 G354 N378	Q353-K376 CarbonylContact C-O 3.58Å; Q353-K376 WeakPolarHBondContact CA-O 3.22Å; Q353-K376 HydrophobicContact CG-CB 4.08Å; Q353-K376 WeakPolarHBondContact CG-O 3.36Å; G354-K376 PolarHBondContact N-O 3.27Å; K376-N378 VanDerWaalsContact C-N 3.33Å; K376-N378 PolarHBondContact O-N 3.06Å; K376-N378 PolarHBondContact O-ND2 3.12Å
377	D	82	Confident	84.8	Confident	92 Å²	92	47.2 Å²	47.2	49%	0.492	24%	0.235	S	C	.	.	S	Bend	trans	59.5	41.7	175.9	-48.7	-44.4	0	0	0	112.7	Q353 G354 N355	Q353-D377 HydrophobicContact CG-CB 4.47Å; Q353-D377 PolarHBondContact NE2-OD2 2.9Å; G354-D377 WeakPolarHBondContact CA-O 3.29Å; G354-D377 PolarHBondContact N-O 3.4Å; N355-D377 PolarHBondContact N-O 3.2Å; N355-D377 VanDerWaalsContact O-O 3.14Å
378	N	82.7	Confident	84.4	Confident	15 Å²	15	47.1 Å²	47.1	8%	0.08	24%	0.235	C	C	.	.	S	Bend	trans	-124.4	144.6	169.9	-81.1	-84.6	0	0	0	109.9	L352 N355 Q356 I357 V375 K376 L380	L352-N378 PolarHBondContact O-ND2 3.14Å; N355-N378 VanDerWaalsContact CA-OD1 3.31Å; N355-N378 WeakPolarHBondContact CA-OD1 3.23Å; N355-N378 WeakPolarHBondContact CB-OD1 3.1Å; N355-N378 PolarHBondContact N-OD1 3.01Å; N355-N378 PolarHBondContact O-OD1 3.03Å; Q356-N378 PolarHBondContact N-OD1 2.93Å; I357-N378 HydrophobicContact CB-CB 4.48Å; I357-N378 WeakPolarHBondContact CB-OD1 3.45Å; I357-N378 PolarHBondContact N-OD1 3.49Å; V375-N378 PolarHBondContact O-ND2 2.9Å; K376-N378 VanDerWaalsContact C-N 3.33Å; K376-N378 PolarHBondContact O-N 3.06Å; K376-N378 PolarHBondContact O-ND2 3.12Å; N378-L380 HydrophobicContact CB-CD1 4.47Å; N378-L380 HydrophobicContact CB-CD2 4.37Å; N378-L380 HydrophobicContact CB-CG 3.91Å; N378-L380 PolarHBondContact O-N 3.43Å
379	P	78.6	Confident	84.1	Confident	75 Å²	75	47.8 Å²	47.8	49%	0.487	23%	0.23	S	C	.	.			trans	-76.8	51.7	177.6	35	-37.7	0	0	0	112.5	I357 A358 I381	I357-P379 CarbonylContact O-C 3.52Å; I357-P379 WeakPolarHBondContact O-CD 3.24Å; A358-P379 WeakPolarHBondContact CA-O 3.45Å; P379-I381 PolarHBondContact O-N 3.21Å
380	L	82.2	Confident	83.6	Confident	3 Å²	3	44 Å²	44	2%	0.016	22%	0.218	C	C	.	.			trans	-61.3	118.4	-173.9	-68.5	170.5	0	0	0	111.9	I357 L360 V375 N378 Y385 C388 R648	I357-L380 HydrophobicContact CG2-CD2 4.21Å; I357-L380 PolarHBondContact O-N 2.98Å; L360-L380 HydrophobicContact CD2-CD2 4.25Å; L360-L380 HydrophobicContact CG-CD2 4.28Å; V375-L380 HydrophobicContact CG1-CD1 3.92Å; V375-L380 HydrophobicContact CG2-CD1 3.85Å; V375-L380 HydrophobicContact CG2-CD2 4.42Å; N378-L380 HydrophobicContact CB-CD1 4.47Å; N378-L380 HydrophobicContact CB-CD2 4.37Å; N378-L380 HydrophobicContact CB-CG 3.91Å; N378-L380 PolarHBondContact O-N 3.43Å; L380-Y385 HydrophobicContact CD1-CD2 4.12Å; L380-C388 HydrophobicContact CD1-CB 3.72Å; L380-R648 PolarHBondContact O-NH2 3.49Å
381	I	74.5	Confident	83.2	Confident	33 Å²	33	44 Å²	44	17%	0.169	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-48.8	174.2	-57.2	172.6	0	0	0	109.3	A358 P379 P644 R648	A358-I381 HydrophobicContact CB-CD1 3.84Å; A358-I381 HydrophobicContact CB-CG1 4.13Å; A358-I381 WeakPolarHBondContact O-CA 3.46Å; A358-I381 WeakPolarHBondContact O-CB 3.35Å; A358-I381 PolarHBondContact O-N 3.48Å; P379-I381 PolarHBondContact O-N 3.21Å; I381-P644 HydrophobicContact CD1-CB 3.37Å; I381-P644 HydrophobicContact CD1-CG 4.46Å; I381-P644 HydrophobicContact CG1-CB 4.03Å; I381-R648 HydrophobicContact CG2-CG 3.52Å
382	Q	77.8	Confident	83.2	Confident	47 Å²	47	37.6 Å²	37.6	22%	0.22	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-142.3	115.8	-172.2	-171.6	171.1	-12.6	0	0	112.3	A358 I359 L360 Y398	A358-Q382 PolarHBondContact O-N 2.91Å; A358-Q382 VanDerWaalsContact O-N 3.17Å; I359-Q382 CarbonylContact C-O 3.53Å; I359-Q382 VanDerWaalsContact CA-O 3.32Å; I359-Q382 WeakPolarHBondContact CA-O 3.26Å; I359-Q382 HydrophobicContact CG1-CB 4.43Å; I359-Q382 HydrophobicContact CG2-CB 4.38Å; L360-Q382 PolarHBondContact N-O 3.46Å; Q382-Y398 HydrophobicContact CG-CE1 4.4Å
383	P	81.3	Confident	83	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	cis	-63	162.3	-10.1	-24.2	38.3	0	0	0	113.1	V387 C388 I395 Y398 Q399	P383-V387 HydrophobicContact CB-CB 4.13Å; P383-V387 HydrophobicContact CB-CG1 4.09Å; P383-C388 PolarHBondContact O-SG 3.21Å; P383-I395 HydrophobicContact CG-CB 4.47Å; P383-I395 HydrophobicContact CG-CG2 3.85Å; P383-Y398 HydrophobicContact CB-CD1 3.57Å; P383-Y398 HydrophobicContact CB-CE1 3.66Å; P383-Y398 HydrophobicContact CB-CG 4.23Å; P383-Y398 HydrophobicContact CG-CD1 3.64Å; P383-Y398 HydrophobicContact CG-CE1 3.88Å; P383-Q399 HydrophobicContact CG-CG 4.47Å
384	P	76.6	Confident	82.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	150.5	173.5	-24.1	33.3	0	0	0	112.1	E386 V387 C388 Y398	P384-E386 WeakPolarHBondContact CB-OE2 3.3Å; P384-E386 PolarHBondContact O-N 2.91Å; P384-V387 HydrophobicContact CB-CG2 4.35Å; P384-V387 HydrophobicContact CG-CG2 4.38Å; P384-V387 WeakPolarHBondContact O-CB 3.33Å; P384-V387 PolarHBondContact O-N 3.27Å; P384-C388 PolarHBondContact O-N 3.4Å; P384-C388 PolarHBondContact O-SG 3.17Å; P384-Y398 HydrophobicContact CG-CE2 4.27Å
385	Y	77	Confident	82.4	Confident	64 Å²	64	37.2 Å²	37.2	25%	0.251	19%	0.189	S	C	.	.	H	α-helix	trans	-53.2	-41	-178.5	177.5	-98.3	0	0	0	112.4	L380 V387 C388 M389	L380-Y385 HydrophobicContact CD1-CD2 4.12Å; Y385-V387 VanDerWaalsContact C-N 3.26Å; Y385-V387 PolarHBondContact O-N 3.36Å; Y385-C388 PolarHBondContact O-N 3.34Å; Y385-M389 HydrophobicContact CD1-CG 3.92Å; Y385-M389 HydrophobicContact CD2-CG 4.32Å; Y385-M389 HydrophobicContact CE1-CE 4.37Å; Y385-M389 HydrophobicContact CE1-CG 3.49Å; Y385-M389 VanDerWaalsContact CE1-CG 3.49Å; Y385-M389 HydrophobicContact CE1-SD 4.18Å; Y385-M389 HydrophobicContact CE2-CG 3.92Å; Y385-M389 HydrophobicContact CE2-SD 3.84Å; Y385-M389 HydrophobicContact CG-CG 4.31Å; Y385-M389 VanDerWaalsContact CZ-CG 3.49Å; Y385-M389 VanDerWaalsContact CZ-SD 3.55Å; Y385-M389 WeakPolarHBondContact O-CG 3.37Å; Y385-M389 PolarHBondContact O-N 3.46Å; Y385-M389 VanDerWaalsContact OH-CE 3.22Å; Y385-M389 WeakPolarHBondContact OH-CE 3.48Å; Y385-M389 PolarHBondContact OH-SD 3.29Å
386	E	75.6	Confident	82.1	Confident	14 Å²	14	38.7 Å²	38.7	7%	0.065	20%	0.201	C	C	.	.	H	α-helix	trans	-66.6	-26.9	-178.8	-47.7	90.6	145.8	0	0	112.6	P384 S690 Y694	P384-E386 WeakPolarHBondContact CB-OE2 3.3Å; P384-E386 PolarHBondContact O-N 2.91Å; E386-S690 PolarHBondContact O-OG 2.78Å; E386-Y694 WeakPolarHBondContact OE1-CA 3.21Å
387	V	80.9	Confident	82	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.036	20%	0.201	C	C	.	.	H	α-helix	trans	-78.2	-43.1	171.1	179.2	0	0	0	0	109.5	P383 P384 Y385 M389 K390 I395 Y398 W654	P383-V387 HydrophobicContact CB-CB 4.13Å; P383-V387 HydrophobicContact CB-CG1 4.09Å; P384-V387 HydrophobicContact CB-CG2 4.35Å; P384-V387 HydrophobicContact CG-CG2 4.38Å; P384-V387 WeakPolarHBondContact O-CB 3.33Å; P384-V387 PolarHBondContact O-N 3.27Å; Y385-V387 VanDerWaalsContact C-N 3.26Å; Y385-V387 PolarHBondContact O-N 3.36Å; V387-M389 VanDerWaalsContact C-N 3.34Å; V387-M389 PolarHBondContact O-N 3.49Å; V387-K390 PolarHBondContact O-N 3.38Å; V387-I395 HydrophobicContact CG1-CG1 4.31Å; V387-Y398 HydrophobicContact CG1-CG 4.27Å; V387-Y398 HydrophobicContact CG2-CD2 4.2Å; V387-W654 HydrophobicContact CG2-CH2 4.06Å; V387-W654 HydrophobicContact CG2-CZ2 4.21Å
388	C	85.8	Confident	82	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-37.3	-177.7	-61.7	0	0	0	0	112.3	W373 V375 L380 P383 P384 Y385 K390 G391 I395	W373-C388 PolarHBondContact NE1-O 3.04Å; V375-C388 HydrophobicContact CG1-CB 3.95Å; L380-C388 HydrophobicContact CD1-CB 3.72Å; P383-C388 PolarHBondContact O-SG 3.21Å; P384-C388 PolarHBondContact O-N 3.4Å; P384-C388 PolarHBondContact O-SG 3.17Å; Y385-C388 PolarHBondContact O-N 3.34Å; C388-K390 PolarHBondContact O-N 3.27Å; C388-G391 PolarHBondContact O-N 3.41Å; C388-G391 VanDerWaalsContact O-N 3.09Å; C388-I395 HydrophobicContact CB-CD1 4.32Å
389	M	81.9	Confident	82.1	Confident	96 Å²	96	33.4 Å²	33.4	47%	0.473	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.8	178.6	-69.2	-64.2	-83.8	0	0	113.6	Y385 V387 G391	Y385-M389 HydrophobicContact CD1-CG 3.92Å; Y385-M389 HydrophobicContact CD2-CG 4.32Å; Y385-M389 HydrophobicContact CE1-CE 4.37Å; Y385-M389 HydrophobicContact CE1-CG 3.49Å; Y385-M389 VanDerWaalsContact CE1-CG 3.49Å; Y385-M389 HydrophobicContact CE1-SD 4.18Å; Y385-M389 HydrophobicContact CE2-CG 3.92Å; Y385-M389 HydrophobicContact CE2-SD 3.84Å; Y385-M389 HydrophobicContact CG-CG 4.31Å; Y385-M389 VanDerWaalsContact CZ-CG 3.49Å; Y385-M389 VanDerWaalsContact CZ-SD 3.55Å; Y385-M389 WeakPolarHBondContact O-CG 3.37Å; Y385-M389 PolarHBondContact O-N 3.46Å; Y385-M389 VanDerWaalsContact OH-CE 3.22Å; Y385-M389 WeakPolarHBondContact OH-CE 3.48Å; Y385-M389 PolarHBondContact OH-SD 3.29Å; V387-M389 VanDerWaalsContact C-N 3.34Å; V387-M389 PolarHBondContact O-N 3.49Å; M389-G391 VanDerWaalsContact C-N 3.32Å
390	K	81.6	Confident	82.3	Confident	62 Å²	62	36.7 Å²	36.7	27%	0.27	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-11.5	173.9	-67.8	-168.7	171.1	168.6	0	113.7	V387 C388 Y394 D686 S690	V387-K390 PolarHBondContact O-N 3.38Å; C388-K390 PolarHBondContact O-N 3.27Å; K390-Y394 HydrophobicContact CB-CD1 4.26Å; K390-Y394 HydrophobicContact CB-CD2 3.51Å; K390-Y394 HydrophobicContact CB-CE2 3.94Å; K390-Y394 HydrophobicContact CB-CG 3.67Å; K390-Y394 HydrophobicContact CD-CD1 4.24Å; K390-Y394 HydrophobicContact CD-CE1 4.24Å; K390-Y394 HydrophobicContact CD-CG 4.49Å; K390-Y394 VanDerWaalsContact O-CD2 3.24Å; K390-Y394 WeakPolarHBondContact O-CD2 3.45Å; K390-D686 PolarHBondContact NZ-O 3.02Å; K390-S690 VanDerWaalsContact CD-OG 3.25Å; K390-S690 WeakPolarHBondContact CD-OG 3.21Å; K390-S690 WeakPolarHBondContact CE-OG 3.4Å; K390-S690 PolarHBondContact NZ-OG 2.94Å
391	G	86.2	Confident	82.1	Confident	12 Å²	12	38.1 Å²	38.1	12%	0.124	19%	0.193	C	C	.	.			trans	101.9	173.9	175.4	0	0	0	0	0	114.9	C388 M389 P393 Y394 I395	C388-G391 PolarHBondContact O-N 3.41Å; C388-G391 VanDerWaalsContact O-N 3.09Å; M389-G391 VanDerWaalsContact C-N 3.32Å; G391-P393 VanDerWaalsContact C-CD 3.48Å; G391-Y394 PolarHBondContact O-N 3.38Å; G391-Y394 VanDerWaalsContact O-N 3.13Å; G391-I395 PolarHBondContact O-N 3.22Å
392	I	89.7	Confident	82.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-37	-170.4	-58.1	-165.7	0	0	0	114.5	F364 L367 V370 W373 Y394 I395 A396	F364-I392 HydrophobicContact CD1-CD1 4.2Å; F364-I392 HydrophobicContact CD1-CG1 4.34Å; F364-I392 HydrophobicContact CD1-CG2 4.32Å; F364-I392 HydrophobicContact CE1-CD1 3.81Å; F364-I392 HydrophobicContact CE1-CG1 4.18Å; F364-I392 WeakPolarHBondContact O-CG2 3.24Å; L367-I392 HydrophobicContact CB-CD1 3.73Å; L367-I392 HydrophobicContact CB-CG2 4.32Å; L367-I392 WeakPolarHBondContact O-CD1 3.22Å; V370-I392 HydrophobicContact CB-CD1 3.65Å; V370-I392 HydrophobicContact CG1-CD1 4.06Å; V370-I392 HydrophobicContact CG2-CD1 3.85Å; W373-I392 HydrophobicContact CD2-CG1 4.44Å; W373-I392 HydrophobicContact CE3-CD1 4.47Å; I392-Y394 VanDerWaalsContact C-N 3.27Å; I392-Y394 PolarHBondContact O-N 3.47Å; I392-I395 WeakPolarHBondContact O-CB 3.3Å; I392-I395 PolarHBondContact O-N 3.08Å; I392-A396 PolarHBondContact O-N 2.84Å
393	P	86.3	Confident	82.1	Confident	83 Å²	83	39.9 Å²	39.9	54%	0.539	22%	0.217	S	C	.	.	H	α-helix	trans	-58.5	-37.1	175.6	-27.1	36.3	0	0	0	113.6	G391 A396 V397	G391-P393 VanDerWaalsContact C-CD 3.48Å; P393-A396 WeakPolarHBondContact O-CB 3.07Å; P393-A396 PolarHBondContact O-N 2.84Å; P393-V397 WeakPolarHBondContact O-CG2 3.42Å; P393-V397 PolarHBondContact O-N 2.96Å
394	Y	84.3	Confident	81.5	Confident	77 Å²	77	46.8 Å²	46.8	30%	0.302	25%	0.249	S	C	.	.	H	α-helix	trans	-73.8	-38.2	179.1	-69	-91.1	0	0	0	112	K390 G391 I392 A396 V397 Y398 D686	K390-Y394 HydrophobicContact CB-CD1 4.26Å; K390-Y394 HydrophobicContact CB-CD2 3.51Å; K390-Y394 HydrophobicContact CB-CE2 3.94Å; K390-Y394 HydrophobicContact CB-CG 3.67Å; K390-Y394 HydrophobicContact CD-CD1 4.24Å; K390-Y394 HydrophobicContact CD-CE1 4.24Å; K390-Y394 HydrophobicContact CD-CG 4.49Å; K390-Y394 VanDerWaalsContact O-CD2 3.24Å; K390-Y394 WeakPolarHBondContact O-CD2 3.45Å; G391-Y394 PolarHBondContact O-N 3.38Å; G391-Y394 VanDerWaalsContact O-N 3.13Å; I392-Y394 VanDerWaalsContact C-N 3.27Å; I392-Y394 PolarHBondContact O-N 3.47Å; Y394-A396 VanDerWaalsContact C-N 3.29Å; Y394-A396 PolarHBondContact O-N 3.32Å; Y394-V397 PolarHBondContact O-N 3.32Å; Y394-Y398 WeakPolarHBondContact O-CB 3.43Å; Y394-Y398 PolarHBondContact O-N 3Å; Y394-D686 HydrophobicContact CE1-CB 3.99Å
395	I	88	Confident	80.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.3	-46	170.8	-64	175.1	0	0	0	109.7	L360 F364 W373 P383 V387 C388 G391 I392 V397 Y398 Q399	L360-I395 HydrophobicContact CD1-CD1 3.83Å; F364-I395 HydrophobicContact CB-CG2 3.83Å; F364-I395 HydrophobicContact CD1-CD1 4.21Å; F364-I395 HydrophobicContact CD1-CG2 4.04Å; F364-I395 HydrophobicContact CE1-CD1 4.49Å; F364-I395 HydrophobicContact CG-CG2 4.29Å; W373-I395 HydrophobicContact CZ2-CD1 4.12Å; P383-I395 HydrophobicContact CG-CB 4.47Å; P383-I395 HydrophobicContact CG-CG2 3.85Å; V387-I395 HydrophobicContact CG1-CG1 4.31Å; C388-I395 HydrophobicContact CB-CD1 4.32Å; G391-I395 PolarHBondContact O-N 3.22Å; I392-I395 WeakPolarHBondContact O-CB 3.3Å; I392-I395 PolarHBondContact O-N 3.08Å; I395-V397 PolarHBondContact O-N 3.25Å; I395-Y398 PolarHBondContact O-N 3.13Å; I395-Q399 WeakPolarHBondContact O-CG 3.3Å; I395-Q399 PolarHBondContact O-N 2.95Å
396	A	86.9	Confident	79.8	Confident	32 Å²	32	52.3 Å²	52.3	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-47	179.7	0	0	0	0	0	112.7	G365 I392 P393 Y394 Q399 K400	G365-A396 VanDerWaalsContact CA-CB 3.44Å; I392-A396 PolarHBondContact O-N 2.84Å; P393-A396 WeakPolarHBondContact O-CB 3.07Å; P393-A396 PolarHBondContact O-N 2.84Å; Y394-A396 VanDerWaalsContact C-N 3.29Å; Y394-A396 PolarHBondContact O-N 3.32Å; A396-Q399 PolarHBondContact O-N 3.2Å; A396-K400 WeakPolarHBondContact O-CB 3.38Å; A396-K400 PolarHBondContact O-N 3.38Å
397	V	81.8	Confident	78.8	Confident	71 Å²	71	58.7 Å²	58.7	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-65.8	-42.7	178.8	174.4	0	0	0	0	110.8	P393 Y394 I395 K400 E401	P393-V397 WeakPolarHBondContact O-CG2 3.42Å; P393-V397 PolarHBondContact O-N 2.96Å; Y394-V397 PolarHBondContact O-N 3.32Å; I395-V397 PolarHBondContact O-N 3.25Å; V397-K400 PolarHBondContact O-N 3.05Å; V397-E401 PolarHBondContact O-N 3.11Å
398	Y	82.1	Confident	77.3	Confident	3 Å²	3	61.3 Å²	61.3	1%	0.012	34%	0.335	C	S	.	.	H	α-helix	trans	-58.2	-49.7	175.8	170.9	-88.8	0	0	0	111.5	Q382 P383 P384 V387 Y394 I395 K400 E401 L402 V649 P651	Q382-Y398 HydrophobicContact CG-CE1 4.4Å; P383-Y398 HydrophobicContact CB-CD1 3.57Å; P383-Y398 HydrophobicContact CB-CE1 3.66Å; P383-Y398 HydrophobicContact CB-CG 4.23Å; P383-Y398 HydrophobicContact CG-CD1 3.64Å; P383-Y398 HydrophobicContact CG-CE1 3.88Å; P384-Y398 HydrophobicContact CG-CE2 4.27Å; V387-Y398 HydrophobicContact CG1-CG 4.27Å; V387-Y398 HydrophobicContact CG2-CD2 4.2Å; Y394-Y398 WeakPolarHBondContact O-CB 3.43Å; Y394-Y398 PolarHBondContact O-N 3Å; I395-Y398 PolarHBondContact O-N 3.13Å; Y398-K400 VanDerWaalsContact C-N 3.33Å; Y398-K400 PolarHBondContact O-N 3.17Å; Y398-E401 PolarHBondContact O-N 2.95Å; Y398-L402 HydrophobicContact CE1-CD2 4.49Å; Y398-L402 WeakPolarHBondContact O-CB 3.3Å; Y398-L402 PolarHBondContact O-N 3.34Å; Y398-V649 PolarHBondContact OH-O 3.26Å; Y398-P651 HydrophobicContact CD2-CG 3.67Å; Y398-P651 HydrophobicContact CE2-CG 3.57Å
399	Q	84.6	Confident	75.9	Confident	22 Å²	22	63.5 Å²	63.5	10%	0.103	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-39.2	178.2	-74.1	179.7	-28.2	0	0	112.1	P361 P383 I395 A396 L402 A403	P361-Q399 PolarHBondContact O-NE2 3.24Å; P383-Q399 HydrophobicContact CG-CG 4.47Å; I395-Q399 WeakPolarHBondContact O-CG 3.3Å; I395-Q399 PolarHBondContact O-N 2.95Å; A396-Q399 PolarHBondContact O-N 3.2Å; Q399-L402 WeakPolarHBondContact O-CB 3.44Å; Q399-L402 PolarHBondContact O-N 3.42Å; Q399-A403 PolarHBondContact O-N 2.81Å
400	K	82.9	Confident	74.7	Confident	143 Å²	143	63.8 Å²	63.8	62%	0.622	35%	0.347	S	S	*	.	H	α-helix	trans	-63.5	-42.2	176.5	-174.8	178.5	179.2	-179.9	0	112.3	A396 V397 Y398 Q404	A396-K400 WeakPolarHBondContact O-CB 3.38Å; A396-K400 PolarHBondContact O-N 3.38Å; V397-K400 PolarHBondContact O-N 3.05Å; Y398-K400 VanDerWaalsContact C-N 3.33Å; Y398-K400 PolarHBondContact O-N 3.17Å; K400-Q404 WeakPolarHBondContact O-CG 3.46Å; K400-Q404 PolarHBondContact O-N 3.25Å
401	E	77.7	Confident	73.9	Confident	33 Å²	33	62.1 Å²	62.1	15%	0.154	34%	0.342	C	S	.	.	H	α-helix	trans	-68.5	-39.5	176.8	-168.4	-179.9	159.6	0	0	111.3	V397 Y398 A403 Q404 S405 P651 S653 R687	V397-E401 PolarHBondContact O-N 3.11Å; Y398-E401 PolarHBondContact O-N 2.95Å; E401-A403 VanDerWaalsContact C-N 3.33Å; E401-A403 PolarHBondContact O-N 3.04Å; E401-Q404 PolarHBondContact O-N 3.28Å; E401-S405 PolarHBondContact O-N 2.67Å; E401-S405 PolarHBondContact O-OG 3.29Å; E401-P651 HydrophobicContact CB-CB 4.49Å; E401-P651 HydrophobicContact CG-CB 3.95Å; E401-P651 WeakPolarHBondContact OE1-CB 3.45Å; E401-S653 WeakPolarHBondContact OE1-CB 3.21Å; E401-S653 PolarHBondContact OE1-N 3.02Å; E401-S653 PolarHBondContact OE1-OG 2.92Å; E401-S653 PolarHBondContact OE2-OG 3.15Å; E401-R687 IonicContact OE2-CZ 2.66Å; E401-R687 IonicContact OE2-NH1 3.49Å; E401-R687 PolarHBondContact OE2-NH1 3.45Å; E401-R687 IonicContact OE2-NH2 3.27Å; E401-R687 PolarHBondContact OE2-NH2 3.35Å
402	L	76.3	Confident	73.3	Confident	27 Å²	27	65.3 Å²	65.3	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-57.8	-46.6	176.4	-161	75.9	0	0	0	111.5	Y398 Q399 Q404 S405 V649	Y398-L402 HydrophobicContact CE1-CD2 4.49Å; Y398-L402 WeakPolarHBondContact O-CB 3.3Å; Y398-L402 PolarHBondContact O-N 3.34Å; Q399-L402 WeakPolarHBondContact O-CB 3.44Å; Q399-L402 PolarHBondContact O-N 3.42Å; L402-Q404 PolarHBondContact O-N 3.45Å; L402-S405 WeakPolarHBondContact CA-OG 3.43Å; L402-S405 PolarHBondContact O-N 3.28Å; L402-S405 VanDerWaalsContact O-N 3.12Å; L402-S405 PolarHBondContact O-OG 2.88Å; L402-V649 HydrophobicContact CD1-CB 3.83Å; L402-V649 HydrophobicContact CD1-CG1 3.44Å; L402-V649 VanDerWaalsContact CD1-CG1 3.44Å; L402-V649 HydrophobicContact CG-CG1 4.3Å
403	A	75.8	Confident	72.9	Confident	91 Å²	91	65.5 Å²	65.5	75%	0.752	35%	0.352	S	S	*	.	H	α-helix	trans	-61.7	-24.3	177.5	0	0	0	0	0	113.5	Q399 E401	Q399-A403 PolarHBondContact O-N 2.81Å; E401-A403 VanDerWaalsContact C-N 3.33Å; E401-A403 PolarHBondContact O-N 3.04Å
404	Q	70.3	Confident	73	Confident	145 Å²	145	62.8 Å²	62.8	68%	0.678	33%	0.332	S	S	*	.	H	α-helix	trans	-91.2	-17.6	178.1	-67.4	176.8	-6.2	0	0	113.1	K400 E401 L402	K400-Q404 WeakPolarHBondContact O-CG 3.46Å; K400-Q404 PolarHBondContact O-N 3.25Å; E401-Q404 PolarHBondContact O-N 3.28Å; L402-Q404 PolarHBondContact O-N 3.45Å
405	S	61.5	Low	73.3	Confident	18 Å²	18	59.1 Å²	59.1	13%	0.126	32%	0.317	C	S	.	.	S	Bend	trans	-89.1	132	-179.7	57.1	0	0	0	0	112.8	E401 L402 L407	E401-S405 PolarHBondContact O-N 2.67Å; E401-S405 PolarHBondContact O-OG 3.29Å; L402-S405 WeakPolarHBondContact CA-OG 3.43Å; L402-S405 PolarHBondContact O-N 3.28Å; L402-S405 VanDerWaalsContact O-N 3.12Å; L402-S405 PolarHBondContact O-OG 2.88Å; S405-L407 PolarHBondContact O-N 2.97Å
406	Q	55.5	Low	73.5	Confident	162 Å²	162	59.1 Å²	59.1	76%	0.757	32%	0.317	S	S	*	.			trans	-64.9	131.1	164.7	-83.9	174	-25.7	0	0	109.9	A408	Q406-A408 PolarHBondContact O-N 3.27Å
407	L	53.9	Low	73.8	Confident	147 Å²	147	57.6 Å²	57.6	77%	0.77	31%	0.305	S	S	*	.	S	Bend	trans	-57.5	91.8	175.5	-69.9	160.9	0	0	0	110.9	S405 V649	S405-L407 PolarHBondContact O-N 2.97Å; L407-V649 HydrophobicContact CD2-CB 4.39Å; L407-V649 HydrophobicContact CD2-CG1 3.75Å; L407-V649 HydrophobicContact CD2-CG2 3.69Å
408	A	51	Low	74.4	Confident	62 Å²	62	54.5 Å²	54.5	51%	0.512	29%	0.285	S	S	.	.			trans	-156.1	64.1	172.4	0	0	0	0	0	111.6	Q406	Q406-A408 PolarHBondContact O-N 3.27Å
409	V	54.8	Low	74.8	Confident	46 Å²	46	54.4 Å²	54.4	28%	0.279	29%	0.286	S	S	.	.			trans	-80.4	135.5	159.9	-177.3	0	0	0	0	107.4	P411 L650	V409-P411 WeakPolarHBondContact O-CD 3.22Å; V409-L650 HydrophobicContact CG1-CD1 4.43Å; V409-L650 HydrophobicContact CG2-CB 3.85Å; V409-L650 HydrophobicContact CG2-CG 4.42Å
410	K	58.5	Low	75.1	Confident	101 Å²	101	55 Å²	55	44%	0.439	29%	0.29	S	S	.	.			trans	-80.6	105	161.8	-59.2	-162.3	174.6	173.8	0	107.5	W412 H460 M462	K410-W412 PolarHBondContact O-N 3.02Å; K410-H460 HydrophobicContact CB-CB 4.31Å; K410-H460 HydrophobicContact CD-CB 4.19Å; K410-H460 HydrophobicContact CG-CB 3.87Å; K410-M462 HydrophobicContact CD-SD 4.3Å
411	P	63.7	Low	75.2	Confident	27 Å²	27	54.4 Å²	54.4	18%	0.175	29%	0.288	C	S	.	.			trans	-64.4	132.4	-178.4	22	-30.4	0	0	0	110.9	V409 L461 M462 L646	V409-P411 WeakPolarHBondContact O-CD 3.22Å; P411-L461 HydrophobicContact CB-CD1 4.04Å; P411-L461 HydrophobicContact CG-CD1 3.75Å; P411-M462 PolarHBondContact O-N 2.78Å; P411-L646 HydrophobicContact CB-CD1 3.5Å; P411-L646 VanDerWaalsContact CB-CD1 3.5Å; P411-L646 HydrophobicContact CB-CD2 4.45Å; P411-L646 HydrophobicContact CB-CG 3.61Å; P411-L646 HydrophobicContact CG-CG 4.49Å
412	W	73.2	Confident	75.5	Confident	80 Å²	80	58.6 Å²	58.6	30%	0.303	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.4	171.8	-73.1	69.5	0	0	0	109.3	K410 M462 L464	K410-W412 PolarHBondContact O-N 3.02Å; W412-M462 CarbonylContact C-O 3.58Å; W412-M462 VanDerWaalsContact CA-O 3.31Å; W412-M462 WeakPolarHBondContact CA-O 3.14Å; W412-M462 HydrophobicContact CD2-CB 3.99Å; W412-M462 HydrophobicContact CE3-CB 4.3Å; W412-M462 HydrophobicContact CG-CB 4.27Å; W412-M462 HydrophobicContact CH2-CE 3.44Å; W412-M462 VanDerWaalsContact CH2-CE 3.44Å; W412-M462 HydrophobicContact CH2-SD 4.41Å; W412-M462 HydrophobicContact CZ2-CE 3.29Å; W412-M462 HydrophobicContact CZ2-SD 3.69Å; W412-M462 HydrophobicContact CZ3-CE 4.13Å; W412-L464 HydrophobicContact CE3-CB 4.13Å; W412-L464 HydrophobicContact CZ3-CB 4.44Å; W412-L464 HydrophobicContact CZ3-CD1 4.18Å
413	L	82.9	Confident	76.1	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.7	172.1	-172.5	56.2	0	0	0	110	L415 M462 F463 L464 G485 L487 A637 F643 L646	L413-L415 PolarHBondContact O-N 3.27Å; L413-M462 PolarHBondContact N-O 3.03Å; L413-F463 HydrophobicContact CB-CD1 3.94Å; L413-F463 HydrophobicContact CB-CE1 3.99Å; L413-F463 HydrophobicContact CD2-CD1 4.37Å; L413-F463 HydrophobicContact CD2-CE1 3.66Å; L413-F463 HydrophobicContact CD2-CZ 4.37Å; L413-F463 HydrophobicContact CG-CD1 4.28Å; L413-F463 HydrophobicContact CG-CE1 4.06Å; L413-F463 VanDerWaalsContact O-CA 3.27Å; L413-F463 WeakPolarHBondContact O-CA 3.48Å; L413-L464 PolarHBondContact O-N 3.49Å; L413-G485 WeakPolarHBondContact CD1-O 3.44Å; L413-L487 HydrophobicContact CD2-CB 4.3Å; L413-L487 HydrophobicContact CD2-CD2 4.5Å; L413-A637 HydrophobicContact CD2-CB 3.63Å; L413-F643 HydrophobicContact CD1-CD1 3.82Å; L413-F643 HydrophobicContact CD1-CE1 3.99Å; L413-F643 HydrophobicContact CD1-CG 4.13Å; L413-F643 HydrophobicContact CD1-CZ 4.41Å; L413-F643 HydrophobicContact CD2-CD2 4.03Å; L413-F643 HydrophobicContact CD2-CE2 3.94Å; L413-F643 HydrophobicContact CD2-CG 4.39Å; L413-F643 HydrophobicContact CD2-CZ 4.29Å; L413-L646 HydrophobicContact CB-CD1 3.84Å; L413-L646 HydrophobicContact CD1-CD1 4.4Å
414	K	86.4	Confident	76.6	Confident	26 Å²	26	53.7 Å²	53.7	11%	0.113	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.1	173.5	-176.3	171.2	171.9	-171.9	0	109.5	V416 Y466 F481 S483 A486 L487	K414-V416 HydrophobicContact CG-CG2 4.06Å; K414-Y466 HydrophobicContact CD-CD2 4.24Å; K414-Y466 HydrophobicContact CD-CE2 3.87Å; K414-Y466 HydrophobicContact CG-CD2 3.81Å; K414-Y466 HydrophobicContact CG-CE2 3.76Å; K414-F481 WeakPolarHBondContact CE-O 3.3Å; K414-F481 PolarHBondContact NZ-O 2.65Å; K414-S483 WeakPolarHBondContact CD-OG 3.46Å; K414-S483 PolarHBondContact NZ-OG 2.98Å; K414-A486 HydrophobicContact CB-CB 4.08Å; K414-A486 HydrophobicContact CD-CB 4.34Å; K414-A486 HydrophobicContact CG-CB 4.14Å; K414-A486 WeakPolarHBondContact O-CA 3.37Å; K414-L487 PolarHBondContact O-N 3.27Å
415	L	90.9	Very high	77.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.9	177.3	-175	145.5	0	0	0	109.6	L413 L417 F463 L464 V465 Y466 L487 V489 L633	L413-L415 PolarHBondContact O-N 3.27Å; L415-L417 HydrophobicContact CD2-CD2 3.55Å; L415-L417 HydrophobicContact CD2-CG 4.12Å; L415-F463 HydrophobicContact CB-CD1 3.89Å; L415-F463 HydrophobicContact CD1-CD1 3.92Å; L415-F463 HydrophobicContact CD1-CE1 4.06Å; L415-L464 PolarHBondContact N-O 3.14Å; L415-V465 HydrophobicContact CB-CG2 4.44Å; L415-V465 HydrophobicContact CD2-CG1 3.87Å; L415-V465 HydrophobicContact CD2-CG2 4.25Å; L415-V465 CarbonylContact O-C 3.5Å; L415-V465 WeakPolarHBondContact O-CA 3.23Å; L415-Y466 PolarHBondContact O-N 3.19Å; L415-L487 CarbonylContact C-O 3.43Å; L415-L487 WeakPolarHBondContact CA-O 3.4Å; L415-L487 HydrophobicContact CD1-CD2 4.28Å; L415-V489 HydrophobicContact CD1-CG2 4.18Å; L415-V489 HydrophobicContact CD2-CG2 4.07Å; L415-V489 HydrophobicContact CG-CG2 4.08Å; L415-L633 HydrophobicContact CD1-CD1 3.91Å; L415-L633 HydrophobicContact CD1-CD2 4.05Å; L415-L633 HydrophobicContact CD1-CG 4.48Å
416	V	92.8	Very high	78.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.6	-173	-176.1	0	0	0	0	110	K414 M418 L468 L482 A486 L487 Y488 V489	K414-V416 HydrophobicContact CG-CG2 4.06Å; V416-M418 HydrophobicContact CG1-CE 4.01Å; V416-L468 HydrophobicContact CG1-CD1 3.48Å; V416-L468 VanDerWaalsContact CG1-CD1 3.48Å; V416-L468 HydrophobicContact CG1-CG 3.77Å; V416-L482 HydrophobicContact CG1-CD2 4.44Å; V416-A486 HydrophobicContact CG2-CB 4.31Å; V416-L487 PolarHBondContact N-O 3.34Å; V416-Y488 HydrophobicContact CB-CD1 3.73Å; V416-Y488 HydrophobicContact CB-CE1 3.93Å; V416-Y488 HydrophobicContact CG1-CD1 4.12Å; V416-Y488 HydrophobicContact CG1-CE1 4.19Å; V416-Y488 HydrophobicContact CG2-CD1 4.3Å; V416-Y488 HydrophobicContact CG2-CE1 4.03Å; V416-V489 PolarHBondContact O-N 3.36Å
417	L	93.4	Very high	80.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.5	173.1	-53.8	-177.9	0	0	0	109.8	L415 R429 V465 Y466 L468 V489	L415-L417 HydrophobicContact CD2-CD2 3.55Å; L415-L417 HydrophobicContact CD2-CG 4.12Å; L417-R429 HydrophobicContact CD1-CB 3.83Å; L417-V465 HydrophobicContact CD1-CG1 4.12Å; L417-V465 HydrophobicContact CG-CG1 4.16Å; L417-Y466 PolarHBondContact N-O 3.06Å; L417-L468 WeakPolarHBondContact O-CB 3.11Å; L417-L468 PolarHBondContact O-N 3.38Å; L417-L468 VanDerWaalsContact O-N 3.13Å; L417-V489 HydrophobicContact CD2-CB 3.71Å; L417-V489 HydrophobicContact CD2-CG1 4.03Å; L417-V489 HydrophobicContact CD2-CG2 4.2Å
418	M	93.3	Very high	81.7	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.025	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155	-178.8	37.4	173	57	0	0	112	V416 L468 L482 Y488 V489 L490 V491 L513	V416-M418 HydrophobicContact CG1-CE 4.01Å; M418-L468 HydrophobicContact CE-CD1 4.08Å; M418-L482 HydrophobicContact CE-CD2 3.4Å; M418-Y488 HydrophobicContact CE-CD1 3.6Å; M418-Y488 HydrophobicContact CE-CE1 3.96Å; M418-Y488 HydrophobicContact SD-CD1 3.89Å; M418-Y488 HydrophobicContact SD-CG 4.48Å; M418-V489 PolarHBondContact N-O 2.98Å; M418-L490 HydrophobicContact CG-CD1 4.46Å; M418-V491 PolarHBondContact O-N 3.44Å; M418-L513 HydrophobicContact CE-CD2 3.89Å; M418-L513 HydrophobicContact CE-CG 4.47Å; M418-L513 HydrophobicContact SD-CD1 3.76Å; M418-L513 HydrophobicContact SD-CD2 4.01Å; M418-L513 HydrophobicContact SD-CG 4.06Å
419	G	91	Very high	83.5	Confident	2 Å²	2	36.7 Å²	36.7	2%	0.021	18%	0.18	C	C	.	.			trans	147.5	172.8	-175.6	0	0	0	0	0	112.7	K425 G470	G419-K425 PolarHBondContact O-NZ 2.88Å; G419-G470 WeakPolarHBondContact O-CA 3.32Å
420	T	90.6	Very high	84.9	Confident	33 Å²	33	39.3 Å²	39.3	20%	0.202	19%	0.189	C	C	.	.			trans	-62.4	160.6	-175.6	63.2	0	0	0	0	113.1	N422 A423 K425 F509	T420-N422 PolarHBondContact O-N 3.25Å; T420-A423 VanDerWaalsContact O-CB 3.25Å; T420-A423 WeakPolarHBondContact O-CB 3.43Å; T420-A423 PolarHBondContact O-N 2.92Å; T420-K425 PolarHBondContact O-NZ 3.4Å; T420-F509 HydrophobicContact CG2-CE2 4.13Å
421	K	85.1	Confident	86.2	Confident	132 Å²	132	35.3 Å²	35.3	57%	0.574	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-37.8	-173.5	-169.6	176.9	176.7	179.8	0	114
422	N	85.5	Confident	87	Confident	120 Å²	120	34.2 Å²	34.2	64%	0.642	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	23.7	-176.7	-61	-15.6	0	0	0	113.7	T420 G424 N493	T420-N422 PolarHBondContact O-N 3.25Å; N422-G424 PolarHBondContact O-N 3.19Å; N422-N493 PolarHBondContact O-ND2 3.37Å
423	A	87.2	Confident	87.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-67.1	-14.7	177.8	0	0	0	0	0	114	T420 K425 V491 T527	T420-A423 VanDerWaalsContact O-CB 3.25Å; T420-A423 WeakPolarHBondContact O-CB 3.43Å; T420-A423 PolarHBondContact O-N 2.92Å; A423-K425 HydrophobicContact CB-CG 4.36Å; A423-V491 HydrophobicContact CB-CB 4.23Å; A423-V491 HydrophobicContact CB-CG1 4.13Å; A423-V491 VanDerWaalsContact CB-O 3.3Å; A423-V491 WeakPolarHBondContact CB-O 3.36Å; A423-V491 VanDerWaalsContact O-CG1 3.27Å; A423-V491 WeakPolarHBondContact O-CG1 3.41Å; A423-T527 PolarHBondContact O-OG1 3.12Å
424	G	86.9	Confident	86.5	Confident	15 Å²	15	34.8 Å²	34.8	16%	0.155	18%	0.181	C	C	.	.			trans	90	17.4	-178.1	0	0	0	0	0	115.2	N422 T426 K427 L428	N422-G424 PolarHBondContact O-N 3.19Å; G424-T426 PolarHBondContact O-N 2.93Å; G424-K427 PolarHBondContact O-N 3.46Å; G424-L428 WeakPolarHBondContact O-CB 3.35Å; G424-L428 PolarHBondContact O-N 3.36Å
425	K	88.6	Confident	85	Confident	3 Å²	3	38 Å²	38	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-53.7	-49.8	-178.6	-61	-178.3	-64.9	-70.1	0	113.9	G419 T420 A423 K427 L428 R429 D467 L468 V491	G419-K425 PolarHBondContact O-NZ 2.88Å; T420-K425 PolarHBondContact O-NZ 3.4Å; A423-K425 HydrophobicContact CB-CG 4.36Å; K425-K427 PolarHBondContact O-N 2.95Å; K425-L428 WeakPolarHBondContact O-CB 3.46Å; K425-L428 PolarHBondContact O-N 3.42Å; K425-L428 VanDerWaalsContact O-N 3.15Å; K425-R429 PolarHBondContact O-N 3.48Å; K425-D467 VanDerWaalsContact CB-OD1 3.3Å; K425-D467 WeakPolarHBondContact CB-OD1 3.39Å; K425-L468 WeakPolarHBondContact CE-O 3.34Å; K425-V491 HydrophobicContact CG-CB 3.97Å; K425-V491 HydrophobicContact CG-CG1 4.4Å; K425-V491 HydrophobicContact CG-CG2 3.98Å
426	T	86.4	Confident	82.8	Confident	34 Å²	34	47.5 Å²	47.5	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-40.3	-177.7	-47.1	0	0	0	0	112.2	G424 L428 R429 Q430 D467	G424-T426 PolarHBondContact O-N 2.93Å; T426-L428 VanDerWaalsContact C-N 3.35Å; T426-R429 PolarHBondContact O-N 3Å; T426-Q430 WeakPolarHBondContact O-CG 3.46Å; T426-Q430 PolarHBondContact O-N 3.18Å; T426-D467 VanDerWaalsContact CA-OD2 3.31Å; T426-D467 WeakPolarHBondContact CA-OD2 3.04Å; T426-D467 PolarHBondContact N-OD2 3.48Å; T426-D467 PolarHBondContact OG1-OD2 3.42Å
427	K	85.9	Confident	80.3	Confident	123 Å²	123	55.8 Å²	55.8	54%	0.535	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-38	173.8	-70.5	-171.3	177.1	-175	0	112	G424 K425 Q430 S431 C619	G424-K427 PolarHBondContact O-N 3.46Å; K425-K427 PolarHBondContact O-N 2.95Å; K427-Q430 PolarHBondContact O-N 2.78Å; K427-S431 WeakPolarHBondContact O-CB 3.27Å; K427-S431 PolarHBondContact O-N 3.5Å; K427-S431 PolarHBondContact O-OG 3.09Å; K427-C619 HydrophobicContact CB-CB 4.19Å
428	L	87.6	Confident	77.7	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-46.5	174.3	177	55.8	0	0	0	111.3	G424 K425 T426 Q430 S431 L432 V491 V525 I617 L629	G424-L428 WeakPolarHBondContact O-CB 3.35Å; G424-L428 PolarHBondContact O-N 3.36Å; K425-L428 WeakPolarHBondContact O-CB 3.46Å; K425-L428 PolarHBondContact O-N 3.42Å; K425-L428 VanDerWaalsContact O-N 3.15Å; T426-L428 VanDerWaalsContact C-N 3.35Å; L428-Q430 PolarHBondContact O-N 2.89Å; L428-S431 PolarHBondContact O-N 3Å; L428-S431 VanDerWaalsContact O-N 3.14Å; L428-L432 HydrophobicContact CD1-CD1 3.9Å; L428-L432 HydrophobicContact CD1-CG 4.03Å; L428-L432 HydrophobicContact CG-CD1 3.9Å; L428-L432 HydrophobicContact CG-CG 4.47Å; L428-L432 WeakPolarHBondContact O-CG 3.21Å; L428-L432 PolarHBondContact O-N 3.39Å; L428-V491 HydrophobicContact CD2-CG1 4.28Å; L428-V491 HydrophobicContact CD2-CG2 3.71Å; L428-V525 HydrophobicContact CD2-CG1 4Å; L428-I617 HydrophobicContact CD1-CD1 3.21Å; L428-I617 HydrophobicContact CD2-CD1 4.14Å; L428-I617 HydrophobicContact CG-CD1 4.18Å; L428-L629 HydrophobicContact CD1-CD2 3.86Å
429	R	88.4	Confident	74.9	Confident	18 Å²	18	67.6 Å²	67.6	7%	0.068	35%	0.354	C	S	.	.	H	α-helix	trans	-55.6	-51.1	174.4	-176	-174.7	63.9	73.4	-11.2	111.3	L417 K425 T426 S431 L432 V433 E449 V465	L417-R429 HydrophobicContact CD1-CB 3.83Å; K425-R429 PolarHBondContact O-N 3.48Å; T426-R429 PolarHBondContact O-N 3Å; R429-S431 PolarHBondContact O-N 3.39Å; R429-L432 PolarHBondContact O-N 2.93Å; R429-L432 VanDerWaalsContact O-N 3.13Å; R429-V433 HydrophobicContact CG-CG2 4.43Å; R429-V433 WeakPolarHBondContact O-CG2 3.44Å; R429-V433 PolarHBondContact O-N 3.38Å; R429-E449 IonicContact CZ-OE2 3.55Å; R429-E449 IonicContact NE-OE2 2.72Å; R429-E449 IonicContact NH2-OE2 2.65Å; R429-E449 PolarHBondContact NH2-OE2 3.4Å; R429-V465 HydrophobicContact CG-CG1 4.26Å
430	Q	85.1	Confident	72.2	Confident	100 Å²	100	77.8 Å²	77.8	47%	0.467	39%	0.392	S	S	.	.	H	α-helix	trans	-59.6	-31.2	178.4	-73.4	171.7	-19.4	0	0	112.9	T426 K427 L428	T426-Q430 WeakPolarHBondContact O-CG 3.46Å; T426-Q430 PolarHBondContact O-N 3.18Å; K427-Q430 PolarHBondContact O-N 2.78Å; L428-Q430 PolarHBondContact O-N 2.89Å
431	S	84.4	Confident	69.7	Low	18 Å²	18	80.4 Å²	80.4	13%	0.126	43%	0.425	C	S	.	.	H	α-helix	trans	-81.9	-26.7	178	-53.5	0	0	0	0	113.1	K427 L428 R429	K427-S431 WeakPolarHBondContact O-CB 3.27Å; K427-S431 PolarHBondContact O-N 3.5Å; K427-S431 PolarHBondContact O-OG 3.09Å; L428-S431 PolarHBondContact O-N 3Å; L428-S431 VanDerWaalsContact O-N 3.14Å; R429-S431 PolarHBondContact O-N 3.39Å
432	L	82.6	Confident	67.2	Low	3 Å²	3	78.9 Å²	78.9	2%	0.016	43%	0.427	C	S	.	.	H	α-helix	trans	-80.3	-38	177.9	-75.8	169.8	0	0	0	112.5	L428 R429 P434 W453 I626 L629 R630	L428-L432 HydrophobicContact CD1-CD1 3.9Å; L428-L432 HydrophobicContact CD1-CG 4.03Å; L428-L432 HydrophobicContact CG-CD1 3.9Å; L428-L432 HydrophobicContact CG-CG 4.47Å; L428-L432 WeakPolarHBondContact O-CG 3.21Å; L428-L432 PolarHBondContact O-N 3.39Å; R429-L432 PolarHBondContact O-N 2.93Å; R429-L432 VanDerWaalsContact O-N 3.13Å; L432-P434 VanDerWaalsContact O-CD 3.31Å; L432-P434 WeakPolarHBondContact O-CD 3.45Å; L432-W453 PolarHBondContact O-NE1 3.46Å; L432-I626 HydrophobicContact CD2-CG2 4.43Å; L432-L629 HydrophobicContact CD1-CD2 4.39Å; L432-L629 HydrophobicContact CD2-CD2 3.97Å; L432-L629 HydrophobicContact CD2-CG 4.25Å; L432-R630 HydrophobicContact CD2-CG 3.89Å
433	V	80.6	Confident	65	Low	8 Å²	8	82.2 Å²	82.2	5%	0.048	44%	0.439	C	S	.	.	S	Bend	trans	-96.1	109.3	-176.5	-172.5	0	0	0	0	109.8	R429 T435 W453	R429-V433 HydrophobicContact CG-CG2 4.43Å; R429-V433 WeakPolarHBondContact O-CG2 3.44Å; R429-V433 PolarHBondContact O-N 3.38Å; V433-T435 HydrophobicContact CG1-CG2 4.08Å; V433-T435 PolarHBondContact O-N 3.48Å; V433-T435 VanDerWaalsContact O-N 3.12Å; V433-W453 HydrophobicContact CG2-CB 4Å; V433-W453 HydrophobicContact CG2-CG 4.18Å
434	P	64.5	Low	63	Low	91 Å²	91	85.3 Å²	85.3	59%	0.591	47%	0.471	S	S	*	.			trans	-73.4	103.2	173.5	29.2	-31.4	0	0	0	109.2	L432	L432-P434 VanDerWaalsContact O-CD 3.31Å; L432-P434 WeakPolarHBondContact O-CD 3.45Å
435	T	54.5	Low	61.2	Low	94 Å²	94	87 Å²	87	58%	0.577	48%	0.477	S	S	*	.			trans	-128.8	128.9	173	32.2	0	0	0	0	111	V433 Q437	V433-T435 HydrophobicContact CG1-CG2 4.08Å; V433-T435 PolarHBondContact O-N 3.48Å; V433-T435 VanDerWaalsContact O-N 3.12Å; T435-Q437 PolarHBondContact O-N 2.93Å
436	E	43.9	Very low	60.1	Low	199 Å²	199	92.4 Å²	92.4	93%	0.93	50%	0.5	S	S	*	.	S	Bend	trans	-72.8	4	176.9	-67.8	-173.8	153.2	0	0	114.2
437	Q	41.4	Very low	59.8	Low	174 Å²	174	90.9 Å²	90.9	81%	0.813	49%	0.491	S	S	*	.			trans	-130.1	78	-175.5	-70.5	-175.8	-9	0	0	111.4	T435	T435-Q437 PolarHBondContact O-N 2.93Å
438	D	38.9	Very low	59.8	Low	109 Å²	109	85.1 Å²	85.1	58%	0.583	47%	0.466	S	S	*	.			trans	-163.2	59.5	154	-102.4	-19.4	0	0	0	110.5	R440	D438-R440 PolarHBondContact O-N 3.17Å
439	V	34.9	Very low	59.7	Low	143 Å²	143	87.5 Å²	87.5	87%	0.867	48%	0.477	S	S	*	.			trans	-85.9	16.8	174.9	-176.1	0	0	0	0	112.1
440	R	33.6	Very low	59.5	Low	217 Å²	217	88.4 Å²	88.4	82%	0.819	49%	0.485	S	S	*	.	S	Bend	trans	-117.1	98.5	169.4	-68	-164.4	-162.8	-150.8	6	110.1	D438 T442	D438-R440 PolarHBondContact O-N 3.17Å; R440-T442 PolarHBondContact O-N 3.25Å; R440-T442 PolarHBondContact O-OG1 3.16Å
441	G	38.3	Very low	59.5	Low	87 Å²	87	85.2 Å²	85.2	90%	0.897	47%	0.472	S	S	*	.			trans	-44.9	105.3	167.4	0	0	0	0	0	110.1
442	T	33	Very low	59.5	Low	100 Å²	100	88.8 Å²	88.8	61%	0.613	49%	0.49	S	S	*	.			trans	-110.7	119.4	171.6	18.6	0	0	0	0	107.6	R440	R440-T442 PolarHBondContact O-N 3.25Å; R440-T442 PolarHBondContact O-OG1 3.16Å
443	Q	38.8	Very low	59.6	Low	190 Å²	190	88.9 Å²	88.9	89%	0.888	49%	0.49	S	S	*	.			trans	-56.4	135.5	177.7	-63.2	-175.3	-10.8	0	0	110.8
444	G	45.1	Very low	59.6	Low	66 Å²	66	92.1 Å²	92.1	68%	0.68	51%	0.51	S	S	*	.	S	Bend	trans	71.3	137.2	154.5	0	0	0	0	0	116.8	K446	G444-K446 PolarHBondContact O-N 3.39Å
445	N	49.3	Very low	60.1	Low	50 Å²	50	88.7 Å²	88.7	27%	0.267	49%	0.489	S	S	.	.			trans	-53.1	117.7	179.2	-167.9	-22.4	0	0	0	112.2	G447	N445-G447 VanDerWaalsContact C-N 3.31Å; N445-G447 PolarHBondContact O-N 3.24Å; N445-G447 PolarHBondContact OD1-N 3.38Å; N445-G447 VanDerWaalsContact OD1-N 3.1Å; N445-G447 PolarHBondContact OD1-O 3.34Å
446	K	64.7	Low	60.8	Low	117 Å²	117	86 Å²	86	51%	0.509	47%	0.471	S	S	.	.			trans	-81.2	2.7	-180	-73.8	-178.6	179.8	173.6	0	114	G444 Q730	G444-K446 PolarHBondContact O-N 3.39Å; K446-Q730 PolarHBondContact O-NE2 3.06Å
447	G	80.1	Confident	61.8	Low	1 Å²	1	80.6 Å²	80.6	1%	0.01	46%	0.455	C	S	.	.	S	Bend	trans	127.8	-130.6	178.9	0	0	0	0	0	112.2	N445 S469 Y474	N445-G447 VanDerWaalsContact C-N 3.31Å; N445-G447 PolarHBondContact O-N 3.24Å; N445-G447 PolarHBondContact OD1-N 3.38Å; N445-G447 VanDerWaalsContact OD1-N 3.1Å; N445-G447 PolarHBondContact OD1-O 3.34Å; G447-S469 WeakPolarHBondContact O-CB 3.31Å; G447-Y474 WeakPolarHBondContact CA-OH 3.3Å
448	I	86.1	Confident	62.9	Low	3 Å²	3	79.5 Å²	79.5	2%	0.015	46%	0.455	C	S	.	.			trans	-95.5	131	172.6	-60.2	174.7	0	0	0	108.7	D467 L468 Y474 I477 F481 I722 N726	I448-D467 WeakPolarHBondContact CA-O 3.43Å; I448-L468 HydrophobicContact CD1-CD2 4.37Å; I448-L468 HydrophobicContact CG1-CD2 4.43Å; I448-L468 HydrophobicContact CG2-CD2 4.15Å; I448-Y474 HydrophobicContact CD1-CD1 3.93Å; I448-Y474 HydrophobicContact CG1-CD1 3.83Å; I448-Y474 HydrophobicContact CG1-CE1 4.17Å; I448-I477 HydrophobicContact CD1-CD1 3.85Å; I448-I477 HydrophobicContact CD1-CG1 4.23Å; I448-F481 HydrophobicContact CD1-CD2 3.72Å; I448-F481 HydrophobicContact CD1-CE2 3.34Å; I448-F481 HydrophobicContact CD1-CZ 4.03Å; I448-I722 HydrophobicContact CB-CG2 3.89Å; I448-I722 HydrophobicContact CG2-CG2 3.89Å; I448-I722 VanDerWaalsContact O-CG2 3.25Å; I448-I722 WeakPolarHBondContact O-CG2 2.83Å; I448-N726 PolarHBondContact N-OD1 3.13Å; I448-N726 PolarHBondContact O-ND2 3.41Å
449	E	85.4	Confident	64	Low	49 Å²	49	81.9 Å²	81.9	23%	0.229	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.8	177.8	-66.7	-179.7	-179.9	0	0	110.8	R429 Y466 D467	R429-E449 IonicContact CZ-OE2 3.55Å; R429-E449 IonicContact NE-OE2 2.72Å; R429-E449 IonicContact NH2-OE2 2.65Å; R429-E449 PolarHBondContact NH2-OE2 3.4Å; E449-Y466 WeakPolarHBondContact O-CA 3.43Å; E449-D467 HydrophobicContact CB-CB 4.45Å; E449-D467 PolarHBondContact N-O 3.24Å; E449-D467 PolarHBondContact O-N 3.42Å
450	V	85.1	Confident	65.5	Low	38 Å²	38	79.4 Å²	79.4	23%	0.23	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.8	177.4	-176.6	0	0	0	0	109.3	L464 V465 Y466 I722	V450-L464 HydrophobicContact CG1-CD1 3.4Å; V450-L464 VanDerWaalsContact CG1-CD1 3.4Å; V450-L464 HydrophobicContact CG1-CG 3.89Å; V450-V465 WeakPolarHBondContact CA-O 3.47Å; V450-Y466 HydrophobicContact CG1-CE1 4.45Å; V450-Y466 HydrophobicContact CG1-CE2 4.35Å; V450-Y466 HydrophobicContact CG2-CD1 3.5Å; V450-Y466 VanDerWaalsContact CG2-CD1 3.5Å; V450-Y466 HydrophobicContact CG2-CE1 3.39Å; V450-Y466 HydrophobicContact CG2-CG 4.15Å; V450-I722 HydrophobicContact CG2-CD1 3.32Å
451	T	85.1	Confident	67.5	Low	33 Å²	33	69.2 Å²	69.2	20%	0.202	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	142	179.1	55.4	0	0	0	0	111.6	V465	T451-V465 PolarHBondContact N-O 3.19Å; T451-V465 PolarHBondContact O-N 3.04Å
452	N	83.6	Confident	69.4	Low	93 Å²	93	66.4 Å²	66.4	50%	0.497	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133	174.9	-63.6	-15.8	0	0	0	109.8	L464	N452-L464 WeakPolarHBondContact OD1-CD1 3.49Å
453	W	84.5	Confident	71.9	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.015	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.4	176.1	176.6	34.1	0	0	0	110.3	L432 V433 A455 F463 V465 R630 L633	L432-W453 PolarHBondContact O-NE1 3.46Å; V433-W453 HydrophobicContact CG2-CB 4Å; V433-W453 HydrophobicContact CG2-CG 4.18Å; W453-A455 HydrophobicContact CD2-CB 4.07Å; W453-A455 HydrophobicContact CE3-CB 4.34Å; W453-A455 HydrophobicContact CH2-CB 3.99Å; W453-A455 HydrophobicContact CZ2-CB 3.69Å; W453-A455 HydrophobicContact CZ3-CB 4.3Å; W453-A455 PolarHBondContact O-N 3.4Å; W453-F463 HydrophobicContact CB-CB 4.23Å; W453-F463 HydrophobicContact CD2-CD2 4.36Å; W453-F463 HydrophobicContact CE3-CB 3.82Å; W453-F463 AromaticContact CE3-CD2 3.65Å; W453-F463 HydrophobicContact CE3-CD2 3.65Å; W453-F463 HydrophobicContact CE3-CE2 4.39Å; W453-F463 AromaticContact CE3-CG 3.85Å; W453-F463 HydrophobicContact CE3-CG 3.85Å; W453-F463 AromaticContact CZ3-CD2 3.79Å; W453-F463 HydrophobicContact CZ3-CD2 3.79Å; W453-F463 HydrophobicContact CZ3-CE2 4.06Å; W453-F463 HydrophobicContact CZ3-CG 4.17Å; W453-F463 PolarHBondContact N-O 3.44Å; W453-F463 PolarHBondContact O-N 2.98Å; W453-V465 HydrophobicContact CB-CG2 4.02Å; W453-V465 HydrophobicContact CE3-CG2 4.33Å; W453-R630 HydrophobicContact CH2-CB 4.33Å; W453-R630 HydrophobicContact CH2-CG 4.02Å; W453-R630 HydrophobicContact CZ2-CB 4.38Å; W453-R630 HydrophobicContact CZ2-CG 3.87Å; W453-L633 HydrophobicContact CH2-CD1 4.37Å; W453-L633 HydrophobicContact CZ3-CD1 4.14Å
454	V	81.6	Confident	74.1	Confident	77 Å²	77	53.8 Å²	53.8	47%	0.467	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	104.8	169.9	-176.5	0	0	0	0	107.1	M462	V454-M462 HydrophobicContact CG2-CE 4.18Å
455	A	73.4	Confident	76.2	Confident	19 Å²	19	50.7 Å²	50.7	16%	0.157	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-34.3	-172.9	0	0	0	0	0	112.6	W453 L461 F463 M634	W453-A455 HydrophobicContact CD2-CB 4.07Å; W453-A455 HydrophobicContact CE3-CB 4.34Å; W453-A455 HydrophobicContact CH2-CB 3.99Å; W453-A455 HydrophobicContact CZ2-CB 3.69Å; W453-A455 HydrophobicContact CZ3-CB 4.3Å; W453-A455 PolarHBondContact O-N 3.4Å; A455-L461 PolarHBondContact N-O 3.35Å; A455-F463 HydrophobicContact CB-CD2 3.57Å; A455-F463 HydrophobicContact CB-CE2 3.6Å; A455-M634 HydrophobicContact CB-CE 4.43Å; A455-M634 HydrophobicContact CB-SD 3.3Å; A455-M634 WeakPolarHBondContact CB-SD 2.98Å
456	D	70.6	Confident	78.1	Confident	37 Å²	37	48.6 Å²	48.6	20%	0.198	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	114.3	174.6	-172.4	-23.6	0	0	0	110.1	D458 R459 H460 L461 M634	D456-D458 VanDerWaalsContact C-N 3.34Å; D456-D458 WeakPolarHBondContact OD1-CA 3.26Å; D456-D458 WeakPolarHBondContact OD1-CB 3.35Å; D456-D458 PolarHBondContact OD1-N 3.36Å; D456-R459 HydrophobicContact CB-CB 4.17Å; D456-R459 PolarHBondContact OD1-N 2.83Å; D456-R459 VanDerWaalsContact OD2-CD 3.23Å; D456-R459 WeakPolarHBondContact OD2-CD 3.29Å; D456-R459 VanDerWaalsContact OD2-CG 3.23Å; D456-R459 WeakPolarHBondContact OD2-CG 3.26Å; D456-R459 IonicContact OD2-NE 3.67Å; D456-H460 WeakPolarHBondContact O-CA 3.33Å; D456-H460 PolarHBondContact O-N 3.09Å; D456-L461 PolarHBondContact O-N 3.48Å; D456-M634 HydrophobicContact CB-CE 3.49Å; D456-M634 VanDerWaalsContact CB-CE 3.49Å
457	S	64.8	Low	79.4	Confident	85 Å²	85	43 Å²	43	59%	0.594	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-33.1	179.5	-51	0	0	0	0	112.3	H460	S457-H460 PolarHBondContact O-CE1 3.12Å; S457-H460 PolarHBondContact O-ND1 2.87Å
458	D	64	Low	79.8	Confident	152 Å²	152	43.2 Å²	43.2	81%	0.813	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-36.6	-173.8	-63.1	-25.8	0	0	0	111.1	D456	D456-D458 VanDerWaalsContact C-N 3.34Å; D456-D458 WeakPolarHBondContact OD1-CA 3.26Å; D456-D458 WeakPolarHBondContact OD1-CB 3.35Å; D456-D458 PolarHBondContact OD1-N 3.36Å
459	R	63.2	Low	79.8	Confident	159 Å²	159	43.4 Å²	43.4	60%	0.6	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.5	174	-62	-176.8	-173.8	-166.5	0.5	114.1	D456 L461 D638	D456-R459 HydrophobicContact CB-CB 4.17Å; D456-R459 PolarHBondContact OD1-N 2.83Å; D456-R459 VanDerWaalsContact OD2-CD 3.23Å; D456-R459 WeakPolarHBondContact OD2-CD 3.29Å; D456-R459 VanDerWaalsContact OD2-CG 3.23Å; D456-R459 WeakPolarHBondContact OD2-CG 3.26Å; D456-R459 IonicContact OD2-NE 3.67Å; R459-L461 PolarHBondContact O-N 3.06Å; R459-L461 VanDerWaalsContact O-N 3.16Å; R459-D638 IonicContact NH1-OD2 2.64Å; R459-D638 PolarHBondContact NH1-OD2 3.22Å
460	H	66.3	Low	79.7	Confident	90 Å²	90	41.8 Å²	41.8	42%	0.417	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	29.1	-179	-59.7	-30.9	0	0	0	115.2	K410 D456 S457	K410-H460 HydrophobicContact CB-CB 4.31Å; K410-H460 HydrophobicContact CD-CB 4.19Å; K410-H460 HydrophobicContact CG-CB 3.87Å; D456-H460 WeakPolarHBondContact O-CA 3.33Å; D456-H460 PolarHBondContact O-N 3.09Å; S457-H460 PolarHBondContact O-CE1 3.12Å; S457-H460 PolarHBondContact O-ND1 2.87Å
461	L	75.2	Confident	79.6	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.6	177	-175.5	66.5	0	0	0	110.8	P411 A455 D456 R459 F463 M634 A637 L646	P411-L461 HydrophobicContact CB-CD1 4.04Å; P411-L461 HydrophobicContact CG-CD1 3.75Å; A455-L461 PolarHBondContact N-O 3.35Å; D456-L461 PolarHBondContact O-N 3.48Å; R459-L461 PolarHBondContact O-N 3.06Å; R459-L461 VanDerWaalsContact O-N 3.16Å; L461-F463 HydrophobicContact CD2-CE2 3.7Å; L461-F463 HydrophobicContact CD2-CZ 3.92Å; L461-F463 HydrophobicContact CG-CE2 4.09Å; L461-M634 HydrophobicContact CB-CE 4.04Å; L461-M634 HydrophobicContact CD2-CE 3.43Å; L461-M634 VanDerWaalsContact CD2-CE 3.43Å; L461-M634 HydrophobicContact CD2-SD 3.65Å; L461-M634 HydrophobicContact CG-CE 4.29Å; L461-A637 HydrophobicContact CD2-CB 3.68Å; L461-L646 HydrophobicContact CD1-CD1 4.21Å; L461-L646 HydrophobicContact CD1-CD2 3.92Å; L461-L646 HydrophobicContact CD1-CG 4.45Å
462	M	78.6	Confident	79.5	Confident	28 Å²	28	46.5 Å²	46.5	14%	0.138	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.5	178.8	-63.3	-172.3	64.2	0	0	111.1	K410 P411 W412 L413 V454	K410-M462 HydrophobicContact CD-SD 4.3Å; P411-M462 PolarHBondContact O-N 2.78Å; W412-M462 CarbonylContact C-O 3.58Å; W412-M462 VanDerWaalsContact CA-O 3.31Å; W412-M462 WeakPolarHBondContact CA-O 3.14Å; W412-M462 HydrophobicContact CD2-CB 3.99Å; W412-M462 HydrophobicContact CE3-CB 4.3Å; W412-M462 HydrophobicContact CG-CB 4.27Å; W412-M462 HydrophobicContact CH2-CE 3.44Å; W412-M462 VanDerWaalsContact CH2-CE 3.44Å; W412-M462 HydrophobicContact CH2-SD 4.41Å; W412-M462 HydrophobicContact CZ2-CE 3.29Å; W412-M462 HydrophobicContact CZ2-SD 3.69Å; W412-M462 HydrophobicContact CZ3-CE 4.13Å; L413-M462 PolarHBondContact N-O 3.03Å; V454-M462 HydrophobicContact CG2-CE 4.18Å
463	F	85	Confident	79.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.1	172	-71.6	-90	0	0	0	111	L413 L415 W453 A455 L461 V465 L487 M634 A637	L413-F463 HydrophobicContact CB-CD1 3.94Å; L413-F463 HydrophobicContact CB-CE1 3.99Å; L413-F463 HydrophobicContact CD2-CD1 4.37Å; L413-F463 HydrophobicContact CD2-CE1 3.66Å; L413-F463 HydrophobicContact CD2-CZ 4.37Å; L413-F463 HydrophobicContact CG-CD1 4.28Å; L413-F463 HydrophobicContact CG-CE1 4.06Å; L413-F463 VanDerWaalsContact O-CA 3.27Å; L413-F463 WeakPolarHBondContact O-CA 3.48Å; L415-F463 HydrophobicContact CB-CD1 3.89Å; L415-F463 HydrophobicContact CD1-CD1 3.92Å; L415-F463 HydrophobicContact CD1-CE1 4.06Å; W453-F463 HydrophobicContact CB-CB 4.23Å; W453-F463 HydrophobicContact CD2-CD2 4.36Å; W453-F463 HydrophobicContact CE3-CB 3.82Å; W453-F463 AromaticContact CE3-CD2 3.65Å; W453-F463 HydrophobicContact CE3-CD2 3.65Å; W453-F463 HydrophobicContact CE3-CE2 4.39Å; W453-F463 AromaticContact CE3-CG 3.85Å; W453-F463 HydrophobicContact CE3-CG 3.85Å; W453-F463 AromaticContact CZ3-CD2 3.79Å; W453-F463 HydrophobicContact CZ3-CD2 3.79Å; W453-F463 HydrophobicContact CZ3-CE2 4.06Å; W453-F463 HydrophobicContact CZ3-CG 4.17Å; W453-F463 PolarHBondContact N-O 3.44Å; W453-F463 PolarHBondContact O-N 2.98Å; A455-F463 HydrophobicContact CB-CD2 3.57Å; A455-F463 HydrophobicContact CB-CE2 3.6Å; L461-F463 HydrophobicContact CD2-CE2 3.7Å; L461-F463 HydrophobicContact CD2-CZ 3.92Å; L461-F463 HydrophobicContact CG-CE2 4.09Å; F463-V465 HydrophobicContact CB-CG2 4.09Å; F463-L487 HydrophobicContact CE1-CD2 4.49Å; F463-M634 HydrophobicContact CE2-SD 3.76Å; F463-M634 HydrophobicContact CZ-SD 4.42Å; F463-A637 HydrophobicContact CZ-CB 4.03Å
464	L	85.1	Confident	79.7	Confident	25 Å²	25	43.8 Å²	43.8	13%	0.131	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	99.8	166.2	-171	63.2	0	0	0	108.2	W412 L413 L415 V450 N452 Y466	W412-L464 HydrophobicContact CE3-CB 4.13Å; W412-L464 HydrophobicContact CZ3-CB 4.44Å; W412-L464 HydrophobicContact CZ3-CD1 4.18Å; L413-L464 PolarHBondContact O-N 3.49Å; L415-L464 PolarHBondContact N-O 3.14Å; V450-L464 HydrophobicContact CG1-CD1 3.4Å; V450-L464 VanDerWaalsContact CG1-CD1 3.4Å; V450-L464 HydrophobicContact CG1-CG 3.89Å; N452-L464 WeakPolarHBondContact OD1-CD1 3.49Å; L464-Y466 HydrophobicContact CB-CE2 4.41Å; L464-Y466 HydrophobicContact CD2-CE2 3.58Å; L464-Y466 HydrophobicContact CG-CD2 4.29Å; L464-Y466 HydrophobicContact CG-CE2 3.6Å
465	V	88.8	Confident	79.9	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	115.4	-172.1	-177.2	0	0	0	0	110.2	L415 L417 R429 V450 T451 W453 F463	L415-V465 HydrophobicContact CB-CG2 4.44Å; L415-V465 HydrophobicContact CD2-CG1 3.87Å; L415-V465 HydrophobicContact CD2-CG2 4.25Å; L415-V465 CarbonylContact O-C 3.5Å; L415-V465 WeakPolarHBondContact O-CA 3.23Å; L417-V465 HydrophobicContact CD1-CG1 4.12Å; L417-V465 HydrophobicContact CG-CG1 4.16Å; R429-V465 HydrophobicContact CG-CG1 4.26Å; V450-V465 WeakPolarHBondContact CA-O 3.47Å; T451-V465 PolarHBondContact N-O 3.19Å; T451-V465 PolarHBondContact O-N 3.04Å; W453-V465 HydrophobicContact CB-CG2 4.02Å; W453-V465 HydrophobicContact CE3-CG2 4.33Å; F463-V465 HydrophobicContact CB-CG2 4.09Å
466	Y	89.6	Confident	80.6	Confident	5 Å²	5	40.7 Å²	40.7	2%	0.02	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.5	173	-73.7	-103.6	0	0	0	110.1	K414 L415 L417 E449 V450 L464 F481 I722	K414-Y466 HydrophobicContact CD-CD2 4.24Å; K414-Y466 HydrophobicContact CD-CE2 3.87Å; K414-Y466 HydrophobicContact CG-CD2 3.81Å; K414-Y466 HydrophobicContact CG-CE2 3.76Å; L415-Y466 PolarHBondContact O-N 3.19Å; L417-Y466 PolarHBondContact N-O 3.06Å; E449-Y466 WeakPolarHBondContact O-CA 3.43Å; V450-Y466 HydrophobicContact CG1-CE1 4.45Å; V450-Y466 HydrophobicContact CG1-CE2 4.35Å; V450-Y466 HydrophobicContact CG2-CD1 3.5Å; V450-Y466 VanDerWaalsContact CG2-CD1 3.5Å; V450-Y466 HydrophobicContact CG2-CE1 3.39Å; V450-Y466 HydrophobicContact CG2-CG 4.15Å; L464-Y466 HydrophobicContact CB-CE2 4.41Å; L464-Y466 HydrophobicContact CD2-CE2 3.58Å; L464-Y466 HydrophobicContact CG-CD2 4.29Å; L464-Y466 HydrophobicContact CG-CE2 3.6Å; Y466-F481 HydrophobicContact CD1-CD1 4.06Å; Y466-F481 AromaticContact CE1-CD1 3.82Å; Y466-F481 HydrophobicContact CE1-CD1 3.82Å; Y466-F481 HydrophobicContact CE1-CE1 4.42Å; Y466-I722 HydrophobicContact CE1-CD1 4.09Å
467	D	90.7	Very high	81.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	102.4	167.3	-173.1	2.1	0	0	0	108.9	K425 T426 I448 E449	K425-D467 VanDerWaalsContact CB-OD1 3.3Å; K425-D467 WeakPolarHBondContact CB-OD1 3.39Å; T426-D467 VanDerWaalsContact CA-OD2 3.31Å; T426-D467 WeakPolarHBondContact CA-OD2 3.04Å; T426-D467 PolarHBondContact N-OD2 3.48Å; T426-D467 PolarHBondContact OG1-OD2 3.42Å; I448-D467 WeakPolarHBondContact CA-O 3.43Å; E449-D467 HydrophobicContact CB-CB 4.45Å; E449-D467 PolarHBondContact N-O 3.24Å; E449-D467 PolarHBondContact O-N 3.42Å
468	L	90.2	Very high	82.5	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.026	18%	0.176	C	C	.	.			trans	-80.5	133.3	178.6	-60.8	-175.1	0	0	0	110.7	V416 L417 M418 K425 I448 G470 F481 L482	V416-L468 HydrophobicContact CG1-CD1 3.48Å; V416-L468 VanDerWaalsContact CG1-CD1 3.48Å; V416-L468 HydrophobicContact CG1-CG 3.77Å; L417-L468 WeakPolarHBondContact O-CB 3.11Å; L417-L468 PolarHBondContact O-N 3.38Å; L417-L468 VanDerWaalsContact O-N 3.13Å; M418-L468 HydrophobicContact CE-CD1 4.08Å; K425-L468 WeakPolarHBondContact CE-O 3.34Å; I448-L468 HydrophobicContact CD1-CD2 4.37Å; I448-L468 HydrophobicContact CG1-CD2 4.43Å; I448-L468 HydrophobicContact CG2-CD2 4.15Å; L468-G470 PolarHBondContact O-N 3.38Å; L468-F481 HydrophobicContact CD2-CB 3.91Å; L468-F481 HydrophobicContact CD2-CD2 4.35Å; L468-F481 HydrophobicContact CD2-CG 4.24Å; L468-L482 HydrophobicContact CD1-CD2 4.06Å
469	S	86.1	Confident	83.7	Confident	8 Å²	8	28.4 Å²	28.4	6%	0.056	14%	0.138	C	C	.	.			trans	-56.8	134.1	176.2	-177.2	0	0	0	0	112.3	G447 N471 Y474 K478	G447-S469 WeakPolarHBondContact O-CB 3.31Å; S469-N471 PolarHBondContact O-N 3.4Å; S469-N471 WeakPolarHBondContact OG-CB 3.4Å; S469-N471 PolarHBondContact OG-N 2.68Å; S469-Y474 WeakPolarHBondContact OG-CD2 3.37Å; S469-K478 WeakPolarHBondContact O-CE 3.47Å; S469-K478 PolarHBondContact O-NZ 3.48Å
470	G	81.6	Confident	84.8	Confident	14 Å²	14	23.8 Å²	23.8	14%	0.144	12%	0.123	C	C	.	.			trans	-81.4	4	171.8	0	0	0	0	0	113.9	G419 L468	G419-G470 WeakPolarHBondContact O-CA 3.32Å; L468-G470 PolarHBondContact O-N 3.38Å
471	N	83.3	Confident	85.7	Confident	41 Å²	41	20.4 Å²	20.4	22%	0.219	11%	0.107	C	C	.	.	S	Bend	trans	-81.2	141.7	177.5	-169.2	-10.3	0	0	0	110.5	S469 N473 Y474 K478	S469-N471 PolarHBondContact O-N 3.4Å; S469-N471 WeakPolarHBondContact OG-CB 3.4Å; S469-N471 PolarHBondContact OG-N 2.68Å; N471-N473 PolarHBondContact ND2-ND2 2.87Å; N471-N473 PolarHBondContact O-N 3.36Å; N471-N473 PolarHBondContact OD1-N 2.79Å; N471-Y474 HydrophobicContact CB-CD2 4.1Å; N471-Y474 PolarHBondContact O-N 2.81Å; N471-K478 PolarHBondContact O-NZ 2.89Å
472	L	83.2	Confident	86.4	Confident	129 Å²	129	20.8 Å²	20.8	68%	0.675	11%	0.109	S	C	*	.	G	3₁₀ helix	trans	-67	-24.8	179	-62.5	173.8	0	0	0	112.2	Y474 D475	L472-Y474 PolarHBondContact O-N 3.09Å; L472-Y474 VanDerWaalsContact O-N 3.09Å; L472-D475 WeakPolarHBondContact CA-OD2 3.49Å; L472-D475 WeakPolarHBondContact CD2-OD2 3.46Å; L472-D475 VanDerWaalsContact O-CB 3.22Å; L472-D475 WeakPolarHBondContact O-CB 3.28Å; L472-D475 VanDerWaalsContact O-CG 3.22Å; L472-D475 PolarHBondContact O-N 2.88Å
473	N	84.6	Confident	86.6	Confident	36 Å²	36	20.3 Å²	20.3	19%	0.193	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-56.9	-29.3	177.1	-61.3	-16.7	0	0	0	112.7	N471 F729 R731	N471-N473 PolarHBondContact ND2-ND2 2.87Å; N471-N473 PolarHBondContact O-N 3.36Å; N471-N473 PolarHBondContact OD1-N 2.79Å; N473-F729 WeakPolarHBondContact CB-O 3.49Å; N473-F729 WeakPolarHBondContact O-CD1 3.46Å; N473-R731 HydrophobicContact CB-CG 4.09Å; N473-R731 VanDerWaalsContact CG-CD 3.41Å; N473-R731 WeakPolarHBondContact ND2-CB 3.5Å; N473-R731 WeakPolarHBondContact ND2-CD 3.23Å; N473-R731 VanDerWaalsContact ND2-CG 3.3Å; N473-R731 WeakPolarHBondContact ND2-CG 3.49Å; N473-R731 WeakPolarHBondContact OD1-CD 3.31Å
474	Y	87.6	Confident	86.4	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.016	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-87.1	-4.5	-177.9	-73.1	-100.9	0	0	0	113.1	G447 I448 S469 N471 L472 L476 I477 K478 N726 F729 Q730	G447-Y474 WeakPolarHBondContact CA-OH 3.3Å; I448-Y474 HydrophobicContact CD1-CD1 3.93Å; I448-Y474 HydrophobicContact CG1-CD1 3.83Å; I448-Y474 HydrophobicContact CG1-CE1 4.17Å; S469-Y474 WeakPolarHBondContact OG-CD2 3.37Å; N471-Y474 HydrophobicContact CB-CD2 4.1Å; N471-Y474 PolarHBondContact O-N 2.81Å; L472-Y474 PolarHBondContact O-N 3.09Å; L472-Y474 VanDerWaalsContact O-N 3.09Å; Y474-L476 PolarHBondContact O-N 3.03Å; Y474-L476 VanDerWaalsContact O-N 3.14Å; Y474-I477 HydrophobicContact CD1-CD1 3.84Å; Y474-I477 HydrophobicContact CD1-CG1 4.25Å; Y474-I477 HydrophobicContact CE1-CD1 4.37Å; Y474-I477 WeakPolarHBondContact O-CG1 3.21Å; Y474-I477 PolarHBondContact O-N 2.91Å; Y474-K478 WeakPolarHBondContact O-CG 3.43Å; Y474-K478 PolarHBondContact O-N 3.46Å; Y474-N726 WeakPolarHBondContact CE1-OD1 3.45Å; Y474-F729 HydrophobicContact CD1-CB 3.97Å; Y474-F729 HydrophobicContact CD2-CB 4.19Å; Y474-F729 HydrophobicContact CE1-CB 3.68Å; Y474-F729 HydrophobicContact CE2-CB 3.93Å; Y474-F729 VanDerWaalsContact CE2-O 3.26Å; Y474-F729 WeakPolarHBondContact CE2-O 3.45Å; Y474-F729 HydrophobicContact CG-CB 4.21Å; Y474-Q730 WeakPolarHBondContact OH-CG 3.37Å
475	D	85.9	Confident	86.1	Confident	24 Å²	24	26.2 Å²	26.2	13%	0.128	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-30	-174.5	-74	-10.7	0	0	0	112.8	L472 I477 K478 P479 P877	L472-D475 WeakPolarHBondContact CA-OD2 3.49Å; L472-D475 WeakPolarHBondContact CD2-OD2 3.46Å; L472-D475 VanDerWaalsContact O-CB 3.22Å; L472-D475 WeakPolarHBondContact O-CB 3.28Å; L472-D475 VanDerWaalsContact O-CG 3.22Å; L472-D475 PolarHBondContact O-N 2.88Å; D475-I477 VanDerWaalsContact C-N 3.31Å; D475-I477 PolarHBondContact O-N 3.43Å; D475-K478 VanDerWaalsContact OD1-CE 3.26Å; D475-K478 WeakPolarHBondContact OD1-CE 3.29Å; D475-K478 IonicContact OD1-NZ 3.15Å; D475-K478 PolarHBondContact OD1-NZ 3.32Å; D475-P479 VanDerWaalsContact O-CD 3.24Å; D475-P479 WeakPolarHBondContact O-CD 3.47Å; D475-P877 HydrophobicContact CB-CB 3.85Å
476	L	88.1	Confident	86.1	Confident	7 Å²	7	26.2 Å²	26.2	4%	0.037	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-37.6	175.2	-172.1	149.5	0	0	0	112.5	Y474 F729 V813 A881 R882	Y474-L476 PolarHBondContact O-N 3.03Å; Y474-L476 VanDerWaalsContact O-N 3.14Å; L476-F729 HydrophobicContact CB-CE1 4.32Å; L476-F729 HydrophobicContact CD2-CZ 4.1Å; L476-V813 HydrophobicContact CD2-CB 4.45Å; L476-V813 HydrophobicContact CD2-CG2 3.79Å; L476-A881 HydrophobicContact CD1-CB 3.69Å; L476-R882 HydrophobicContact CG-CG 4.36Å
477	I	88.3	Confident	86.2	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-18.7	-173.3	60.3	166.9	0	0	0	114.5	I448 Y474 D475 P479 F480 F481 L725 F729 V813	I448-I477 HydrophobicContact CD1-CD1 3.85Å; I448-I477 HydrophobicContact CD1-CG1 4.23Å; Y474-I477 HydrophobicContact CD1-CD1 3.84Å; Y474-I477 HydrophobicContact CD1-CG1 4.25Å; Y474-I477 HydrophobicContact CE1-CD1 4.37Å; Y474-I477 WeakPolarHBondContact O-CG1 3.21Å; Y474-I477 PolarHBondContact O-N 2.91Å; D475-I477 VanDerWaalsContact C-N 3.31Å; D475-I477 PolarHBondContact O-N 3.43Å; I477-P479 VanDerWaalsContact C-N 3.3Å; I477-F480 HydrophobicContact CB-CD2 4.11Å; I477-F480 HydrophobicContact CG2-CD2 4.29Å; I477-F480 HydrophobicContact CG2-CE2 4.32Å; I477-F480 WeakPolarHBondContact O-CD2 3.38Å; I477-F480 PolarHBondContact O-N 2.94Å; I477-F480 VanDerWaalsContact O-N 3.11Å; I477-F481 HydrophobicContact CB-CE2 4.37Å; I477-F481 HydrophobicContact CD1-CE2 4.36Å; I477-F481 HydrophobicContact CG1-CE2 4.48Å; I477-F481 VanDerWaalsContact O-CD2 3.26Å; I477-F481 WeakPolarHBondContact O-CD2 3.41Å; I477-F481 WeakPolarHBondContact O-CE2 3.44Å; I477-L725 HydrophobicContact CD1-CB 4.07Å; I477-L725 HydrophobicContact CD1-CD1 4.31Å; I477-F729 HydrophobicContact CD1-CD2 3.6Å; I477-F729 HydrophobicContact CD1-CE2 3.9Å; I477-F729 HydrophobicContact CD1-CG 4.25Å; I477-F729 HydrophobicContact CG1-CD2 4.25Å; I477-F729 HydrophobicContact CG1-CE2 4.28Å; I477-F729 HydrophobicContact CG2-CD2 4.32Å; I477-F729 HydrophobicContact CG2-CE2 3.52Å; I477-F729 HydrophobicContact CG2-CZ 3.64Å; I477-V813 HydrophobicContact CG2-CG2 4.17Å
478	K	87.5	Confident	86.4	Confident	15 Å²	15	26 Å²	26	7%	0.065	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-48.5	-45.1	176.5	-77.9	172.7	-158.5	176.6	0	113.3	S469 N471 Y474 D475 F480 F481	S469-K478 WeakPolarHBondContact O-CE 3.47Å; S469-K478 PolarHBondContact O-NZ 3.48Å; N471-K478 PolarHBondContact O-NZ 2.89Å; Y474-K478 WeakPolarHBondContact O-CG 3.43Å; Y474-K478 PolarHBondContact O-N 3.46Å; D475-K478 VanDerWaalsContact OD1-CE 3.26Å; D475-K478 WeakPolarHBondContact OD1-CE 3.29Å; D475-K478 IonicContact OD1-NZ 3.15Å; D475-K478 PolarHBondContact OD1-NZ 3.32Å; K478-F480 PolarHBondContact O-N 3.33Å; K478-F481 PolarHBondContact O-N 3.43Å
479	P	88.9	Confident	86.7	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.013	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-60.7	-25.9	-177.3	-25.6	36.9	0	0	0	114.4	D475 I477 F481 L482 K516 P877 W958	D475-P479 VanDerWaalsContact O-CD 3.24Å; D475-P479 WeakPolarHBondContact O-CD 3.47Å; I477-P479 VanDerWaalsContact C-N 3.3Å; P479-F481 PolarHBondContact O-N 3.4Å; P479-L482 PolarHBondContact O-N 2.97Å; P479-K516 HydrophobicContact CB-CD 4.34Å; P479-K516 WeakPolarHBondContact O-CE 3.38Å; P479-P877 HydrophobicContact CG-CG 4.04Å; P479-W958 HydrophobicContact CB-CH2 3.82Å; P479-W958 HydrophobicContact CB-CZ2 3.81Å; P479-W958 HydrophobicContact CG-CH2 3.61Å; P479-W958 HydrophobicContact CG-CZ2 3.74Å
480	F	85.5	Confident	87.1	Confident	62 Å²	62	25.5 Å²	25.5	27%	0.272	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-69.4	-22.7	177.3	-59.9	-63.2	0	0	0	113.1	I477 K478 M811	I477-F480 HydrophobicContact CB-CD2 4.11Å; I477-F480 HydrophobicContact CG2-CD2 4.29Å; I477-F480 HydrophobicContact CG2-CE2 4.32Å; I477-F480 WeakPolarHBondContact O-CD2 3.38Å; I477-F480 PolarHBondContact O-N 2.94Å; I477-F480 VanDerWaalsContact O-N 3.11Å; K478-F480 PolarHBondContact O-N 3.33Å; F480-M811 HydrophobicContact CB-CE 4.03Å; F480-M811 HydrophobicContact CD1-CE 4.16Å; F480-M811 HydrophobicContact CD2-CE 3.37Å; F480-M811 HydrophobicContact CE2-CB 4.35Å; F480-M811 HydrophobicContact CE2-CE 3.84Å; F480-M811 HydrophobicContact CG-CE 3.58Å; F480-M811 HydrophobicContact CZ-CB 4.17Å; F480-M811 HydrophobicContact CZ-CE 4.4Å; F480-M811 WeakPolarHBondContact CZ-O 3.49Å
481	F	86.6	Confident	87.8	Confident	19 Å²	19	24.9 Å²	24.9	8%	0.083	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-91.2	-3.9	177.6	-57.5	-76.8	0	0	0	112.4	K414 I448 Y466 L468 I477 K478 P479 I722 L725	K414-F481 WeakPolarHBondContact CE-O 3.3Å; K414-F481 PolarHBondContact NZ-O 2.65Å; I448-F481 HydrophobicContact CD1-CD2 3.72Å; I448-F481 HydrophobicContact CD1-CE2 3.34Å; I448-F481 HydrophobicContact CD1-CZ 4.03Å; Y466-F481 HydrophobicContact CD1-CD1 4.06Å; Y466-F481 AromaticContact CE1-CD1 3.82Å; Y466-F481 HydrophobicContact CE1-CD1 3.82Å; Y466-F481 HydrophobicContact CE1-CE1 4.42Å; L468-F481 HydrophobicContact CD2-CB 3.91Å; L468-F481 HydrophobicContact CD2-CD2 4.35Å; L468-F481 HydrophobicContact CD2-CG 4.24Å; I477-F481 HydrophobicContact CB-CE2 4.37Å; I477-F481 HydrophobicContact CD1-CE2 4.36Å; I477-F481 HydrophobicContact CG1-CE2 4.48Å; I477-F481 VanDerWaalsContact O-CD2 3.26Å; I477-F481 WeakPolarHBondContact O-CD2 3.41Å; I477-F481 WeakPolarHBondContact O-CE2 3.44Å; K478-F481 PolarHBondContact O-N 3.43Å; P479-F481 PolarHBondContact O-N 3.4Å; F481-I722 HydrophobicContact CE1-CD1 3.8Å; F481-I722 HydrophobicContact CE1-CG1 3.77Å; F481-I722 HydrophobicContact CZ-CD1 4.49Å; F481-I722 HydrophobicContact CZ-CG1 4.04Å; F481-L725 HydrophobicContact CE2-CD1 4.48Å; F481-L725 HydrophobicContact CZ-CD1 3.86Å
482	L	88.8	Confident	88.3	Confident	10 Å²	10	23.1 Å²	23.1	5%	0.052	14%	0.136	C	C	.	.			trans	-90.8	119.3	175.1	-50.1	-177.6	0	0	0	108.7	V416 M418 L468 P479 Y488 L512 L513 K516 V517	V416-L482 HydrophobicContact CG1-CD2 4.44Å; M418-L482 HydrophobicContact CE-CD2 3.4Å; L468-L482 HydrophobicContact CD1-CD2 4.06Å; P479-L482 PolarHBondContact O-N 2.97Å; L482-Y488 WeakPolarHBondContact CA-OH 3.34Å; L482-Y488 HydrophobicContact CD2-CD1 4.49Å; L482-Y488 HydrophobicContact CD2-CE1 3.66Å; L482-L512 HydrophobicContact CD1-CD2 4.38Å; L482-L512 HydrophobicContact CD1-CG 4.29Å; L482-L513 HydrophobicContact CD1-CD2 4.48Å; L482-L513 HydrophobicContact CD2-CD2 4.5Å; L482-K516 HydrophobicContact CB-CG 4.03Å; L482-K516 HydrophobicContact CD1-CB 4.23Å; L482-K516 HydrophobicContact CD1-CG 4.09Å; L482-V517 HydrophobicContact CB-CG2 3.91Å
483	S	84	Confident	88.7	Confident	19 Å²	19	17.9 Å²	17.9	13%	0.133	11%	0.109	C	C	.	.			trans	-133.7	144.3	-178.4	54.1	0	0	0	0	110.7	K414 A486 Y488	K414-S483 WeakPolarHBondContact CD-OG 3.46Å; K414-S483 PolarHBondContact NZ-OG 2.98Å; S483-A486 WeakPolarHBondContact O-CB 3.41Å; S483-A486 PolarHBondContact O-N 3.24Å; S483-Y488 PolarHBondContact N-OH 3.15Å; S483-Y488 VanDerWaalsContact N-OH 3.07Å; S483-Y488 PolarHBondContact O-OH 3.38Å
484	P	80.5	Confident	89	Confident	106 Å²	106	16.2 Å²	16.2	69%	0.688	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	147	169.7	-23.5	33.4	0	0	0	111.9	A486 V517	P484-A486 VanDerWaalsContact C-N 3.27Å; P484-A486 PolarHBondContact O-N 3.21Å; P484-V517 HydrophobicContact CB-CG1 4.31Å; P484-V517 HydrophobicContact CG-CG1 4.27Å
485	G	79.6	Confident	89.2	Confident	43 Å²	43	21 Å²	21	44%	0.443	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	4.5	179.9	0	0	0	0	0	115.8	L413 F643	L413-G485 WeakPolarHBondContact CD1-O 3.44Å; G485-F643 WeakPolarHBondContact O-CD1 3.31Å; G485-F643 WeakPolarHBondContact O-CE1 3.34Å
486	A	88.3	Confident	89.5	Confident	2 Å²	2	22.4 Å²	22.4	2%	0.017	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-83	151	169.8	0	0	0	0	0	112	K414 V416 S483 P484 Y488	K414-A486 HydrophobicContact CB-CB 4.08Å; K414-A486 HydrophobicContact CD-CB 4.34Å; K414-A486 HydrophobicContact CG-CB 4.14Å; K414-A486 WeakPolarHBondContact O-CA 3.37Å; V416-A486 HydrophobicContact CG2-CB 4.31Å; S483-A486 WeakPolarHBondContact O-CB 3.41Å; S483-A486 PolarHBondContact O-N 3.24Å; P484-A486 VanDerWaalsContact C-N 3.27Å; P484-A486 PolarHBondContact O-N 3.21Å; A486-Y488 HydrophobicContact CB-CE2 4.05Å; A486-Y488 WeakPolarHBondContact O-CD2 3.48Å
487	L	91.9	Very high	89.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	116.5	170.7	-178.6	56.1	0	0	0	109.9	L413 K414 L415 V416 F463 V521 L611 L633 V636 F643	L413-L487 HydrophobicContact CD2-CB 4.3Å; L413-L487 HydrophobicContact CD2-CD2 4.5Å; K414-L487 PolarHBondContact O-N 3.27Å; L415-L487 CarbonylContact C-O 3.43Å; L415-L487 WeakPolarHBondContact CA-O 3.4Å; L415-L487 HydrophobicContact CD1-CD2 4.28Å; V416-L487 PolarHBondContact N-O 3.34Å; F463-L487 HydrophobicContact CE1-CD2 4.49Å; L487-V521 HydrophobicContact CD1-CB 4.28Å; L487-V521 HydrophobicContact CD1-CG1 3.77Å; L487-L611 HydrophobicContact CD1-CD1 4.38Å; L487-L633 HydrophobicContact CD2-CD2 3.61Å; L487-L633 HydrophobicContact CG-CD2 4.41Å; L487-V636 HydrophobicContact CD1-CG1 4.3Å; L487-F643 HydrophobicContact CB-CE1 4.44Å; L487-F643 HydrophobicContact CB-CE2 4.32Å; L487-F643 HydrophobicContact CB-CZ 3.68Å; L487-F643 HydrophobicContact CD1-CE2 4.29Å; L487-F643 HydrophobicContact CD1-CZ 3.93Å; L487-F643 HydrophobicContact CG-CZ 4.27Å
488	Y	94.8	Very high	89.9	Confident	1 Å²	1	24.2 Å²	24.2	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.5	-178.9	-64	-81.8	0	0	0	110.9	V416 M418 L482 S483 A486 L513 V517 A520 V521 V522 C523	V416-Y488 HydrophobicContact CB-CD1 3.73Å; V416-Y488 HydrophobicContact CB-CE1 3.93Å; V416-Y488 HydrophobicContact CG1-CD1 4.12Å; V416-Y488 HydrophobicContact CG1-CE1 4.19Å; V416-Y488 HydrophobicContact CG2-CD1 4.3Å; V416-Y488 HydrophobicContact CG2-CE1 4.03Å; M418-Y488 HydrophobicContact CE-CD1 3.6Å; M418-Y488 HydrophobicContact CE-CE1 3.96Å; M418-Y488 HydrophobicContact SD-CD1 3.89Å; M418-Y488 HydrophobicContact SD-CG 4.48Å; L482-Y488 WeakPolarHBondContact CA-OH 3.34Å; L482-Y488 HydrophobicContact CD2-CD1 4.49Å; L482-Y488 HydrophobicContact CD2-CE1 3.66Å; S483-Y488 PolarHBondContact N-OH 3.15Å; S483-Y488 VanDerWaalsContact N-OH 3.07Å; S483-Y488 PolarHBondContact O-OH 3.38Å; A486-Y488 HydrophobicContact CB-CE2 4.05Å; A486-Y488 WeakPolarHBondContact O-CD2 3.48Å; Y488-L513 HydrophobicContact CD1-CD2 3.63Å; Y488-L513 HydrophobicContact CD2-CD2 4.11Å; Y488-L513 HydrophobicContact CE1-CD2 3.63Å; Y488-L513 HydrophobicContact CE2-CD2 4.09Å; Y488-L513 HydrophobicContact CG-CD1 4.17Å; Y488-L513 HydrophobicContact CG-CD2 3.86Å; Y488-V517 HydrophobicContact CE2-CG1 4.49Å; Y488-A520 HydrophobicContact CD2-CB 3.78Å; Y488-A520 HydrophobicContact CE2-CB 3.67Å; Y488-V521 WeakPolarHBondContact CB-O 3.05Å; Y488-V521 PolarHBondContact N-O 3Å; Y488-V522 CarbonylContact O-C 3.59Å; Y488-V522 WeakPolarHBondContact O-CA 3.04Å; Y488-C523 PolarHBondContact O-N 3.36Å
489	V	95.3	Very high	90	Very high	2 Å²	2	27 Å²	27	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	107.4	173.4	-177.5	0	0	0	0	108.5	L415 V416 L417 M418 V491 C523 V525 L633	L415-V489 HydrophobicContact CD1-CG2 4.18Å; L415-V489 HydrophobicContact CD2-CG2 4.07Å; L415-V489 HydrophobicContact CG-CG2 4.08Å; V416-V489 PolarHBondContact O-N 3.36Å; L417-V489 HydrophobicContact CD2-CB 3.71Å; L417-V489 HydrophobicContact CD2-CG1 4.03Å; L417-V489 HydrophobicContact CD2-CG2 4.2Å; M418-V489 PolarHBondContact N-O 2.98Å; V489-V491 HydrophobicContact CG1-CG2 4.21Å; V489-C523 CarbonylContact C-O 3.54Å; V489-C523 WeakPolarHBondContact CA-O 3.4Å; V489-C523 HydrophobicContact CG2-CB 4.42Å; V489-V525 HydrophobicContact CG1-CB 4.1Å; V489-V525 HydrophobicContact CG1-CG2 3.54Å; V489-L633 HydrophobicContact CG2-CD2 4.09Å
490	L	95.7	Very high	90.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	109.5	177	-178	57.7	0	0	0	109.5	M418 I506 F509 L510 V522 C523 L524 V525	M418-L490 HydrophobicContact CG-CD1 4.46Å; L490-I506 HydrophobicContact CD2-CB 4.48Å; L490-I506 HydrophobicContact CD2-CG2 3.94Å; L490-F509 HydrophobicContact CD1-CB 3.75Å; L490-F509 HydrophobicContact CD1-CD1 4.43Å; L490-F509 HydrophobicContact CD1-CD2 3.84Å; L490-F509 HydrophobicContact CD1-CG 3.76Å; L490-F509 HydrophobicContact CD2-CB 4.08Å; L490-L510 HydrophobicContact CD2-CD2 4.33Å; L490-V522 HydrophobicContact CB-CG1 4.15Å; L490-C523 PolarHBondContact N-O 2.77Å; L490-L524 HydrophobicContact CB-CD2 4.04Å; L490-L524 HydrophobicContact CD2-CD2 3.81Å; L490-L524 HydrophobicContact CG-CD2 4.09Å; L490-V525 PolarHBondContact O-N 3.43Å
491	V	94.6	Very high	90.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.9	-175.5	-169.6	0	0	0	0	109.8	M418 A423 K425 L428 V489 V525 T527	M418-V491 PolarHBondContact O-N 3.44Å; A423-V491 HydrophobicContact CB-CB 4.23Å; A423-V491 HydrophobicContact CB-CG1 4.13Å; A423-V491 VanDerWaalsContact CB-O 3.3Å; A423-V491 WeakPolarHBondContact CB-O 3.36Å; A423-V491 VanDerWaalsContact O-CG1 3.27Å; A423-V491 WeakPolarHBondContact O-CG1 3.41Å; K425-V491 HydrophobicContact CG-CB 3.97Å; K425-V491 HydrophobicContact CG-CG1 4.4Å; K425-V491 HydrophobicContact CG-CG2 3.98Å; L428-V491 HydrophobicContact CD2-CG1 4.28Å; L428-V491 HydrophobicContact CD2-CG2 3.71Å; V489-V491 HydrophobicContact CG1-CG2 4.21Å; V491-V525 CarbonylContact C-O 3.57Å; V491-V525 WeakPolarHBondContact CA-O 3.21Å; V491-T527 HydrophobicContact CG1-CG2 3.44Å; V491-T527 VanDerWaalsContact CG1-CG2 3.44Å
492	V	93.9	Very high	90.7	Very high	3 Å²	3	37 Å²	37	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127	-176.8	-175.5	0	0	0	0	109.4	L494 Y497 I506 V525 G526 T527 I544	V492-L494 PolarHBondContact O-N 3.1Å; V492-Y497 HydrophobicContact CG1-CD2 4.25Å; V492-I506 HydrophobicContact CG1-CD1 4.29Å; V492-I506 HydrophobicContact CG1-CG1 4.47Å; V492-I506 HydrophobicContact CG2-CD1 3.87Å; V492-I506 HydrophobicContact CG2-CG1 3.75Å; V492-V525 PolarHBondContact N-O 2.96Å; V492-G526 CarbonylContact O-C 3.25Å; V492-G526 WeakPolarHBondContact O-CA 3.39Å; V492-T527 PolarHBondContact O-N 2.48Å; V492-T527 PolarHBondContact O-OG1 2.91Å; V492-I544 HydrophobicContact CG1-CD1 4.4Å
493	N	92.8	Very high	90.8	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.107	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	106	170.1	-178.8	-28.5	0	0	0	109.2	N422 K495 A496 Y497	N422-N493 PolarHBondContact O-ND2 3.37Å; N493-K495 VanDerWaalsContact C-N 3.25Å; N493-K495 PolarHBondContact O-N 3.1Å; N493-K495 WeakPolarHBondContact OD1-CA 3.36Å; N493-K495 WeakPolarHBondContact OD1-CB 3.44Å; N493-K495 PolarHBondContact OD1-N 2.91Å; N493-A496 HydrophobicContact CB-CB 4.2Å; N493-A496 PolarHBondContact O-N 3.11Å; N493-A496 PolarHBondContact OD1-N 2.96Å; N493-A496 VanDerWaalsContact OD1-N 3.11Å; N493-Y497 WeakPolarHBondContact O-CB 3.47Å; N493-Y497 PolarHBondContact O-N 3.09Å
494	L	91.4	Very high	91.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-29.1	-177.4	-66.7	177.2	0	0	0	112.4	V492 Y497 T527 A529 V537 K540 T541 I544 N616	V492-L494 PolarHBondContact O-N 3.1Å; L494-Y497 PolarHBondContact O-N 3.05Å; L494-T527 WeakPolarHBondContact CB-O 3.42Å; L494-T527 PolarHBondContact N-O 3.04Å; L494-A529 HydrophobicContact CD1-CB 4.15Å; L494-V537 HydrophobicContact CD1-CG1 4.03Å; L494-K540 VanDerWaalsContact O-CD 3.31Å; L494-K540 WeakPolarHBondContact O-CD 3.48Å; L494-K540 WeakPolarHBondContact O-CE 3.3Å; L494-K540 PolarHBondContact O-NZ 3.27Å; L494-T541 HydrophobicContact CD2-CG2 4.45Å; L494-I544 HydrophobicContact CD2-CD1 4.09Å; L494-N616 HydrophobicContact CD1-CB 4.26Å
495	K	91.1	Very high	91.6	Very high	104 Å²	104	39.7 Å²	39.7	45%	0.452	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-42.3	177.7	-173.7	58.4	171.8	-169.1	0	112	N493 H528 L531	N493-K495 VanDerWaalsContact C-N 3.25Å; N493-K495 PolarHBondContact O-N 3.1Å; N493-K495 WeakPolarHBondContact OD1-CA 3.36Å; N493-K495 WeakPolarHBondContact OD1-CB 3.44Å; N493-K495 PolarHBondContact OD1-N 2.91Å; K495-H528 HydrophobicContact CB-CB 4.32Å; K495-L531 HydrophobicContact CB-CB 4.32Å; K495-L531 HydrophobicContact CD-CB 4.19Å; K495-L531 WeakPolarHBondContact CD-O 3.48Å; K495-L531 HydrophobicContact CG-CB 4.23Å; K495-L531 PolarHBondContact NZ-O 3.09Å
496	A	91.1	Very high	92.2	Very high	55 Å²	55	37.6 Å²	37.6	46%	0.455	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-16.8	179.5	0	0	0	0	0	113.6	N493	N493-A496 HydrophobicContact CB-CB 4.2Å; N493-A496 PolarHBondContact O-N 3.11Å; N493-A496 PolarHBondContact OD1-N 2.96Å; N493-A496 VanDerWaalsContact OD1-N 3.11Å
497	Y	93.7	Very high	92.4	Very high	5 Å²	5	37.5 Å²	37.5	2%	0.02	20%	0.201	C	C	.	.			trans	-67.8	135.9	-177.7	178.2	-97.2	0	0	0	112.5	V492 N493 L494 F502 I506 K540 D543 I544	V492-Y497 HydrophobicContact CG1-CD2 4.25Å; N493-Y497 WeakPolarHBondContact O-CB 3.47Å; N493-Y497 PolarHBondContact O-N 3.09Å; L494-Y497 PolarHBondContact O-N 3.05Å; Y497-F502 HydrophobicContact CE2-CB 4.34Å; Y497-F502 HydrophobicContact CE2-CD2 4.15Å; Y497-I506 HydrophobicContact CD2-CD1 4.48Å; Y497-I506 HydrophobicContact CE2-CD1 4.05Å; Y497-K540 HydrophobicContact CD1-CB 4.13Å; Y497-K540 HydrophobicContact CD1-CD 4.35Å; Y497-K540 HydrophobicContact CD1-CG 4.06Å; Y497-K540 WeakPolarHBondContact O-CE 3.5Å; Y497-D543 WeakPolarHBondContact CE1-OD2 3.34Å; Y497-D543 PolarHBondContact OH-OD2 3.43Å; Y497-I544 HydrophobicContact CD1-CD1 4.31Å; Y497-I544 HydrophobicContact CD1-CG1 4.26Å; Y497-I544 HydrophobicContact CD2-CD1 4.37Å; Y497-I544 HydrophobicContact CD2-CG1 4.29Å; Y497-I544 HydrophobicContact CE1-CD1 4.24Å; Y497-I544 HydrophobicContact CE1-CG1 3.69Å; Y497-I544 HydrophobicContact CE2-CD1 4.28Å; Y497-I544 HydrophobicContact CE2-CG1 3.72Å; Y497-I544 HydrophobicContact CG-CD1 4.38Å
498	S	92.1	Very high	92.4	Very high	40 Å²	40	40.1 Å²	40.1	28%	0.28	21%	0.211	S	C	.	.			trans	-145.6	154.8	165.8	65.1	0	0	0	0	109.9	K500 N501 F502	S498-K500 PolarHBondContact O-N 2.98Å; S498-K500 VanDerWaalsContact O-N 3.1Å; S498-N501 PolarHBondContact O-N 3.3Å; S498-F502 PolarHBondContact O-N 2.79Å
499	P	90.3	Very high	92.4	Very high	74 Å²	74	40.9 Å²	40.9	48%	0.481	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-56.6	-30.6	-179	-23.8	30.4	0	0	0	113.6	N501 F502 D543	P499-N501 VanDerWaalsContact C-N 3.29Å; P499-N501 PolarHBondContact O-N 3.03Å; P499-F502 WeakPolarHBondContact O-CB 3.2Å; P499-F502 PolarHBondContact O-N 3.14Å; P499-D543 WeakPolarHBondContact CG-OD2 3.02Å
500	K	89.4	Confident	92.3	Very high	198 Å²	198	41.2 Å²	41.2	86%	0.861	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-65.8	-31.1	178.2	-65.7	-176.4	-178.4	178.2	0	113	S498	S498-K500 PolarHBondContact O-N 2.98Å; S498-K500 VanDerWaalsContact O-N 3.1Å
501	N	91.3	Very high	92.2	Very high	81 Å²	81	42.1 Å²	42.1	43%	0.433	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-104.6	14.8	-176.1	-63.7	-13.9	0	0	0	112.4	S498 P499 Y503 A504 H505	S498-N501 PolarHBondContact O-N 3.3Å; P499-N501 VanDerWaalsContact C-N 3.29Å; P499-N501 PolarHBondContact O-N 3.03Å; N501-Y503 VanDerWaalsContact C-N 3.31Å; N501-Y503 PolarHBondContact O-N 2.88Å; N501-A504 PolarHBondContact O-N 2.88Å; N501-H505 PolarHBondContact O-N 3.21Å; N501-H505 PolarHBondContact O-ND1 2.97Å
502	F	93.6	Very high	92.1	Very high	14 Å²	14	42.3 Å²	42.3	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-52.5	-47.4	180	168.5	-100.8	0	0	0	112.2	Y497 S498 P499 A504 H505 I506 G507 Q547 I548 Q551	Y497-F502 HydrophobicContact CE2-CB 4.34Å; Y497-F502 HydrophobicContact CE2-CD2 4.15Å; S498-F502 PolarHBondContact O-N 2.79Å; P499-F502 WeakPolarHBondContact O-CB 3.2Å; P499-F502 PolarHBondContact O-N 3.14Å; F502-A504 PolarHBondContact O-N 3.26Å; F502-H505 PolarHBondContact O-N 3.44Å; F502-I506 HydrophobicContact CD2-CB 4.08Å; F502-I506 HydrophobicContact CD2-CD1 4.1Å; F502-I506 HydrophobicContact CD2-CG1 4.49Å; F502-I506 HydrophobicContact CE2-CB 3.74Å; F502-I506 HydrophobicContact CE2-CD1 4.02Å; F502-I506 HydrophobicContact CE2-CG1 4.42Å; F502-I506 HydrophobicContact CE2-CG2 3.76Å; F502-I506 HydrophobicContact CZ-CB 4.29Å; F502-I506 HydrophobicContact CZ-CG2 4.1Å; F502-I506 PolarHBondContact O-N 3.18Å; F502-G507 PolarHBondContact O-N 3.4Å; F502-G507 VanDerWaalsContact O-N 3.16Å; F502-Q547 HydrophobicContact CB-CG 4.42Å; F502-Q547 HydrophobicContact CD1-CB 3.8Å; F502-Q547 HydrophobicContact CD1-CG 4.46Å; F502-Q547 HydrophobicContact CD2-CB 3.44Å; F502-Q547 VanDerWaalsContact CD2-CB 3.44Å; F502-Q547 HydrophobicContact CD2-CG 3.99Å; F502-Q547 HydrophobicContact CE1-CB 3.74Å; F502-Q547 HydrophobicContact CE2-CB 3.4Å; F502-Q547 HydrophobicContact CE2-CG 4.42Å; F502-Q547 HydrophobicContact CG-CB 3.65Å; F502-Q547 HydrophobicContact CG-CG 4.03Å; F502-Q547 HydrophobicContact CZ-CB 3.56Å; F502-I548 HydrophobicContact CE2-CG1 3.88Å; F502-I548 HydrophobicContact CZ-CG1 3.76Å; F502-Q551 HydrophobicContact CE1-CB 4.49Å
503	Y	91.1	Very high	92.1	Very high	104 Å²	104	42.2 Å²	42.2	41%	0.408	22%	0.22	S	C	.	.	I	π-helix	trans	-61.3	-43.9	-178.3	-168.4	-101.3	0	0	0	112.3	N501 H505 G507 Y508 H511 F873	N501-Y503 VanDerWaalsContact C-N 3.31Å; N501-Y503 PolarHBondContact O-N 2.88Å; Y503-H505 VanDerWaalsContact C-N 3.31Å; Y503-H505 PolarHBondContact O-N 3.31Å; Y503-G507 PolarHBondContact O-N 3.44Å; Y503-Y508 VanDerWaalsContact O-CB 3.28Å; Y503-Y508 WeakPolarHBondContact O-CB 3.37Å; Y503-Y508 PolarHBondContact O-N 2.54Å; Y503-H511 AromaticContact CE2-CE1 3.78Å; Y503-H511 AromaticContact CE2-ND1 3.52Å; Y503-H511 AromaticContact CZ-ND1 3.77Å; Y503-H511 PolarHBondContact OH-ND1 2.91Å; Y503-H511 VanDerWaalsContact OH-ND1 3.09Å; Y503-F873 PolarHBondContact OH-O 3.28Å
504	A	89.9	Confident	92.1	Very high	60 Å²	60	42 Å²	42	50%	0.496	22%	0.22	S	C	.	.	I	π-helix	trans	-67.1	-30.6	-179.7	0	0	0	0	0	113.3	N501 F502	N501-A504 PolarHBondContact O-N 2.88Å; F502-A504 PolarHBondContact O-N 3.26Å
505	H	91	Very high	92.2	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.12	22%	0.222	C	C	.	.	I	π-helix	trans	-91.4	-33.9	-177.6	-70.8	76.8	0	0	0	113.4	N501 F502 Y503 F509	N501-H505 PolarHBondContact O-N 3.21Å; N501-H505 PolarHBondContact O-ND1 2.97Å; F502-H505 PolarHBondContact O-N 3.44Å; Y503-H505 VanDerWaalsContact C-N 3.31Å; Y503-H505 PolarHBondContact O-N 3.31Å; H505-F509 WeakPolarHBondContact O-CD2 3.44Å
506	I	93.6	Very high	92.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-132.2	-57.1	-168.8	-56.5	179.6	0	0	0	110.8	L490 V492 Y497 F502 Y508 F509 L510 L524 I544 I548	L490-I506 HydrophobicContact CD2-CB 4.48Å; L490-I506 HydrophobicContact CD2-CG2 3.94Å; V492-I506 HydrophobicContact CG1-CD1 4.29Å; V492-I506 HydrophobicContact CG1-CG1 4.47Å; V492-I506 HydrophobicContact CG2-CD1 3.87Å; V492-I506 HydrophobicContact CG2-CG1 3.75Å; Y497-I506 HydrophobicContact CD2-CD1 4.48Å; Y497-I506 HydrophobicContact CE2-CD1 4.05Å; F502-I506 HydrophobicContact CD2-CB 4.08Å; F502-I506 HydrophobicContact CD2-CD1 4.1Å; F502-I506 HydrophobicContact CD2-CG1 4.49Å; F502-I506 HydrophobicContact CE2-CB 3.74Å; F502-I506 HydrophobicContact CE2-CD1 4.02Å; F502-I506 HydrophobicContact CE2-CG1 4.42Å; F502-I506 HydrophobicContact CE2-CG2 3.76Å; F502-I506 HydrophobicContact CZ-CB 4.29Å; F502-I506 HydrophobicContact CZ-CG2 4.1Å; F502-I506 PolarHBondContact O-N 3.18Å; I506-Y508 VanDerWaalsContact C-N 3.32Å; I506-Y508 PolarHBondContact O-N 2.92Å; I506-F509 PolarHBondContact O-N 3.44Å; I506-L510 HydrophobicContact CG2-CD1 3.82Å; I506-L510 HydrophobicContact CG2-CG 4.16Å; I506-L510 PolarHBondContact O-N 2.81Å; I506-L510 VanDerWaalsContact O-N 3.07Å; I506-L524 HydrophobicContact CG2-CD2 4.37Å; I506-I544 HydrophobicContact CD1-CB 4.19Å; I506-I544 HydrophobicContact CD1-CD1 3.93Å; I506-I544 HydrophobicContact CD1-CG1 3.67Å; I506-I544 HydrophobicContact CD1-CG2 3.52Å; I506-I548 HydrophobicContact CG2-CD1 4.19Å; I506-I548 HydrophobicContact CG2-CG1 4.21Å
507	G	92.4	Very high	92.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-57.7	-38.9	-170.4	0	0	0	0	0	114.8	F502 Y503 L510 H511 Q551	F502-G507 PolarHBondContact O-N 3.4Å; F502-G507 VanDerWaalsContact O-N 3.16Å; Y503-G507 PolarHBondContact O-N 3.44Å; G507-L510 PolarHBondContact O-N 3.33Å; G507-H511 PolarHBondContact O-N 2.79Å; G507-Q551 PolarHBondContact O-NE2 2.79Å
508	Y	92.1	Very high	92.1	Very high	55 Å²	55	37 Å²	37	22%	0.216	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-45.5	174.9	170.4	-98	0	0	0	112.1	Y503 I506 H511 L512 L874	Y503-Y508 VanDerWaalsContact O-CB 3.28Å; Y503-Y508 WeakPolarHBondContact O-CB 3.37Å; Y503-Y508 PolarHBondContact O-N 2.54Å; I506-Y508 VanDerWaalsContact C-N 3.32Å; I506-Y508 PolarHBondContact O-N 2.92Å; Y508-H511 PolarHBondContact O-N 2.89Å; Y508-L512 WeakPolarHBondContact O-CB 3.22Å; Y508-L512 PolarHBondContact O-N 3.31Å; Y508-L874 HydrophobicContact CD2-CD1 3.99Å; Y508-L874 HydrophobicContact CE2-CD1 3.71Å
509	F	93.4	Very high	91.9	Very high	17 Å²	17	39.1 Å²	39.1	8%	0.075	20%	0.197	C	C	.	.	H	α-helix	trans	-69.5	-35	-179.8	-66	-78.9	0	0	0	111.8	T420 L490 H505 I506 L512 L513	T420-F509 HydrophobicContact CG2-CE2 4.13Å; L490-F509 HydrophobicContact CD1-CB 3.75Å; L490-F509 HydrophobicContact CD1-CD1 4.43Å; L490-F509 HydrophobicContact CD1-CD2 3.84Å; L490-F509 HydrophobicContact CD1-CG 3.76Å; L490-F509 HydrophobicContact CD2-CB 4.08Å; H505-F509 WeakPolarHBondContact O-CD2 3.44Å; I506-F509 PolarHBondContact O-N 3.44Å; F509-L512 WeakPolarHBondContact O-CB 3.12Å; F509-L512 PolarHBondContact O-N 3.35Å; F509-L513 WeakPolarHBondContact O-CG 3.42Å; F509-L513 PolarHBondContact O-N 3.12Å
510	L	94.1	Very high	92	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-44.6	173.6	-65.5	-178.9	0	0	0	111.6	L490 I506 G507 L512 L513 C514 V522 I548 L608 I610	L490-L510 HydrophobicContact CD2-CD2 4.33Å; I506-L510 HydrophobicContact CG2-CD1 3.82Å; I506-L510 HydrophobicContact CG2-CG 4.16Å; I506-L510 PolarHBondContact O-N 2.81Å; I506-L510 VanDerWaalsContact O-N 3.07Å; G507-L510 PolarHBondContact O-N 3.33Å; L510-L512 VanDerWaalsContact C-N 3.33Å; L510-L512 PolarHBondContact O-N 3.09Å; L510-L513 PolarHBondContact O-N 3.25Å; L510-C514 VanDerWaalsContact O-CB 3.27Å; L510-C514 WeakPolarHBondContact O-CB 3.46Å; L510-C514 PolarHBondContact O-N 3.15Å; L510-V522 HydrophobicContact CD2-CG1 4.27Å; L510-I548 HydrophobicContact CD1-CD1 4.23Å; L510-I548 HydrophobicContact CD1-CG1 3.86Å; L510-I548 HydrophobicContact CD1-CG2 4.24Å; L510-L608 HydrophobicContact CB-CD1 4.18Å; L510-L608 HydrophobicContact CD2-CD1 3.97Å; L510-L608 WeakPolarHBondContact O-CD1 3.3Å; L510-I610 HydrophobicContact CD1-CD1 4.21Å; L510-I610 HydrophobicContact CD2-CD1 4.24Å
511	H	93	Very high	92.1	Very high	19 Å²	19	26.6 Å²	26.6	9%	0.088	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-40.7	172.4	-77.5	175.1	0	0	0	112.4	Y503 G507 Y508 C514 A515 Q551 D555 F873 L874	Y503-H511 AromaticContact CE2-CE1 3.78Å; Y503-H511 AromaticContact CE2-ND1 3.52Å; Y503-H511 AromaticContact CZ-ND1 3.77Å; Y503-H511 PolarHBondContact OH-ND1 2.91Å; Y503-H511 VanDerWaalsContact OH-ND1 3.09Å; G507-H511 PolarHBondContact O-N 2.79Å; Y508-H511 PolarHBondContact O-N 2.89Å; H511-C514 PolarHBondContact O-N 3.37Å; H511-A515 VanDerWaalsContact O-CB 3.27Å; H511-A515 WeakPolarHBondContact O-CB 3.45Å; H511-A515 PolarHBondContact O-N 3.08Å; H511-Q551 PolarHBondContact CD2-NE2 2.76Å; H511-Q551 PolarHBondContact CE1-NE2 3.43Å; H511-Q551 PolarHBondContact NE2-NE2 2.99Å; H511-D555 IonicContact CD2-OD2 2.73Å; H511-D555 IonicContact NE2-OD1 3.63Å; H511-D555 IonicContact NE2-OD2 3.51Å; H511-D555 PolarHBondContact NE2-OD2 3.31Å; H511-F873 PolarHBondContact ND1-O 3.49Å; H511-L874 HydrophobicContact CB-CB 4.31Å
512	L	93.2	Very high	92.3	Very high	6 Å²	6	22.8 Å²	22.8	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-58.6	-48.5	176.6	-179.6	68.7	0	0	0	111.8	L482 Y508 F509 L510 A515 K516 L874 P877 W958	L482-L512 HydrophobicContact CD1-CD2 4.38Å; L482-L512 HydrophobicContact CD1-CG 4.29Å; Y508-L512 WeakPolarHBondContact O-CB 3.22Å; Y508-L512 PolarHBondContact O-N 3.31Å; F509-L512 WeakPolarHBondContact O-CB 3.12Å; F509-L512 PolarHBondContact O-N 3.35Å; L510-L512 VanDerWaalsContact C-N 3.33Å; L510-L512 PolarHBondContact O-N 3.09Å; L512-A515 PolarHBondContact O-N 3.17Å; L512-K516 WeakPolarHBondContact O-CB 3.5Å; L512-K516 PolarHBondContact O-N 2.98Å; L512-L874 HydrophobicContact CB-CD2 4.33Å; L512-L874 HydrophobicContact CD1-CD2 4.18Å; L512-P877 HydrophobicContact CD1-CG 3.6Å; L512-W958 HydrophobicContact CD1-CH2 3.9Å; L512-W958 HydrophobicContact CD1-CZ3 3.82Å
513	L	94.1	Very high	92.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.4	-47.6	177.7	-73.5	175.1	0	0	0	111.4	M418 L482 Y488 F509 L510 A515 K516 V517 V522 L608	M418-L513 HydrophobicContact CE-CD2 3.89Å; M418-L513 HydrophobicContact CE-CG 4.47Å; M418-L513 HydrophobicContact SD-CD1 3.76Å; M418-L513 HydrophobicContact SD-CD2 4.01Å; M418-L513 HydrophobicContact SD-CG 4.06Å; L482-L513 HydrophobicContact CD1-CD2 4.48Å; L482-L513 HydrophobicContact CD2-CD2 4.5Å; Y488-L513 HydrophobicContact CD1-CD2 3.63Å; Y488-L513 HydrophobicContact CD2-CD2 4.11Å; Y488-L513 HydrophobicContact CE1-CD2 3.63Å; Y488-L513 HydrophobicContact CE2-CD2 4.09Å; Y488-L513 HydrophobicContact CG-CD1 4.17Å; Y488-L513 HydrophobicContact CG-CD2 3.86Å; F509-L513 WeakPolarHBondContact O-CG 3.42Å; F509-L513 PolarHBondContact O-N 3.12Å; L510-L513 PolarHBondContact O-N 3.25Å; L513-A515 PolarHBondContact O-N 3.21Å; L513-K516 PolarHBondContact O-N 3.36Å; L513-V517 CarbonylContact O-C 3.59Å; L513-V517 WeakPolarHBondContact O-CA 3.36Å; L513-V517 PolarHBondContact O-N 3.04Å; L513-V522 HydrophobicContact CD1-CG1 4.37Å; L513-V522 HydrophobicContact CD1-CG2 3.59Å; L513-L608 HydrophobicContact CB-CD1 4.42Å; L513-L608 HydrophobicContact CB-CD2 4.01Å
514	C	93.2	Very high	92.5	Very high	15 Å²	15	17.5 Å²	17.5	10%	0.101	10%	0.095	C	C	.	.	H	α-helix	trans	-57.6	-39.5	178.8	-168.5	0	0	0	0	111.6	L510 H511 L608 G960	L510-C514 VanDerWaalsContact O-CB 3.27Å; L510-C514 WeakPolarHBondContact O-CB 3.46Å; L510-C514 PolarHBondContact O-N 3.15Å; H511-C514 PolarHBondContact O-N 3.37Å; C514-L608 HydrophobicContact CB-CD1 4.21Å; C514-L608 HydrophobicContact CB-CD2 4.41Å; C514-L608 HydrophobicContact CB-CG 4.18Å; C514-G960 WeakPolarHBondContact O-CA 3.27Å
515	A	92.9	Very high	92.7	Very high	5 Å²	5	14.6 Å²	14.6	4%	0.041	7%	0.072	C	C	.	.	H	α-helix	trans	-72	-42.8	179	0	0	0	0	0	113.5	H511 L512 L513 L874 W958 G960 L961	H511-A515 VanDerWaalsContact O-CB 3.27Å; H511-A515 WeakPolarHBondContact O-CB 3.45Å; H511-A515 PolarHBondContact O-N 3.08Å; L512-A515 PolarHBondContact O-N 3.17Å; L513-A515 PolarHBondContact O-N 3.21Å; A515-L874 HydrophobicContact CB-CD2 3.87Å; A515-W958 HydrophobicContact CB-CE3 3.96Å; A515-W958 HydrophobicContact CB-CZ3 4.4Å; A515-W958 CarbonylContact O-C 3.24Å; A515-W958 VanDerWaalsContact O-C 3.29Å; A515-G960 CarbonylContact O-C 3.51Å; A515-G960 WeakPolarHBondContact O-CA 3.25Å; A515-G960 PolarHBondContact O-N 3.09Å; A515-L961 HydrophobicContact CB-CB 4.23Å; A515-L961 HydrophobicContact CB-CD1 4.06Å; A515-L961 PolarHBondContact O-N 3.36Å
516	K	92.4	Very high	92.8	Very high	29 Å²	29	13.4 Å²	13.4	13%	0.126	7%	0.066	C	C	.	.	H	α-helix	trans	-88.3	-42.4	-174	-173.4	59.3	-179.6	176.1	0	113.7	P479 L482 L512 L513 E957 W958	P479-K516 HydrophobicContact CB-CD 4.34Å; P479-K516 WeakPolarHBondContact O-CE 3.38Å; L482-K516 HydrophobicContact CB-CG 4.03Å; L482-K516 HydrophobicContact CD1-CB 4.23Å; L482-K516 HydrophobicContact CD1-CG 4.09Å; L512-K516 WeakPolarHBondContact O-CB 3.5Å; L512-K516 PolarHBondContact O-N 2.98Å; L513-K516 PolarHBondContact O-N 3.36Å; K516-E957 VanDerWaalsContact CD-O 3.3Å; K516-E957 WeakPolarHBondContact CD-O 3.47Å; K516-E957 WeakPolarHBondContact CE-O 3.42Å; K516-E957 PolarHBondContact NZ-O 3.03Å; K516-E957 IonicContact NZ-OE2 2.85Å; K516-W958 HydrophobicContact CB-CE3 3.73Å; K516-W958 HydrophobicContact CB-CH2 4.43Å; K516-W958 HydrophobicContact CB-CZ3 3.63Å; K516-W958 HydrophobicContact CD-CD2 4Å; K516-W958 HydrophobicContact CD-CE3 3.94Å; K516-W958 HydrophobicContact CD-CH2 4.34Å; K516-W958 HydrophobicContact CD-CZ2 4.41Å; K516-W958 HydrophobicContact CD-CZ3 4.13Å; K516-W958 HydrophobicContact CG-CE3 4.38Å; K516-W958 HydrophobicContact CG-CZ3 4.26Å
517	V	91.3	Very high	92.7	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.067	C	C	.	.	S	Bend	trans	-131.8	81.2	-174.5	-170.9	0	0	0	0	108.6	L482 P484 Y488 L513 A520	L482-V517 HydrophobicContact CB-CG2 3.91Å; P484-V517 HydrophobicContact CB-CG1 4.31Å; P484-V517 HydrophobicContact CG-CG1 4.27Å; Y488-V517 HydrophobicContact CE2-CG1 4.49Å; L513-V517 CarbonylContact O-C 3.59Å; L513-V517 WeakPolarHBondContact O-CA 3.36Å; L513-V517 PolarHBondContact O-N 3.04Å; V517-A520 HydrophobicContact CB-CB 4.16Å; V517-A520 HydrophobicContact CG1-CB 3.98Å; V517-A520 WeakPolarHBondContact O-CB 3.31Å; V517-A520 PolarHBondContact O-N 3.48Å
518	P	89	Confident	92.5	Very high	22 Å²	22	15.7 Å²	15.7	14%	0.143	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	145.9	172.6	-23.2	32.9	0	0	0	110.3	A520 Y602 Q606 P959	P518-A520 PolarHBondContact O-N 3.01Å; P518-Y602 HydrophobicContact CG-CE1 4.28Å; P518-Q606 HydrophobicContact CB-CB 3.69Å; P518-P959 HydrophobicContact CG-CB 4.23Å; P518-P959 HydrophobicContact CG-CG 3.94Å
519	H	89.5	Confident	92.3	Very high	85 Å²	85	14 Å²	14	39%	0.394	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	17.2	-178	-151.2	50	0	0	0	116.6	Q606 R607 Q609	H519-Q606 PolarHBondContact N-O 2.77Å; H519-R607 WeakPolarHBondContact CA-O 3.42Å; H519-R607 PolarHBondContact ND1-O 2.86Å; H519-R607 VanDerWaalsContact ND1-O 3.13Å; H519-Q609 PolarHBondContact CE1-NE2 2.77Å; H519-Q609 PolarHBondContact NE2-NE2 3.08Å
520	A	91.1	Very high	91.9	Very high	5 Å²	5	16.6 Å²	16.6	4%	0.041	9%	0.089	C	C	.	.			trans	-59.6	144.3	175.4	0	0	0	0	0	113.1	Y488 V517 P518 L608 Q609	Y488-A520 HydrophobicContact CD2-CB 3.78Å; Y488-A520 HydrophobicContact CE2-CB 3.67Å; V517-A520 HydrophobicContact CB-CB 4.16Å; V517-A520 HydrophobicContact CG1-CB 3.98Å; V517-A520 WeakPolarHBondContact O-CB 3.31Å; V517-A520 PolarHBondContact O-N 3.48Å; P518-A520 PolarHBondContact O-N 3.01Å; A520-L608 HydrophobicContact CB-CD2 3.79Å; A520-Q609 PolarHBondContact O-N 3.13Å
521	V	92.6	Very high	91.6	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.03	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.8	179	-175.3	0	0	0	0	109.2	L487 Y488 Q609 L611 V636 I642 F643	L487-V521 HydrophobicContact CD1-CB 4.28Å; L487-V521 HydrophobicContact CD1-CG1 3.77Å; Y488-V521 WeakPolarHBondContact CB-O 3.05Å; Y488-V521 PolarHBondContact N-O 3Å; V521-Q609 WeakPolarHBondContact CA-O 3.4Å; V521-Q609 HydrophobicContact CG2-CB 4.33Å; V521-L611 HydrophobicContact CG1-CD1 4Å; V521-L611 HydrophobicContact CG1-CD2 4.25Å; V521-L611 HydrophobicContact CG1-CG 4.14Å; V521-V636 HydrophobicContact CG1-CG1 4.31Å; V521-I642 HydrophobicContact CB-CG2 4.29Å; V521-I642 HydrophobicContact CG1-CG2 3.94Å; V521-I642 HydrophobicContact CG2-CG2 3.47Å; V521-I642 VanDerWaalsContact CG2-CG2 3.47Å; V521-F643 HydrophobicContact CB-CZ 4.02Å; V521-F643 HydrophobicContact CG1-CZ 4.21Å; V521-F643 HydrophobicContact CG2-CE1 4.25Å; V521-F643 HydrophobicContact CG2-CZ 4.1Å
522	V	95.1	Very high	91.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.5	-171.2	-169.9	0	0	0	0	111.3	Y488 L490 L510 L513 Q609 L611	Y488-V522 CarbonylContact O-C 3.59Å; Y488-V522 WeakPolarHBondContact O-CA 3.04Å; L490-V522 HydrophobicContact CB-CG1 4.15Å; L510-V522 HydrophobicContact CD2-CG1 4.27Å; L513-V522 HydrophobicContact CD1-CG1 4.37Å; L513-V522 HydrophobicContact CD1-CG2 3.59Å; V522-Q609 PolarHBondContact N-O 3.38Å; V522-L611 PolarHBondContact O-N 3.5Å
523	C	94.8	Very high	91	Very high	4 Å²	4	22.1 Å²	22.1	3%	0.027	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.1	170.8	-171.7	0	0	0	0	110.4	Y488 V489 L490 L611	Y488-C523 PolarHBondContact O-N 3.36Å; V489-C523 CarbonylContact C-O 3.54Å; V489-C523 WeakPolarHBondContact CA-O 3.4Å; V489-C523 HydrophobicContact CG2-CB 4.42Å; L490-C523 PolarHBondContact N-O 2.77Å; C523-L611 HydrophobicContact CB-CD1 4.11Å
524	L	94.6	Very high	90.6	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	128	177.2	-71.4	158.8	0	0	0	111	L490 I506 I544 I548 I610 V614 L615	L490-L524 HydrophobicContact CB-CD2 4.04Å; L490-L524 HydrophobicContact CD2-CD2 3.81Å; L490-L524 HydrophobicContact CG-CD2 4.09Å; I506-L524 HydrophobicContact CG2-CD2 4.37Å; L524-I544 HydrophobicContact CD1-CG2 4.41Å; L524-I548 HydrophobicContact CD1-CD1 3.37Å; L524-I548 HydrophobicContact CD2-CD1 4.48Å; L524-I610 HydrophobicContact CD1-CG2 3.83Å; L524-V614 HydrophobicContact CB-CB 4.34Å; L524-V614 HydrophobicContact CB-CG1 4.09Å; L524-V614 HydrophobicContact CB-CG2 3.94Å; L524-V614 HydrophobicContact CD1-CG2 4Å; L524-L615 PolarHBondContact O-N 3.16Å
525	V	94.2	Very high	90.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	116.8	-179.3	178	0	0	0	0	110.3	L428 V489 L490 V491 V492 L615 I617 L629	L428-V525 HydrophobicContact CD2-CG1 4Å; V489-V525 HydrophobicContact CG1-CB 4.1Å; V489-V525 HydrophobicContact CG1-CG2 3.54Å; L490-V525 PolarHBondContact O-N 3.43Å; V491-V525 CarbonylContact C-O 3.57Å; V491-V525 WeakPolarHBondContact CA-O 3.21Å; V492-V525 PolarHBondContact N-O 2.96Å; V525-L615 CarbonylContact C-O 3.44Å; V525-L615 WeakPolarHBondContact CA-O 3.41Å; V525-I617 HydrophobicContact CG1-CD1 3.3Å; V525-I617 HydrophobicContact CG1-CG1 3.59Å; V525-I617 HydrophobicContact CG1-CG2 4.44Å; V525-L629 HydrophobicContact CG1-CD2 4.35Å; V525-L629 HydrophobicContact CG2-CD1 3.8Å; V525-L629 HydrophobicContact CG2-CD2 4.29Å
526	G	92.5	Very high	90.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.3	175.9	0	0	0	0	0	111.8	V492 L615 N616 I617	V492-G526 CarbonylContact O-C 3.25Å; V492-G526 WeakPolarHBondContact O-CA 3.39Å; G526-L615 PolarHBondContact N-O 2.89Å; G526-N616 CarbonylContact O-C 3.55Å; G526-N616 WeakPolarHBondContact O-CA 3.45Å; G526-I617 WeakPolarHBondContact O-CG1 3.48Å; G526-I617 PolarHBondContact O-N 2.97Å
527	T	91.3	Very high	90.1	Very high	2 Å²	2	37 Å²	37	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	171.8	175.1	62.5	0	0	0	0	111.5	A423 V491 V492 L494 A529 I617	A423-T527 PolarHBondContact O-OG1 3.12Å; V491-T527 HydrophobicContact CG1-CG2 3.44Å; V491-T527 VanDerWaalsContact CG1-CG2 3.44Å; V492-T527 PolarHBondContact O-N 2.48Å; V492-T527 PolarHBondContact O-OG1 2.91Å; L494-T527 WeakPolarHBondContact CB-O 3.42Å; L494-T527 PolarHBondContact N-O 3.04Å; T527-A529 PolarHBondContact O-N 2.98Å; T527-I617 HydrophobicContact CG2-CD1 3.93Å; T527-I617 HydrophobicContact CG2-CG1 4.05Å
528	H	89.3	Confident	90	Very high	46 Å²	46	42.7 Å²	42.7	21%	0.213	23%	0.226	C	C	.	.			trans	60.6	28	-179.9	-52.7	78.6	0	0	0	112.7	K495 D530 L531	K495-H528 HydrophobicContact CB-CB 4.32Å; H528-D530 VanDerWaalsContact C-OD1 3.25Å; H528-D530 VanDerWaalsContact CA-OD1 3.27Å; H528-D530 WeakPolarHBondContact CA-OD1 3.46Å; H528-D530 PolarHBondContact O-N 3.03Å; H528-L531 HydrophobicContact CB-CD1 4.12Å; H528-L531 HydrophobicContact CB-CG 4.4Å; H528-L531 PolarHBondContact O-N 3.47Å; H528-L531 VanDerWaalsContact O-N 3.13Å
529	A	86.9	Confident	90.1	Very high	19 Å²	19	48.2 Å²	48.2	16%	0.157	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-63.7	-27.2	177.9	0	0	0	0	0	111.7	L494 T527 L531 C532 V537 N616	L494-A529 HydrophobicContact CD1-CB 4.15Å; T527-A529 PolarHBondContact O-N 2.98Å; A529-L531 PolarHBondContact O-N 3.01Å; A529-C532 PolarHBondContact O-N 3.1Å; A529-V537 HydrophobicContact CB-CG2 4.29Å; A529-N616 HydrophobicContact CB-CB 4.18Å
530	D	85.3	Confident	90.3	Very high	72 Å²	72	45.7 Å²	45.7	39%	0.385	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-65.3	-20.5	174.1	57.8	-36.7	0	0	0	114	H528 T620	H528-D530 VanDerWaalsContact C-OD1 3.25Å; H528-D530 VanDerWaalsContact CA-OD1 3.27Å; H528-D530 WeakPolarHBondContact CA-OD1 3.46Å; H528-D530 PolarHBondContact O-N 3.03Å; D530-T620 WeakPolarHBondContact OD2-CG2 3.25Å; D530-T620 PolarHBondContact OD2-OG1 3.28Å
531	L	86.5	Confident	90.3	Very high	91 Å²	91	46.5 Å²	46.5	48%	0.476	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-91.4	2.1	177.1	-56.5	-177	0	0	0	113.7	K495 H528 A529	K495-L531 HydrophobicContact CB-CB 4.32Å; K495-L531 HydrophobicContact CD-CB 4.19Å; K495-L531 WeakPolarHBondContact CD-O 3.48Å; K495-L531 HydrophobicContact CG-CB 4.23Å; K495-L531 PolarHBondContact NZ-O 3.09Å; H528-L531 HydrophobicContact CB-CD1 4.12Å; H528-L531 HydrophobicContact CB-CG 4.4Å; H528-L531 PolarHBondContact O-N 3.47Å; H528-L531 VanDerWaalsContact O-N 3.13Å; A529-L531 PolarHBondContact O-N 3.01Å
532	C	86.4	Confident	90.3	Very high	17 Å²	17	52.1 Å²	52.1	12%	0.115	27%	0.272	C	S	.	.	S	Bend	trans	-122.1	152.8	-176.4	-56.2	0	0	0	0	109.9	A529 E536 V537	A529-C532 PolarHBondContact O-N 3.1Å; C532-E536 WeakPolarHBondContact CA-OE2 3.29Å; C532-E536 HydrophobicContact CB-CB 4.47Å; C532-E536 HydrophobicContact CB-CG 4.42Å; C532-V537 HydrophobicContact CB-CG2 3.56Å
533	G	87.9	Confident	90.2	Very high	41 Å²	41	53.5 Å²	53.5	42%	0.423	28%	0.279	S	S	.	.			trans	-69.5	153.8	170.7	0	0	0	0	0	111.6	M535 E536 V537	G533-M535 PolarHBondContact O-N 2.61Å; G533-E536 PolarHBondContact N-OE2 3.29Å; G533-E536 WeakPolarHBondContact O-CB 3.1Å; G533-E536 PolarHBondContact O-N 3.36Å; G533-V537 WeakPolarHBondContact O-CG2 3.18Å; G533-V537 PolarHBondContact O-N 3.17Å
534	E	85.8	Confident	90.2	Very high	143 Å²	143	53.3 Å²	53.3	67%	0.668	28%	0.278	S	S	*	.	H	α-helix	trans	-58.1	-44.5	-178.3	-67.1	-166.7	148.2	0	0	112.5	E536 V537 E538 K624	E534-E536 VanDerWaalsContact C-N 3.33Å; E534-E536 PolarHBondContact O-N 3.05Å; E534-V537 PolarHBondContact O-N 3.43Å; E534-E538 PolarHBondContact O-N 3.33Å; E534-K624 IonicContact OE1-NZ 2.78Å
535	M	88.2	Confident	90.1	Very high	149 Å²	149	58.3 Å²	58.3	73%	0.734	30%	0.301	S	S	*	.	H	α-helix	trans	-62.2	-38	173.7	-65.5	-167.9	-62	0	0	112.7	G533 V537 E538 E539	G533-M535 PolarHBondContact O-N 2.61Å; M535-V537 VanDerWaalsContact C-N 3.32Å; M535-V537 PolarHBondContact O-N 3.06Å; M535-E538 PolarHBondContact O-N 2.86Å; M535-E539 WeakPolarHBondContact O-CG 3.15Å; M535-E539 PolarHBondContact O-N 3.39Å
536	E	91.4	Very high	90.1	Very high	62 Å²	62	65.4 Å²	65.4	29%	0.29	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-37.7	178.8	-173.2	-168.8	170.4	0	0	111.3	C532 G533 E534 K540	C532-E536 WeakPolarHBondContact CA-OE2 3.29Å; C532-E536 HydrophobicContact CB-CB 4.47Å; C532-E536 HydrophobicContact CB-CG 4.42Å; G533-E536 PolarHBondContact N-OE2 3.29Å; G533-E536 WeakPolarHBondContact O-CB 3.1Å; G533-E536 PolarHBondContact O-N 3.36Å; E534-E536 VanDerWaalsContact C-N 3.33Å; E534-E536 PolarHBondContact O-N 3.05Å; E536-K540 HydrophobicContact CG-CD 4.12Å; E536-K540 WeakPolarHBondContact O-CB 3.32Å; E536-K540 VanDerWaalsContact O-CG 3.25Å; E536-K540 WeakPolarHBondContact O-CG 3.48Å; E536-K540 PolarHBondContact O-N 2.86Å; E536-K540 WeakPolarHBondContact OE1-CE 3.25Å; E536-K540 IonicContact OE1-NZ 2.79Å; E536-K540 PolarHBondContact OE1-NZ 3.19Å
537	V	88.9	Confident	90.2	Very high	8 Å²	8	67.2 Å²	67.2	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-66.4	-43.9	176.6	172.8	0	0	0	0	110.9	L494 A529 C532 G533 E534 M535 K540 T541 N616	L494-V537 HydrophobicContact CD1-CG1 4.03Å; A529-V537 HydrophobicContact CB-CG2 4.29Å; C532-V537 HydrophobicContact CB-CG2 3.56Å; G533-V537 WeakPolarHBondContact O-CG2 3.18Å; G533-V537 PolarHBondContact O-N 3.17Å; E534-V537 PolarHBondContact O-N 3.43Å; M535-V537 VanDerWaalsContact C-N 3.32Å; M535-V537 PolarHBondContact O-N 3.06Å; V537-K540 PolarHBondContact O-N 2.92Å; V537-T541 HydrophobicContact CG1-CG2 4.39Å; V537-T541 WeakPolarHBondContact O-CB 3.29Å; V537-T541 VanDerWaalsContact O-CG2 3.28Å; V537-T541 WeakPolarHBondContact O-CG2 3.48Å; V537-T541 PolarHBondContact O-N 2.88Å; V537-T541 PolarHBondContact O-OG1 3.48Å; V537-N616 HydrophobicContact CG1-CB 3.81Å; V537-N616 VanDerWaalsContact CG1-ND2 3.29Å; V537-N616 WeakPolarHBondContact CG1-ND2 3.03Å
538	E	89.6	Confident	90.3	Very high	123 Å²	123	67.4 Å²	67.4	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-62.8	-47.1	176.7	-70.4	-177.7	172.7	0	0	111.7	E534 M535 K540 T541 L542	E534-E538 PolarHBondContact O-N 3.33Å; M535-E538 PolarHBondContact O-N 2.86Å; E538-K540 PolarHBondContact O-N 3.48Å; E538-T541 WeakPolarHBondContact CA-OG1 3.35Å; E538-T541 PolarHBondContact O-N 3.37Å; E538-T541 PolarHBondContact O-OG1 3.09Å; E538-L542 WeakPolarHBondContact O-CB 3.35Å; E538-L542 WeakPolarHBondContact O-CG 3.4Å; E538-L542 PolarHBondContact O-N 3.03Å
539	E	91.3	Very high	90.5	Very high	138 Å²	138	66.4 Å²	66.4	65%	0.645	34%	0.338	S	S	*	.	H	α-helix	trans	-58.9	-46.6	176.4	-74.8	-179.8	172.5	0	0	112.2	M535 L542 D543	M535-E539 WeakPolarHBondContact O-CG 3.15Å; M535-E539 PolarHBondContact O-N 3.39Å; E539-L542 PolarHBondContact O-N 2.87Å; E539-D543 WeakPolarHBondContact O-CB 3.37Å; E539-D543 PolarHBondContact O-N 3.44Å
540	K	93.3	Very high	90.9	Very high	31 Å²	31	69 Å²	69	14%	0.135	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-40.9	179.9	-75.8	176.7	170.5	176.7	0	112.3	L494 Y497 E536 V537 E538 D543 I544	L494-K540 VanDerWaalsContact O-CD 3.31Å; L494-K540 WeakPolarHBondContact O-CD 3.48Å; L494-K540 WeakPolarHBondContact O-CE 3.3Å; L494-K540 PolarHBondContact O-NZ 3.27Å; Y497-K540 HydrophobicContact CD1-CB 4.13Å; Y497-K540 HydrophobicContact CD1-CD 4.35Å; Y497-K540 HydrophobicContact CD1-CG 4.06Å; Y497-K540 WeakPolarHBondContact O-CE 3.5Å; E536-K540 HydrophobicContact CG-CD 4.12Å; E536-K540 WeakPolarHBondContact O-CB 3.32Å; E536-K540 VanDerWaalsContact O-CG 3.25Å; E536-K540 WeakPolarHBondContact O-CG 3.48Å; E536-K540 PolarHBondContact O-N 2.86Å; E536-K540 WeakPolarHBondContact OE1-CE 3.25Å; E536-K540 IonicContact OE1-NZ 2.79Å; E536-K540 PolarHBondContact OE1-NZ 3.19Å; V537-K540 PolarHBondContact O-N 2.92Å; E538-K540 PolarHBondContact O-N 3.48Å; K540-D543 PolarHBondContact O-N 3.22Å; K540-I544 WeakPolarHBondContact O-CG1 3.44Å; K540-I544 PolarHBondContact O-N 3.41Å
541	T	91.5	Very high	91.2	Very high	22 Å²	22	66.8 Å²	66.8	14%	0.135	34%	0.337	C	S	.	.	H	α-helix	trans	-68.2	-37.9	178.7	50.4	0	0	0	0	112	L494 V537 E538 H545 V614	L494-T541 HydrophobicContact CD2-CG2 4.45Å; V537-T541 HydrophobicContact CG1-CG2 4.39Å; V537-T541 WeakPolarHBondContact O-CB 3.29Å; V537-T541 VanDerWaalsContact O-CG2 3.28Å; V537-T541 WeakPolarHBondContact O-CG2 3.48Å; V537-T541 PolarHBondContact O-N 2.88Å; V537-T541 PolarHBondContact O-OG1 3.48Å; E538-T541 WeakPolarHBondContact CA-OG1 3.35Å; E538-T541 PolarHBondContact O-N 3.37Å; E538-T541 PolarHBondContact O-OG1 3.09Å; T541-H545 PolarHBondContact O-N 2.91Å; T541-V614 HydrophobicContact CG2-CB 4.05Å; T541-V614 HydrophobicContact CG2-CG1 3.92Å
542	L	92.1	Very high	91.4	Very high	124 Å²	124	65 Å²	65	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-66.4	-42.9	172.2	-72.6	172.6	0	0	0	112.4	E538 E539 I544 H545 R546	E538-L542 WeakPolarHBondContact O-CB 3.35Å; E538-L542 WeakPolarHBondContact O-CG 3.4Å; E538-L542 PolarHBondContact O-N 3.03Å; E539-L542 PolarHBondContact O-N 2.87Å; L542-I544 PolarHBondContact O-N 2.95Å; L542-H545 PolarHBondContact O-N 2.88Å; L542-R546 PolarHBondContact O-N 3.15Å
543	D	93.3	Very high	91.7	Very high	29 Å²	29	73.1 Å²	73.1	16%	0.155	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-44.1	175.5	176.7	68.9	0	0	0	111.1	Y497 P499 E539 K540 H545 R546 Q547	Y497-D543 WeakPolarHBondContact CE1-OD2 3.34Å; Y497-D543 PolarHBondContact OH-OD2 3.43Å; P499-D543 WeakPolarHBondContact CG-OD2 3.02Å; E539-D543 WeakPolarHBondContact O-CB 3.37Å; E539-D543 PolarHBondContact O-N 3.44Å; K540-D543 PolarHBondContact O-N 3.22Å; D543-H545 VanDerWaalsContact C-N 3.3Å; D543-H545 PolarHBondContact O-N 3.3Å; D543-R546 WeakPolarHBondContact O-CB 3.42Å; D543-R546 PolarHBondContact O-N 3.03Å; D543-R546 VanDerWaalsContact O-N 3.12Å; D543-Q547 VanDerWaalsContact O-CG 3.28Å; D543-Q547 WeakPolarHBondContact O-CG 3.38Å; D543-Q547 PolarHBondContact O-N 3Å; D543-Q547 PolarHBondContact OD1-NE2 3.3Å; D543-Q547 VanDerWaalsContact OD1-NE2 3.13Å
544	I	94.1	Very high	91.9	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-53.6	-49.2	174.9	-72.5	166.5	0	0	0	110.7	V492 L494 Y497 I506 L524 K540 L542 R546 Q547 I548 V614	V492-I544 HydrophobicContact CG1-CD1 4.4Å; L494-I544 HydrophobicContact CD2-CD1 4.09Å; Y497-I544 HydrophobicContact CD1-CD1 4.31Å; Y497-I544 HydrophobicContact CD1-CG1 4.26Å; Y497-I544 HydrophobicContact CD2-CD1 4.37Å; Y497-I544 HydrophobicContact CD2-CG1 4.29Å; Y497-I544 HydrophobicContact CE1-CD1 4.24Å; Y497-I544 HydrophobicContact CE1-CG1 3.69Å; Y497-I544 HydrophobicContact CE2-CD1 4.28Å; Y497-I544 HydrophobicContact CE2-CG1 3.72Å; Y497-I544 HydrophobicContact CG-CD1 4.38Å; I506-I544 HydrophobicContact CD1-CB 4.19Å; I506-I544 HydrophobicContact CD1-CD1 3.93Å; I506-I544 HydrophobicContact CD1-CG1 3.67Å; I506-I544 HydrophobicContact CD1-CG2 3.52Å; L524-I544 HydrophobicContact CD1-CG2 4.41Å; K540-I544 WeakPolarHBondContact O-CG1 3.44Å; K540-I544 PolarHBondContact O-N 3.41Å; L542-I544 PolarHBondContact O-N 2.95Å; I544-R546 VanDerWaalsContact C-N 3.34Å; I544-R546 PolarHBondContact O-N 2.95Å; I544-Q547 PolarHBondContact O-N 2.69Å; I544-I548 HydrophobicContact CG2-CD1 3.84Å; I544-I548 VanDerWaalsContact O-CG1 3.26Å; I544-I548 WeakPolarHBondContact O-CG1 3.12Å; I544-I548 PolarHBondContact O-N 2.77Å; I544-V614 HydrophobicContact CG2-CG2 4.1Å
545	H	93.3	Very high	92.2	Very high	108 Å²	108	68.2 Å²	68.2	50%	0.5	33%	0.329	S	S	.	.	H	α-helix	trans	-62.2	-42.3	179.3	-169.6	69.9	0	0	0	112.1	T541 L542 D543 I548 G549	T541-H545 PolarHBondContact O-N 2.91Å; L542-H545 PolarHBondContact O-N 2.88Å; D543-H545 VanDerWaalsContact C-N 3.3Å; D543-H545 PolarHBondContact O-N 3.3Å; H545-I548 PolarHBondContact O-N 3.5Å; H545-G549 PolarHBondContact O-N 3.1Å
546	R	93.8	Very high	92.3	Very high	149 Å²	149	63.2 Å²	63.2	56%	0.562	30%	0.304	S	S	*	.	H	α-helix	trans	-61.2	-46.4	175.9	-178.1	-178.5	176.1	-82.3	-3	112	L542 D543 I544 G549 L550	L542-R546 PolarHBondContact O-N 3.15Å; D543-R546 WeakPolarHBondContact O-CB 3.42Å; D543-R546 PolarHBondContact O-N 3.03Å; D543-R546 VanDerWaalsContact O-N 3.12Å; I544-R546 VanDerWaalsContact C-N 3.34Å; I544-R546 PolarHBondContact O-N 2.95Å; R546-G549 PolarHBondContact O-N 3.22Å; R546-L550 HydrophobicContact CG-CD1 4.38Å; R546-L550 WeakPolarHBondContact O-CG 3.49Å; R546-L550 PolarHBondContact O-N 2.82Å
547	Q	94.4	Very high	92.4	Very high	38 Å²	38	67.2 Å²	67.2	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-38.5	-179	-65.3	-61.1	-25.7	0	0	112	F502 D543 I544 L550 Q551	F502-Q547 HydrophobicContact CB-CG 4.42Å; F502-Q547 HydrophobicContact CD1-CB 3.8Å; F502-Q547 HydrophobicContact CD1-CG 4.46Å; F502-Q547 HydrophobicContact CD2-CB 3.44Å; F502-Q547 VanDerWaalsContact CD2-CB 3.44Å; F502-Q547 HydrophobicContact CD2-CG 3.99Å; F502-Q547 HydrophobicContact CE1-CB 3.74Å; F502-Q547 HydrophobicContact CE2-CB 3.4Å; F502-Q547 HydrophobicContact CE2-CG 4.42Å; F502-Q547 HydrophobicContact CG-CB 3.65Å; F502-Q547 HydrophobicContact CG-CG 4.03Å; F502-Q547 HydrophobicContact CZ-CB 3.56Å; D543-Q547 VanDerWaalsContact O-CG 3.28Å; D543-Q547 WeakPolarHBondContact O-CG 3.38Å; D543-Q547 PolarHBondContact O-N 3Å; D543-Q547 PolarHBondContact OD1-NE2 3.3Å; D543-Q547 VanDerWaalsContact OD1-NE2 3.13Å; I544-Q547 PolarHBondContact O-N 2.69Å; Q547-L550 PolarHBondContact O-N 3.35Å; Q547-Q551 PolarHBondContact O-N 2.53Å
548	I	94.1	Very high	92.5	Very high	6 Å²	6	69.1 Å²	69.1	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-49.6	172.5	-69.2	171.7	0	0	0	110.3	F502 I506 L510 L524 I544 H545 L550 Q551 E552 I610	F502-I548 HydrophobicContact CE2-CG1 3.88Å; F502-I548 HydrophobicContact CZ-CG1 3.76Å; I506-I548 HydrophobicContact CG2-CD1 4.19Å; I506-I548 HydrophobicContact CG2-CG1 4.21Å; L510-I548 HydrophobicContact CD1-CD1 4.23Å; L510-I548 HydrophobicContact CD1-CG1 3.86Å; L510-I548 HydrophobicContact CD1-CG2 4.24Å; L524-I548 HydrophobicContact CD1-CD1 3.37Å; L524-I548 HydrophobicContact CD2-CD1 4.48Å; I544-I548 HydrophobicContact CG2-CD1 3.84Å; I544-I548 VanDerWaalsContact O-CG1 3.26Å; I544-I548 WeakPolarHBondContact O-CG1 3.12Å; I544-I548 PolarHBondContact O-N 2.77Å; H545-I548 PolarHBondContact O-N 3.5Å; I548-L550 VanDerWaalsContact C-N 3.27Å; I548-L550 PolarHBondContact O-N 2.8Å; I548-Q551 PolarHBondContact O-N 3.04Å; I548-E552 PolarHBondContact O-N 3.5Å; I548-I610 HydrophobicContact CG2-CD1 3.39Å
549	G	92.8	Very high	92.6	Very high	24 Å²	24	63.3 Å²	63.3	25%	0.247	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-33.7	177.7	0	0	0	0	0	113.4	H545 R546 R553	H545-G549 PolarHBondContact O-N 3.1Å; R546-G549 PolarHBondContact O-N 3.22Å; G549-R553 WeakPolarHBondContact O-CB 3.37Å; G549-R553 WeakPolarHBondContact O-CG 3.36Å; G549-R553 PolarHBondContact O-N 3.39Å; G549-R553 VanDerWaalsContact O-N 3.09Å
550	L	94	Very high	92.7	Very high	74 Å²	74	64.2 Å²	64.2	39%	0.387	31%	0.307	S	S	.	.	H	α-helix	trans	-68.8	-44.1	174	-72	173.7	0	0	0	112.2	R546 Q547 I548 R553 S554	R546-L550 HydrophobicContact CG-CD1 4.38Å; R546-L550 WeakPolarHBondContact O-CG 3.49Å; R546-L550 PolarHBondContact O-N 2.82Å; Q547-L550 PolarHBondContact O-N 3.35Å; I548-L550 VanDerWaalsContact C-N 3.27Å; I548-L550 PolarHBondContact O-N 2.8Å; L550-R553 PolarHBondContact O-N 3.03Å; L550-S554 WeakPolarHBondContact O-CB 3.42Å; L550-S554 PolarHBondContact O-N 3.32Å
551	Q	92.2	Very high	92.8	Very high	26 Å²	26	65.1 Å²	65.1	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-49.3	176.6	-175.4	174.7	-34.7	0	0	110.7	F502 G507 H511 Q547 I548 R553 S554 D555	F502-Q551 HydrophobicContact CE1-CB 4.49Å; G507-Q551 PolarHBondContact O-NE2 2.79Å; H511-Q551 PolarHBondContact CD2-NE2 2.76Å; H511-Q551 PolarHBondContact CE1-NE2 3.43Å; H511-Q551 PolarHBondContact NE2-NE2 2.99Å; Q547-Q551 PolarHBondContact O-N 2.53Å; I548-Q551 PolarHBondContact O-N 3.04Å; Q551-R553 PolarHBondContact O-N 2.75Å; Q551-S554 WeakPolarHBondContact O-CB 3.48Å; Q551-S554 PolarHBondContact O-N 2.92Å; Q551-S554 VanDerWaalsContact O-N 3.17Å; Q551-D555 PolarHBondContact O-N 3.48Å
552	E	91.9	Very high	92.8	Very high	53 Å²	53	65.5 Å²	65.5	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-61.6	-41.6	179	-72.6	-166.8	149.4	0	0	113.1	I548 S554 D555 I556 I610	I548-E552 PolarHBondContact O-N 3.5Å; E552-S554 VanDerWaalsContact C-N 3.33Å; E552-S554 PolarHBondContact O-N 2.95Å; E552-D555 PolarHBondContact O-N 3.13Å; E552-I556 WeakPolarHBondContact O-CB 2.87Å; E552-I556 WeakPolarHBondContact O-CD1 3.13Å; E552-I556 WeakPolarHBondContact O-CG1 3.32Å; E552-I556 PolarHBondContact O-N 3.28Å; E552-I610 WeakPolarHBondContact OE1-CD1 3.4Å
553	R	92.8	Very high	92.8	Very high	187 Å²	187	60.3 Å²	60.3	71%	0.706	29%	0.291	S	S	*	.	H	α-helix	trans	-61.4	-43.4	175.6	-76.9	174.4	-173.5	-177.6	3.3	111.5	G549 L550 Q551 Q557	G549-R553 WeakPolarHBondContact O-CB 3.37Å; G549-R553 WeakPolarHBondContact O-CG 3.36Å; G549-R553 PolarHBondContact O-N 3.39Å; G549-R553 VanDerWaalsContact O-N 3.09Å; L550-R553 PolarHBondContact O-N 3.03Å; Q551-R553 PolarHBondContact O-N 2.75Å; R553-Q557 VanDerWaalsContact O-CB 3.26Å; R553-Q557 WeakPolarHBondContact O-CB 3.28Å; R553-Q557 PolarHBondContact O-N 2.78Å
554	S	91.6	Very high	92.7	Very high	72 Å²	72	64.8 Å²	64.8	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-61.8	-46.3	177.4	-175.7	0	0	0	0	111.5	L550 Q551 E552 Q557 C558	L550-S554 WeakPolarHBondContact O-CB 3.42Å; L550-S554 PolarHBondContact O-N 3.32Å; Q551-S554 WeakPolarHBondContact O-CB 3.48Å; Q551-S554 PolarHBondContact O-N 2.92Å; Q551-S554 VanDerWaalsContact O-N 3.17Å; E552-S554 VanDerWaalsContact C-N 3.33Å; E552-S554 PolarHBondContact O-N 2.95Å; S554-Q557 PolarHBondContact O-N 3.02Å; S554-C558 WeakPolarHBondContact O-CB 3.49Å; S554-C558 PolarHBondContact O-N 3.46Å
555	D	90.7	Very high	92.7	Very high	10 Å²	10	68.1 Å²	68.1	5%	0.053	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-48.4	178.7	-62.3	-12.9	0	0	0	111.8	H511 Q551 E552 Q557 C558 L559 R607	H511-D555 IonicContact CD2-OD2 2.73Å; H511-D555 IonicContact NE2-OD1 3.63Å; H511-D555 IonicContact NE2-OD2 3.51Å; H511-D555 PolarHBondContact NE2-OD2 3.31Å; Q551-D555 PolarHBondContact O-N 3.48Å; E552-D555 PolarHBondContact O-N 3.13Å; D555-Q557 VanDerWaalsContact C-N 3.31Å; D555-Q557 PolarHBondContact O-N 3.06Å; D555-C558 WeakPolarHBondContact O-CB 3.26Å; D555-C558 PolarHBondContact O-N 2.67Å; D555-L559 WeakPolarHBondContact O-CG 3.43Å; D555-L559 PolarHBondContact O-N 3.02Å; D555-R607 IonicContact OD2-CZ 2.74Å; D555-R607 IonicContact OD2-NH1 3.43Å; D555-R607 IonicContact OD2-NH2 2.67Å; D555-R607 PolarHBondContact OD2-NH2 2.69Å
556	I	91.7	Very high	92.6	Very high	43 Å²	43	63 Å²	63	22%	0.221	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-41.5	-180	-70.7	167.4	0	0	0	110.2	E552 L559 R560 L604	E552-I556 WeakPolarHBondContact O-CB 2.87Å; E552-I556 WeakPolarHBondContact O-CD1 3.13Å; E552-I556 WeakPolarHBondContact O-CG1 3.32Å; E552-I556 PolarHBondContact O-N 3.28Å; I556-L559 PolarHBondContact O-N 2.95Å; I556-R560 HydrophobicContact CG2-CG 4.24Å; I556-R560 VanDerWaalsContact O-CB 3.31Å; I556-R560 WeakPolarHBondContact O-CB 3.4Å; I556-R560 VanDerWaalsContact O-CG 3.3Å; I556-R560 WeakPolarHBondContact O-CG 3.42Å; I556-R560 PolarHBondContact O-N 3Å; I556-L604 HydrophobicContact CG2-CD2 4.16Å
557	Q	94.1	Very high	92.4	Very high	146 Å²	146	58 Å²	58	68%	0.682	29%	0.288	S	S	*	.	H	α-helix	trans	-63.4	-42.1	177.1	-175.2	175.1	2	0	0	111.5	R553 S554 D555 S561	R553-Q557 VanDerWaalsContact O-CB 3.26Å; R553-Q557 WeakPolarHBondContact O-CB 3.28Å; R553-Q557 PolarHBondContact O-N 2.78Å; S554-Q557 PolarHBondContact O-N 3.02Å; D555-Q557 VanDerWaalsContact C-N 3.31Å; D555-Q557 PolarHBondContact O-N 3.06Å; Q557-S561 WeakPolarHBondContact O-CB 3.14Å; Q557-S561 PolarHBondContact O-N 2.92Å
558	C	90.8	Very high	92.2	Very high	49 Å²	49	60.9 Å²	60.9	33%	0.331	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-50.4	175.7	-176.8	0	0	0	0	111.5	S554 D555 R560 S561 L562 F873	S554-C558 WeakPolarHBondContact O-CB 3.49Å; S554-C558 PolarHBondContact O-N 3.46Å; D555-C558 WeakPolarHBondContact O-CB 3.26Å; D555-C558 PolarHBondContact O-N 2.67Å; C558-R560 PolarHBondContact O-N 3.34Å; C558-S561 PolarHBondContact O-N 2.88Å; C558-L562 WeakPolarHBondContact O-CG 3.2Å; C558-L562 PolarHBondContact O-N 2.89Å; C558-L562 VanDerWaalsContact O-N 3.09Å; C558-F873 HydrophobicContact CB-CE1 4.34Å; C558-F873 HydrophobicContact CB-CZ 3.93Å
559	L	91.3	Very high	91.8	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-42.7	178.9	-68.7	174.8	0	0	0	112.3	D555 I556 S561 L562 V563 L600 M603 L604 F873	D555-L559 WeakPolarHBondContact O-CG 3.43Å; D555-L559 PolarHBondContact O-N 3.02Å; I556-L559 PolarHBondContact O-N 2.95Å; L559-S561 VanDerWaalsContact C-N 3.35Å; L559-S561 PolarHBondContact O-N 3.37Å; L559-L562 PolarHBondContact O-N 3.5Å; L559-V563 WeakPolarHBondContact O-CG2 3.2Å; L559-V563 PolarHBondContact O-N 3.36Å; L559-L600 HydrophobicContact CD2-CD2 3.97Å; L559-M603 HydrophobicContact CD1-CB 4.21Å; L559-M603 HydrophobicContact CD1-CE 4.5Å; L559-M603 HydrophobicContact CD2-CE 4.19Å; L559-M603 HydrophobicContact CD2-SD 4.49Å; L559-L604 HydrophobicContact CB-CD1 4.49Å; L559-L604 HydrophobicContact CB-CD2 3.73Å; L559-L604 HydrophobicContact CB-CG 4.01Å; L559-L604 HydrophobicContact CD1-CD2 4.19Å; L559-L604 HydrophobicContact CD1-CG 4.42Å; L559-F873 HydrophobicContact CD2-CE2 4.42Å
560	R	93.6	Very high	91.5	Very high	156 Å²	156	61.2 Å²	61.2	59%	0.589	30%	0.3	S	S	*	.	H	α-helix	trans	-62.9	-40.3	176.1	-77.2	-179.9	178.2	176.1	0.2	112.3	I556 C558 L562 V563 Q564 L604	I556-R560 HydrophobicContact CG2-CG 4.24Å; I556-R560 VanDerWaalsContact O-CB 3.31Å; I556-R560 WeakPolarHBondContact O-CB 3.4Å; I556-R560 VanDerWaalsContact O-CG 3.3Å; I556-R560 WeakPolarHBondContact O-CG 3.42Å; I556-R560 PolarHBondContact O-N 3Å; C558-R560 PolarHBondContact O-N 3.34Å; R560-L562 VanDerWaalsContact C-N 3.3Å; R560-L562 PolarHBondContact O-N 3.19Å; R560-V563 PolarHBondContact O-N 2.87Å; R560-Q564 WeakPolarHBondContact O-CG 3.47Å; R560-Q564 PolarHBondContact O-N 3.03Å; R560-L604 HydrophobicContact CG-CD1 4.15Å; R560-L604 HydrophobicContact CG-CD2 4.09Å
561	S	94	Very high	91.2	Very high	51 Å²	51	65.1 Å²	65.1	36%	0.357	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-40.2	175.7	-175.5	0	0	0	0	111.5	Q557 C558 L559 Q564 Q565	Q557-S561 WeakPolarHBondContact O-CB 3.14Å; Q557-S561 PolarHBondContact O-N 2.92Å; C558-S561 PolarHBondContact O-N 2.88Å; L559-S561 VanDerWaalsContact C-N 3.35Å; L559-S561 PolarHBondContact O-N 3.37Å; S561-Q564 PolarHBondContact O-N 3.21Å; S561-Q565 WeakPolarHBondContact O-CG 3.26Å; S561-Q565 PolarHBondContact O-N 3.02Å
562	L	91.8	Very high	90.8	Very high	29 Å²	29	68.1 Å²	68.1	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-66.3	-41.5	175.3	-67.5	169.1	0	0	0	112.4	C558 L559 R560 Q564 Q565 V566 L600 H962	C558-L562 WeakPolarHBondContact O-CG 3.2Å; C558-L562 PolarHBondContact O-N 2.89Å; C558-L562 VanDerWaalsContact O-N 3.09Å; L559-L562 PolarHBondContact O-N 3.5Å; R560-L562 VanDerWaalsContact C-N 3.3Å; R560-L562 PolarHBondContact O-N 3.19Å; L562-Q564 VanDerWaalsContact C-N 3.33Å; L562-Q564 PolarHBondContact O-N 3.09Å; L562-Q565 PolarHBondContact O-N 3.39Å; L562-V566 WeakPolarHBondContact O-CG2 3.46Å; L562-V566 PolarHBondContact O-N 3Å; L562-L600 HydrophobicContact CB-CD1 3.88Å; L562-L600 HydrophobicContact CB-CD2 4.41Å; L562-L600 HydrophobicContact CD1-CD2 4.36Å; L562-H962 WeakPolarHBondContact CD1-NE2 3.26Å
563	V	91.9	Very high	90.3	Very high	15 Å²	15	66.7 Å²	66.7	9%	0.091	33%	0.33	C	S	.	.	H	α-helix	trans	-60	-45	174.5	173.5	0	0	0	0	110.7	L559 R560 Q565 V566 D567 L600 L604	L559-V563 WeakPolarHBondContact O-CG2 3.2Å; L559-V563 PolarHBondContact O-N 3.36Å; R560-V563 PolarHBondContact O-N 2.87Å; V563-Q565 VanDerWaalsContact C-N 3.33Å; V563-Q565 PolarHBondContact O-N 3.47Å; V563-V566 PolarHBondContact O-N 2.84Å; V563-V566 VanDerWaalsContact O-N 3.13Å; V563-D567 PolarHBondContact O-N 2.71Å; V563-L600 HydrophobicContact CG2-CB 3.52Å; V563-L600 HydrophobicContact CG2-CD1 4.03Å; V563-L600 HydrophobicContact CG2-CG 4.41Å; V563-L604 HydrophobicContact CG2-CD1 3.98Å
564	Q	93.1	Very high	89.7	Confident	123 Å²	123	61.6 Å²	61.6	58%	0.575	31%	0.311	S	S	*	.	H	α-helix	trans	-60.7	-40	176.3	-73.8	175.5	-14	0	0	112.4	R560 S561 L562 V566 D567 L568	R560-Q564 WeakPolarHBondContact O-CG 3.47Å; R560-Q564 PolarHBondContact O-N 3.03Å; S561-Q564 PolarHBondContact O-N 3.21Å; L562-Q564 VanDerWaalsContact C-N 3.33Å; L562-Q564 PolarHBondContact O-N 3.09Å; Q564-V566 VanDerWaalsContact C-N 3.32Å; Q564-V566 PolarHBondContact O-N 3.45Å; Q564-D567 PolarHBondContact O-N 3.15Å; Q564-L568 WeakPolarHBondContact O-CB 3.45Å; Q564-L568 VanDerWaalsContact O-CG 3.3Å; Q564-L568 WeakPolarHBondContact O-CG 3.48Å; Q564-L568 PolarHBondContact O-N 2.98Å
565	Q	92.6	Very high	89	Confident	70 Å²	70	66.8 Å²	66.8	33%	0.327	33%	0.325	S	S	.	.	H	α-helix	trans	-62.7	-38.5	174.8	-71.9	174.1	18.5	0	0	112.3	S561 L562 V563 A569 L584 F585	S561-Q565 WeakPolarHBondContact O-CG 3.26Å; S561-Q565 PolarHBondContact O-N 3.02Å; L562-Q565 PolarHBondContact O-N 3.39Å; V563-Q565 VanDerWaalsContact C-N 3.33Å; V563-Q565 PolarHBondContact O-N 3.47Å; Q565-A569 WeakPolarHBondContact O-CB 3.33Å; Q565-A569 PolarHBondContact O-N 2.88Å; Q565-A569 VanDerWaalsContact O-N 3.08Å; Q565-L584 HydrophobicContact CB-CD1 4.46Å; Q565-L584 HydrophobicContact CG-CD1 4.33Å; Q565-F585 HydrophobicContact CB-CE2 4.45Å
566	V	91.2	Very high	88.4	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-70.1	-39	176.5	176	0	0	0	0	111.3	L562 V563 Q564 A569 L570 F585 L593 K596 K597 L600	L562-V566 WeakPolarHBondContact O-CG2 3.46Å; L562-V566 PolarHBondContact O-N 3Å; V563-V566 PolarHBondContact O-N 2.84Å; V563-V566 VanDerWaalsContact O-N 3.13Å; Q564-V566 VanDerWaalsContact C-N 3.32Å; Q564-V566 PolarHBondContact O-N 3.45Å; V566-A569 WeakPolarHBondContact O-CB 3.41Å; V566-A569 PolarHBondContact O-N 2.78Å; V566-L570 HydrophobicContact CG1-CD1 4.13Å; V566-L570 WeakPolarHBondContact O-CG 3.38Å; V566-L570 PolarHBondContact O-N 3Å; V566-F585 HydrophobicContact CG2-CE2 4.05Å; V566-F585 HydrophobicContact CG2-CZ 3.73Å; V566-L593 HydrophobicContact CG1-CB 4.1Å; V566-L593 HydrophobicContact CG1-CD2 4.36Å; V566-L593 WeakPolarHBondContact CG1-O 3.33Å; V566-K596 HydrophobicContact CG2-CD 4.45Å; V566-K596 HydrophobicContact CG2-CG 4.24Å; V566-K597 HydrophobicContact CG1-CB 3.93Å; V566-L600 HydrophobicContact CG2-CD1 4.36Å
567	D	89.3	Confident	88	Confident	44 Å²	44	67.5 Å²	67.5	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-48.3	176.5	-77.8	-27.9	0	0	0	111.9	V563 Q564 A569 L570 E571 K597	V563-D567 PolarHBondContact O-N 2.71Å; Q564-D567 PolarHBondContact O-N 3.15Å; D567-A569 PolarHBondContact O-N 3.2Å; D567-L570 WeakPolarHBondContact O-CB 3.29Å; D567-L570 PolarHBondContact O-N 2.88Å; D567-L570 VanDerWaalsContact O-N 3.09Å; D567-E571 WeakPolarHBondContact O-CG 3.45Å; D567-E571 PolarHBondContact O-N 3.3Å; D567-K597 VanDerWaalsContact OD1-CD 3.29Å; D567-K597 WeakPolarHBondContact OD1-CD 3.31Å; D567-K597 WeakPolarHBondContact OD1-CE 3.04Å; D567-K597 IonicContact OD1-NZ 3.48Å; D567-K597 PolarHBondContact OD1-NZ 3.48Å; D567-K597 IonicContact OD2-NZ 3.81Å
568	L	90.4	Very high	87.2	Confident	99 Å²	99	63.3 Å²	63.3	52%	0.518	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-39.7	173.6	-72.2	168.7	0	0	0	111.7	Q564 Q572	Q564-L568 WeakPolarHBondContact O-CB 3.45Å; Q564-L568 VanDerWaalsContact O-CG 3.3Å; Q564-L568 WeakPolarHBondContact O-CG 3.48Å; Q564-L568 PolarHBondContact O-N 2.98Å; L568-Q572 VanDerWaalsContact O-CG 3.28Å; L568-Q572 WeakPolarHBondContact O-CG 3.48Å; L568-Q572 PolarHBondContact O-N 2.99Å
569	A	87.2	Confident	86.3	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-42.9	176.2	0	0	0	0	0	111.5	Q565 V566 D567 Q572 R577 F585 L593	Q565-A569 WeakPolarHBondContact O-CB 3.33Å; Q565-A569 PolarHBondContact O-N 2.88Å; Q565-A569 VanDerWaalsContact O-N 3.08Å; V566-A569 WeakPolarHBondContact O-CB 3.41Å; V566-A569 PolarHBondContact O-N 2.78Å; D567-A569 PolarHBondContact O-N 3.2Å; A569-Q572 PolarHBondContact O-N 2.93Å; A569-R577 PolarHBondContact O-NH1 3.4Å; A569-F585 HydrophobicContact CB-CD2 3.6Å; A569-F585 HydrophobicContact CB-CE2 4.21Å; A569-L593 HydrophobicContact CB-CD1 3.88Å
570	L	86.3	Confident	85.6	Confident	35 Å²	35	67 Å²	67	18%	0.183	34%	0.342	C	S	.	.	H	α-helix	trans	-63	-41.7	176.8	-76.6	167.7	0	0	0	112.2	V566 D567 Q572 G573 D590 L593 R594 K597	V566-L570 HydrophobicContact CG1-CD1 4.13Å; V566-L570 WeakPolarHBondContact O-CG 3.38Å; V566-L570 PolarHBondContact O-N 3Å; D567-L570 WeakPolarHBondContact O-CB 3.29Å; D567-L570 PolarHBondContact O-N 2.88Å; D567-L570 VanDerWaalsContact O-N 3.09Å; L570-Q572 VanDerWaalsContact C-N 3.33Å; L570-Q572 PolarHBondContact O-N 3.03Å; L570-G573 PolarHBondContact O-N 3.29Å; L570-G573 VanDerWaalsContact O-N 3.13Å; L570-D590 HydrophobicContact CD2-CB 4.02Å; L570-L593 HydrophobicContact CD1-CB 4.49Å; L570-L593 HydrophobicContact CD2-CB 3.71Å; L570-L593 HydrophobicContact CD2-CD1 4.15Å; L570-L593 HydrophobicContact CG-CB 4Å; L570-L593 HydrophobicContact CG-CD1 4.25Å; L570-R594 HydrophobicContact CD1-CG 4.26Å; L570-R594 HydrophobicContact CD2-CG 4.13Å; L570-K597 HydrophobicContact CD1-CD 4.34Å
571	E	86.8	Confident	84.6	Confident	156 Å²	156	60.6 Å²	60.6	73%	0.729	32%	0.321	S	S	*	.	H	α-helix	trans	-61.9	-36.6	177.5	-73.9	175.5	-177.2	0	0	113	D567 G573	D567-E571 WeakPolarHBondContact O-CG 3.45Å; D567-E571 PolarHBondContact O-N 3.3Å; E571-G573 PolarHBondContact O-N 3.07Å
572	Q	83.9	Confident	83.8	Confident	89 Å²	89	64.6 Å²	64.6	42%	0.416	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-21.7	176.6	-71.1	169.2	10.1	0	0	113.2	L568 A569 L570 V576	L568-Q572 VanDerWaalsContact O-CG 3.28Å; L568-Q572 WeakPolarHBondContact O-CG 3.48Å; L568-Q572 PolarHBondContact O-N 2.99Å; A569-Q572 PolarHBondContact O-N 2.93Å; L570-Q572 VanDerWaalsContact C-N 3.33Å; L570-Q572 PolarHBondContact O-N 3.03Å; Q572-V576 WeakPolarHBondContact O-CB 3.35Å; Q572-V576 VanDerWaalsContact O-CG2 3.27Å; Q572-V576 WeakPolarHBondContact O-CG2 3.18Å
573	G	80.7	Confident	83.2	Confident	23 Å²	23	64.6 Å²	64.6	24%	0.237	34%	0.335	C	S	.	.	H	α-helix	trans	72.9	156.1	-179.3	0	0	0	0	0	114.7	L570 E571 K575 V576 R577	L570-G573 PolarHBondContact O-N 3.29Å; L570-G573 VanDerWaalsContact O-N 3.13Å; E571-G573 PolarHBondContact O-N 3.07Å; G573-K575 VanDerWaalsContact C-N 3.33Å; G573-K575 PolarHBondContact O-N 2.94Å; G573-V576 PolarHBondContact O-N 2.96Å; G573-R577 VanDerWaalsContact C-NH1 3.27Å; G573-R577 PolarHBondContact O-N 3.26Å; G573-R577 PolarHBondContact O-NH1 3Å
574	Y	81.5	Confident	82.6	Confident	80 Å²	80	68.8 Å²	68.8	31%	0.314	36%	0.356	S	S	.	.	H	α-helix	trans	-58	-39.1	-174.5	-178.4	-118.2	0	0	0	114.2	V576 R577 T578	Y574-V576 VanDerWaalsContact C-N 3.32Å; Y574-V576 PolarHBondContact O-N 3.1Å; Y574-R577 PolarHBondContact O-N 3.27Å; Y574-T578 HydrophobicContact CD1-CG2 4.41Å; Y574-T578 HydrophobicContact CD2-CG2 4.19Å; Y574-T578 HydrophobicContact CE1-CG2 3.94Å; Y574-T578 HydrophobicContact CE2-CG2 3.69Å; Y574-T578 PolarHBondContact O-N 2.94Å; Y574-T578 PolarHBondContact O-OG1 2.67Å
575	K	76.7	Confident	82	Confident	181 Å²	181	64.1 Å²	64.1	79%	0.787	33%	0.334	S	S	*	.	H	α-helix	trans	-60.1	-39.7	-176.7	-67.3	-175.9	-180	179.4	0	112.9	G573 T578 S579	G573-K575 VanDerWaalsContact C-N 3.33Å; G573-K575 PolarHBondContact O-N 2.94Å; K575-T578 PolarHBondContact O-N 2.97Å; K575-T578 PolarHBondContact O-OG1 3.46Å; K575-S579 PolarHBondContact O-N 3.05Å; K575-S579 PolarHBondContact O-OG 3.45Å
576	V	77.8	Confident	81.6	Confident	68 Å²	68	62 Å²	62	41%	0.412	32%	0.323	S	S	.	.	H	α-helix	trans	-71	-42.3	-179.9	178.5	0	0	0	0	110.4	Q572 G573 Y574 T578 S579 S580	Q572-V576 WeakPolarHBondContact O-CB 3.35Å; Q572-V576 VanDerWaalsContact O-CG2 3.27Å; Q572-V576 WeakPolarHBondContact O-CG2 3.18Å; G573-V576 PolarHBondContact O-N 2.96Å; Y574-V576 VanDerWaalsContact C-N 3.32Å; Y574-V576 PolarHBondContact O-N 3.1Å; V576-T578 PolarHBondContact O-N 2.96Å; V576-S579 WeakPolarHBondContact CA-OG 3.47Å; V576-S579 PolarHBondContact O-N 3.21Å; V576-S579 PolarHBondContact O-OG 3.27Å; V576-S580 PolarHBondContact O-N 3.37Å
577	R	84	Confident	81	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-67.2	-18.2	177.5	-60.2	-166.1	-52.4	-87.1	-4.9	113.7	A569 G573 Y574 V583 Y586 G587 V588 D590	A569-R577 PolarHBondContact O-NH1 3.4Å; G573-R577 VanDerWaalsContact C-NH1 3.27Å; G573-R577 PolarHBondContact O-N 3.26Å; G573-R577 PolarHBondContact O-NH1 3Å; Y574-R577 PolarHBondContact O-N 3.27Å; R577-V583 HydrophobicContact CG-CG1 3.92Å; R577-Y586 WeakPolarHBondContact O-CD2 3.38Å; R577-Y586 WeakPolarHBondContact O-CE2 3.45Å; R577-G587 PolarHBondContact O-N 2.61Å; R577-G587 VanDerWaalsContact O-N 3.09Å; R577-V588 PolarHBondContact NE-O 2.96Å; R577-V588 PolarHBondContact NH2-O 3.43Å; R577-D590 IonicContact CZ-OD1 3.48Å; R577-D590 VanDerWaalsContact CZ-OD1 3.27Å; R577-D590 IonicContact NH1-OD1 2.78Å; R577-D590 PolarHBondContact NH1-OD1 3.2Å; R577-D590 IonicContact NH2-OD1 3.78Å; R577-D590 PolarHBondContact NH2-OD1 3.34Å
578	T	75.7	Confident	80.8	Confident	57 Å²	57	60 Å²	60	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-88.5	-22.3	170	51.3	0	0	0	0	113.7	Y574 K575 V576	Y574-T578 HydrophobicContact CD1-CG2 4.41Å; Y574-T578 HydrophobicContact CD2-CG2 4.19Å; Y574-T578 HydrophobicContact CE1-CG2 3.94Å; Y574-T578 HydrophobicContact CE2-CG2 3.69Å; Y574-T578 PolarHBondContact O-N 2.94Å; Y574-T578 PolarHBondContact O-OG1 2.67Å; K575-T578 PolarHBondContact O-N 2.97Å; K575-T578 PolarHBondContact O-OG1 3.46Å; V576-T578 PolarHBondContact O-N 2.96Å
579	S	73.5	Confident	80.6	Confident	88 Å²	88	56.4 Å²	56.4	62%	0.615	30%	0.296	S	S	*	.	H	α-helix	trans	-87.1	-26.8	-176.2	60.6	0	0	0	0	114.8	K575 V576	K575-S579 PolarHBondContact O-N 3.05Å; K575-S579 PolarHBondContact O-OG 3.45Å; V576-S579 WeakPolarHBondContact CA-OG 3.47Å; V576-S579 PolarHBondContact O-N 3.21Å; V576-S579 PolarHBondContact O-OG 3.27Å
580	S	76.6	Confident	80.4	Confident	40 Å²	40	59 Å²	59	28%	0.28	31%	0.31	S	S	.	.			trans	-125	117.1	-174.8	178.9	0	0	0	0	111.9	V576 H582 V583 Y586	V576-S580 PolarHBondContact O-N 3.37Å; S580-H582 PolarHBondContact O-N 3.07Å; S580-V583 PolarHBondContact O-N 3.22Å; S580-Y586 WeakPolarHBondContact O-CD2 3.33Å
581	P	71.4	Confident	80.2	Confident	21 Å²	21	61.9 Å²	61.9	14%	0.136	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-15.8	-178.6	28.9	-34.9	0	0	0	113.4	V583 Y586 I1000 P1002	P581-V583 VanDerWaalsContact C-N 3.34Å; P581-Y586 VanDerWaalsContact CA-CD2 3.48Å; P581-Y586 HydrophobicContact CB-CD2 4.47Å; P581-Y586 HydrophobicContact CB-CE1 4.39Å; P581-Y586 HydrophobicContact CB-CE2 4.17Å; P581-I1000 HydrophobicContact CB-CB 4.4Å; P581-I1000 HydrophobicContact CG-CB 4.34Å; P581-I1000 HydrophobicContact CG-CG2 4.36Å; P581-P1002 HydrophobicContact CB-CB 4.39Å; P581-P1002 HydrophobicContact CB-CG 3.97Å; P581-P1002 WeakPolarHBondContact O-CB 3.43Å; P581-P1002 WeakPolarHBondContact O-CG 3.43Å
582	H	77.3	Confident	80.1	Confident	135 Å²	135	55 Å²	55	63%	0.625	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.5	-178.7	-59.5	-72.3	0	0	0	114	S580 P1002	S580-H582 PolarHBondContact O-N 3.07Å; H582-P1002 PolarHBondContact CE1-O 2.97Å
583	V	79.6	Confident	80.4	Confident	30 Å²	30	50.8 Å²	50.8	18%	0.182	27%	0.269	C	S	.	.	S	Bend	trans	-80.6	141.6	-178.9	-179.8	0	0	0	0	110.1	R577 S580 P581 Y586	R577-V583 HydrophobicContact CG-CG1 3.92Å; S580-V583 PolarHBondContact O-N 3.22Å; P581-V583 VanDerWaalsContact C-N 3.34Å; V583-Y586 PolarHBondContact O-N 3.35Å
584	L	78.5	Confident	80.6	Confident	102 Å²	102	58 Å²	58	53%	0.534	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	142.1	173.3	-69.5	174.3	0	0	0	110.1	Q565 Y586	Q565-L584 HydrophobicContact CB-CD1 4.46Å; Q565-L584 HydrophobicContact CG-CD1 4.33Å; L584-Y586 VanDerWaalsContact C-N 3.28Å; L584-Y586 PolarHBondContact O-N 3.36Å
585	F	81.7	Confident	80.7	Confident	25 Å²	25	60.7 Å²	60.7	11%	0.11	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	38.9	-176.5	-50.3	-79.6	0	0	0	113.5	Q565 V566 A569 G587 V588 L593 K596	Q565-F585 HydrophobicContact CB-CE2 4.45Å; V566-F585 HydrophobicContact CG2-CE2 4.05Å; V566-F585 HydrophobicContact CG2-CZ 3.73Å; A569-F585 HydrophobicContact CB-CD2 3.6Å; A569-F585 HydrophobicContact CB-CE2 4.21Å; F585-G587 PolarHBondContact O-N 2.87Å; F585-V588 HydrophobicContact CB-CB 4Å; F585-V588 HydrophobicContact CB-CG2 3.95Å; F585-V588 WeakPolarHBondContact O-CB 3.36Å; F585-V588 WeakPolarHBondContact O-CG2 3.47Å; F585-V588 PolarHBondContact O-N 3.13Å; F585-L593 HydrophobicContact CB-CD2 3.83Å; F585-L593 HydrophobicContact CD1-CD2 3.63Å; F585-L593 HydrophobicContact CD2-CD2 3.97Å; F585-L593 HydrophobicContact CE1-CD2 4.13Å; F585-L593 HydrophobicContact CE2-CD2 4.42Å; F585-L593 HydrophobicContact CG-CD2 3.54Å; F585-L593 HydrophobicContact CZ-CD2 4.5Å; F585-K596 HydrophobicContact CE1-CD 4.2Å
586	Y	83.4	Confident	81.3	Confident	26 Å²	26	53.5 Å²	53.5	10%	0.102	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	124.6	175.2	179	-117	0	0	0	111.8	R577 S580 P581 V583 L584 V588 F983 I999	R577-Y586 WeakPolarHBondContact O-CD2 3.38Å; R577-Y586 WeakPolarHBondContact O-CE2 3.45Å; S580-Y586 WeakPolarHBondContact O-CD2 3.33Å; P581-Y586 VanDerWaalsContact CA-CD2 3.48Å; P581-Y586 HydrophobicContact CB-CD2 4.47Å; P581-Y586 HydrophobicContact CB-CE1 4.39Å; P581-Y586 HydrophobicContact CB-CE2 4.17Å; V583-Y586 PolarHBondContact O-N 3.35Å; L584-Y586 VanDerWaalsContact C-N 3.28Å; L584-Y586 PolarHBondContact O-N 3.36Å; Y586-V588 VanDerWaalsContact C-N 3.25Å; Y586-V588 PolarHBondContact O-N 2.67Å; Y586-F983 HydrophobicContact CD1-CE1 4.49Å; Y586-I999 HydrophobicContact CE1-CB 4.44Å; Y586-I999 HydrophobicContact CE1-CG2 4.06Å
587	G	78.4	Confident	81.8	Confident	2 Å²	2	52.8 Å²	52.8	2%	0.021	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-4.4	-179.7	0	0	0	0	0	116.5	R577 F585 Q990	R577-G587 PolarHBondContact O-N 2.61Å; R577-G587 VanDerWaalsContact O-N 3.09Å; F585-G587 PolarHBondContact O-N 2.87Å; G587-Q990 PolarHBondContact O-NE2 3.02Å
588	V	85.2	Confident	81.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.			trans	-80.8	130.9	-177.2	-174.8	0	0	0	0	111.6	R577 F585 Y586 N592 L593 P984 E986 L987	R577-V588 PolarHBondContact NE-O 2.96Å; R577-V588 PolarHBondContact NH2-O 3.43Å; F585-V588 HydrophobicContact CB-CB 4Å; F585-V588 HydrophobicContact CB-CG2 3.95Å; F585-V588 WeakPolarHBondContact O-CB 3.36Å; F585-V588 WeakPolarHBondContact O-CG2 3.47Å; F585-V588 PolarHBondContact O-N 3.13Å; Y586-V588 VanDerWaalsContact C-N 3.25Å; Y586-V588 PolarHBondContact O-N 2.67Å; V588-N592 HydrophobicContact CG1-CB 3.83Å; V588-L593 HydrophobicContact CG1-CD2 4.01Å; V588-L593 HydrophobicContact CG1-CG 3.98Å; V588-P984 HydrophobicContact CG2-CB 3.64Å; V588-P984 HydrophobicContact CG2-CG 3.85Å; V588-E986 HydrophobicContact CG1-CB 3.63Å; V588-E986 HydrophobicContact CG1-CG 4.23Å; V588-E986 HydrophobicContact CG2-CB 4.1Å; V588-L987 HydrophobicContact CG2-CD2 3.92Å; V588-L987 HydrophobicContact CG2-CG 4.25Å
589	S	86	Confident	82.3	Confident	25 Å²	25	56.8 Å²	56.8	18%	0.175	28%	0.283	C	S	.	.			trans	-66.9	152.1	177.1	65.1	0	0	0	0	113.8	K591 N592 L593 Q990	S589-K591 PolarHBondContact O-N 2.84Å; S589-N592 PolarHBondContact O-N 3.01Å; S589-N592 PolarHBondContact OG-N 3.37Å; S589-L593 PolarHBondContact O-N 3.03Å; S589-L593 VanDerWaalsContact O-N 3.15Å; S589-Q990 VanDerWaalsContact CB-OE1 3.29Å; S589-Q990 PolarHBondContact OG-OE1 2.98Å
590	D	84.2	Confident	83.1	Confident	56 Å²	56	52.9 Å²	52.9	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-31.4	176.5	-67.5	-29.3	0	0	0	112	L570 R577 L593 R594	L570-D590 HydrophobicContact CD2-CB 4.02Å; R577-D590 IonicContact CZ-OD1 3.48Å; R577-D590 VanDerWaalsContact CZ-OD1 3.27Å; R577-D590 IonicContact NH1-OD1 2.78Å; R577-D590 PolarHBondContact NH1-OD1 3.2Å; R577-D590 IonicContact NH2-OD1 3.78Å; R577-D590 PolarHBondContact NH2-OD1 3.34Å; D590-L593 PolarHBondContact O-N 3.45Å; D590-R594 WeakPolarHBondContact O-CB 3.13Å; D590-R594 VanDerWaalsContact O-CG 3.3Å; D590-R594 WeakPolarHBondContact O-CG 3.21Å; D590-R594 PolarHBondContact O-N 3.11Å
591	K	82.1	Confident	83.6	Confident	96 Å²	96	54.9 Å²	54.9	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-47.9	175.6	-177	-179.8	179.3	-179.8	0	111.6	M22 S589 R594 R595	M22-K591 PolarHBondContact SD-NZ 3.38Å; M22-K591 VanDerWaalsContact SD-NZ 3.43Å; S589-K591 PolarHBondContact O-N 2.84Å; K591-R594 PolarHBondContact O-N 3.36Å; K591-R595 WeakPolarHBondContact O-CG 3.47Å; K591-R595 PolarHBondContact O-N 3.29Å; K591-R595 VanDerWaalsContact O-N 3.11Å
592	N	85	Confident	84.4	Confident	11 Å²	11	58.7 Å²	58.7	6%	0.059	27%	0.272	C	S	.	.	H	α-helix	trans	-70.6	-35.7	-179	-73.2	-9.4	0	0	0	111.9	V588 S589 R595 K596 E986 S989	V588-N592 HydrophobicContact CG1-CB 3.83Å; S589-N592 PolarHBondContact O-N 3.01Å; S589-N592 PolarHBondContact OG-N 3.37Å; N592-R595 PolarHBondContact O-N 2.67Å; N592-K596 PolarHBondContact O-N 3.42Å; N592-E986 HydrophobicContact CB-CB 4.17Å; N592-E986 PolarHBondContact ND2-O 3.33Å; N592-E986 VanDerWaalsContact ND2-O 3.09Å; N592-S989 PolarHBondContact ND2-OG 2.92Å; N592-S989 VanDerWaalsContact ND2-OG 3.08Å
593	L	88.9	Confident	85	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-42.5	172.4	-70.7	-177.4	0	0	0	112.6	V566 A569 L570 F585 V588 S589 D590 R595 K596 K597	V566-L593 HydrophobicContact CG1-CB 4.1Å; V566-L593 HydrophobicContact CG1-CD2 4.36Å; V566-L593 WeakPolarHBondContact CG1-O 3.33Å; A569-L593 HydrophobicContact CB-CD1 3.88Å; L570-L593 HydrophobicContact CD1-CB 4.49Å; L570-L593 HydrophobicContact CD2-CB 3.71Å; L570-L593 HydrophobicContact CD2-CD1 4.15Å; L570-L593 HydrophobicContact CG-CB 4Å; L570-L593 HydrophobicContact CG-CD1 4.25Å; F585-L593 HydrophobicContact CB-CD2 3.83Å; F585-L593 HydrophobicContact CD1-CD2 3.63Å; F585-L593 HydrophobicContact CD2-CD2 3.97Å; F585-L593 HydrophobicContact CE1-CD2 4.13Å; F585-L593 HydrophobicContact CE2-CD2 4.42Å; F585-L593 HydrophobicContact CG-CD2 3.54Å; F585-L593 HydrophobicContact CZ-CD2 4.5Å; V588-L593 HydrophobicContact CG1-CD2 4.01Å; V588-L593 HydrophobicContact CG1-CG 3.98Å; S589-L593 PolarHBondContact O-N 3.03Å; S589-L593 VanDerWaalsContact O-N 3.15Å; D590-L593 PolarHBondContact O-N 3.45Å; L593-R595 VanDerWaalsContact C-N 3.33Å; L593-R595 PolarHBondContact O-N 3.23Å; L593-K596 PolarHBondContact O-N 3.29Å; L593-K597 WeakPolarHBondContact O-CB 3.37Å; L593-K597 PolarHBondContact O-N 3.29Å
594	R	85.8	Confident	85.4	Confident	175 Å²	175	53.4 Å²	53.4	66%	0.66	25%	0.247	S	C	*	.	H	α-helix	trans	-62.1	-39.3	175.1	-73.8	177.9	-173.7	-139.3	3.6	112.3	L570 D590 K591 K597 A598	L570-R594 HydrophobicContact CD1-CG 4.26Å; L570-R594 HydrophobicContact CD2-CG 4.13Å; D590-R594 WeakPolarHBondContact O-CB 3.13Å; D590-R594 VanDerWaalsContact O-CG 3.3Å; D590-R594 WeakPolarHBondContact O-CG 3.21Å; D590-R594 PolarHBondContact O-N 3.11Å; K591-R594 PolarHBondContact O-N 3.36Å; R594-K597 PolarHBondContact O-N 3.33Å; R594-A598 WeakPolarHBondContact O-CB 3.35Å; R594-A598 PolarHBondContact O-N 3.16Å
595	R	83.3	Confident	85.8	Confident	137 Å²	137	54.6 Å²	54.6	52%	0.517	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-47.5	173.2	-74.1	175	172.3	-179.9	-8.3	111.7	K591 N592 L593 K597 A598 Q599	K591-R595 WeakPolarHBondContact O-CG 3.47Å; K591-R595 PolarHBondContact O-N 3.29Å; K591-R595 VanDerWaalsContact O-N 3.11Å; N592-R595 PolarHBondContact O-N 2.67Å; L593-R595 VanDerWaalsContact C-N 3.33Å; L593-R595 PolarHBondContact O-N 3.23Å; R595-K597 VanDerWaalsContact C-N 3.34Å; R595-K597 PolarHBondContact O-N 3Å; R595-A598 PolarHBondContact O-N 2.63Å; R595-Q599 PolarHBondContact O-N 3.39Å
596	K	88.3	Confident	86	Confident	29 Å²	29	56.4 Å²	56.4	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-42.5	175.7	-179	156.8	179.1	150.6	0	112.1	V566 F585 N592 L593 Q599 L600 E986	V566-K596 HydrophobicContact CG2-CD 4.45Å; V566-K596 HydrophobicContact CG2-CG 4.24Å; F585-K596 HydrophobicContact CE1-CD 4.2Å; N592-K596 PolarHBondContact O-N 3.42Å; L593-K596 PolarHBondContact O-N 3.29Å; K596-Q599 PolarHBondContact O-N 2.95Å; K596-L600 HydrophobicContact CG-CD1 4.2Å; K596-L600 WeakPolarHBondContact O-CG 3.44Å; K596-L600 PolarHBondContact O-N 3.09Å; K596-E986 HydrophobicContact CD-CG 4.47Å; K596-E986 WeakPolarHBondContact CD-OE1 3.3Å; K596-E986 WeakPolarHBondContact CE-OE1 3.24Å; K596-E986 IonicContact NZ-OE1 2.88Å; K596-E986 PolarHBondContact NZ-OE1 2.98Å
597	K	88.3	Confident	86.3	Confident	53 Å²	53	56.9 Å²	56.9	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-58.9	-48.5	174.3	-177	177.2	177.9	173.1	0	111.5	V566 D567 L570 L593 R594 R595 Q599 L600 Q601	V566-K597 HydrophobicContact CG1-CB 3.93Å; D567-K597 VanDerWaalsContact OD1-CD 3.29Å; D567-K597 WeakPolarHBondContact OD1-CD 3.31Å; D567-K597 WeakPolarHBondContact OD1-CE 3.04Å; D567-K597 IonicContact OD1-NZ 3.48Å; D567-K597 PolarHBondContact OD1-NZ 3.48Å; D567-K597 IonicContact OD2-NZ 3.81Å; L570-K597 HydrophobicContact CD1-CD 4.34Å; L593-K597 WeakPolarHBondContact O-CB 3.37Å; L593-K597 PolarHBondContact O-N 3.29Å; R594-K597 PolarHBondContact O-N 3.33Å; R595-K597 VanDerWaalsContact C-N 3.34Å; R595-K597 PolarHBondContact O-N 3Å; K597-Q599 VanDerWaalsContact C-N 3.33Å; K597-Q599 PolarHBondContact O-N 3.45Å; K597-L600 PolarHBondContact O-N 3.23Å; K597-Q601 VanDerWaalsContact CE-NE2 3.31Å; K597-Q601 HydrophobicContact CG-CG 4.31Å; K597-Q601 WeakPolarHBondContact O-CB 3.48Å; K597-Q601 VanDerWaalsContact O-CG 3.32Å; K597-Q601 WeakPolarHBondContact O-CG 3.46Å; K597-Q601 PolarHBondContact O-N 2.95Å
598	A	83.6	Confident	87	Confident	53 Å²	53	57.6 Å²	57.6	44%	0.438	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-42.5	179	0	0	0	0	0	111.9	R594 R595 Q601 Y602	R594-A598 WeakPolarHBondContact O-CB 3.35Å; R594-A598 PolarHBondContact O-N 3.16Å; R595-A598 PolarHBondContact O-N 2.63Å; A598-Q601 PolarHBondContact O-N 3.28Å; A598-Y602 WeakPolarHBondContact O-CB 3.39Å; A598-Y602 PolarHBondContact O-N 3.43Å
599	Q	87	Confident	87.2	Confident	89 Å²	89	60 Å²	60	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-46	175.3	-172.5	-177.8	9.3	0	0	112	R595 K596 K597 Q601 Y602 M603	R595-Q599 PolarHBondContact O-N 3.39Å; K596-Q599 PolarHBondContact O-N 2.95Å; K597-Q599 VanDerWaalsContact C-N 3.33Å; K597-Q599 PolarHBondContact O-N 3.45Å; Q599-Q601 VanDerWaalsContact C-N 3.35Å; Q599-Q601 PolarHBondContact O-N 3.48Å; Q599-Y602 WeakPolarHBondContact O-CB 3.38Å; Q599-Y602 PolarHBondContact O-N 2.76Å; Q599-M603 WeakPolarHBondContact O-CG 3.48Å; Q599-M603 PolarHBondContact O-N 2.96Å
600	L	90.3	Very high	87.5	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-38.2	177.7	-68.5	171.6	0	0	0	112.3	L559 L562 V563 V566 K596 K597 M603 L604	L559-L600 HydrophobicContact CD2-CD2 3.97Å; L562-L600 HydrophobicContact CB-CD1 3.88Å; L562-L600 HydrophobicContact CB-CD2 4.41Å; L562-L600 HydrophobicContact CD1-CD2 4.36Å; V563-L600 HydrophobicContact CG2-CB 3.52Å; V563-L600 HydrophobicContact CG2-CD1 4.03Å; V563-L600 HydrophobicContact CG2-CG 4.41Å; V566-L600 HydrophobicContact CG2-CD1 4.36Å; K596-L600 HydrophobicContact CG-CD1 4.2Å; K596-L600 WeakPolarHBondContact O-CG 3.44Å; K596-L600 PolarHBondContact O-N 3.09Å; K597-L600 PolarHBondContact O-N 3.23Å; L600-M603 PolarHBondContact O-N 3.24Å; L600-L604 WeakPolarHBondContact O-CG 3.35Å; L600-L604 PolarHBondContact O-N 3.46Å
601	Q	88.3	Confident	87.7	Confident	83 Å²	83	59.6 Å²	59.6	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-66.2	-41.5	175.1	-74.8	178.2	-37	0	0	111.7	K597 A598 Q599 M603 L604 N605	K597-Q601 VanDerWaalsContact CE-NE2 3.31Å; K597-Q601 HydrophobicContact CG-CG 4.31Å; K597-Q601 WeakPolarHBondContact O-CB 3.48Å; K597-Q601 VanDerWaalsContact O-CG 3.32Å; K597-Q601 WeakPolarHBondContact O-CG 3.46Å; K597-Q601 PolarHBondContact O-N 2.95Å; A598-Q601 PolarHBondContact O-N 3.28Å; Q599-Q601 VanDerWaalsContact C-N 3.35Å; Q599-Q601 PolarHBondContact O-N 3.48Å; Q601-M603 VanDerWaalsContact C-N 3.32Å; Q601-M603 PolarHBondContact O-N 2.84Å; Q601-L604 PolarHBondContact O-N 2.72Å; Q601-N605 WeakPolarHBondContact O-CB 3.31Å; Q601-N605 VanDerWaalsContact O-CG 3.25Å; Q601-N605 PolarHBondContact O-N 3.22Å
602	Y	87.8	Confident	87.7	Confident	101 Å²	101	58.6 Å²	58.6	40%	0.396	28%	0.279	S	S	.	.	H	α-helix	trans	-56	-47.6	172.8	174.3	-95.7	0	0	0	111.1	P518 A598 Q599 L604 N605 Q606	P518-Y602 HydrophobicContact CG-CE1 4.28Å; A598-Y602 WeakPolarHBondContact O-CB 3.39Å; A598-Y602 PolarHBondContact O-N 3.43Å; Q599-Y602 WeakPolarHBondContact O-CB 3.38Å; Q599-Y602 PolarHBondContact O-N 2.76Å; Y602-L604 VanDerWaalsContact C-N 3.31Å; Y602-L604 PolarHBondContact O-N 2.64Å; Y602-N605 PolarHBondContact O-N 3.22Å; Y602-Q606 HydrophobicContact CD2-CG 3.88Å; Y602-Q606 HydrophobicContact CE1-CG 4.29Å; Y602-Q606 HydrophobicContact CE2-CG 3.6Å; Y602-Q606 HydrophobicContact CG-CG 4.34Å; Y602-Q606 WeakPolarHBondContact O-CB 3.49Å; Y602-Q606 WeakPolarHBondContact O-CG 3.26Å; Y602-Q606 PolarHBondContact O-N 3.02Å
603	M	88.5	Confident	87.8	Confident	15 Å²	15	61.5 Å²	61.5	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-32.6	177.2	-66.2	-178.3	66	0	0	113.9	L559 Q599 L600 Q601 R607 G960 H962	L559-M603 HydrophobicContact CD1-CB 4.21Å; L559-M603 HydrophobicContact CD1-CE 4.5Å; L559-M603 HydrophobicContact CD2-CE 4.19Å; L559-M603 HydrophobicContact CD2-SD 4.49Å; Q599-M603 WeakPolarHBondContact O-CG 3.48Å; Q599-M603 PolarHBondContact O-N 2.96Å; L600-M603 PolarHBondContact O-N 3.24Å; Q601-M603 VanDerWaalsContact C-N 3.32Å; Q601-M603 PolarHBondContact O-N 2.84Å; M603-R607 WeakPolarHBondContact O-CD 3.3Å; M603-G960 WeakPolarHBondContact CE-O 3.48Å; M603-H962 HydrophobicContact CE-CB 3.6Å; M603-H962 HydrophobicContact SD-CB 4.17Å
604	L	89.2	Confident	87.7	Confident	39 Å²	39	62.4 Å²	62.4	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-71.9	-35.2	175	-79.1	169	0	0	0	112.4	I556 L559 R560 V563 L600 Q601 Y602 R607	I556-L604 HydrophobicContact CG2-CD2 4.16Å; L559-L604 HydrophobicContact CB-CD1 4.49Å; L559-L604 HydrophobicContact CB-CD2 3.73Å; L559-L604 HydrophobicContact CB-CG 4.01Å; L559-L604 HydrophobicContact CD1-CD2 4.19Å; L559-L604 HydrophobicContact CD1-CG 4.42Å; R560-L604 HydrophobicContact CG-CD1 4.15Å; R560-L604 HydrophobicContact CG-CD2 4.09Å; V563-L604 HydrophobicContact CG2-CD1 3.98Å; L600-L604 WeakPolarHBondContact O-CG 3.35Å; L600-L604 PolarHBondContact O-N 3.46Å; Q601-L604 PolarHBondContact O-N 2.72Å; Y602-L604 VanDerWaalsContact C-N 3.31Å; Y602-L604 PolarHBondContact O-N 2.64Å; L604-R607 WeakPolarHBondContact O-CG 3.46Å
605	N	86.3	Confident	87.9	Confident	126 Å²	126	54.9 Å²	54.9	67%	0.674	28%	0.277	S	S	*	.	H	α-helix	trans	-81.3	-32.1	-178.5	-67	-11.8	0	0	0	112.1	Q601 Y602 R607	Q601-N605 WeakPolarHBondContact O-CB 3.31Å; Q601-N605 VanDerWaalsContact O-CG 3.25Å; Q601-N605 PolarHBondContact O-N 3.22Å; Y602-N605 PolarHBondContact O-N 3.22Å; N605-R607 PolarHBondContact O-N 2.77Å
606	Q	86.5	Confident	88.2	Confident	63 Å²	63	50.6 Å²	50.6	29%	0.294	27%	0.265	S	S	.	.	S	Bend	trans	-98.2	47.8	-174	-60.2	-64.5	-19.6	0	0	113.2	P518 H519 Y602	P518-Q606 HydrophobicContact CB-CB 3.69Å; H519-Q606 PolarHBondContact N-O 2.77Å; Y602-Q606 HydrophobicContact CD2-CG 3.88Å; Y602-Q606 HydrophobicContact CE1-CG 4.29Å; Y602-Q606 HydrophobicContact CE2-CG 3.6Å; Y602-Q606 HydrophobicContact CG-CG 4.34Å; Y602-Q606 WeakPolarHBondContact O-CB 3.49Å; Y602-Q606 WeakPolarHBondContact O-CG 3.26Å; Y602-Q606 PolarHBondContact O-N 3.02Å
607	R	90.1	Very high	88.1	Confident	37 Å²	37	49.3 Å²	49.3	14%	0.14	26%	0.259	C	S	.	.			trans	-75.8	157.9	177.1	-63.7	-63.7	-63.7	-168.9	-0.2	111.9	H519 D555 M603 L604 N605	H519-R607 WeakPolarHBondContact CA-O 3.42Å; H519-R607 PolarHBondContact ND1-O 2.86Å; H519-R607 VanDerWaalsContact ND1-O 3.13Å; D555-R607 IonicContact OD2-CZ 2.74Å; D555-R607 IonicContact OD2-NH1 3.43Å; D555-R607 IonicContact OD2-NH2 2.67Å; D555-R607 PolarHBondContact OD2-NH2 2.69Å; M603-R607 WeakPolarHBondContact O-CD 3.3Å; L604-R607 WeakPolarHBondContact O-CG 3.46Å; N605-R607 PolarHBondContact O-N 2.77Å
608	L	91.4	Very high	87.8	Confident	17 Å²	17	47 Å²	47	9%	0.089	25%	0.249	C	C	.	.			trans	-59.9	145.5	179.3	-62.9	178.6	0	0	0	112.1	L510 L513 C514 A520 I610	L510-L608 HydrophobicContact CB-CD1 4.18Å; L510-L608 HydrophobicContact CD2-CD1 3.97Å; L510-L608 WeakPolarHBondContact O-CD1 3.3Å; L513-L608 HydrophobicContact CB-CD1 4.42Å; L513-L608 HydrophobicContact CB-CD2 4.01Å; C514-L608 HydrophobicContact CB-CD1 4.21Å; C514-L608 HydrophobicContact CB-CD2 4.41Å; C514-L608 HydrophobicContact CB-CG 4.18Å; A520-L608 HydrophobicContact CB-CD2 3.79Å; L608-I610 HydrophobicContact CB-CG1 4.18Å
609	Q	91.3	Very high	87.2	Confident	51 Å²	51	45.8 Å²	45.8	24%	0.238	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	93.3	170.5	-58.4	-174.4	22.4	0	0	109.4	H519 A520 V521 V522	H519-Q609 PolarHBondContact CE1-NE2 2.77Å; H519-Q609 PolarHBondContact NE2-NE2 3.08Å; A520-Q609 PolarHBondContact O-N 3.13Å; V521-Q609 WeakPolarHBondContact CA-O 3.4Å; V521-Q609 HydrophobicContact CG2-CB 4.33Å; V522-Q609 PolarHBondContact N-O 3.38Å
610	I	91.2	Very high	86.5	Confident	42 Å²	42	44.5 Å²	44.5	22%	0.215	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	117.6	-178.8	-55.5	177.1	0	0	0	109.8	L510 L524 I548 E552 L608	L510-I610 HydrophobicContact CD1-CD1 4.21Å; L510-I610 HydrophobicContact CD2-CD1 4.24Å; L524-I610 HydrophobicContact CD1-CG2 3.83Å; I548-I610 HydrophobicContact CG2-CD1 3.39Å; E552-I610 WeakPolarHBondContact OE1-CD1 3.4Å; L608-I610 HydrophobicContact CB-CG1 4.18Å
611	L	88.9	Confident	84.9	Confident	29 Å²	29	54 Å²	54	15%	0.152	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.7	-178.3	-57.3	177.2	0	0	0	111.1	L487 V521 V522 C523 V636	L487-L611 HydrophobicContact CD1-CD1 4.38Å; V521-L611 HydrophobicContact CG1-CD1 4Å; V521-L611 HydrophobicContact CG1-CD2 4.25Å; V521-L611 HydrophobicContact CG1-CG 4.14Å; V522-L611 PolarHBondContact O-N 3.5Å; C523-L611 HydrophobicContact CB-CD1 4.11Å; L611-V636 HydrophobicContact CD1-CB 4.41Å; L611-V636 HydrophobicContact CD1-CG1 3.82Å; L611-V636 HydrophobicContact CD1-CG2 3.74Å
612	S	82	Confident	83.5	Confident	76 Å²	76	55.3 Å²	55.3	53%	0.531	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.5	174.5	-178.6	0	0	0	0	111
613	P	86.1	Confident	82.7	Confident	72 Å²	72	55.6 Å²	55.6	47%	0.468	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-86.3	171.1	-5.7	35.3	-35.6	0	0	0	113.4	L615	P613-L615 PolarHBondContact O-N 3.06Å
614	V	87.9	Confident	82.1	Confident	19 Å²	19	60.3 Å²	60.3	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	120.3	169.6	-178.6	0	0	0	0	109.1	L524 T541 I544	L524-V614 HydrophobicContact CB-CB 4.34Å; L524-V614 HydrophobicContact CB-CG1 4.09Å; L524-V614 HydrophobicContact CB-CG2 3.94Å; L524-V614 HydrophobicContact CD1-CG2 4Å; T541-V614 HydrophobicContact CG2-CB 4.05Å; T541-V614 HydrophobicContact CG2-CG1 3.92Å; I544-V614 HydrophobicContact CG2-CG2 4.1Å
615	L	89.5	Confident	81.7	Confident	16 Å²	16	61.1 Å²	61.1	8%	0.084	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	116.2	-177.5	-66.6	175.8	0	0	0	110.5	L524 V525 G526 P613 L629 K632	L524-L615 PolarHBondContact O-N 3.16Å; V525-L615 CarbonylContact C-O 3.44Å; V525-L615 WeakPolarHBondContact CA-O 3.41Å; G526-L615 PolarHBondContact N-O 2.89Å; P613-L615 PolarHBondContact O-N 3.06Å; L615-L629 HydrophobicContact CD1-CB 4.37Å; L615-L629 HydrophobicContact CD1-CD1 3.54Å; L615-K632 HydrophobicContact CD1-CB 4.14Å; L615-K632 HydrophobicContact CD1-CG 4.15Å
616	N	89.1	Confident	81.7	Confident	48 Å²	48	55.3 Å²	55.3	26%	0.257	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.5	174.3	56.2	22.1	0	0	0	110.7	L494 G526 A529 V537 N625	L494-N616 HydrophobicContact CD1-CB 4.26Å; G526-N616 CarbonylContact O-C 3.55Å; G526-N616 WeakPolarHBondContact O-CA 3.45Å; A529-N616 HydrophobicContact CB-CB 4.18Å; V537-N616 HydrophobicContact CG1-CB 3.81Å; V537-N616 VanDerWaalsContact CG1-ND2 3.29Å; V537-N616 WeakPolarHBondContact CG1-ND2 3.03Å; N616-N625 VanDerWaalsContact O-CB 3.25Å; N616-N625 WeakPolarHBondContact O-CB 3.44Å; N616-N625 PolarHBondContact O-ND2 2.99Å; N616-N625 PolarHBondContact OD1-ND2 2.92Å
617	I	87.1	Confident	81.6	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	30%	0.304	C	S	.	.			trans	-136.5	150.3	-176.7	58.9	165.7	0	0	0	111.6	L428 V525 G526 T527 N625 L629	L428-I617 HydrophobicContact CD1-CD1 3.21Å; L428-I617 HydrophobicContact CD2-CD1 4.14Å; L428-I617 HydrophobicContact CG-CD1 4.18Å; V525-I617 HydrophobicContact CG1-CD1 3.3Å; V525-I617 HydrophobicContact CG1-CG1 3.59Å; V525-I617 HydrophobicContact CG1-CG2 4.44Å; G526-I617 WeakPolarHBondContact O-CG1 3.48Å; G526-I617 PolarHBondContact O-N 2.97Å; T527-I617 HydrophobicContact CG2-CD1 3.93Å; T527-I617 HydrophobicContact CG2-CG1 4.05Å; I617-N625 HydrophobicContact CG2-CB 4.19Å; I617-L629 HydrophobicContact CD1-CD2 4.37Å; I617-L629 HydrophobicContact CG2-CD2 4.5Å
618	S	82.1	Confident	81.4	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.028	32%	0.322	C	S	.	.			trans	-113.8	127.2	165.9	-179.1	0	0	0	0	109.2	T620 Q623 K624 I626	S618-T620 PolarHBondContact OG-N 3.04Å; S618-T620 PolarHBondContact OG-OG1 2.78Å; S618-Q623 WeakPolarHBondContact O-CA 3.49Å; S618-K624 PolarHBondContact N-O 2.65Å; S618-I626 WeakPolarHBondContact O-CD1 3.41Å
619	C	71.4	Confident	81.2	Confident	28 Å²	28	61.9 Å²	61.9	19%	0.189	32%	0.318	C	S	.	.			trans	-101.2	17.6	177.7	-53.6	0	0	0	0	112.1	K427	K427-C619 HydrophobicContact CB-CB 4.19Å
620	T	71.1	Confident	81.1	Confident	62 Å²	62	62.1 Å²	62.1	38%	0.38	32%	0.317	S	S	.	.	S	Bend	trans	-90.1	-174.5	174.4	55.1	0	0	0	0	111.1	D530 S618 T622 Q623	D530-T620 WeakPolarHBondContact OD2-CG2 3.25Å; D530-T620 PolarHBondContact OD2-OG1 3.28Å; S618-T620 PolarHBondContact OG-N 3.04Å; S618-T620 PolarHBondContact OG-OG1 2.78Å; T620-T622 PolarHBondContact O-N 3.41Å; T620-Q623 PolarHBondContact O-N 3.48Å
621	E	57.4	Low	80.9	Confident	206 Å²	206	65.5 Å²	65.5	96%	0.963	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-23.9	-173.1	-68	178.9	175.4	0	0	114.8
622	T	59.5	Low	80.8	Confident	110 Å²	110	67.7 Å²	67.7	68%	0.675	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.5	-179.4	55.3	0	0	0	0	114.7	T620 K624	T620-T622 PolarHBondContact O-N 3.41Å; T622-K624 PolarHBondContact O-N 3.46Å
623	Q	71	Confident	81.1	Confident	107 Å²	107	64.1 Å²	64.1	50%	0.5	32%	0.315	S	S	.	.			trans	37.2	44.2	177.8	-69.7	-164.3	-11.6	0	0	116.3	S618 T620 N625 I626	S618-Q623 WeakPolarHBondContact O-CA 3.49Å; T620-Q623 PolarHBondContact O-N 3.48Å; Q623-N625 PolarHBondContact O-N 3.05Å; Q623-I626 HydrophobicContact CB-CD1 3.65Å; Q623-I626 HydrophobicContact CG-CD1 3.73Å
624	K	75.1	Confident	81.1	Confident	114 Å²	114	61.8 Å²	61.8	50%	0.496	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	131.1	-177	-163.2	176.3	-179.8	-178.7	0	111.1	E534 S618 T622 I626	E534-K624 IonicContact OE1-NZ 2.78Å; S618-K624 PolarHBondContact N-O 2.65Å; T622-K624 PolarHBondContact O-N 3.46Å; K624-I626 VanDerWaalsContact C-N 3.3Å; K624-I626 PolarHBondContact O-N 2.92Å
625	N	81.7	Confident	81	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.294	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	6.2	175.3	-62.1	-24.7	0	0	0	117.9	N616 I617 Q623 Q627 R628 L629	N616-N625 VanDerWaalsContact O-CB 3.25Å; N616-N625 WeakPolarHBondContact O-CB 3.44Å; N616-N625 PolarHBondContact O-ND2 2.99Å; N616-N625 PolarHBondContact OD1-ND2 2.92Å; I617-N625 HydrophobicContact CG2-CB 4.19Å; Q623-N625 PolarHBondContact O-N 3.05Å; N625-Q627 PolarHBondContact O-N 2.85Å; N625-R628 PolarHBondContact O-N 3.09Å; N625-L629 PolarHBondContact O-N 3.08Å; N625-L629 VanDerWaalsContact O-N 3.13Å
626	I	84.8	Confident	80.8	Confident	5 Å²	5	63 Å²	63	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-39.2	177	-71.1	161.3	0	0	0	111.7	L432 S618 Q623 K624 R628 L629 R630	L432-I626 HydrophobicContact CD2-CG2 4.43Å; S618-I626 WeakPolarHBondContact O-CD1 3.41Å; Q623-I626 HydrophobicContact CB-CD1 3.65Å; Q623-I626 HydrophobicContact CG-CD1 3.73Å; K624-I626 VanDerWaalsContact C-N 3.3Å; K624-I626 PolarHBondContact O-N 2.92Å; I626-R628 VanDerWaalsContact C-N 3.33Å; I626-R628 PolarHBondContact O-N 2.88Å; I626-L629 WeakPolarHBondContact O-CB 3.5Å; I626-L629 PolarHBondContact O-N 3.18Å; I626-L629 VanDerWaalsContact O-N 3.15Å; I626-R630 PolarHBondContact O-N 2.88Å
627	Q	84.4	Confident	80.5	Confident	114 Å²	114	60.7 Å²	60.7	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-42.7	176.6	-175.6	61.6	14.9	0	0	112	N625 L629 R630 E631	N625-Q627 PolarHBondContact O-N 2.85Å; Q627-L629 VanDerWaalsContact C-N 3.29Å; Q627-L629 PolarHBondContact O-N 2.86Å; Q627-R630 WeakPolarHBondContact O-CB 3.3Å; Q627-R630 PolarHBondContact O-N 2.56Å; Q627-R630 VanDerWaalsContact O-N 3.14Å; Q627-E631 PolarHBondContact NE2-OE1 2.89Å; Q627-E631 WeakPolarHBondContact O-CG 3.37Å; Q627-E631 PolarHBondContact O-N 3.37Å
628	R	86.9	Confident	80.1	Confident	139 Å²	139	63.4 Å²	63.4	53%	0.525	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-36.6	175.4	-173.1	178.9	180	-176.9	0.8	112.2	N625 I626 K632	N625-R628 PolarHBondContact O-N 3.09Å; I626-R628 VanDerWaalsContact C-N 3.33Å; I626-R628 PolarHBondContact O-N 2.88Å; R628-K632 WeakPolarHBondContact O-CB 3.46Å; R628-K632 PolarHBondContact O-N 3.43Å
629	L	87.9	Confident	79.9	Confident	1 Å²	1	68 Å²	68	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-64.7	-44.5	173.4	175.7	62.4	0	0	0	111.1	L428 L432 V525 L615 I617 N625 I626 Q627 K632 L633	L428-L629 HydrophobicContact CD1-CD2 3.86Å; L432-L629 HydrophobicContact CD1-CD2 4.39Å; L432-L629 HydrophobicContact CD2-CD2 3.97Å; L432-L629 HydrophobicContact CD2-CG 4.25Å; V525-L629 HydrophobicContact CG1-CD2 4.35Å; V525-L629 HydrophobicContact CG2-CD1 3.8Å; V525-L629 HydrophobicContact CG2-CD2 4.29Å; L615-L629 HydrophobicContact CD1-CB 4.37Å; L615-L629 HydrophobicContact CD1-CD1 3.54Å; I617-L629 HydrophobicContact CD1-CD2 4.37Å; I617-L629 HydrophobicContact CG2-CD2 4.5Å; N625-L629 PolarHBondContact O-N 3.08Å; N625-L629 VanDerWaalsContact O-N 3.13Å; I626-L629 WeakPolarHBondContact O-CB 3.5Å; I626-L629 PolarHBondContact O-N 3.18Å; I626-L629 VanDerWaalsContact O-N 3.15Å; Q627-L629 VanDerWaalsContact C-N 3.29Å; Q627-L629 PolarHBondContact O-N 2.86Å; L629-K632 PolarHBondContact O-N 3.16Å; L629-L633 HydrophobicContact CD1-CD1 4.12Å; L629-L633 HydrophobicContact CD1-CD2 4.42Å; L629-L633 HydrophobicContact CD1-CG 4.06Å; L629-L633 HydrophobicContact CG-CD1 4.07Å; L629-L633 HydrophobicContact CG-CG 4.43Å; L629-L633 VanDerWaalsContact O-CG 3.28Å; L629-L633 WeakPolarHBondContact O-CG 3.46Å; L629-L633 PolarHBondContact O-N 2.75Å
630	R	87.4	Confident	79.8	Confident	56 Å²	56	75.7 Å²	75.7	21%	0.211	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-51.3	176.1	-66.3	174.8	69.1	143.6	1.3	111	L432 W453 I626 Q627 K632 L633 M634	L432-R630 HydrophobicContact CD2-CG 3.89Å; W453-R630 HydrophobicContact CH2-CB 4.33Å; W453-R630 HydrophobicContact CH2-CG 4.02Å; W453-R630 HydrophobicContact CZ2-CB 4.38Å; W453-R630 HydrophobicContact CZ2-CG 3.87Å; I626-R630 PolarHBondContact O-N 2.88Å; Q627-R630 WeakPolarHBondContact O-CB 3.3Å; Q627-R630 PolarHBondContact O-N 2.56Å; Q627-R630 VanDerWaalsContact O-N 3.14Å; R630-K632 VanDerWaalsContact C-N 3.3Å; R630-K632 PolarHBondContact O-N 3.2Å; R630-L633 PolarHBondContact O-N 3.05Å; R630-M634 VanDerWaalsContact O-CG 3.25Å; R630-M634 WeakPolarHBondContact O-CG 3.19Å; R630-M634 PolarHBondContact O-N 3.17Å
631	E	86.9	Confident	79.8	Confident	114 Å²	114	81.4 Å²	81.4	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-58.3	-40.8	178	-71.8	167	-169.4	0	0	112.4	Q627 M634 S635	Q627-E631 PolarHBondContact NE2-OE1 2.89Å; Q627-E631 WeakPolarHBondContact O-CG 3.37Å; Q627-E631 PolarHBondContact O-N 3.37Å; E631-M634 PolarHBondContact O-N 3.18Å; E631-S635 WeakPolarHBondContact O-CB 3.46Å; E631-S635 PolarHBondContact O-N 3.27Å
632	K	87.5	Confident	80.6	Confident	74 Å²	74	73.5 Å²	73.5	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-65.4	-45.7	176.6	-174.6	63.7	174.8	-178.9	0	111.9	L615 R628 L629 R630 M634 S635 V636	L615-K632 HydrophobicContact CD1-CB 4.14Å; L615-K632 HydrophobicContact CD1-CG 4.15Å; R628-K632 WeakPolarHBondContact O-CB 3.46Å; R628-K632 PolarHBondContact O-N 3.43Å; L629-K632 PolarHBondContact O-N 3.16Å; R630-K632 VanDerWaalsContact C-N 3.3Å; R630-K632 PolarHBondContact O-N 3.2Å; K632-M634 VanDerWaalsContact C-N 3.31Å; K632-M634 PolarHBondContact O-N 2.99Å; K632-S635 PolarHBondContact O-N 2.95Å; K632-V636 HydrophobicContact CD-CG2 4.27Å; K632-V636 HydrophobicContact CG-CG2 4.41Å; K632-V636 WeakPolarHBondContact O-CG2 3.33Å; K632-V636 PolarHBondContact O-N 3.38Å
633	L	88.4	Confident	81.4	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-40.8	178.6	-66.7	172	0	0	0	111.4	L415 W453 L487 V489 L629 R630 V636 A637	L415-L633 HydrophobicContact CD1-CD1 3.91Å; L415-L633 HydrophobicContact CD1-CD2 4.05Å; L415-L633 HydrophobicContact CD1-CG 4.48Å; W453-L633 HydrophobicContact CH2-CD1 4.37Å; W453-L633 HydrophobicContact CZ3-CD1 4.14Å; L487-L633 HydrophobicContact CD2-CD2 3.61Å; L487-L633 HydrophobicContact CG-CD2 4.41Å; V489-L633 HydrophobicContact CG2-CD2 4.09Å; L629-L633 HydrophobicContact CD1-CD1 4.12Å; L629-L633 HydrophobicContact CD1-CD2 4.42Å; L629-L633 HydrophobicContact CD1-CG 4.06Å; L629-L633 HydrophobicContact CG-CD1 4.07Å; L629-L633 HydrophobicContact CG-CG 4.43Å; L629-L633 VanDerWaalsContact O-CG 3.28Å; L629-L633 WeakPolarHBondContact O-CG 3.46Å; L629-L633 PolarHBondContact O-N 2.75Å; R630-L633 PolarHBondContact O-N 3.05Å; L633-V636 PolarHBondContact O-N 2.9Å; L633-A637 WeakPolarHBondContact O-CB 3.4Å; L633-A637 PolarHBondContact O-N 3.11Å
634	M	85.6	Confident	81.2	Confident	23 Å²	23	65.4 Å²	65.4	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-50.1	174.3	-67.9	-60.7	-58.8	0	0	112	A455 D456 L461 F463 R630 E631 K632 V636 A637 D638	A455-M634 HydrophobicContact CB-CE 4.43Å; A455-M634 HydrophobicContact CB-SD 3.3Å; A455-M634 WeakPolarHBondContact CB-SD 2.98Å; D456-M634 HydrophobicContact CB-CE 3.49Å; D456-M634 VanDerWaalsContact CB-CE 3.49Å; L461-M634 HydrophobicContact CB-CE 4.04Å; L461-M634 HydrophobicContact CD2-CE 3.43Å; L461-M634 VanDerWaalsContact CD2-CE 3.43Å; L461-M634 HydrophobicContact CD2-SD 3.65Å; L461-M634 HydrophobicContact CG-CE 4.29Å; F463-M634 HydrophobicContact CE2-SD 3.76Å; F463-M634 HydrophobicContact CZ-SD 4.42Å; R630-M634 VanDerWaalsContact O-CG 3.25Å; R630-M634 WeakPolarHBondContact O-CG 3.19Å; R630-M634 PolarHBondContact O-N 3.17Å; E631-M634 PolarHBondContact O-N 3.18Å; K632-M634 VanDerWaalsContact C-N 3.31Å; K632-M634 PolarHBondContact O-N 2.99Å; M634-V636 VanDerWaalsContact C-N 3.27Å; M634-V636 PolarHBondContact O-N 3.33Å; M634-A637 WeakPolarHBondContact O-CB 3.24Å; M634-A637 PolarHBondContact O-N 3.04Å; M634-A637 VanDerWaalsContact O-N 3.14Å; M634-D638 PolarHBondContact O-N 2.9Å
635	S	85.9	Confident	80.8	Confident	56 Å²	56	63.5 Å²	63.5	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-59	-38.9	179.2	167.3	0	0	0	0	112.2	E631 K632 H639	E631-S635 WeakPolarHBondContact O-CB 3.46Å; E631-S635 PolarHBondContact O-N 3.27Å; K632-S635 PolarHBondContact O-N 2.95Å; S635-H639 PolarHBondContact O-CD2 3.39Å
636	V	85.6	Confident	80.1	Confident	4 Å²	4	62 Å²	62	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-39.2	178	-179.4	0	0	0	0	110.8	L487 V521 L611 K632 L633 M634 D638 H639 I642 F643	L487-V636 HydrophobicContact CD1-CG1 4.3Å; V521-V636 HydrophobicContact CG1-CG1 4.31Å; L611-V636 HydrophobicContact CD1-CB 4.41Å; L611-V636 HydrophobicContact CD1-CG1 3.82Å; L611-V636 HydrophobicContact CD1-CG2 3.74Å; K632-V636 HydrophobicContact CD-CG2 4.27Å; K632-V636 HydrophobicContact CG-CG2 4.41Å; K632-V636 WeakPolarHBondContact O-CG2 3.33Å; K632-V636 PolarHBondContact O-N 3.38Å; L633-V636 PolarHBondContact O-N 2.9Å; M634-V636 VanDerWaalsContact C-N 3.27Å; M634-V636 PolarHBondContact O-N 3.33Å; V636-D638 VanDerWaalsContact C-N 3.31Å; V636-D638 PolarHBondContact O-N 2.82Å; V636-H639 PolarHBondContact O-N 3.44Å; V636-I642 HydrophobicContact CG1-CD1 4.24Å; V636-I642 HydrophobicContact CG1-CG2 4.28Å; V636-F643 HydrophobicContact CG1-CE2 3.85Å
637	A	82.6	Confident	79.2	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-37.9	176.4	0	0	0	0	0	112.5	L413 L461 F463 L633 M634 H639 L646	L413-A637 HydrophobicContact CD2-CB 3.63Å; L461-A637 HydrophobicContact CD2-CB 3.68Å; F463-A637 HydrophobicContact CZ-CB 4.03Å; L633-A637 WeakPolarHBondContact O-CB 3.4Å; L633-A637 PolarHBondContact O-N 3.11Å; M634-A637 WeakPolarHBondContact O-CB 3.24Å; M634-A637 PolarHBondContact O-N 3.04Å; M634-A637 VanDerWaalsContact O-N 3.14Å; A637-H639 VanDerWaalsContact C-N 3.25Å; A637-H639 PolarHBondContact O-N 2.96Å; A637-L646 HydrophobicContact CB-CD2 4.13Å; A637-L646 WeakPolarHBondContact O-CD2 3.35Å
638	D	78.4	Confident	78.4	Confident	58 Å²	58	60.9 Å²	60.9	31%	0.31	28%	0.282	S	S	.	.	H	α-helix	trans	-69.9	-17	-179.9	-77	-15.8	0	0	0	113.8	R459 M634 V636 R640 H647	R459-D638 IonicContact NH1-OD2 2.64Å; R459-D638 PolarHBondContact NH1-OD2 3.22Å; M634-D638 PolarHBondContact O-N 2.9Å; V636-D638 VanDerWaalsContact C-N 3.31Å; V636-D638 PolarHBondContact O-N 2.82Å; D638-R640 PolarHBondContact O-N 3.48Å; D638-H647 PolarHBondContact O-NE2 3.33Å
639	H	78.4	Confident	77.4	Confident	100 Å²	100	55.8 Å²	55.8	46%	0.463	27%	0.266	S	S	.	.			trans	-71.5	110.9	179.7	-83.8	-72.8	0	0	0	112.3	S635 V636 A637 E641 I642 F643	S635-H639 PolarHBondContact O-CD2 3.39Å; V636-H639 PolarHBondContact O-N 3.44Å; A637-H639 VanDerWaalsContact C-N 3.25Å; A637-H639 PolarHBondContact O-N 2.96Å; H639-E641 VanDerWaalsContact C-N 3.28Å; H639-E641 PolarHBondContact O-N 3.23Å; H639-I642 HydrophobicContact CB-CB 4.11Å; H639-I642 HydrophobicContact CB-CD1 3.82Å; H639-I642 HydrophobicContact CB-CG1 3.9Å; H639-I642 PolarHBondContact O-N 2.91Å; H639-I642 VanDerWaalsContact O-N 3.15Å; H639-F643 PolarHBondContact O-N 2.95Å; H639-F643 VanDerWaalsContact O-N 3.09Å
640	R	69.8	Low	76.6	Confident	190 Å²	190	56.3 Å²	56.3	72%	0.717	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.1	-179.6	-67.8	-174.2	176.6	-174.3	1.2	114.6	D638 P644	D638-R640 PolarHBondContact O-N 3.48Å; R640-P644 VanDerWaalsContact O-CA 3.26Å; R640-P644 WeakPolarHBondContact O-CA 3.16Å
641	E	70.4	Confident	75.8	Confident	182 Å²	182	53.6 Å²	53.6	85%	0.85	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-31.3	179.5	-65	179	179.6	0	0	112.5	H639	H639-E641 VanDerWaalsContact C-N 3.28Å; H639-E641 PolarHBondContact O-N 3.23Å
642	I	75.3	Confident	75.2	Confident	39 Å²	39	53.1 Å²	53.1	20%	0.2	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-44.3	-176.6	-59.6	-179.1	0	0	0	110.4	V521 V636 H639 P644	V521-I642 HydrophobicContact CB-CG2 4.29Å; V521-I642 HydrophobicContact CG1-CG2 3.94Å; V521-I642 HydrophobicContact CG2-CG2 3.47Å; V521-I642 VanDerWaalsContact CG2-CG2 3.47Å; V636-I642 HydrophobicContact CG1-CD1 4.24Å; V636-I642 HydrophobicContact CG1-CG2 4.28Å; H639-I642 HydrophobicContact CB-CB 4.11Å; H639-I642 HydrophobicContact CB-CD1 3.82Å; H639-I642 HydrophobicContact CB-CG1 3.9Å; H639-I642 PolarHBondContact O-N 2.91Å; H639-I642 VanDerWaalsContact O-N 3.15Å; I642-P644 VanDerWaalsContact C-CD 3.42Å; I642-P644 WeakPolarHBondContact O-CD 3.22Å
643	F	76.1	Confident	74.6	Confident	5 Å²	5	50 Å²	50	2%	0.022	24%	0.241	C	C	.	.			trans	-124.6	67.8	179.5	-63.7	-65.6	0	0	0	111.8	L413 G485 L487 V521 V636 H639 N645 L646 H647	L413-F643 HydrophobicContact CD1-CD1 3.82Å; L413-F643 HydrophobicContact CD1-CE1 3.99Å; L413-F643 HydrophobicContact CD1-CG 4.13Å; L413-F643 HydrophobicContact CD1-CZ 4.41Å; L413-F643 HydrophobicContact CD2-CD2 4.03Å; L413-F643 HydrophobicContact CD2-CE2 3.94Å; L413-F643 HydrophobicContact CD2-CG 4.39Å; L413-F643 HydrophobicContact CD2-CZ 4.29Å; G485-F643 WeakPolarHBondContact O-CD1 3.31Å; G485-F643 WeakPolarHBondContact O-CE1 3.34Å; L487-F643 HydrophobicContact CB-CE1 4.44Å; L487-F643 HydrophobicContact CB-CE2 4.32Å; L487-F643 HydrophobicContact CB-CZ 3.68Å; L487-F643 HydrophobicContact CD1-CE2 4.29Å; L487-F643 HydrophobicContact CD1-CZ 3.93Å; L487-F643 HydrophobicContact CG-CZ 4.27Å; V521-F643 HydrophobicContact CB-CZ 4.02Å; V521-F643 HydrophobicContact CG1-CZ 4.21Å; V521-F643 HydrophobicContact CG2-CE1 4.25Å; V521-F643 HydrophobicContact CG2-CZ 4.1Å; V636-F643 HydrophobicContact CG1-CE2 3.85Å; H639-F643 PolarHBondContact O-N 2.95Å; H639-F643 VanDerWaalsContact O-N 3.09Å; F643-N645 PolarHBondContact O-N 2.81Å; F643-L646 HydrophobicContact CB-CB 4Å; F643-L646 VanDerWaalsContact O-CB 3.27Å; F643-L646 WeakPolarHBondContact O-CB 3.22Å; F643-L646 PolarHBondContact O-N 3.45Å; F643-H647 PolarHBondContact O-CD2 3.36Å
644	P	66.4	Low	74.2	Confident	43 Å²	43	50.2 Å²	50.2	28%	0.279	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-57.8	-35	-179.6	19.5	-30.8	0	0	0	112.7	I381 R640 I642 L646 H647	I381-P644 HydrophobicContact CD1-CB 3.37Å; I381-P644 HydrophobicContact CD1-CG 4.46Å; I381-P644 HydrophobicContact CG1-CB 4.03Å; R640-P644 VanDerWaalsContact O-CA 3.26Å; R640-P644 WeakPolarHBondContact O-CA 3.16Å; I642-P644 VanDerWaalsContact C-CD 3.42Å; I642-P644 WeakPolarHBondContact O-CD 3.22Å; P644-L646 PolarHBondContact O-N 3.21Å; P644-H647 PolarHBondContact O-N 3.04Å
645	N	65.5	Low	73.7	Confident	74 Å²	74	51.8 Å²	51.8	40%	0.396	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-67	-22.8	-179.4	-65.7	-10.3	0	0	0	113.5	F643 H647 R648	F643-N645 PolarHBondContact O-N 2.81Å; N645-H647 VanDerWaalsContact C-N 3.28Å; N645-R648 WeakPolarHBondContact O-CB 3.06Å; N645-R648 PolarHBondContact O-N 2.93Å; N645-R648 PolarHBondContact OD1-NE 2.94Å; N645-R648 PolarHBondContact OD1-NH2 3.42Å
646	L	68.6	Low	73.4	Confident	24 Å²	24	52.8 Å²	52.8	13%	0.126	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-70.2	-29.5	177.4	-163.6	73.6	0	0	0	111.8	P411 L413 L461 A637 F643 P644 R648	P411-L646 HydrophobicContact CB-CD1 3.5Å; P411-L646 VanDerWaalsContact CB-CD1 3.5Å; P411-L646 HydrophobicContact CB-CD2 4.45Å; P411-L646 HydrophobicContact CB-CG 3.61Å; P411-L646 HydrophobicContact CG-CG 4.49Å; L413-L646 HydrophobicContact CB-CD1 3.84Å; L413-L646 HydrophobicContact CD1-CD1 4.4Å; L461-L646 HydrophobicContact CD1-CD1 4.21Å; L461-L646 HydrophobicContact CD1-CD2 3.92Å; L461-L646 HydrophobicContact CD1-CG 4.45Å; A637-L646 HydrophobicContact CB-CD2 4.13Å; A637-L646 WeakPolarHBondContact O-CD2 3.35Å; F643-L646 HydrophobicContact CB-CB 4Å; F643-L646 VanDerWaalsContact O-CB 3.27Å; F643-L646 WeakPolarHBondContact O-CB 3.22Å; F643-L646 PolarHBondContact O-N 3.45Å; P644-L646 PolarHBondContact O-N 3.21Å; L646-R648 VanDerWaalsContact C-N 3.33Å
647	H	65	Low	73.4	Confident	67 Å²	67	52.6 Å²	52.6	31%	0.31	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-92.5	6.8	-180	-60.1	-85.8	0	0	0	112.5	D638 F643 P644 N645 V649	D638-H647 PolarHBondContact O-NE2 3.33Å; F643-H647 PolarHBondContact O-CD2 3.36Å; P644-H647 PolarHBondContact O-N 3.04Å; N645-H647 VanDerWaalsContact C-N 3.28Å; H647-V649 PolarHBondContact O-N 3.31Å
648	R	68.3	Low	73.2	Confident	28 Å²	28	53.6 Å²	53.6	11%	0.106	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-63.7	125.3	173.2	-75.6	177.2	-174.6	-160.7	0.5	109.5	L380 I381 N645 L646	L380-R648 PolarHBondContact O-NH2 3.49Å; I381-R648 HydrophobicContact CG2-CG 3.52Å; N645-R648 WeakPolarHBondContact O-CB 3.06Å; N645-R648 PolarHBondContact O-N 2.93Å; N645-R648 PolarHBondContact OD1-NE 2.94Å; N645-R648 PolarHBondContact OD1-NH2 3.42Å; L646-R648 VanDerWaalsContact C-N 3.33Å
649	V	66.3	Low	73.4	Confident	31 Å²	31	55 Å²	55	19%	0.188	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-84.8	120.6	171.7	-172.2	0	0	0	0	108.2	Y398 L402 L407 H647	Y398-V649 PolarHBondContact OH-O 3.26Å; L402-V649 HydrophobicContact CD1-CB 3.83Å; L402-V649 HydrophobicContact CD1-CG1 3.44Å; L402-V649 VanDerWaalsContact CD1-CG1 3.44Å; L402-V649 HydrophobicContact CG-CG1 4.3Å; L407-V649 HydrophobicContact CD2-CB 4.39Å; L407-V649 HydrophobicContact CD2-CG1 3.75Å; L407-V649 HydrophobicContact CD2-CG2 3.69Å; H647-V649 PolarHBondContact O-N 3.31Å
650	L	69.2	Low	73.6	Confident	12 Å²	12	51.4 Å²	51.4	6%	0.063	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-98.3	145.9	178	-64.2	173.9	0	0	0	110.6	V409 W654 Y694	V409-L650 HydrophobicContact CG1-CD1 4.43Å; V409-L650 HydrophobicContact CG2-CB 3.85Å; V409-L650 HydrophobicContact CG2-CG 4.42Å; L650-W654 HydrophobicContact CD2-CE3 4.1Å; L650-Y694 HydrophobicContact CD1-CE1 3.6Å; L650-Y694 HydrophobicContact CD2-CD1 4.35Å; L650-Y694 HydrophobicContact CD2-CE1 3.74Å; L650-Y694 HydrophobicContact CD2-CE2 4.25Å; L650-Y694 HydrophobicContact CG-CE1 4.31Å
651	P	71.3	Confident	74.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-63.6	149	172	-16.2	29.1	0	0	0	111.5	Y398 E401 S653 W654 Q655	Y398-P651 HydrophobicContact CD2-CG 3.67Å; Y398-P651 HydrophobicContact CE2-CG 3.57Å; E401-P651 HydrophobicContact CB-CB 4.49Å; E401-P651 HydrophobicContact CG-CB 3.95Å; E401-P651 WeakPolarHBondContact OE1-CB 3.45Å; P651-S653 PolarHBondContact O-N 3.36Å; P651-W654 HydrophobicContact CG-CG 4.46Å; P651-W654 PolarHBondContact O-N 2.64Å; P651-Q655 PolarHBondContact O-N 2.79Å
652	K	73.6	Confident	74.8	Confident	104 Å²	104	38.8 Å²	38.8	45%	0.452	19%	0.189	S	C	.	.	H	α-helix	trans	-56.5	-33.8	178.8	-78.5	179.3	175.6	-177.8	0	113.1	W654 Q655 M656	K652-W654 VanDerWaalsContact C-N 3.32Å; K652-W654 PolarHBondContact O-N 3.14Å; K652-Q655 PolarHBondContact O-N 3.11Å; K652-M656 WeakPolarHBondContact O-CB 3.46Å; K652-M656 PolarHBondContact O-N 2.99Å
653	S	76.6	Confident	75	Confident	7 Å²	7	43.8 Å²	43.8	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-36.5	177.5	57.2	0	0	0	0	112.6	E401 P651 M656 L657 A681 L683	E401-S653 WeakPolarHBondContact OE1-CB 3.21Å; E401-S653 PolarHBondContact OE1-N 3.02Å; E401-S653 PolarHBondContact OE1-OG 2.92Å; E401-S653 PolarHBondContact OE2-OG 3.15Å; P651-S653 PolarHBondContact O-N 3.36Å; S653-M656 PolarHBondContact O-N 3.4Å; S653-L657 WeakPolarHBondContact O-CB 3.01Å; S653-L657 PolarHBondContact O-N 3.11Å; S653-A681 VanDerWaalsContact CA-O 3.29Å; S653-A681 WeakPolarHBondContact CA-O 3.43Å; S653-A681 WeakPolarHBondContact CB-O 3.01Å; S653-A681 WeakPolarHBondContact O-CB 3.38Å; S653-L683 WeakPolarHBondContact OG-CD2 3.42Å
654	W	79.8	Confident	75.1	Confident	7 Å²	7	45 Å²	45	3%	0.027	22%	0.218	C	C	.	.	H	α-helix	trans	-72.5	-37.9	179.1	-72.2	35.6	0	0	0	111.1	V387 L650 P651 K652 L657 E658 S690 A691 Y694	V387-W654 HydrophobicContact CG2-CH2 4.06Å; V387-W654 HydrophobicContact CG2-CZ2 4.21Å; L650-W654 HydrophobicContact CD2-CE3 4.1Å; P651-W654 HydrophobicContact CG-CG 4.46Å; P651-W654 PolarHBondContact O-N 2.64Å; K652-W654 VanDerWaalsContact C-N 3.32Å; K652-W654 PolarHBondContact O-N 3.14Å; W654-L657 WeakPolarHBondContact O-CB 3.32Å; W654-L657 PolarHBondContact O-N 3.45Å; W654-E658 PolarHBondContact O-N 3.25Å; W654-S690 WeakPolarHBondContact CH2-O 3.29Å; W654-A691 HydrophobicContact CD2-CB 3.66Å; W654-A691 HydrophobicContact CE3-CB 4.09Å; W654-A691 HydrophobicContact CG-CB 4.03Å; W654-A691 HydrophobicContact CH2-CB 4.38Å; W654-A691 HydrophobicContact CZ2-CB 3.97Å; W654-A691 HydrophobicContact CZ3-CB 4.45Å; W654-Y694 AromaticContact CE3-CD1 3.8Å; W654-Y694 HydrophobicContact CE3-CD1 3.8Å; W654-Y694 HydrophobicContact CE3-CG 4.09Å; W654-Y694 AromaticContact CZ3-CD1 3.78Å; W654-Y694 HydrophobicContact CZ3-CD1 3.78Å; W654-Y694 HydrophobicContact CZ3-CD2 4.33Å; W654-Y694 AromaticContact CZ3-CG 3.56Å; W654-Y694 HydrophobicContact CZ3-CG 3.56Å
655	Q	74.7	Confident	75.7	Confident	56 Å²	56	51.6 Å²	51.6	26%	0.262	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-46.5	173.2	-178.3	-173.5	-10.8	0	0	111.6	P651 K652 L657 E658 E659	P651-Q655 PolarHBondContact O-N 2.79Å; K652-Q655 PolarHBondContact O-N 3.11Å; Q655-L657 VanDerWaalsContact C-N 3.26Å; Q655-L657 PolarHBondContact O-N 3.37Å; Q655-E658 WeakPolarHBondContact O-CB 3.27Å; Q655-E658 PolarHBondContact O-N 3.01Å; Q655-E658 VanDerWaalsContact O-N 3.16Å; Q655-E659 PolarHBondContact NE2-OE1 2.93Å; Q655-E659 PolarHBondContact O-N 2.97Å
656	M	79.6	Confident	76.5	Confident	77 Å²	77	52.3 Å²	52.3	38%	0.379	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-39.1	178.1	-174.5	63.5	176.5	0	0	110.9	K652 S653 E658 E659 L660 A681	K652-M656 WeakPolarHBondContact O-CB 3.46Å; K652-M656 PolarHBondContact O-N 2.99Å; S653-M656 PolarHBondContact O-N 3.4Å; M656-E658 VanDerWaalsContact C-N 3.35Å; M656-E658 PolarHBondContact O-N 3.37Å; M656-E659 PolarHBondContact O-N 2.85Å; M656-L660 HydrophobicContact CE-CD1 4.17Å; M656-L660 HydrophobicContact CE-CD2 4.12Å; M656-L660 HydrophobicContact CE-CG 4.15Å; M656-L660 HydrophobicContact CG-CD1 4.1Å; M656-L660 HydrophobicContact CG-CG 4.44Å; M656-L660 WeakPolarHBondContact O-CB 3.46Å; M656-L660 WeakPolarHBondContact O-CG 3.43Å; M656-L660 PolarHBondContact O-N 3.26Å; M656-A681 HydrophobicContact CB-CB 3.97Å; M656-A681 HydrophobicContact CG-CB 3.98Å
657	L	84.4	Confident	77.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-48	173.3	-173.8	70.3	0	0	0	111.6	S653 W654 Q655 L660 H661 L677 A681 L683 L688 A691 L695	S653-L657 WeakPolarHBondContact O-CB 3.01Å; S653-L657 PolarHBondContact O-N 3.11Å; W654-L657 WeakPolarHBondContact O-CB 3.32Å; W654-L657 PolarHBondContact O-N 3.45Å; Q655-L657 VanDerWaalsContact C-N 3.26Å; Q655-L657 PolarHBondContact O-N 3.37Å; L657-L660 PolarHBondContact O-N 2.66Å; L657-H661 WeakPolarHBondContact CD1-CE1 3.28Å; L657-H661 PolarHBondContact O-N 2.92Å; L657-H661 PolarHBondContact O-ND1 3.5Å; L657-L677 HydrophobicContact CD1-CB 4.3Å; L657-A681 HydrophobicContact CB-CB 4.17Å; L657-L683 HydrophobicContact CB-CD1 4.06Å; L657-L683 HydrophobicContact CD1-CD1 4.31Å; L657-L683 HydrophobicContact CD2-CD1 3.76Å; L657-L683 HydrophobicContact CG-CD1 4.27Å; L657-L688 HydrophobicContact CD1-CD1 3.76Å; L657-L688 HydrophobicContact CD2-CD1 3.65Å; L657-L688 HydrophobicContact CG-CD1 4.34Å; L657-A691 HydrophobicContact CD2-CB 3.73Å; L657-L695 HydrophobicContact CD2-CD1 4.33Å
658	E	80	Confident	78.1	Confident	22 Å²	22	50.1 Å²	50.1	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-53.8	177.5	-175	-174.7	161.2	0	0	110.9	W654 Q655 M656 L660 H661 F662 L695 K700	W654-E658 PolarHBondContact O-N 3.25Å; Q655-E658 WeakPolarHBondContact O-CB 3.27Å; Q655-E658 PolarHBondContact O-N 3.01Å; Q655-E658 VanDerWaalsContact O-N 3.16Å; M656-E658 VanDerWaalsContact C-N 3.35Å; M656-E658 PolarHBondContact O-N 3.37Å; E658-L660 VanDerWaalsContact C-N 3.26Å; E658-L660 PolarHBondContact O-N 2.94Å; E658-H661 PolarHBondContact O-N 3.46Å; E658-H661 VanDerWaalsContact O-N 3.13Å; E658-F662 HydrophobicContact CG-CD2 3.76Å; E658-F662 HydrophobicContact CG-CE2 3.64Å; E658-F662 VanDerWaalsContact O-CD2 3.24Å; E658-F662 WeakPolarHBondContact O-CD2 2.97Å; E658-F662 PolarHBondContact O-N 3.27Å; E658-F662 VanDerWaalsContact O-N 3.09Å; E658-L695 HydrophobicContact CB-CD2 4.42Å; E658-L695 HydrophobicContact CG-CD2 4.3Å; E658-K700 HydrophobicContact CG-CD 4.45Å; E658-K700 WeakPolarHBondContact OE1-CD 3.08Å; E658-K700 WeakPolarHBondContact OE1-CE 3.5Å; E658-K700 IonicContact OE1-NZ 3.06Å; E658-K700 PolarHBondContact OE1-NZ 3.29Å; E658-K700 IonicContact OE2-NZ 2.99Å; E658-K700 PolarHBondContact OE2-NZ 3.09Å
659	E	81.4	Confident	79.1	Confident	87 Å²	87	49.4 Å²	49.4	41%	0.407	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-35.7	-179.7	-71	-178.8	-164.3	0	0	112.8	Q655 M656 K663	Q655-E659 PolarHBondContact NE2-OE1 2.93Å; Q655-E659 PolarHBondContact O-N 2.97Å; M656-E659 PolarHBondContact O-N 2.85Å; E659-K663 VanDerWaalsContact O-CG 3.3Å; E659-K663 WeakPolarHBondContact O-CG 3.02Å; E659-K663 PolarHBondContact O-N 3.09Å
660	L	83.9	Confident	80.2	Confident	24 Å²	24	49.5 Å²	49.5	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-69.7	-40.4	176.4	-73.2	173.6	0	0	0	112.3	M656 L657 E658 K663 L677 Q680 A681	M656-L660 HydrophobicContact CE-CD1 4.17Å; M656-L660 HydrophobicContact CE-CD2 4.12Å; M656-L660 HydrophobicContact CE-CG 4.15Å; M656-L660 HydrophobicContact CG-CD1 4.1Å; M656-L660 HydrophobicContact CG-CG 4.44Å; M656-L660 WeakPolarHBondContact O-CB 3.46Å; M656-L660 WeakPolarHBondContact O-CG 3.43Å; M656-L660 PolarHBondContact O-N 3.26Å; L657-L660 PolarHBondContact O-N 2.66Å; E658-L660 VanDerWaalsContact C-N 3.26Å; E658-L660 PolarHBondContact O-N 2.94Å; L660-K663 PolarHBondContact O-N 3.3Å; L660-L677 HydrophobicContact CB-CB 4.36Å; L660-L677 HydrophobicContact CB-CD1 4.35Å; L660-L677 HydrophobicContact CB-CD2 4.24Å; L660-L677 HydrophobicContact CD1-CB 4.38Å; L660-L677 HydrophobicContact CD1-CD2 4.49Å; L660-Q680 HydrophobicContact CD1-CB 4.14Å; L660-A681 HydrophobicContact CD1-CB 4.4Å
661	H	83.4	Confident	81	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-41.5	177.6	-80.1	71.2	0	0	0	111.8	L657 E658 K663 S664 S674 H716	L657-H661 WeakPolarHBondContact CD1-CE1 3.28Å; L657-H661 PolarHBondContact O-N 2.92Å; L657-H661 PolarHBondContact O-ND1 3.5Å; E658-H661 PolarHBondContact O-N 3.46Å; E658-H661 VanDerWaalsContact O-N 3.13Å; H661-K663 VanDerWaalsContact C-N 3.27Å; H661-K663 PolarHBondContact O-N 2.87Å; H661-S664 PolarHBondContact O-N 3.39Å; H661-S674 PolarHBondContact CE1-OG 2.91Å; H661-S674 VanDerWaalsContact CE1-OG 3.32Å; H661-S674 PolarHBondContact NE2-OG 3.26Å; H661-H716 HydrophobicContact CB-CB 4.34Å; H661-H716 PolarHBondContact O-CE1 3.45Å; H661-H716 PolarHBondContact O-ND1 2.87Å
662	F	80.3	Confident	81.8	Confident	106 Å²	106	59.4 Å²	59.4	47%	0.465	27%	0.271	S	S	.	.	H	α-helix	trans	-73.9	-12.3	179.8	-76.9	-73	0	0	0	114.6	E658 K700	E658-F662 HydrophobicContact CG-CD2 3.76Å; E658-F662 HydrophobicContact CG-CE2 3.64Å; E658-F662 VanDerWaalsContact O-CD2 3.24Å; E658-F662 WeakPolarHBondContact O-CD2 2.97Å; E658-F662 PolarHBondContact O-N 3.27Å; E658-F662 VanDerWaalsContact O-N 3.09Å; F662-K700 HydrophobicContact CZ-CB 4.25Å
663	K	80.3	Confident	82.5	Confident	143 Å²	143	56.9 Å²	56.9	62%	0.622	27%	0.267	S	S	*	.	H	α-helix	trans	-77.4	-23	173	-77.7	169.8	-173.7	170.9	0	113.1	E659 L660 H661	E659-K663 VanDerWaalsContact O-CG 3.3Å; E659-K663 WeakPolarHBondContact O-CG 3.02Å; E659-K663 PolarHBondContact O-N 3.09Å; L660-K663 PolarHBondContact O-N 3.3Å; H661-K663 VanDerWaalsContact C-N 3.27Å; H661-K663 PolarHBondContact O-N 2.87Å
664	S	77.9	Confident	83	Confident	31 Å²	31	56.6 Å²	56.6	22%	0.217	26%	0.264	C	S	.	.			trans	-70.6	142	177.1	-175.9	0	0	0	0	111.2	H661 D666 H716	H661-S664 PolarHBondContact O-N 3.39Å; S664-D666 PolarHBondContact OG-N 3.29Å; S664-D666 PolarHBondContact OG-OD2 3.13Å; S664-H716 PolarHBondContact O-CE1 3.24Å
665	K	78.7	Confident	83.3	Confident	181 Å²	181	57 Å²	57	79%	0.787	27%	0.269	S	S	*	.			trans	-90.7	-7.6	174.6	-67.6	-174	178.9	-179.3	0	113.1	R720	K665-R720 PolarHBondContact O-NH1 3.33Å
666	D	82.6	Confident	83.9	Confident	90 Å²	90	62.6 Å²	62.6	48%	0.481	29%	0.288	S	S	.	.	S	Bend	trans	-64.7	162.4	-177.8	-57.7	-36	0	0	0	111.2	S664 W668 H716 N717	S664-D666 PolarHBondContact OG-N 3.29Å; S664-D666 PolarHBondContact OG-OD2 3.13Å; D666-W668 WeakPolarHBondContact CB-O 3.43Å; D666-H716 PolarHBondContact O-CE1 3.01Å; D666-H716 PolarHBondContact O-NE2 3.45Å; D666-N717 VanDerWaalsContact O-CB 3.31Å; D666-N717 WeakPolarHBondContact O-CB 2.99Å; D666-N717 PolarHBondContact O-ND2 2.9Å; D666-N717 VanDerWaalsContact O-ND2 3.16Å
667	L	81.1	Confident	84.3	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.037	28%	0.278	C	S	.	.	S	Bend	trans	-75.5	-36	174.5	-178.4	64.5	0	0	0	111.1	R720 I724 I804	L667-R720 HydrophobicContact CD1-CB 3.93Å; L667-R720 HydrophobicContact CD1-CG 3.74Å; L667-I724 HydrophobicContact CD1-CD1 4.21Å; L667-I724 HydrophobicContact CD2-CD1 4.27Å; L667-I804 HydrophobicContact CD2-CD1 3.86Å; L667-I804 HydrophobicContact CD2-CG1 3.8Å
668	W	87.1	Confident	84.3	Confident	37 Å²	37	60.5 Å²	60.5	14%	0.14	28%	0.278	C	S	.	.			trans	-150.4	161.1	-177.6	54.5	-92.1	0	0	0	109.7	D666 Y713 V714 F715 Q799 D800 L803	D666-W668 WeakPolarHBondContact CB-O 3.43Å; W668-Y713 HydrophobicContact CD2-CD1 4.05Å; W668-Y713 AromaticContact CE3-CD1 3.3Å; W668-Y713 HydrophobicContact CE3-CD1 3.3Å; W668-Y713 AromaticContact CE3-CE1 3.84Å; W668-Y713 HydrophobicContact CE3-CE1 3.84Å; W668-Y713 HydrophobicContact CE3-CG 4.34Å; W668-Y713 HydrophobicContact CH2-CD1 4.02Å; W668-Y713 AromaticContact CH2-CE1 3.64Å; W668-Y713 HydrophobicContact CH2-CE1 3.64Å; W668-Y713 HydrophobicContact CZ2-CE1 4.43Å; W668-Y713 AromaticContact CZ3-CD1 3.29Å; W668-Y713 HydrophobicContact CZ3-CD1 3.29Å; W668-Y713 AromaticContact CZ3-CE1 3.31Å; W668-Y713 HydrophobicContact CZ3-CE1 3.31Å; W668-V714 CarbonylContact C-O 3.58Å; W668-V714 VanDerWaalsContact CA-O 3.31Å; W668-V714 WeakPolarHBondContact CA-O 3.33Å; W668-F715 HydrophobicContact CB-CD1 3.82Å; W668-F715 HydrophobicContact CB-CE1 4.1Å; W668-F715 HydrophobicContact CB-CG 4.34Å; W668-F715 HydrophobicContact CG-CE1 4.43Å; W668-Q799 HydrophobicContact CH2-CG 4.44Å; W668-Q799 HydrophobicContact CZ2-CG 4.06Å; W668-D800 PolarHBondContact NE1-OD1 3.46Å; W668-L803 HydrophobicContact CD2-CD1 3.81Å; W668-L803 HydrophobicContact CE3-CD1 4.35Å; W668-L803 HydrophobicContact CG-CD1 4.35Å; W668-L803 HydrophobicContact CH2-CD1 4Å; W668-L803 HydrophobicContact CZ2-CD1 3.42Å; W668-L803 VanDerWaalsContact CZ2-CD1 3.42Å; W668-L803 HydrophobicContact CZ3-CD1 4.44Å
669	L	88.6	Confident	84.6	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	142.8	172	-67.1	171.1	0	0	0	109.5	L677 Y713 V714	L669-L677 HydrophobicContact CD1-CD1 3.84Å; L669-Y713 CarbonylContact O-C 3.6Å; L669-Y713 WeakPolarHBondContact O-CA 2.92Å; L669-V714 PolarHBondContact N-O 2.78Å; L669-V714 PolarHBondContact O-N 2.8Å
670	S	89.1	Confident	84.7	Confident	33 Å²	33	67.1 Å²	67.1	23%	0.231	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	157.6	168.9	66.4	0	0	0	0	110.6	W672 S673 S674 E712	S670-W672 PolarHBondContact O-N 3.06Å; S670-S673 PolarHBondContact O-N 3.41Å; S670-S673 PolarHBondContact OG-N 3.24Å; S670-S673 PolarHBondContact OG-OG 3.36Å; S670-S674 PolarHBondContact O-N 2.96Å; S670-E712 CarbonylContact C-O 3.54Å; S670-E712 WeakPolarHBondContact CA-O 2.88Å
671	W	87.2	Confident	84.7	Confident	33 Å²	33	66.6 Å²	66.6	13%	0.125	31%	0.311	C	S	.	.	H	α-helix	trans	-50.5	-46.6	175.5	178.3	-104.8	0	0	0	111.3	S673 S674 A675 E685 L688 Q689 L692 Y703 E712	W671-S673 PolarHBondContact O-N 3.48Å; W671-S674 CarbonylContact O-C 3.58Å; W671-S674 WeakPolarHBondContact O-CB 3.34Å; W671-S674 PolarHBondContact O-N 3.29Å; W671-A675 WeakPolarHBondContact O-CB 3.4Å; W671-A675 PolarHBondContact O-N 2.94Å; W671-E685 HydrophobicContact CZ2-CG 4.19Å; W671-E685 PolarHBondContact NE1-OE1 2.85Å; W671-L688 HydrophobicContact CH2-CD2 3.96Å; W671-L688 HydrophobicContact CH2-CG 4.34Å; W671-L688 HydrophobicContact CZ2-CD2 4.03Å; W671-L688 HydrophobicContact CZ3-CD2 4.28Å; W671-Q689 HydrophobicContact CH2-CB 3.98Å; W671-Q689 HydrophobicContact CH2-CG 4.41Å; W671-L692 HydrophobicContact CE3-CD1 4.2Å; W671-L692 HydrophobicContact CH2-CD1 4.26Å; W671-L692 HydrophobicContact CZ3-CD1 3.52Å; W671-Y703 HydrophobicContact CE3-CE2 4.01Å; W671-Y703 HydrophobicContact CZ3-CE1 4.35Å; W671-Y703 AromaticContact CZ3-CE2 3.89Å; W671-Y703 HydrophobicContact CZ3-CE2 3.89Å; W671-Y703 AromaticContact CZ3-CZ 3.54Å; W671-Y703 WeakPolarHBondContact CZ3-OH 3.19Å; W671-E712 PolarHBondContact N-O 3.42Å
672	W	87.3	Confident	84.5	Confident	188 Å²	188	69.1 Å²	69.1	71%	0.712	34%	0.338	S	S	*	.	H	α-helix	trans	-63.5	-37.9	179.9	-58.6	110.9	0	0	0	113.5	S670 R676	S670-W672 PolarHBondContact O-N 3.06Å; W672-R676 PolarHBondContact O-N 2.97Å
673	S	87.6	Confident	84.5	Confident	51 Å²	51	64.3 Å²	64.3	36%	0.357	32%	0.317	S	S	.	.	H	α-helix	trans	-67.7	-43.8	174.4	-67.7	0	0	0	0	110.8	S670 W671 A675 R676 L677	S670-S673 PolarHBondContact O-N 3.41Å; S670-S673 PolarHBondContact OG-N 3.24Å; S670-S673 PolarHBondContact OG-OG 3.36Å; W671-S673 PolarHBondContact O-N 3.48Å; S673-A675 VanDerWaalsContact C-N 3.35Å; S673-A675 PolarHBondContact O-N 3.01Å; S673-R676 WeakPolarHBondContact O-CB 3.26Å; S673-R676 PolarHBondContact O-N 3.3Å; S673-L677 WeakPolarHBondContact O-CG 3.18Å; S673-L677 PolarHBondContact O-N 2.82Å; S673-L677 VanDerWaalsContact O-N 3.13Å
674	S	87.7	Confident	84.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-40.5	174.7	-172.7	0	0	0	0	111.9	H661 S670 W671 R676 L677 G678	H661-S674 PolarHBondContact CE1-OG 2.91Å; H661-S674 VanDerWaalsContact CE1-OG 3.32Å; H661-S674 PolarHBondContact NE2-OG 3.26Å; S670-S674 PolarHBondContact O-N 2.96Å; W671-S674 CarbonylContact O-C 3.58Å; W671-S674 WeakPolarHBondContact O-CB 3.34Å; W671-S674 PolarHBondContact O-N 3.29Å; S674-R676 VanDerWaalsContact C-N 3.35Å; S674-R676 PolarHBondContact O-N 3.21Å; S674-L677 CarbonylContact O-C 3.53Å; S674-L677 WeakPolarHBondContact O-CB 3.23Å; S674-L677 PolarHBondContact O-N 3.31Å; S674-L677 VanDerWaalsContact O-N 3.14Å; S674-G678 PolarHBondContact O-N 3.14Å
675	A	85.9	Confident	84.2	Confident	15 Å²	15	64.8 Å²	64.8	12%	0.124	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-35.5	176.6	0	0	0	0	0	112.9	W671 S673 G678 L679 L688	W671-A675 WeakPolarHBondContact O-CB 3.4Å; W671-A675 PolarHBondContact O-N 2.94Å; S673-A675 VanDerWaalsContact C-N 3.35Å; S673-A675 PolarHBondContact O-N 3.01Å; A675-G678 WeakPolarHBondContact O-CA 3.32Å; A675-G678 PolarHBondContact O-N 2.69Å; A675-L679 WeakPolarHBondContact O-CG 3.36Å; A675-L679 PolarHBondContact O-N 2.95Å; A675-L688 VanDerWaalsContact CA-CD2 3.42Å; A675-L688 HydrophobicContact CB-CD2 3.78Å
676	R	86.9	Confident	83.7	Confident	175 Å²	175	60.4 Å²	60.4	66%	0.66	31%	0.309	S	S	*	.	H	α-helix	trans	-63.2	-42.3	171	-169.5	-178.8	-63	-179.6	1	111.7	W672 S673 S674 G678 L679 Q680	W672-R676 PolarHBondContact O-N 2.97Å; S673-R676 WeakPolarHBondContact O-CB 3.26Å; S673-R676 PolarHBondContact O-N 3.3Å; S674-R676 VanDerWaalsContact C-N 3.35Å; S674-R676 PolarHBondContact O-N 3.21Å; R676-G678 VanDerWaalsContact C-N 3.33Å; R676-L679 PolarHBondContact O-N 2.68Å; R676-Q680 WeakPolarHBondContact O-CG 3.34Å; R676-Q680 PolarHBondContact O-N 3.49Å; R676-Q680 VanDerWaalsContact O-N 3.08Å
677	L	87.9	Confident	83.2	Confident	31 Å²	31	57.6 Å²	57.6	16%	0.162	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-37.2	173.6	-60.6	179.8	0	0	0	111.3	L657 L660 L669 S673 S674 Q680 A681	L657-L677 HydrophobicContact CD1-CB 4.3Å; L660-L677 HydrophobicContact CB-CB 4.36Å; L660-L677 HydrophobicContact CB-CD1 4.35Å; L660-L677 HydrophobicContact CB-CD2 4.24Å; L660-L677 HydrophobicContact CD1-CB 4.38Å; L660-L677 HydrophobicContact CD1-CD2 4.49Å; L669-L677 HydrophobicContact CD1-CD1 3.84Å; S673-L677 WeakPolarHBondContact O-CG 3.18Å; S673-L677 PolarHBondContact O-N 2.82Å; S673-L677 VanDerWaalsContact O-N 3.13Å; S674-L677 CarbonylContact O-C 3.53Å; S674-L677 WeakPolarHBondContact O-CB 3.23Å; S674-L677 PolarHBondContact O-N 3.31Å; S674-L677 VanDerWaalsContact O-N 3.14Å; L677-Q680 WeakPolarHBondContact O-CB 3.29Å; L677-Q680 PolarHBondContact O-N 3.42Å; L677-A681 WeakPolarHBondContact O-CB 3.14Å; L677-A681 PolarHBondContact O-N 2.8Å
678	G	85.4	Confident	83.3	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-54	-53.5	170.7	0	0	0	0	0	112.7	S674 A675 R676 Q680 A681 G682 L683	S674-G678 PolarHBondContact O-N 3.14Å; A675-G678 WeakPolarHBondContact O-CA 3.32Å; A675-G678 PolarHBondContact O-N 2.69Å; R676-G678 VanDerWaalsContact C-N 3.33Å; G678-Q680 VanDerWaalsContact C-N 3.33Å; G678-Q680 PolarHBondContact O-N 2.95Å; G678-A681 CarbonylContact O-C 3.55Å; G678-A681 WeakPolarHBondContact O-CA 3.42Å; G678-A681 WeakPolarHBondContact O-CB 3.49Å; G678-A681 PolarHBondContact O-N 3.32Å; G678-G682 PolarHBondContact O-N 2.71Å; G678-G682 VanDerWaalsContact O-N 3.08Å; G678-L683 WeakPolarHBondContact O-CB 3.29Å; G678-L683 PolarHBondContact O-N 3.33Å
679	L	85.4	Confident	83.1	Confident	125 Å²	125	58.4 Å²	58.4	65%	0.654	30%	0.297	S	S	*	.	H	α-helix	trans	-61.3	-40.8	177.8	-71.9	167.9	0	0	0	112	A675 R676 A681 G682	A675-L679 WeakPolarHBondContact O-CG 3.36Å; A675-L679 PolarHBondContact O-N 2.95Å; R676-L679 PolarHBondContact O-N 2.68Å; L679-A681 PolarHBondContact O-N 3.26Å; L679-G682 PolarHBondContact O-N 2.91Å
680	Q	85.4	Confident	82.5	Confident	124 Å²	124	58 Å²	58	58%	0.579	30%	0.295	S	S	*	.	H	α-helix	trans	-62.5	-32.7	173.8	-73.4	178.2	-10	0	0	112.6	L660 R676 L677 G678 G682	L660-Q680 HydrophobicContact CD1-CB 4.14Å; R676-Q680 WeakPolarHBondContact O-CG 3.34Å; R676-Q680 PolarHBondContact O-N 3.49Å; R676-Q680 VanDerWaalsContact O-N 3.08Å; L677-Q680 WeakPolarHBondContact O-CB 3.29Å; L677-Q680 PolarHBondContact O-N 3.42Å; G678-Q680 VanDerWaalsContact C-N 3.33Å; G678-Q680 PolarHBondContact O-N 2.95Å; Q680-G682 VanDerWaalsContact C-N 3.28Å
681	A	82.8	Confident	82	Confident	12 Å²	12	56.4 Å²	56.4	10%	0.099	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-3.5	174.8	0	0	0	0	0	113.6	S653 M656 L657 L660 L677 G678 L679	S653-A681 VanDerWaalsContact CA-O 3.29Å; S653-A681 WeakPolarHBondContact CA-O 3.43Å; S653-A681 WeakPolarHBondContact CB-O 3.01Å; S653-A681 WeakPolarHBondContact O-CB 3.38Å; M656-A681 HydrophobicContact CB-CB 3.97Å; M656-A681 HydrophobicContact CG-CB 3.98Å; L657-A681 HydrophobicContact CB-CB 4.17Å; L660-A681 HydrophobicContact CD1-CB 4.4Å; L677-A681 WeakPolarHBondContact O-CB 3.14Å; L677-A681 PolarHBondContact O-N 2.8Å; G678-A681 CarbonylContact O-C 3.55Å; G678-A681 WeakPolarHBondContact O-CA 3.42Å; G678-A681 WeakPolarHBondContact O-CB 3.49Å; G678-A681 PolarHBondContact O-N 3.32Å; L679-A681 PolarHBondContact O-N 3.26Å
682	G	79.8	Confident	81.8	Confident	56 Å²	56	54.9 Å²	54.9	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	18.7	-178.5	0	0	0	0	0	114.7	G678 L679 Q680	G678-G682 PolarHBondContact O-N 2.71Å; G678-G682 VanDerWaalsContact O-N 3.08Å; L679-G682 PolarHBondContact O-N 2.91Å; Q680-G682 VanDerWaalsContact C-N 3.28Å
683	L	79.9	Confident	81.4	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.249	C	C	.	.			trans	-94.9	138.2	177.5	-64.3	169	0	0	0	111.5	S653 L657 G678 R687 A691	S653-L683 WeakPolarHBondContact OG-CD2 3.42Å; L657-L683 HydrophobicContact CB-CD1 4.06Å; L657-L683 HydrophobicContact CD1-CD1 4.31Å; L657-L683 HydrophobicContact CD2-CD1 3.76Å; L657-L683 HydrophobicContact CG-CD1 4.27Å; G678-L683 WeakPolarHBondContact O-CB 3.29Å; G678-L683 PolarHBondContact O-N 3.33Å; L683-R687 HydrophobicContact CD2-CB 3.99Å; L683-A691 HydrophobicContact CD1-CB 4.22Å
684	T	78.2	Confident	80.9	Confident	78 Å²	78	45.3 Å²	45.3	48%	0.479	24%	0.237	S	C	.	.			trans	-76.3	163.3	163.5	57.3	0	0	0	0	110.3	D686 R687 L688	T684-D686 PolarHBondContact O-N 3.31Å; T684-R687 PolarHBondContact O-N 3.03Å; T684-R687 VanDerWaalsContact OG1-CG 3.31Å; T684-R687 WeakPolarHBondContact OG1-CG 3.27Å; T684-L688 PolarHBondContact O-N 2.88Å
685	E	74	Confident	80.4	Confident	107 Å²	107	45.7 Å²	45.7	50%	0.5	24%	0.239	S	C	.	.	H	α-helix	trans	-56	-47.3	-179.4	-173.7	168.5	-164	0	0	112.4	W671 R687 L688 Q689	W671-E685 HydrophobicContact CZ2-CG 4.19Å; W671-E685 PolarHBondContact NE1-OE1 2.85Å; E685-R687 PolarHBondContact O-N 3.46Å; E685-L688 WeakPolarHBondContact O-CB 3.44Å; E685-L688 PolarHBondContact O-N 2.62Å; E685-Q689 PolarHBondContact O-N 2.76Å
686	D	66.8	Low	80.1	Confident	88 Å²	88	48 Å²	48	47%	0.471	25%	0.247	S	C	.	.	H	α-helix	trans	-60.8	-33.5	177.3	-61.3	-49.5	0	0	0	112.5	K390 Y394 T684	K390-D686 PolarHBondContact NZ-O 3.02Å; Y394-D686 HydrophobicContact CE1-CB 3.99Å; T684-D686 PolarHBondContact O-N 3.31Å
687	R	73.6	Confident	79.2	Confident	31 Å²	31	45.2 Å²	45.2	12%	0.117	24%	0.241	C	C	.	.	H	α-helix	trans	-80.4	-28.9	-179.8	-67.8	-173	69.9	-155.8	-2	112.6	E401 L683 T684 E685 Q689 S690 A691	E401-R687 IonicContact OE2-CZ 2.66Å; E401-R687 IonicContact OE2-NH1 3.49Å; E401-R687 PolarHBondContact OE2-NH1 3.45Å; E401-R687 IonicContact OE2-NH2 3.27Å; E401-R687 PolarHBondContact OE2-NH2 3.35Å; L683-R687 HydrophobicContact CD2-CB 3.99Å; T684-R687 PolarHBondContact O-N 3.03Å; T684-R687 VanDerWaalsContact OG1-CG 3.31Å; T684-R687 WeakPolarHBondContact OG1-CG 3.27Å; E685-R687 PolarHBondContact O-N 3.46Å; R687-Q689 VanDerWaalsContact C-N 3.29Å; R687-Q689 PolarHBondContact O-N 2.7Å; R687-S690 PolarHBondContact O-N 3.14Å; R687-A691 PolarHBondContact O-N 2.8Å
688	L	83.7	Confident	78.2	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-45.7	173	177.1	72.2	0	0	0	110.5	L657 W671 A675 T684 E685 S690 A691 L692	L657-L688 HydrophobicContact CD1-CD1 3.76Å; L657-L688 HydrophobicContact CD2-CD1 3.65Å; L657-L688 HydrophobicContact CG-CD1 4.34Å; W671-L688 HydrophobicContact CH2-CD2 3.96Å; W671-L688 HydrophobicContact CH2-CG 4.34Å; W671-L688 HydrophobicContact CZ2-CD2 4.03Å; W671-L688 HydrophobicContact CZ3-CD2 4.28Å; A675-L688 VanDerWaalsContact CA-CD2 3.42Å; A675-L688 HydrophobicContact CB-CD2 3.78Å; T684-L688 PolarHBondContact O-N 2.88Å; E685-L688 WeakPolarHBondContact O-CB 3.44Å; E685-L688 PolarHBondContact O-N 2.62Å; L688-S690 PolarHBondContact O-N 3.25Å; L688-A691 WeakPolarHBondContact O-CB 3.14Å; L688-A691 PolarHBondContact O-N 2.72Å; L688-A691 VanDerWaalsContact O-N 3.12Å; L688-L692 HydrophobicContact CD1-CD1 4.15Å; L688-L692 HydrophobicContact CD1-CG 4.17Å; L688-L692 HydrophobicContact CD2-CD1 4.25Å; L688-L692 HydrophobicContact CG-CD1 3.82Å; L688-L692 HydrophobicContact CG-CG 4.2Å; L688-L692 WeakPolarHBondContact O-CG 3.49Å; L688-L692 PolarHBondContact O-N 3.39Å
689	Q	81.3	Confident	77.4	Confident	60 Å²	60	46.4 Å²	46.4	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-57.2	-49.3	179.6	-168.9	178.8	-5.9	0	0	110.8	W671 E685 R687 A691 L692 S693 Y703 E705	W671-Q689 HydrophobicContact CH2-CB 3.98Å; W671-Q689 HydrophobicContact CH2-CG 4.41Å; E685-Q689 PolarHBondContact O-N 2.76Å; R687-Q689 VanDerWaalsContact C-N 3.29Å; R687-Q689 PolarHBondContact O-N 2.7Å; Q689-A691 VanDerWaalsContact C-N 3.29Å; Q689-A691 PolarHBondContact O-N 3.1Å; Q689-L692 PolarHBondContact O-N 2.84Å; Q689-L692 VanDerWaalsContact O-N 3.1Å; Q689-S693 PolarHBondContact O-N 3.3Å; Q689-S693 PolarHBondContact O-OG 3.42Å; Q689-Y703 HydrophobicContact CG-CE1 4.29Å; Q689-E705 PolarHBondContact NE2-OE2 3.2Å
690	S	76.6	Confident	76.9	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-37.8	177.6	-67.9	0	0	0	0	113	E386 K390 W654 R687 L688 Y694	E386-S690 PolarHBondContact O-OG 2.78Å; K390-S690 VanDerWaalsContact CD-OG 3.25Å; K390-S690 WeakPolarHBondContact CD-OG 3.21Å; K390-S690 WeakPolarHBondContact CE-OG 3.4Å; K390-S690 PolarHBondContact NZ-OG 2.94Å; W654-S690 WeakPolarHBondContact CH2-O 3.29Å; R687-S690 PolarHBondContact O-N 3.14Å; L688-S690 PolarHBondContact O-N 3.25Å; S690-Y694 WeakPolarHBondContact O-CB 3.41Å; S690-Y694 PolarHBondContact O-N 2.91Å
691	A	79.2	Confident	76.8	Confident	1 Å²	1	36 Å²	36	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-65.9	-41.5	176.6	0	0	0	0	0	111.2	W654 L657 L683 R687 L688 Q689 Y694 L695	W654-A691 HydrophobicContact CD2-CB 3.66Å; W654-A691 HydrophobicContact CE3-CB 4.09Å; W654-A691 HydrophobicContact CG-CB 4.03Å; W654-A691 HydrophobicContact CH2-CB 4.38Å; W654-A691 HydrophobicContact CZ2-CB 3.97Å; W654-A691 HydrophobicContact CZ3-CB 4.45Å; L657-A691 HydrophobicContact CD2-CB 3.73Å; L683-A691 HydrophobicContact CD1-CB 4.22Å; R687-A691 PolarHBondContact O-N 2.8Å; L688-A691 WeakPolarHBondContact O-CB 3.14Å; L688-A691 PolarHBondContact O-N 2.72Å; L688-A691 VanDerWaalsContact O-N 3.12Å; Q689-A691 VanDerWaalsContact C-N 3.29Å; Q689-A691 PolarHBondContact O-N 3.1Å; A691-Y694 PolarHBondContact O-N 3.48Å; A691-L695 WeakPolarHBondContact O-CB 3.46Å; A691-L695 VanDerWaalsContact O-CG 3.22Å; A691-L695 WeakPolarHBondContact O-CG 3.29Å; A691-L695 PolarHBondContact O-N 3.1Å
692	L	82.6	Confident	76.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.6	-41.1	176.5	-69	174.7	0	0	0	112.2	W671 L688 Q689 Y694 L695 H696 L701 Y703 V714	W671-L692 HydrophobicContact CE3-CD1 4.2Å; W671-L692 HydrophobicContact CH2-CD1 4.26Å; W671-L692 HydrophobicContact CZ3-CD1 3.52Å; L688-L692 HydrophobicContact CD1-CD1 4.15Å; L688-L692 HydrophobicContact CD1-CG 4.17Å; L688-L692 HydrophobicContact CD2-CD1 4.25Å; L688-L692 HydrophobicContact CG-CD1 3.82Å; L688-L692 HydrophobicContact CG-CG 4.2Å; L688-L692 WeakPolarHBondContact O-CG 3.49Å; L688-L692 PolarHBondContact O-N 3.39Å; Q689-L692 PolarHBondContact O-N 2.84Å; Q689-L692 VanDerWaalsContact O-N 3.1Å; L692-Y694 VanDerWaalsContact C-N 3.31Å; L692-Y694 PolarHBondContact O-N 3.36Å; L692-L695 PolarHBondContact O-N 2.96Å; L692-H696 VanDerWaalsContact O-CB 3.31Å; L692-H696 WeakPolarHBondContact O-CB 3.39Å; L692-H696 PolarHBondContact O-N 3.19Å; L692-L701 HydrophobicContact CD2-CD2 3.88Å; L692-Y703 HydrophobicContact CB-CD1 3.89Å; L692-Y703 HydrophobicContact CB-CE1 4.27Å; L692-Y703 HydrophobicContact CB-CG 4.24Å; L692-V714 HydrophobicContact CD1-CG2 3.91Å; L692-V714 HydrophobicContact CD2-CG1 3.96Å; L692-V714 HydrophobicContact CD2-CG2 4.32Å
693	S	78.1	Confident	77.1	Confident	14 Å²	14	35.1 Å²	35.1	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-57.3	-46.4	172.8	-40	0	0	0	0	110.3	Q689 H696 E697 E705	Q689-S693 PolarHBondContact O-N 3.3Å; Q689-S693 PolarHBondContact O-OG 3.42Å; S693-H696 WeakPolarHBondContact O-CB 3.47Å; S693-H696 PolarHBondContact O-N 2.96Å; S693-E697 WeakPolarHBondContact O-CG 3.33Å; S693-E697 PolarHBondContact O-N 2.63Å; S693-E705 WeakPolarHBondContact CB-OE1 3.36Å; S693-E705 PolarHBondContact OG-OE1 3.32Å
694	Y	76.9	Confident	77.2	Confident	25 Å²	25	36.9 Å²	36.9	10%	0.098	19%	0.189	C	C	.	.	H	α-helix	trans	-63.9	-43.2	176.4	170.4	-96.8	0	0	0	113.2	E386 L650 W654 S690 A691 L692 H696 E697 S698	E386-Y694 WeakPolarHBondContact OE1-CA 3.21Å; L650-Y694 HydrophobicContact CD1-CE1 3.6Å; L650-Y694 HydrophobicContact CD2-CD1 4.35Å; L650-Y694 HydrophobicContact CD2-CE1 3.74Å; L650-Y694 HydrophobicContact CD2-CE2 4.25Å; L650-Y694 HydrophobicContact CG-CE1 4.31Å; W654-Y694 AromaticContact CE3-CD1 3.8Å; W654-Y694 HydrophobicContact CE3-CD1 3.8Å; W654-Y694 HydrophobicContact CE3-CG 4.09Å; W654-Y694 AromaticContact CZ3-CD1 3.78Å; W654-Y694 HydrophobicContact CZ3-CD1 3.78Å; W654-Y694 HydrophobicContact CZ3-CD2 4.33Å; W654-Y694 AromaticContact CZ3-CG 3.56Å; W654-Y694 HydrophobicContact CZ3-CG 3.56Å; S690-Y694 WeakPolarHBondContact O-CB 3.41Å; S690-Y694 PolarHBondContact O-N 2.91Å; A691-Y694 PolarHBondContact O-N 3.48Å; L692-Y694 VanDerWaalsContact C-N 3.31Å; L692-Y694 PolarHBondContact O-N 3.36Å; Y694-H696 PolarHBondContact O-N 2.97Å; Y694-E697 PolarHBondContact O-N 3.49Å; Y694-S698 WeakPolarHBondContact O-CB 3.31Å; Y694-S698 PolarHBondContact O-N 3.08Å; Y694-S698 PolarHBondContact O-OG 2.9Å
695	L	78	Confident	77.2	Confident	7 Å²	7	37 Å²	37	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-29.6	176.2	-69.6	172	0	0	0	111.7	L657 E658 A691 L692 S698 G699 K700 L701	L657-L695 HydrophobicContact CD2-CD1 4.33Å; E658-L695 HydrophobicContact CB-CD2 4.42Å; E658-L695 HydrophobicContact CG-CD2 4.3Å; A691-L695 WeakPolarHBondContact O-CB 3.46Å; A691-L695 VanDerWaalsContact O-CG 3.22Å; A691-L695 WeakPolarHBondContact O-CG 3.29Å; A691-L695 PolarHBondContact O-N 3.1Å; L692-L695 PolarHBondContact O-N 2.96Å; L695-S698 WeakPolarHBondContact CA-OG 3.42Å; L695-S698 PolarHBondContact O-OG 3.43Å; L695-G699 PolarHBondContact O-N 2.86Å; L695-K700 HydrophobicContact CD2-CB 4.39Å; L695-K700 HydrophobicContact CD2-CD 3.86Å; L695-K700 PolarHBondContact O-N 2.93Å; L695-L701 HydrophobicContact CB-CD1 4.27Å; L695-L701 HydrophobicContact CB-CD2 3.65Å; L695-L701 HydrophobicContact CB-CG 3.7Å; L695-L701 HydrophobicContact CD1-CD2 3.86Å; L695-L701 HydrophobicContact CG-CD2 4.4Å; L695-L701 PolarHBondContact O-N 3.1Å
696	H	79.7	Confident	77.1	Confident	65 Å²	65	39.5 Å²	39.5	30%	0.301	20%	0.201	S	C	.	.	H	α-helix	trans	-70.2	-49.8	171.6	178.9	56.3	0	0	0	112.1	L692 S693 Y694 S698 G699 L701 Y703	L692-H696 VanDerWaalsContact O-CB 3.31Å; L692-H696 WeakPolarHBondContact O-CB 3.39Å; L692-H696 PolarHBondContact O-N 3.19Å; S693-H696 WeakPolarHBondContact O-CB 3.47Å; S693-H696 PolarHBondContact O-N 2.96Å; Y694-H696 PolarHBondContact O-N 2.97Å; H696-S698 VanDerWaalsContact C-N 3.32Å; H696-S698 PolarHBondContact O-N 2.83Å; H696-G699 WeakPolarHBondContact O-CA 3.36Å; H696-G699 PolarHBondContact O-N 3.17Å; H696-L701 WeakPolarHBondContact CA-O 3.42Å; H696-L701 HydrophobicContact CB-CD1 4.12Å; H696-L701 PolarHBondContact ND1-O 3.14Å; H696-Y703 PolarHBondContact CD2-O 2.76Å; H696-Y703 PolarHBondContact ND1-N 2.79Å
697	E	68.3	Low	77.5	Confident	116 Å²	116	36 Å²	36	54%	0.542	18%	0.184	S	C	.	.	H	α-helix	trans	-62.6	-36.8	177.8	-73.5	-169.2	-168.7	0	0	112.5	S693 Y694 G699	S693-E697 WeakPolarHBondContact O-CG 3.33Å; S693-E697 PolarHBondContact O-N 2.63Å; Y694-E697 PolarHBondContact O-N 3.49Å; E697-G699 PolarHBondContact O-N 3.39Å
698	S	67.2	Low	77.6	Confident	40 Å²	40	41.3 Å²	41.3	28%	0.28	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.7	173.3	59.5	0	0	0	0	113.7	Y694 L695 H696 K700	Y694-S698 WeakPolarHBondContact O-CB 3.31Å; Y694-S698 PolarHBondContact O-N 3.08Å; Y694-S698 PolarHBondContact O-OG 2.9Å; L695-S698 WeakPolarHBondContact CA-OG 3.42Å; L695-S698 PolarHBondContact O-OG 3.43Å; H696-S698 VanDerWaalsContact C-N 3.32Å; H696-S698 PolarHBondContact O-N 2.83Å; S698-K700 VanDerWaalsContact C-N 3.34Å; S698-K700 PolarHBondContact O-N 3.36Å
699	G	68.1	Low	77.3	Confident	17 Å²	17	44 Å²	44	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	21	175.5	0	0	0	0	0	114.6	L695 H696 E697 L718	L695-G699 PolarHBondContact O-N 2.86Å; H696-G699 WeakPolarHBondContact O-CA 3.36Å; H696-G699 PolarHBondContact O-N 3.17Å; E697-G699 PolarHBondContact O-N 3.39Å; G699-L718 WeakPolarHBondContact O-CD1 3.06Å
700	K	75.1	Confident	77.4	Confident	27 Å²	27	41.1 Å²	41.1	12%	0.117	22%	0.216	C	C	.	.	S	Bend	trans	-81.5	-29.7	176.2	-67.1	-169.9	-178	-172.1	0	112.5	E658 F662 L695 S698 L718	E658-K700 HydrophobicContact CG-CD 4.45Å; E658-K700 WeakPolarHBondContact OE1-CD 3.08Å; E658-K700 WeakPolarHBondContact OE1-CE 3.5Å; E658-K700 IonicContact OE1-NZ 3.06Å; E658-K700 PolarHBondContact OE1-NZ 3.29Å; E658-K700 IonicContact OE2-NZ 2.99Å; E658-K700 PolarHBondContact OE2-NZ 3.09Å; F662-K700 HydrophobicContact CZ-CB 4.25Å; L695-K700 HydrophobicContact CD2-CB 4.39Å; L695-K700 HydrophobicContact CD2-CD 3.86Å; L695-K700 PolarHBondContact O-N 2.93Å; S698-K700 VanDerWaalsContact C-N 3.34Å; S698-K700 PolarHBondContact O-N 3.36Å; K700-L718 VanDerWaalsContact O-CD1 3.28Å; K700-L718 WeakPolarHBondContact O-CD1 3.25Å
701	L	84	Confident	77.8	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.234	C	C	.	.	S	Bend	trans	-144.1	171	175.5	61	77.7	0	0	0	111.3	L692 L695 H696 V714 F715 H716	L692-L701 HydrophobicContact CD2-CD2 3.88Å; L695-L701 HydrophobicContact CB-CD1 4.27Å; L695-L701 HydrophobicContact CB-CD2 3.65Å; L695-L701 HydrophobicContact CB-CG 3.7Å; L695-L701 HydrophobicContact CD1-CD2 3.86Å; L695-L701 HydrophobicContact CG-CD2 4.4Å; L695-L701 PolarHBondContact O-N 3.1Å; H696-L701 WeakPolarHBondContact CA-O 3.42Å; H696-L701 HydrophobicContact CB-CD1 4.12Å; H696-L701 PolarHBondContact ND1-O 3.14Å; L701-V714 HydrophobicContact CD1-CG1 4.12Å; L701-V714 HydrophobicContact CD2-CG1 3.88Å; L701-V714 HydrophobicContact CG-CG1 4.45Å; L701-F715 WeakPolarHBondContact CA-O 3.27Å; L701-F715 WeakPolarHBondContact CB-O 3.48Å; L701-H716 HydrophobicContact CB-CB 4.48Å
702	L	83.8	Confident	78.1	Confident	36 Å²	36	50.4 Å²	50.4	19%	0.188	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.4	168.9	-48.7	169.1	0	0	0	110.3	F704 F715 L718 F721 L807	L702-F704 HydrophobicContact CB-CE2 3.81Å; L702-F704 HydrophobicContact CB-CZ 4.13Å; L702-F715 HydrophobicContact CB-CB 4.06Å; L702-F715 HydrophobicContact CB-CD2 4.42Å; L702-F715 PolarHBondContact N-O 3.24Å; L702-F715 PolarHBondContact O-N 2.64Å; L702-L718 HydrophobicContact CD1-CD2 4.15Å; L702-L718 HydrophobicContact CD2-CD2 4.38Å; L702-L718 HydrophobicContact CG-CD2 3.78Å; L702-F721 HydrophobicContact CD1-CD1 4.14Å; L702-F721 HydrophobicContact CD1-CE1 4Å; L702-L807 HydrophobicContact CD1-CD2 4.43Å
703	Y	85.1	Confident	78.4	Confident	13 Å²	13	52.2 Å²	52.2	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.1	175.4	179.5	-120.4	0	0	0	108.7	W671 Q689 L692 H696 E705 K711 V714	W671-Y703 HydrophobicContact CE3-CE2 4.01Å; W671-Y703 HydrophobicContact CZ3-CE1 4.35Å; W671-Y703 AromaticContact CZ3-CE2 3.89Å; W671-Y703 HydrophobicContact CZ3-CE2 3.89Å; W671-Y703 AromaticContact CZ3-CZ 3.54Å; W671-Y703 WeakPolarHBondContact CZ3-OH 3.19Å; Q689-Y703 HydrophobicContact CG-CE1 4.29Å; L692-Y703 HydrophobicContact CB-CD1 3.89Å; L692-Y703 HydrophobicContact CB-CE1 4.27Å; L692-Y703 HydrophobicContact CB-CG 4.24Å; H696-Y703 PolarHBondContact CD2-O 2.76Å; H696-Y703 PolarHBondContact ND1-N 2.79Å; Y703-E705 HydrophobicContact CD1-CG 3.8Å; Y703-E705 HydrophobicContact CE1-CG 3.26Å; Y703-K711 WeakPolarHBondContact CE2-O 3.47Å; Y703-V714 HydrophobicContact CD2-CG2 3.91Å; Y703-V714 HydrophobicContact CE2-CG2 4.33Å
704	F	82.1	Confident	78.8	Confident	41 Å²	41	51.5 Å²	51.5	18%	0.18	26%	0.26	C	S	.	.			trans	-123.3	90.3	-169.7	-63.3	-84	0	0	0	111.1	L702 D706 S707 L710 K711 F715 L807	L702-F704 HydrophobicContact CB-CE2 3.81Å; L702-F704 HydrophobicContact CB-CZ 4.13Å; F704-D706 PolarHBondContact O-N 3.08Å; F704-S707 PolarHBondContact O-N 3.09Å; F704-L710 HydrophobicContact CB-CB 3.88Å; F704-L710 HydrophobicContact CD2-CB 4.02Å; F704-L710 HydrophobicContact CD2-CD1 3.97Å; F704-L710 HydrophobicContact CE2-CD1 4.35Å; F704-L710 HydrophobicContact CG-CB 4.24Å; F704-L710 HydrophobicContact CG-CD1 4.2Å; F704-K711 VanDerWaalsContact O-CA 3.24Å; F704-K711 WeakPolarHBondContact O-CA 3.38Å; F704-K711 WeakPolarHBondContact O-CB 3.39Å; F704-K711 PolarHBondContact O-N 3.19Å; F704-F715 HydrophobicContact CD2-CE2 4.43Å; F704-F715 HydrophobicContact CE2-CD2 4.27Å; F704-F715 HydrophobicContact CE2-CE2 4.35Å; F704-L807 HydrophobicContact CD2-CD1 4.45Å; F704-L807 HydrophobicContact CE2-CD1 3.38Å; F704-L807 HydrophobicContact CZ-CD1 3.41Å; F704-L807 VanDerWaalsContact CZ-CD1 3.41Å
705	E	76.3	Confident	79.3	Confident	79 Å²	79	50.5 Å²	50.5	37%	0.369	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-38.8	-178	-67.2	-178.2	-147.9	0	0	112.9	Q689 S693 Y703 S707	Q689-E705 PolarHBondContact NE2-OE2 3.2Å; S693-E705 WeakPolarHBondContact CB-OE1 3.36Å; S693-E705 PolarHBondContact OG-OE1 3.32Å; Y703-E705 HydrophobicContact CD1-CG 3.8Å; Y703-E705 HydrophobicContact CE1-CG 3.26Å; E705-S707 VanDerWaalsContact C-N 3.25Å; E705-S707 PolarHBondContact O-N 3.24Å
706	D	72.4	Confident	79.6	Confident	161 Å²	161	50.3 Å²	50.3	86%	0.861	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-3	-175.4	-56.5	-40	0	0	0	113.9	F704	F704-D706 PolarHBondContact O-N 3.08Å
707	S	75.6	Confident	79.8	Confident	15 Å²	15	48.9 Å²	48.9	11%	0.105	25%	0.249	C	C	.	.			trans	-97.6	121.4	-178.9	178.6	0	0	0	0	110.7	F704 E705 T709 L710 K711	F704-S707 PolarHBondContact O-N 3.09Å; E705-S707 VanDerWaalsContact C-N 3.25Å; E705-S707 PolarHBondContact O-N 3.24Å; S707-T709 PolarHBondContact O-N 3.12Å; S707-T709 VanDerWaalsContact O-N 3.15Å; S707-T709 PolarHBondContact OG-OG1 2.87Å; S707-L710 WeakPolarHBondContact OG-CB 3.39Å; S707-L710 PolarHBondContact OG-N 2.78Å; S707-K711 WeakPolarHBondContact O-CB 3.28Å; S707-K711 WeakPolarHBondContact O-CG 3.36Å; S707-K711 PolarHBondContact O-N 3.47Å
708	I	75.8	Confident	80.5	Confident	142 Å²	142	44.3 Å²	44.3	73%	0.728	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.6	178.7	-61.7	165.9	0	0	0	111.7	K711	I708-K711 WeakPolarHBondContact O-CE 3.2Å
709	T	77.3	Confident	81.2	Confident	57 Å²	57	46.1 Å²	46.1	35%	0.35	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-45.2	-176.2	45.8	0	0	0	0	112.8	S707 Y713 E806	S707-T709 PolarHBondContact O-N 3.12Å; S707-T709 VanDerWaalsContact O-N 3.15Å; S707-T709 PolarHBondContact OG-OG1 2.87Å; T709-Y713 WeakPolarHBondContact O-CD2 3.4Å; T709-E806 WeakPolarHBondContact CB-OE1 3.47Å; T709-E806 WeakPolarHBondContact CB-OE2 3.3Å; T709-E806 WeakPolarHBondContact CG2-OE1 3.46Å; T709-E806 PolarHBondContact OG1-OE1 2.82Å; T709-E806 PolarHBondContact OG1-OE2 3.37Å
710	L	83.7	Confident	82	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-79.2	-16.7	-175.8	-59.3	173.4	0	0	0	113.5	F704 S707 E712 Y713 F715 E806 L807 K810	F704-L710 HydrophobicContact CB-CB 3.88Å; F704-L710 HydrophobicContact CD2-CB 4.02Å; F704-L710 HydrophobicContact CD2-CD1 3.97Å; F704-L710 HydrophobicContact CE2-CD1 4.35Å; F704-L710 HydrophobicContact CG-CB 4.24Å; F704-L710 HydrophobicContact CG-CD1 4.2Å; S707-L710 WeakPolarHBondContact OG-CB 3.39Å; S707-L710 PolarHBondContact OG-N 2.78Å; L710-E712 PolarHBondContact O-N 2.88Å; L710-E712 VanDerWaalsContact O-N 3.12Å; L710-Y713 PolarHBondContact O-N 3.1Å; L710-Y713 VanDerWaalsContact O-O 3.1Å; L710-F715 HydrophobicContact CD2-CE2 4.14Å; L710-F715 HydrophobicContact CD2-CZ 4.07Å; L710-E806 HydrophobicContact CD2-CB 4.45Å; L710-E806 HydrophobicContact CD2-CG 4.1Å; L710-E806 HydrophobicContact CG-CG 4.3Å; L710-L807 HydrophobicContact CD1-CD1 4.4Å; L710-K810 HydrophobicContact CD1-CB 4.19Å; L710-K810 HydrophobicContact CD1-CG 4.33Å
711	K	84.4	Confident	82.6	Confident	94 Å²	94	46.6 Å²	46.6	41%	0.409	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-59.8	-21.7	176.6	68.7	-177.6	-176.3	173.9	0	113.9	Y703 F704 S707 I708 Y713	Y703-K711 WeakPolarHBondContact CE2-O 3.47Å; F704-K711 VanDerWaalsContact O-CA 3.24Å; F704-K711 WeakPolarHBondContact O-CA 3.38Å; F704-K711 WeakPolarHBondContact O-CB 3.39Å; F704-K711 PolarHBondContact O-N 3.19Å; S707-K711 WeakPolarHBondContact O-CB 3.28Å; S707-K711 WeakPolarHBondContact O-CG 3.36Å; S707-K711 PolarHBondContact O-N 3.47Å; I708-K711 WeakPolarHBondContact O-CE 3.2Å; K711-Y713 VanDerWaalsContact C-N 3.25Å; K711-Y713 PolarHBondContact O-N 3.14Å
712	E	86	Confident	82.6	Confident	105 Å²	105	46.7 Å²	46.7	49%	0.491	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-83.4	-0.3	179.1	-61.3	-170.3	170.5	0	0	112.9	S670 W671 L710	S670-E712 CarbonylContact C-O 3.54Å; S670-E712 WeakPolarHBondContact CA-O 2.88Å; W671-E712 PolarHBondContact N-O 3.42Å; L710-E712 PolarHBondContact O-N 2.88Å; L710-E712 VanDerWaalsContact O-N 3.12Å
713	Y	88.3	Confident	82.7	Confident	38 Å²	38	46.2 Å²	46.2	15%	0.149	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.9	-172	-56.8	-77.2	0	0	0	112.3	W668 L669 T709 L710 K711 Q799 L803	W668-Y713 HydrophobicContact CD2-CD1 4.05Å; W668-Y713 AromaticContact CE3-CD1 3.3Å; W668-Y713 HydrophobicContact CE3-CD1 3.3Å; W668-Y713 AromaticContact CE3-CE1 3.84Å; W668-Y713 HydrophobicContact CE3-CE1 3.84Å; W668-Y713 HydrophobicContact CE3-CG 4.34Å; W668-Y713 HydrophobicContact CH2-CD1 4.02Å; W668-Y713 AromaticContact CH2-CE1 3.64Å; W668-Y713 HydrophobicContact CH2-CE1 3.64Å; W668-Y713 HydrophobicContact CZ2-CE1 4.43Å; W668-Y713 AromaticContact CZ3-CD1 3.29Å; W668-Y713 HydrophobicContact CZ3-CD1 3.29Å; W668-Y713 AromaticContact CZ3-CE1 3.31Å; W668-Y713 HydrophobicContact CZ3-CE1 3.31Å; L669-Y713 CarbonylContact O-C 3.6Å; L669-Y713 WeakPolarHBondContact O-CA 2.92Å; T709-Y713 WeakPolarHBondContact O-CD2 3.4Å; L710-Y713 PolarHBondContact O-N 3.1Å; L710-Y713 VanDerWaalsContact O-O 3.1Å; K711-Y713 VanDerWaalsContact C-N 3.25Å; K711-Y713 PolarHBondContact O-N 3.14Å; Y713-Q799 PolarHBondContact OH-NE2 3.2Å; Y713-L803 HydrophobicContact CD1-CD1 3.93Å; Y713-L803 HydrophobicContact CD2-CD1 4.45Å; Y713-L803 HydrophobicContact CD2-CD2 3.61Å; Y713-L803 HydrophobicContact CE1-CD1 3.81Å; Y713-L803 HydrophobicContact CE1-CD2 4.39Å; Y713-L803 HydrophobicContact CE2-CD1 4.38Å; Y713-L803 HydrophobicContact CE2-CD2 3.47Å; Y713-L803 VanDerWaalsContact CE2-CD2 3.47Å; Y713-L803 HydrophobicContact CG-CD1 4.22Å; Y713-L803 HydrophobicContact CG-CD2 4.15Å
714	V	87.4	Confident	82.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.4	178.5	-178.4	0	0	0	0	108.9	W668 L669 L692 L701 Y703 H716	W668-V714 CarbonylContact C-O 3.58Å; W668-V714 VanDerWaalsContact CA-O 3.31Å; W668-V714 WeakPolarHBondContact CA-O 3.33Å; L669-V714 PolarHBondContact N-O 2.78Å; L669-V714 PolarHBondContact O-N 2.8Å; L692-V714 HydrophobicContact CD1-CG2 3.91Å; L692-V714 HydrophobicContact CD2-CG1 3.96Å; L692-V714 HydrophobicContact CD2-CG2 4.32Å; L701-V714 HydrophobicContact CD1-CG1 4.12Å; L701-V714 HydrophobicContact CD2-CG1 3.88Å; L701-V714 HydrophobicContact CG-CG1 4.45Å; Y703-V714 HydrophobicContact CD2-CG2 3.91Å; Y703-V714 HydrophobicContact CE2-CG2 4.33Å; V714-H716 PolarHBondContact O-N 2.85Å
715	F	86.6	Confident	83.1	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	89.3	179.6	-59.3	-93	0	0	0	110	W668 L701 L702 F704 L710 L807	W668-F715 HydrophobicContact CB-CD1 3.82Å; W668-F715 HydrophobicContact CB-CE1 4.1Å; W668-F715 HydrophobicContact CB-CG 4.34Å; W668-F715 HydrophobicContact CG-CE1 4.43Å; L701-F715 WeakPolarHBondContact CA-O 3.27Å; L701-F715 WeakPolarHBondContact CB-O 3.48Å; L702-F715 HydrophobicContact CB-CB 4.06Å; L702-F715 HydrophobicContact CB-CD2 4.42Å; L702-F715 PolarHBondContact N-O 3.24Å; L702-F715 PolarHBondContact O-N 2.64Å; F704-F715 HydrophobicContact CD2-CE2 4.43Å; F704-F715 HydrophobicContact CE2-CD2 4.27Å; F704-F715 HydrophobicContact CE2-CE2 4.35Å; L710-F715 HydrophobicContact CD2-CE2 4.14Å; L710-F715 HydrophobicContact CD2-CZ 4.07Å; F715-L807 HydrophobicContact CD1-CD2 4.1Å; F715-L807 HydrophobicContact CE1-CD2 3.98Å; F715-L807 HydrophobicContact CE2-CD2 4.39Å; F715-L807 HydrophobicContact CG-CD2 4.37Å; F715-L807 HydrophobicContact CZ-CD2 4.13Å
716	H	84.1	Confident	83.6	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.014	21%	0.213	C	C	.	.			trans	-86.6	-22.8	-178.9	69.7	91.7	0	0	0	113.5	H661 S664 D666 L701 V714 L718	H661-H716 HydrophobicContact CB-CB 4.34Å; H661-H716 PolarHBondContact O-CE1 3.45Å; H661-H716 PolarHBondContact O-ND1 2.87Å; S664-H716 PolarHBondContact O-CE1 3.24Å; D666-H716 PolarHBondContact O-CE1 3.01Å; D666-H716 PolarHBondContact O-NE2 3.45Å; L701-H716 HydrophobicContact CB-CB 4.48Å; V714-H716 PolarHBondContact O-N 2.85Å; H716-L718 PolarHBondContact O-N 3.17Å
717	N	85.3	Confident	84.2	Confident	34 Å²	34	33 Å²	33	18%	0.182	17%	0.172	C	C	.	.			trans	-92.9	69.4	-175.1	-164	-20.3	0	0	0	112.5	D666 P719 R720 F721	D666-N717 VanDerWaalsContact O-CB 3.31Å; D666-N717 WeakPolarHBondContact O-CB 2.99Å; D666-N717 PolarHBondContact O-ND2 2.9Å; D666-N717 VanDerWaalsContact O-ND2 3.16Å; N717-P719 VanDerWaalsContact C-CD 3.48Å; N717-R720 HydrophobicContact CB-CB 4.37Å; N717-R720 PolarHBondContact O-N 3.17Å; N717-R720 WeakPolarHBondContact OD1-CB 3.46Å; N717-R720 PolarHBondContact OD1-N 2.88Å; N717-F721 PolarHBondContact O-N 3.41Å; N717-F721 VanDerWaalsContact O-N 3.14Å
718	L	81.8	Confident	84.5	Confident	21 Å²	21	32.4 Å²	32.4	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-57	-39.4	179.1	-60.6	-179.3	0	0	0	114.2	G699 K700 L702 H716 R720 F721 I722	G699-L718 WeakPolarHBondContact O-CD1 3.06Å; K700-L718 VanDerWaalsContact O-CD1 3.28Å; K700-L718 WeakPolarHBondContact O-CD1 3.25Å; L702-L718 HydrophobicContact CD1-CD2 4.15Å; L702-L718 HydrophobicContact CD2-CD2 4.38Å; L702-L718 HydrophobicContact CG-CD2 3.78Å; H716-L718 PolarHBondContact O-N 3.17Å; L718-R720 PolarHBondContact O-N 3.08Å; L718-F721 WeakPolarHBondContact O-CB 3.46Å; L718-F721 PolarHBondContact O-N 3.26Å; L718-I722 VanDerWaalsContact O-CG1 3.28Å; L718-I722 WeakPolarHBondContact O-CG1 3.2Å; L718-I722 PolarHBondContact O-N 3.15Å
719	P	83.3	Confident	84.9	Confident	78 Å²	78	25.7 Å²	25.7	51%	0.506	13%	0.132	S	C	.	.	H	α-helix	trans	-60.8	-42.9	178	-25.7	36.1	0	0	0	113.3	N717 F721 I722 A723	N717-P719 VanDerWaalsContact C-CD 3.48Å; P719-F721 VanDerWaalsContact C-N 3.33Å; P719-I722 PolarHBondContact O-N 3.23Å; P719-A723 PolarHBondContact O-N 2.8Å
720	R	84.2	Confident	84.9	Confident	45 Å²	45	25 Å²	25	17%	0.17	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-38.6	176.1	-166.9	175.5	176.3	160.9	3.5	110.9	K665 L667 N717 L718 A723 I724 H794 E796	K665-R720 PolarHBondContact O-NH1 3.33Å; L667-R720 HydrophobicContact CD1-CB 3.93Å; L667-R720 HydrophobicContact CD1-CG 3.74Å; N717-R720 HydrophobicContact CB-CB 4.37Å; N717-R720 PolarHBondContact O-N 3.17Å; N717-R720 WeakPolarHBondContact OD1-CB 3.46Å; N717-R720 PolarHBondContact OD1-N 2.88Å; L718-R720 PolarHBondContact O-N 3.08Å; R720-A723 WeakPolarHBondContact O-CB 3.31Å; R720-A723 PolarHBondContact O-N 2.89Å; R720-I724 WeakPolarHBondContact O-CG1 3.33Å; R720-I724 PolarHBondContact O-N 3.28Å; R720-I724 VanDerWaalsContact O-N 3.16Å; R720-H794 HydrophobicContact CG-CB 4.5Å; R720-H794 VanDerWaalsContact CZ-O 3.22Å; R720-H794 PolarHBondContact NE-O 2.76Å; R720-H794 PolarHBondContact NH2-O 2.64Å; R720-E796 IonicContact CZ-OE1 3.68Å; R720-E796 IonicContact NH1-OE1 3.55Å; R720-E796 PolarHBondContact NH1-OE1 3.46Å; R720-E796 IonicContact NH2-OE1 3.95Å; R720-E796 PolarHBondContact NH2-OE1 3.06Å
721	F	86.6	Confident	84.5	Confident	8 Å²	8	29 Å²	29	4%	0.035	14%	0.141	C	C	.	.	H	α-helix	trans	-64.1	-42.7	173.9	-179.3	-118.8	0	0	0	113.2	L702 N717 L718 P719 A723 I724 L725 I804 L807 M811	L702-F721 HydrophobicContact CD1-CD1 4.14Å; L702-F721 HydrophobicContact CD1-CE1 4Å; N717-F721 PolarHBondContact O-N 3.41Å; N717-F721 VanDerWaalsContact O-N 3.14Å; L718-F721 WeakPolarHBondContact O-CB 3.46Å; L718-F721 PolarHBondContact O-N 3.26Å; P719-F721 VanDerWaalsContact C-N 3.33Å; F721-A723 VanDerWaalsContact C-N 3.3Å; F721-A723 PolarHBondContact O-N 2.99Å; F721-I724 WeakPolarHBondContact O-CB 3.45Å; F721-I724 PolarHBondContact O-N 2.86Å; F721-L725 HydrophobicContact CD1-CD1 4.19Å; F721-L725 HydrophobicContact CE1-CD1 3.69Å; F721-L725 HydrophobicContact CE1-CG 4.27Å; F721-L725 HydrophobicContact CE2-CG 4.42Å; F721-L725 HydrophobicContact CZ-CD1 3.96Å; F721-L725 HydrophobicContact CZ-CD2 4.18Å; F721-L725 HydrophobicContact CZ-CG 4.1Å; F721-L725 PolarHBondContact O-N 3.46Å; F721-I804 HydrophobicContact CD2-CD1 3.85Å; F721-I804 HydrophobicContact CE2-CD1 4.13Å; F721-L807 HydrophobicContact CD2-CD2 3.98Å; F721-L807 HydrophobicContact CE1-CD2 4.31Å; F721-L807 HydrophobicContact CE2-CD2 3.41Å; F721-L807 VanDerWaalsContact CE2-CD2 3.41Å; F721-L807 HydrophobicContact CE2-CG 4.11Å; F721-L807 HydrophobicContact CZ-CD2 3.6Å; F721-L807 HydrophobicContact CZ-CG 4.05Å; F721-M811 HydrophobicContact CE1-CE 4.36Å; F721-M811 HydrophobicContact CE1-SD 3.94Å; F721-M811 HydrophobicContact CZ-CE 4.39Å; F721-M811 HydrophobicContact CZ-SD 3.51Å; F721-M811 VanDerWaalsContact CZ-SD 3.51Å
722	I	85.6	Confident	84.1	Confident	6 Å²	6	27.9 Å²	27.9	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-64.5	-36.6	175.9	-69.4	168.3	0	0	0	111	I448 V450 Y466 F481 L718 P719 I724 L725 N726	I448-I722 HydrophobicContact CB-CG2 3.89Å; I448-I722 HydrophobicContact CG2-CG2 3.89Å; I448-I722 VanDerWaalsContact O-CG2 3.25Å; I448-I722 WeakPolarHBondContact O-CG2 2.83Å; V450-I722 HydrophobicContact CG2-CD1 3.32Å; Y466-I722 HydrophobicContact CE1-CD1 4.09Å; F481-I722 HydrophobicContact CE1-CD1 3.8Å; F481-I722 HydrophobicContact CE1-CG1 3.77Å; F481-I722 HydrophobicContact CZ-CD1 4.49Å; F481-I722 HydrophobicContact CZ-CG1 4.04Å; L718-I722 VanDerWaalsContact O-CG1 3.28Å; L718-I722 WeakPolarHBondContact O-CG1 3.2Å; L718-I722 PolarHBondContact O-N 3.15Å; P719-I722 PolarHBondContact O-N 3.23Å; I722-I724 VanDerWaalsContact C-N 3.32Å; I722-I724 PolarHBondContact O-N 2.83Å; I722-L725 PolarHBondContact O-N 2.83Å; I722-N726 VanDerWaalsContact O-CG 3.31Å; I722-N726 PolarHBondContact O-N 3.45Å; I722-N726 PolarHBondContact O-ND2 3.24Å
723	A	84.8	Confident	83.6	Confident	26 Å²	26	26.9 Å²	26.9	22%	0.215	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-40.8	174	0	0	0	0	0	112	P719 R720 F721 N726 V727	P719-A723 PolarHBondContact O-N 2.8Å; R720-A723 WeakPolarHBondContact O-CB 3.31Å; R720-A723 PolarHBondContact O-N 2.89Å; F721-A723 VanDerWaalsContact C-N 3.3Å; F721-A723 PolarHBondContact O-N 2.99Å; A723-N726 PolarHBondContact O-N 2.81Å; A723-V727 VanDerWaalsContact O-CG2 3.27Å; A723-V727 WeakPolarHBondContact O-CG2 3.48Å; A723-V727 PolarHBondContact O-N 2.65Å
724	I	87.2	Confident	82.9	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.2	-48.3	172.9	-68.5	166.8	0	0	0	110.7	L667 R720 F721 I722 N726 V727 F728 L791 H794 I795 I804	L667-I724 HydrophobicContact CD1-CD1 4.21Å; L667-I724 HydrophobicContact CD2-CD1 4.27Å; R720-I724 WeakPolarHBondContact O-CG1 3.33Å; R720-I724 PolarHBondContact O-N 3.28Å; R720-I724 VanDerWaalsContact O-N 3.16Å; F721-I724 WeakPolarHBondContact O-CB 3.45Å; F721-I724 PolarHBondContact O-N 2.86Å; I722-I724 VanDerWaalsContact C-N 3.32Å; I722-I724 PolarHBondContact O-N 2.83Å; I724-N726 VanDerWaalsContact C-N 3.33Å; I724-N726 PolarHBondContact O-N 3.27Å; I724-V727 WeakPolarHBondContact O-CB 3.21Å; I724-V727 PolarHBondContact O-N 2.78Å; I724-V727 VanDerWaalsContact O-N 3.17Å; I724-F728 HydrophobicContact CG2-CD2 4.44Å; I724-F728 HydrophobicContact CG2-CE2 4.01Å; I724-F728 WeakPolarHBondContact O-CD2 3.2Å; I724-L791 HydrophobicContact CB-CD2 4.46Å; I724-L791 HydrophobicContact CG1-CD2 4.44Å; I724-L791 HydrophobicContact CG2-CD1 4.18Å; I724-L791 HydrophobicContact CG2-CD2 3.89Å; I724-H794 HydrophobicContact CD1-CB 4.11Å; I724-H794 HydrophobicContact CG1-CB 3.64Å; I724-I795 HydrophobicContact CD1-CD1 4.36Å; I724-I795 HydrophobicContact CD1-CG1 4.16Å; I724-I804 HydrophobicContact CD1-CD1 3.87Å; I724-I804 HydrophobicContact CD1-CG1 4.15Å; I724-I804 HydrophobicContact CG2-CG2 3.98Å
725	L	87.8	Confident	82.3	Confident	1 Å²	1	30 Å²	30	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-43.4	177.1	-69	174.1	0	0	0	111.8	I477 F481 F721 I722 V727 F728 F729 L808	I477-L725 HydrophobicContact CD1-CB 4.07Å; I477-L725 HydrophobicContact CD1-CD1 4.31Å; F481-L725 HydrophobicContact CE2-CD1 4.48Å; F481-L725 HydrophobicContact CZ-CD1 3.86Å; F721-L725 HydrophobicContact CD1-CD1 4.19Å; F721-L725 HydrophobicContact CE1-CD1 3.69Å; F721-L725 HydrophobicContact CE1-CG 4.27Å; F721-L725 HydrophobicContact CE2-CG 4.42Å; F721-L725 HydrophobicContact CZ-CD1 3.96Å; F721-L725 HydrophobicContact CZ-CD2 4.18Å; F721-L725 HydrophobicContact CZ-CG 4.1Å; F721-L725 PolarHBondContact O-N 3.46Å; I722-L725 PolarHBondContact O-N 2.83Å; L725-V727 PolarHBondContact O-N 2.93Å; L725-F728 PolarHBondContact O-N 2.85Å; L725-F729 HydrophobicContact CD2-CE2 4.46Å; L725-F729 VanDerWaalsContact O-CD2 3.28Å; L725-F729 WeakPolarHBondContact O-CD2 3.31Å; L725-F729 PolarHBondContact O-N 2.89Å; L725-L808 HydrophobicContact CD2-CD2 3.55Å
726	N	87.3	Confident	81.9	Confident	16 Å²	16	29.9 Å²	29.9	9%	0.086	16%	0.159	C	C	.	.	H	α-helix	trans	-58.3	-33.2	178.8	-73.8	-26.5	0	0	0	112.4	I448 Y474 I722 A723 I724 F728 F729 Q730	I448-N726 PolarHBondContact N-OD1 3.13Å; I448-N726 PolarHBondContact O-ND2 3.41Å; Y474-N726 WeakPolarHBondContact CE1-OD1 3.45Å; I722-N726 VanDerWaalsContact O-CG 3.31Å; I722-N726 PolarHBondContact O-N 3.45Å; I722-N726 PolarHBondContact O-ND2 3.24Å; A723-N726 PolarHBondContact O-N 2.81Å; I724-N726 VanDerWaalsContact C-N 3.33Å; I724-N726 PolarHBondContact O-N 3.27Å; N726-F728 VanDerWaalsContact C-N 3.32Å; N726-F728 PolarHBondContact O-N 3.4Å; N726-F729 PolarHBondContact O-N 3.43Å; N726-Q730 WeakPolarHBondContact O-CG 3.4Å; N726-Q730 PolarHBondContact O-N 2.72Å; N726-Q730 VanDerWaalsContact O-N 3.15Å
727	V	84.9	Confident	81.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-46.3	174.8	-171.7	0	0	0	0	110.9	A723 I724 L725 F729 L736 R739 L790 L791	A723-V727 VanDerWaalsContact O-CG2 3.27Å; A723-V727 WeakPolarHBondContact O-CG2 3.48Å; A723-V727 PolarHBondContact O-N 2.65Å; I724-V727 WeakPolarHBondContact O-CB 3.21Å; I724-V727 PolarHBondContact O-N 2.78Å; I724-V727 VanDerWaalsContact O-N 3.17Å; L725-V727 PolarHBondContact O-N 2.93Å; V727-F729 PolarHBondContact O-N 3.08Å; V727-L736 HydrophobicContact CG1-CD2 4.17Å; V727-R739 VanDerWaalsContact CG2-NH1 3.28Å; V727-L790 HydrophobicContact CG1-CB 4.41Å; V727-L791 HydrophobicContact CB-CD2 4.25Å; V727-L791 HydrophobicContact CG1-CD2 4.39Å; V727-L791 HydrophobicContact CG2-CD2 4.17Å
728	F	83.3	Confident	80.7	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.009	18%	0.182	C	C	.	.	H	α-helix	trans	-79.7	-8.9	-177	-64.8	-69.2	0	0	0	114.9	I724 L725 N726 F776 I787 L791 L808 F834 Y837	I724-F728 HydrophobicContact CG2-CD2 4.44Å; I724-F728 HydrophobicContact CG2-CE2 4.01Å; I724-F728 WeakPolarHBondContact O-CD2 3.2Å; L725-F728 PolarHBondContact O-N 2.85Å; N726-F728 VanDerWaalsContact C-N 3.32Å; N726-F728 PolarHBondContact O-N 3.4Å; F728-F776 HydrophobicContact CD1-CZ 4.48Å; F728-I787 HydrophobicContact CE1-CG2 4.37Å; F728-I787 HydrophobicContact CZ-CG2 3.88Å; F728-L791 HydrophobicContact CE2-CD1 4.01Å; F728-L791 HydrophobicContact CE2-CD2 4.01Å; F728-L791 HydrophobicContact CE2-CG 4.48Å; F728-L791 HydrophobicContact CZ-CD1 3.9Å; F728-L791 HydrophobicContact CZ-CD2 4.19Å; F728-L791 HydrophobicContact CZ-CG 4.29Å; F728-L808 HydrophobicContact CD2-CD1 4.32Å; F728-L808 HydrophobicContact CE2-CD1 3.79Å; F728-L808 HydrophobicContact CZ-CD1 4.37Å; F728-F834 AromaticContact CD1-CE1 3.88Å; F728-F834 HydrophobicContact CD1-CE1 3.88Å; F728-F834 AromaticContact CD1-CZ 3.92Å; F728-F834 HydrophobicContact CD1-CZ 3.92Å; F728-F834 HydrophobicContact CE1-CE1 4.11Å; F728-F834 AromaticContact CE1-CZ 3.7Å; F728-F834 HydrophobicContact CE1-CZ 3.7Å; F728-F834 HydrophobicContact CG-CE1 4.24Å; F728-F834 HydrophobicContact CZ-CZ 4.26Å; F728-Y837 VanDerWaalsContact O-CE2 3.3Å; F728-Y837 WeakPolarHBondContact O-CE2 3.24Å; F728-Y837 VanDerWaalsContact O-CZ 3.28Å; F728-Y837 PolarHBondContact O-OH 3.31Å
729	F	84.3	Confident	80.3	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-122.4	-4.3	-175.2	-70.7	-75.2	0	0	0	114.7	N473 Y474 L476 I477 L725 N726 V727 R731 V813	N473-F729 WeakPolarHBondContact CB-O 3.49Å; N473-F729 WeakPolarHBondContact O-CD1 3.46Å; Y474-F729 HydrophobicContact CD1-CB 3.97Å; Y474-F729 HydrophobicContact CD2-CB 4.19Å; Y474-F729 HydrophobicContact CE1-CB 3.68Å; Y474-F729 HydrophobicContact CE2-CB 3.93Å; Y474-F729 VanDerWaalsContact CE2-O 3.26Å; Y474-F729 WeakPolarHBondContact CE2-O 3.45Å; Y474-F729 HydrophobicContact CG-CB 4.21Å; L476-F729 HydrophobicContact CB-CE1 4.32Å; L476-F729 HydrophobicContact CD2-CZ 4.1Å; I477-F729 HydrophobicContact CD1-CD2 3.6Å; I477-F729 HydrophobicContact CD1-CE2 3.9Å; I477-F729 HydrophobicContact CD1-CG 4.25Å; I477-F729 HydrophobicContact CG1-CD2 4.25Å; I477-F729 HydrophobicContact CG1-CE2 4.28Å; I477-F729 HydrophobicContact CG2-CD2 4.32Å; I477-F729 HydrophobicContact CG2-CE2 3.52Å; I477-F729 HydrophobicContact CG2-CZ 3.64Å; L725-F729 HydrophobicContact CD2-CE2 4.46Å; L725-F729 VanDerWaalsContact O-CD2 3.28Å; L725-F729 WeakPolarHBondContact O-CD2 3.31Å; L725-F729 PolarHBondContact O-N 2.89Å; N726-F729 PolarHBondContact O-N 3.43Å; V727-F729 PolarHBondContact O-N 3.08Å; F729-R731 PolarHBondContact O-N 3.46Å; F729-V813 HydrophobicContact CE2-CG1 4.17Å; F729-V813 HydrophobicContact CZ-CG1 3.87Å
730	Q	76.2	Confident	79.7	Confident	44 Å²	44	33.4 Å²	33.4	21%	0.206	17%	0.168	C	C	.	.	S	Bend	trans	-63.6	-26	172.1	-80.5	169.2	0.3	0	0	113.1	K446 Y474 N726 D732	K446-Q730 PolarHBondContact O-NE2 3.06Å; Y474-Q730 WeakPolarHBondContact OH-CG 3.37Å; N726-Q730 WeakPolarHBondContact O-CG 3.4Å; N726-Q730 PolarHBondContact O-N 2.72Å; N726-Q730 VanDerWaalsContact O-N 3.15Å; Q730-D732 PolarHBondContact O-N 2.73Å
731	R	75.9	Confident	78.9	Confident	83 Å²	83	34.1 Å²	34.1	31%	0.313	17%	0.174	S	C	.	.			trans	49.4	20	178.6	-59.2	-154.2	177.1	176.2	-6.4	116.5	N473 F729 S836 Y837	N473-R731 HydrophobicContact CB-CG 4.09Å; N473-R731 VanDerWaalsContact CG-CD 3.41Å; N473-R731 WeakPolarHBondContact ND2-CB 3.5Å; N473-R731 WeakPolarHBondContact ND2-CD 3.23Å; N473-R731 VanDerWaalsContact ND2-CG 3.3Å; N473-R731 WeakPolarHBondContact ND2-CG 3.49Å; N473-R731 WeakPolarHBondContact OD1-CD 3.31Å; F729-R731 PolarHBondContact O-N 3.46Å; R731-S836 VanDerWaalsContact NH2-C 3.25Å; R731-S836 PolarHBondContact NH2-O 3.23Å; R731-S836 PolarHBondContact NH2-OG 2.8Å; R731-Y837 HydrophobicContact CB-CE1 4.41Å; R731-Y837 HydrophobicContact CG-CE1 3.66Å; R731-Y837 WeakPolarHBondContact CG-OH 3.01Å
732	D	75.6	Confident	77.6	Confident	71 Å²	71	37.5 Å²	37.5	38%	0.38	20%	0.199	S	C	.	.			trans	-101.6	113.2	179.7	-177.9	-8.2	0	0	0	110.5	Q730 S734 T735 L736	Q730-D732 PolarHBondContact O-N 2.73Å; D732-S734 VanDerWaalsContact CG-OG 3.26Å; D732-S734 PolarHBondContact O-N 3.13Å; D732-S734 PolarHBondContact OD1-N 3Å; D732-S734 PolarHBondContact OD1-OG 3.32Å; D732-S734 PolarHBondContact OD2-OG 3.01Å; D732-T735 HydrophobicContact CB-CG2 4.04Å; D732-T735 WeakPolarHBondContact CB-OG1 3.43Å; D732-T735 PolarHBondContact O-N 3.02Å; D732-T735 PolarHBondContact O-OG1 3.05Å; D732-T735 WeakPolarHBondContact OD2-CG2 3.33Å; D732-L736 WeakPolarHBondContact O-CG 3.36Å; D732-L736 PolarHBondContact O-N 3.18Å
733	K	74.5	Confident	76.1	Confident	83 Å²	83	43 Å²	43	36%	0.361	22%	0.224	S	C	.	.	H	α-helix	trans	-55	-39.6	-179.3	-171.4	-179.5	-179.2	-178.1	0	112	L737 E774 L777	K733-L737 VanDerWaalsContact O-CB 3.26Å; K733-L737 WeakPolarHBondContact O-CB 3.4Å; K733-L737 PolarHBondContact O-N 2.94Å; K733-E774 IonicContact NZ-OE1 3.81Å; K733-E774 PolarHBondContact NZ-OE1 3.32Å; K733-L777 HydrophobicContact CB-CD1 3.71Å; K733-L777 HydrophobicContact CD-CD1 4.32Å; K733-L777 HydrophobicContact CG-CD1 3.94Å
734	S	73.8	Confident	74.2	Confident	63 Å²	63	42.3 Å²	42.3	44%	0.441	22%	0.22	S	C	.	.	H	α-helix	trans	-66.5	-46.9	-178.3	64.7	0	0	0	0	110.9	D732 L736 L737 D738	D732-S734 VanDerWaalsContact CG-OG 3.26Å; D732-S734 PolarHBondContact O-N 3.13Å; D732-S734 PolarHBondContact OD1-N 3Å; D732-S734 PolarHBondContact OD1-OG 3.32Å; D732-S734 PolarHBondContact OD2-OG 3.01Å; S734-L736 PolarHBondContact O-N 2.79Å; S734-L737 PolarHBondContact O-N 2.69Å; S734-D738 WeakPolarHBondContact O-CB 3.25Å; S734-D738 PolarHBondContact O-N 2.91Å
735	T	76	Confident	71.9	Confident	41 Å²	41	49.6 Å²	49.6	25%	0.252	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-36.7	178.2	65.4	0	0	0	0	113.6	D732 R739	D732-T735 HydrophobicContact CB-CG2 4.04Å; D732-T735 WeakPolarHBondContact CB-OG1 3.43Å; D732-T735 PolarHBondContact O-N 3.02Å; D732-T735 PolarHBondContact O-OG1 3.05Å; D732-T735 WeakPolarHBondContact OD2-CG2 3.33Å; T735-R739 VanDerWaalsContact O-CG 3.3Å; T735-R739 WeakPolarHBondContact O-CG 3.29Å; T735-R739 PolarHBondContact O-N 3.36Å; T735-R739 VanDerWaalsContact O-N 3.08Å
736	L	76.9	Confident	69.5	Low	2 Å²	2	61 Å²	61	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-41	176.6	-71.1	173	0	0	0	111.1	V727 D732 S734 R739 L740 L773 L790	V727-L736 HydrophobicContact CG1-CD2 4.17Å; D732-L736 WeakPolarHBondContact O-CG 3.36Å; D732-L736 PolarHBondContact O-N 3.18Å; S734-L736 PolarHBondContact O-N 2.79Å; L736-R739 PolarHBondContact O-N 2.93Å; L736-L740 WeakPolarHBondContact O-CG 3.45Å; L736-L740 PolarHBondContact O-N 2.83Å; L736-L740 VanDerWaalsContact O-N 3.13Å; L736-L773 HydrophobicContact CB-CD1 4.29Å; L736-L773 HydrophobicContact CB-CD2 4.17Å; L736-L773 HydrophobicContact CD1-CD2 4.42Å; L736-L790 HydrophobicContact CD2-CD2 4.21Å
737	L	73.7	Confident	67.2	Low	28 Å²	28	62.3 Å²	62.3	15%	0.147	31%	0.314	C	S	.	.	H	α-helix	trans	-68	-43	177.1	-169.7	71.7	0	0	0	111.4	K733 S734 R739 L740 L741 Q770 L773	K733-L737 VanDerWaalsContact O-CB 3.26Å; K733-L737 WeakPolarHBondContact O-CB 3.4Å; K733-L737 PolarHBondContact O-N 2.94Å; S734-L737 PolarHBondContact O-N 2.69Å; L737-R739 VanDerWaalsContact C-N 3.31Å; L737-R739 PolarHBondContact O-N 3.42Å; L737-L740 PolarHBondContact O-N 3.21Å; L737-L740 VanDerWaalsContact O-N 3.14Å; L737-L741 HydrophobicContact CD1-CD1 4.32Å; L737-L741 HydrophobicContact CD1-CG 4.5Å; L737-L741 HydrophobicContact CD2-CD1 4.18Å; L737-L741 HydrophobicContact CG-CD1 3.77Å; L737-L741 HydrophobicContact CG-CG 4.28Å; L737-L741 WeakPolarHBondContact O-CB 3.37Å; L737-L741 VanDerWaalsContact O-CG 3.28Å; L737-L741 WeakPolarHBondContact O-CG 3.34Å; L737-L741 PolarHBondContact O-N 3.38Å; L737-Q770 HydrophobicContact CD1-CG 3.74Å; L737-Q770 HydrophobicContact CD2-CG 4.38Å; L737-L773 HydrophobicContact CB-CD1 4.17Å; L737-L773 HydrophobicContact CD1-CD1 3.95Å
738	D	71.2	Confident	64.9	Low	101 Å²	101	70.7 Å²	70.7	54%	0.54	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-40.5	175.7	-77.3	-15.2	0	0	0	111.6	S734 L740 L741 S742	S734-D738 WeakPolarHBondContact O-CB 3.25Å; S734-D738 PolarHBondContact O-N 2.91Å; D738-L740 PolarHBondContact O-N 3.31Å; D738-L741 PolarHBondContact O-N 2.96Å; D738-S742 WeakPolarHBondContact O-CB 3.27Å; D738-S742 PolarHBondContact O-N 2.76Å; D738-S742 PolarHBondContact O-OG 3Å
739	R	73.3	Confident	62.6	Low	74 Å²	74	79.9 Å²	79.9	28%	0.279	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-41.4	173.8	-76.3	178.6	-168.9	-127.9	14.8	112.3	V727 T735 L736 L737 S742	V727-R739 VanDerWaalsContact CG2-NH1 3.28Å; T735-R739 VanDerWaalsContact O-CG 3.3Å; T735-R739 WeakPolarHBondContact O-CG 3.29Å; T735-R739 PolarHBondContact O-N 3.36Å; T735-R739 VanDerWaalsContact O-N 3.08Å; L736-R739 PolarHBondContact O-N 2.93Å; L737-R739 VanDerWaalsContact C-N 3.31Å; L737-R739 PolarHBondContact O-N 3.42Å; R739-S742 PolarHBondContact O-OG 3.22Å
740	L	71	Confident	60.4	Low	7 Å²	7	83.7 Å²	83.7	4%	0.037	44%	0.439	C	S	.	.	H	α-helix	trans	-67.9	-36.1	176.3	-72.3	175.9	0	0	0	112.9	L736 L737 D738 L773 L789 L790	L736-L740 WeakPolarHBondContact O-CG 3.45Å; L736-L740 PolarHBondContact O-N 2.83Å; L736-L740 VanDerWaalsContact O-N 3.13Å; L737-L740 PolarHBondContact O-N 3.21Å; L737-L740 VanDerWaalsContact O-N 3.14Å; D738-L740 PolarHBondContact O-N 3.31Å; L740-L773 HydrophobicContact CD1-CD1 3.67Å; L740-L773 HydrophobicContact CD1-CD2 4.21Å; L740-L773 HydrophobicContact CD1-CG 4Å; L740-L789 HydrophobicContact CD2-CB 3.8Å; L740-L790 HydrophobicContact CD1-CD2 4.15Å; L740-L790 HydrophobicContact CD2-CD2 3.63Å; L740-L790 HydrophobicContact CD2-CG 3.85Å; L740-L790 HydrophobicContact CG-CD2 3.63Å; L740-L790 HydrophobicContact CG-CG 4.36Å
741	L	66.8	Low	58.4	Low	60 Å²	60	92 Å²	92	31%	0.314	47%	0.468	S	S	.	.	H	α-helix	trans	-86.8	-29.6	-174.8	-67.7	175.9	0	0	0	113.8	L737 D738 E743 G744 V766	L737-L741 HydrophobicContact CD1-CD1 4.32Å; L737-L741 HydrophobicContact CD1-CG 4.5Å; L737-L741 HydrophobicContact CD2-CD1 4.18Å; L737-L741 HydrophobicContact CG-CD1 3.77Å; L737-L741 HydrophobicContact CG-CG 4.28Å; L737-L741 WeakPolarHBondContact O-CB 3.37Å; L737-L741 VanDerWaalsContact O-CG 3.28Å; L737-L741 WeakPolarHBondContact O-CG 3.34Å; L737-L741 PolarHBondContact O-N 3.38Å; D738-L741 PolarHBondContact O-N 2.96Å; L741-E743 PolarHBondContact O-N 3.32Å; L741-G744 PolarHBondContact O-N 3.33Å; L741-V766 HydrophobicContact CD2-CG1 4.2Å; L741-V766 HydrophobicContact CD2-CG2 4.05Å
742	S	60	Low	56.5	Low	78 Å²	78	92.9 Å²	92.9	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-18.9	-177.8	58.6	0	0	0	0	114.3	D738 R739	D738-S742 WeakPolarHBondContact O-CB 3.27Å; D738-S742 PolarHBondContact O-N 2.76Å; D738-S742 PolarHBondContact O-OG 3Å; R739-S742 PolarHBondContact O-OG 3.22Å
743	E	53.1	Low	54.6	Low	122 Å²	122	92.6 Å²	92.6	57%	0.57	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	7.8	-175.2	-69.8	-76.2	152.7	0	0	113.2	L741 E745	L741-E743 PolarHBondContact O-N 3.32Å; E743-E745 PolarHBondContact O-N 3.16Å
744	G	45.1	Very low	53.1	Low	12 Å²	12	94.7 Å²	94.7	12%	0.124	50%	0.5	C	S	.	.	S	Bend	trans	-66.7	128.2	163.9	0	0	0	0	0	109.3	L741 R746	L741-G744 PolarHBondContact O-N 3.33Å; G744-R746 PolarHBondContact O-N 3.04Å; G744-R746 VanDerWaalsContact O-N 3.16Å
745	E	40.4	Very low	51.5	Low	153 Å²	153	94.2 Å²	94.2	72%	0.715	50%	0.495	S	S	*	.			trans	-38.6	117.4	-170.2	-65.8	-173.7	156.8	0	0	113.9	E743 G747	E743-E745 PolarHBondContact O-N 3.16Å; E745-G747 VanDerWaalsContact C-N 3.26Å; E745-G747 PolarHBondContact O-N 3.33Å
746	R	36.9	Very low	50.2	Low	241 Å²	241	93.6 Å²	93.6	91%	0.909	49%	0.49	S	S	*	.			trans	-73.4	87	162.5	-76.2	-171.8	-172.9	-155	2.2	108.3	G744	G744-R746 PolarHBondContact O-N 3.04Å; G744-R746 VanDerWaalsContact O-N 3.16Å
747	G	37.7	Very low	48.5	Very low	43 Å²	43	100.3 Å²	100.3	44%	0.443	52%	0.521	S	S	.	.			trans	-59.9	151.2	161.8	0	0	0	0	0	110.9	E745 K749 G750	E745-G747 VanDerWaalsContact C-N 3.26Å; E745-G747 PolarHBondContact O-N 3.33Å; G747-K749 PolarHBondContact O-N 3.47Å; G747-G750 PolarHBondContact O-N 3.2Å
748	D	36.6	Very low	47.1	Very low	175 Å²	175	101.4 Å²	101.4	94%	0.936	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	17.8	-168.5	-138.6	8	0	0	0	116.4
749	K	36	Very low	45.8	Very low	195 Å²	195	103.2 Å²	103.2	85%	0.848	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.4	25.6	-178.6	-66.3	-169.7	179	178.9	0	114.8	G747 R751	G747-K749 PolarHBondContact O-N 3.47Å; K749-R751 PolarHBondContact O-N 3.1Å
750	G	38	Very low	44.2	Very low	82 Å²	82	106.8 Å²	106.8	85%	0.845	55%	0.55	S	S	*	.	S	Bend	trans	60.9	18.7	166.5	0	0	0	0	0	116	G747	G747-G750 PolarHBondContact O-N 3.2Å
751	R	33.3	Very low	42.9	Very low	218 Å²	218	109.1 Å²	109.1	82%	0.823	58%	0.575	S	S	*	*			trans	-106.8	121.3	167.6	-78.9	-173.8	172.9	176.8	-1.7	108.3	K749 S753	K749-R751 PolarHBondContact O-N 3.1Å; R751-S753 PolarHBondContact O-N 3.06Å; R751-S753 VanDerWaalsContact O-N 3.08Å
752	V	36.4	Very low	41.8	Very low	102 Å²	102	113.3 Å²	113.3	62%	0.618	59%	0.593	S	S	*	*			trans	-57.9	110.1	168.4	179.6	0	0	0	0	107.1	L754	V752-L754 PolarHBondContact O-N 3.04Å
753	S	37.1	Very low	41.2	Very low	65 Å²	65	114.4 Å²	114.4	46%	0.455	59%	0.593	S	S	.	*			trans	-68.4	121.4	172.9	-152.2	0	0	0	0	107.5	R751 V755	R751-S753 PolarHBondContact O-N 3.06Å; R751-S753 VanDerWaalsContact O-N 3.08Å; S753-V755 PolarHBondContact O-N 2.97Å
754	L	41.9	Very low	41.2	Very low	126 Å²	126	109.6 Å²	109.6	66%	0.66	57%	0.571	S	S	*	*	S	Bend	trans	-73.4	25.2	-178	-75.2	160.8	0	0	0	113	V752 V766	V752-L754 PolarHBondContact O-N 3.04Å; L754-V766 HydrophobicContact CD2-CG2 3.78Å
755	V	39.6	Very low	42	Very low	54 Å²	54	117 Å²	117	33%	0.327	60%	0.596	S	S	.	*			trans	-137.9	113.2	-168.9	-174.9	0	0	0	0	108.3	S753 N763	S753-V755 PolarHBondContact O-N 2.97Å; V755-N763 HydrophobicContact CG1-CB 4.18Å; V755-N763 WeakPolarHBondContact CG1-OD1 3.42Å
756	I	48.8	Very low	43	Very low	27 Å²	27	111.3 Å²	111.3	14%	0.138	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	116.4	168.3	-57.5	178.9	0	0	0	105.7	D758 L769 L789	I756-D758 PolarHBondContact O-N 2.88Å; I756-L769 HydrophobicContact CD1-CD1 3.99Å; I756-L789 HydrophobicContact CG2-CD1 4.14Å; I756-L789 HydrophobicContact CG2-CD2 4.05Å
757	E	42.4	Very low	44.3	Very low	144 Å²	144	103.4 Å²	103.4	67%	0.673	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.4	177.7	-65.6	-174.2	169.4	0	0	110
758	D	43	Very low	45.8	Very low	50 Å²	50	105.3 Å²	105.3	27%	0.267	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-80.3	164.7	165.9	-153.2	-10.8	0	0	0	109.9	I756 K760 G761 L764 N785	I756-D758 PolarHBondContact O-N 2.88Å; D758-K760 PolarHBondContact O-N 2.93Å; D758-G761 PolarHBondContact O-N 3.44Å; D758-L764 HydrophobicContact CB-CD1 4.08Å; D758-N785 PolarHBondContact OD2-ND2 2.82Å
759	E	43.9	Very low	47.5	Very low	140 Å²	140	97.1 Å²	97.1	65%	0.654	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-2.9	-177.7	-72.3	-176.4	169.9	0	0	114.7	R788	E759-R788 IonicContact OE1-CZ 3.02Å; E759-R788 IonicContact OE1-NH1 2.69Å; E759-R788 PolarHBondContact OE1-NH1 2.97Å
760	K	41.3	Very low	49.2	Very low	149 Å²	149	91.1 Å²	91.1	65%	0.648	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	4.1	176.7	-63.6	-174	-178	176.2	0	114.7	D758 E762 G827	D758-K760 PolarHBondContact O-N 2.93Å; K760-E762 VanDerWaalsContact C-N 3.29Å; K760-E762 PolarHBondContact O-N 3.06Å; K760-G827 PolarHBondContact NZ-O 2.85Å
761	G	43.1	Very low	51.1	Low	55 Å²	55	93 Å²	93	57%	0.567	46%	0.464	S	S	*	.			trans	70.6	20	-178	0	0	0	0	0	114.6	D758	D758-G761 PolarHBondContact O-N 3.44Å
762	E	42.8	Very low	53.3	Low	148 Å²	148	85.1 Å²	85.1	69%	0.692	44%	0.437	S	S	*	.			trans	-85.8	124.8	171.7	-70	-155	166.8	0	0	111	K760 L764	K760-E762 VanDerWaalsContact C-N 3.29Å; K760-E762 PolarHBondContact O-N 3.06Å; E762-L764 PolarHBondContact O-N 3.34Å
763	N	47.4	Very low	55.3	Low	101 Å²	101	80.3 Å²	80.3	54%	0.54	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	97.7	179.8	-69.2	-28	0	0	0	110.9	V755 R765	V755-N763 HydrophobicContact CG1-CB 4.18Å; V755-N763 WeakPolarHBondContact CG1-OD1 3.42Å; N763-R765 PolarHBondContact O-N 3.29Å
764	L	54.4	Low	57.3	Low	21 Å²	21	81.8 Å²	81.8	11%	0.11	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	98.1	170.3	-86.8	151.5	0	0	0	109.7	D758 E762 H768 L769	D758-L764 HydrophobicContact CB-CD1 4.08Å; E762-L764 PolarHBondContact O-N 3.34Å; L764-H768 HydrophobicContact CD2-CB 4.39Å; L764-L769 HydrophobicContact CD2-CD2 4.43Å
765	R	60.1	Low	59	Low	169 Å²	169	76.9 Å²	76.9	64%	0.638	39%	0.387	S	S	*	.			trans	-64.5	144.5	172.3	-67.9	-179	178.1	170.9	0.3	110	N763 T767 H768 L769	N763-R765 PolarHBondContact O-N 3.29Å; R765-T767 PolarHBondContact O-N 3.2Å; R765-H768 WeakPolarHBondContact O-CB 3.43Å; R765-H768 PolarHBondContact O-N 3.19Å; R765-L769 PolarHBondContact O-N 3.26Å
766	V	62.7	Low	61.1	Low	33 Å²	33	74.4 Å²	74.4	20%	0.2	37%	0.372	C	S	.	.	H	α-helix	trans	-50.5	-32.8	175.9	177	0	0	0	0	112.7	L741 L754 H768 L769 Q770	L741-V766 HydrophobicContact CD2-CG1 4.2Å; L741-V766 HydrophobicContact CD2-CG2 4.05Å; L754-V766 HydrophobicContact CD2-CG2 3.78Å; V766-H768 PolarHBondContact O-N 3.14Å; V766-L769 PolarHBondContact O-N 3.1Å; V766-Q770 WeakPolarHBondContact O-CG 3.27Å; V766-Q770 PolarHBondContact O-N 3.41Å
767	T	63.4	Low	62.6	Low	75 Å²	75	75.2 Å²	75.2	46%	0.46	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-37.1	175.8	52.2	0	0	0	0	113.1	R765 Q771	R765-T767 PolarHBondContact O-N 3.2Å; T767-Q771 VanDerWaalsContact O-CG 3.31Å; T767-Q771 WeakPolarHBondContact O-CG 3.28Å; T767-Q771 PolarHBondContact O-N 3.01Å
768	H	70.1	Confident	64.5	Low	82 Å²	82	73.3 Å²	73.3	38%	0.38	37%	0.367	S	S	.	.	H	α-helix	trans	-72.6	-38	176.9	-64.1	168.9	0	0	0	111.5	L764 R765 V766 Q770 Q771 H772	L764-H768 HydrophobicContact CD2-CB 4.39Å; R765-H768 WeakPolarHBondContact O-CB 3.43Å; R765-H768 PolarHBondContact O-N 3.19Å; V766-H768 PolarHBondContact O-N 3.14Å; H768-Q770 VanDerWaalsContact C-N 3.35Å; H768-Q771 PolarHBondContact O-N 2.91Å; H768-H772 PolarHBondContact O-CD2 2.82Å; H768-H772 PolarHBondContact O-N 3.31Å
769	L	72.4	Confident	66.2	Low	3 Å²	3	73.9 Å²	73.9	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-64.3	-39.6	174.4	-68.7	171.1	0	0	0	111.8	I756 L764 R765 V766 H772 L773 V786	I756-L769 HydrophobicContact CD1-CD1 3.99Å; L764-L769 HydrophobicContact CD2-CD2 4.43Å; R765-L769 PolarHBondContact O-N 3.26Å; V766-L769 PolarHBondContact O-N 3.1Å; L769-H772 PolarHBondContact O-N 3.09Å; L769-L773 WeakPolarHBondContact O-CG 3.47Å; L769-L773 PolarHBondContact O-N 3.22Å; L769-V786 HydrophobicContact CD2-CG2 4.12Å
770	Q	71.8	Confident	68.1	Low	70 Å²	70	67.2 Å²	67.2	33%	0.327	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-43	173.4	-76.4	177.3	-19.9	0	0	112	L737 V766 H768 L773 E774	L737-Q770 HydrophobicContact CD1-CG 3.74Å; L737-Q770 HydrophobicContact CD2-CG 4.38Å; V766-Q770 WeakPolarHBondContact O-CG 3.27Å; V766-Q770 PolarHBondContact O-N 3.41Å; H768-Q770 VanDerWaalsContact C-N 3.35Å; Q770-L773 PolarHBondContact O-N 2.78Å; Q770-E774 WeakPolarHBondContact O-CB 3.24Å; Q770-E774 WeakPolarHBondContact O-CG 3.31Å; Q770-E774 PolarHBondContact O-N 2.96Å
771	Q	76.6	Confident	70.3	Confident	120 Å²	120	62.5 Å²	62.5	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-62.4	-42.3	175.1	-75.2	171.9	-15.2	0	0	112.2	T767 H768 E774 G775	T767-Q771 VanDerWaalsContact O-CG 3.31Å; T767-Q771 WeakPolarHBondContact O-CG 3.28Å; T767-Q771 PolarHBondContact O-N 3.01Å; H768-Q771 PolarHBondContact O-N 2.91Å; Q771-E774 PolarHBondContact O-N 2.99Å; Q771-G775 PolarHBondContact O-N 2.9Å
772	H	79.8	Confident	72.4	Confident	54 Å²	54	59.9 Å²	59.9	25%	0.25	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-39.8	175	-72.5	-52.5	0	0	0	112.5	H768 L769 F776 W831	H768-H772 PolarHBondContact O-CD2 2.82Å; H768-H772 PolarHBondContact O-N 3.31Å; L769-H772 PolarHBondContact O-N 3.09Å; H772-F776 WeakPolarHBondContact O-CB 3.19Å; H772-F776 PolarHBondContact O-N 2.85Å; H772-W831 AromaticContact CE1-CH2 3.87Å; H772-W831 AromaticContact ND1-CH2 3.93Å
773	L	79.8	Confident	74.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.8	-36.1	175.2	-74.9	-179.7	0	0	0	112.7	L736 L737 L740 L769 Q770 F776 L777	L736-L773 HydrophobicContact CB-CD1 4.29Å; L736-L773 HydrophobicContact CB-CD2 4.17Å; L736-L773 HydrophobicContact CD1-CD2 4.42Å; L737-L773 HydrophobicContact CB-CD1 4.17Å; L737-L773 HydrophobicContact CD1-CD1 3.95Å; L740-L773 HydrophobicContact CD1-CD1 3.67Å; L740-L773 HydrophobicContact CD1-CD2 4.21Å; L740-L773 HydrophobicContact CD1-CG 4Å; L769-L773 WeakPolarHBondContact O-CG 3.47Å; L769-L773 PolarHBondContact O-N 3.22Å; Q770-L773 PolarHBondContact O-N 2.78Å; L773-F776 WeakPolarHBondContact O-CB 3.44Å; L773-F776 PolarHBondContact O-N 3.48Å; L773-L777 VanDerWaalsContact O-CG 3.29Å; L773-L777 WeakPolarHBondContact O-CG 3.19Å; L773-L777 PolarHBondContact O-N 3.33Å
774	E	78.8	Confident	76.2	Confident	97 Å²	97	49.5 Å²	49.5	45%	0.453	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-46.4	174	-76	174.2	-178.1	0	0	111.2	K733 Q770 Q771 F776 L777 H778	K733-E774 IonicContact NZ-OE1 3.81Å; K733-E774 PolarHBondContact NZ-OE1 3.32Å; Q770-E774 WeakPolarHBondContact O-CB 3.24Å; Q770-E774 WeakPolarHBondContact O-CG 3.31Å; Q770-E774 PolarHBondContact O-N 2.96Å; Q771-E774 PolarHBondContact O-N 2.99Å; E774-F776 VanDerWaalsContact C-N 3.26Å; E774-F776 PolarHBondContact O-N 3.22Å; E774-L777 PolarHBondContact O-N 2.99Å; E774-H778 WeakPolarHBondContact O-CB 3.33Å; E774-H778 PolarHBondContact O-N 3.29Å
775	G	77.3	Confident	77.4	Confident	22 Å²	22	49.9 Å²	49.9	23%	0.227	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-34.1	172.1	0	0	0	0	0	112.8	Q771 D779 G780	Q771-G775 PolarHBondContact O-N 2.9Å; G775-D779 CarbonylContact O-C 3.52Å; G775-D779 WeakPolarHBondContact O-CA 3.27Å; G775-D779 WeakPolarHBondContact O-CB 3.16Å; G775-D779 PolarHBondContact O-N 3.4Å; G775-G780 PolarHBondContact O-N 2.84Å
776	F	82.4	Confident	78.5	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-46.4	172.9	179.8	-128.9	0	0	0	113.1	F728 H772 L773 E774 H778 G780 L782 F834 Y837	F728-F776 HydrophobicContact CD1-CZ 4.48Å; H772-F776 WeakPolarHBondContact O-CB 3.19Å; H772-F776 PolarHBondContact O-N 2.85Å; L773-F776 WeakPolarHBondContact O-CB 3.44Å; L773-F776 PolarHBondContact O-N 3.48Å; E774-F776 VanDerWaalsContact C-N 3.26Å; E774-F776 PolarHBondContact O-N 3.22Å; F776-H778 PolarHBondContact O-N 3.38Å; F776-G780 WeakPolarHBondContact O-CA 3.45Å; F776-G780 PolarHBondContact O-N 2.86Å; F776-L782 HydrophobicContact CB-CD1 3.32Å; F776-L782 HydrophobicContact CD1-CD1 3.56Å; F776-L782 HydrophobicContact CD2-CD1 3.09Å; F776-L782 HydrophobicContact CD2-CG 4.41Å; F776-L782 HydrophobicContact CE1-CD1 4.08Å; F776-L782 HydrophobicContact CE2-CD1 3.66Å; F776-L782 HydrophobicContact CG-CD1 3.01Å; F776-L782 HydrophobicContact CG-CG 4.47Å; F776-L782 HydrophobicContact CZ-CD1 4.12Å; F776-F834 HydrophobicContact CD2-CD2 4.42Å; F776-F834 HydrophobicContact CE2-CB 3.96Å; F776-F834 HydrophobicContact CE2-CD1 4.45Å; F776-F834 AromaticContact CE2-CD2 3.62Å; F776-F834 HydrophobicContact CE2-CD2 3.62Å; F776-F834 HydrophobicContact CE2-CE2 4.2Å; F776-F834 AromaticContact CE2-CG 3.76Å; F776-F834 HydrophobicContact CE2-CG 3.76Å; F776-F834 HydrophobicContact CZ-CD2 4.49Å; F776-F834 HydrophobicContact CZ-CG 4.41Å; F776-Y837 HydrophobicContact CD1-CE1 4.31Å; F776-Y837 HydrophobicContact CE1-CD1 4.32Å; F776-Y837 HydrophobicContact CE1-CD2 4.5Å; F776-Y837 AromaticContact CE1-CE1 3.78Å; F776-Y837 HydrophobicContact CE1-CE1 3.78Å; F776-Y837 AromaticContact CE1-CE2 3.99Å; F776-Y837 HydrophobicContact CE1-CE2 3.99Å; F776-Y837 AromaticContact CE1-CZ 3.55Å; F776-Y837 AromaticContact CE2-CD2 3.92Å; F776-Y837 HydrophobicContact CE2-CD2 3.92Å; F776-Y837 HydrophobicContact CE2-CE2 4.05Å; F776-Y837 HydrophobicContact CE2-CG 4.18Å; F776-Y837 HydrophobicContact CZ-CD1 4.33Å; F776-Y837 AromaticContact CZ-CD2 3.77Å; F776-Y837 HydrophobicContact CZ-CD2 3.77Å; F776-Y837 HydrophobicContact CZ-CE1 4.01Å; F776-Y837 AromaticContact CZ-CE2 3.4Å; F776-Y837 HydrophobicContact CZ-CE2 3.4Å; F776-Y837 VanDerWaalsContact CZ-CE2 3.4Å; F776-Y837 HydrophobicContact CZ-CG 4.19Å; F776-Y837 AromaticContact CZ-CZ 3.5Å; F776-Y837 WeakPolarHBondContact O-CB 3.49Å
777	L	82.1	Confident	79.5	Confident	44 Å²	44	40.3 Å²	40.3	23%	0.23	21%	0.208	C	C	.	.	H	α-helix	trans	-70	-23.7	-177.6	-68.9	173.1	0	0	0	112.4	K733 L773 E774 Y837	K733-L777 HydrophobicContact CB-CD1 3.71Å; K733-L777 HydrophobicContact CD-CD1 4.32Å; K733-L777 HydrophobicContact CG-CD1 3.94Å; L773-L777 VanDerWaalsContact O-CG 3.29Å; L773-L777 WeakPolarHBondContact O-CG 3.19Å; L773-L777 PolarHBondContact O-N 3.33Å; E774-L777 PolarHBondContact O-N 2.99Å; L777-Y837 HydrophobicContact CD2-CD1 4.23Å; L777-Y837 HydrophobicContact CD2-CE1 3.8Å
778	H	80.6	Confident	80.4	Confident	104 Å²	104	39.9 Å²	39.9	48%	0.481	20%	0.198	S	C	.	.	H	α-helix	trans	-95.5	-52.2	178.9	-161.3	62.2	0	0	0	113.3	E774 F776 S839	E774-H778 WeakPolarHBondContact O-CB 3.33Å; E774-H778 PolarHBondContact O-N 3.29Å; F776-H778 PolarHBondContact O-N 3.38Å; H778-S839 PolarHBondContact O-N 3.43Å
779	D	78.7	Confident	80.8	Confident	63 Å²	63	37.4 Å²	37.4	34%	0.337	19%	0.187	S	C	.	.	H	α-helix	trans	-107.5	-7.4	-172.6	-57.6	-44.5	0	0	0	113.1	G775 L781 K833	G775-D779 CarbonylContact O-C 3.52Å; G775-D779 WeakPolarHBondContact O-CA 3.27Å; G775-D779 WeakPolarHBondContact O-CB 3.16Å; G775-D779 PolarHBondContact O-N 3.4Å; D779-L781 VanDerWaalsContact C-N 3.3Å; D779-L781 HydrophobicContact CB-CD1 4.24Å; D779-L781 HydrophobicContact CB-CG 4.39Å; D779-L781 PolarHBondContact O-N 2.7Å; D779-K833 WeakPolarHBondContact O-CD 3.49Å; D779-K833 WeakPolarHBondContact O-CE 3.4Å; D779-K833 PolarHBondContact O-NZ 2.95Å
780	G	84.8	Confident	81.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.			trans	69.4	22.1	-179.1	0	0	0	0	0	114.4	G775 F776 K833 F834	G775-G780 PolarHBondContact O-N 2.84Å; F776-G780 WeakPolarHBondContact O-CA 3.45Å; F776-G780 PolarHBondContact O-N 2.86Å; G780-K833 CarbonylContact O-C 3.57Å; G780-K833 WeakPolarHBondContact O-CA 3.17Å; G780-F834 PolarHBondContact O-N 3.09Å
781	L	86.8	Confident	81.7	Confident	49 Å²	49	34 Å²	34	26%	0.257	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.9	-179.7	-72.4	169.4	0	0	0	111.8	D779 I817 W831 K833	D779-L781 VanDerWaalsContact C-N 3.3Å; D779-L781 HydrophobicContact CB-CD1 4.24Å; D779-L781 HydrophobicContact CB-CG 4.39Å; D779-L781 PolarHBondContact O-N 2.7Å; L781-I817 HydrophobicContact CD2-CD1 3.36Å; L781-W831 HydrophobicContact CB-CE3 4.3Å; L781-W831 HydrophobicContact CB-CZ3 4.3Å; L781-K833 HydrophobicContact CD2-CB 4.21Å; L781-K833 HydrophobicContact CD2-CD 3.46Å; L781-K833 VanDerWaalsContact CD2-CD 3.46Å; L781-K833 HydrophobicContact CD2-CG 4.43Å; L781-K833 HydrophobicContact CG-CD 3.82Å
782	L	87.2	Confident	81.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.3	170	-118	104.7	0	0	0	112.6	F776 V786 I787 L790 Y832 F834	F776-L782 HydrophobicContact CB-CD1 3.32Å; F776-L782 HydrophobicContact CD1-CD1 3.56Å; F776-L782 HydrophobicContact CD2-CD1 3.09Å; F776-L782 HydrophobicContact CD2-CG 4.41Å; F776-L782 HydrophobicContact CE1-CD1 4.08Å; F776-L782 HydrophobicContact CE2-CD1 3.66Å; F776-L782 HydrophobicContact CG-CD1 3.01Å; F776-L782 HydrophobicContact CG-CG 4.47Å; F776-L782 HydrophobicContact CZ-CD1 4.12Å; L782-V786 HydrophobicContact CD2-CB 3.97Å; L782-V786 HydrophobicContact CD2-CG1 3.66Å; L782-V786 HydrophobicContact CG-CG1 4.45Å; L782-I787 HydrophobicContact CB-CD1 4.1Å; L782-I787 HydrophobicContact CB-CG1 3.87Å; L782-I787 HydrophobicContact CD2-CB 4.38Å; L782-I787 HydrophobicContact CD2-CG1 3.45Å; L782-I787 VanDerWaalsContact CD2-CG1 3.45Å; L782-I787 HydrophobicContact CG-CG1 4.25Å; L782-L790 HydrophobicContact CD2-CD1 3.6Å; L782-Y832 PolarHBondContact N-O 3.12Å; L782-Y832 PolarHBondContact O-N 3.29Å; L782-F834 HydrophobicContact CB-CE2 4.5Å
783	P	86.3	Confident	81.2	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	149	169.5	35.1	-35.1	0	0	0	111.4	N785 V786 I787 W831	P783-N785 VanDerWaalsContact C-N 3.32Å; P783-N785 VanDerWaalsContact CB-OD1 3.28Å; P783-N785 WeakPolarHBondContact CB-OD1 3.5Å; P783-N785 WeakPolarHBondContact CG-OD1 2.97Å; P783-N785 PolarHBondContact O-N 3.46Å; P783-V786 HydrophobicContact CG-CB 3.98Å; P783-V786 HydrophobicContact CG-CG2 3.62Å; P783-V786 PolarHBondContact O-N 3.49Å; P783-V786 VanDerWaalsContact O-N 3.13Å; P783-I787 PolarHBondContact O-N 3.36Å; P783-I787 VanDerWaalsContact O-N 3.09Å; P783-W831 HydrophobicContact CB-CD2 4.08Å; P783-W831 HydrophobicContact CB-CE3 4.2Å; P783-W831 HydrophobicContact CB-CH2 4.3Å; P783-W831 HydrophobicContact CB-CZ2 4.17Å; P783-W831 HydrophobicContact CB-CZ3 4.31Å; P783-W831 HydrophobicContact CG-CH2 4.29Å; P783-W831 HydrophobicContact CG-CZ3 4.32Å
784	S	83.8	Confident	81	Confident	28 Å²	28	37 Å²	37	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-56.7	-35.8	-175.8	46.9	0	0	0	0	115	I787 R788 V830	S784-I787 PolarHBondContact O-N 3.27Å; S784-R788 PolarHBondContact O-N 3.27Å; S784-V830 WeakPolarHBondContact CB-O 3.27Å; S784-V830 PolarHBondContact N-O 3.07Å; S784-V830 PolarHBondContact OG-O 2.88Å
785	N	79.8	Confident	81.1	Confident	29 Å²	29	32.7 Å²	32.7	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-41.9	175.9	58.7	-18.1	0	0	0	112.1	D758 P783 R788 L789	D758-N785 PolarHBondContact OD2-ND2 2.82Å; P783-N785 VanDerWaalsContact C-N 3.32Å; P783-N785 VanDerWaalsContact CB-OD1 3.28Å; P783-N785 WeakPolarHBondContact CB-OD1 3.5Å; P783-N785 WeakPolarHBondContact CG-OD1 2.97Å; P783-N785 PolarHBondContact O-N 3.46Å; N785-R788 WeakPolarHBondContact O-CB 3.38Å; N785-R788 PolarHBondContact O-N 3.25Å; N785-L789 WeakPolarHBondContact O-CG 3.1Å; N785-L789 PolarHBondContact O-N 2.83Å; N785-L789 VanDerWaalsContact O-N 3.15Å
786	V	82.6	Confident	81	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-70	-37.3	176	-179.6	0	0	0	0	111.1	L769 L782 P783 R788 L789 L790	L769-V786 HydrophobicContact CD2-CG2 4.12Å; L782-V786 HydrophobicContact CD2-CB 3.97Å; L782-V786 HydrophobicContact CD2-CG1 3.66Å; L782-V786 HydrophobicContact CG-CG1 4.45Å; P783-V786 HydrophobicContact CG-CB 3.98Å; P783-V786 HydrophobicContact CG-CG2 3.62Å; P783-V786 PolarHBondContact O-N 3.49Å; P783-V786 VanDerWaalsContact O-N 3.13Å; V786-R788 VanDerWaalsContact C-N 3.31Å; V786-R788 PolarHBondContact O-N 3.41Å; V786-L789 PolarHBondContact O-N 2.85Å; V786-L790 HydrophobicContact CG1-CD1 4.45Å; V786-L790 WeakPolarHBondContact O-CG 3.29Å; V786-L790 PolarHBondContact O-N 2.72Å
787	I	84.5	Confident	81	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-44.9	173.4	-62.9	172.9	0	0	0	110.3	F728 L782 P783 S784 L789 L790 L791 L801 M805 Y832 F834	F728-I787 HydrophobicContact CE1-CG2 4.37Å; F728-I787 HydrophobicContact CZ-CG2 3.88Å; L782-I787 HydrophobicContact CB-CD1 4.1Å; L782-I787 HydrophobicContact CB-CG1 3.87Å; L782-I787 HydrophobicContact CD2-CB 4.38Å; L782-I787 HydrophobicContact CD2-CG1 3.45Å; L782-I787 VanDerWaalsContact CD2-CG1 3.45Å; L782-I787 HydrophobicContact CG-CG1 4.25Å; P783-I787 PolarHBondContact O-N 3.36Å; P783-I787 VanDerWaalsContact O-N 3.09Å; S784-I787 PolarHBondContact O-N 3.27Å; I787-L789 VanDerWaalsContact C-N 3.31Å; I787-L789 PolarHBondContact O-N 3.23Å; I787-L790 PolarHBondContact O-N 3.37Å; I787-L791 HydrophobicContact CG2-CD1 3.73Å; I787-L791 HydrophobicContact CG2-CG 4.25Å; I787-L791 WeakPolarHBondContact O-CB 3.25Å; I787-L791 WeakPolarHBondContact O-CG 3.37Å; I787-L791 PolarHBondContact O-N 2.78Å; I787-L801 HydrophobicContact CB-CD1 4.46Å; I787-L801 HydrophobicContact CG2-CD1 3.77Å; I787-M805 HydrophobicContact CD1-CE 3.82Å; I787-M805 HydrophobicContact CD1-SD 4.17Å; I787-M805 HydrophobicContact CG2-SD 3.93Å; I787-Y832 HydrophobicContact CD1-CD2 3.59Å; I787-Y832 HydrophobicContact CD1-CE2 4.36Å; I787-Y832 HydrophobicContact CD1-CG 4.05Å; I787-F834 HydrophobicContact CD1-CE2 4.45Å
788	R	82.3	Confident	80.9	Confident	66 Å²	66	45.1 Å²	45.1	25%	0.249	22%	0.222	C	C	.	.	H	α-helix	trans	-57.6	-44.8	177.1	-167.8	177.5	175.3	-176	-3.2	111.6	E759 S784 N785 V786 L791 R792 L801	E759-R788 IonicContact OE1-CZ 3.02Å; E759-R788 IonicContact OE1-NH1 2.69Å; E759-R788 PolarHBondContact OE1-NH1 2.97Å; S784-R788 PolarHBondContact O-N 3.27Å; N785-R788 WeakPolarHBondContact O-CB 3.38Å; N785-R788 PolarHBondContact O-N 3.25Å; V786-R788 VanDerWaalsContact C-N 3.31Å; V786-R788 PolarHBondContact O-N 3.41Å; R788-L791 CarbonylContact O-C 3.55Å; R788-L791 PolarHBondContact O-N 3.3Å; R788-R792 WeakPolarHBondContact O-CG 3.38Å; R788-R792 PolarHBondContact O-N 3Å; R788-L801 HydrophobicContact CB-CD2 3.85Å; R788-L801 HydrophobicContact CG-CD2 4.2Å
789	L	78.5	Confident	81	Confident	30 Å²	30	44.8 Å²	44.8	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-42.7	177.5	-68.3	172.7	0	0	0	112	L740 I756 N785 V786 I787 L791 R792	L740-L789 HydrophobicContact CD2-CB 3.8Å; I756-L789 HydrophobicContact CG2-CD1 4.14Å; I756-L789 HydrophobicContact CG2-CD2 4.05Å; N785-L789 WeakPolarHBondContact O-CG 3.1Å; N785-L789 PolarHBondContact O-N 2.83Å; N785-L789 VanDerWaalsContact O-N 3.15Å; V786-L789 PolarHBondContact O-N 2.85Å; I787-L789 VanDerWaalsContact C-N 3.31Å; I787-L789 PolarHBondContact O-N 3.23Å; L789-L791 PolarHBondContact O-N 2.88Å; L789-R792 PolarHBondContact O-N 2.97Å
790	L	79.4	Confident	81.3	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-29.5	175.9	-73.6	172.4	0	0	0	113.1	V727 L736 L740 L782 V786 I787	V727-L790 HydrophobicContact CG1-CB 4.41Å; L736-L790 HydrophobicContact CD2-CD2 4.21Å; L740-L790 HydrophobicContact CD1-CD2 4.15Å; L740-L790 HydrophobicContact CD2-CD2 3.63Å; L740-L790 HydrophobicContact CD2-CG 3.85Å; L740-L790 HydrophobicContact CG-CD2 3.63Å; L740-L790 HydrophobicContact CG-CG 4.36Å; L782-L790 HydrophobicContact CD2-CD1 3.6Å; V786-L790 HydrophobicContact CG1-CD1 4.45Å; V786-L790 WeakPolarHBondContact O-CG 3.29Å; V786-L790 PolarHBondContact O-N 2.72Å; I787-L790 PolarHBondContact O-N 3.37Å
791	L	83	Confident	81.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-103.1	-1.8	-174.4	-60.5	-177.1	0	0	0	114.5	I724 V727 F728 I787 R788 L789 P793 H794 I795 L801 I804	I724-L791 HydrophobicContact CB-CD2 4.46Å; I724-L791 HydrophobicContact CG1-CD2 4.44Å; I724-L791 HydrophobicContact CG2-CD1 4.18Å; I724-L791 HydrophobicContact CG2-CD2 3.89Å; V727-L791 HydrophobicContact CB-CD2 4.25Å; V727-L791 HydrophobicContact CG1-CD2 4.39Å; V727-L791 HydrophobicContact CG2-CD2 4.17Å; F728-L791 HydrophobicContact CE2-CD1 4.01Å; F728-L791 HydrophobicContact CE2-CD2 4.01Å; F728-L791 HydrophobicContact CE2-CG 4.48Å; F728-L791 HydrophobicContact CZ-CD1 3.9Å; F728-L791 HydrophobicContact CZ-CD2 4.19Å; F728-L791 HydrophobicContact CZ-CG 4.29Å; I787-L791 HydrophobicContact CG2-CD1 3.73Å; I787-L791 HydrophobicContact CG2-CG 4.25Å; I787-L791 WeakPolarHBondContact O-CB 3.25Å; I787-L791 WeakPolarHBondContact O-CG 3.37Å; I787-L791 PolarHBondContact O-N 2.78Å; R788-L791 CarbonylContact O-C 3.55Å; R788-L791 PolarHBondContact O-N 3.3Å; L789-L791 PolarHBondContact O-N 2.88Å; L791-P793 VanDerWaalsContact C-N 3.35Å; L791-P793 VanDerWaalsContact O-N 3.15Å; L791-H794 CarbonylContact O-C 3.42Å; L791-H794 WeakPolarHBondContact O-CA 3.27Å; L791-H794 PolarHBondContact O-N 3.49Å; L791-I795 HydrophobicContact CB-CB 4.24Å; L791-I795 HydrophobicContact CB-CD1 3.68Å; L791-I795 HydrophobicContact CB-CG1 3.97Å; L791-I795 HydrophobicContact CD1-CD1 3.47Å; L791-I795 VanDerWaalsContact CD1-CD1 3.47Å; L791-I795 HydrophobicContact CG-CD1 4.2Å; L791-I795 PolarHBondContact O-N 2.98Å; L791-L801 HydrophobicContact CD1-CD1 4.39Å; L791-I804 HydrophobicContact CD1-CG2 4.45Å
792	R	75.4	Confident	81.3	Confident	122 Å²	122	46.4 Å²	46.4	46%	0.46	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-37.2	-179.6	-89.3	-167.6	-179.7	-172.5	2.6	116.5	R788 L789 H794	R788-R792 WeakPolarHBondContact O-CG 3.38Å; R788-R792 PolarHBondContact O-N 3Å; L789-R792 PolarHBondContact O-N 2.97Å; R792-H794 PolarHBondContact O-N 2.97Å
793	P	70.7	Confident	81.3	Confident	77 Å²	77	46.6 Å²	46.6	50%	0.5	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.3	175.4	26.1	-34.8	0	0	0	113.8	L791	L791-P793 VanDerWaalsContact C-N 3.35Å; L791-P793 VanDerWaalsContact O-N 3.15Å
794	H	77.2	Confident	81.4	Confident	38 Å²	38	46.4 Å²	46.4	18%	0.176	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-14.7	-175.8	-59	-49.5	0	0	0	113.6	R720 I724 L791 R792	R720-H794 HydrophobicContact CG-CB 4.5Å; R720-H794 VanDerWaalsContact CZ-O 3.22Å; R720-H794 PolarHBondContact NE-O 2.76Å; R720-H794 PolarHBondContact NH2-O 2.64Å; I724-H794 HydrophobicContact CD1-CB 4.11Å; I724-H794 HydrophobicContact CG1-CB 3.64Å; L791-H794 CarbonylContact O-C 3.42Å; L791-H794 WeakPolarHBondContact O-CA 3.27Å; L791-H794 PolarHBondContact O-N 3.49Å; R792-H794 PolarHBondContact O-N 2.97Å
795	I	80.1	Confident	81.7	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	22%	0.217	C	C	.	.			trans	-130.9	124.3	-175.1	-67.3	-170.4	0	0	0	108.5	I724 L791 T797 D800 L801 I804	I724-I795 HydrophobicContact CD1-CD1 4.36Å; I724-I795 HydrophobicContact CD1-CG1 4.16Å; L791-I795 HydrophobicContact CB-CB 4.24Å; L791-I795 HydrophobicContact CB-CD1 3.68Å; L791-I795 HydrophobicContact CB-CG1 3.97Å; L791-I795 HydrophobicContact CD1-CD1 3.47Å; L791-I795 VanDerWaalsContact CD1-CD1 3.47Å; L791-I795 HydrophobicContact CG-CD1 4.2Å; L791-I795 PolarHBondContact O-N 2.98Å; I795-T797 WeakPolarHBondContact CG2-O 3.4Å; I795-D800 HydrophobicContact CB-CB 4.33Å; I795-D800 HydrophobicContact CG1-CB 4.49Å; I795-D800 HydrophobicContact CG2-CB 3.52Å; I795-L801 HydrophobicContact CD1-CD1 4.45Å; I795-L801 HydrophobicContact CG2-CB 4.18Å; I795-I804 HydrophobicContact CD1-CB 4.16Å; I795-I804 HydrophobicContact CD1-CG1 4.05Å; I795-I804 HydrophobicContact CD1-CG2 4.25Å
796	E	75.4	Confident	82.2	Confident	140 Å²	140	45.2 Å²	45.2	65%	0.654	22%	0.216	S	C	*	.			trans	-101.1	-37.7	-174.7	-70.8	165.5	-136.9	0	0	111.3	R720 D800	R720-E796 IonicContact CZ-OE1 3.68Å; R720-E796 IonicContact NH1-OE1 3.55Å; R720-E796 PolarHBondContact NH1-OE1 3.46Å; R720-E796 IonicContact NH2-OE1 3.95Å; R720-E796 PolarHBondContact NH2-OE1 3.06Å; E796-D800 PolarHBondContact N-OD2 2.6Å
797	T	81.9	Confident	82.5	Confident	64 Å²	64	45.2 Å²	45.2	39%	0.393	22%	0.216	S	C	.	.	S	Bend	trans	-113.1	163.2	-174.3	71.1	0	0	0	0	113.3	I795 Q799 D800 L801	I795-T797 WeakPolarHBondContact CG2-O 3.4Å; T797-Q799 VanDerWaalsContact C-N 3.25Å; T797-Q799 PolarHBondContact O-N 3.42Å; T797-Q799 PolarHBondContact OG1-N 3Å; T797-D800 PolarHBondContact N-OD2 3.09Å; T797-D800 WeakPolarHBondContact O-CB 3.49Å; T797-D800 PolarHBondContact O-N 3.21Å; T797-D800 PolarHBondContact OG1-N 2.89Å; T797-D800 PolarHBondContact OG1-OD1 2.91Å; T797-D800 PolarHBondContact OG1-OD2 2.71Å; T797-L801 PolarHBondContact O-N 2.91Å
798	Q	79.8	Confident	82.7	Confident	126 Å²	126	45.2 Å²	45.2	59%	0.589	22%	0.216	S	C	*	.	H	α-helix	trans	-67.9	-28.1	171.3	-170.4	175.4	6.8	0	0	112.1	L801 H802	Q798-L801 PolarHBondContact O-N 3.38Å; Q798-H802 PolarHBondContact O-N 3.08Å
799	Q	82.9	Confident	83.1	Confident	96 Å²	96	43.6 Å²	43.6	45%	0.449	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-41	174.6	-173	172.5	0.1	0	0	111.2	W668 Y713 T797 L801 H802 L803	W668-Q799 HydrophobicContact CH2-CG 4.44Å; W668-Q799 HydrophobicContact CZ2-CG 4.06Å; Y713-Q799 PolarHBondContact OH-NE2 3.2Å; T797-Q799 VanDerWaalsContact C-N 3.25Å; T797-Q799 PolarHBondContact O-N 3.42Å; T797-Q799 PolarHBondContact OG1-N 3Å; Q799-L801 VanDerWaalsContact C-N 3.32Å; Q799-L801 PolarHBondContact O-N 3.03Å; Q799-H802 PolarHBondContact O-N 3.06Å; Q799-L803 HydrophobicContact CG-CD1 4.14Å; Q799-L803 WeakPolarHBondContact O-CG 3.34Å; Q799-L803 PolarHBondContact O-N 2.84Å
800	D	83.9	Confident	83.4	Confident	18 Å²	18	47.3 Å²	47.3	10%	0.096	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-44.1	174.1	-64.9	-34.4	0	0	0	111.7	W668 I795 E796 T797 I804	W668-D800 PolarHBondContact NE1-OD1 3.46Å; I795-D800 HydrophobicContact CB-CB 4.33Å; I795-D800 HydrophobicContact CG1-CB 4.49Å; I795-D800 HydrophobicContact CG2-CB 3.52Å; E796-D800 PolarHBondContact N-OD2 2.6Å; T797-D800 PolarHBondContact N-OD2 3.09Å; T797-D800 WeakPolarHBondContact O-CB 3.49Å; T797-D800 PolarHBondContact O-N 3.21Å; T797-D800 PolarHBondContact OG1-N 2.89Å; T797-D800 PolarHBondContact OG1-OD1 2.91Å; T797-D800 PolarHBondContact OG1-OD2 2.71Å; D800-I804 WeakPolarHBondContact O-CB 3.35Å; D800-I804 VanDerWaalsContact O-CG1 3.28Å; D800-I804 WeakPolarHBondContact O-CG1 3.14Å; D800-I804 PolarHBondContact O-N 2.97Å
801	L	86.3	Confident	83.8	Confident	16 Å²	16	48 Å²	48	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-46.7	175.9	179.4	66.6	0	0	0	110.9	I787 R788 L791 I795 T797 Q798 Q799 L803 I804 M805	I787-L801 HydrophobicContact CB-CD1 4.46Å; I787-L801 HydrophobicContact CG2-CD1 3.77Å; R788-L801 HydrophobicContact CB-CD2 3.85Å; R788-L801 HydrophobicContact CG-CD2 4.2Å; L791-L801 HydrophobicContact CD1-CD1 4.39Å; I795-L801 HydrophobicContact CD1-CD1 4.45Å; I795-L801 HydrophobicContact CG2-CB 4.18Å; T797-L801 PolarHBondContact O-N 2.91Å; Q798-L801 PolarHBondContact O-N 3.38Å; Q799-L801 VanDerWaalsContact C-N 3.32Å; Q799-L801 PolarHBondContact O-N 3.03Å; L801-L803 PolarHBondContact O-N 2.86Å; L801-I804 PolarHBondContact O-N 3.22Å; L801-M805 HydrophobicContact CD1-CG 4.09Å; L801-M805 HydrophobicContact CD1-SD 4.45Å; L801-M805 HydrophobicContact CG-CG 4.39Å; L801-M805 WeakPolarHBondContact O-CB 3.24Å; L801-M805 VanDerWaalsContact O-CG 3.24Å; L801-M805 WeakPolarHBondContact O-CG 3.04Å; L801-M805 PolarHBondContact O-N 3.25Å
802	H	86.3	Confident	84.1	Confident	112 Å²	112	48 Å²	48	52%	0.519	23%	0.23	S	C	.	.	H	α-helix	trans	-59.1	-49.1	180	-178.3	59.1	0	0	0	112.1	Q798 Q799 M805 E806	Q798-H802 PolarHBondContact O-N 3.08Å; Q799-H802 PolarHBondContact O-N 3.06Å; H802-M805 PolarHBondContact O-N 3.2Å; H802-E806 WeakPolarHBondContact O-CB 3.42Å; H802-E806 PolarHBondContact O-N 2.59Å
803	L	87.3	Confident	84.8	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-39.3	-179.4	-68.7	171.8	0	0	0	112.5	W668 Y713 Q799 L801 E806 L807	W668-L803 HydrophobicContact CD2-CD1 3.81Å; W668-L803 HydrophobicContact CE3-CD1 4.35Å; W668-L803 HydrophobicContact CG-CD1 4.35Å; W668-L803 HydrophobicContact CH2-CD1 4Å; W668-L803 HydrophobicContact CZ2-CD1 3.42Å; W668-L803 VanDerWaalsContact CZ2-CD1 3.42Å; W668-L803 HydrophobicContact CZ3-CD1 4.44Å; Y713-L803 HydrophobicContact CD1-CD1 3.93Å; Y713-L803 HydrophobicContact CD2-CD1 4.45Å; Y713-L803 HydrophobicContact CD2-CD2 3.61Å; Y713-L803 HydrophobicContact CE1-CD1 3.81Å; Y713-L803 HydrophobicContact CE1-CD2 4.39Å; Y713-L803 HydrophobicContact CE2-CD1 4.38Å; Y713-L803 HydrophobicContact CE2-CD2 3.47Å; Y713-L803 VanDerWaalsContact CE2-CD2 3.47Å; Y713-L803 HydrophobicContact CG-CD1 4.22Å; Y713-L803 HydrophobicContact CG-CD2 4.15Å; Q799-L803 HydrophobicContact CG-CD1 4.14Å; Q799-L803 WeakPolarHBondContact O-CG 3.34Å; Q799-L803 PolarHBondContact O-N 2.84Å; L801-L803 PolarHBondContact O-N 2.86Å; L803-E806 PolarHBondContact O-N 2.81Å; L803-L807 WeakPolarHBondContact O-CB 3.44Å; L803-L807 PolarHBondContact O-N 3.3Å
804	I	89.3	Confident	85.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-42.5	175.7	-73	-67.7	0	0	0	111.2	L667 F721 I724 L791 I795 D800 L801 E806 L807 L808	L667-I804 HydrophobicContact CD2-CD1 3.86Å; L667-I804 HydrophobicContact CD2-CG1 3.8Å; F721-I804 HydrophobicContact CD2-CD1 3.85Å; F721-I804 HydrophobicContact CE2-CD1 4.13Å; I724-I804 HydrophobicContact CD1-CD1 3.87Å; I724-I804 HydrophobicContact CD1-CG1 4.15Å; I724-I804 HydrophobicContact CG2-CG2 3.98Å; L791-I804 HydrophobicContact CD1-CG2 4.45Å; I795-I804 HydrophobicContact CD1-CB 4.16Å; I795-I804 HydrophobicContact CD1-CG1 4.05Å; I795-I804 HydrophobicContact CD1-CG2 4.25Å; D800-I804 WeakPolarHBondContact O-CB 3.35Å; D800-I804 VanDerWaalsContact O-CG1 3.28Å; D800-I804 WeakPolarHBondContact O-CG1 3.14Å; D800-I804 PolarHBondContact O-N 2.97Å; L801-I804 PolarHBondContact O-N 3.22Å; I804-E806 VanDerWaalsContact C-N 3.33Å; I804-E806 PolarHBondContact O-N 3.02Å; I804-L807 PolarHBondContact O-N 3.08Å; I804-L808 HydrophobicContact CG2-CD1 4.02Å; I804-L808 HydrophobicContact CG2-CG 4.36Å; I804-L808 WeakPolarHBondContact O-CB 3.13Å; I804-L808 VanDerWaalsContact O-CG 3.24Å; I804-L808 WeakPolarHBondContact O-CG 3.25Å; I804-L808 PolarHBondContact O-N 3.17Å
805	M	90.2	Very high	86.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-39.5	176.5	-67.1	-46.8	-63.3	0	0	111.6	I787 L801 H802 L808 E809 C814 Y832 F834	I787-M805 HydrophobicContact CD1-CE 3.82Å; I787-M805 HydrophobicContact CD1-SD 4.17Å; I787-M805 HydrophobicContact CG2-SD 3.93Å; L801-M805 HydrophobicContact CD1-CG 4.09Å; L801-M805 HydrophobicContact CD1-SD 4.45Å; L801-M805 HydrophobicContact CG-CG 4.39Å; L801-M805 WeakPolarHBondContact O-CB 3.24Å; L801-M805 VanDerWaalsContact O-CG 3.24Å; L801-M805 WeakPolarHBondContact O-CG 3.04Å; L801-M805 PolarHBondContact O-N 3.25Å; H802-M805 PolarHBondContact O-N 3.2Å; M805-L808 PolarHBondContact O-N 3.36Å; M805-L808 HydrophobicContact SD-CD1 4.09Å; M805-E809 WeakPolarHBondContact O-CG 3.4Å; M805-E809 PolarHBondContact O-N 3.05Å; M805-C814 VanDerWaalsContact CE-SG 3.58Å; M805-Y832 HydrophobicContact CB-CE1 3.94Å; M805-Y832 HydrophobicContact CE-CD1 3.33Å; M805-Y832 HydrophobicContact CE-CD2 3.8Å; M805-Y832 HydrophobicContact CE-CE1 3.56Å; M805-Y832 HydrophobicContact CE-CE2 3.99Å; M805-Y832 HydrophobicContact CE-CG 3.46Å; M805-Y832 VanDerWaalsContact CE-CG 3.46Å; M805-Y832 HydrophobicContact CG-CE1 4.26Å; M805-Y832 HydrophobicContact CG-CE2 4.21Å; M805-F834 HydrophobicContact CE-CZ 4.43Å
806	E	88.4	Confident	86.9	Confident	32 Å²	32	37.4 Å²	37.4	15%	0.15	18%	0.179	C	C	.	.	H	α-helix	trans	-64.8	-40.1	174.8	-174.9	160.9	-146.3	0	0	112.7	T709 L710 H802 L803 I804 E809 K810	T709-E806 WeakPolarHBondContact CB-OE1 3.47Å; T709-E806 WeakPolarHBondContact CB-OE2 3.3Å; T709-E806 WeakPolarHBondContact CG2-OE1 3.46Å; T709-E806 PolarHBondContact OG1-OE1 2.82Å; T709-E806 PolarHBondContact OG1-OE2 3.37Å; L710-E806 HydrophobicContact CD2-CB 4.45Å; L710-E806 HydrophobicContact CD2-CG 4.1Å; L710-E806 HydrophobicContact CG-CG 4.3Å; H802-E806 WeakPolarHBondContact O-CB 3.42Å; H802-E806 PolarHBondContact O-N 2.59Å; L803-E806 PolarHBondContact O-N 2.81Å; I804-E806 VanDerWaalsContact C-N 3.33Å; I804-E806 PolarHBondContact O-N 3.02Å; E806-E809 PolarHBondContact O-N 2.91Å; E806-K810 PolarHBondContact O-N 2.8Å
807	L	89.1	Confident	87.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-43	172.9	-179.8	58.4	0	0	0	111.7	L702 F704 L710 F715 F721 L803 I804 K810 M811	L702-L807 HydrophobicContact CD1-CD2 4.43Å; F704-L807 HydrophobicContact CD2-CD1 4.45Å; F704-L807 HydrophobicContact CE2-CD1 3.38Å; F704-L807 HydrophobicContact CZ-CD1 3.41Å; F704-L807 VanDerWaalsContact CZ-CD1 3.41Å; L710-L807 HydrophobicContact CD1-CD1 4.4Å; F715-L807 HydrophobicContact CD1-CD2 4.1Å; F715-L807 HydrophobicContact CE1-CD2 3.98Å; F715-L807 HydrophobicContact CE2-CD2 4.39Å; F715-L807 HydrophobicContact CG-CD2 4.37Å; F715-L807 HydrophobicContact CZ-CD2 4.13Å; F721-L807 HydrophobicContact CD2-CD2 3.98Å; F721-L807 HydrophobicContact CE1-CD2 4.31Å; F721-L807 HydrophobicContact CE2-CD2 3.41Å; F721-L807 VanDerWaalsContact CE2-CD2 3.41Å; F721-L807 HydrophobicContact CE2-CG 4.11Å; F721-L807 HydrophobicContact CZ-CD2 3.6Å; F721-L807 HydrophobicContact CZ-CG 4.05Å; L803-L807 WeakPolarHBondContact O-CB 3.44Å; L803-L807 PolarHBondContact O-N 3.3Å; I804-L807 PolarHBondContact O-N 3.08Å; L807-K810 PolarHBondContact O-N 2.97Å; L807-M811 HydrophobicContact CD1-CG 4.42Å; L807-M811 HydrophobicContact CD1-SD 4.43Å; L807-M811 HydrophobicContact CG-SD 4.3Å; L807-M811 WeakPolarHBondContact O-CB 3.31Å; L807-M811 VanDerWaalsContact O-CG 3.3Å; L807-M811 WeakPolarHBondContact O-CG 3.44Å; L807-M811 PolarHBondContact O-N 2.76Å
808	L	90.3	Very high	86.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.9	-35.8	176.2	-69.5	176.3	0	0	0	112.5	L725 F728 I804 M805 M811 G812 V813	L725-L808 HydrophobicContact CD2-CD2 3.55Å; F728-L808 HydrophobicContact CD2-CD1 4.32Å; F728-L808 HydrophobicContact CE2-CD1 3.79Å; F728-L808 HydrophobicContact CZ-CD1 4.37Å; I804-L808 HydrophobicContact CG2-CD1 4.02Å; I804-L808 HydrophobicContact CG2-CG 4.36Å; I804-L808 WeakPolarHBondContact O-CB 3.13Å; I804-L808 VanDerWaalsContact O-CG 3.24Å; I804-L808 WeakPolarHBondContact O-CG 3.25Å; I804-L808 PolarHBondContact O-N 3.17Å; M805-L808 PolarHBondContact O-N 3.36Å; M805-L808 HydrophobicContact SD-CD1 4.09Å; L808-M811 PolarHBondContact O-N 3.41Å; L808-G812 PolarHBondContact O-N 3.22Å; L808-V813 HydrophobicContact CB-CB 4.26Å; L808-V813 HydrophobicContact CD2-CB 4.2Å; L808-V813 HydrophobicContact CD2-CG1 4.3Å; L808-V813 HydrophobicContact CD2-CG2 4.1Å; L808-V813 WeakPolarHBondContact O-CB 3.19Å; L808-V813 PolarHBondContact O-N 2.86Å
809	E	89.1	Confident	85.8	Confident	31 Å²	31	36.6 Å²	36.6	15%	0.145	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-48.5	170	-74.2	-171.9	174.2	0	0	110.9	M805 E806 M811 G812 C814 C816 K819	M805-E809 WeakPolarHBondContact O-CG 3.4Å; M805-E809 PolarHBondContact O-N 3.05Å; E806-E809 PolarHBondContact O-N 2.91Å; E809-M811 VanDerWaalsContact C-N 3.3Å; E809-M811 PolarHBondContact O-N 2.66Å; E809-G812 PolarHBondContact O-N 3.46Å; E809-C814 WeakPolarHBondContact CA-O 3.48Å; E809-C814 WeakPolarHBondContact CG-O 3.34Å; E809-C816 WeakPolarHBondContact OE1-CB 3.37Å; E809-C816 PolarHBondContact OE1-N 2.95Å; E809-K819 IonicContact OE2-NZ 3.79Å; E809-K819 PolarHBondContact OE2-NZ 2.78Å
810	K	86.5	Confident	84.4	Confident	109 Å²	109	35 Å²	35	47%	0.474	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-36.4	178.7	-171.2	63.4	177.7	-179.9	0	112.3	L710 E806 L807 G812	L710-K810 HydrophobicContact CD1-CB 4.19Å; L710-K810 HydrophobicContact CD1-CG 4.33Å; E806-K810 PolarHBondContact O-N 2.8Å; L807-K810 PolarHBondContact O-N 2.97Å; K810-G812 PolarHBondContact O-N 3.26Å
811	M	86.2	Confident	82.6	Confident	17 Å²	17	46.5 Å²	46.5	8%	0.084	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-8	173	-69.2	-178.9	75.2	0	0	113.4	F480 F721 L807 L808 E809 V813 R882	F480-M811 HydrophobicContact CB-CE 4.03Å; F480-M811 HydrophobicContact CD1-CE 4.16Å; F480-M811 HydrophobicContact CD2-CE 3.37Å; F480-M811 HydrophobicContact CE2-CB 4.35Å; F480-M811 HydrophobicContact CE2-CE 3.84Å; F480-M811 HydrophobicContact CG-CE 3.58Å; F480-M811 HydrophobicContact CZ-CB 4.17Å; F480-M811 HydrophobicContact CZ-CE 4.4Å; F480-M811 WeakPolarHBondContact CZ-O 3.49Å; F721-M811 HydrophobicContact CE1-CE 4.36Å; F721-M811 HydrophobicContact CE1-SD 3.94Å; F721-M811 HydrophobicContact CZ-CE 4.39Å; F721-M811 HydrophobicContact CZ-SD 3.51Å; F721-M811 VanDerWaalsContact CZ-SD 3.51Å; L807-M811 HydrophobicContact CD1-CG 4.42Å; L807-M811 HydrophobicContact CD1-SD 4.43Å; L807-M811 HydrophobicContact CG-SD 4.3Å; L807-M811 WeakPolarHBondContact O-CB 3.31Å; L807-M811 VanDerWaalsContact O-CG 3.3Å; L807-M811 WeakPolarHBondContact O-CG 3.44Å; L807-M811 PolarHBondContact O-N 2.76Å; L808-M811 PolarHBondContact O-N 3.41Å; E809-M811 VanDerWaalsContact C-N 3.3Å; E809-M811 PolarHBondContact O-N 2.66Å; M811-V813 HydrophobicContact CB-CG2 4.03Å; M811-R882 PolarHBondContact O-NE 3.26Å
812	G	89.3	Confident	80.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	26.8	-179.3	0	0	0	0	0	113.7	L808 E809 K810 V885	L808-G812 PolarHBondContact O-N 3.22Å; E809-G812 PolarHBondContact O-N 3.46Å; K810-G812 PolarHBondContact O-N 3.26Å; G812-V885 WeakPolarHBondContact O-CG2 3.24Å
813	V	91.5	Very high	78.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-85.1	-42	179.6	176.1	0	0	0	0	111.5	L476 I477 F729 L808 M811 F834	L476-V813 HydrophobicContact CD2-CB 4.45Å; L476-V813 HydrophobicContact CD2-CG2 3.79Å; I477-V813 HydrophobicContact CG2-CG2 4.17Å; F729-V813 HydrophobicContact CE2-CG1 4.17Å; F729-V813 HydrophobicContact CZ-CG1 3.87Å; L808-V813 HydrophobicContact CB-CB 4.26Å; L808-V813 HydrophobicContact CD2-CB 4.2Å; L808-V813 HydrophobicContact CD2-CG1 4.3Å; L808-V813 HydrophobicContact CD2-CG2 4.1Å; L808-V813 WeakPolarHBondContact O-CB 3.19Å; L808-V813 PolarHBondContact O-N 2.86Å; M811-V813 HydrophobicContact CB-CG2 4.03Å; V813-F834 HydrophobicContact CG1-CD1 3.97Å; V813-F834 HydrophobicContact CG1-CE1 3.97Å
814	C	92.3	Very high	76.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.281	C	S	.	.			trans	-146	168	-179.2	61.6	0	0	0	0	111.6	M805 E809 K833 F834 V885	M805-C814 VanDerWaalsContact CE-SG 3.58Å; E809-C814 WeakPolarHBondContact CA-O 3.48Å; E809-C814 WeakPolarHBondContact CG-O 3.34Å; C814-K833 CarbonylContact C-O 3.56Å; C814-K833 WeakPolarHBondContact CA-O 2.95Å; C814-K833 VanDerWaalsContact CB-O 3.22Å; C814-K833 WeakPolarHBondContact CB-O 3.04Å; C814-F834 HydrophobicContact CB-CD1 3.76Å; C814-F834 HydrophobicContact CB-CD2 4.09Å; C814-F834 HydrophobicContact CB-CE1 3.7Å; C814-F834 HydrophobicContact CB-CE2 4.03Å; C814-F834 HydrophobicContact CB-CG 3.96Å; C814-F834 HydrophobicContact CB-CZ 3.83Å; C814-V885 VanDerWaalsContact O-CG1 3.26Å; C814-V885 WeakPolarHBondContact O-CG1 3.47Å
815	Y	90.4	Very high	73.8	Confident	15 Å²	15	65.6 Å²	65.6	6%	0.059	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.4	168.4	64.1	-94.4	0	0	0	111.7	I817 Y832 K833 P835 V885 N888	Y815-I817 HydrophobicContact CE2-CG1 4.08Å; Y815-Y832 WeakPolarHBondContact O-CA 3.4Å; Y815-K833 HydrophobicContact CD1-CB 4.2Å; Y815-K833 HydrophobicContact CD2-CB 4.29Å; Y815-K833 HydrophobicContact CE1-CB 3.74Å; Y815-K833 HydrophobicContact CE1-CG 3.79Å; Y815-K833 HydrophobicContact CE2-CB 3.84Å; Y815-K833 HydrophobicContact CE2-CG 4.45Å; Y815-K833 HydrophobicContact CG-CB 4.47Å; Y815-K833 PolarHBondContact N-O 2.96Å; Y815-K833 PolarHBondContact O-N 2.94Å; Y815-P835 HydrophobicContact CD1-CG 4.16Å; Y815-P835 HydrophobicContact CE1-CG 3.9Å; Y815-V885 HydrophobicContact CD1-CG2 4.13Å; Y815-N888 HydrophobicContact CD2-CB 4.13Å; Y815-N888 WeakPolarHBondContact CD2-OD1 3.32Å; Y815-N888 VanDerWaalsContact CE2-OD1 3.23Å; Y815-N888 WeakPolarHBondContact CE2-OD1 3.49Å; Y815-N888 HydrophobicContact CG-CB 4.08Å
816	C	88.4	Confident	71.5	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.034	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.8	169.8	-178	0	0	0	0	111.5	E809 K819 V830 Y832 N888	E809-C816 WeakPolarHBondContact OE1-CB 3.37Å; E809-C816 PolarHBondContact OE1-N 2.95Å; C816-K819 HydrophobicContact CB-CB 4.37Å; C816-V830 WeakPolarHBondContact SG-CG1 3.43Å; C816-Y832 HydrophobicContact CB-CD1 4.14Å; C816-Y832 HydrophobicContact CB-CE1 3.83Å; C816-N888 PolarHBondContact O-ND2 3.25Å
817	I	83.2	Confident	69.7	Low	57 Å²	57	73.4 Å²	73.4	29%	0.292	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	130	170.3	-61.8	172	0	0	0	108.1	L781 Y815 W831 K833	L781-I817 HydrophobicContact CD2-CD1 3.36Å; Y815-I817 HydrophobicContact CE2-CG1 4.08Å; I817-W831 HydrophobicContact CB-CB 4.36Å; I817-W831 HydrophobicContact CD1-CB 4.22Å; I817-W831 PolarHBondContact N-O 2.8Å; I817-K833 HydrophobicContact CD1-CB 4.24Å; I817-K833 HydrophobicContact CG1-CB 4.36Å
818	N	68.3	Low	68.3	Low	148 Å²	148	77.1 Å²	77.1	79%	0.791	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	51.8	179.3	-59.7	-28.5	0	0	0	113.8	P820	N818-P820 VanDerWaalsContact O-CD 3.24Å; N818-P820 WeakPolarHBondContact O-CD 3.49Å
819	K	62.9	Low	67.1	Low	107 Å²	107	80.6 Å²	80.6	47%	0.465	43%	0.427	S	S	.	.			trans	-52.5	112.1	178.2	-163.6	166.6	-173.2	165.2	0	109.7	E809 C816 R821	E809-K819 IonicContact OE2-NZ 3.79Å; E809-K819 PolarHBondContact OE2-NZ 2.78Å; C816-K819 HydrophobicContact CB-CB 4.37Å; K819-R821 PolarHBondContact O-N 2.93Å
820	P	54	Low	66.8	Low	64 Å²	64	81 Å²	81	42%	0.416	43%	0.432	S	S	.	.			trans	-69.1	127.6	-176.8	27.6	-32.8	0	0	0	108.8	N818 T822	N818-P820 VanDerWaalsContact O-CD 3.24Å; N818-P820 WeakPolarHBondContact O-CD 3.49Å; P820-T822 WeakPolarHBondContact CB-O 3.01Å; P820-T822 PolarHBondContact O-N 3.49Å; P820-T822 VanDerWaalsContact O-N 3.14Å
821	R	46	Very low	66.7	Low	259 Å²	259	80.2 Å²	80.2	98%	0.977	43%	0.426	S	S	*	.	S	Bend	trans	-67.4	-9	-178.6	-72.9	-176.4	172.8	179.2	-3.1	113.7	K819	K819-R821 PolarHBondContact O-N 2.93Å
822	T	43.6	Very low	66.9	Low	104 Å²	104	80.4 Å²	80.4	64%	0.638	43%	0.426	S	S	*	.	S	Bend	trans	-142.9	165.2	176.1	50.2	0	0	0	0	109.5	P820	P820-T822 WeakPolarHBondContact CB-O 3.01Å; P820-T822 PolarHBondContact O-N 3.49Å; P820-T822 VanDerWaalsContact O-N 3.14Å
823	K	41	Very low	66.9	Low	193 Å²	193	81.7 Å²	81.7	84%	0.839	43%	0.431	S	S	*	.	S	Bend	trans	-42.7	131.3	173.4	-77.3	-177.3	178.1	179.3	0	110	L825	K823-L825 PolarHBondContact O-N 2.82Å
824	P	39.4	Very low	66.9	Low	83 Å²	83	81.7 Å²	81.7	54%	0.539	43%	0.431	S	S	.	.			trans	-61.6	110.3	-174.9	23.1	-31.1	0	0	0	109.1	N826	P824-N826 PolarHBondContact O-N 3.24Å
825	L	39.8	Very low	66.6	Low	153 Å²	153	82.4 Å²	82.4	80%	0.801	44%	0.436	S	S	*	.	S	Bend	trans	-74	-2.9	-178.5	-100.6	155.8	0	0	0	113.4	K823	K823-L825 PolarHBondContact O-N 2.82Å
826	N	42.4	Very low	66.4	Low	142 Å²	142	82.9 Å²	82.9	76%	0.759	44%	0.442	S	S	*	.	S	Bend	trans	-148.1	129.1	170.3	-77.9	-39.8	0	0	0	107.1	P824 A828	P824-N826 PolarHBondContact O-N 3.24Å; N826-A828 PolarHBondContact O-N 3.45Å
827	G	50.9	Low	66.1	Low	54 Å²	54	82.9 Å²	82.9	56%	0.557	44%	0.441	S	S	*	.			trans	-65.7	59.2	-171.9	0	0	0	0	0	115.8	K760	K760-G827 PolarHBondContact NZ-O 2.85Å
828	A	57.7	Low	66	Low	79 Å²	79	80.6 Å²	80.6	65%	0.653	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-73.7	133.1	168.9	0	0	0	0	0	109.6	N826 V830	N826-A828 PolarHBondContact O-N 3.45Å; A828-V830 PolarHBondContact O-N 2.85Å
829	T	67.1	Low	66.2	Low	72 Å²	72	76.5 Å²	76.5	44%	0.442	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-62.9	122.1	176.3	40.4	0	0	0	0	110.3
830	V	81.3	Confident	66.5	Low	41 Å²	41	72.7 Å²	72.7	25%	0.248	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-72.8	135.1	175.5	-180	0	0	0	0	109.6	S784 C816 A828 Y832	S784-V830 WeakPolarHBondContact CB-O 3.27Å; S784-V830 PolarHBondContact N-O 3.07Å; S784-V830 PolarHBondContact OG-O 2.88Å; C816-V830 WeakPolarHBondContact SG-CG1 3.43Å; A828-V830 PolarHBondContact O-N 2.85Å; V830-Y832 HydrophobicContact CG1-CD2 4.42Å; V830-Y832 HydrophobicContact CG1-CE2 3.81Å
831	W	85.3	Confident	66.8	Low	91 Å²	91	76.6 Å²	76.6	35%	0.345	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.4	179.2	-73.3	81	0	0	0	111.4	H772 L781 P783 I817	H772-W831 AromaticContact CE1-CH2 3.87Å; H772-W831 AromaticContact ND1-CH2 3.93Å; L781-W831 HydrophobicContact CB-CE3 4.3Å; L781-W831 HydrophobicContact CB-CZ3 4.3Å; P783-W831 HydrophobicContact CB-CD2 4.08Å; P783-W831 HydrophobicContact CB-CE3 4.2Å; P783-W831 HydrophobicContact CB-CH2 4.3Å; P783-W831 HydrophobicContact CB-CZ2 4.17Å; P783-W831 HydrophobicContact CB-CZ3 4.31Å; P783-W831 HydrophobicContact CG-CH2 4.29Å; P783-W831 HydrophobicContact CG-CZ3 4.32Å; I817-W831 HydrophobicContact CB-CB 4.36Å; I817-W831 HydrophobicContact CD1-CB 4.22Å; I817-W831 PolarHBondContact N-O 2.8Å
832	Y	89.3	Confident	67.3	Low	22 Å²	22	71 Å²	71	9%	0.086	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.9	176.2	-68	-90.1	0	0	0	110.6	L782 I787 M805 Y815 C816 V830	L782-Y832 PolarHBondContact N-O 3.12Å; L782-Y832 PolarHBondContact O-N 3.29Å; I787-Y832 HydrophobicContact CD1-CD2 3.59Å; I787-Y832 HydrophobicContact CD1-CE2 4.36Å; I787-Y832 HydrophobicContact CD1-CG 4.05Å; M805-Y832 HydrophobicContact CB-CE1 3.94Å; M805-Y832 HydrophobicContact CE-CD1 3.33Å; M805-Y832 HydrophobicContact CE-CD2 3.8Å; M805-Y832 HydrophobicContact CE-CE1 3.56Å; M805-Y832 HydrophobicContact CE-CE2 3.99Å; M805-Y832 HydrophobicContact CE-CG 3.46Å; M805-Y832 VanDerWaalsContact CE-CG 3.46Å; M805-Y832 HydrophobicContact CG-CE1 4.26Å; M805-Y832 HydrophobicContact CG-CE2 4.21Å; Y815-Y832 WeakPolarHBondContact O-CA 3.4Å; C816-Y832 HydrophobicContact CB-CD1 4.14Å; C816-Y832 HydrophobicContact CB-CE1 3.83Å; V830-Y832 HydrophobicContact CG1-CD2 4.42Å; V830-Y832 HydrophobicContact CG1-CE2 3.81Å
833	K	90	Very high	67.9	Low	26 Å²	26	66.7 Å²	66.7	11%	0.113	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.6	173.4	-173.7	79.9	168.2	-171.9	0	109.7	D779 G780 L781 C814 Y815 I817 P835	D779-K833 WeakPolarHBondContact O-CD 3.49Å; D779-K833 WeakPolarHBondContact O-CE 3.4Å; D779-K833 PolarHBondContact O-NZ 2.95Å; G780-K833 CarbonylContact O-C 3.57Å; G780-K833 WeakPolarHBondContact O-CA 3.17Å; L781-K833 HydrophobicContact CD2-CB 4.21Å; L781-K833 HydrophobicContact CD2-CD 3.46Å; L781-K833 VanDerWaalsContact CD2-CD 3.46Å; L781-K833 HydrophobicContact CD2-CG 4.43Å; L781-K833 HydrophobicContact CG-CD 3.82Å; C814-K833 CarbonylContact C-O 3.56Å; C814-K833 WeakPolarHBondContact CA-O 2.95Å; C814-K833 VanDerWaalsContact CB-O 3.22Å; C814-K833 WeakPolarHBondContact CB-O 3.04Å; Y815-K833 HydrophobicContact CD1-CB 4.2Å; Y815-K833 HydrophobicContact CD2-CB 4.29Å; Y815-K833 HydrophobicContact CE1-CB 3.74Å; Y815-K833 HydrophobicContact CE1-CG 3.79Å; Y815-K833 HydrophobicContact CE2-CB 3.84Å; Y815-K833 HydrophobicContact CE2-CG 4.45Å; Y815-K833 HydrophobicContact CG-CB 4.47Å; Y815-K833 PolarHBondContact N-O 2.96Å; Y815-K833 PolarHBondContact O-N 2.94Å; I817-K833 HydrophobicContact CD1-CB 4.24Å; I817-K833 HydrophobicContact CG1-CB 4.36Å; K833-P835 WeakPolarHBondContact O-CD 3.5Å
834	F	90.8	Very high	68.1	Low	1 Å²	1	64.3 Å²	64.3	0%	0.004	36%	0.363	C	S	.	.			trans	-112.7	95.5	174.1	-68.8	-103.5	0	0	0	109.2	F728 F776 G780 L782 I787 M805 V813 C814 S836 Y837	F728-F834 AromaticContact CD1-CE1 3.88Å; F728-F834 HydrophobicContact CD1-CE1 3.88Å; F728-F834 AromaticContact CD1-CZ 3.92Å; F728-F834 HydrophobicContact CD1-CZ 3.92Å; F728-F834 HydrophobicContact CE1-CE1 4.11Å; F728-F834 AromaticContact CE1-CZ 3.7Å; F728-F834 HydrophobicContact CE1-CZ 3.7Å; F728-F834 HydrophobicContact CG-CE1 4.24Å; F728-F834 HydrophobicContact CZ-CZ 4.26Å; F776-F834 HydrophobicContact CD2-CD2 4.42Å; F776-F834 HydrophobicContact CE2-CB 3.96Å; F776-F834 HydrophobicContact CE2-CD1 4.45Å; F776-F834 AromaticContact CE2-CD2 3.62Å; F776-F834 HydrophobicContact CE2-CD2 3.62Å; F776-F834 HydrophobicContact CE2-CE2 4.2Å; F776-F834 AromaticContact CE2-CG 3.76Å; F776-F834 HydrophobicContact CE2-CG 3.76Å; F776-F834 HydrophobicContact CZ-CD2 4.49Å; F776-F834 HydrophobicContact CZ-CG 4.41Å; G780-F834 PolarHBondContact O-N 3.09Å; L782-F834 HydrophobicContact CB-CE2 4.5Å; I787-F834 HydrophobicContact CD1-CE2 4.45Å; M805-F834 HydrophobicContact CE-CZ 4.43Å; V813-F834 HydrophobicContact CG1-CD1 3.97Å; V813-F834 HydrophobicContact CG1-CE1 3.97Å; C814-F834 HydrophobicContact CB-CD1 3.76Å; C814-F834 HydrophobicContact CB-CD2 4.09Å; C814-F834 HydrophobicContact CB-CE1 3.7Å; C814-F834 HydrophobicContact CB-CE2 4.03Å; C814-F834 HydrophobicContact CB-CG 3.96Å; C814-F834 HydrophobicContact CB-CZ 3.83Å; F834-S836 PolarHBondContact O-N 3.24Å; F834-Y837 HydrophobicContact CB-CD2 3.94Å; F834-Y837 PolarHBondContact O-N 3.26Å; F834-Y837 VanDerWaalsContact O-N 3.07Å
835	P	87.4	Confident	67.9	Low	15 Å²	15	65.1 Å²	65.1	10%	0.097	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-58.6	-26.4	-174	-28.9	37.6	0	0	0	114.3	Y815 K833 Y837 V838 A881 S884 V885	Y815-P835 HydrophobicContact CD1-CG 4.16Å; Y815-P835 HydrophobicContact CE1-CG 3.9Å; K833-P835 WeakPolarHBondContact O-CD 3.5Å; P835-Y837 PolarHBondContact O-N 3.25Å; P835-V838 PolarHBondContact O-N 3.03Å; P835-A881 HydrophobicContact CB-CB 4.13Å; P835-S884 VanDerWaalsContact CG-OG 3.31Å; P835-S884 WeakPolarHBondContact CG-OG 3.45Å; P835-V885 HydrophobicContact CG-CG2 3.89Å
836	S	84.8	Confident	67.5	Low	25 Å²	25	66.5 Å²	66.5	18%	0.175	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-63.6	-23.2	179.4	70.8	0	0	0	0	113.8	R731 F834	R731-S836 VanDerWaalsContact NH2-C 3.25Å; R731-S836 PolarHBondContact NH2-O 3.23Å; R731-S836 PolarHBondContact NH2-OG 2.8Å; F834-S836 PolarHBondContact O-N 3.24Å
837	Y	82.6	Confident	66.9	Low	5 Å²	5	64.8 Å²	64.8	2%	0.02	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-90.6	-10.4	-177.4	-83.6	-91.7	0	0	0	114.2	F728 R731 F776 L777 F834 P835 S839	F728-Y837 VanDerWaalsContact O-CE2 3.3Å; F728-Y837 WeakPolarHBondContact O-CE2 3.24Å; F728-Y837 VanDerWaalsContact O-CZ 3.28Å; F728-Y837 PolarHBondContact O-OH 3.31Å; R731-Y837 HydrophobicContact CB-CE1 4.41Å; R731-Y837 HydrophobicContact CG-CE1 3.66Å; R731-Y837 WeakPolarHBondContact CG-OH 3.01Å; F776-Y837 HydrophobicContact CD1-CE1 4.31Å; F776-Y837 HydrophobicContact CE1-CD1 4.32Å; F776-Y837 HydrophobicContact CE1-CD2 4.5Å; F776-Y837 AromaticContact CE1-CE1 3.78Å; F776-Y837 HydrophobicContact CE1-CE1 3.78Å; F776-Y837 AromaticContact CE1-CE2 3.99Å; F776-Y837 HydrophobicContact CE1-CE2 3.99Å; F776-Y837 AromaticContact CE1-CZ 3.55Å; F776-Y837 AromaticContact CE2-CD2 3.92Å; F776-Y837 HydrophobicContact CE2-CD2 3.92Å; F776-Y837 HydrophobicContact CE2-CE2 4.05Å; F776-Y837 HydrophobicContact CE2-CG 4.18Å; F776-Y837 HydrophobicContact CZ-CD1 4.33Å; F776-Y837 AromaticContact CZ-CD2 3.77Å; F776-Y837 HydrophobicContact CZ-CD2 3.77Å; F776-Y837 HydrophobicContact CZ-CE1 4.01Å; F776-Y837 AromaticContact CZ-CE2 3.4Å; F776-Y837 HydrophobicContact CZ-CE2 3.4Å; F776-Y837 VanDerWaalsContact CZ-CE2 3.4Å; F776-Y837 HydrophobicContact CZ-CG 4.19Å; F776-Y837 AromaticContact CZ-CZ 3.5Å; F776-Y837 WeakPolarHBondContact O-CB 3.49Å; L777-Y837 HydrophobicContact CD2-CD1 4.23Å; L777-Y837 HydrophobicContact CD2-CE1 3.8Å; F834-Y837 HydrophobicContact CB-CD2 3.94Å; F834-Y837 PolarHBondContact O-N 3.26Å; F834-Y837 VanDerWaalsContact O-N 3.07Å; P835-Y837 PolarHBondContact O-N 3.25Å; Y837-S839 PolarHBondContact O-N 3.43Å; Y837-S839 VanDerWaalsContact O-N 3.09Å; Y837-S839 PolarHBondContact O-OG 3.09Å
838	V	81.9	Confident	66	Low	9 Å²	9	68 Å²	68	6%	0.055	37%	0.366	C	S	.	.			trans	-63.7	114.2	-178.1	178.5	0	0	0	0	109.8	P835 D896	P835-V838 PolarHBondContact O-N 3.03Å; V838-D896 WeakPolarHBondContact CG1-O 3.35Å
839	S	71.9	Confident	64.8	Low	62 Å²	62	70.7 Å²	70.7	43%	0.434	37%	0.374	S	S	.	.			trans	-96.6	-19.3	-177.6	-62.7	0	0	0	0	113.4	H778 Y837 E841	H778-S839 PolarHBondContact O-N 3.43Å; Y837-S839 PolarHBondContact O-N 3.43Å; Y837-S839 VanDerWaalsContact O-N 3.09Å; Y837-S839 PolarHBondContact O-OG 3.09Å; S839-E841 PolarHBondContact O-N 3.07Å
840	S	70.1	Confident	63	Low	27 Å²	27	70.2 Å²	70.2	19%	0.189	38%	0.384	C	S	.	.			trans	-65.1	130	177	-174.7	0	0	0	0	111.6	E842 R898	S840-E842 PolarHBondContact OG-N 2.87Å; S840-E842 PolarHBondContact OG-O 3.34Å; S840-R898 WeakPolarHBondContact O-CB 3.42Å; S840-R898 PolarHBondContact O-N 3.23Å
841	E	60.3	Low	60.4	Low	145 Å²	145	72.3 Å²	72.3	68%	0.678	41%	0.413	S	S	*	.	S	Bend	trans	-72.6	-31.4	175.6	-65.2	-164.8	160.6	0	0	112	S839	S839-E841 PolarHBondContact O-N 3.07Å
842	E	55.8	Low	57.5	Low	143 Å²	143	74.9 Å²	74.9	67%	0.668	43%	0.434	S	S	*	.	S	Bend	trans	-110.8	143.5	-178.2	-65.2	-176.7	173.6	0	0	111.9	S840 Q844	S840-E842 PolarHBondContact OG-N 2.87Å; S840-E842 PolarHBondContact OG-O 3.34Å; E842-Q844 PolarHBondContact O-N 3.21Å
843	A	55.5	Low	54.5	Low	13 Å²	13	78.8 Å²	78.8	11%	0.107	46%	0.464	C	S	.	.			trans	-75.1	100	170.4	0	0	0	0	0	108.7	S895 F902	A843-S895 WeakPolarHBondContact CB-OG 3.36Å; A843-F902 HydrophobicContact CB-CB 4.4Å
844	Q	45.1	Very low	51.7	Low	142 Å²	142	85 Å²	85	66%	0.664	50%	0.498	S	S	*	.			trans	-74.8	133.7	179.8	-66.8	-175.3	-9.5	0	0	110.3	E842 S895	E842-Q844 PolarHBondContact O-N 3.21Å; Q844-S895 PolarHBondContact O-OG 3.16Å
845	F	36.5	Very low	48.8	Very low	100 Å²	100	91.6 Å²	91.6	44%	0.439	53%	0.533	S	S	.	.			trans	-114.3	103.4	172.2	-153.4	-95.4	0	0	0	106.8	D847	F845-D847 HydrophobicContact CD1-CB 4.16Å; F845-D847 HydrophobicContact CE1-CB 4.08Å; F845-D847 WeakPolarHBondContact CE1-OD1 3.43Å; F845-D847 WeakPolarHBondContact CE1-OD2 3.38Å
846	E	31.8	Very low	46.8	Very low	183 Å²	183	96.1 Å²	96.1	86%	0.855	56%	0.556	S	S	*	*			trans	-95.5	92	162.7	-75.9	-166.6	161.9	0	0	107.5	S848	E846-S848 PolarHBondContact O-N 2.88Å; E846-S848 VanDerWaalsContact O-N 3.15Å
847	D	29.8	Very low	44.3	Very low	106 Å²	106	99.7 Å²	99.7	57%	0.567	58%	0.581	S	S	*	*			trans	-70	104.9	159.8	-110.8	-8.9	0	0	0	106.8	F845 V849	F845-D847 HydrophobicContact CD1-CB 4.16Å; F845-D847 HydrophobicContact CE1-CB 4.08Å; F845-D847 WeakPolarHBondContact CE1-OD1 3.43Å; F845-D847 WeakPolarHBondContact CE1-OD2 3.38Å; D847-V849 PolarHBondContact O-N 2.73Å
848	S	31.2	Very low	42.5	Very low	120 Å²	120	103.3 Å²	103.3	84%	0.839	61%	0.605	S	S	*	*	S	Bend	trans	-73.3	48.3	167.9	59.9	0	0	0	0	111.2	E846	E846-S848 PolarHBondContact O-N 2.88Å; E846-S848 VanDerWaalsContact O-N 3.15Å
849	V	31.6	Very low	40.7	Very low	136 Å²	136	108.7 Å²	108.7	82%	0.824	63%	0.633	S	S	*	*	S	Bend	trans	-154.4	77.5	160.1	-172.5	0	0	0	0	107.8	D847	D847-V849 PolarHBondContact O-N 2.73Å
850	G	30.6	Very low	39.5	Very low	63 Å²	63	110.4 Å²	110.4	65%	0.649	63%	0.633	S	S	*	*	S	Bend	trans	111.8	92.6	171.5	0	0	0	0	0	113.4	N852	G850-N852 PolarHBondContact O-N 3.41Å
851	G	25.3	Very low	38.6	Very low	84 Å²	84	113.8 Å²	113.8	87%	0.866	66%	0.657	S	S	*	*			trans	-64.4	86.9	-178.9	0	0	0	0	0	114.1
852	N	25.1	Very low	38.8	Very low	146 Å²	146	109.6 Å²	109.6	78%	0.781	64%	0.641	S	S	*	*			trans	-131.7	110.8	159	-88.7	-19.1	0	0	0	108.6	G850 L854	G850-N852 PolarHBondContact O-N 3.41Å; N852-L854 PolarHBondContact O-N 3.48Å; N852-L854 VanDerWaalsContact O-N 3.12Å
853	S	25.3	Very low	39.5	Very low	104 Å²	104	103.5 Å²	103.5	73%	0.727	61%	0.612	S	S	*	*			trans	-63.6	106.8	167.7	52.9	0	0	0	0	109.2	N855	S853-N855 PolarHBondContact O-N 3.29Å; S853-N855 VanDerWaalsContact O-N 3.08Å
854	L	32.8	Very low	40.5	Very low	156 Å²	156	104.1 Å²	104.1	82%	0.817	61%	0.613	S	S	*	*			trans	-71.7	100.1	172.5	-81.8	160.5	0	0	0	109.1	N852 L856	N852-L854 PolarHBondContact O-N 3.48Å; N852-L854 VanDerWaalsContact O-N 3.12Å; L854-L856 PolarHBondContact O-N 2.73Å; L854-L856 VanDerWaalsContact O-N 3.09Å
855	N	28.7	Very low	42.4	Very low	139 Å²	139	97.5 Å²	97.5	74%	0.743	58%	0.582	S	S	*	*			trans	-60.4	109.8	167.3	-81.9	-23.7	0	0	0	109.5	S853 S857	S853-N855 PolarHBondContact O-N 3.29Å; S853-N855 VanDerWaalsContact O-N 3.08Å; N855-S857 PolarHBondContact O-N 2.8Å
856	L	45.1	Very low	45	Very low	110 Å²	110	94.5 Å²	94.5	58%	0.576	57%	0.568	S	S	*	*			trans	-77.4	81.3	176	-84.5	146.3	0	0	0	110.6	L854	L854-L856 PolarHBondContact O-N 2.73Å; L854-L856 VanDerWaalsContact O-N 3.09Å
857	S	33.1	Very low	47.8	Very low	100 Å²	100	85.8 Å²	85.8	70%	0.699	53%	0.527	S	S	*	.			trans	-145.2	149.5	160.1	58.6	0	0	0	0	110.3	N855	N855-S857 PolarHBondContact O-N 2.8Å
858	P	45.3	Very low	50.9	Low	82 Å²	82	82.8 Å²	82.8	53%	0.532	51%	0.51	S	S	.	.				-88.7	126.7	-88.9	33.1	-27.6	0	0	0	112.8	F860	P858-F860 HydrophobicContact CB-CD2 3.45Å; P858-F860 VanDerWaalsContact CB-CD2 3.45Å; P858-F860 HydrophobicContact CB-CE1 4.3Å; P858-F860 HydrophobicContact CB-CE2 3.2Å; P858-F860 HydrophobicContact CB-CG 4.11Å; P858-F860 HydrophobicContact CB-CZ 3.65Å; P858-F860 HydrophobicContact CG-CD2 3.28Å; P858-F860 HydrophobicContact CG-CE2 3.08Å; P858-F860 HydrophobicContact CG-CG 4.34Å; P858-F860 HydrophobicContact CG-CZ 4.02Å; P858-F860 PolarHBondContact O-N 2.9Å
859	L	43.6	Very low	53.9	Low	122 Å²	122	77.1 Å²	77.1	64%	0.639	47%	0.47	S	S	*	.			trans	-70.4	68	172.2	-77.9	147.4	0	0	0	111.2	S861 Q864	L859-S861 VanDerWaalsContact C-N 3.27Å; L859-S861 PolarHBondContact O-N 3.44Å; L859-Q864 PolarHBondContact O-NE2 3.05Å
860	F	47.4	Very low	56.8	Low	97 Å²	97	71.1 Å²	71.1	43%	0.425	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	10	177.4	-70.8	-53.8	0	0	0	114.3	P858 V862 L973	P858-F860 HydrophobicContact CB-CD2 3.45Å; P858-F860 VanDerWaalsContact CB-CD2 3.45Å; P858-F860 HydrophobicContact CB-CE1 4.3Å; P858-F860 HydrophobicContact CB-CE2 3.2Å; P858-F860 HydrophobicContact CB-CG 4.11Å; P858-F860 HydrophobicContact CB-CZ 3.65Å; P858-F860 HydrophobicContact CG-CD2 3.28Å; P858-F860 HydrophobicContact CG-CE2 3.08Å; P858-F860 HydrophobicContact CG-CG 4.34Å; P858-F860 HydrophobicContact CG-CZ 4.02Å; P858-F860 PolarHBondContact O-N 2.9Å; F860-V862 PolarHBondContact O-N 3.23Å; F860-L973 WeakPolarHBondContact CD1-O 3.43Å
861	S	51.4	Low	59.7	Low	99 Å²	99	68.3 Å²	68.3	69%	0.692	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.7	-170.7	-51.8	0	0	0	0	114.8	L859	L859-S861 VanDerWaalsContact C-N 3.27Å; L859-S861 PolarHBondContact O-N 3.44Å
862	V	63.7	Low	62.6	Low	57 Å²	57	66.1 Å²	66.1	35%	0.345	37%	0.374	S	S	.	.	S	Bend	trans	-127.7	142.3	-172.4	-171.3	0	0	0	0	110.6	F860 Q864	F860-V862 PolarHBondContact O-N 3.23Å; V862-Q864 WeakPolarHBondContact O-CG 3.41Å; V862-Q864 PolarHBondContact O-N 3.43Å
863	E	69.4	Low	65.5	Low	14 Å²	14	61.4 Å²	61.4	7%	0.065	35%	0.347	C	S	.	.			trans	-70.2	122	171.5	-70.9	169.5	-146.2	0	0	109.4	L934 K971 K974 L1013	E863-L934 HydrophobicContact CB-CD1 3.84Å; E863-L934 HydrophobicContact CB-CD2 3.67Å; E863-L934 HydrophobicContact CB-CG 3.78Å; E863-L934 HydrophobicContact CG-CD1 4.01Å; E863-L934 HydrophobicContact CG-CD2 4.43Å; E863-L934 HydrophobicContact CG-CG 4.48Å; E863-K971 VanDerWaalsContact CD-NZ 3.32Å; E863-K971 HydrophobicContact CG-CD 4.49Å; E863-K971 VanDerWaalsContact OE1-CE 3.29Å; E863-K971 WeakPolarHBondContact OE1-CE 3.28Å; E863-K971 IonicContact OE1-NZ 3.15Å; E863-K971 PolarHBondContact OE1-NZ 3.02Å; E863-K971 WeakPolarHBondContact OE2-CE 3.47Å; E863-K971 IonicContact OE2-NZ 3.87Å; E863-K971 PolarHBondContact OE2-NZ 3.27Å; E863-K974 HydrophobicContact CG-CD 4.1Å; E863-K974 IonicContact OE1-NZ 3.4Å; E863-L1013 HydrophobicContact CB-CD1 4.32Å
864	Q	77.9	Confident	68.6	Low	27 Å²	27	57 Å²	57	13%	0.126	32%	0.315	C	S	.	.			trans	-122	148	-171.4	-70.1	165.6	8.7	0	0	109.8	L859 V862 V929 S930 H931	L859-Q864 PolarHBondContact O-NE2 3.05Å; V862-Q864 WeakPolarHBondContact O-CG 3.41Å; V862-Q864 PolarHBondContact O-N 3.43Å; Q864-V929 HydrophobicContact CB-CG1 4.44Å; Q864-S930 VanDerWaalsContact CB-O 3.31Å; Q864-S930 WeakPolarHBondContact CB-O 3.34Å; Q864-S930 WeakPolarHBondContact CG-O 3.33Å; Q864-H931 PolarHBondContact NE2-ND1 3.08Å; Q864-H931 PolarHBondContact OE1-CE1 2.93Å; Q864-H931 PolarHBondContact OE1-ND1 3.46Å
865	L	85.6	Confident	71.4	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.4	166.7	-179	67.1	0	0	0	108.4	I867 V929 S930 W941 V944 I967 L1013	L865-I867 HydrophobicContact CG-CG1 4.45Å; L865-V929 WeakPolarHBondContact O-CA 3.47Å; L865-S930 WeakPolarHBondContact CB-OG 3.41Å; L865-S930 PolarHBondContact O-N 2.77Å; L865-W941 HydrophobicContact CD1-CH2 3.84Å; L865-W941 HydrophobicContact CD1-CZ2 3.53Å; L865-W941 HydrophobicContact CD2-CD2 3.64Å; L865-W941 HydrophobicContact CD2-CE3 3.75Å; L865-W941 HydrophobicContact CD2-CG 4.22Å; L865-W941 HydrophobicContact CD2-CH2 4.03Å; L865-W941 HydrophobicContact CD2-CZ2 3.95Å; L865-W941 HydrophobicContact CD2-CZ3 3.94Å; L865-W941 HydrophobicContact CG-CZ2 4.41Å; L865-V944 HydrophobicContact CD2-CB 4.13Å; L865-V944 HydrophobicContact CD2-CG1 4.21Å; L865-V944 HydrophobicContact CD2-CG2 4.23Å; L865-I967 HydrophobicContact CD1-CG2 4.37Å; L865-L1013 WeakPolarHBondContact CD1-O 3.38Å
866	Y	89.5	Confident	74.4	Confident	37 Å²	37	44 Å²	44	15%	0.145	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	112.9	-177.7	-167.6	-62.5	0	0	0	109.2	Q868 S927 V929 L968 L973	Y866-Q868 HydrophobicContact CD1-CB 4.38Å; Y866-Q868 HydrophobicContact CE1-CB 3.99Å; Y866-Q868 HydrophobicContact CE1-CG 4.45Å; Y866-S927 VanDerWaalsContact OH-CB 3.31Å; Y866-S927 WeakPolarHBondContact OH-CB 3.38Å; Y866-S927 PolarHBondContact OH-OG 3.03Å; Y866-V929 HydrophobicContact CD2-CB 4.3Å; Y866-V929 HydrophobicContact CD2-CG1 4.01Å; Y866-V929 HydrophobicContact CD2-CG2 3.36Å; Y866-V929 HydrophobicContact CE2-CG2 3.37Å; Y866-V929 HydrophobicContact CG-CG2 3.99Å; Y866-L968 HydrophobicContact CD1-CB 3.97Å; Y866-L968 HydrophobicContact CD1-CD1 3.3Å; Y866-L968 HydrophobicContact CD1-CG 3.55Å; Y866-L968 HydrophobicContact CE1-CD1 3.31Å; Y866-L968 HydrophobicContact CE1-CG 3.97Å; Y866-L968 HydrophobicContact CG-CB 4.24Å; Y866-L968 HydrophobicContact CG-CD1 3.97Å; Y866-L968 HydrophobicContact CG-CG 4.29Å; Y866-L968 PolarHBondContact O-N 2.86Å; Y866-L973 HydrophobicContact CD2-CD1 3.81Å; Y866-L973 HydrophobicContact CG-CD1 3.8Å
867	I	92.2	Very high	76.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.2	177.5	-59	175.7	0	0	0	108.3	L865 Y869 S927 I928 W941 V944 V948 V965 L988	L865-I867 HydrophobicContact CG-CG1 4.45Å; I867-Y869 HydrophobicContact CG2-CD2 4.35Å; I867-Y869 HydrophobicContact CG2-CE2 3.75Å; I867-S927 CarbonylContact O-C 3.31Å; I867-S927 VanDerWaalsContact O-CA 3.24Å; I867-S927 WeakPolarHBondContact O-CA 3.19Å; I867-I928 PolarHBondContact N-O 3.11Å; I867-I928 PolarHBondContact O-N 2.79Å; I867-W941 HydrophobicContact CD1-CH2 4.43Å; I867-W941 HydrophobicContact CD1-CZ3 4.18Å; I867-V944 HydrophobicContact CD1-CG1 3.74Å; I867-V948 HydrophobicContact CD1-CG2 3.74Å; I867-V965 HydrophobicContact CG2-CG1 4.05Å; I867-L988 HydrophobicContact CD1-CD1 4.41Å; I867-L988 HydrophobicContact CD1-CD2 3.98Å; I867-L988 HydrophobicContact CG2-CD1 4.22Å
868	Q	93.4	Very high	79.2	Confident	43 Å²	43	35.8 Å²	35.8	20%	0.201	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	-177.8	-167.6	-179.4	-37.4	0	0	111.2	Y866 T925 V965 H966 L968	Y866-Q868 HydrophobicContact CD1-CB 4.38Å; Y866-Q868 HydrophobicContact CE1-CB 3.99Å; Y866-Q868 HydrophobicContact CE1-CG 4.45Å; Q868-T925 HydrophobicContact CG-CG2 4.47Å; Q868-V965 WeakPolarHBondContact O-CA 3.29Å; Q868-H966 PolarHBondContact N-O 3.19Å; Q868-H966 PolarHBondContact O-N 3.03Å; Q868-L968 HydrophobicContact CB-CG 4.43Å
869	Y	94.7	Very high	81.4	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.6	168.1	-68.1	-106.6	0	0	0	108.3	I867 T925 L926 L951 N952 L955 Y963 N964 V965	I867-Y869 HydrophobicContact CG2-CD2 4.35Å; I867-Y869 HydrophobicContact CG2-CE2 3.75Å; Y869-T925 CarbonylContact O-C 3.59Å; Y869-T925 WeakPolarHBondContact O-CA 3.37Å; Y869-T925 WeakPolarHBondContact O-CB 3.35Å; Y869-L926 PolarHBondContact N-O 3.34Å; Y869-L926 PolarHBondContact O-N 2.96Å; Y869-L951 HydrophobicContact CD1-CD2 4.2Å; Y869-L951 HydrophobicContact CD2-CD2 3.65Å; Y869-L951 HydrophobicContact CE1-CD2 4.08Å; Y869-L951 HydrophobicContact CE2-CD2 3.53Å; Y869-L951 HydrophobicContact CG-CD2 4.02Å; Y869-N952 PolarHBondContact OH-OD1 2.94Å; Y869-L955 HydrophobicContact CD1-CD1 3.85Å; Y869-L955 HydrophobicContact CE1-CD1 3.81Å; Y869-Y963 AromaticContact CD1-CD2 3.87Å; Y869-Y963 HydrophobicContact CD1-CD2 3.87Å; Y869-Y963 HydrophobicContact CD1-CE2 4.13Å; Y869-Y963 HydrophobicContact CE1-CD2 4.29Å; Y869-Y963 HydrophobicContact CE1-CE2 4.07Å; Y869-N964 CarbonylContact C-O 3.53Å; Y869-N964 WeakPolarHBondContact CA-O 3.5Å; Y869-V965 HydrophobicContact CD1-CG2 3.65Å; Y869-V965 HydrophobicContact CE1-CB 4.44Å; Y869-V965 HydrophobicContact CE1-CG1 4.21Å; Y869-V965 HydrophobicContact CE1-CG2 3.41Å; Y869-V965 VanDerWaalsContact CE1-CG2 3.41Å; Y869-V965 HydrophobicContact CE2-CG1 4.25Å; Y869-V965 HydrophobicContact CG-CG2 4.44Å
870	S	91.9	Very high	83.7	Confident	10 Å²	10	27.2 Å²	27.2	7%	0.07	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.6	172.6	61.5	0	0	0	0	111	P872 Y963 N964	S870-P872 WeakPolarHBondContact O-CD 3.48Å; S870-Y963 CarbonylContact O-C 3.27Å; S870-Y963 VanDerWaalsContact O-CA 3.25Å; S870-Y963 WeakPolarHBondContact O-CA 3.45Å; S870-Y963 WeakPolarHBondContact O-CB 3.23Å; S870-N964 PolarHBondContact N-O 3.34Å; S870-N964 PolarHBondContact O-N 2.88Å; S870-N964 PolarHBondContact OG-O 3.25Å
871	F	92	Very high	85.8	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.018	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	97.2	-175.2	-61.6	-86.7	0	0	0	109.7	F875 L879 E924 L926 L955 L961 Y963	F871-F875 AromaticContact CD2-CD2 3.57Å; F871-F875 HydrophobicContact CD2-CD2 3.57Å; F871-F875 HydrophobicContact CD2-CE2 4.06Å; F871-F875 AromaticContact CE2-CD2 3.83Å; F871-F875 HydrophobicContact CE2-CD2 3.83Å; F871-F875 AromaticContact CE2-CE2 3.86Å; F871-F875 HydrophobicContact CE2-CE2 3.86Å; F871-F875 HydrophobicContact CG-CD2 4.05Å; F871-F875 HydrophobicContact CZ-CE2 4.49Å; F871-L879 HydrophobicContact CE1-CD2 4.37Å; F871-L879 HydrophobicContact CZ-CD2 3.93Å; F871-E924 PolarHBondContact N-O 2.97Å; F871-L926 HydrophobicContact CE2-CB 4.11Å; F871-L955 HydrophobicContact CE1-CD2 3.82Å; F871-L955 HydrophobicContact CZ-CD2 4.11Å; F871-L961 HydrophobicContact CD1-CD1 4.43Å; F871-L961 HydrophobicContact CD1-CD2 4.19Å; F871-L961 HydrophobicContact CE1-CD2 3.95Å; F871-Y963 HydrophobicContact CE1-CG 4.37Å
872	P	86.3	Confident	87.8	Confident	37 Å²	37	19 Å²	19	24%	0.24	10%	0.104	C	C	.	.	S	Bend	trans	-69	-36.4	-173.4	-24.5	36.7	0	0	0	115.5	S870 M923 H962	S870-P872 WeakPolarHBondContact O-CD 3.48Å; P872-M923 VanDerWaalsContact CA-CE 3.48Å; P872-M923 HydrophobicContact CB-CE 3.27Å; P872-M923 HydrophobicContact CG-CE 3.43Å; P872-M923 VanDerWaalsContact CG-CE 3.43Å; P872-H962 WeakPolarHBondContact CD-O 3.26Å
873	F	85.3	Confident	89.2	Confident	48 Å²	48	16.2 Å²	16.2	21%	0.211	9%	0.087	C	C	.	.	S	Bend	trans	-106.4	-40.9	-172.3	-55.4	-65.4	0	0	0	113.1	Y503 H511 C558 L559 H962	Y503-F873 PolarHBondContact OH-O 3.28Å; H511-F873 PolarHBondContact ND1-O 3.49Å; C558-F873 HydrophobicContact CB-CE1 4.34Å; C558-F873 HydrophobicContact CB-CZ 3.93Å; L559-F873 HydrophobicContact CD2-CE2 4.42Å; F873-H962 HydrophobicContact CD2-CB 3.83Å; F873-H962 HydrophobicContact CE2-CB 3.83Å; F873-H962 AromaticContact CE2-CD2 3.55Å; F873-H962 AromaticContact CE2-CG 3.99Å
874	L	90.3	Very high	90.3	Very high	10 Å²	10	15.6 Å²	15.6	5%	0.052	8%	0.084	C	C	.	.			trans	-154.9	125.8	-174.8	-178.7	74.8	0	0	0	110.2	Y508 H511 L512 A515 L961	Y508-L874 HydrophobicContact CD2-CD1 3.99Å; Y508-L874 HydrophobicContact CE2-CD1 3.71Å; H511-L874 HydrophobicContact CB-CB 4.31Å; L512-L874 HydrophobicContact CB-CD2 4.33Å; L512-L874 HydrophobicContact CD1-CD2 4.18Å; A515-L874 HydrophobicContact CB-CD2 3.87Å; L874-L961 WeakPolarHBondContact O-CD1 3.37Å
875	F	91.6	Very high	90.9	Very high	23 Å²	23	14.8 Å²	14.8	10%	0.101	8%	0.081	C	C	.	.	P	Polyproline II helix	trans	-80.3	122.8	160.2	-174.8	-98.1	0	0	0	108.8	F871 L879 F880 H914 E924 L926	F871-F875 AromaticContact CD2-CD2 3.57Å; F871-F875 HydrophobicContact CD2-CD2 3.57Å; F871-F875 HydrophobicContact CD2-CE2 4.06Å; F871-F875 AromaticContact CE2-CD2 3.83Å; F871-F875 HydrophobicContact CE2-CD2 3.83Å; F871-F875 AromaticContact CE2-CE2 3.86Å; F871-F875 HydrophobicContact CE2-CE2 3.86Å; F871-F875 HydrophobicContact CG-CD2 4.05Å; F871-F875 HydrophobicContact CZ-CE2 4.49Å; F875-L879 HydrophobicContact CE1-CB 4.02Å; F875-L879 HydrophobicContact CE2-CD2 3.99Å; F875-L879 HydrophobicContact CZ-CB 3.97Å; F875-L879 HydrophobicContact CZ-CD2 4.05Å; F875-L879 HydrophobicContact CZ-CG 4.33Å; F875-F880 HydrophobicContact CZ-CB 4.32Å; F875-H914 AromaticContact CD1-NE2 3.89Å; F875-H914 AromaticContact CE1-CE1 3.77Å; F875-H914 AromaticContact CE1-NE2 3.75Å; F875-H914 AromaticContact CE2-CD2 3.76Å; F875-H914 AromaticContact CE2-NE2 3.91Å; F875-H914 AromaticContact CZ-CD2 3.71Å; F875-H914 AromaticContact CZ-NE2 3.77Å; F875-E924 HydrophobicContact CB-CB 3.93Å; F875-E924 VanDerWaalsContact CB-CD 3.49Å; F875-E924 HydrophobicContact CB-CG 4.28Å; F875-E924 WeakPolarHBondContact CB-OE2 3.15Å; F875-E924 HydrophobicContact CD2-CB 4.28Å; F875-E924 HydrophobicContact CG-CB 4.39Å; F875-E924 WeakPolarHBondContact CG-OE2 3.18Å; F875-L926 HydrophobicContact CE2-CB 4.32Å; F875-L926 HydrophobicContact CE2-CD1 4.31Å; F875-L926 HydrophobicContact CZ-CD1 4.35Å
876	P	92.6	Very high	91.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	P	Polyproline II helix	trans	-61.5	128.7	-174.4	-21.4	31	0	0	0	111.7	G878 L879 W958 L961	P876-G878 PolarHBondContact O-N 3.38Å; P876-L879 HydrophobicContact CB-CB 4.13Å; P876-L879 HydrophobicContact CB-CD2 4.49Å; P876-L879 HydrophobicContact CG-CD2 4.08Å; P876-L879 VanDerWaalsContact O-CB 3.25Å; P876-L879 WeakPolarHBondContact O-CB 2.91Å; P876-L879 PolarHBondContact O-N 2.8Å; P876-L879 VanDerWaalsContact O-N 3.11Å; P876-W958 HydrophobicContact CB-CD2 3.9Å; P876-W958 HydrophobicContact CB-CE3 4.25Å; P876-W958 HydrophobicContact CB-CG 4.49Å; P876-W958 HydrophobicContact CB-CH2 4.03Å; P876-W958 HydrophobicContact CB-CZ2 3.64Å; P876-W958 HydrophobicContact CB-CZ3 4.3Å; P876-W958 HydrophobicContact CG-CD2 4.29Å; P876-L961 HydrophobicContact CG-CD1 4.01Å; P876-L961 HydrophobicContact CG-CD2 3.4Å; P876-L961 HydrophobicContact CG-CG 4.35Å
877	P	89.7	Confident	91.2	Very high	15 Å²	15	14.9 Å²	14.9	10%	0.097	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	131.8	-177.4	22.3	-33.4	0	0	0	111.3	D475 P479 L512 L879 W958	D475-P877 HydrophobicContact CB-CB 3.85Å; P479-P877 HydrophobicContact CG-CG 4.04Å; L512-P877 HydrophobicContact CD1-CG 3.6Å; P877-L879 PolarHBondContact O-N 2.77Å; P877-W958 HydrophobicContact CG-CH2 3.94Å
878	G	88.9	Confident	91.1	Very high	23 Å²	23	16.3 Å²	16.3	24%	0.237	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	0.5	-179.7	0	0	0	0	0	115.6	P876 F880 A881 R882	P876-G878 PolarHBondContact O-N 3.38Å; G878-F880 VanDerWaalsContact C-N 3.34Å; G878-F880 PolarHBondContact O-N 2.94Å; G878-A881 PolarHBondContact O-N 2.88Å; G878-A881 VanDerWaalsContact O-N 3.16Å; G878-R882 WeakPolarHBondContact O-CG 3.4Å; G878-R882 PolarHBondContact O-N 3.47Å
879	L	92.6	Very high	90.7	Very high	5 Å²	5	20.3 Å²	20.3	3%	0.026	11%	0.113	C	C	.	.	H	α-helix	trans	-53.6	-47.8	-177.5	179.9	63.3	0	0	0	112.5	F871 F875 P876 P877 A881 R882 F883 L926 L951 L954 L955	F871-L879 HydrophobicContact CE1-CD2 4.37Å; F871-L879 HydrophobicContact CZ-CD2 3.93Å; F875-L879 HydrophobicContact CE1-CB 4.02Å; F875-L879 HydrophobicContact CE2-CD2 3.99Å; F875-L879 HydrophobicContact CZ-CB 3.97Å; F875-L879 HydrophobicContact CZ-CD2 4.05Å; F875-L879 HydrophobicContact CZ-CG 4.33Å; P876-L879 HydrophobicContact CB-CB 4.13Å; P876-L879 HydrophobicContact CB-CD2 4.49Å; P876-L879 HydrophobicContact CG-CD2 4.08Å; P876-L879 VanDerWaalsContact O-CB 3.25Å; P876-L879 WeakPolarHBondContact O-CB 2.91Å; P876-L879 PolarHBondContact O-N 2.8Å; P876-L879 VanDerWaalsContact O-N 3.11Å; P877-L879 PolarHBondContact O-N 2.77Å; L879-A881 PolarHBondContact O-N 2.86Å; L879-R882 PolarHBondContact O-N 2.64Å; L879-F883 VanDerWaalsContact O-CB 3.24Å; L879-F883 WeakPolarHBondContact O-CB 3.4Å; L879-F883 PolarHBondContact O-N 3.22Å; L879-L926 HydrophobicContact CD2-CD1 4.46Å; L879-L951 HydrophobicContact CD1-CD1 4.16Å; L879-L951 HydrophobicContact CD2-CD1 4.36Å; L879-L951 HydrophobicContact CG-CD1 4.39Å; L879-L954 HydrophobicContact CD1-CB 4.02Å; L879-L954 HydrophobicContact CD1-CD1 4.42Å; L879-L955 HydrophobicContact CD1-CD2 4.43Å; L879-L955 HydrophobicContact CD2-CD2 3.98Å
880	F	92.1	Very high	90.3	Very high	18 Å²	18	22.7 Å²	22.7	8%	0.079	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-41.8	-179.3	-174.1	-103.5	0	0	0	112.7	F875 G878 F883 S884 R898 H899 I901 I912 H914	F875-F880 HydrophobicContact CZ-CB 4.32Å; G878-F880 VanDerWaalsContact C-N 3.34Å; G878-F880 PolarHBondContact O-N 2.94Å; F880-F883 PolarHBondContact O-N 2.93Å; F880-S884 PolarHBondContact O-N 3.43Å; F880-R898 WeakPolarHBondContact CD1-O 3.14Å; F880-R898 VanDerWaalsContact CE1-O 3.31Å; F880-R898 WeakPolarHBondContact CE1-O 3.35Å; F880-H899 VanDerWaalsContact CZ-C 3.43Å; F880-I901 HydrophobicContact CE1-CD1 4.18Å; F880-I901 HydrophobicContact CE1-CG1 4.2Å; F880-I901 HydrophobicContact CE2-CD1 4.03Å; F880-I901 HydrophobicContact CE2-CG1 4.42Å; F880-I901 HydrophobicContact CZ-CD1 3.7Å; F880-I901 HydrophobicContact CZ-CG1 3.7Å; F880-I912 HydrophobicContact CE2-CG2 3.99Å; F880-H914 HydrophobicContact CB-CB 4.46Å; F880-H914 HydrophobicContact CD2-CB 3.52Å; F880-H914 HydrophobicContact CE2-CB 3.82Å; F880-H914 HydrophobicContact CG-CB 4Å
881	A	90.9	Very high	90	Very high	12 Å²	12	23.1 Å²	23.1	10%	0.099	13%	0.126	C	C	.	.	H	α-helix	trans	-67.4	-42.6	177.9	0	0	0	0	0	111.7	L476 P835 G878 L879 F883 S884 V885	L476-A881 HydrophobicContact CD1-CB 3.69Å; P835-A881 HydrophobicContact CB-CB 4.13Å; G878-A881 PolarHBondContact O-N 2.88Å; G878-A881 VanDerWaalsContact O-N 3.16Å; L879-A881 PolarHBondContact O-N 2.86Å; A881-F883 VanDerWaalsContact C-N 3.34Å; A881-S884 WeakPolarHBondContact O-CB 3.45Å; A881-S884 PolarHBondContact O-N 2.73Å; A881-V885 PolarHBondContact O-N 3Å
882	R	92.9	Very high	89.5	Confident	11 Å²	11	28.5 Å²	28.5	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-65.9	-38.6	175.5	-68	-174.6	68.8	-154.4	-5.1	111.7	L476 M811 G878 L879 V885 Q886 L954 E957	L476-R882 HydrophobicContact CG-CG 4.36Å; M811-R882 PolarHBondContact O-NE 3.26Å; G878-R882 WeakPolarHBondContact O-CG 3.4Å; G878-R882 PolarHBondContact O-N 3.47Å; L879-R882 PolarHBondContact O-N 2.64Å; R882-V885 WeakPolarHBondContact O-CB 3.5Å; R882-V885 PolarHBondContact O-N 3.21Å; R882-V885 VanDerWaalsContact O-N 3.16Å; R882-Q886 PolarHBondContact O-N 3.16Å; R882-L954 HydrophobicContact CB-CD1 4.39Å; R882-L954 HydrophobicContact CB-CD2 4.42Å; R882-E957 IonicContact CZ-OE1 3.55Å; R882-E957 IonicContact CZ-OE2 3.74Å; R882-E957 IonicContact NH1-OE1 3.63Å; R882-E957 IonicContact NH1-OE2 3.6Å; R882-E957 PolarHBondContact NH1-OE2 3.33Å; R882-E957 VanDerWaalsContact NH2-CD 3.33Å; R882-E957 IonicContact NH2-OE1 3.65Å; R882-E957 PolarHBondContact NH2-OE1 3.42Å; R882-E957 IonicContact NH2-OE2 3Å; R882-E957 PolarHBondContact NH2-OE2 2.84Å; R882-E957 VanDerWaalsContact NH2-OE2 3.15Å
883	F	93.5	Very high	89.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-43.9	174.9	-173.8	-135.4	0	0	0	111.2	L879 F880 A881 V885 Q886 I887 I912 L926 I928 L947 E950 L951 L954	L879-F883 VanDerWaalsContact O-CB 3.24Å; L879-F883 WeakPolarHBondContact O-CB 3.4Å; L879-F883 PolarHBondContact O-N 3.22Å; F880-F883 PolarHBondContact O-N 2.93Å; A881-F883 VanDerWaalsContact C-N 3.34Å; F883-V885 PolarHBondContact O-N 3.2Å; F883-Q886 PolarHBondContact O-N 3.47Å; F883-I887 HydrophobicContact CD2-CG2 3.78Å; F883-I887 HydrophobicContact CE1-CG2 4.43Å; F883-I887 HydrophobicContact CE2-CG2 3.38Å; F883-I887 HydrophobicContact CG-CG2 4.43Å; F883-I887 HydrophobicContact CZ-CG2 3.76Å; F883-I887 WeakPolarHBondContact O-CG1 3.45Å; F883-I887 WeakPolarHBondContact O-CG2 3.27Å; F883-I887 PolarHBondContact O-N 3.49Å; F883-I887 VanDerWaalsContact O-N 3.1Å; F883-I912 HydrophobicContact CD1-CD1 4.39Å; F883-I912 HydrophobicContact CD1-CG2 3.93Å; F883-I912 HydrophobicContact CE1-CB 4.49Å; F883-I912 HydrophobicContact CE1-CD1 3.67Å; F883-I912 HydrophobicContact CE1-CG1 4.12Å; F883-I912 HydrophobicContact CE1-CG2 3.61Å; F883-I912 HydrophobicContact CZ-CD1 4.13Å; F883-L926 HydrophobicContact CD1-CD1 4.49Å; F883-L926 HydrophobicContact CE1-CD2 4.42Å; F883-I928 HydrophobicContact CE1-CD1 4.2Å; F883-I928 HydrophobicContact CE1-CG1 4.4Å; F883-I928 HydrophobicContact CZ-CD1 3.87Å; F883-L947 WeakPolarHBondContact CE2-O 3.24Å; F883-L947 HydrophobicContact CZ-CB 4.25Å; F883-L947 WeakPolarHBondContact CZ-O 3.38Å; F883-E950 HydrophobicContact CE2-CB 4.16Å; F883-L951 HydrophobicContact CD2-CB 4.15Å; F883-L951 HydrophobicContact CD2-CD1 4.35Å; F883-L951 HydrophobicContact CE2-CB 3.72Å; F883-L951 HydrophobicContact CG-CD1 4.33Å; F883-L951 HydrophobicContact CZ-CB 4.02Å; F883-L954 HydrophobicContact CB-CD1 3.95Å; F883-L954 HydrophobicContact CD2-CD1 4.13Å
884	S	92.1	Very high	89.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-52.5	-41.5	171.4	162	0	0	0	0	112.4	P835 F880 A881 I887 R894 D896	P835-S884 VanDerWaalsContact CG-OG 3.31Å; P835-S884 WeakPolarHBondContact CG-OG 3.45Å; F880-S884 PolarHBondContact O-N 3.43Å; A881-S884 WeakPolarHBondContact O-CB 3.45Å; A881-S884 PolarHBondContact O-N 2.73Å; S884-I887 VanDerWaalsContact O-CG1 3.27Å; S884-I887 WeakPolarHBondContact O-CG1 3.11Å; S884-R894 PolarHBondContact O-NH1 2.85Å; S884-R894 PolarHBondContact O-NH2 3.12Å; S884-R894 VanDerWaalsContact O-NH2 3.08Å; S884-R894 PolarHBondContact OG-NH2 3.15Å; S884-D896 PolarHBondContact OG-OD2 3.13Å
885	V	91.9	Very high	89.1	Confident	9 Å²	9	33.1 Å²	33.1	6%	0.055	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-50	177.5	173.4	0	0	0	0	111.6	G812 C814 Y815 P835 A881 R882 F883 I887 N888	G812-V885 WeakPolarHBondContact O-CG2 3.24Å; C814-V885 VanDerWaalsContact O-CG1 3.26Å; C814-V885 WeakPolarHBondContact O-CG1 3.47Å; Y815-V885 HydrophobicContact CD1-CG2 4.13Å; P835-V885 HydrophobicContact CG-CG2 3.89Å; A881-V885 PolarHBondContact O-N 3Å; R882-V885 WeakPolarHBondContact O-CB 3.5Å; R882-V885 PolarHBondContact O-N 3.21Å; R882-V885 VanDerWaalsContact O-N 3.16Å; F883-V885 PolarHBondContact O-N 3.2Å; V885-I887 VanDerWaalsContact C-N 3.34Å; V885-I887 PolarHBondContact O-N 3.11Å; V885-N888 WeakPolarHBondContact O-CB 3.21Å; V885-N888 PolarHBondContact O-N 2.96Å; V885-N888 VanDerWaalsContact O-N 3.17Å
886	Q	90.4	Very high	88.8	Confident	42 Å²	42	32.9 Å²	32.9	20%	0.196	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-37.6	-174.9	-66	-57.1	-17.1	0	0	113	R882 F883 N888 E950 L954	R882-Q886 PolarHBondContact O-N 3.16Å; F883-Q886 PolarHBondContact O-N 3.47Å; Q886-N888 PolarHBondContact O-N 3.2Å; Q886-N888 VanDerWaalsContact O-N 3.14Å; Q886-E950 HydrophobicContact CB-CB 4.43Å; Q886-L954 HydrophobicContact CG-CD1 4.08Å; Q886-L954 HydrophobicContact CG-CD2 4.13Å; Q886-L954 HydrophobicContact CG-CG 4.3Å
887	I	90.6	Very high	88.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-70.3	-11	-179.4	65.8	162.8	0	0	0	113.6	F883 S884 V885 N889 H890 V891 I901 I912 L947	F883-I887 HydrophobicContact CD2-CG2 3.78Å; F883-I887 HydrophobicContact CE1-CG2 4.43Å; F883-I887 HydrophobicContact CE2-CG2 3.38Å; F883-I887 HydrophobicContact CG-CG2 4.43Å; F883-I887 HydrophobicContact CZ-CG2 3.76Å; F883-I887 WeakPolarHBondContact O-CG1 3.45Å; F883-I887 WeakPolarHBondContact O-CG2 3.27Å; F883-I887 PolarHBondContact O-N 3.49Å; F883-I887 VanDerWaalsContact O-N 3.1Å; S884-I887 VanDerWaalsContact O-CG1 3.27Å; S884-I887 WeakPolarHBondContact O-CG1 3.11Å; V885-I887 VanDerWaalsContact C-N 3.34Å; V885-I887 PolarHBondContact O-N 3.11Å; I887-N889 PolarHBondContact O-N 3.4Å; I887-H890 WeakPolarHBondContact O-CB 3.44Å; I887-H890 PolarHBondContact O-N 2.89Å; I887-V891 WeakPolarHBondContact O-CG2 3.28Å; I887-V891 PolarHBondContact O-N 3.13Å; I887-I901 HydrophobicContact CD1-CD1 4.28Å; I887-I901 HydrophobicContact CD1-CG2 4.13Å; I887-I912 HydrophobicContact CD1-CD1 3.54Å; I887-L947 HydrophobicContact CB-CD2 3.81Å; I887-L947 HydrophobicContact CG2-CD2 3.55Å
888	N	90.1	Very high	88.2	Confident	31 Å²	31	39.1 Å²	39.1	17%	0.166	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-57.1	-36.6	-173.9	-172.6	61.7	0	0	0	112.9	Y815 C816 V885 Q886 H890 R894	Y815-N888 HydrophobicContact CD2-CB 4.13Å; Y815-N888 WeakPolarHBondContact CD2-OD1 3.32Å; Y815-N888 VanDerWaalsContact CE2-OD1 3.23Å; Y815-N888 WeakPolarHBondContact CE2-OD1 3.49Å; Y815-N888 HydrophobicContact CG-CB 4.08Å; C816-N888 PolarHBondContact O-ND2 3.25Å; V885-N888 WeakPolarHBondContact O-CB 3.21Å; V885-N888 PolarHBondContact O-N 2.96Å; V885-N888 VanDerWaalsContact O-N 3.17Å; Q886-N888 PolarHBondContact O-N 3.2Å; Q886-N888 VanDerWaalsContact O-N 3.14Å; N888-H890 PolarHBondContact O-N 3.33Å; N888-R894 PolarHBondContact OD1-NH1 3.38Å
889	N	84.8	Confident	88	Confident	126 Å²	126	40.5 Å²	40.5	67%	0.674	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-74.8	-13.6	179.2	-65.8	-29.1	0	0	0	113.3	I887	I887-N889 PolarHBondContact O-N 3.4Å
890	H	85.7	Confident	87.9	Confident	52 Å²	52	42.9 Å²	42.9	24%	0.241	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-99.6	-13.7	-176.7	-64.2	-75.5	0	0	0	113.2	I887 N888 R905 L947 E950	I887-H890 WeakPolarHBondContact O-CB 3.44Å; I887-H890 PolarHBondContact O-N 2.89Å; N888-H890 PolarHBondContact O-N 3.33Å; H890-R905 WeakPolarHBondContact O-CD 3.31Å; H890-R905 VanDerWaalsContact O-CG 3.31Å; H890-R905 WeakPolarHBondContact O-CG 3.12Å; H890-L947 HydrophobicContact CB-CD2 4.14Å; H890-E950 IonicContact CD2-OE1 2.76Å; H890-E950 IonicContact CE1-OE1 3.3Å; H890-E950 IonicContact NE2-OE1 3.36Å; H890-E950 PolarHBondContact NE2-OE1 3.39Å
891	V	86.4	Confident	87.8	Confident	19 Å²	19	42.1 Å²	42.1	12%	0.115	21%	0.209	C	C	.	.			trans	-117.1	153.4	-174.1	-58.6	0	0	0	0	111.7	I887 R894 A903	I887-V891 WeakPolarHBondContact O-CG2 3.28Å; I887-V891 PolarHBondContact O-N 3.13Å; V891-R894 HydrophobicContact CG2-CB 4.24Å; V891-R894 HydrophobicContact CG2-CG 4.44Å; V891-A903 HydrophobicContact CB-CB 3.95Å; V891-A903 HydrophobicContact CG1-CB 3.72Å; V891-A903 HydrophobicContact CG2-CB 4.39Å
892	V	81.1	Confident	87.7	Confident	116 Å²	116	43.2 Å²	43.2	70%	0.703	21%	0.212	S	C	*	.	S	Bend	trans	-105.5	-61.5	-176.8	-175.2	0	0	0	0	111.1	Y904	V892-Y904 PolarHBondContact N-O 2.8Å
893	Q	81.7	Confident	87.5	Confident	119 Å²	119	42.8 Å²	42.8	56%	0.556	21%	0.211	S	C	*	.	S	Bend	trans	-108.8	129.7	175.2	-71.8	178.1	-14.6	0	0	108.2	A903 Y904	Q893-A903 CarbonylContact O-C 3.38Å; Q893-A903 VanDerWaalsContact O-CA 3.24Å; Q893-A903 WeakPolarHBondContact O-CA 3.26Å; Q893-Y904 HydrophobicContact CB-CD2 3.97Å; Q893-Y904 PolarHBondContact O-N 2.85Å
894	R	86.9	Confident	87.1	Confident	51 Å²	51	45.9 Å²	45.9	19%	0.192	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	148.7	-178.4	66.7	-178.5	-63.9	174.3	3.9	112.1	S884 N888 V891 D896 F902 A903	S884-R894 PolarHBondContact O-NH1 2.85Å; S884-R894 PolarHBondContact O-NH2 3.12Å; S884-R894 VanDerWaalsContact O-NH2 3.08Å; S884-R894 PolarHBondContact OG-NH2 3.15Å; N888-R894 PolarHBondContact OD1-NH1 3.38Å; V891-R894 HydrophobicContact CG2-CB 4.24Å; V891-R894 HydrophobicContact CG2-CG 4.44Å; R894-D896 IonicContact CZ-OD1 2.61Å; R894-D896 IonicContact CZ-OD2 2.67Å; R894-D896 IonicContact NE-OD1 2.63Å; R894-D896 PolarHBondContact NE-OD1 3.25Å; R894-D896 IonicContact NE-OD2 3.57Å; R894-D896 IonicContact NH2-OD1 2.77Å; R894-D896 PolarHBondContact NH2-OD1 2.58Å; R894-D896 IonicContact NH2-OD2 2.76Å; R894-D896 PolarHBondContact NH2-OD2 3.16Å; R894-F902 CarbonylContact C-O 3.58Å; R894-F902 VanDerWaalsContact CA-O 3.24Å; R894-F902 WeakPolarHBondContact CA-O 3.43Å; R894-A903 HydrophobicContact CB-CB 3.88Å
895	S	85.5	Confident	86.8	Confident	23 Å²	23	48.8 Å²	48.8	16%	0.161	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.8	167.8	-176.4	0	0	0	0	108.4	A843 Q844 F902	A843-S895 WeakPolarHBondContact CB-OG 3.36Å; Q844-S895 PolarHBondContact O-OG 3.16Å; S895-F902 PolarHBondContact N-O 3.42Å; S895-F902 PolarHBondContact O-N 3.13Å
896	D	85	Confident	86.3	Confident	18 Å²	18	51.2 Å²	51.2	10%	0.096	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	116.2	-173	-81.8	36.2	0	0	0	109.3	V838 S884 R894	V838-D896 WeakPolarHBondContact CG1-O 3.35Å; S884-D896 PolarHBondContact OG-OD2 3.13Å; R894-D896 IonicContact CZ-OD1 2.61Å; R894-D896 IonicContact CZ-OD2 2.67Å; R894-D896 IonicContact NE-OD1 2.63Å; R894-D896 PolarHBondContact NE-OD1 3.25Å; R894-D896 IonicContact NE-OD2 3.57Å; R894-D896 IonicContact NH2-OD1 2.77Å; R894-D896 PolarHBondContact NH2-OD1 2.58Å; R894-D896 IonicContact NH2-OD2 2.76Å; R894-D896 PolarHBondContact NH2-OD2 3.16Å
897	G	85.2	Confident	85.9	Confident	5 Å²	5	58.8 Å²	58.8	5%	0.052	29%	0.292	C	S	.	.			trans	-102.7	172	164.4	0	0	0	0	0	111.4	H899 Q900	G897-H899 VanDerWaalsContact C-N 3.27Å; G897-H899 PolarHBondContact O-N 2.91Å; G897-Q900 CarbonylContact C-O 3.51Å; G897-Q900 VanDerWaalsContact CA-O 3.31Å; G897-Q900 WeakPolarHBondContact CA-O 3.38Å; G897-Q900 PolarHBondContact N-O 3.43Å
898	R	83.1	Confident	85.5	Confident	141 Å²	141	59.6 Å²	59.6	53%	0.532	30%	0.298	S	S	.	.	S	Bend	trans	-60.5	-34.6	-177.9	-175.3	-179.8	174.6	-179.6	-0.9	113.8	S840 F880	S840-R898 WeakPolarHBondContact O-CB 3.42Å; S840-R898 PolarHBondContact O-N 3.23Å; F880-R898 WeakPolarHBondContact CD1-O 3.14Å; F880-R898 VanDerWaalsContact CE1-O 3.31Å; F880-R898 WeakPolarHBondContact CE1-O 3.35Å
899	H	86	Confident	85.4	Confident	51 Å²	51	59.5 Å²	59.5	24%	0.236	30%	0.298	C	S	.	.	S	Bend	trans	-126.4	-0.3	-175.2	-69.7	-67.9	0	0	0	113.4	F880 G897 S913 H914	F880-H899 VanDerWaalsContact CZ-C 3.43Å; G897-H899 VanDerWaalsContact C-N 3.27Å; G897-H899 PolarHBondContact O-N 2.91Å; H899-S913 CarbonylContact O-C 3.59Å; H899-S913 WeakPolarHBondContact O-CA 3.22Å; H899-H914 WeakPolarHBondContact CB-O 3.46Å; H899-H914 AromaticContact ND1-ND1 3.45Å; H899-H914 PolarHBondContact ND1-ND1 3.14Å; H899-H914 PolarHBondContact O-N 3.49Å
900	Q	90	Very high	85.5	Confident	56 Å²	56	53.5 Å²	53.5	26%	0.262	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	137	-177.3	-168.6	176.5	21.1	0	0	110.5	G897 V911 I912	G897-Q900 CarbonylContact C-O 3.51Å; G897-Q900 VanDerWaalsContact CA-O 3.31Å; G897-Q900 WeakPolarHBondContact CA-O 3.38Å; G897-Q900 PolarHBondContact N-O 3.43Å; Q900-V911 HydrophobicContact CG-CG1 4Å; Q900-V911 VanDerWaalsContact NE2-CG1 3.32Å; Q900-I912 CarbonylContact C-O 3.4Å; Q900-I912 VanDerWaalsContact CA-O 3.29Å; Q900-I912 WeakPolarHBondContact CA-O 3.23Å
901	I	90.1	Very high	85.7	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.8	171.7	-58.3	154.2	0	0	0	107	F880 I887 A903 V911 I912	F880-I901 HydrophobicContact CE1-CD1 4.18Å; F880-I901 HydrophobicContact CE1-CG1 4.2Å; F880-I901 HydrophobicContact CE2-CD1 4.03Å; F880-I901 HydrophobicContact CE2-CG1 4.42Å; F880-I901 HydrophobicContact CZ-CD1 3.7Å; F880-I901 HydrophobicContact CZ-CG1 3.7Å; I887-I901 HydrophobicContact CD1-CD1 4.28Å; I887-I901 HydrophobicContact CD1-CG2 4.13Å; I901-A903 HydrophobicContact CG2-CB 4.43Å; I901-V911 WeakPolarHBondContact O-CA 3.32Å; I901-I912 HydrophobicContact CB-CB 4.29Å; I901-I912 PolarHBondContact N-O 3.39Å; I901-I912 PolarHBondContact O-N 3.4Å
902	F	88.8	Confident	86	Confident	36 Å²	36	50.8 Å²	50.8	16%	0.158	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.2	170.9	-178.2	-92.2	0	0	0	108.1	A843 R894 S895 Y904 P909 V911	A843-F902 HydrophobicContact CB-CB 4.4Å; R894-F902 CarbonylContact C-O 3.58Å; R894-F902 VanDerWaalsContact CA-O 3.24Å; R894-F902 WeakPolarHBondContact CA-O 3.43Å; S895-F902 PolarHBondContact N-O 3.42Å; S895-F902 PolarHBondContact O-N 3.13Å; F902-Y904 HydrophobicContact CD1-CE2 4.45Å; F902-Y904 HydrophobicContact CE1-CD2 4.1Å; F902-Y904 AromaticContact CE1-CE2 3.43Å; F902-Y904 HydrophobicContact CE1-CE2 3.43Å; F902-Y904 VanDerWaalsContact CE1-CE2 3.43Å; F902-Y904 AromaticContact CE1-CZ 3.85Å; F902-Y904 AromaticContact CZ-CE2 3.96Å; F902-Y904 HydrophobicContact CZ-CE2 3.96Å; F902-Y904 AromaticContact CZ-CZ 3.89Å; F902-P909 HydrophobicContact CE2-CB 4.26Å; F902-P909 HydrophobicContact CZ-CB 4.07Å; F902-V911 HydrophobicContact CD2-CG2 3.64Å; F902-V911 HydrophobicContact CE2-CG2 4.15Å
903	A	89.2	Confident	86.5	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	155	-177.5	0	0	0	0	0	113	V891 Q893 R894 I901 V910	V891-A903 HydrophobicContact CB-CB 3.95Å; V891-A903 HydrophobicContact CG1-CB 3.72Å; V891-A903 HydrophobicContact CG2-CB 4.39Å; Q893-A903 CarbonylContact O-C 3.38Å; Q893-A903 VanDerWaalsContact O-CA 3.24Å; Q893-A903 WeakPolarHBondContact O-CA 3.26Å; R894-A903 HydrophobicContact CB-CB 3.88Å; I901-A903 HydrophobicContact CG2-CB 4.43Å; A903-V910 PolarHBondContact N-O 3.44Å; A903-V910 PolarHBondContact O-N 2.82Å
904	Y	85.7	Confident	86.9	Confident	65 Å²	65	41.4 Å²	41.4	26%	0.255	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131	171.7	-73.3	-85.1	0	0	0	110.8	V892 Q893 F902 P909	V892-Y904 PolarHBondContact N-O 2.8Å; Q893-Y904 HydrophobicContact CB-CD2 3.97Å; Q893-Y904 PolarHBondContact O-N 2.85Å; F902-Y904 HydrophobicContact CD1-CE2 4.45Å; F902-Y904 HydrophobicContact CE1-CD2 4.1Å; F902-Y904 AromaticContact CE1-CE2 3.43Å; F902-Y904 HydrophobicContact CE1-CE2 3.43Å; F902-Y904 VanDerWaalsContact CE1-CE2 3.43Å; F902-Y904 AromaticContact CE1-CZ 3.85Å; F902-Y904 AromaticContact CZ-CE2 3.96Å; F902-Y904 HydrophobicContact CZ-CE2 3.96Å; F902-Y904 AromaticContact CZ-CZ 3.89Å; Y904-P909 HydrophobicContact CD1-CB 4.11Å; Y904-P909 HydrophobicContact CE1-CB 3.71Å; Y904-P909 HydrophobicContact CE1-CG 4.01Å
905	R	85.4	Confident	86.9	Confident	62 Å²	62	44.3 Å²	44.3	23%	0.234	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	107.3	166.9	-174.4	157.8	177.9	-125.5	-18.2	109.3	H890 K907 V908 Q942 A943	H890-R905 WeakPolarHBondContact O-CD 3.31Å; H890-R905 VanDerWaalsContact O-CG 3.31Å; H890-R905 WeakPolarHBondContact O-CG 3.12Å; R905-K907 PolarHBondContact O-N 3.12Å; R905-V908 PolarHBondContact N-O 3.1Å; R905-V908 PolarHBondContact O-N 3.25Å; R905-V908 VanDerWaalsContact O-N 3.13Å; R905-Q942 PolarHBondContact NH1-O 3.19Å; R905-Q942 PolarHBondContact NH2-O 3.39Å; R905-A943 HydrophobicContact CB-CB 4.29Å; R905-A943 WeakPolarHBondContact CD-O 2.98Å; R905-A943 VanDerWaalsContact NH1-C 3.28Å; R905-A943 PolarHBondContact NH1-O 2.8Å
906	G	81.7	Confident	86.6	Confident	60 Å²	60	46 Å²	46	62%	0.619	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	-119.5	-164.5	0	0	0	0	0	110.3
907	K	81.1	Confident	86	Confident	200 Å²	200	47.5 Å²	47.5	87%	0.87	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	2.9	176.2	-62.6	-176.2	-179.8	179.4	0	113.7	R905	R905-K907 PolarHBondContact O-N 3.12Å
908	V	82.8	Confident	84.6	Confident	18 Å²	18	56.3 Å²	56.3	11%	0.109	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.2	-174.7	-179.3	0	0	0	0	109.9	R905 A932 A943	R905-V908 PolarHBondContact N-O 3.1Å; R905-V908 PolarHBondContact O-N 3.25Å; R905-V908 VanDerWaalsContact O-N 3.13Å; V908-A932 HydrophobicContact CG1-CB 3.95Å; V908-A943 HydrophobicContact CB-CB 3.97Å; V908-A943 HydrophobicContact CG1-CB 3.88Å
909	P	86.4	Confident	83.2	Confident	28 Å²	28	51.7 Å²	51.7	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.2	172	15.4	-10.5	0	0	0	110.9	F902 Y904 H931	F902-P909 HydrophobicContact CE2-CB 4.26Å; F902-P909 HydrophobicContact CZ-CB 4.07Å; Y904-P909 HydrophobicContact CD1-CB 4.11Å; Y904-P909 HydrophobicContact CE1-CB 3.71Å; Y904-P909 HydrophobicContact CE1-CG 4.01Å; P909-H931 HydrophobicContact CB-CB 4.24Å; P909-H931 HydrophobicContact CG-CB 3.88Å; P909-H931 PolarHBondContact O-N 2.91Å
910	V	88.6	Confident	81.2	Confident	1 Å²	1	60 Å²	60	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.1	177	-176.7	0	0	0	0	109.4	A903 I912 I928 V929 A943 L947	A903-V910 PolarHBondContact N-O 3.44Å; A903-V910 PolarHBondContact O-N 2.82Å; V910-I912 HydrophobicContact CG1-CG1 4.5Å; V910-I928 HydrophobicContact CG1-CG2 4.07Å; V910-V929 CarbonylContact C-O 3.41Å; V910-V929 VanDerWaalsContact CA-O 3.31Å; V910-V929 WeakPolarHBondContact CA-O 3.37Å; V910-V929 WeakPolarHBondContact CG1-O 3.27Å; V910-A943 HydrophobicContact CG2-CB 4.08Å; V910-L947 HydrophobicContact CB-CD1 4.34Å; V910-L947 HydrophobicContact CG1-CD1 3.63Å; V910-L947 HydrophobicContact CG2-CD1 4.4Å
911	V	90	Very high	79	Confident	10 Å²	10	65 Å²	65	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.7	174.8	174.8	0	0	0	0	109	Q900 I901 F902 V929 H931	Q900-V911 HydrophobicContact CG-CG1 4Å; Q900-V911 VanDerWaalsContact NE2-CG1 3.32Å; I901-V911 WeakPolarHBondContact O-CA 3.32Å; F902-V911 HydrophobicContact CD2-CG2 3.64Å; F902-V911 HydrophobicContact CE2-CG2 4.15Å; V911-V929 HydrophobicContact CB-CB 4.47Å; V911-V929 PolarHBondContact N-O 3.24Å; V911-V929 PolarHBondContact O-N 2.65Å; V911-H931 WeakPolarHBondContact CG2-NE2 3.36Å
912	I	92.1	Very high	77.3	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.015	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.6	170.8	-58.9	159.6	0	0	0	106.6	F880 F883 I887 Q900 I901 V910 L926 S927 I928	F880-I912 HydrophobicContact CE2-CG2 3.99Å; F883-I912 HydrophobicContact CD1-CD1 4.39Å; F883-I912 HydrophobicContact CD1-CG2 3.93Å; F883-I912 HydrophobicContact CE1-CB 4.49Å; F883-I912 HydrophobicContact CE1-CD1 3.67Å; F883-I912 HydrophobicContact CE1-CG1 4.12Å; F883-I912 HydrophobicContact CE1-CG2 3.61Å; F883-I912 HydrophobicContact CZ-CD1 4.13Å; I887-I912 HydrophobicContact CD1-CD1 3.54Å; Q900-I912 CarbonylContact C-O 3.4Å; Q900-I912 VanDerWaalsContact CA-O 3.29Å; Q900-I912 WeakPolarHBondContact CA-O 3.23Å; I901-I912 HydrophobicContact CB-CB 4.29Å; I901-I912 PolarHBondContact N-O 3.39Å; I901-I912 PolarHBondContact O-N 3.4Å; V910-I912 HydrophobicContact CG1-CG1 4.5Å; I912-L926 HydrophobicContact CG2-CD2 4.39Å; I912-S927 VanDerWaalsContact CA-O 3.29Å; I912-S927 WeakPolarHBondContact CA-O 3.31Å; I912-I928 HydrophobicContact CG1-CG1 4.41Å; I912-I928 HydrophobicContact CG1-CG2 4.43Å
913	S	90.6	Very high	76.6	Confident	20 Å²	20	74.8 Å²	74.8	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.6	177.9	71.2	0	0	0	0	112.1	H899 L926 S927	H899-S913 CarbonylContact O-C 3.59Å; H899-S913 WeakPolarHBondContact O-CA 3.22Å; S913-L926 CarbonylContact O-C 3.14Å; S913-L926 WeakPolarHBondContact O-CA 3.35Å; S913-S927 PolarHBondContact N-O 3.43Å; S913-S927 PolarHBondContact O-N 3.19Å; S913-S927 PolarHBondContact OG-OG 3.08Å
914	H	90.9	Very high	76.5	Confident	19 Å²	19	77.4 Å²	77.4	9%	0.088	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.6	174.1	167.2	-138	0	0	0	108.6	F875 F880 H899 P916 E924 T925	F875-H914 AromaticContact CD1-NE2 3.89Å; F875-H914 AromaticContact CE1-CE1 3.77Å; F875-H914 AromaticContact CE1-NE2 3.75Å; F875-H914 AromaticContact CE2-CD2 3.76Å; F875-H914 AromaticContact CE2-NE2 3.91Å; F875-H914 AromaticContact CZ-CD2 3.71Å; F875-H914 AromaticContact CZ-NE2 3.77Å; F880-H914 HydrophobicContact CB-CB 4.46Å; F880-H914 HydrophobicContact CD2-CB 3.52Å; F880-H914 HydrophobicContact CE2-CB 3.82Å; F880-H914 HydrophobicContact CG-CB 4Å; H899-H914 WeakPolarHBondContact CB-O 3.46Å; H899-H914 AromaticContact ND1-ND1 3.45Å; H899-H914 PolarHBondContact ND1-ND1 3.14Å; H899-H914 PolarHBondContact O-N 3.49Å; H914-P916 VanDerWaalsContact O-CD 3.3Å; H914-P916 WeakPolarHBondContact O-CD 3.42Å; H914-E924 IonicContact NE2-OE2 2.67Å; H914-E924 PolarHBondContact NE2-OE2 3.05Å; H914-T925 WeakPolarHBondContact CA-O 3.47Å
915	Q	86.9	Confident	76.7	Confident	111 Å²	111	74.9 Å²	74.9	52%	0.519	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	106.3	175.8	-64.8	-173.8	-0	0	0	109.8	T925	Q915-T925 PolarHBondContact N-O 3.38Å; Q915-T925 PolarHBondContact O-N 3.12Å
916	P	79.2	Confident	77.1	Confident	59 Å²	59	72 Å²	72	38%	0.383	38%	0.376	S	S	.	.			trans	-69.9	152.4	176.1	30.2	-35.1	0	0	0	111	H914 K918	H914-P916 VanDerWaalsContact O-CD 3.3Å; H914-P916 WeakPolarHBondContact O-CD 3.42Å; P916-K918 PolarHBondContact O-N 3.2Å
917	S	72.4	Confident	77.6	Confident	50 Å²	50	69.1 Å²	69.1	35%	0.35	35%	0.347	S	S	.	.			trans	-64.1	120.8	-178	-180	0	0	0	0	111	G919 F922	S917-G919 VanDerWaalsContact C-N 3.27Å; S917-G919 PolarHBondContact O-N 2.84Å; S917-G919 PolarHBondContact OG-O 3.04Å; S917-F922 WeakPolarHBondContact CB-O 3.47Å; S917-F922 PolarHBondContact OG-O 3.22Å
918	K	55.8	Low	78.1	Confident	190 Å²	190	59.6 Å²	59.6	83%	0.826	31%	0.305	S	S	*	.			trans	-90.4	55.4	168.9	-65.7	-174.6	-179.8	-179.7	0	110.8	P916	P916-K918 PolarHBondContact O-N 3.2Å
919	G	53.8	Low	78.4	Confident	43 Å²	43	59.1 Å²	59.1	44%	0.443	30%	0.302	S	S	.	.	S	Bend	trans	103.8	179.2	173.6	0	0	0	0	0	115.5	S917 L921 F922	S917-G919 VanDerWaalsContact C-N 3.27Å; S917-G919 PolarHBondContact O-N 2.84Å; S917-G919 PolarHBondContact OG-O 3.04Å; G919-L921 PolarHBondContact O-N 3.18Å; G919-F922 PolarHBondContact O-N 3.44Å
920	K	44.5	Very low	78.4	Confident	227 Å²	227	57.8 Å²	57.8	99%	0.987	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-10.8	-168.8	-73	-175.5	176.9	-177.6	0	117.1
921	L	42.6	Very low	77.8	Confident	160 Å²	160	60.4 Å²	60.4	84%	0.838	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-8.8	-172.9	-79.8	154.6	0	0	0	114.3	G919	G919-L921 PolarHBondContact O-N 3.18Å
922	F	54.3	Low	76.8	Confident	140 Å²	140	60.5 Å²	60.5	61%	0.614	31%	0.307	S	S	*	.			trans	-115.3	124.5	-176.3	-67.7	-77.6	0	0	0	111.2	S917 G919	S917-F922 WeakPolarHBondContact CB-O 3.47Å; S917-F922 PolarHBondContact OG-O 3.22Å; G919-F922 PolarHBondContact O-N 3.44Å
923	M	74.1	Confident	75.4	Confident	103 Å²	103	63.3 Å²	63.3	51%	0.507	33%	0.327	S	S	.	.			trans	-75.7	142.4	176.1	-52.1	175.9	105.2	0	0	109.2	P872	P872-M923 VanDerWaalsContact CA-CE 3.48Å; P872-M923 HydrophobicContact CB-CE 3.27Å; P872-M923 HydrophobicContact CG-CE 3.43Å; P872-M923 VanDerWaalsContact CG-CE 3.43Å
924	E	86.9	Confident	73.7	Confident	56 Å²	56	65.3 Å²	65.3	26%	0.262	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	137	172.8	-67.9	-169.6	-137.7	0	0	109.6	F871 F875 H914	F871-E924 PolarHBondContact N-O 2.97Å; F875-E924 HydrophobicContact CB-CB 3.93Å; F875-E924 VanDerWaalsContact CB-CD 3.49Å; F875-E924 HydrophobicContact CB-CG 4.28Å; F875-E924 WeakPolarHBondContact CB-OE2 3.15Å; F875-E924 HydrophobicContact CD2-CB 4.28Å; F875-E924 HydrophobicContact CG-CB 4.39Å; F875-E924 WeakPolarHBondContact CG-OE2 3.18Å; H914-E924 IonicContact NE2-OE2 2.67Å; H914-E924 PolarHBondContact NE2-OE2 3.05Å
925	T	90.3	Very high	72.3	Confident	13 Å²	13	69.7 Å²	69.7	8%	0.08	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.7	-176.3	63.9	0	0	0	0	111.8	Q868 Y869 H914 Q915	Q868-T925 HydrophobicContact CG-CG2 4.47Å; Y869-T925 CarbonylContact O-C 3.59Å; Y869-T925 WeakPolarHBondContact O-CA 3.37Å; Y869-T925 WeakPolarHBondContact O-CB 3.35Å; H914-T925 WeakPolarHBondContact CA-O 3.47Å; Q915-T925 PolarHBondContact N-O 3.38Å; Q915-T925 PolarHBondContact O-N 3.12Å
926	L	93.8	Very high	71.2	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.5	171.4	-173.3	158.6	0	0	0	107.8	Y869 F871 F875 L879 F883 I912 S913 I928 L951	Y869-L926 PolarHBondContact N-O 3.34Å; Y869-L926 PolarHBondContact O-N 2.96Å; F871-L926 HydrophobicContact CE2-CB 4.11Å; F875-L926 HydrophobicContact CE2-CB 4.32Å; F875-L926 HydrophobicContact CE2-CD1 4.31Å; F875-L926 HydrophobicContact CZ-CD1 4.35Å; L879-L926 HydrophobicContact CD2-CD1 4.46Å; F883-L926 HydrophobicContact CD1-CD1 4.49Å; F883-L926 HydrophobicContact CE1-CD2 4.42Å; I912-L926 HydrophobicContact CG2-CD2 4.39Å; S913-L926 CarbonylContact O-C 3.14Å; S913-L926 WeakPolarHBondContact O-CA 3.35Å; L926-I928 HydrophobicContact CD2-CG1 4.16Å; L926-L951 HydrophobicContact CD1-CD1 4.24Å; L926-L951 HydrophobicContact CD2-CD2 3.61Å
927	S	92.6	Very high	71	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.4	179.9	60.7	0	0	0	0	112.1	Y866 I867 I912 S913	Y866-S927 VanDerWaalsContact OH-CB 3.31Å; Y866-S927 WeakPolarHBondContact OH-CB 3.38Å; Y866-S927 PolarHBondContact OH-OG 3.03Å; I867-S927 CarbonylContact O-C 3.31Å; I867-S927 VanDerWaalsContact O-CA 3.24Å; I867-S927 WeakPolarHBondContact O-CA 3.19Å; I912-S927 VanDerWaalsContact CA-O 3.29Å; I912-S927 WeakPolarHBondContact CA-O 3.31Å; S913-S927 PolarHBondContact N-O 3.43Å; S913-S927 PolarHBondContact O-N 3.19Å; S913-S927 PolarHBondContact OG-OG 3.08Å
928	I	92.4	Very high	71.3	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.6	172.7	-53.9	173.6	0	0	0	106.9	I867 F883 V910 I912 L926 V944 L947 V948 L951	I867-I928 PolarHBondContact N-O 3.11Å; I867-I928 PolarHBondContact O-N 2.79Å; F883-I928 HydrophobicContact CE1-CD1 4.2Å; F883-I928 HydrophobicContact CE1-CG1 4.4Å; F883-I928 HydrophobicContact CZ-CD1 3.87Å; V910-I928 HydrophobicContact CG1-CG2 4.07Å; I912-I928 HydrophobicContact CG1-CG1 4.41Å; I912-I928 HydrophobicContact CG1-CG2 4.43Å; L926-I928 HydrophobicContact CD2-CG1 4.16Å; I928-V944 HydrophobicContact CG2-CG1 3.95Å; I928-V944 HydrophobicContact CG2-CG2 4.31Å; I928-L947 HydrophobicContact CD1-CB 4.39Å; I928-L947 HydrophobicContact CG2-CB 4.47Å; I928-L947 HydrophobicContact CG2-CD1 4.34Å; I928-V948 HydrophobicContact CD1-CG2 3.93Å; I928-L951 HydrophobicContact CD1-CD2 4.13Å
929	V	88.8	Confident	72.5	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.048	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.9	-171.9	-171.5	0	0	0	0	109.9	Q864 L865 Y866 V910 V911	Q864-V929 HydrophobicContact CB-CG1 4.44Å; L865-V929 WeakPolarHBondContact O-CA 3.47Å; Y866-V929 HydrophobicContact CD2-CB 4.3Å; Y866-V929 HydrophobicContact CD2-CG1 4.01Å; Y866-V929 HydrophobicContact CD2-CG2 3.36Å; Y866-V929 HydrophobicContact CE2-CG2 3.37Å; Y866-V929 HydrophobicContact CG-CG2 3.99Å; V910-V929 CarbonylContact C-O 3.41Å; V910-V929 VanDerWaalsContact CA-O 3.31Å; V910-V929 WeakPolarHBondContact CA-O 3.37Å; V910-V929 WeakPolarHBondContact CG1-O 3.27Å; V911-V929 HydrophobicContact CB-CB 4.47Å; V911-V929 PolarHBondContact N-O 3.24Å; V911-V929 PolarHBondContact O-N 2.65Å
930	S	85.6	Confident	73.9	Confident	1 Å²	1	61 Å²	61	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.4	169.4	68.9	0	0	0	0	110.7	Q864 L865 A932 A940	Q864-S930 VanDerWaalsContact CB-O 3.31Å; Q864-S930 WeakPolarHBondContact CB-O 3.34Å; Q864-S930 WeakPolarHBondContact CG-O 3.33Å; L865-S930 WeakPolarHBondContact CB-OG 3.41Å; L865-S930 PolarHBondContact O-N 2.77Å; S930-A932 VanDerWaalsContact C-N 3.32Å; S930-A932 PolarHBondContact O-N 3.48Å; S930-A940 WeakPolarHBondContact OG-CB 3.48Å
931	H	75.8	Confident	75.9	Confident	56 Å²	56	50.7 Å²	50.7	26%	0.259	26%	0.263	S	S	.	.			trans	-94.9	29.5	176	-69.6	-71.2	0	0	0	113.1	Q864 P909 V911	Q864-H931 PolarHBondContact NE2-ND1 3.08Å; Q864-H931 PolarHBondContact OE1-CE1 2.93Å; Q864-H931 PolarHBondContact OE1-ND1 3.46Å; P909-H931 HydrophobicContact CB-CB 4.24Å; P909-H931 HydrophobicContact CG-CB 3.88Å; P909-H931 PolarHBondContact O-N 2.91Å; V911-H931 WeakPolarHBondContact CG2-NE2 3.36Å
932	A	68.8	Low	77.9	Confident	11 Å²	11	47.8 Å²	47.8	9%	0.091	25%	0.246	C	C	.	.			trans	-72.4	150.3	176.1	0	0	0	0	0	112	V908 S930 A940	V908-A932 HydrophobicContact CG1-CB 3.95Å; S930-A932 VanDerWaalsContact C-N 3.32Å; S930-A932 PolarHBondContact O-N 3.48Å; A932-A940 HydrophobicContact CB-CB 3.9Å
933	S	63.8	Low	79.4	Confident	62 Å²	62	41.3 Å²	41.3	43%	0.434	22%	0.218	S	C	.	.			trans	-80.1	149.1	172.8	60.5	0	0	0	0	112.4	P935 N936	S933-P935 WeakPolarHBondContact O-CD 3.47Å; S933-N936 PolarHBondContact O-N 3.42Å
934	L	55.3	Low	80.1	Confident	63 Å²	63	36.4 Å²	36.4	33%	0.33	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-48.4	-34.6	-176.6	-82.7	165	0	0	0	118	E863 N936 I937 L1013	E863-L934 HydrophobicContact CB-CD1 3.84Å; E863-L934 HydrophobicContact CB-CD2 3.67Å; E863-L934 HydrophobicContact CB-CG 3.78Å; E863-L934 HydrophobicContact CG-CD1 4.01Å; E863-L934 HydrophobicContact CG-CD2 4.43Å; E863-L934 HydrophobicContact CG-CG 4.48Å; L934-N936 PolarHBondContact O-N 3.24Å; L934-N936 VanDerWaalsContact O-N 3.08Å; L934-I937 HydrophobicContact CD2-CD1 4.11Å; L934-I937 HydrophobicContact CD2-CG1 4.4Å; L934-I937 WeakPolarHBondContact O-CG1 3.47Å; L934-L1013 HydrophobicContact CD2-CD1 4.21Å
935	P	60.4	Low	80.2	Confident	111 Å²	111	35.9 Å²	35.9	72%	0.721	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-63.9	-13.5	176.4	21.9	-31.8	0	0	0	113.6	S933	S933-P935 WeakPolarHBondContact O-CD 3.47Å
936	N	64.7	Low	80.2	Confident	84 Å²	84	36.2 Å²	36.2	45%	0.449	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-123.9	42.2	-175.9	-62.4	-30.6	0	0	0	113.6	S933 L934 W938 T939 A940	S933-N936 PolarHBondContact O-N 3.42Å; L934-N936 PolarHBondContact O-N 3.24Å; L934-N936 VanDerWaalsContact O-N 3.08Å; N936-W938 PolarHBondContact O-N 3.22Å; N936-W938 VanDerWaalsContact O-N 3.14Å; N936-T939 HydrophobicContact CB-CG2 3.98Å; N936-T939 VanDerWaalsContact CB-OG1 3.23Å; N936-T939 WeakPolarHBondContact CB-OG1 3.44Å; N936-T939 PolarHBondContact O-N 3.21Å; N936-T939 PolarHBondContact O-OG1 3.05Å; N936-A940 PolarHBondContact O-N 2.88Å
937	I	75.1	Confident	80.1	Confident	27 Å²	27	36.3 Å²	36.3	14%	0.138	20%	0.197	C	C	.	.	H	α-helix	trans	-52.5	-35.8	176.1	-68	164.3	0	0	0	111.9	L934 T939 A940 W941 A1012 L1013	L934-I937 HydrophobicContact CD2-CD1 4.11Å; L934-I937 HydrophobicContact CD2-CG1 4.4Å; L934-I937 WeakPolarHBondContact O-CG1 3.47Å; I937-T939 VanDerWaalsContact C-N 3.33Å; I937-T939 PolarHBondContact O-N 3.18Å; I937-A940 VanDerWaalsContact O-CB 3.27Å; I937-A940 WeakPolarHBondContact O-CB 3.33Å; I937-A940 PolarHBondContact O-N 2.91Å; I937-A940 VanDerWaalsContact O-N 3.12Å; I937-W941 PolarHBondContact O-N 3.03Å; I937-W941 VanDerWaalsContact O-N 3.1Å; I937-A1012 HydrophobicContact CD1-CB 4.29Å; I937-A1012 HydrophobicContact CG2-CB 4.01Å; I937-A1012 WeakPolarHBondContact CG2-O 3.48Å; I937-L1013 HydrophobicContact CD1-CD2 4.11Å; I937-L1013 HydrophobicContact CD1-CG 4.1Å; I937-L1013 HydrophobicContact CG1-CD2 3.93Å; I937-L1013 HydrophobicContact CG1-CG 4.47Å; I937-L1013 HydrophobicContact CG2-CD2 4.11Å
938	W	78.4	Confident	80	Confident	114 Å²	114	37 Å²	37	43%	0.432	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-42.3	174.3	177.5	-95.4	0	0	0	112.5	N936 A940 W941 Q942 P1017	N936-W938 PolarHBondContact O-N 3.22Å; N936-W938 VanDerWaalsContact O-N 3.14Å; W938-A940 VanDerWaalsContact C-N 3.28Å; W938-A940 PolarHBondContact O-N 2.8Å; W938-W941 PolarHBondContact O-N 3.21Å; W938-Q942 HydrophobicContact CZ2-CG 4.41Å; W938-Q942 WeakPolarHBondContact O-CG 3.22Å; W938-Q942 PolarHBondContact O-N 3.36Å; W938-P1017 HydrophobicContact CD2-CG 4.4Å; W938-P1017 HydrophobicContact CE3-CB 3.48Å; W938-P1017 VanDerWaalsContact CE3-CB 3.48Å; W938-P1017 HydrophobicContact CE3-CG 3.31Å; W938-P1017 HydrophobicContact CH2-CG 4.25Å; W938-P1017 HydrophobicContact CZ3-CB 3.38Å; W938-P1017 HydrophobicContact CZ3-CG 3.24Å
939	T	81.1	Confident	80	Confident	41 Å²	41	42.1 Å²	42.1	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-68.5	-28	176.9	69.2	0	0	0	0	112.7	N936 I937 A943	N936-T939 HydrophobicContact CB-CG2 3.98Å; N936-T939 VanDerWaalsContact CB-OG1 3.23Å; N936-T939 WeakPolarHBondContact CB-OG1 3.44Å; N936-T939 PolarHBondContact O-N 3.21Å; N936-T939 PolarHBondContact O-OG1 3.05Å; I937-T939 VanDerWaalsContact C-N 3.33Å; I937-T939 PolarHBondContact O-N 3.18Å; T939-A943 WeakPolarHBondContact O-CB 3.43Å; T939-A943 PolarHBondContact O-N 3.32Å
940	A	82.6	Confident	80.1	Confident	4 Å²	4	44 Å²	44	3%	0.033	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-48.8	173.8	0	0	0	0	0	110.8	S930 A932 N936 I937 W938 A943 V944	S930-A940 WeakPolarHBondContact OG-CB 3.48Å; A932-A940 HydrophobicContact CB-CB 3.9Å; N936-A940 PolarHBondContact O-N 2.88Å; I937-A940 VanDerWaalsContact O-CB 3.27Å; I937-A940 WeakPolarHBondContact O-CB 3.33Å; I937-A940 PolarHBondContact O-N 2.91Å; I937-A940 VanDerWaalsContact O-N 3.12Å; W938-A940 VanDerWaalsContact C-N 3.28Å; W938-A940 PolarHBondContact O-N 2.8Å; A940-A943 PolarHBondContact O-N 3.08Å; A940-V944 WeakPolarHBondContact O-CG2 3.49Å; A940-V944 PolarHBondContact O-N 2.93Å
941	W	86	Confident	80.5	Confident	10 Å²	10	43.9 Å²	43.9	4%	0.038	23%	0.233	C	C	.	.	H	α-helix	trans	-63.7	-43.3	174.1	-79.1	109.3	0	0	0	112.2	L865 I867 I937 W938 A943 V944 T945 L988 A1012 P1016 P1017	L865-W941 HydrophobicContact CD1-CH2 3.84Å; L865-W941 HydrophobicContact CD1-CZ2 3.53Å; L865-W941 HydrophobicContact CD2-CD2 3.64Å; L865-W941 HydrophobicContact CD2-CE3 3.75Å; L865-W941 HydrophobicContact CD2-CG 4.22Å; L865-W941 HydrophobicContact CD2-CH2 4.03Å; L865-W941 HydrophobicContact CD2-CZ2 3.95Å; L865-W941 HydrophobicContact CD2-CZ3 3.94Å; L865-W941 HydrophobicContact CG-CZ2 4.41Å; I867-W941 HydrophobicContact CD1-CH2 4.43Å; I867-W941 HydrophobicContact CD1-CZ3 4.18Å; I937-W941 PolarHBondContact O-N 3.03Å; I937-W941 VanDerWaalsContact O-N 3.1Å; W938-W941 PolarHBondContact O-N 3.21Å; W941-A943 PolarHBondContact O-N 2.92Å; W941-V944 PolarHBondContact O-N 3.48Å; W941-T945 WeakPolarHBondContact O-CB 3.46Å; W941-T945 PolarHBondContact O-N 2.83Å; W941-T945 PolarHBondContact O-OG1 3.38Å; W941-L988 HydrophobicContact CH2-CD2 3.48Å; W941-L988 VanDerWaalsContact CH2-CD2 3.48Å; W941-L988 HydrophobicContact CZ3-CD2 3.75Å; W941-A1012 PolarHBondContact NE1-O 3.42Å; W941-P1016 HydrophobicContact CD2-CB 4.47Å; W941-P1016 HydrophobicContact CE3-CB 4.21Å; W941-P1016 HydrophobicContact CH2-CB 4.32Å; W941-P1016 HydrophobicContact CZ3-CB 4.14Å; W941-P1017 HydrophobicContact CB-CG 4.19Å; W941-P1017 HydrophobicContact CG-CG 4.28Å
942	Q	85	Confident	81.3	Confident	99 Å²	99	43.5 Å²	43.5	46%	0.463	23%	0.233	S	C	.	.	H	α-helix	trans	-57.2	-36.5	175.1	-79.1	-172	-33.2	0	0	111.7	R905 W938	R905-Q942 PolarHBondContact NH1-O 3.19Å; R905-Q942 PolarHBondContact NH2-O 3.39Å; W938-Q942 HydrophobicContact CZ2-CG 4.41Å; W938-Q942 WeakPolarHBondContact O-CG 3.22Å; W938-Q942 PolarHBondContact O-N 3.36Å
943	A	85.9	Confident	82.3	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-76.1	-39.9	177.9	0	0	0	0	0	113.4	R905 V908 V910 T939 A940 W941	R905-A943 HydrophobicContact CB-CB 4.29Å; R905-A943 WeakPolarHBondContact CD-O 2.98Å; R905-A943 VanDerWaalsContact NH1-C 3.28Å; R905-A943 PolarHBondContact NH1-O 2.8Å; V908-A943 HydrophobicContact CB-CB 3.97Å; V908-A943 HydrophobicContact CG1-CB 3.88Å; V910-A943 HydrophobicContact CG2-CB 4.08Å; T939-A943 WeakPolarHBondContact O-CB 3.43Å; T939-A943 PolarHBondContact O-N 3.32Å; A940-A943 PolarHBondContact O-N 3.08Å; W941-A943 PolarHBondContact O-N 2.92Å
944	V	88.5	Confident	83.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-84.9	-33.9	-173.8	171.3	0	0	0	0	113.5	L865 I867 I928 A940 W941 L947 V948	L865-V944 HydrophobicContact CD2-CB 4.13Å; L865-V944 HydrophobicContact CD2-CG1 4.21Å; L865-V944 HydrophobicContact CD2-CG2 4.23Å; I867-V944 HydrophobicContact CD1-CG1 3.74Å; I928-V944 HydrophobicContact CG2-CG1 3.95Å; I928-V944 HydrophobicContact CG2-CG2 4.31Å; A940-V944 WeakPolarHBondContact O-CG2 3.49Å; A940-V944 PolarHBondContact O-N 2.93Å; W941-V944 PolarHBondContact O-N 3.48Å; V944-L947 WeakPolarHBondContact O-CA 3.45Å; V944-L947 WeakPolarHBondContact O-CB 3.34Å; V944-L947 PolarHBondContact O-N 3.02Å; V944-V948 HydrophobicContact CG1-CG2 3.69Å; V944-V948 PolarHBondContact O-N 2.91Å
945	T	89	Confident	85.5	Confident	46 Å²	46	42.6 Å²	42.6	28%	0.282	22%	0.22	S	C	.	.	H	α-helix	trans	-57.9	-54.1	-168.6	-59.5	0	0	0	0	112.7	W941 L947 V948 E949	W941-T945 WeakPolarHBondContact O-CB 3.46Å; W941-T945 PolarHBondContact O-N 2.83Å; W941-T945 PolarHBondContact O-OG1 3.38Å; T945-L947 VanDerWaalsContact C-N 3.28Å; T945-L947 PolarHBondContact O-N 2.99Å; T945-V948 WeakPolarHBondContact O-CA 3.49Å; T945-V948 WeakPolarHBondContact O-CB 3.38Å; T945-V948 PolarHBondContact O-N 3.48Å; T945-E949 HydrophobicContact CG2-CG 4.49Å; T945-E949 WeakPolarHBondContact CG2-OE1 3.41Å; T945-E949 WeakPolarHBondContact O-CG 3.48Å; T945-E949 PolarHBondContact O-N 2.92Å
946	P	90	Very high	86.9	Confident	20 Å²	20	43.5 Å²	43.5	13%	0.13	22%	0.215	C	C	.	.	H	α-helix	trans	-55.6	-33.9	171.8	-38.4	41.1	0	0	0	115.9	V948 E949 E950	P946-V948 VanDerWaalsContact C-N 3.35Å; P946-E949 PolarHBondContact O-N 2.74Å; P946-E950 VanDerWaalsContact O-CG 3.29Å; P946-E950 WeakPolarHBondContact O-CG 3.08Å; P946-E950 PolarHBondContact O-N 2.72Å
947	L	92.4	Very high	88	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-37.1	176.6	-53.5	176.8	0	0	0	111.1	F883 I887 H890 V910 I928 V944 T945 L951	F883-L947 WeakPolarHBondContact CE2-O 3.24Å; F883-L947 HydrophobicContact CZ-CB 4.25Å; F883-L947 WeakPolarHBondContact CZ-O 3.38Å; I887-L947 HydrophobicContact CB-CD2 3.81Å; I887-L947 HydrophobicContact CG2-CD2 3.55Å; H890-L947 HydrophobicContact CB-CD2 4.14Å; V910-L947 HydrophobicContact CB-CD1 4.34Å; V910-L947 HydrophobicContact CG1-CD1 3.63Å; V910-L947 HydrophobicContact CG2-CD1 4.4Å; I928-L947 HydrophobicContact CD1-CB 4.39Å; I928-L947 HydrophobicContact CG2-CB 4.47Å; I928-L947 HydrophobicContact CG2-CD1 4.34Å; V944-L947 WeakPolarHBondContact O-CA 3.45Å; V944-L947 WeakPolarHBondContact O-CB 3.34Å; V944-L947 PolarHBondContact O-N 3.02Å; T945-L947 VanDerWaalsContact C-N 3.28Å; T945-L947 PolarHBondContact O-N 2.99Å; L947-L951 WeakPolarHBondContact O-CB 3.19Å; L947-L951 PolarHBondContact O-N 3.47Å; L947-L951 VanDerWaalsContact O-N 3.1Å
948	V	91.5	Very high	88.9	Confident	14 Å²	14	41.7 Å²	41.7	9%	0.085	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-40.9	172.7	166.2	0	0	0	0	111.1	I867 I928 V944 T945 P946 L951 N952	I867-V948 HydrophobicContact CD1-CG2 3.74Å; I928-V948 HydrophobicContact CD1-CG2 3.93Å; V944-V948 HydrophobicContact CG1-CG2 3.69Å; V944-V948 PolarHBondContact O-N 2.91Å; T945-V948 WeakPolarHBondContact O-CA 3.49Å; T945-V948 WeakPolarHBondContact O-CB 3.38Å; T945-V948 PolarHBondContact O-N 3.48Å; P946-V948 VanDerWaalsContact C-N 3.35Å; V948-L951 PolarHBondContact O-N 2.93Å; V948-N952 WeakPolarHBondContact CG1-ND2 3.5Å; V948-N952 WeakPolarHBondContact O-CB 3.35Å; V948-N952 VanDerWaalsContact O-CG 3.27Å; V948-N952 PolarHBondContact O-N 3.43Å; V948-N952 PolarHBondContact O-ND2 3.5Å; V948-N952 VanDerWaalsContact O-ND2 3.14Å
949	E	91	Very high	89.4	Confident	108 Å²	108	39 Å²	39	51%	0.505	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-48.7	176.2	-71.2	167.9	174.4	0	0	111.5	T945 P946 L951 N952 M953	T945-E949 HydrophobicContact CG2-CG 4.49Å; T945-E949 WeakPolarHBondContact CG2-OE1 3.41Å; T945-E949 WeakPolarHBondContact O-CG 3.48Å; T945-E949 PolarHBondContact O-N 2.92Å; P946-E949 PolarHBondContact O-N 2.74Å; E949-L951 VanDerWaalsContact C-N 3.33Å; E949-L951 PolarHBondContact O-N 3.38Å; E949-N952 PolarHBondContact O-N 3.2Å; E949-M953 WeakPolarHBondContact O-CG 3.24Å; E949-M953 PolarHBondContact O-N 3.1Å
950	E	92.3	Very high	89.9	Confident	47 Å²	47	37.3 Å²	37.3	22%	0.22	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-42.1	176	-70.5	-63.2	168.3	0	0	112.2	F883 Q886 H890 P946 M953 L954	F883-E950 HydrophobicContact CE2-CB 4.16Å; Q886-E950 HydrophobicContact CB-CB 4.43Å; H890-E950 IonicContact CD2-OE1 2.76Å; H890-E950 IonicContact CE1-OE1 3.3Å; H890-E950 IonicContact NE2-OE1 3.36Å; H890-E950 PolarHBondContact NE2-OE1 3.39Å; P946-E950 VanDerWaalsContact O-CG 3.29Å; P946-E950 WeakPolarHBondContact O-CG 3.08Å; P946-E950 PolarHBondContact O-N 2.72Å; E950-M953 PolarHBondContact O-N 3.47Å; E950-L954 WeakPolarHBondContact O-CG 3.33Å; E950-L954 PolarHBondContact O-N 3.12Å
951	L	93.9	Very high	90.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-44.5	175.8	-179.2	60.8	0	0	0	111.4	Y869 L879 F883 L926 I928 L947 V948 E949 M953 L954 L955	Y869-L951 HydrophobicContact CD1-CD2 4.2Å; Y869-L951 HydrophobicContact CD2-CD2 3.65Å; Y869-L951 HydrophobicContact CE1-CD2 4.08Å; Y869-L951 HydrophobicContact CE2-CD2 3.53Å; Y869-L951 HydrophobicContact CG-CD2 4.02Å; L879-L951 HydrophobicContact CD1-CD1 4.16Å; L879-L951 HydrophobicContact CD2-CD1 4.36Å; L879-L951 HydrophobicContact CG-CD1 4.39Å; F883-L951 HydrophobicContact CD2-CB 4.15Å; F883-L951 HydrophobicContact CD2-CD1 4.35Å; F883-L951 HydrophobicContact CE2-CB 3.72Å; F883-L951 HydrophobicContact CG-CD1 4.33Å; F883-L951 HydrophobicContact CZ-CB 4.02Å; L926-L951 HydrophobicContact CD1-CD1 4.24Å; L926-L951 HydrophobicContact CD2-CD2 3.61Å; I928-L951 HydrophobicContact CD1-CD2 4.13Å; L947-L951 WeakPolarHBondContact O-CB 3.19Å; L947-L951 PolarHBondContact O-N 3.47Å; L947-L951 VanDerWaalsContact O-N 3.1Å; V948-L951 PolarHBondContact O-N 2.93Å; E949-L951 VanDerWaalsContact C-N 3.33Å; E949-L951 PolarHBondContact O-N 3.38Å; L951-M953 VanDerWaalsContact C-N 3.31Å; L951-M953 PolarHBondContact O-N 3.37Å; L951-L954 PolarHBondContact O-N 3.04Å; L951-L955 HydrophobicContact CD1-CG 4.44Å; L951-L955 HydrophobicContact CG-CD1 4.14Å; L951-L955 HydrophobicContact CG-CG 4.49Å; L951-L955 VanDerWaalsContact O-CG 3.3Å; L951-L955 WeakPolarHBondContact O-CG 3.17Å; L951-L955 PolarHBondContact O-N 2.96Å
952	N	91.6	Very high	90.6	Very high	47 Å²	47	37.4 Å²	37.4	25%	0.251	19%	0.191	S	C	.	.	H	α-helix	trans	-62.6	-38.4	177.5	-76	-34.9	0	0	0	111.7	Y869 V948 E949 L955 Q956	Y869-N952 PolarHBondContact OH-OD1 2.94Å; V948-N952 WeakPolarHBondContact CG1-ND2 3.5Å; V948-N952 WeakPolarHBondContact O-CB 3.35Å; V948-N952 VanDerWaalsContact O-CG 3.27Å; V948-N952 PolarHBondContact O-N 3.43Å; V948-N952 PolarHBondContact O-ND2 3.5Å; V948-N952 VanDerWaalsContact O-ND2 3.14Å; E949-N952 PolarHBondContact O-N 3.2Å; N952-L955 PolarHBondContact O-N 3.43Å; N952-Q956 WeakPolarHBondContact O-CG 3.19Å; N952-Q956 PolarHBondContact O-N 3.34Å
953	M	90.4	Very high	91	Very high	110 Å²	110	35.3 Å²	35.3	54%	0.542	18%	0.179	S	C	.	.	H	α-helix	trans	-61.2	-43.8	173.2	-72.6	-60.7	-64.4	0	0	111.7	E949 E950 L951 L955 Q956	E949-M953 WeakPolarHBondContact O-CG 3.24Å; E949-M953 PolarHBondContact O-N 3.1Å; E950-M953 PolarHBondContact O-N 3.47Å; L951-M953 VanDerWaalsContact C-N 3.31Å; L951-M953 PolarHBondContact O-N 3.37Å; M953-L955 VanDerWaalsContact C-N 3.31Å; M953-L955 PolarHBondContact O-N 2.89Å; M953-Q956 WeakPolarHBondContact O-CB 3.17Å; M953-Q956 PolarHBondContact O-N 3.26Å
954	L	91.8	Very high	91.2	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-36.2	174.6	-71.6	173.4	0	0	0	112.5	L879 R882 F883 Q886 E950 L951 Q956 E957	L879-L954 HydrophobicContact CD1-CB 4.02Å; L879-L954 HydrophobicContact CD1-CD1 4.42Å; R882-L954 HydrophobicContact CB-CD1 4.39Å; R882-L954 HydrophobicContact CB-CD2 4.42Å; F883-L954 HydrophobicContact CB-CD1 3.95Å; F883-L954 HydrophobicContact CD2-CD1 4.13Å; Q886-L954 HydrophobicContact CG-CD1 4.08Å; Q886-L954 HydrophobicContact CG-CD2 4.13Å; Q886-L954 HydrophobicContact CG-CG 4.3Å; E950-L954 WeakPolarHBondContact O-CG 3.33Å; E950-L954 PolarHBondContact O-N 3.12Å; L951-L954 PolarHBondContact O-N 3.04Å; L954-Q956 VanDerWaalsContact C-N 3.34Å; L954-E957 WeakPolarHBondContact O-CB 3.36Å; L954-E957 PolarHBondContact O-N 3.09Å
955	L	93.1	Very high	91.4	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-71.2	-27.1	177.6	-67.6	172.7	0	0	0	112.6	Y869 F871 L879 L951 N952 M953 E957 W958 L961 Y963	Y869-L955 HydrophobicContact CD1-CD1 3.85Å; Y869-L955 HydrophobicContact CE1-CD1 3.81Å; F871-L955 HydrophobicContact CE1-CD2 3.82Å; F871-L955 HydrophobicContact CZ-CD2 4.11Å; L879-L955 HydrophobicContact CD1-CD2 4.43Å; L879-L955 HydrophobicContact CD2-CD2 3.98Å; L951-L955 HydrophobicContact CD1-CG 4.44Å; L951-L955 HydrophobicContact CG-CD1 4.14Å; L951-L955 HydrophobicContact CG-CG 4.49Å; L951-L955 VanDerWaalsContact O-CG 3.3Å; L951-L955 WeakPolarHBondContact O-CG 3.17Å; L951-L955 PolarHBondContact O-N 2.96Å; N952-L955 PolarHBondContact O-N 3.43Å; M953-L955 VanDerWaalsContact C-N 3.31Å; M953-L955 PolarHBondContact O-N 2.89Å; L955-E957 PolarHBondContact O-N 3.23Å; L955-W958 WeakPolarHBondContact O-CB 3.3Å; L955-W958 PolarHBondContact O-N 3.06Å; L955-L961 HydrophobicContact CD2-CD2 3.67Å; L955-Y963 HydrophobicContact CB-CE1 4.27Å; L955-Y963 HydrophobicContact CD1-CD1 4.47Å; L955-Y963 HydrophobicContact CD1-CD2 4.24Å; L955-Y963 HydrophobicContact CD1-CE1 4.17Å; L955-Y963 HydrophobicContact CD1-CE2 3.91Å
956	Q	90.2	Very high	91.5	Very high	130 Å²	130	37.6 Å²	37.6	61%	0.607	19%	0.188	S	C	*	.	H	α-helix	trans	-62.5	-25.7	173.8	-73.4	173.1	15.6	0	0	112.8	N952 M953 L954 W958	N952-Q956 WeakPolarHBondContact O-CG 3.19Å; N952-Q956 PolarHBondContact O-N 3.34Å; M953-Q956 WeakPolarHBondContact O-CB 3.17Å; M953-Q956 PolarHBondContact O-N 3.26Å; L954-Q956 VanDerWaalsContact C-N 3.34Å; Q956-W958 PolarHBondContact O-N 3.01Å; Q956-W958 VanDerWaalsContact O-N 3.1Å
957	E	88.8	Confident	91.6	Very high	65 Å²	65	36.7 Å²	36.7	30%	0.304	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-6.8	172.7	-58.4	-174.3	-168.3	0	0	113.5	K516 R882 L954 L955 P959	K516-E957 VanDerWaalsContact CD-O 3.3Å; K516-E957 WeakPolarHBondContact CD-O 3.47Å; K516-E957 WeakPolarHBondContact CE-O 3.42Å; K516-E957 PolarHBondContact NZ-O 3.03Å; K516-E957 IonicContact NZ-OE2 2.85Å; R882-E957 IonicContact CZ-OE1 3.55Å; R882-E957 IonicContact CZ-OE2 3.74Å; R882-E957 IonicContact NH1-OE1 3.63Å; R882-E957 IonicContact NH1-OE2 3.6Å; R882-E957 PolarHBondContact NH1-OE2 3.33Å; R882-E957 VanDerWaalsContact NH2-CD 3.33Å; R882-E957 IonicContact NH2-OE1 3.65Å; R882-E957 PolarHBondContact NH2-OE1 3.42Å; R882-E957 IonicContact NH2-OE2 3Å; R882-E957 PolarHBondContact NH2-OE2 2.84Å; R882-E957 VanDerWaalsContact NH2-OE2 3.15Å; L954-E957 WeakPolarHBondContact O-CB 3.36Å; L954-E957 PolarHBondContact O-N 3.09Å; L955-E957 PolarHBondContact O-N 3.23Å; E957-P959 VanDerWaalsContact C-CD 3.47Å; E957-P959 WeakPolarHBondContact O-CD 3.11Å
958	W	92.7	Very high	91.4	Very high	8 Å²	8	37.3 Å²	37.3	3%	0.03	19%	0.185	C	C	.	.			trans	-121	71.8	-178.2	-60.1	82.6	0	0	0	110.9	P479 L512 A515 K516 P876 P877 L955 Q956 G960 L961	P479-W958 HydrophobicContact CB-CH2 3.82Å; P479-W958 HydrophobicContact CB-CZ2 3.81Å; P479-W958 HydrophobicContact CG-CH2 3.61Å; P479-W958 HydrophobicContact CG-CZ2 3.74Å; L512-W958 HydrophobicContact CD1-CH2 3.9Å; L512-W958 HydrophobicContact CD1-CZ3 3.82Å; A515-W958 HydrophobicContact CB-CE3 3.96Å; A515-W958 HydrophobicContact CB-CZ3 4.4Å; A515-W958 CarbonylContact O-C 3.24Å; A515-W958 VanDerWaalsContact O-C 3.29Å; K516-W958 HydrophobicContact CB-CE3 3.73Å; K516-W958 HydrophobicContact CB-CH2 4.43Å; K516-W958 HydrophobicContact CB-CZ3 3.63Å; K516-W958 HydrophobicContact CD-CD2 4Å; K516-W958 HydrophobicContact CD-CE3 3.94Å; K516-W958 HydrophobicContact CD-CH2 4.34Å; K516-W958 HydrophobicContact CD-CZ2 4.41Å; K516-W958 HydrophobicContact CD-CZ3 4.13Å; K516-W958 HydrophobicContact CG-CE3 4.38Å; K516-W958 HydrophobicContact CG-CZ3 4.26Å; P876-W958 HydrophobicContact CB-CD2 3.9Å; P876-W958 HydrophobicContact CB-CE3 4.25Å; P876-W958 HydrophobicContact CB-CG 4.49Å; P876-W958 HydrophobicContact CB-CH2 4.03Å; P876-W958 HydrophobicContact CB-CZ2 3.64Å; P876-W958 HydrophobicContact CB-CZ3 4.3Å; P876-W958 HydrophobicContact CG-CD2 4.29Å; P877-W958 HydrophobicContact CG-CH2 3.94Å; L955-W958 WeakPolarHBondContact O-CB 3.3Å; L955-W958 PolarHBondContact O-N 3.06Å; Q956-W958 PolarHBondContact O-N 3.01Å; Q956-W958 VanDerWaalsContact O-N 3.1Å; W958-G960 PolarHBondContact O-N 3.09Å; W958-G960 VanDerWaalsContact O-N 3.1Å; W958-L961 HydrophobicContact CB-CB 3.66Å; W958-L961 HydrophobicContact CB-CD2 3.99Å; W958-L961 HydrophobicContact CB-CG 4.46Å; W958-L961 HydrophobicContact CG-CD2 4.4Å; W958-L961 VanDerWaalsContact O-CB 3.3Å; W958-L961 WeakPolarHBondContact O-CB 3.31Å; W958-L961 PolarHBondContact O-N 3.19Å
959	P	90.2	Very high	91.2	Very high	56 Å²	56	36.6 Å²	36.6	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.9	-169.8	24.1	-34.3	0	0	0	114.7	P518 E957	P518-P959 HydrophobicContact CG-CB 4.23Å; P518-P959 HydrophobicContact CG-CG 3.94Å; E957-P959 VanDerWaalsContact C-CD 3.47Å; E957-P959 WeakPolarHBondContact O-CD 3.11Å
960	G	90.5	Very high	90.8	Very high	7 Å²	7	31.6 Å²	31.6	7%	0.072	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	9	176.2	0	0	0	0	0	114.4	C514 A515 M603 W958	C514-G960 WeakPolarHBondContact O-CA 3.27Å; A515-G960 CarbonylContact O-C 3.51Å; A515-G960 WeakPolarHBondContact O-CA 3.25Å; A515-G960 PolarHBondContact O-N 3.09Å; M603-G960 WeakPolarHBondContact CE-O 3.48Å; W958-G960 PolarHBondContact O-N 3.09Å; W958-G960 VanDerWaalsContact O-N 3.1Å
961	L	92.9	Very high	90.3	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	16%	0.159	C	C	.	.			trans	-80.8	125	-178.7	-179.2	70.9	0	0	0	111.2	A515 F871 L874 P876 L955 W958 Y963	A515-L961 HydrophobicContact CB-CB 4.23Å; A515-L961 HydrophobicContact CB-CD1 4.06Å; A515-L961 PolarHBondContact O-N 3.36Å; F871-L961 HydrophobicContact CD1-CD1 4.43Å; F871-L961 HydrophobicContact CD1-CD2 4.19Å; F871-L961 HydrophobicContact CE1-CD2 3.95Å; L874-L961 WeakPolarHBondContact O-CD1 3.37Å; P876-L961 HydrophobicContact CG-CD1 4.01Å; P876-L961 HydrophobicContact CG-CD2 3.4Å; P876-L961 HydrophobicContact CG-CG 4.35Å; L955-L961 HydrophobicContact CD2-CD2 3.67Å; W958-L961 HydrophobicContact CB-CB 3.66Å; W958-L961 HydrophobicContact CB-CD2 3.99Å; W958-L961 HydrophobicContact CB-CG 4.46Å; W958-L961 HydrophobicContact CG-CD2 4.4Å; W958-L961 VanDerWaalsContact O-CB 3.3Å; W958-L961 WeakPolarHBondContact O-CB 3.31Å; W958-L961 PolarHBondContact O-N 3.19Å; L961-Y963 HydrophobicContact CD2-CD1 4.22Å; L961-Y963 HydrophobicContact CG-CD1 4.29Å
962	H	91.4	Very high	89.7	Confident	13 Å²	13	31.9 Å²	31.9	6%	0.06	16%	0.159	C	C	.	.			trans	-90.7	124.6	169.1	179.4	53.9	0	0	0	110.2	L562 M603 P872 F873 N964	L562-H962 WeakPolarHBondContact CD1-NE2 3.26Å; M603-H962 HydrophobicContact CE-CB 3.6Å; M603-H962 HydrophobicContact SD-CB 4.17Å; P872-H962 WeakPolarHBondContact CD-O 3.26Å; F873-H962 HydrophobicContact CD2-CB 3.83Å; F873-H962 HydrophobicContact CE2-CB 3.83Å; F873-H962 AromaticContact CE2-CD2 3.55Å; F873-H962 AromaticContact CE2-CG 3.99Å; H962-N964 PolarHBondContact NE2-ND2 3.06Å
963	Y	92.8	Very high	89.2	Confident	54 Å²	54	31 Å²	31	21%	0.212	15%	0.154	C	C	.	.			trans	-140.9	155.4	171.2	62.5	-85.8	0	0	0	109.9	Y869 S870 F871 L955 L961 V965	Y869-Y963 AromaticContact CD1-CD2 3.87Å; Y869-Y963 HydrophobicContact CD1-CD2 3.87Å; Y869-Y963 HydrophobicContact CD1-CE2 4.13Å; Y869-Y963 HydrophobicContact CE1-CD2 4.29Å; Y869-Y963 HydrophobicContact CE1-CE2 4.07Å; S870-Y963 CarbonylContact O-C 3.27Å; S870-Y963 VanDerWaalsContact O-CA 3.25Å; S870-Y963 WeakPolarHBondContact O-CA 3.45Å; S870-Y963 WeakPolarHBondContact O-CB 3.23Å; F871-Y963 HydrophobicContact CE1-CG 4.37Å; L955-Y963 HydrophobicContact CB-CE1 4.27Å; L955-Y963 HydrophobicContact CD1-CD1 4.47Å; L955-Y963 HydrophobicContact CD1-CD2 4.24Å; L955-Y963 HydrophobicContact CD1-CE1 4.17Å; L955-Y963 HydrophobicContact CD1-CE2 3.91Å; L961-Y963 HydrophobicContact CD2-CD1 4.22Å; L961-Y963 HydrophobicContact CG-CD1 4.29Å; Y963-V965 HydrophobicContact CD2-CG2 3.71Å; Y963-V965 HydrophobicContact CE2-CG2 3.61Å
964	N	90.8	Very high	88.6	Confident	25 Å²	25	30.4 Å²	30.4	13%	0.134	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.9	172.3	-64.8	-61.6	0	0	0	109.9	Y869 S870 H962 H966	Y869-N964 CarbonylContact C-O 3.53Å; Y869-N964 WeakPolarHBondContact CA-O 3.5Å; S870-N964 PolarHBondContact N-O 3.34Å; S870-N964 PolarHBondContact O-N 2.88Å; S870-N964 PolarHBondContact OG-O 3.25Å; H962-N964 PolarHBondContact NE2-ND2 3.06Å; N964-H966 WeakPolarHBondContact CB-CE1 3.41Å
965	V	92.6	Very high	87.8	Confident	22 Å²	22	37.8 Å²	37.8	13%	0.133	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.4	176.8	-170.7	0	0	0	0	108.2	I867 Q868 Y869 Y963 G985 L988	I867-V965 HydrophobicContact CG2-CG1 4.05Å; Q868-V965 WeakPolarHBondContact O-CA 3.29Å; Y869-V965 HydrophobicContact CD1-CG2 3.65Å; Y869-V965 HydrophobicContact CE1-CB 4.44Å; Y869-V965 HydrophobicContact CE1-CG1 4.21Å; Y869-V965 HydrophobicContact CE1-CG2 3.41Å; Y869-V965 VanDerWaalsContact CE1-CG2 3.41Å; Y869-V965 HydrophobicContact CE2-CG1 4.25Å; Y869-V965 HydrophobicContact CG-CG2 4.44Å; Y963-V965 HydrophobicContact CD2-CG2 3.71Å; Y963-V965 HydrophobicContact CE2-CG2 3.61Å; V965-G985 VanDerWaalsContact O-CA 3.25Å; V965-G985 WeakPolarHBondContact O-CA 3.46Å; V965-G985 PolarHBondContact O-N 3.4Å; V965-L988 HydrophobicContact CG1-CD1 3.76Å
966	H	91.8	Very high	86.9	Confident	51 Å²	51	39.7 Å²	39.7	24%	0.236	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.5	178.7	-57.4	95.8	0	0	0	110.8	Q868 N964 A982 F983	Q868-H966 PolarHBondContact N-O 3.19Å; Q868-H966 PolarHBondContact O-N 3.03Å; N964-H966 WeakPolarHBondContact CB-CE1 3.41Å; H966-A982 HydrophobicContact CB-CB 3.9Å; H966-F983 VanDerWaalsContact CA-O 3.28Å; H966-F983 WeakPolarHBondContact CA-O 3.38Å
967	I	90.8	Very high	86.3	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.3	168.2	-52.1	169.6	0	0	0	106.6	L865 F983 L988 V1014	L865-I967 HydrophobicContact CD1-CG2 4.37Å; I967-F983 HydrophobicContact CB-CB 4.25Å; I967-F983 PolarHBondContact N-O 3.22Å; I967-F983 WeakPolarHBondContact O-CD2 3.49Å; I967-F983 PolarHBondContact O-N 2.6Å; I967-L988 HydrophobicContact CD1-CD2 3.56Å; I967-L988 HydrophobicContact CD1-CG 3.95Å; I967-L988 HydrophobicContact CG1-CD2 4.02Å; I967-L988 HydrophobicContact CG1-CG 4.27Å; I967-V1014 HydrophobicContact CD1-CG1 4.34Å; I967-V1014 WeakPolarHBondContact CD1-O 3.45Å
968	L	89.1	Confident	85.5	Confident	14 Å²	14	39 Å²	39	7%	0.073	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	139.5	-178	-59.9	-170.4	0	0	0	110.6	Y866 Q868 S970 L973 P980 A982	Y866-L968 HydrophobicContact CD1-CB 3.97Å; Y866-L968 HydrophobicContact CD1-CD1 3.3Å; Y866-L968 HydrophobicContact CD1-CG 3.55Å; Y866-L968 HydrophobicContact CE1-CD1 3.31Å; Y866-L968 HydrophobicContact CE1-CG 3.97Å; Y866-L968 HydrophobicContact CG-CB 4.24Å; Y866-L968 HydrophobicContact CG-CD1 3.97Å; Y866-L968 HydrophobicContact CG-CG 4.29Å; Y866-L968 PolarHBondContact O-N 2.86Å; Q868-L968 HydrophobicContact CB-CG 4.43Å; L968-S970 PolarHBondContact O-N 3.41Å; L968-S970 VanDerWaalsContact O-N 3.12Å; L968-L973 HydrophobicContact CB-CD1 3.84Å; L968-L973 HydrophobicContact CB-CG 4.37Å; L968-L973 HydrophobicContact CD1-CD1 4.41Å; L968-L973 HydrophobicContact CD1-CD2 4.18Å; L968-P980 HydrophobicContact CB-CG 4.46Å; L968-P980 HydrophobicContact CD1-CG 3.83Å; L968-P980 HydrophobicContact CD2-CG 4.23Å; L968-P980 HydrophobicContact CG-CG 4.41Å; L968-A982 HydrophobicContact CD2-CB 4.14Å
969	C	87	Confident	84.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.			trans	-62.7	114.4	177.9	177.1	0	0	0	0	111.2	K971 C972 L973 H981 F983 V1009	C969-K971 PolarHBondContact O-N 3.32Å; C969-C972 HydrophobicContact CB-CB 4.02Å; C969-C972 WeakPolarHBondContact O-CB 3.39Å; C969-C972 PolarHBondContact O-N 3.14Å; C969-C972 VanDerWaalsContact O-N 3.11Å; C969-C972 VanDerWaalsContact SG-SG 3.66Å; C969-L973 PolarHBondContact O-N 2.91Å; C969-L973 VanDerWaalsContact O-N 3.08Å; C969-H981 HydrophobicContact CB-CB 4.02Å; C969-H981 WeakPolarHBondContact CB-O 3.45Å; C969-H981 PolarHBondContact N-O 3.29Å; C969-F983 HydrophobicContact CB-CE2 3.9Å; C969-V1009 VanDerWaalsContact SG-CG2 3.59Å
970	S	83	Confident	84.5	Confident	3 Å²	3	42 Å²	42	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-56.5	-36.1	-179.7	62.8	0	0	0	0	113	L968 L973 K974 L1013	L968-S970 PolarHBondContact O-N 3.41Å; L968-S970 VanDerWaalsContact O-N 3.12Å; S970-L973 PolarHBondContact O-N 3Å; S970-K974 WeakPolarHBondContact O-CB 3.29Å; S970-K974 PolarHBondContact O-N 2.88Å; S970-L1013 WeakPolarHBondContact OG-CD1 3.12Å
971	K	81.6	Confident	84.3	Confident	52 Å²	52	43.1 Å²	43.1	23%	0.226	23%	0.231	C	C	.	.	H	α-helix	trans	-69.8	-40.6	177.5	-60.8	-70.7	-174.8	175.2	0	112.3	E863 C969 L973 K974 R975 V1009	E863-K971 VanDerWaalsContact CD-NZ 3.32Å; E863-K971 HydrophobicContact CG-CD 4.49Å; E863-K971 VanDerWaalsContact OE1-CE 3.29Å; E863-K971 WeakPolarHBondContact OE1-CE 3.28Å; E863-K971 IonicContact OE1-NZ 3.15Å; E863-K971 PolarHBondContact OE1-NZ 3.02Å; E863-K971 WeakPolarHBondContact OE2-CE 3.47Å; E863-K971 IonicContact OE2-NZ 3.87Å; E863-K971 PolarHBondContact OE2-NZ 3.27Å; C969-K971 PolarHBondContact O-N 3.32Å; K971-L973 VanDerWaalsContact C-N 3.3Å; K971-L973 PolarHBondContact O-N 3.08Å; K971-K974 PolarHBondContact O-N 3.15Å; K971-R975 WeakPolarHBondContact O-CG 3.44Å; K971-R975 PolarHBondContact O-N 3.35Å; K971-V1009 HydrophobicContact CG-CG2 4.01Å
972	C	81.7	Confident	84	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-40.8	174.3	-68.5	0	0	0	0	111.1	C969 R975 S977 P980 C1001	C969-C972 HydrophobicContact CB-CB 4.02Å; C969-C972 WeakPolarHBondContact O-CB 3.39Å; C969-C972 PolarHBondContact O-N 3.14Å; C969-C972 VanDerWaalsContact O-N 3.11Å; C969-C972 VanDerWaalsContact SG-SG 3.66Å; C972-R975 PolarHBondContact O-N 2.7Å; C972-S977 WeakPolarHBondContact O-CB 3.4Å; C972-S977 PolarHBondContact O-N 2.65Å; C972-P980 HydrophobicContact CB-CB 3.57Å; C972-C1001 VanDerWaalsContact SG-SG 3.6Å
973	L	80.4	Confident	83.9	Confident	29 Å²	29	44.1 Å²	44.1	15%	0.152	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-44.3	177.7	-69.8	173.3	0	0	0	112.2	F860 Y866 L968 C969 S970 K971 R975 G976 P980	F860-L973 WeakPolarHBondContact CD1-O 3.43Å; Y866-L973 HydrophobicContact CD2-CD1 3.81Å; Y866-L973 HydrophobicContact CG-CD1 3.8Å; L968-L973 HydrophobicContact CB-CD1 3.84Å; L968-L973 HydrophobicContact CB-CG 4.37Å; L968-L973 HydrophobicContact CD1-CD1 4.41Å; L968-L973 HydrophobicContact CD1-CD2 4.18Å; C969-L973 PolarHBondContact O-N 2.91Å; C969-L973 VanDerWaalsContact O-N 3.08Å; S970-L973 PolarHBondContact O-N 3Å; K971-L973 VanDerWaalsContact C-N 3.3Å; K971-L973 PolarHBondContact O-N 3.08Å; L973-R975 PolarHBondContact O-N 2.85Å; L973-G976 PolarHBondContact O-N 2.84Å; L973-P980 HydrophobicContact CD2-CB 4.21Å; L973-P980 HydrophobicContact CD2-CG 3.96Å; L973-P980 HydrophobicContact CG-CB 4.36Å
974	K	76.9	Confident	83.8	Confident	96 Å²	96	42.3 Å²	42.3	42%	0.417	24%	0.237	S	C	.	.	H	α-helix	trans	-57.9	-32.8	176.3	-171.2	179.9	-173.6	177.3	0	112.9	E863 S970 K971 G976	E863-K974 HydrophobicContact CG-CD 4.1Å; E863-K974 IonicContact OE1-NZ 3.4Å; S970-K974 WeakPolarHBondContact O-CB 3.29Å; S970-K974 PolarHBondContact O-N 2.88Å; K971-K974 PolarHBondContact O-N 3.15Å; K974-G976 VanDerWaalsContact C-N 3.26Å; K974-G976 PolarHBondContact O-N 3.31Å
975	R	75.9	Confident	83.5	Confident	160 Å²	160	41.5 Å²	41.5	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.1	176.4	-69.6	176.1	173.4	-151.8	-8.8	113.7	K971 C972 L973 S977 E1007	K971-R975 WeakPolarHBondContact O-CG 3.44Å; K971-R975 PolarHBondContact O-N 3.35Å; C972-R975 PolarHBondContact O-N 2.7Å; L973-R975 PolarHBondContact O-N 2.85Å; R975-S977 VanDerWaalsContact C-N 3.31Å; R975-S977 PolarHBondContact O-N 3.46Å; R975-E1007 IonicContact CZ-OE1 3.22Å; R975-E1007 IonicContact CZ-OE2 3.29Å; R975-E1007 IonicContact NE-OE1 2.71Å; R975-E1007 PolarHBondContact NE-OE1 3.31Å; R975-E1007 IonicContact NE-OE2 3.08Å; R975-E1007 PolarHBondContact NE-OE2 3.12Å; R975-E1007 IonicContact NH1-OE2 2.6Å; R975-E1007 IonicContact NH2-OE1 3.77Å; R975-E1007 PolarHBondContact NH2-OE1 2.84Å; R975-E1007 IonicContact NH2-OE2 3.53Å; R975-E1007 PolarHBondContact NH2-OE2 3.4Å
976	G	73.8	Confident	83.3	Confident	44 Å²	44	41.9 Å²	41.9	45%	0.454	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	29.1	-174.3	0	0	0	0	0	113.4	L973 K974 S978	L973-G976 PolarHBondContact O-N 2.84Å; K974-G976 VanDerWaalsContact C-N 3.26Å; K974-G976 PolarHBondContact O-N 3.31Å; G976-S978 PolarHBondContact O-N 3.37Å
977	S	77.4	Confident	83.1	Confident	50 Å²	50	39.6 Å²	39.6	35%	0.35	22%	0.224	S	C	.	.			trans	-62.1	129.6	177.5	-176.3	0	0	0	0	110.7	C972 R975 N979	C972-S977 WeakPolarHBondContact O-CB 3.4Å; C972-S977 PolarHBondContact O-N 2.65Å; R975-S977 VanDerWaalsContact C-N 3.31Å; R975-S977 PolarHBondContact O-N 3.46Å; S977-N979 PolarHBondContact O-N 3.48Å; S977-N979 PolarHBondContact OG-N 2.79Å
978	S	71.9	Confident	82.8	Confident	130 Å²	130	41.3 Å²	41.3	91%	0.909	23%	0.233	S	C	*	.	S	Bend	trans	-68.8	-16.2	176.9	55.6	0	0	0	0	113.9	G976	G976-S978 PolarHBondContact O-N 3.37Å
979	N	77.6	Confident	82.4	Confident	105 Å²	105	44.4 Å²	44.4	56%	0.561	26%	0.256	S	S	*	.	S	Bend	trans	-141.9	77.2	179	-172.8	4.6	0	0	0	109.8	S977 K1003	S977-N979 PolarHBondContact O-N 3.48Å; S977-N979 PolarHBondContact OG-N 2.79Å; N979-K1003 PolarHBondContact ND2-NZ 3.19Å; N979-K1003 PolarHBondContact O-NZ 3.11Å; N979-K1003 PolarHBondContact OD1-NZ 3.4Å
980	P	84.5	Confident	82.2	Confident	21 Å²	21	45.3 Å²	45.3	14%	0.136	26%	0.26	C	S	.	.			trans	-60.7	157.7	-179.5	25.5	-33.5	0	0	0	111.9	L968 C972 L973 K1003	L968-P980 HydrophobicContact CB-CG 4.46Å; L968-P980 HydrophobicContact CD1-CG 3.83Å; L968-P980 HydrophobicContact CD2-CG 4.23Å; L968-P980 HydrophobicContact CG-CG 4.41Å; C972-P980 HydrophobicContact CB-CB 3.57Å; L973-P980 HydrophobicContact CD2-CB 4.21Å; L973-P980 HydrophobicContact CD2-CG 3.96Å; L973-P980 HydrophobicContact CG-CB 4.36Å; P980-K1003 PolarHBondContact O-NZ 2.77Å
981	H	86.4	Confident	82	Confident	31 Å²	31	51 Å²	51	14%	0.144	29%	0.29	C	S	.	.			trans	-69.3	139.2	170.1	-177.6	69.7	0	0	0	109.8	C969 F983 P1002 K1003	C969-H981 HydrophobicContact CB-CB 4.02Å; C969-H981 WeakPolarHBondContact CB-O 3.45Å; C969-H981 PolarHBondContact N-O 3.29Å; H981-F983 AromaticContact CD2-CD1 3.8Å; H981-F983 AromaticContact CD2-CE1 3.69Å; H981-F983 AromaticContact CD2-CE2 3.98Å; H981-F983 AromaticContact CD2-CG 4Å; H981-F983 AromaticContact CD2-CZ 3.79Å; H981-F983 AromaticContact NE2-CD1 3.74Å; H981-F983 AromaticContact NE2-CE1 3.86Å; H981-P1002 VanDerWaalsContact CD2-CD 3.45Å; H981-P1002 WeakPolarHBondContact CD2-CD 3.49Å; H981-P1002 VanDerWaalsContact CE1-CG 3.42Å; H981-P1002 WeakPolarHBondContact CE1-CG 3.44Å; H981-P1002 WeakPolarHBondContact NE2-CD 3.33Å; H981-K1003 HydrophobicContact CB-CB 4.37Å; H981-K1003 HydrophobicContact CB-CD 4.08Å; H981-K1003 HydrophobicContact CB-CG 4.19Å
982	A	87.6	Confident	81.8	Confident	37 Å²	37	52.4 Å²	52.4	31%	0.306	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	103.1	-176.2	0	0	0	0	0	108.5	H966 L968	H966-A982 HydrophobicContact CB-CB 3.9Å; L968-A982 HydrophobicContact CD2-CB 4.14Å
983	F	88.9	Confident	81.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145.5	173.4	-65.2	-77.2	0	0	0	109.9	Y586 H966 I967 C969 H981 G985 L987 I999 V1014	Y586-F983 HydrophobicContact CD1-CE1 4.49Å; H966-F983 VanDerWaalsContact CA-O 3.28Å; H966-F983 WeakPolarHBondContact CA-O 3.38Å; I967-F983 HydrophobicContact CB-CB 4.25Å; I967-F983 PolarHBondContact N-O 3.22Å; I967-F983 WeakPolarHBondContact O-CD2 3.49Å; I967-F983 PolarHBondContact O-N 2.6Å; C969-F983 HydrophobicContact CB-CE2 3.9Å; H981-F983 AromaticContact CD2-CD1 3.8Å; H981-F983 AromaticContact CD2-CE1 3.69Å; H981-F983 AromaticContact CD2-CE2 3.98Å; H981-F983 AromaticContact CD2-CG 4Å; H981-F983 AromaticContact CD2-CZ 3.79Å; H981-F983 AromaticContact NE2-CD1 3.74Å; H981-F983 AromaticContact NE2-CE1 3.86Å; F983-G985 PolarHBondContact O-N 2.71Å; F983-L987 HydrophobicContact CB-CD1 4.34Å; F983-I999 HydrophobicContact CE1-CD1 4.16Å; F983-I999 HydrophobicContact CZ-CD1 4.13Å; F983-V1014 HydrophobicContact CB-CG1 3.98Å; F983-V1014 HydrophobicContact CD1-CG1 4.29Å; F983-V1014 HydrophobicContact CD2-CG1 4.21Å; F983-V1014 HydrophobicContact CD2-CG2 3.7Å; F983-V1014 HydrophobicContact CE2-CG2 3.76Å; F983-V1014 HydrophobicContact CG-CG1 3.92Å; F983-V1014 HydrophobicContact CG-CG2 4.24Å; F983-V1014 HydrophobicContact CZ-CG2 4.36Å
984	P	89.3	Confident	80.7	Confident	16 Å²	16	60.6 Å²	60.6	10%	0.104	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	130.5	-179.9	-16.5	27.7	0	0	0	111.6	V588 E986 L987	V588-P984 HydrophobicContact CG2-CB 3.64Å; V588-P984 HydrophobicContact CG2-CG 3.85Å; P984-E986 WeakPolarHBondContact CB-OE2 3.5Å; P984-E986 PolarHBondContact O-N 3.07Å; P984-L987 WeakPolarHBondContact O-CB 3.48Å; P984-L987 VanDerWaalsContact O-CG 3.27Å; P984-L987 WeakPolarHBondContact O-CG 3.35Å; P984-L987 PolarHBondContact O-N 3.11Å
985	G	86.2	Confident	80.2	Confident	8 Å²	8	60.2 Å²	60.2	8%	0.082	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-69.2	-12.7	180	0	0	0	0	0	114.1	V965 F983 L987 L988	V965-G985 VanDerWaalsContact O-CA 3.25Å; V965-G985 WeakPolarHBondContact O-CA 3.46Å; V965-G985 PolarHBondContact O-N 3.4Å; F983-G985 PolarHBondContact O-N 2.71Å; G985-L987 PolarHBondContact O-N 2.88Å; G985-L987 VanDerWaalsContact O-N 3.1Å; G985-L988 VanDerWaalsContact O-CB 3.25Å; G985-L988 WeakPolarHBondContact O-CB 3.33Å; G985-L988 WeakPolarHBondContact O-CG 3.33Å; G985-L988 PolarHBondContact O-N 2.99Å
986	E	88.4	Confident	80	Confident	31 Å²	31	55.4 Å²	55.4	15%	0.145	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-58.4	-21.8	171.9	-65	77.1	-170.7	0	0	112.3	V588 N592 K596 P984 L988 S989	V588-E986 HydrophobicContact CG1-CB 3.63Å; V588-E986 HydrophobicContact CG1-CG 4.23Å; V588-E986 HydrophobicContact CG2-CB 4.1Å; N592-E986 HydrophobicContact CB-CB 4.17Å; N592-E986 PolarHBondContact ND2-O 3.33Å; N592-E986 VanDerWaalsContact ND2-O 3.09Å; K596-E986 HydrophobicContact CD-CG 4.47Å; K596-E986 WeakPolarHBondContact CD-OE1 3.3Å; K596-E986 WeakPolarHBondContact CE-OE1 3.24Å; K596-E986 IonicContact NZ-OE1 2.88Å; K596-E986 PolarHBondContact NZ-OE1 2.98Å; P984-E986 WeakPolarHBondContact CB-OE2 3.5Å; P984-E986 PolarHBondContact O-N 3.07Å; E986-L988 VanDerWaalsContact C-N 3.25Å; E986-L988 PolarHBondContact O-N 3.33Å; E986-S989 PolarHBondContact O-N 3.44Å; E986-S989 PolarHBondContact O-OG 2.82Å
987	L	86.9	Confident	80	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-65.6	-24.5	173.8	-59.7	178.1	0	0	0	113	V588 F983 P984 G985 S989 Q990 V1014 Y1015 P1016	V588-L987 HydrophobicContact CG2-CD2 3.92Å; V588-L987 HydrophobicContact CG2-CG 4.25Å; F983-L987 HydrophobicContact CB-CD1 4.34Å; P984-L987 WeakPolarHBondContact O-CB 3.48Å; P984-L987 VanDerWaalsContact O-CG 3.27Å; P984-L987 WeakPolarHBondContact O-CG 3.35Å; P984-L987 PolarHBondContact O-N 3.11Å; G985-L987 PolarHBondContact O-N 2.88Å; G985-L987 VanDerWaalsContact O-N 3.1Å; L987-S989 PolarHBondContact O-N 2.82Å; L987-S989 VanDerWaalsContact O-N 3.14Å; L987-Q990 PolarHBondContact O-N 2.73Å; L987-V1014 HydrophobicContact CD1-CG1 3.62Å; L987-Y1015 HydrophobicContact CB-CE1 4.47Å; L987-Y1015 HydrophobicContact CD2-CE1 3.79Å; L987-P1016 WeakPolarHBondContact O-CD 3.46Å
988	L	84.8	Confident	80.1	Confident	38 Å²	38	59.4 Å²	59.4	20%	0.199	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-62.3	-19.3	175.4	-64.9	175.7	0	0	0	113.4	I867 W941 V965 I967 G985 E986 P1016	I867-L988 HydrophobicContact CD1-CD1 4.41Å; I867-L988 HydrophobicContact CD1-CD2 3.98Å; I867-L988 HydrophobicContact CG2-CD1 4.22Å; W941-L988 HydrophobicContact CH2-CD2 3.48Å; W941-L988 VanDerWaalsContact CH2-CD2 3.48Å; W941-L988 HydrophobicContact CZ3-CD2 3.75Å; V965-L988 HydrophobicContact CG1-CD1 3.76Å; I967-L988 HydrophobicContact CD1-CD2 3.56Å; I967-L988 HydrophobicContact CD1-CG 3.95Å; I967-L988 HydrophobicContact CG1-CD2 4.02Å; I967-L988 HydrophobicContact CG1-CG 4.27Å; G985-L988 VanDerWaalsContact O-CB 3.25Å; G985-L988 WeakPolarHBondContact O-CB 3.33Å; G985-L988 WeakPolarHBondContact O-CG 3.33Å; G985-L988 PolarHBondContact O-N 2.99Å; E986-L988 VanDerWaalsContact C-N 3.25Å; E986-L988 PolarHBondContact O-N 3.33Å; L988-P1016 WeakPolarHBondContact O-CG 3.48Å
989	S	80.9	Confident	80.5	Confident	79 Å²	79	53.4 Å²	53.4	55%	0.552	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-106.4	4.7	179.1	67.7	0	0	0	0	113	N592 E986 L987	N592-S989 PolarHBondContact ND2-OG 2.92Å; N592-S989 VanDerWaalsContact ND2-OG 3.08Å; E986-S989 PolarHBondContact O-N 3.44Å; E986-S989 PolarHBondContact O-OG 2.82Å; L987-S989 PolarHBondContact O-N 2.82Å; L987-S989 VanDerWaalsContact O-N 3.14Å
990	Q	82.6	Confident	80.6	Confident	19 Å²	19	51.7 Å²	51.7	9%	0.089	30%	0.304	C	S	.	.	S	Bend	trans	-111.1	138.7	-173.1	-168.1	174	-60.7	0	0	111	G587 S589 L987	G587-Q990 PolarHBondContact O-NE2 3.02Å; S589-Q990 VanDerWaalsContact CB-OE1 3.29Å; S589-Q990 PolarHBondContact OG-OE1 2.98Å; L987-Q990 PolarHBondContact O-N 2.73Å
991	L	77.8	Confident	80.5	Confident	122 Å²	122	50.7 Å²	50.7	64%	0.639	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-67	145.2	172.2	-59.7	174.3	0	0	0	110.6	T1018	L991-T1018 HydrophobicContact CB-CG2 4.42Å; L991-T1018 HydrophobicContact CD2-CG2 3.74Å
992	R	77.6	Confident	79.8	Confident	81 Å²	81	50.1 Å²	50.1	31%	0.306	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-59.2	130	174.8	-177.8	178.2	179.5	163.7	7.3	110.1	L996 V1011	R992-L996 PolarHBondContact NE-O 3.36Å; R992-L996 VanDerWaalsContact NE-O 3.14Å; R992-L996 PolarHBondContact NH2-O 2.92Å; R992-V1011 HydrophobicContact CG-CG1 3.73Å
993	P	71.6	Confident	79.2	Confident	32 Å²	32	53 Å²	53	21%	0.208	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-63.5	135.8	173.5	-21.8	32.9	0	0	0	112.9	G995 L996 Y1015	P993-G995 PolarHBondContact O-N 2.92Å; P993-L996 HydrophobicContact CB-CB 4.3Å; P993-L996 HydrophobicContact CB-CD2 4.49Å; P993-L996 HydrophobicContact CG-CD2 4.3Å; P993-L996 PolarHBondContact O-N 3.03Å; P993-Y1015 HydrophobicContact CG-CE1 4.27Å
994	D	66.8	Low	78.1	Confident	171 Å²	171	55.2 Å²	55.2	91%	0.914	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	133.1	178.9	-69.5	-33.3	0	0	0	111.8	L996	D994-L996 VanDerWaalsContact C-N 3.3Å; D994-L996 PolarHBondContact O-N 3.03Å
995	G	66.8	Low	76.6	Confident	87 Å²	87	57.3 Å²	57.3	90%	0.897	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-0.3	177.7	0	0	0	0	0	115.8	P993	P993-G995 PolarHBondContact O-N 2.92Å
996	L	71.9	Confident	75.3	Confident	59 Å²	59	61.7 Å²	61.7	31%	0.309	37%	0.368	S	S	.	.			trans	-93.7	109.9	178.1	-164	74	0	0	0	111.4	R992 P993 D994 I999 V1011	R992-L996 PolarHBondContact NE-O 3.36Å; R992-L996 VanDerWaalsContact NE-O 3.14Å; R992-L996 PolarHBondContact NH2-O 2.92Å; P993-L996 HydrophobicContact CB-CB 4.3Å; P993-L996 HydrophobicContact CB-CD2 4.49Å; P993-L996 HydrophobicContact CG-CD2 4.3Å; P993-L996 PolarHBondContact O-N 3.03Å; D994-L996 VanDerWaalsContact C-N 3.3Å; D994-L996 PolarHBondContact O-N 3.03Å; L996-I999 HydrophobicContact CD2-CG2 3.87Å; L996-V1011 HydrophobicContact CD2-CG2 3.95Å; L996-V1011 HydrophobicContact CG-CG2 3.85Å
997	T	74.6	Confident	74.4	Confident	94 Å²	94	62.1 Å²	62.1	58%	0.577	37%	0.37	S	S	*	.			trans	-94.5	-36.5	178.4	51.8	0	0	0	0	113.2	V1011	T997-V1011 VanDerWaalsContact C-CG2 3.41Å; T997-V1011 WeakPolarHBondContact O-CB 2.83Å; T997-V1011 WeakPolarHBondContact O-CG2 3.23Å; T997-V1011 PolarHBondContact O-N 2.92Å; T997-V1011 VanDerWaalsContact O-N 3.15Å
998	E	78.8	Confident	74	Confident	85 Å²	85	69.5 Å²	69.5	40%	0.397	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.9	-172.8	-68.5	179	139.6	0	0	111.6	R1008 V1009	E998-R1008 HydrophobicContact CB-CB 4.01Å; E998-R1008 HydrophobicContact CB-CG 4.47Å; E998-R1008 HydrophobicContact CG-CB 4.25Å; E998-R1008 WeakPolarHBondContact OE2-CD 3.49Å; E998-R1008 IonicContact OE2-CZ 3.69Å; E998-R1008 IonicContact OE2-NE 3.71Å; E998-R1008 IonicContact OE2-NH1 2.84Å; E998-R1008 PolarHBondContact OE2-NH1 3.09Å; E998-V1009 WeakPolarHBondContact CA-O 3.39Å
999	I	80.8	Confident	73.7	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.015	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.3	176	35.4	170.9	0	0	0	110.5	Y586 F983 L996 V1009 V1011 V1014	Y586-I999 HydrophobicContact CE1-CB 4.44Å; Y586-I999 HydrophobicContact CE1-CG2 4.06Å; F983-I999 HydrophobicContact CE1-CD1 4.16Å; F983-I999 HydrophobicContact CZ-CD1 4.13Å; L996-I999 HydrophobicContact CD2-CG2 3.87Å; I999-V1009 HydrophobicContact CG1-CB 4.24Å; I999-V1009 WeakPolarHBondContact CG1-O 3.17Å; I999-V1009 PolarHBondContact N-O 3.23Å; I999-V1009 PolarHBondContact O-N 3.43Å; I999-V1011 HydrophobicContact CB-CG2 4.38Å; I999-V1011 HydrophobicContact CG1-CG2 3.92Å; I999-V1011 HydrophobicContact CG2-CG2 3.97Å; I999-V1014 HydrophobicContact CD1-CB 3.52Å; I999-V1014 HydrophobicContact CD1-CG1 3.82Å; I999-V1014 HydrophobicContact CD1-CG2 3.41Å; I999-V1014 VanDerWaalsContact CD1-CG2 3.41Å
1000	I	79.8	Confident	73.6	Confident	70 Å²	70	66.8 Å²	66.8	36%	0.359	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.7	-177.1	-60	173	0	0	0	109.6	P581 P1002	P581-I1000 HydrophobicContact CB-CB 4.4Å; P581-I1000 HydrophobicContact CG-CB 4.34Å; P581-I1000 HydrophobicContact CG-CG2 4.36Å; I1000-P1002 WeakPolarHBondContact O-CD 3.32Å
1001	C	81.6	Confident	73.6	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	37%	0.373	C	S	.	.			trans	-72.8	116.4	170.4	-179.9	0	0	0	0	110.3	C972 K1003 N1004 G1005 E1007 V1009	C972-C1001 VanDerWaalsContact SG-SG 3.6Å; C1001-K1003 VanDerWaalsContact C-N 3.26Å; C1001-K1003 PolarHBondContact O-N 3.01Å; C1001-N1004 HydrophobicContact CB-CB 4.34Å; C1001-N1004 PolarHBondContact O-N 3.32Å; C1001-G1005 PolarHBondContact O-N 2.98Å; C1001-E1007 PolarHBondContact N-O 3.22Å; C1001-V1009 HydrophobicContact CB-CG2 4.22Å
1002	P	72.4	Confident	73.6	Confident	18 Å²	18	61.1 Å²	61.1	12%	0.117	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.8	-174.9	-17.1	29.3	0	0	0	113.8	P581 H582 H981 I1000	P581-P1002 HydrophobicContact CB-CB 4.39Å; P581-P1002 HydrophobicContact CB-CG 3.97Å; P581-P1002 WeakPolarHBondContact O-CB 3.43Å; P581-P1002 WeakPolarHBondContact O-CG 3.43Å; H582-P1002 PolarHBondContact CE1-O 2.97Å; H981-P1002 VanDerWaalsContact CD2-CD 3.45Å; H981-P1002 WeakPolarHBondContact CD2-CD 3.49Å; H981-P1002 VanDerWaalsContact CE1-CG 3.42Å; H981-P1002 WeakPolarHBondContact CE1-CG 3.44Å; H981-P1002 WeakPolarHBondContact NE2-CD 3.33Å; I1000-P1002 WeakPolarHBondContact O-CD 3.32Å
1003	K	74.4	Confident	73.7	Confident	98 Å²	98	57.7 Å²	57.7	43%	0.426	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-24.3	178.8	-77.2	-174.4	175.6	171	0	113.4	N979 P980 H981 C1001	N979-K1003 PolarHBondContact ND2-NZ 3.19Å; N979-K1003 PolarHBondContact O-NZ 3.11Å; N979-K1003 PolarHBondContact OD1-NZ 3.4Å; P980-K1003 PolarHBondContact O-NZ 2.77Å; H981-K1003 HydrophobicContact CB-CB 4.37Å; H981-K1003 HydrophobicContact CB-CD 4.08Å; H981-K1003 HydrophobicContact CB-CG 4.19Å; C1001-K1003 VanDerWaalsContact C-N 3.26Å; C1001-K1003 PolarHBondContact O-N 3.01Å
1004	N	67.1	Low	74.2	Confident	46 Å²	46	56.3 Å²	56.3	25%	0.246	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	1	-173.2	-71	9.6	0	0	0	113.7	C1001 S1006 E1007	C1001-N1004 HydrophobicContact CB-CB 4.34Å; C1001-N1004 PolarHBondContact O-N 3.32Å; N1004-S1006 PolarHBondContact O-N 3Å; N1004-E1007 HydrophobicContact CB-CB 4.42Å; N1004-E1007 PolarHBondContact ND2-OE2 3.43Å
1005	G	56.9	Low	75	Confident	60 Å²	60	48.5 Å²	48.5	62%	0.619	29%	0.288	S	S	*	.	S	Bend	trans	65.2	-13.4	162.4	0	0	0	0	0	118.6	C1001	C1001-G1005 PolarHBondContact O-N 2.98Å
1006	S	58.9	Low	75.6	Confident	100 Å²	100	45.6 Å²	45.6	70%	0.699	25%	0.253	S	S	*	.	S	Bend	trans	-152.7	-12.5	-178.5	58.3	0	0	0	0	114.7	N1004	N1004-S1006 PolarHBondContact O-N 3Å
1007	E	69.6	Low	75.6	Confident	41 Å²	41	45.1 Å²	45.1	19%	0.192	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-81	131.8	179.9	-72.8	-166.9	127.2	0	0	112.4	R975 C1001 N1004	R975-E1007 IonicContact CZ-OE1 3.22Å; R975-E1007 IonicContact CZ-OE2 3.29Å; R975-E1007 IonicContact NE-OE1 2.71Å; R975-E1007 PolarHBondContact NE-OE1 3.31Å; R975-E1007 IonicContact NE-OE2 3.08Å; R975-E1007 PolarHBondContact NE-OE2 3.12Å; R975-E1007 IonicContact NH1-OE2 2.6Å; R975-E1007 IonicContact NH2-OE1 3.77Å; R975-E1007 PolarHBondContact NH2-OE1 2.84Å; R975-E1007 IonicContact NH2-OE2 3.53Å; R975-E1007 PolarHBondContact NH2-OE2 3.4Å; C1001-E1007 PolarHBondContact N-O 3.22Å; N1004-E1007 HydrophobicContact CB-CB 4.42Å; N1004-E1007 PolarHBondContact ND2-OE2 3.43Å
1008	R	77.3	Confident	74.8	Confident	156 Å²	156	43.3 Å²	43.3	59%	0.589	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.6	176.4	-64.1	-167.3	-173	-179	-0.6	109.9	E998	E998-R1008 HydrophobicContact CB-CB 4.01Å; E998-R1008 HydrophobicContact CB-CG 4.47Å; E998-R1008 HydrophobicContact CG-CB 4.25Å; E998-R1008 WeakPolarHBondContact OE2-CD 3.49Å; E998-R1008 IonicContact OE2-CZ 3.69Å; E998-R1008 IonicContact OE2-NE 3.71Å; E998-R1008 IonicContact OE2-NH1 2.84Å; E998-R1008 PolarHBondContact OE2-NH1 3.09Å
1009	V	80.1	Confident	73.2	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.5	174.9	-175.7	0	0	0	0	107.3	C969 K971 E998 I999 C1001 V1011 V1014	C969-V1009 VanDerWaalsContact SG-CG2 3.59Å; K971-V1009 HydrophobicContact CG-CG2 4.01Å; E998-V1009 WeakPolarHBondContact CA-O 3.39Å; I999-V1009 HydrophobicContact CG1-CB 4.24Å; I999-V1009 WeakPolarHBondContact CG1-O 3.17Å; I999-V1009 PolarHBondContact N-O 3.23Å; I999-V1009 PolarHBondContact O-N 3.43Å; C1001-V1009 HydrophobicContact CB-CG2 4.22Å; V1009-V1011 PolarHBondContact O-N 3.47Å; V1009-V1014 HydrophobicContact CG1-CG2 4.37Å
1010	D	78.9	Confident	71.1	Confident	60 Å²	60	49.4 Å²	49.4	32%	0.321	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	127.1	174.1	-168.1	-30.9	0	0	0	109.6	A1012 L1013	D1010-A1012 PolarHBondContact O-N 3.33Å; D1010-A1012 VanDerWaalsContact OD1-CB 3.29Å; D1010-A1012 WeakPolarHBondContact OD1-CB 3.01Å; D1010-A1012 PolarHBondContact OD1-N 3.14Å; D1010-L1013 PolarHBondContact O-N 3.06Å
1011	V	81.3	Confident	68.9	Low	0 Å²	0	50.5 Å²	50.5	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-56.7	-30.2	177.4	169.9	0	0	0	0	111.3	R992 L996 T997 I999 V1009 L1013 V1014 Y1015	R992-V1011 HydrophobicContact CG-CG1 3.73Å; L996-V1011 HydrophobicContact CD2-CG2 3.95Å; L996-V1011 HydrophobicContact CG-CG2 3.85Å; T997-V1011 VanDerWaalsContact C-CG2 3.41Å; T997-V1011 WeakPolarHBondContact O-CB 2.83Å; T997-V1011 WeakPolarHBondContact O-CG2 3.23Å; T997-V1011 PolarHBondContact O-N 2.92Å; T997-V1011 VanDerWaalsContact O-N 3.15Å; I999-V1011 HydrophobicContact CB-CG2 4.38Å; I999-V1011 HydrophobicContact CG1-CG2 3.92Å; I999-V1011 HydrophobicContact CG2-CG2 3.97Å; V1009-V1011 PolarHBondContact O-N 3.47Å; V1011-L1013 PolarHBondContact O-N 3.36Å; V1011-V1014 PolarHBondContact O-N 3.32Å; V1011-Y1015 HydrophobicContact CB-CD2 4.48Å; V1011-Y1015 HydrophobicContact CG1-CD2 3.44Å; V1011-Y1015 VanDerWaalsContact CG1-CD2 3.44Å; V1011-Y1015 HydrophobicContact CG1-CE2 4.04Å; V1011-Y1015 HydrophobicContact CG1-CG 4.09Å; V1011-Y1015 PolarHBondContact O-N 3.25Å
1012	A	78.4	Confident	66.5	Low	22 Å²	22	56.9 Å²	56.9	18%	0.182	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-65.7	-15.4	178.1	0	0	0	0	0	114.1	I937 W941 D1010	I937-A1012 HydrophobicContact CD1-CB 4.29Å; I937-A1012 HydrophobicContact CG2-CB 4.01Å; I937-A1012 WeakPolarHBondContact CG2-O 3.48Å; W941-A1012 PolarHBondContact NE1-O 3.42Å; D1010-A1012 PolarHBondContact O-N 3.33Å; D1010-A1012 VanDerWaalsContact OD1-CB 3.29Å; D1010-A1012 WeakPolarHBondContact OD1-CB 3.01Å; D1010-A1012 PolarHBondContact OD1-N 3.14Å
1013	L	80.6	Confident	64.1	Low	9 Å²	9	60.1 Å²	60.1	5%	0.047	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-90.3	-5.9	173.6	-69.9	173.9	0	0	0	113.3	E863 L865 L934 I937 S970 D1010 V1011	E863-L1013 HydrophobicContact CB-CD1 4.32Å; L865-L1013 WeakPolarHBondContact CD1-O 3.38Å; L934-L1013 HydrophobicContact CD2-CD1 4.21Å; I937-L1013 HydrophobicContact CD1-CD2 4.11Å; I937-L1013 HydrophobicContact CD1-CG 4.1Å; I937-L1013 HydrophobicContact CG1-CD2 3.93Å; I937-L1013 HydrophobicContact CG1-CG 4.47Å; I937-L1013 HydrophobicContact CG2-CD2 4.11Å; S970-L1013 WeakPolarHBondContact OG-CD1 3.12Å; D1010-L1013 PolarHBondContact O-N 3.06Å; V1011-L1013 PolarHBondContact O-N 3.36Å
1014	V	82.1	Confident	61.9	Low	3 Å²	3	61.5 Å²	61.5	2%	0.018	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-32.9	-177.3	178.3	0	0	0	0	112.1	I967 F983 L987 I999 V1009 V1011	I967-V1014 HydrophobicContact CD1-CG1 4.34Å; I967-V1014 WeakPolarHBondContact CD1-O 3.45Å; F983-V1014 HydrophobicContact CB-CG1 3.98Å; F983-V1014 HydrophobicContact CD1-CG1 4.29Å; F983-V1014 HydrophobicContact CD2-CG1 4.21Å; F983-V1014 HydrophobicContact CD2-CG2 3.7Å; F983-V1014 HydrophobicContact CE2-CG2 3.76Å; F983-V1014 HydrophobicContact CG-CG1 3.92Å; F983-V1014 HydrophobicContact CG-CG2 4.24Å; F983-V1014 HydrophobicContact CZ-CG2 4.36Å; L987-V1014 HydrophobicContact CD1-CG1 3.62Å; I999-V1014 HydrophobicContact CD1-CB 3.52Å; I999-V1014 HydrophobicContact CD1-CG1 3.82Å; I999-V1014 HydrophobicContact CD1-CG2 3.41Å; I999-V1014 VanDerWaalsContact CD1-CG2 3.41Å; V1009-V1014 HydrophobicContact CG1-CG2 4.37Å; V1011-V1014 PolarHBondContact O-N 3.32Å
1015	Y	82.6	Confident	60.2	Low	7 Å²	7	72.5 Å²	72.5	3%	0.027	43%	0.434	C	S	.	.	S	Bend	trans	-103	131.6	173.6	-67.6	-98.9	0	0	0	109.4	L987 P993 V1011	L987-Y1015 HydrophobicContact CB-CE1 4.47Å; L987-Y1015 HydrophobicContact CD2-CE1 3.79Å; P993-Y1015 HydrophobicContact CG-CE1 4.27Å; V1011-Y1015 HydrophobicContact CB-CD2 4.48Å; V1011-Y1015 HydrophobicContact CG1-CD2 3.44Å; V1011-Y1015 VanDerWaalsContact CG1-CD2 3.44Å; V1011-Y1015 HydrophobicContact CG1-CE2 4.04Å; V1011-Y1015 HydrophobicContact CG1-CG 4.09Å; V1011-Y1015 PolarHBondContact O-N 3.25Å
1016	P	80.2	Confident	60.4	Low	26 Å²	26	73.2 Å²	73.2	17%	0.169	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-61.1	147.2	169.7	30.2	-35.4	0	0	0	108.8	W941 L987 L988	W941-P1016 HydrophobicContact CD2-CB 4.47Å; W941-P1016 HydrophobicContact CE3-CB 4.21Å; W941-P1016 HydrophobicContact CH2-CB 4.32Å; W941-P1016 HydrophobicContact CZ3-CB 4.14Å; L987-P1016 WeakPolarHBondContact O-CD 3.46Å; L988-P1016 WeakPolarHBondContact O-CG 3.48Å
1017	P	71	Confident	60.4	Low	49 Å²	49	71.7 Å²	71.7	32%	0.318	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-72.6	141.4	-176.4	34.8	-38.4	0	0	0	109.8	W938 W941	W938-P1017 HydrophobicContact CD2-CG 4.4Å; W938-P1017 HydrophobicContact CE3-CB 3.48Å; W938-P1017 VanDerWaalsContact CE3-CB 3.48Å; W938-P1017 HydrophobicContact CE3-CG 3.31Å; W938-P1017 HydrophobicContact CH2-CG 4.25Å; W938-P1017 HydrophobicContact CZ3-CB 3.38Å; W938-P1017 HydrophobicContact CZ3-CG 3.24Å; W941-P1017 HydrophobicContact CB-CG 4.19Å; W941-P1017 HydrophobicContact CG-CG 4.28Å
1018	T	58.6	Low	59.9	Low	56 Å²	56	73.4 Å²	73.4	34%	0.344	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-60.1	134.6	173.7	19.9	0	0	0	0	108.8	L991 T1020	L991-T1018 HydrophobicContact CB-CG2 4.42Å; L991-T1018 HydrophobicContact CD2-CG2 3.74Å; T1018-T1020 PolarHBondContact O-N 2.7Å
1019	P	44.8	Very low	58.9	Low	118 Å²	118	68.6 Å²	68.6	77%	0.766	41%	0.413	S	S	*	.			trans	-68.6	79.1	168.9	26.4	-30.2	0	0	0	108.5	A1021	P1019-A1021 PolarHBondContact O-N 3.12Å
1020	T	36.8	Very low	57.6	Low	98 Å²	98	72.8 Å²	72.8	60%	0.601	44%	0.438	S	S	*	.			trans	-71.2	121.1	164.5	43.4	0	0	0	0	107.1	T1018 T1022	T1018-T1020 PolarHBondContact O-N 2.7Å; T1020-T1022 PolarHBondContact O-N 3.22Å
1021	A	32.4	Very low	56.1	Low	92 Å²	92	73.7 Å²	73.7	76%	0.76	45%	0.446	S	S	*	.	S	Bend	trans	-44.2	135.5	161.7	0	0	0	0	0	109.1	P1019	P1019-A1021 PolarHBondContact O-N 3.12Å
1022	T	31.3	Very low	54.3	Low	134 Å²	134	78.9 Å²	78.9	82%	0.822	48%	0.478	S	S	*	.			trans	83.2	86.6	-174.8	69.2	0	0	0	0	116.4	T1020	T1020-T1022 PolarHBondContact O-N 3.22Å
1023	S	22.3	Very low	52.5	Low	86 Å²	86	83.3 Å²	83.3	60%	0.601	50%	0.501	S	S	*	.			trans	-71.8	134.8	142.5	54.7	0	0	0	0	108.8	K1025	S1023-K1025 PolarHBondContact O-N 2.75Å
1024	P	29.6	Very low	50.2	Low	127 Å²	127	89.5 Å²	89.5	83%	0.825	54%	0.538	S	S	*	.			trans	-62.2	131.2	163.8	-4.1	19.1	0	0	0	107.7
1025	K	30.4	Very low	47.3	Very low	278 Å²	278	97.4 Å²	97.4	100%	1.209	59%	0.586	S	S	*	*			trans	-60.6	0	174.4	-77.8	-177.5	174.7	178.7	0	112.1	S1023	S1023-K1025 PolarHBondContact O-N 2.75Å

Retrieved 1,025 of 1,025 residues in 803.4 ms (Link to these results)

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