A0A087X6D2_POEFO Loading...

Leucine rich repeats and immunoglobulin like domains 1

AlphaFold DB , UniProt , Accession A0A087X6D2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,050 aa.

						>A0A087X6D2_POEFO|A0A087X6D2
MAASLGRLGCVSHCVFYLMLSLELLNCFGLSSDAPCPQNCTCSGESVDCSGLELIVPPVDLPVWTVSLNLGHNKLASLSAEAFANLPNLRELRLDHNELTSIPDLGRAASNVVSLYLHHNKIRTINGSRTTELVSVETLDLSNNDITDLRGDGFPSGLQIRDLYLSNNKISTLQLGALDHLGSTLQVLRLSRNRISQIPIRAFQLPRLTQLELNRNRILQIEGLTFQGLSSLEVLKLQRNSISKLTDGAFWNLSKMKVLHLEYNNLTEVNSGSLYGLSSLTQLFLSNNSIARINPDGWKFCQRLRELNLSYNNLTRLDEGSLAVLGDLHTLRLGRNSISHINEGAFRGLKALRVLELDHNDISGTIEDTNGAFAGLDKLNKLTLFGNKIKSVAKKAFAGLETLEHLNLGDNAIRSIQPDAFSRMRNLKSLLIQSNSFLCDCQLQWLPFWLHIHGLQVGVNATCAHPVSLQGTSIFEAPQNSFVCDDLPKPQITVQPENTVTVLGSDVRLTCTAASSSSSPITFAWRKDQELLRHGEMENFAHVRTQGDTADTPAIAGGVMEYTTILHLRRATFADEGRYQCIITNHFGSTYSSKAQVVVNVLPSFLKTPRDSTIRTGHTARLECAAEGHPAPQIAWQKDGGTDFPAARERRMHVMPDDDVFFITDVKPEDMGVYSCTAKNTAGTVSANATLIVLETPHLAQEMEDRSVAVGDTVALQCKALGSPPPRITWLRDDQPLRPSDRHYFTPGNQLLVIGAASPEDAGRYTCLMSNTLGTERAHSQLAVTQHRGVCAQQAGGNAIIGIIVIAVVTSIVVTSLVWVCIIYQTRKKSEECSVTNTDETIVPPDVPSYLSSQGTLSERQDMCIRVEAGGGPQPNGHVVDASGFDGAVVCTDCMETGNSYSNDAGYLTHGYGLARGAEYRQQQQQLGPPRYSQCNLGEPRDTGSHASAPLCNGTPRGNRKDTQESAVPKNHDTIERSHDERKAGRAGHTSAGPPSQDDSFHEPVKLPGGTSRPRTDTDCEPELRQTLLPNGHALRAAQNESAPLRRASD
					

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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	33.1	Very low	33	Very low	236 Å²	236	134.1 Å²	134.1	100%	1.163	82%	0.824	S	S	*	*				0	113.8	0	-51.8	175.3	-168	0	0	104.8
2	A	32.8	Very low	33	Very low	101 Å²	101	129.8 Å²	129.8	84%	0.835	80%	0.803	S	S	*	*				54.4	128.9	56.7	0	0	0	0	0	109.5
3	A	35.3	Very low	32.9	Very low	94 Å²	94	132.8 Å²	132.8	78%	0.777	80%	0.801	S	S	*	*			cis	174.4	170.3	13	0	0	0	0	0	103.4
4	S	39.4	Very low	32.7	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	79%	0.794	S	S	*	*			cis	-170.9	-169.1	-8.5	46.8	0	0	0	0	108.1
5	L	36.8	Very low	32.7	Very low	169 Å²	169	129.7 Å²	129.7	89%	0.885	79%	0.788	S	S	*	*			trans	78	130.7	168.5	-54	150.4	0	0	0	116.4
6	G	31.2	Very low	32.5	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	79%	0.789	S	S	*	*			cis	134.1	147	-26.6	0	0	0	0	0	117
7	R	35.6	Very low	32.4	Very low	238 Å²	238	136.5 Å²	136.5	90%	0.898	79%	0.787	S	S	*	*			trans	72	157.2	164.7	-64.6	-178.2	171.8	-161.9	-2.5	116.1
8	L	31.4	Very low	32.4	Very low	143 Å²	143	136.8 Å²	136.8	75%	0.749	79%	0.785	S	S	*	*			cis	-156.7	159.6	-6	-123.5	166.5	0	0	0	109.6
9	G	27.2	Very low	32.4	Very low	75 Å²	75	138.4 Å²	138.4	77%	0.773	79%	0.787	S	S	*	*			trans	168.6	96.9	169.3	0	0	0	0	0	114.2
10	C	28	Very low	32.4	Very low	113 Å²	113	139.6 Å²	139.6	76%	0.764	79%	0.789	S	S	*	*			trans	-126.4	-172.6	-179.7	-60.4	0	0	0	0	111.1
11	V	31.8	Very low	32.9	Very low	145 Å²	145	137.1 Å²	137.1	88%	0.879	78%	0.781	S	S	*	*			trans	98.8	132.4	167	178.9	0	0	0	0	114.8
12	S	33.2	Very low	33.2	Very low	83 Å²	83	133.6 Å²	133.6	58%	0.58	77%	0.766	S	S	*	*			cis	-172	178.1	-22.8	-164	0	0	0	0	110.2
13	H	31.6	Very low	33.5	Very low	168 Å²	168	137.8 Å²	137.8	78%	0.778	77%	0.769	S	S	*	*			trans	73.7	151.3	154.7	-67.5	161.2	0	0	0	119.2
14	C	30.8	Very low	33.5	Very low	104 Å²	104	141.3 Å²	141.3	70%	0.703	77%	0.773	S	S	*	*			cis	-176.4	173.6	-28.3	-132.2	0	0	0	0	107.6
15	V	31.8	Very low	33.5	Very low	115 Å²	115	145 Å²	145	70%	0.697	79%	0.785	S	S	*	*			cis	-146.1	156.5	-0.7	-154.6	0	0	0	0	106.9
16	F	30.3	Very low	33.9	Very low	184 Å²	184	144.2 Å²	144.2	81%	0.807	78%	0.782	S	S	*	*				-178.6	159.4	119.9	-114.9	-94.7	0	0	0	112.2
17	Y	30.2	Very low	34.5	Very low	191 Å²	191	147.2 Å²	147.2	75%	0.749	79%	0.791	S	S	*	*			trans	-40.9	136.9	-171.8	-76.6	-117.4	0	0	0	115.7
18	L	33.6	Very low	34.7	Very low	143 Å²	143	145.6 Å²	145.6	75%	0.749	79%	0.791	S	S	*	*			cis	80.2	95	48.9	-164.3	138.7	0	0	0	114.1
19	M	31.7	Very low	35	Very low	167 Å²	167	142.8 Å²	142.8	82%	0.823	80%	0.796	S	S	*	*			trans	43.4	105.2	150.3	-64.6	-70.7	-160.4	0	0	119.2
20	L	33.1	Very low	35.7	Very low	161 Å²	161	147.3 Å²	147.3	84%	0.843	80%	0.802	S	S	*	*				-159.2	149.1	105.1	-130.6	72.3	0	0	0	113.4
21	S	42.4	Very low	36.1	Very low	89 Å²	89	146.8 Å²	146.8	62%	0.622	80%	0.799	S	S	*	*			trans	-11.4	138.3	162.7	56.2	0	0	0	0	121.5
22	L	39.9	Very low	37	Very low	161 Å²	161	144.5 Å²	144.5	84%	0.843	79%	0.789	S	S	*	*	S	Bend	trans	73.3	162.2	165.7	-79	73.1	0	0	0	116.5
23	E	37.8	Very low	38	Very low	189 Å²	189	146 Å²	146	88%	0.883	79%	0.791	S	S	*	*	S	Bend	trans	60.1	57.6	174	-59	-167	174.1	0	0	118.5
24	L	36.2	Very low	39.3	Very low	168 Å²	168	139.8 Å²	139.8	88%	0.88	77%	0.768	S	S	*	*			trans	-153.1	26.9	144.6	-117.4	170.8	0	0	0	114.8	N26	L24-N26 PolarHBondContact O-N 2.92Å
25	L	39	Very low	41.4	Very low	175 Å²	175	139.9 Å²	139.9	92%	0.916	77%	0.768	S	S	*	*			trans	-97.8	59.2	176.8	-151.2	84.2	0	0	0	111.6
26	N	44.7	Very low	43.9	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	75%	0.752	S	S	*	*			trans	-158	82.3	178.8	-110.5	-23.7	0	0	0	112.2	L24	L24-N26 PolarHBondContact O-N 2.92Å
27	C	43.8	Very low	46.5	Very low	126 Å²	126	128.8 Å²	128.8	85%	0.851	72%	0.717	S	S	*	*	S	Bend	trans	175.6	62.5	149.9	-95.4	0	0	0	0	112.6
28	F	40.2	Very low	48.7	Very low	205 Å²	205	128.3 Å²	128.3	90%	0.899	72%	0.722	S	S	*	*			trans	-177.2	97.9	141.4	-104.3	-66.1	0	0	0	107.6	L30	F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 2.85Å
29	G	39	Very low	51.2	Low	83 Å²	83	128.1 Å²	128.1	86%	0.856	72%	0.721	S	S	*	*			trans	-77.4	68	-170.4	0	0	0	0	0	114	S31	G29-S31 PolarHBondContact O-N 2.89Å
30	L	40.6	Very low	54	Low	171 Å²	171	120.9 Å²	120.9	90%	0.895	69%	0.687	S	S	*	*			trans	-78.3	73.6	164.2	-78.2	170	0	0	0	109.7	F28 S32	F28-L30 VanDerWaalsContact C-N 3.3Å; F28-L30 PolarHBondContact O-N 2.85Å; L30-S32 PolarHBondContact O-N 3.45Å
31	S	37.2	Very low	56.9	Low	101 Å²	101	117.8 Å²	117.8	71%	0.706	68%	0.675	S	S	*	*			trans	-64.5	121	160.8	-166.9	0	0	0	0	107.8	G29	G29-S31 PolarHBondContact O-N 2.89Å
32	S	49.7	Very low	59.3	Low	97 Å²	97	115.8 Å²	115.8	68%	0.678	66%	0.661	S	S	*	*	S	Bend	trans	-57.8	152.7	154.2	49.1	0	0	0	0	109	L30	L30-S32 PolarHBondContact O-N 3.45Å
33	D	53.9	Low	61.7	Low	116 Å²	116	112.8 Å²	112.8	62%	0.62	65%	0.653	S	S	*	*			trans	60.1	89.1	-174.8	-54	-38.6	0	0	0	114.4
34	A	59.3	Low	64.1	Low	36 Å²	36	107 Å²	107	30%	0.298	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-59.4	131.4	153.5	0	0	0	0	0	108.3
35	P	74.8	Confident	66.8	Low	107 Å²	107	104.9 Å²	104.9	70%	0.695	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-65.4	161.3	179.9	28.6	-35.3	0	0	0	111.1
36	C	84.1	Confident	69.4	Low	52 Å²	52	99.2 Å²	99.2	35%	0.351	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-54.8	130.1	173.6	-167.7	0	0	0	0	110.2	C42	C36-C42 VanDerWaalsContact CA-SG 3.52Å; C36-C42 HydrophobicContact CB-CB 3.83Å; C36-C42 WeakPolarHBondContact CB-SG 3.38Å; C36-C42 WeakPolarHBondContact SG-CB 3.45Å; C36-C42 PolarHBondContact SG-N 3.44Å; C36-C42 VanDerWaalsContact SG-N 3.36Å; C36-C42 CovalentContact SG-SG 2.04Å; C36-C42 PolarHBondContact SG-SG 2.95Å
37	P	86.1	Confident	71.8	Confident	13 Å²	13	92 Å²	92	8%	0.084	57%	0.566	C	S	.	*	P	Polyproline II helix	trans	-58.7	142.8	-176.6	-22.7	31.1	0	0	0	111.9	N39 C40 P58 L61	P37-N39 PolarHBondContact O-N 2.86Å; P37-C40 HydrophobicContact CB-CB 4.24Å; P37-C40 WeakPolarHBondContact O-CB 3.43Å; P37-C40 PolarHBondContact O-N 2.85Å; P37-P58 HydrophobicContact CB-CB 4.07Å; P37-L61 HydrophobicContact CG-CD2 4.1Å
38	Q	76.9	Confident	74.3	Confident	182 Å²	182	88.8 Å²	88.8	85%	0.85	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	139.3	-177.4	-70.9	-169.9	-12.2	0	0	111.7	C40	Q38-C40 PolarHBondContact O-N 2.68Å; Q38-C40 VanDerWaalsContact O-N 3.15Å
39	N	85	Confident	76.9	Confident	138 Å²	138	79 Å²	79	74%	0.738	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	-12.2	-172.2	-50.5	-31.5	0	0	0	116.2	P37 L52	P37-N39 PolarHBondContact O-N 2.86Å; N39-L52 HydrophobicContact CB-CD1 4.13Å; N39-L52 HydrophobicContact CB-CD2 4.28Å; N39-L52 WeakPolarHBondContact O-CD1 3.37Å
40	C	91.3	Very high	79.6	Confident	16 Å²	16	76.9 Å²	76.9	11%	0.108	47%	0.47	C	S	.	.			trans	-80.4	165.8	169.3	-56.7	0	0	0	0	111.6	P37 Q38 V47 D48 C49	P37-C40 HydrophobicContact CB-CB 4.24Å; P37-C40 WeakPolarHBondContact O-CB 3.43Å; P37-C40 PolarHBondContact O-N 2.85Å; Q38-C40 PolarHBondContact O-N 2.68Å; Q38-C40 VanDerWaalsContact O-N 3.15Å; C40-V47 HydrophobicContact CB-CG1 4.46Å; C40-D48 CarbonylContact C-O 3.57Å; C40-D48 WeakPolarHBondContact CA-O 3.36Å; C40-D48 WeakPolarHBondContact CB-O 3.47Å; C40-C49 HydrophobicContact CB-CB 4.08Å; C40-C49 WeakPolarHBondContact CB-SG 3.3Å; C40-C49 WeakPolarHBondContact SG-CB 3.38Å; C40-C49 CovalentContact SG-SG 2.03Å; C40-C49 PolarHBondContact SG-SG 3.04Å
41	T	92.4	Very high	82.1	Confident	96 Å²	96	71 Å²	71	59%	0.589	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.4	171.2	63.1	0	0	0	0	109.9	D48	T41-D48 PolarHBondContact N-O 3.42Å; T41-D48 PolarHBondContact O-N 3.07Å
42	C	92.6	Very high	84.9	Confident	46 Å²	46	69.2 Å²	69.2	31%	0.311	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.2	-179.2	-61.2	0	0	0	0	109.8	C36 S46 W64	C36-C42 VanDerWaalsContact CA-SG 3.52Å; C36-C42 HydrophobicContact CB-CB 3.83Å; C36-C42 WeakPolarHBondContact CB-SG 3.38Å; C36-C42 WeakPolarHBondContact SG-CB 3.45Å; C36-C42 PolarHBondContact SG-N 3.44Å; C36-C42 VanDerWaalsContact SG-N 3.36Å; C36-C42 CovalentContact SG-SG 2.04Å; C36-C42 PolarHBondContact SG-SG 2.95Å; C42-S46 WeakPolarHBondContact CA-O 3.24Å; C42-W64 HydrophobicContact CB-CH2 4.07Å
43	S	90.6	Very high	86.9	Confident	98 Å²	98	70.6 Å²	70.6	69%	0.685	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	104.8	-177	-171.1	0	0	0	0	109.9	E45 S46	S43-E45 PolarHBondContact O-N 2.73Å; S43-S46 PolarHBondContact N-O 3.47Å; S43-S46 WeakPolarHBondContact O-CB 3.13Å; S43-S46 PolarHBondContact O-N 2.79Å; S43-S46 VanDerWaalsContact O-N 3.14Å
44	G	88.8	Confident	88.7	Confident	68 Å²	68	67.1 Å²	67.1	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	-129.8	-168.6	0	0	0	0	0	111	S46 W64	G44-S46 VanDerWaalsContact C-N 3.26Å; G44-S46 PolarHBondContact O-N 2.93Å; G44-W64 VanDerWaalsContact O-CZ3 3.3Å; G44-W64 WeakPolarHBondContact O-CZ3 3.36Å
45	E	92.3	Very high	90.2	Very high	124 Å²	124	71.4 Å²	71.4	58%	0.579	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	4.6	179.2	-56.5	177.2	150.7	0	0	113.5	S43 V66 S67	S43-E45 PolarHBondContact O-N 2.73Å; E45-V66 HydrophobicContact CB-CB 3.88Å; E45-V66 HydrophobicContact CB-CG2 3.83Å; E45-V66 HydrophobicContact CG-CG2 4.32Å; E45-V66 PolarHBondContact O-N 3.09Å; E45-S67 PolarHBondContact O-N 2.87Å
46	S	94.7	Very high	90.9	Very high	56 Å²	56	71 Å²	71	39%	0.392	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.4	-178.3	-60.3	0	0	0	0	112.4	C42 S43 G44 S67	C42-S46 WeakPolarHBondContact CA-O 3.24Å; S43-S46 PolarHBondContact N-O 3.47Å; S43-S46 WeakPolarHBondContact O-CB 3.13Å; S43-S46 PolarHBondContact O-N 2.79Å; S43-S46 VanDerWaalsContact O-N 3.14Å; G44-S46 VanDerWaalsContact C-N 3.26Å; G44-S46 PolarHBondContact O-N 2.93Å; S46-S67 WeakPolarHBondContact CA-O 3.39Å
47	V	94.9	Very high	91	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.006	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.3	175.9	-178.8	0	0	0	0	109.2	C40 W64 T65 S67 L68 N69	C40-V47 HydrophobicContact CB-CG1 4.46Å; V47-W64 HydrophobicContact CG2-CH2 3.81Å; V47-W64 HydrophobicContact CG2-CZ3 3.74Å; V47-T65 HydrophobicContact CB-CG2 4.07Å; V47-T65 HydrophobicContact CG2-CG2 3.77Å; V47-T65 WeakPolarHBondContact CG2-OG1 3.32Å; V47-S67 PolarHBondContact N-O 3.12Å; V47-L68 HydrophobicContact CB-CD1 4.02Å; V47-L68 HydrophobicContact CG1-CD1 4.04Å; V47-L68 WeakPolarHBondContact O-CA 3.47Å; V47-N69 PolarHBondContact O-N 3.18Å
48	D	95.6	Very high	90.9	Very high	59 Å²	59	70.2 Å²	70.2	32%	0.316	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	114.3	178	-160.7	-35.2	0	0	0	111.4	C40 T41 S50 N69	C40-D48 CarbonylContact C-O 3.57Å; C40-D48 WeakPolarHBondContact CA-O 3.36Å; C40-D48 WeakPolarHBondContact CB-O 3.47Å; T41-D48 PolarHBondContact N-O 3.42Å; T41-D48 PolarHBondContact O-N 3.07Å; D48-S50 VanDerWaalsContact OD1-CB 3.22Å; D48-S50 WeakPolarHBondContact OD1-CB 3.41Å; D48-S50 PolarHBondContact OD1-N 3.03Å; D48-S50 PolarHBondContact OD1-OG 2.83Å; D48-N69 HydrophobicContact CB-CB 4.29Å; D48-N69 VanDerWaalsContact CG-ND2 3.25Å; D48-N69 PolarHBondContact OD1-ND2 2.93Å; D48-N69 VanDerWaalsContact OD1-ND2 3.17Å; D48-N69 PolarHBondContact OD2-ND2 2.84Å
49	C	95.1	Very high	91	Very high	0 Å²	0	67 Å²	67	0%	0	41%	0.409	C	S	.	.			trans	-119.2	23.5	178.6	-62.4	0	0	0	0	110.9	C40 L52 L54 P58 N69 L70 N73	C40-C49 HydrophobicContact CB-CB 4.08Å; C40-C49 WeakPolarHBondContact CB-SG 3.3Å; C40-C49 WeakPolarHBondContact SG-CB 3.38Å; C40-C49 CovalentContact SG-SG 2.03Å; C40-C49 PolarHBondContact SG-SG 3.04Å; C49-L52 HydrophobicContact CB-CD1 4.16Å; C49-L54 HydrophobicContact CB-CD1 4.26Å; C49-P58 HydrophobicContact CB-CG 4.14Å; C49-N69 CarbonylContact C-O 3.47Å; C49-N69 WeakPolarHBondContact CA-O 3.39Å; C49-N69 PolarHBondContact N-O 2.75Å; C49-L70 HydrophobicContact CB-CD2 3.74Å; C49-N73 PolarHBondContact O-ND2 2.84Å
50	S	95.6	Very high	90.7	Very high	37 Å²	37	66.5 Å²	66.5	26%	0.259	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	150	-175.5	65.4	0	0	0	0	113.6	D48 L52 N69 G71	D48-S50 VanDerWaalsContact OD1-CB 3.22Å; D48-S50 WeakPolarHBondContact OD1-CB 3.41Å; D48-S50 PolarHBondContact OD1-N 3.03Å; D48-S50 PolarHBondContact OD1-OG 2.83Å; S50-L52 PolarHBondContact O-N 3.04Å; S50-N69 WeakPolarHBondContact CB-ND2 3.48Å; S50-N69 PolarHBondContact N-O 3.27Å; S50-N69 PolarHBondContact OG-ND2 2.8Å; S50-N69 VanDerWaalsContact OG-ND2 3.08Å; S50-G71 CarbonylContact C-O 3.39Å; S50-G71 WeakPolarHBondContact CA-O 3.15Å; S50-G71 WeakPolarHBondContact CB-O 3.31Å
51	G	94.2	Very high	90.5	Very high	49 Å²	49	66.6 Å²	66.6	51%	0.505	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	7.8	178.1	0	0	0	0	0	115.6	E53 G71 H72	G51-E53 VanDerWaalsContact C-N 3.28Å; G51-E53 PolarHBondContact O-N 3.38Å; G51-G71 PolarHBondContact N-O 2.87Å; G51-G71 VanDerWaalsContact N-O 3.1Å; G51-H72 VanDerWaalsContact CA-O 3.29Å; G51-H72 WeakPolarHBondContact CA-O 3.4Å; G51-H72 PolarHBondContact N-O 2.82Å
52	L	94.4	Very high	90.3	Very high	63 Å²	63	62 Å²	62	33%	0.33	38%	0.377	S	S	.	.	S	Bend	trans	-87.7	11.4	-176.4	-61.7	179.5	0	0	0	113.7	N39 C49 S50 L54 N73	N39-L52 HydrophobicContact CB-CD1 4.13Å; N39-L52 HydrophobicContact CB-CD2 4.28Å; N39-L52 WeakPolarHBondContact O-CD1 3.37Å; C49-L52 HydrophobicContact CB-CD1 4.16Å; S50-L52 PolarHBondContact O-N 3.04Å; L52-L54 HydrophobicContact CB-CD1 4.39Å; L52-L54 HydrophobicContact CB-CD2 3.98Å; L52-L54 HydrophobicContact CB-CG 3.84Å; L52-L54 PolarHBondContact O-N 3.09Å; L52-L54 VanDerWaalsContact O-N 3.17Å; L52-N73 PolarHBondContact N-OD1 2.91Å; L52-N73 VanDerWaalsContact N-OD1 3.09Å
53	E	93.2	Very high	90.1	Very high	126 Å²	126	63.7 Å²	63.7	59%	0.589	39%	0.386	S	S	*	.			trans	55.6	22.7	-176.1	-54.8	-148.7	127.2	0	0	115.8	G51 I55 N73 K74	G51-E53 VanDerWaalsContact C-N 3.28Å; G51-E53 PolarHBondContact O-N 3.38Å; E53-I55 PolarHBondContact O-N 3.05Å; E53-N73 PolarHBondContact N-OD1 2.93Å; E53-K74 HydrophobicContact CB-CD 4.11Å; E53-K74 VanDerWaalsContact CD-CE 3.5Å; E53-K74 VanDerWaalsContact OE1-CE 3.27Å; E53-K74 WeakPolarHBondContact OE1-CE 3.38Å; E53-K74 IonicContact OE1-NZ 2.93Å; E53-K74 PolarHBondContact OE1-NZ 2.84Å; E53-K74 IonicContact OE2-NZ 3.23Å; E53-K74 PolarHBondContact OE2-NZ 3.32Å
54	L	91.4	Very high	90	Very high	42 Å²	42	62.7 Å²	62.7	22%	0.22	37%	0.367	C	S	.	.			trans	-60.4	127.3	-171.2	-58.4	178.8	0	0	0	112.9	C49 L52 P58 L70 N73 K74 L75	C49-L54 HydrophobicContact CB-CD1 4.26Å; L52-L54 HydrophobicContact CB-CD1 4.39Å; L52-L54 HydrophobicContact CB-CD2 3.98Å; L52-L54 HydrophobicContact CB-CG 3.84Å; L52-L54 PolarHBondContact O-N 3.09Å; L52-L54 VanDerWaalsContact O-N 3.17Å; L54-P58 HydrophobicContact CD1-CG 3.98Å; L54-L70 HydrophobicContact CD1-CD2 4.09Å; L54-N73 HydrophobicContact CB-CB 4.12Å; L54-N73 PolarHBondContact N-OD1 3.21Å; L54-K74 CarbonylContact O-C 3.07Å; L54-K74 VanDerWaalsContact O-CA 3.3Å; L54-K74 WeakPolarHBondContact O-CA 3.38Å; L54-K74 PolarHBondContact O-N 3.47Å; L54-L75 HydrophobicContact CB-CD2 4.23Å; L54-L75 WeakPolarHBondContact O-CD2 3.47Å; L54-L75 PolarHBondContact O-N 3.15Å
55	I	91.3	Very high	90.1	Very high	126 Å²	126	59.4 Å²	59.4	65%	0.646	33%	0.334	S	S	*	.	S	Bend	trans	-92.7	-16.5	172	56.8	169.6	0	0	0	113.3	E53 K74	E53-I55 PolarHBondContact O-N 3.05Å; I55-K74 HydrophobicContact CG2-CB 3.85Å
56	V	88.8	Confident	90.3	Very high	98 Å²	98	55 Å²	55	59%	0.594	32%	0.315	S	S	*	.	S	Bend	trans	-138.4	154.4	173.6	-66.4	0	0	0	0	109.3	L75	V56-L75 VanDerWaalsContact C-CD2 3.46Å
57	P	85.7	Confident	90.3	Very high	26 Å²	26	53.1 Å²	53.1	17%	0.169	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-58.6	155.1	175.6	-27.3	37.9	0	0	0	113.3	L78 A82	P57-L78 HydrophobicContact CG-CD2 3.32Å; P57-A82 HydrophobicContact CB-CB 4.15Å; P57-A82 HydrophobicContact CG-CB 3.87Å
58	P	85.2	Confident	90.4	Very high	23 Å²	23	53.1 Å²	53.1	15%	0.149	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-58.3	140.6	167.4	-17.9	29.9	0	0	0	111	P37 C49 L54 L61 L70	P37-P58 HydrophobicContact CB-CB 4.07Å; C49-P58 HydrophobicContact CB-CG 4.14Å; L54-P58 HydrophobicContact CD1-CG 3.98Å; P58-L61 HydrophobicContact CB-CD2 4.01Å; P58-L61 HydrophobicContact CB-CG 4.46Å; P58-L61 HydrophobicContact CG-CD2 4.16Å; P58-L70 VanDerWaalsContact CD-CD2 3.48Å; P58-L70 HydrophobicContact CG-CD2 3.96Å
59	V	77.9	Confident	90.4	Very high	116 Å²	116	51 Å²	51	70%	0.703	29%	0.291	S	S	*	.	S	Bend	trans	-79.7	153.5	168.6	-167.7	0	0	0	0	108.5	L61	V59-L61 PolarHBondContact O-N 3.01Å
60	D	78.2	Confident	90.5	Very high	127 Å²	127	51 Å²	51	68%	0.679	29%	0.291	S	S	*	.	S	Bend	trans	59.2	44	175.4	-54.4	-38.5	0	0	0	115.7
61	L	86.9	Confident	90.5	Very high	18 Å²	18	49.3 Å²	49.3	9%	0.094	28%	0.279	C	S	.	.			trans	-58.6	131.3	171.1	-69.3	169.9	0	0	0	111.9	P37 P58 V59 L68 L86	P37-L61 HydrophobicContact CG-CD2 4.1Å; P58-L61 HydrophobicContact CB-CD2 4.01Å; P58-L61 HydrophobicContact CB-CG 4.46Å; P58-L61 HydrophobicContact CG-CD2 4.16Å; V59-L61 PolarHBondContact O-N 3.01Å; L61-L68 HydrophobicContact CD1-CD2 3.83Å; L61-L68 HydrophobicContact CD2-CD1 3.96Å; L61-L68 HydrophobicContact CD2-CD2 4.45Å; L61-L86 HydrophobicContact CB-CD1 4.3Å; L61-L86 HydrophobicContact CB-CD2 3.97Å; L61-L86 HydrophobicContact CD1-CD1 4.06Å
62	P	88.2	Confident	90.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.277	C	S	.	.			trans	-65.2	135	-175.2	-24.4	34.2	0	0	0	115	W64 T65 L86	P62-W64 HydrophobicContact CB-CD2 3.79Å; P62-W64 HydrophobicContact CB-CE3 4.32Å; P62-W64 HydrophobicContact CB-CG 4.28Å; P62-W64 HydrophobicContact CB-CH2 4.03Å; P62-W64 HydrophobicContact CB-CZ2 3.5Å; P62-W64 VanDerWaalsContact CB-CZ2 3.5Å; P62-W64 HydrophobicContact CB-CZ3 4.42Å; P62-W64 HydrophobicContact CG-CH2 4.03Å; P62-W64 HydrophobicContact CG-CZ2 3.67Å; P62-W64 PolarHBondContact O-N 2.97Å; P62-W64 VanDerWaalsContact O-N 3.14Å; P62-T65 VanDerWaalsContact O-CB 3.27Å; P62-T65 WeakPolarHBondContact O-CB 3.42Å; P62-T65 PolarHBondContact O-N 2.84Å; P62-T65 PolarHBondContact O-OG1 2.96Å; P62-L86 VanDerWaalsContact O-CD2 3.3Å; P62-L86 WeakPolarHBondContact O-CD2 3.36Å
63	V	88.3	Confident	90.7	Very high	81 Å²	81	49.1 Å²	49.1	49%	0.491	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.1	-177.5	-177.2	0	0	0	0	113.3	T65 P87 N88	V63-T65 VanDerWaalsContact C-N 3.31Å; V63-P87 HydrophobicContact CG1-CG 3.84Å; V63-N88 PolarHBondContact O-ND2 2.83Å
64	W	88.8	Confident	90.9	Very high	76 Å²	76	47.4 Å²	47.4	29%	0.288	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-5.4	175.5	51.9	-114.7	0	0	0	114.3	C42 G44 V47 P62 V66	C42-W64 HydrophobicContact CB-CH2 4.07Å; G44-W64 VanDerWaalsContact O-CZ3 3.3Å; G44-W64 WeakPolarHBondContact O-CZ3 3.36Å; V47-W64 HydrophobicContact CG2-CH2 3.81Å; V47-W64 HydrophobicContact CG2-CZ3 3.74Å; P62-W64 HydrophobicContact CB-CD2 3.79Å; P62-W64 HydrophobicContact CB-CE3 4.32Å; P62-W64 HydrophobicContact CB-CG 4.28Å; P62-W64 HydrophobicContact CB-CH2 4.03Å; P62-W64 HydrophobicContact CB-CZ2 3.5Å; P62-W64 VanDerWaalsContact CB-CZ2 3.5Å; P62-W64 HydrophobicContact CB-CZ3 4.42Å; P62-W64 HydrophobicContact CG-CH2 4.03Å; P62-W64 HydrophobicContact CG-CZ2 3.67Å; P62-W64 PolarHBondContact O-N 2.97Å; P62-W64 VanDerWaalsContact O-N 3.14Å; W64-V66 PolarHBondContact O-N 3.26Å
65	T	92.2	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.			trans	-61.3	122	-175.7	-54.2	0	0	0	0	111.8	V47 P62 V63 S67 L68 N88 L89	V47-T65 HydrophobicContact CB-CG2 4.07Å; V47-T65 HydrophobicContact CG2-CG2 3.77Å; V47-T65 WeakPolarHBondContact CG2-OG1 3.32Å; P62-T65 VanDerWaalsContact O-CB 3.27Å; P62-T65 WeakPolarHBondContact O-CB 3.42Å; P62-T65 PolarHBondContact O-N 2.84Å; P62-T65 PolarHBondContact O-OG1 2.96Å; V63-T65 VanDerWaalsContact C-N 3.31Å; T65-S67 WeakPolarHBondContact CG2-O 3.5Å; T65-L68 HydrophobicContact CG2-CB 4.02Å; T65-N88 CarbonylContact O-C 3.58Å; T65-L89 HydrophobicContact CG2-CD1 4.17Å; T65-L89 WeakPolarHBondContact O-CA 3.41Å; T65-L89 PolarHBondContact O-N 2.86Å
66	V	94.9	Very high	91.1	Very high	31 Å²	31	41.8 Å²	41.8	19%	0.188	23%	0.232	C	C	.	.	S	Bend	trans	-102.9	-35.6	175.9	175.5	0	0	0	0	111.7	E45 W64 N88 R90 E91	E45-V66 HydrophobicContact CB-CB 3.88Å; E45-V66 HydrophobicContact CB-CG2 3.83Å; E45-V66 HydrophobicContact CG-CG2 4.32Å; E45-V66 PolarHBondContact O-N 3.09Å; W64-V66 PolarHBondContact O-N 3.26Å; V66-N88 HydrophobicContact CG2-CB 4.01Å; V66-R90 HydrophobicContact CG1-CB 4.08Å; V66-R90 HydrophobicContact CG1-CG 4.23Å; V66-R90 PolarHBondContact O-N 2.84Å; V66-E91 PolarHBondContact O-N 2.9Å
67	S	96.7	Very high	91.1	Very high	17 Å²	17	41.4 Å²	41.4	12%	0.119	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.9	172.9	-176	0	0	0	0	110.5	E45 S46 V47 T65 E91	E45-S67 PolarHBondContact O-N 2.87Å; S46-S67 WeakPolarHBondContact CA-O 3.39Å; V47-S67 PolarHBondContact N-O 3.12Å; T65-S67 WeakPolarHBondContact CG2-O 3.5Å; S67-E91 WeakPolarHBondContact CA-O 3.27Å; S67-E91 WeakPolarHBondContact CB-OE2 3.39Å; S67-E91 PolarHBondContact OG-OE2 2.02Å
68	L	95.4	Very high	91.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.4	-179.1	179.1	58	0	0	0	110.4	V47 L61 T65 L70 F83 L86 L89 E91 L92 R93	V47-L68 HydrophobicContact CB-CD1 4.02Å; V47-L68 HydrophobicContact CG1-CD1 4.04Å; V47-L68 WeakPolarHBondContact O-CA 3.47Å; L61-L68 HydrophobicContact CD1-CD2 3.83Å; L61-L68 HydrophobicContact CD2-CD1 3.96Å; L61-L68 HydrophobicContact CD2-CD2 4.45Å; T65-L68 HydrophobicContact CG2-CB 4.02Å; L68-L70 HydrophobicContact CD1-CD1 4.48Å; L68-L70 HydrophobicContact CD1-CG 4.24Å; L68-L70 HydrophobicContact CD2-CD1 3.85Å; L68-L70 HydrophobicContact CD2-CG 4.45Å; L68-L70 HydrophobicContact CG-CD1 4.02Å; L68-L70 HydrophobicContact CG-CG 4.1Å; L68-F83 HydrophobicContact CD2-CD1 4.25Å; L68-F83 HydrophobicContact CD2-CE1 4.01Å; L68-L86 HydrophobicContact CD2-CD1 4.14Å; L68-L89 HydrophobicContact CB-CD1 3.63Å; L68-E91 PolarHBondContact N-O 2.93Å; L68-L92 HydrophobicContact CB-CD1 4.12Å; L68-L92 HydrophobicContact CD2-CD1 3.98Å; L68-L92 HydrophobicContact CG-CD1 4.1Å; L68-R93 PolarHBondContact O-N 2.81Å
69	N	96.9	Very high	90.8	Very high	16 Å²	16	43.1 Å²	43.1	9%	0.086	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	110.8	174.5	-174.7	16.3	0	0	0	111.5	V47 D48 C49 S50 G71 R93	V47-N69 PolarHBondContact O-N 3.18Å; D48-N69 HydrophobicContact CB-CB 4.29Å; D48-N69 VanDerWaalsContact CG-ND2 3.25Å; D48-N69 PolarHBondContact OD1-ND2 2.93Å; D48-N69 VanDerWaalsContact OD1-ND2 3.17Å; D48-N69 PolarHBondContact OD2-ND2 2.84Å; C49-N69 CarbonylContact C-O 3.47Å; C49-N69 WeakPolarHBondContact CA-O 3.39Å; C49-N69 PolarHBondContact N-O 2.75Å; S50-N69 WeakPolarHBondContact CB-ND2 3.48Å; S50-N69 PolarHBondContact N-O 3.27Å; S50-N69 PolarHBondContact OG-ND2 2.8Å; S50-N69 VanDerWaalsContact OG-ND2 3.08Å; N69-G71 PolarHBondContact OD1-N 3Å; N69-R93 HydrophobicContact CB-CB 4.46Å
70	L	96.1	Very high	90.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.22	C	C	.	.			trans	-116.1	18.5	174.4	-75.1	166	0	0	0	111.3	C49 L54 P58 L68 N73 L75 F83 L92 R93 L94 N97	C49-L70 HydrophobicContact CB-CD2 3.74Å; L54-L70 HydrophobicContact CD1-CD2 4.09Å; P58-L70 VanDerWaalsContact CD-CD2 3.48Å; P58-L70 HydrophobicContact CG-CD2 3.96Å; L68-L70 HydrophobicContact CD1-CD1 4.48Å; L68-L70 HydrophobicContact CD1-CG 4.24Å; L68-L70 HydrophobicContact CD2-CD1 3.85Å; L68-L70 HydrophobicContact CD2-CG 4.45Å; L68-L70 HydrophobicContact CG-CD1 4.02Å; L68-L70 HydrophobicContact CG-CG 4.1Å; L70-N73 PolarHBondContact O-ND2 3.12Å; L70-L75 HydrophobicContact CB-CD1 4.17Å; L70-F83 HydrophobicContact CD1-CE1 4Å; L70-F83 HydrophobicContact CD1-CZ 4.34Å; L70-L92 HydrophobicContact CD1-CD1 4.49Å; L70-R93 CarbonylContact C-O 3.16Å; L70-R93 WeakPolarHBondContact CA-O 3.37Å; L70-R93 WeakPolarHBondContact CB-O 3Å; L70-R93 PolarHBondContact N-O 3.24Å; L70-L94 HydrophobicContact CB-CD2 3.76Å; L70-L94 HydrophobicContact CD1-CD2 4.07Å; L70-N97 PolarHBondContact O-ND2 3.02Å
71	G	96.1	Very high	91	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.			trans	-67.4	167.9	-177.7	0	0	0	0	0	114.6	S50 G51 N69 N73 R93 D95	S50-G71 CarbonylContact C-O 3.39Å; S50-G71 WeakPolarHBondContact CA-O 3.15Å; S50-G71 WeakPolarHBondContact CB-O 3.31Å; G51-G71 PolarHBondContact N-O 2.87Å; G51-G71 VanDerWaalsContact N-O 3.1Å; N69-G71 PolarHBondContact OD1-N 3Å; G71-N73 VanDerWaalsContact C-N 3.27Å; G71-N73 PolarHBondContact O-N 2.86Å; G71-N73 PolarHBondContact O-ND2 2.84Å; G71-R93 PolarHBondContact N-O 3.11Å; G71-D95 CarbonylContact C-O 3.5Å; G71-D95 WeakPolarHBondContact CA-O 3.48Å
72	H	97.2	Very high	90.6	Very high	100 Å²	100	39.8 Å²	39.8	46%	0.463	23%	0.227	S	C	.	.	S	Bend	trans	54.1	39.4	177	-64.6	-80.2	0	0	0	114	G51 D95 H96	G51-H72 VanDerWaalsContact CA-O 3.29Å; G51-H72 WeakPolarHBondContact CA-O 3.4Å; G51-H72 PolarHBondContact N-O 2.82Å; H72-D95 PolarHBondContact N-O 2.86Å; H72-H96 CarbonylContact C-O 3.33Å; H72-H96 WeakPolarHBondContact CA-O 3.29Å; H72-H96 HydrophobicContact CB-CB 4.4Å; H72-H96 AromaticContact CE1-CD2 3.64Å; H72-H96 AromaticContact CE1-CE1 3.5Å; H72-H96 PolarHBondContact CE1-CE1 2.74Å; H72-H96 VanDerWaalsContact CE1-CE1 3.5Å; H72-H96 AromaticContact CE1-CG 3.3Å; H72-H96 AromaticContact CE1-ND1 3.23Å; H72-H96 PolarHBondContact CE1-ND1 2.97Å; H72-H96 AromaticContact CE1-NE2 3.76Å; H72-H96 PolarHBondContact N-O 2.86Å; H72-H96 WeakPolarHBondContact ND1-CB 3.42Å; H72-H96 AromaticContact ND1-CG 3.53Å; H72-H96 AromaticContact ND1-ND1 3.85Å; H72-H96 AromaticContact NE2-CE1 3.72Å; H72-H96 AromaticContact NE2-CG 3.86Å; H72-H96 AromaticContact NE2-ND1 3.36Å; H72-H96 PolarHBondContact NE2-ND1 2.76Å
73	N	96.3	Very high	90.5	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.048	23%	0.227	C	C	.	.	S	Bend	trans	-118.6	-169.7	-178.8	-80.3	-50.2	0	0	0	110.7	C49 L52 E53 L54 L70 G71 L75 H96 N97	C49-N73 PolarHBondContact O-ND2 2.84Å; L52-N73 PolarHBondContact N-OD1 2.91Å; L52-N73 VanDerWaalsContact N-OD1 3.09Å; E53-N73 PolarHBondContact N-OD1 2.93Å; L54-N73 HydrophobicContact CB-CB 4.12Å; L54-N73 PolarHBondContact N-OD1 3.21Å; L70-N73 PolarHBondContact O-ND2 3.12Å; G71-N73 VanDerWaalsContact C-N 3.27Å; G71-N73 PolarHBondContact O-N 2.86Å; G71-N73 PolarHBondContact O-ND2 2.84Å; N73-L75 HydrophobicContact CB-CD1 4.38Å; N73-L75 HydrophobicContact CB-CG 4.14Å; N73-H96 PolarHBondContact N-O 3.2Å; N73-N97 WeakPolarHBondContact CA-OD1 3.21Å; N73-N97 WeakPolarHBondContact CB-OD1 3.3Å; N73-N97 PolarHBondContact O-OD1 3.21Å
74	K	96.1	Very high	89.9	Confident	89 Å²	89	37.7 Å²	37.7	39%	0.387	22%	0.217	S	C	.	.			trans	-115.8	27.2	-176.7	-62.4	177.6	-176.9	172.2	0	111.7	E53 L54 I55 A76 N97	E53-K74 HydrophobicContact CB-CD 4.11Å; E53-K74 VanDerWaalsContact CD-CE 3.5Å; E53-K74 VanDerWaalsContact OE1-CE 3.27Å; E53-K74 WeakPolarHBondContact OE1-CE 3.38Å; E53-K74 IonicContact OE1-NZ 2.93Å; E53-K74 PolarHBondContact OE1-NZ 2.84Å; E53-K74 IonicContact OE2-NZ 3.23Å; E53-K74 PolarHBondContact OE2-NZ 3.32Å; L54-K74 CarbonylContact O-C 3.07Å; L54-K74 VanDerWaalsContact O-CA 3.3Å; L54-K74 WeakPolarHBondContact O-CA 3.38Å; L54-K74 PolarHBondContact O-N 3.47Å; I55-K74 HydrophobicContact CG2-CB 3.85Å; K74-A76 PolarHBondContact O-N 3.35Å; K74-N97 PolarHBondContact N-OD1 3.5Å
75	L	95	Very high	89.4	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.236	C	C	.	.			trans	-70.9	110.6	-176.1	-56.1	169	0	0	0	110	L54 V56 L70 N73 L78 L94 N97 E98 L99	L54-L75 HydrophobicContact CB-CD2 4.23Å; L54-L75 WeakPolarHBondContact O-CD2 3.47Å; L54-L75 PolarHBondContact O-N 3.15Å; V56-L75 VanDerWaalsContact C-CD2 3.46Å; L70-L75 HydrophobicContact CB-CD1 4.17Å; N73-L75 HydrophobicContact CB-CD1 4.38Å; N73-L75 HydrophobicContact CB-CG 4.14Å; L75-L78 HydrophobicContact CD1-CD2 4.45Å; L75-L94 HydrophobicContact CD1-CD2 3.93Å; L75-N97 HydrophobicContact CB-CB 4.49Å; L75-N97 WeakPolarHBondContact CB-OD1 3.37Å; L75-N97 VanDerWaalsContact CG-OD1 3.26Å; L75-N97 WeakPolarHBondContact CG-OD1 3.35Å; L75-N97 PolarHBondContact N-OD1 3.48Å; L75-E98 CarbonylContact O-C 3.52Å; L75-E98 VanDerWaalsContact O-C 3.27Å; L75-E98 WeakPolarHBondContact O-CA 3.41Å; L75-E98 WeakPolarHBondContact O-CB 3.36Å; L75-E98 PolarHBondContact O-N 3Å; L75-L99 HydrophobicContact CB-CD2 4.34Å; L75-L99 WeakPolarHBondContact O-CD2 3.37Å; L75-L99 PolarHBondContact O-N 3.19Å; L75-L99 VanDerWaalsContact O-N 3.17Å
76	A	92.7	Very high	89.2	Confident	51 Å²	51	40.4 Å²	40.4	42%	0.421	24%	0.237	S	C	.	.			trans	-91.4	-25.9	-178.9	0	0	0	0	0	113.6	K74 E98	K74-A76 PolarHBondContact O-N 3.35Å; A76-E98 HydrophobicContact CB-CB 4.15Å
77	S	87.6	Confident	88.9	Confident	90 Å²	90	42.2 Å²	42.2	63%	0.629	25%	0.25	S	C	*	.			trans	-153	160.8	176.4	57.4	0	0	0	0	110.6
78	L	86.4	Confident	88.6	Confident	23 Å²	23	45.1 Å²	45.1	12%	0.12	26%	0.264	C	S	.	.			trans	-139.5	147.1	177.7	-65.6	169.8	0	0	0	108.9	P57 L75 F83 L94 L99 P103	P57-L78 HydrophobicContact CG-CD2 3.32Å; L75-L78 HydrophobicContact CD1-CD2 4.45Å; L78-F83 HydrophobicContact CB-CE2 4.36Å; L78-F83 HydrophobicContact CD1-CE2 4.11Å; L78-F83 HydrophobicContact CD1-CZ 4.08Å; L78-F83 HydrophobicContact CD2-CE2 4.5Å; L78-F83 HydrophobicContact CD2-CZ 4.32Å; L78-L94 HydrophobicContact CD1-CD1 3.48Å; L78-L94 VanDerWaalsContact CD1-CD1 3.48Å; L78-L94 HydrophobicContact CD1-CD2 3.69Å; L78-L94 HydrophobicContact CD1-CG 4.23Å; L78-L99 HydrophobicContact CD1-CD1 4.22Å; L78-L99 HydrophobicContact CD1-CD2 4.06Å; L78-L99 HydrophobicContact CG-CD2 4Å; L78-P103 HydrophobicContact CB-CB 3.84Å; L78-P103 HydrophobicContact CD1-CB 3.73Å; L78-P103 HydrophobicContact CD1-CG 4.2Å; L78-P103 HydrophobicContact CG-CB 4.32Å
79	S	79.6	Confident	88.5	Confident	62 Å²	62	45.1 Å²	45.1	43%	0.434	26%	0.264	S	S	.	.			trans	-119.9	157.7	176.7	75.4	0	0	0	0	111.1	E81 A82	S79-E81 WeakPolarHBondContact CB-OE2 3.45Å; S79-E81 PolarHBondContact O-N 3.19Å; S79-E81 VanDerWaalsContact O-N 3.11Å; S79-E81 PolarHBondContact OG-OE2 2.99Å; S79-A82 WeakPolarHBondContact O-CB 3.35Å; S79-A82 PolarHBondContact O-N 2.86Å; S79-A82 VanDerWaalsContact O-N 3.15Å
80	A	78.5	Confident	88.4	Confident	22 Å²	22	51.8 Å²	51.8	18%	0.182	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-55.4	-31.9	-173.2	0	0	0	0	0	113.6	A82 F83 A84 D104	A80-A82 VanDerWaalsContact C-N 3.27Å; A80-A82 PolarHBondContact O-N 2.71Å; A80-F83 PolarHBondContact O-N 3.16Å; A80-A84 PolarHBondContact O-N 2.96Å; A80-D104 WeakPolarHBondContact CB-OD1 3.31Å
81	E	81	Confident	88.5	Confident	138 Å²	138	54.7 Å²	54.7	65%	0.645	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-64	-31.8	-176.7	-59	73.6	-157.3	0	0	112.2	S79 F83 A84	S79-E81 WeakPolarHBondContact CB-OE2 3.45Å; S79-E81 PolarHBondContact O-N 3.19Å; S79-E81 VanDerWaalsContact O-N 3.11Å; S79-E81 PolarHBondContact OG-OE2 2.99Å; E81-F83 PolarHBondContact O-N 2.86Å; E81-F83 VanDerWaalsContact O-N 3.15Å; E81-A84 PolarHBondContact O-N 3.45Å
82	A	79.9	Confident	88.5	Confident	31 Å²	31	54.7 Å²	54.7	26%	0.256	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.6	-22.6	-176.9	0	0	0	0	0	113.8	P57 S79 A80	P57-A82 HydrophobicContact CB-CB 4.15Å; P57-A82 HydrophobicContact CG-CB 3.87Å; S79-A82 WeakPolarHBondContact O-CB 3.35Å; S79-A82 PolarHBondContact O-N 2.86Å; S79-A82 VanDerWaalsContact O-N 3.15Å; A80-A82 VanDerWaalsContact C-N 3.27Å; A80-A82 PolarHBondContact O-N 2.71Å
83	F	84.5	Confident	88.6	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-121.7	0.6	-178.7	-50.2	-68.3	0	0	0	113.2	L68 L70 L78 A80 E81 N85 L86 L92 L105 A108	L68-F83 HydrophobicContact CD2-CD1 4.25Å; L68-F83 HydrophobicContact CD2-CE1 4.01Å; L70-F83 HydrophobicContact CD1-CE1 4Å; L70-F83 HydrophobicContact CD1-CZ 4.34Å; L78-F83 HydrophobicContact CB-CE2 4.36Å; L78-F83 HydrophobicContact CD1-CE2 4.11Å; L78-F83 HydrophobicContact CD1-CZ 4.08Å; L78-F83 HydrophobicContact CD2-CE2 4.5Å; L78-F83 HydrophobicContact CD2-CZ 4.32Å; A80-F83 PolarHBondContact O-N 3.16Å; E81-F83 PolarHBondContact O-N 2.86Å; E81-F83 VanDerWaalsContact O-N 3.15Å; F83-N85 PolarHBondContact O-N 2.82Å; F83-L86 HydrophobicContact CD1-CD1 4.22Å; F83-L86 PolarHBondContact O-N 3.13Å; F83-L92 HydrophobicContact CE1-CD1 4.08Å; F83-L92 HydrophobicContact CE1-CD2 4.28Å; F83-L92 HydrophobicContact CZ-CD2 4.29Å; F83-L105 HydrophobicContact CD2-CD2 3.71Å; F83-L105 HydrophobicContact CE2-CD2 3.76Å; F83-L105 HydrophobicContact CG-CD2 4.48Å; F83-A108 HydrophobicContact CB-CB 3.86Å
84	A	75.3	Confident	88.6	Confident	35 Å²	35	53.1 Å²	53.1	29%	0.289	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.1	-168.3	0	0	0	0	0	115.3	A80 E81	A80-A84 PolarHBondContact O-N 2.96Å; E81-A84 PolarHBondContact O-N 3.45Å
85	N	78.9	Confident	88.7	Confident	126 Å²	126	48.9 Å²	48.9	67%	0.674	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	18.1	-176.1	-67	-23.5	0	0	0	113.9	F83 P87	F83-N85 PolarHBondContact O-N 2.82Å; N85-P87 VanDerWaalsContact C-CD 3.46Å; N85-P87 WeakPolarHBondContact O-CD 3.37Å
86	L	87.9	Confident	88.8	Confident	7 Å²	7	52 Å²	52	4%	0.037	29%	0.287	C	S	.	.			trans	-109.9	76.2	-177.3	-57.7	179.6	0	0	0	112.3	L61 P62 L68 F83 N88 L89	L61-L86 HydrophobicContact CB-CD1 4.3Å; L61-L86 HydrophobicContact CB-CD2 3.97Å; L61-L86 HydrophobicContact CD1-CD1 4.06Å; P62-L86 VanDerWaalsContact O-CD2 3.3Å; P62-L86 WeakPolarHBondContact O-CD2 3.36Å; L68-L86 HydrophobicContact CD2-CD1 4.14Å; F83-L86 HydrophobicContact CD1-CD1 4.22Å; F83-L86 PolarHBondContact O-N 3.13Å; L86-N88 VanDerWaalsContact C-N 3.28Å; L86-N88 PolarHBondContact O-N 2.92Å; L86-L89 HydrophobicContact CB-CB 4.02Å; L86-L89 HydrophobicContact CB-CD2 4.48Å; L86-L89 HydrophobicContact CD1-CD2 4.16Å
87	P	87.9	Confident	89.1	Confident	70 Å²	70	49.9 Å²	49.9	46%	0.455	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-20.7	-175.2	30.3	-36.6	0	0	0	113.7	V63 N85 N111	V63-P87 HydrophobicContact CG1-CG 3.84Å; N85-P87 VanDerWaalsContact C-CD 3.46Å; N85-P87 WeakPolarHBondContact O-CD 3.37Å; P87-N111 PolarHBondContact O-ND2 2.82Å
88	N	90.8	Very high	89.5	Confident	77 Å²	77	49.2 Å²	49.2	41%	0.412	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-5.9	-176.2	-61.6	-59.6	0	0	0	113.7	V63 T65 V66 L86 R90	V63-N88 PolarHBondContact O-ND2 2.83Å; T65-N88 CarbonylContact O-C 3.58Å; V66-N88 HydrophobicContact CG2-CB 4.01Å; L86-N88 VanDerWaalsContact C-N 3.28Å; L86-N88 PolarHBondContact O-N 2.92Å; N88-R90 PolarHBondContact O-N 2.8Å
89	L	93.8	Very high	90	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	S	.	.			trans	-65.7	118.5	-171.9	-171.8	70.2	0	0	0	111.8	T65 L68 L86 E91 L92 A108 N111 V112	T65-L89 HydrophobicContact CG2-CD1 4.17Å; T65-L89 WeakPolarHBondContact O-CA 3.41Å; T65-L89 PolarHBondContact O-N 2.86Å; L68-L89 HydrophobicContact CB-CD1 3.63Å; L86-L89 HydrophobicContact CB-CB 4.02Å; L86-L89 HydrophobicContact CB-CD2 4.48Å; L86-L89 HydrophobicContact CD1-CD2 4.16Å; L89-E91 WeakPolarHBondContact CD1-O 3.44Å; L89-L92 HydrophobicContact CD2-CB 4.38Å; L89-L92 HydrophobicContact CD2-CD2 4.46Å; L89-A108 HydrophobicContact CD2-CB 4.32Å; L89-N111 CarbonylContact O-C 3.4Å; L89-N111 WeakPolarHBondContact O-CB 3.44Å; L89-V112 HydrophobicContact CD2-CG2 3.91Å; L89-V112 HydrophobicContact CG-CG2 4.03Å; L89-V112 PolarHBondContact O-N 2.9Å
90	R	95.9	Very high	90.7	Very high	156 Å²	156	49.3 Å²	49.3	59%	0.589	26%	0.255	S	S	*	.			trans	-115	-30.3	178.8	-70.3	174.7	179.7	-100.7	-1.6	112.9	V66 N88 V113 S114	V66-R90 HydrophobicContact CG1-CB 4.08Å; V66-R90 HydrophobicContact CG1-CG 4.23Å; V66-R90 PolarHBondContact O-N 2.84Å; N88-R90 PolarHBondContact O-N 2.8Å; R90-V113 HydrophobicContact CB-CG2 4.42Å; R90-V113 HydrophobicContact CG-CG2 4.45Å; R90-V113 PolarHBondContact O-N 2.88Å; R90-S114 PolarHBondContact O-N 2.92Å
91	E	97.4	Very high	91.3	Very high	61 Å²	61	51.1 Å²	51.1	29%	0.285	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.4	177.8	178.5	175.8	-143.9	0	0	110.2	V66 S67 L68 L89 R93 S114 Y116	V66-E91 PolarHBondContact O-N 2.9Å; S67-E91 WeakPolarHBondContact CA-O 3.27Å; S67-E91 WeakPolarHBondContact CB-OE2 3.39Å; S67-E91 PolarHBondContact OG-OE2 2.02Å; L68-E91 PolarHBondContact N-O 2.93Å; L89-E91 WeakPolarHBondContact CD1-O 3.44Å; E91-R93 HydrophobicContact CG-CG 4.44Å; E91-S114 WeakPolarHBondContact CA-O 3.32Å; E91-Y116 HydrophobicContact CG-CE2 4.06Å; E91-Y116 WeakPolarHBondContact OE1-CE2 3.31Å
92	L	96.7	Very high	91.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	116.8	176.2	179.1	56.6	0	0	0	109.9	L68 L70 F83 L89 L94 L105 V112 S114 L115 Y116	L68-L92 HydrophobicContact CB-CD1 4.12Å; L68-L92 HydrophobicContact CD2-CD1 3.98Å; L68-L92 HydrophobicContact CG-CD1 4.1Å; L70-L92 HydrophobicContact CD1-CD1 4.49Å; F83-L92 HydrophobicContact CE1-CD1 4.08Å; F83-L92 HydrophobicContact CE1-CD2 4.28Å; F83-L92 HydrophobicContact CZ-CD2 4.29Å; L89-L92 HydrophobicContact CD2-CB 4.38Å; L89-L92 HydrophobicContact CD2-CD2 4.46Å; L92-L94 HydrophobicContact CD1-CD1 4.39Å; L92-L94 HydrophobicContact CD1-CG 4.17Å; L92-L94 HydrophobicContact CD2-CD1 3.92Å; L92-L94 HydrophobicContact CG-CD1 3.99Å; L92-L94 HydrophobicContact CG-CG 4.1Å; L92-L105 HydrophobicContact CD2-CD1 4.1Å; L92-L105 HydrophobicContact CD2-CD2 3.5Å; L92-L105 HydrophobicContact CD2-CG 4.47Å; L92-V112 HydrophobicContact CB-CG1 4.33Å; L92-V112 HydrophobicContact CB-CG2 4.43Å; L92-S114 PolarHBondContact N-O 2.82Å; L92-L115 HydrophobicContact CB-CD1 4.1Å; L92-L115 HydrophobicContact CD2-CD1 4.03Å; L92-L115 HydrophobicContact CG-CD1 4.06Å; L92-Y116 PolarHBondContact O-N 3.39Å
93	R	97.9	Very high	92.4	Very high	77 Å²	77	43.6 Å²	43.6	29%	0.291	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.2	175.8	-66.7	-172.1	59.2	-178	-7.9	110.9	L68 N69 L70 G71 E91 D95 Y116	L68-R93 PolarHBondContact O-N 2.81Å; N69-R93 HydrophobicContact CB-CB 4.46Å; L70-R93 CarbonylContact C-O 3.16Å; L70-R93 WeakPolarHBondContact CA-O 3.37Å; L70-R93 WeakPolarHBondContact CB-O 3Å; L70-R93 PolarHBondContact N-O 3.24Å; G71-R93 PolarHBondContact N-O 3.11Å; E91-R93 HydrophobicContact CG-CG 4.44Å; R93-D95 IonicContact CZ-OD1 2.68Å; R93-D95 VanDerWaalsContact CZ-OD1 3.32Å; R93-D95 IonicContact NE-OD1 3.22Å; R93-D95 PolarHBondContact NE-OD1 2.77Å; R93-D95 IonicContact NH2-OD1 2.73Å; R93-D95 PolarHBondContact NH2-OD1 2.96Å; R93-D95 IonicContact NH2-OD2 2.71Å; R93-D95 PolarHBondContact NH2-OD2 3Å; R93-Y116 HydrophobicContact CG-CD2 3.59Å; R93-Y116 HydrophobicContact CG-CE2 4.22Å; R93-Y116 HydrophobicContact CG-CG 4.2Å
94	L	97	Very high	92.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.233	C	C	.	.			trans	-126.8	27.4	179.1	-74	169.7	0	0	0	110.4	L70 L75 L78 L92 L99 P103 Y116 L117 N120	L70-L94 HydrophobicContact CB-CD2 3.76Å; L70-L94 HydrophobicContact CD1-CD2 4.07Å; L75-L94 HydrophobicContact CD1-CD2 3.93Å; L78-L94 HydrophobicContact CD1-CD1 3.48Å; L78-L94 VanDerWaalsContact CD1-CD1 3.48Å; L78-L94 HydrophobicContact CD1-CD2 3.69Å; L78-L94 HydrophobicContact CD1-CG 4.23Å; L92-L94 HydrophobicContact CD1-CD1 4.39Å; L92-L94 HydrophobicContact CD1-CG 4.17Å; L92-L94 HydrophobicContact CD2-CD1 3.92Å; L92-L94 HydrophobicContact CG-CD1 3.99Å; L92-L94 HydrophobicContact CG-CG 4.1Å; L94-L99 HydrophobicContact CB-CD1 4.09Å; L94-L99 HydrophobicContact CD1-CD1 4.42Å; L94-P103 HydrophobicContact CD1-CG 3.93Å; L94-Y116 CarbonylContact C-O 3.45Å; L94-Y116 WeakPolarHBondContact CA-O 3.46Å; L94-Y116 PolarHBondContact N-O 2.72Å; L94-L117 HydrophobicContact CB-CD2 3.8Å; L94-L117 HydrophobicContact CD1-CD2 4.1Å; L94-N120 PolarHBondContact O-ND2 3.1Å
95	D	97.9	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.			trans	-75.5	159.4	-177.2	63	-89.3	0	0	0	113.8	G71 H72 R93 N97 Y116 H118	G71-D95 CarbonylContact C-O 3.5Å; G71-D95 WeakPolarHBondContact CA-O 3.48Å; H72-D95 PolarHBondContact N-O 2.86Å; R93-D95 IonicContact CZ-OD1 2.68Å; R93-D95 VanDerWaalsContact CZ-OD1 3.32Å; R93-D95 IonicContact NE-OD1 3.22Å; R93-D95 PolarHBondContact NE-OD1 2.77Å; R93-D95 IonicContact NH2-OD1 2.73Å; R93-D95 PolarHBondContact NH2-OD1 2.96Å; R93-D95 IonicContact NH2-OD2 2.71Å; R93-D95 PolarHBondContact NH2-OD2 3Å; D95-N97 PolarHBondContact O-N 2.68Å; D95-N97 PolarHBondContact O-ND2 2.88Å; D95-Y116 PolarHBondContact N-O 3.04Å; D95-H118 CarbonylContact C-O 3.55Å; D95-H118 WeakPolarHBondContact CA-O 3.49Å; D95-H118 WeakPolarHBondContact CB-CE1 2.99Å; D95-H118 WeakPolarHBondContact CB-ND1 3.43Å; D95-H118 VanDerWaalsContact CB-O 3.27Å; D95-H118 WeakPolarHBondContact CB-O 3.42Å; D95-H118 VanDerWaalsContact CG-CE1 3.49Å; D95-H118 IonicContact OD2-CE1 3.32Å; D95-H118 PolarHBondContact OD2-CE1 3.21Å
96	H	98.1	Very high	93.4	Very high	64 Å²	64	38.6 Å²	38.6	30%	0.296	20%	0.201	S	C	.	.	S	Bend	trans	52.2	56.8	-179.7	-59.3	95.8	0	0	0	112.3	H72 N73 H118 H119	H72-H96 CarbonylContact C-O 3.33Å; H72-H96 WeakPolarHBondContact CA-O 3.29Å; H72-H96 HydrophobicContact CB-CB 4.4Å; H72-H96 AromaticContact CE1-CD2 3.64Å; H72-H96 AromaticContact CE1-CE1 3.5Å; H72-H96 PolarHBondContact CE1-CE1 2.74Å; H72-H96 VanDerWaalsContact CE1-CE1 3.5Å; H72-H96 AromaticContact CE1-CG 3.3Å; H72-H96 AromaticContact CE1-ND1 3.23Å; H72-H96 PolarHBondContact CE1-ND1 2.97Å; H72-H96 AromaticContact CE1-NE2 3.76Å; H72-H96 PolarHBondContact N-O 2.86Å; H72-H96 WeakPolarHBondContact ND1-CB 3.42Å; H72-H96 AromaticContact ND1-CG 3.53Å; H72-H96 AromaticContact ND1-ND1 3.85Å; H72-H96 AromaticContact NE2-CE1 3.72Å; H72-H96 AromaticContact NE2-CG 3.86Å; H72-H96 AromaticContact NE2-ND1 3.36Å; H72-H96 PolarHBondContact NE2-ND1 2.76Å; N73-H96 PolarHBondContact N-O 3.2Å; H96-H118 AromaticContact CE1-CE1 3.6Å; H96-H118 AromaticContact CE1-ND1 3.95Å; H96-H118 PolarHBondContact N-O 3.1Å; H96-H118 AromaticContact ND1-CE1 3.78Å; H96-H119 WeakPolarHBondContact CA-O 3.28Å; H96-H119 HydrophobicContact CB-CB 4.41Å; H96-H119 VanDerWaalsContact CD2-CB 3.47Å; H96-H119 WeakPolarHBondContact CD2-CB 3.46Å; H96-H119 AromaticContact CD2-CG 3.63Å; H96-H119 AromaticContact CE1-ND1 3.75Å; H96-H119 PolarHBondContact N-O 3.22Å; H96-H119 AromaticContact NE2-CD2 3.92Å; H96-H119 AromaticContact NE2-CE1 3.85Å; H96-H119 AromaticContact NE2-CG 3.51Å; H96-H119 AromaticContact NE2-ND1 3.48Å; H96-H119 PolarHBondContact NE2-ND1 3.49Å
97	N	97.4	Very high	93.1	Very high	7 Å²	7	48 Å²	48	4%	0.037	24%	0.236	C	C	.	.	S	Bend	trans	-135.1	-173.8	-176.6	-93	-81.6	0	0	0	110.4	L70 N73 K74 L75 D95 L99 H119 N120	L70-N97 PolarHBondContact O-ND2 3.02Å; N73-N97 WeakPolarHBondContact CA-OD1 3.21Å; N73-N97 WeakPolarHBondContact CB-OD1 3.3Å; N73-N97 PolarHBondContact O-OD1 3.21Å; K74-N97 PolarHBondContact N-OD1 3.5Å; L75-N97 HydrophobicContact CB-CB 4.49Å; L75-N97 WeakPolarHBondContact CB-OD1 3.37Å; L75-N97 VanDerWaalsContact CG-OD1 3.26Å; L75-N97 WeakPolarHBondContact CG-OD1 3.35Å; L75-N97 PolarHBondContact N-OD1 3.48Å; D95-N97 PolarHBondContact O-N 2.68Å; D95-N97 PolarHBondContact O-ND2 2.88Å; N97-L99 HydrophobicContact CB-CG 4.41Å; N97-H119 PolarHBondContact N-O 2.94Å; N97-H119 VanDerWaalsContact N-O 3.16Å; N97-N120 WeakPolarHBondContact CA-OD1 3.19Å; N97-N120 WeakPolarHBondContact CB-OD1 3.31Å; N97-N120 PolarHBondContact O-OD1 2.94Å
98	E	96.9	Very high	93	Very high	76 Å²	76	44.7 Å²	44.7	36%	0.355	21%	0.214	S	C	.	.			trans	-104.5	13.3	-173.4	-75.6	-71.5	149.7	0	0	113.1	L75 A76 T100 N120 K121	L75-E98 CarbonylContact O-C 3.52Å; L75-E98 VanDerWaalsContact O-C 3.27Å; L75-E98 WeakPolarHBondContact O-CA 3.41Å; L75-E98 WeakPolarHBondContact O-CB 3.36Å; L75-E98 PolarHBondContact O-N 3Å; A76-E98 HydrophobicContact CB-CB 4.15Å; E98-T100 PolarHBondContact O-N 2.88Å; E98-N120 PolarHBondContact N-OD1 3.09Å; E98-K121 WeakPolarHBondContact OE1-CE 3.44Å; E98-K121 IonicContact OE1-NZ 2.84Å; E98-K121 PolarHBondContact OE1-NZ 3.38Å; E98-K121 WeakPolarHBondContact OE2-CD 3.24Å; E98-K121 VanDerWaalsContact OE2-CE 3.29Å; E98-K121 WeakPolarHBondContact OE2-CE 3.32Å; E98-K121 IonicContact OE2-NZ 3.3Å; E98-K121 PolarHBondContact OE2-NZ 2.85Å
99	L	95.8	Very high	92.7	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	20%	0.196	C	C	.	.			trans	-64.6	129.7	-171.7	-58.6	173.4	0	0	0	111.9	L75 L78 L94 N97 L117 N120 K121 I122	L75-L99 HydrophobicContact CB-CD2 4.34Å; L75-L99 WeakPolarHBondContact O-CD2 3.37Å; L75-L99 PolarHBondContact O-N 3.19Å; L75-L99 VanDerWaalsContact O-N 3.17Å; L78-L99 HydrophobicContact CD1-CD1 4.22Å; L78-L99 HydrophobicContact CD1-CD2 4.06Å; L78-L99 HydrophobicContact CG-CD2 4Å; L94-L99 HydrophobicContact CB-CD1 4.09Å; L94-L99 HydrophobicContact CD1-CD1 4.42Å; N97-L99 HydrophobicContact CB-CG 4.41Å; L99-L117 HydrophobicContact CD1-CD2 3.68Å; L99-N120 HydrophobicContact CB-CB 4.26Å; L99-N120 VanDerWaalsContact CB-OD1 3.25Å; L99-N120 WeakPolarHBondContact CB-OD1 3.48Å; L99-N120 WeakPolarHBondContact CG-OD1 3.18Å; L99-N120 PolarHBondContact N-OD1 2.86Å; L99-K121 CarbonylContact O-C 3.19Å; L99-K121 WeakPolarHBondContact O-CA 3.34Å; L99-K121 PolarHBondContact O-N 2.84Å; L99-I122 PolarHBondContact O-N 3.25Å
100	T	94.1	Very high	92.4	Very high	86 Å²	86	44 Å²	44	53%	0.528	22%	0.215	S	C	.	.	S	Bend	trans	-97.8	-9.9	-178.7	53.3	0	0	0	0	114.3	E98 K121	E98-T100 PolarHBondContact O-N 2.88Å; T100-K121 HydrophobicContact CG2-CB 4.47Å
101	S	92.4	Very high	92.2	Very high	60 Å²	60	39 Å²	39	42%	0.42	20%	0.201	S	C	.	.	S	Bend	trans	-148.4	166	176.2	59	0	0	0	0	110.5
102	I	92.4	Very high	92	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-62.6	127.1	169.5	-62.2	176.7	0	0	0	107.9	L117 I122 I125 R129 T130 L133 L141	I102-L117 HydrophobicContact CG1-CD1 4.39Å; I102-L117 HydrophobicContact CG2-CD1 4.24Å; I102-I122 HydrophobicContact CG1-CD1 4.34Å; I102-I125 HydrophobicContact CD1-CG2 3.97Å; I102-R129 HydrophobicContact CB-CB 4.19Å; I102-R129 HydrophobicContact CG2-CB 4.36Å; I102-T130 HydrophobicContact CD1-CG2 3.76Å; I102-L133 HydrophobicContact CG2-CD1 4.2Å; I102-L141 HydrophobicContact CD1-CD1 4.09Å; I102-L141 HydrophobicContact CD1-CD2 4.19Å; I102-L141 HydrophobicContact CG1-CD2 4.02Å
103	P	90.4	Very high	92	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.039	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-72.1	158.1	-172.8	31	-37.3	0	0	0	112.7	L78 L94 L105 L117	L78-P103 HydrophobicContact CB-CB 3.84Å; L78-P103 HydrophobicContact CD1-CB 3.73Å; L78-P103 HydrophobicContact CD1-CG 4.2Å; L78-P103 HydrophobicContact CG-CB 4.32Å; L94-P103 HydrophobicContact CD1-CG 3.93Å; P103-L105 HydrophobicContact CB-CD2 4.46Å; P103-L105 HydrophobicContact CG-CD2 4.11Å; P103-L117 HydrophobicContact CG-CD2 4.02Å
104	D	88.4	Confident	92.1	Very high	29 Å²	29	35.5 Å²	35.5	16%	0.155	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-78.2	122.3	167.7	-162.7	-39.5	0	0	0	109.1	A80 G106 R129	A80-D104 WeakPolarHBondContact CB-OD1 3.31Å; D104-G106 PolarHBondContact OD1-N 2.95Å; D104-R129 VanDerWaalsContact CG-NH1 3.3Å; D104-R129 IonicContact OD2-CZ 2.72Å; D104-R129 VanDerWaalsContact OD2-CZ 3.3Å; D104-R129 IonicContact OD2-NH1 3.2Å; D104-R129 PolarHBondContact OD2-NH1 3.48Å; D104-R129 IonicContact OD2-NH2 3.32Å; D104-R129 PolarHBondContact OD2-NH2 2.69Å; D104-R129 VanDerWaalsContact OD2-NH2 3.17Å
105	L	87.4	Confident	92.1	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.193	C	C	.	.			trans	-106.7	-1.1	179.4	-58.7	-174.8	0	0	0	112.6	F83 L92 P103 R107 A108 A109 L115 L133	F83-L105 HydrophobicContact CD2-CD2 3.71Å; F83-L105 HydrophobicContact CE2-CD2 3.76Å; F83-L105 HydrophobicContact CG-CD2 4.48Å; L92-L105 HydrophobicContact CD2-CD1 4.1Å; L92-L105 HydrophobicContact CD2-CD2 3.5Å; L92-L105 HydrophobicContact CD2-CG 4.47Å; P103-L105 HydrophobicContact CB-CD2 4.46Å; P103-L105 HydrophobicContact CG-CD2 4.11Å; L105-R107 PolarHBondContact O-N 3.39Å; L105-A108 WeakPolarHBondContact O-CB 3.41Å; L105-A108 PolarHBondContact O-N 3.16Å; L105-A109 HydrophobicContact CB-CB 3.95Å; L105-L115 HydrophobicContact CD1-CD1 4.29Å; L105-L115 HydrophobicContact CD1-CD2 4.06Å; L105-L133 HydrophobicContact CD1-CD2 3.91Å
106	G	84.9	Confident	92.1	Very high	27 Å²	27	38.2 Å²	38.2	28%	0.278	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	44.7	-124.9	-177.9	0	0	0	0	0	113.3	D104 A108 A109	D104-G106 PolarHBondContact OD1-N 2.95Å; G106-A108 VanDerWaalsContact C-N 3.29Å; G106-A108 PolarHBondContact O-N 2.82Å; G106-A109 VanDerWaalsContact O-CB 3.31Å; G106-A109 WeakPolarHBondContact O-CB 3.43Å; G106-A109 PolarHBondContact O-N 2.71Å
107	R	82.4	Confident	92.1	Very high	205 Å²	205	35.2 Å²	35.2	77%	0.774	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-70.3	-16.9	-178.2	-67.8	-175.8	178.2	-177.9	-0.1	114.9	L105 A109 S110	L105-R107 PolarHBondContact O-N 3.39Å; R107-A109 VanDerWaalsContact C-N 3.31Å; R107-S110 PolarHBondContact O-OG 2.84Å
108	A	84.6	Confident	92.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.008	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-77.4	-19.5	176.3	0	0	0	0	0	112.4	F83 L89 L105 G106 S110 N111 V112	F83-A108 HydrophobicContact CB-CB 3.86Å; L89-A108 HydrophobicContact CD2-CB 4.32Å; L105-A108 WeakPolarHBondContact O-CB 3.41Å; L105-A108 PolarHBondContact O-N 3.16Å; G106-A108 VanDerWaalsContact C-N 3.29Å; G106-A108 PolarHBondContact O-N 2.82Å; A108-S110 PolarHBondContact O-N 3.2Å; A108-S110 VanDerWaalsContact O-N 3.14Å; A108-N111 PolarHBondContact O-N 3.31Å; A108-V112 PolarHBondContact O-N 3.4Å; A108-V112 VanDerWaalsContact O-N 3.15Å
109	A	85.3	Confident	92.2	Very high	3 Å²	3	36.6 Å²	36.6	3%	0.025	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.4	-177	0	0	0	0	0	113.8	L105 G106 R107 N111 E132	L105-A109 HydrophobicContact CB-CB 3.95Å; G106-A109 VanDerWaalsContact O-CB 3.31Å; G106-A109 WeakPolarHBondContact O-CB 3.43Å; G106-A109 PolarHBondContact O-N 2.71Å; R107-A109 VanDerWaalsContact C-N 3.31Å; A109-N111 VanDerWaalsContact C-N 3.28Å; A109-N111 PolarHBondContact O-N 2.82Å; A109-E132 HydrophobicContact CB-CB 3.92Å; A109-E132 VanDerWaalsContact CB-O 3.23Å; A109-E132 WeakPolarHBondContact CB-O 3.29Å
110	S	86.6	Confident	92.3	Very high	58 Å²	58	36.9 Å²	36.9	41%	0.406	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.3	176.9	63.5	0	0	0	0	114.6	R107 A108 S135	R107-S110 PolarHBondContact O-OG 2.84Å; A108-S110 PolarHBondContact O-N 3.2Å; A108-S110 VanDerWaalsContact O-N 3.14Å; S110-S135 VanDerWaalsContact O-CB 3.22Å; S110-S135 WeakPolarHBondContact O-CB 3.33Å; S110-S135 PolarHBondContact O-OG 3.35Å
111	N	91.1	Very high	92.4	Very high	53 Å²	53	37.2 Å²	37.2	28%	0.283	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-29.7	-171	-52.1	-19.8	0	0	0	111.9	P87 L89 A108 A109 V113	P87-N111 PolarHBondContact O-ND2 2.82Å; L89-N111 CarbonylContact O-C 3.4Å; L89-N111 WeakPolarHBondContact O-CB 3.44Å; A108-N111 PolarHBondContact O-N 3.31Å; A109-N111 VanDerWaalsContact C-N 3.28Å; A109-N111 PolarHBondContact O-N 2.82Å; N111-V113 PolarHBondContact O-N 2.85Å
112	V	94.6	Very high	92.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.			trans	-64.1	124.5	175.9	176.5	0	0	0	0	110.3	L89 L92 A108 S114 L115 S135 V136	L89-V112 HydrophobicContact CD2-CG2 3.91Å; L89-V112 HydrophobicContact CG-CG2 4.03Å; L89-V112 PolarHBondContact O-N 2.9Å; L92-V112 HydrophobicContact CB-CG1 4.33Å; L92-V112 HydrophobicContact CB-CG2 4.43Å; A108-V112 PolarHBondContact O-N 3.4Å; A108-V112 VanDerWaalsContact O-N 3.15Å; V112-S114 WeakPolarHBondContact CG1-O 3.4Å; V112-L115 HydrophobicContact CG1-CB 4.17Å; V112-S135 CarbonylContact O-C 3.49Å; V112-S135 VanDerWaalsContact O-C 3.27Å; V112-V136 HydrophobicContact CG1-CG2 4.29Å; V112-V136 WeakPolarHBondContact O-CA 3.22Å; V112-V136 WeakPolarHBondContact O-CG2 3.31Å; V112-V136 PolarHBondContact O-N 3.02Å
113	V	97.1	Very high	92.6	Very high	41 Å²	41	41.8 Å²	41.8	25%	0.248	20%	0.199	C	C	.	.	S	Bend	trans	-100.6	-35.3	177.3	-179.5	0	0	0	0	110.8	R90 N111 E137 T138	R90-V113 HydrophobicContact CB-CG2 4.42Å; R90-V113 HydrophobicContact CG-CG2 4.45Å; R90-V113 PolarHBondContact O-N 2.88Å; N111-V113 PolarHBondContact O-N 2.85Å; V113-E137 HydrophobicContact CG1-CB 4.01Å; V113-E137 HydrophobicContact CG1-CG 4.05Å; V113-E137 PolarHBondContact O-N 3.45Å; V113-T138 PolarHBondContact O-N 2.83Å
114	S	98.2	Very high	92.6	Very high	22 Å²	22	44.9 Å²	44.9	15%	0.154	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.8	-178.5	-63.4	0	0	0	0	110.9	R90 E91 L92 V112	R90-S114 PolarHBondContact O-N 2.92Å; E91-S114 WeakPolarHBondContact CA-O 3.32Å; L92-S114 PolarHBondContact N-O 2.82Å; V112-S114 WeakPolarHBondContact CG1-O 3.4Å
115	L	97.6	Very high	92.8	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	113.6	-179	-179.6	58.5	0	0	0	110.5	L92 L105 V112 L117 L133 V136 T138 L139 D140	L92-L115 HydrophobicContact CB-CD1 4.1Å; L92-L115 HydrophobicContact CD2-CD1 4.03Å; L92-L115 HydrophobicContact CG-CD1 4.06Å; L105-L115 HydrophobicContact CD1-CD1 4.29Å; L105-L115 HydrophobicContact CD1-CD2 4.06Å; V112-L115 HydrophobicContact CG1-CB 4.17Å; L115-L117 HydrophobicContact CD1-CD1 4.48Å; L115-L117 HydrophobicContact CD1-CG 4.31Å; L115-L117 HydrophobicContact CD2-CD1 3.98Å; L115-L117 HydrophobicContact CG-CD1 3.99Å; L115-L117 HydrophobicContact CG-CG 4.16Å; L115-L133 HydrophobicContact CD2-CD1 4.08Å; L115-L133 HydrophobicContact CD2-CD2 4.03Å; L115-V136 HydrophobicContact CB-CG1 4.26Å; L115-T138 PolarHBondContact N-O 2.89Å; L115-L139 HydrophobicContact CB-CD1 4.14Å; L115-L139 HydrophobicContact CD2-CD1 4Å; L115-L139 HydrophobicContact CG-CD1 4.1Å; L115-D140 PolarHBondContact O-N 3.09Å
116	Y	98.5	Very high	92.7	Very high	58 Å²	58	47.4 Å²	47.4	23%	0.227	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.5	-179.2	-55.9	-92.6	0	0	0	110.7	E91 L92 R93 L94 D95 D140	E91-Y116 HydrophobicContact CG-CE2 4.06Å; E91-Y116 WeakPolarHBondContact OE1-CE2 3.31Å; L92-Y116 PolarHBondContact O-N 3.39Å; R93-Y116 HydrophobicContact CG-CD2 3.59Å; R93-Y116 HydrophobicContact CG-CE2 4.22Å; R93-Y116 HydrophobicContact CG-CG 4.2Å; L94-Y116 CarbonylContact C-O 3.45Å; L94-Y116 WeakPolarHBondContact CA-O 3.46Å; L94-Y116 PolarHBondContact N-O 2.72Å; D95-Y116 PolarHBondContact N-O 3.04Å; Y116-D140 HydrophobicContact CD1-CB 3.93Å
117	L	97.9	Very high	92.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.			trans	-121.5	17.5	-178.8	-69.8	163.6	0	0	0	111.4	L94 L99 I102 P103 L115 N120 I122 L139 D140 L141 N144	L94-L117 HydrophobicContact CB-CD2 3.8Å; L94-L117 HydrophobicContact CD1-CD2 4.1Å; L99-L117 HydrophobicContact CD1-CD2 3.68Å; I102-L117 HydrophobicContact CG1-CD1 4.39Å; I102-L117 HydrophobicContact CG2-CD1 4.24Å; P103-L117 HydrophobicContact CG-CD2 4.02Å; L115-L117 HydrophobicContact CD1-CD1 4.48Å; L115-L117 HydrophobicContact CD1-CG 4.31Å; L115-L117 HydrophobicContact CD2-CD1 3.98Å; L115-L117 HydrophobicContact CG-CD1 3.99Å; L115-L117 HydrophobicContact CG-CG 4.16Å; L117-N120 WeakPolarHBondContact O-CB 3.35Å; L117-N120 PolarHBondContact O-ND2 3.44Å; L117-I122 HydrophobicContact CB-CD1 4.11Å; L117-I122 HydrophobicContact CD1-CD1 4.34Å; L117-L139 HydrophobicContact CD1-CD1 4.36Å; L117-D140 CarbonylContact C-O 3.49Å; L117-D140 WeakPolarHBondContact CA-O 3.38Å; L117-D140 WeakPolarHBondContact CB-O 3.46Å; L117-D140 PolarHBondContact N-O 2.9Å; L117-L141 HydrophobicContact CB-CD2 3.98Å; L117-L141 HydrophobicContact CD1-CD2 3.86Å; L117-N144 PolarHBondContact O-ND2 3.02Å
118	H	98.3	Very high	92.7	Very high	33 Å²	33	40.2 Å²	40.2	15%	0.153	21%	0.21	C	C	.	.			trans	-70.5	151.6	-174.6	71.8	46.1	0	0	0	113.2	D95 H96 D140 S142	D95-H118 CarbonylContact C-O 3.55Å; D95-H118 WeakPolarHBondContact CA-O 3.49Å; D95-H118 WeakPolarHBondContact CB-CE1 2.99Å; D95-H118 WeakPolarHBondContact CB-ND1 3.43Å; D95-H118 VanDerWaalsContact CB-O 3.27Å; D95-H118 WeakPolarHBondContact CB-O 3.42Å; D95-H118 VanDerWaalsContact CG-CE1 3.49Å; D95-H118 IonicContact OD2-CE1 3.32Å; D95-H118 PolarHBondContact OD2-CE1 3.21Å; H96-H118 AromaticContact CE1-CE1 3.6Å; H96-H118 AromaticContact CE1-ND1 3.95Å; H96-H118 PolarHBondContact N-O 3.1Å; H96-H118 AromaticContact ND1-CE1 3.78Å; H118-D140 IonicContact CD2-OD2 2.67Å; H118-D140 PolarHBondContact CD2-OD2 2.83Å; H118-D140 PolarHBondContact N-O 2.95Å; H118-S142 WeakPolarHBondContact CA-O 3.43Å; H118-S142 WeakPolarHBondContact CB-O 3.34Å; H118-S142 VanDerWaalsContact CB-OG 3.27Å; H118-S142 WeakPolarHBondContact CB-OG 3.43Å
119	H	98.3	Very high	92.6	Very high	79 Å²	79	44 Å²	44	37%	0.366	22%	0.224	S	C	.	.	S	Bend	trans	60	52.8	-175	-60.8	90.2	0	0	0	112	H96 N97 S142 N143	H96-H119 WeakPolarHBondContact CA-O 3.28Å; H96-H119 HydrophobicContact CB-CB 4.41Å; H96-H119 VanDerWaalsContact CD2-CB 3.47Å; H96-H119 WeakPolarHBondContact CD2-CB 3.46Å; H96-H119 AromaticContact CD2-CG 3.63Å; H96-H119 AromaticContact CE1-ND1 3.75Å; H96-H119 PolarHBondContact N-O 3.22Å; H96-H119 AromaticContact NE2-CD2 3.92Å; H96-H119 AromaticContact NE2-CE1 3.85Å; H96-H119 AromaticContact NE2-CG 3.51Å; H96-H119 AromaticContact NE2-ND1 3.48Å; H96-H119 PolarHBondContact NE2-ND1 3.49Å; N97-H119 PolarHBondContact N-O 2.94Å; N97-H119 VanDerWaalsContact N-O 3.16Å; H119-S142 PolarHBondContact N-O 2.89Å; H119-S142 VanDerWaalsContact N-O 3.13Å; H119-N143 WeakPolarHBondContact CA-O 3.4Å; H119-N143 HydrophobicContact CB-CB 4.41Å; H119-N143 PolarHBondContact CE1-ND2 2.81Å; H119-N143 VanDerWaalsContact CE1-ND2 3.34Å; H119-N143 PolarHBondContact N-O 3.05Å
120	N	97.9	Very high	92.7	Very high	9 Å²	9	43.9 Å²	43.9	5%	0.048	22%	0.223	C	C	.	.	S	Bend	trans	-124.2	-170.7	172	-84.4	-82.3	0	0	0	109.8	L94 N97 E98 L99 L117 I122 N144	L94-N120 PolarHBondContact O-ND2 3.1Å; N97-N120 WeakPolarHBondContact CA-OD1 3.19Å; N97-N120 WeakPolarHBondContact CB-OD1 3.31Å; N97-N120 PolarHBondContact O-OD1 2.94Å; E98-N120 PolarHBondContact N-OD1 3.09Å; L99-N120 HydrophobicContact CB-CB 4.26Å; L99-N120 VanDerWaalsContact CB-OD1 3.25Å; L99-N120 WeakPolarHBondContact CB-OD1 3.48Å; L99-N120 WeakPolarHBondContact CG-OD1 3.18Å; L99-N120 PolarHBondContact N-OD1 2.86Å; L117-N120 WeakPolarHBondContact O-CB 3.35Å; L117-N120 PolarHBondContact O-ND2 3.44Å; N120-I122 HydrophobicContact CB-CD1 4.48Å; N120-I122 HydrophobicContact CB-CG1 4.22Å; N120-N144 WeakPolarHBondContact CA-OD1 3.43Å; N120-N144 WeakPolarHBondContact CB-OD1 3.22Å; N120-N144 PolarHBondContact O-OD1 2.01Å
121	K	96.9	Very high	92.7	Very high	92 Å²	92	44.9 Å²	44.9	40%	0.4	23%	0.226	S	C	.	.			trans	-112.3	27.2	-178.6	-65.9	178.1	-175.3	169.3	0	112.6	E98 L99 T100 R123 N144	E98-K121 WeakPolarHBondContact OE1-CE 3.44Å; E98-K121 IonicContact OE1-NZ 2.84Å; E98-K121 PolarHBondContact OE1-NZ 3.38Å; E98-K121 WeakPolarHBondContact OE2-CD 3.24Å; E98-K121 VanDerWaalsContact OE2-CE 3.29Å; E98-K121 WeakPolarHBondContact OE2-CE 3.32Å; E98-K121 IonicContact OE2-NZ 3.3Å; E98-K121 PolarHBondContact OE2-NZ 2.85Å; L99-K121 CarbonylContact O-C 3.19Å; L99-K121 WeakPolarHBondContact O-CA 3.34Å; L99-K121 PolarHBondContact O-N 2.84Å; T100-K121 HydrophobicContact CG2-CB 4.47Å; K121-R123 PolarHBondContact O-N 2.76Å; K121-N144 PolarHBondContact N-OD1 2.9Å
122	I	95.8	Very high	92.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.			trans	-66.9	126.4	-179.1	-57.4	175.3	0	0	0	109.7	L99 I102 L117 N120 L141 N144 D145 I146	L99-I122 PolarHBondContact O-N 3.25Å; I102-I122 HydrophobicContact CG1-CD1 4.34Å; L117-I122 HydrophobicContact CB-CD1 4.11Å; L117-I122 HydrophobicContact CD1-CD1 4.34Å; N120-I122 HydrophobicContact CB-CD1 4.48Å; N120-I122 HydrophobicContact CB-CG1 4.22Å; I122-L141 HydrophobicContact CD1-CD2 3.83Å; I122-N144 HydrophobicContact CB-CB 4.4Å; I122-N144 WeakPolarHBondContact CB-OD1 3.39Å; I122-N144 WeakPolarHBondContact CG1-OD1 3.41Å; I122-N144 PolarHBondContact N-OD1 3.19Å; I122-D145 CarbonylContact O-C 3.22Å; I122-D145 VanDerWaalsContact O-C 3.32Å; I122-D145 VanDerWaalsContact O-CA 3.31Å; I122-D145 WeakPolarHBondContact O-CA 3.48Å; I122-D145 WeakPolarHBondContact O-CB 3.32Å; I122-D145 PolarHBondContact O-N 3.48Å; I122-I146 HydrophobicContact CG2-CD1 4.45Å; I122-I146 HydrophobicContact CG2-CG1 4.29Å; I122-I146 WeakPolarHBondContact O-CG1 3.32Å; I122-I146 PolarHBondContact O-N 2.81Å
123	R	93.1	Very high	92.1	Very high	161 Å²	161	46.1 Å²	46.1	61%	0.608	23%	0.23	S	C	*	.			trans	-104.6	-24.1	-176.2	-61.8	-173.1	175.7	165.5	3	114.8	K121 D145 I146	K121-R123 PolarHBondContact O-N 2.76Å; R123-D145 HydrophobicContact CG-CB 3.95Å; R123-I146 WeakPolarHBondContact O-CA 3.47Å
124	T	90.8	Very high	91.7	Very high	70 Å²	70	47.1 Å²	47.1	43%	0.429	24%	0.237	S	C	.	.			trans	-145.3	146.8	-175.4	48.1	0	0	0	0	110.5
125	I	91.9	Very high	91.5	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.062	24%	0.243	C	C	.	.			trans	-97.6	126	166.9	-49.5	-179.6	0	0	0	105.9	I102 T130 L141 I146 L149 G153 F154 L165	I102-I125 HydrophobicContact CD1-CG2 3.97Å; I125-T130 HydrophobicContact CG2-CG2 3.73Å; I125-L141 HydrophobicContact CD1-CD1 3.97Å; I125-L141 HydrophobicContact CG1-CD1 4.33Å; I125-I146 HydrophobicContact CD1-CD1 4.22Å; I125-I146 HydrophobicContact CG1-CD1 4.02Å; I125-I146 HydrophobicContact CG1-CG2 4.32Å; I125-L149 HydrophobicContact CD1-CD2 3.81Å; I125-G153 WeakPolarHBondContact CG2-O 3.49Å; I125-F154 HydrophobicContact CD1-CE2 3.74Å; I125-F154 HydrophobicContact CD1-CZ 3.61Å; I125-F154 HydrophobicContact CG2-CE1 4.36Å; I125-F154 HydrophobicContact CG2-CE2 4.3Å; I125-F154 HydrophobicContact CG2-CZ 4.09Å; I125-L165 HydrophobicContact CD1-CD2 3.76Å
126	N	85.1	Confident	91.4	Very high	72 Å²	72	48.1 Å²	48.1	39%	0.385	24%	0.243	S	C	.	.			trans	-123.3	127.2	-175.7	176	-1.9	0	0	0	109.1	S128 R129 T130	N126-S128 PolarHBondContact ND2-OG 2.84Å; N126-S128 VanDerWaalsContact ND2-OG 3.11Å; N126-S128 PolarHBondContact O-N 2.95Å; N126-S128 VanDerWaalsContact O-N 3.13Å; N126-S128 PolarHBondContact OD1-N 3.44Å; N126-S128 PolarHBondContact OD1-OG 3.44Å; N126-R129 PolarHBondContact O-N 2.89Å; N126-T130 PolarHBondContact O-N 2.79Å; N126-T130 VanDerWaalsContact O-N 3.15Å; N126-T130 PolarHBondContact O-OG1 3.2Å
127	G	83.1	Confident	91.4	Very high	10 Å²	10	47.9 Å²	47.9	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-51.2	-34.1	177.8	0	0	0	0	0	114.2	R129 T130 T131 D152	G127-R129 PolarHBondContact O-N 2.76Å; G127-T130 WeakPolarHBondContact CA-OG1 3.29Å; G127-T130 PolarHBondContact O-N 2.89Å; G127-T131 WeakPolarHBondContact O-CB 3.37Å; G127-T131 PolarHBondContact O-N 3.39Å; G127-T131 PolarHBondContact O-OG1 2.85Å; G127-D152 WeakPolarHBondContact CA-O 3.4Å; G127-D152 PolarHBondContact N-O 3.24Å; G127-D152 VanDerWaalsContact N-O 3.07Å
128	S	84.3	Confident	91.4	Very high	71 Å²	71	49.3 Å²	49.3	50%	0.497	25%	0.253	S	S	.	.	H	α-helix	trans	-69.8	-9.4	178.4	82.6	0	0	0	0	114.3	N126	N126-S128 PolarHBondContact ND2-OG 2.84Å; N126-S128 VanDerWaalsContact ND2-OG 3.11Å; N126-S128 PolarHBondContact O-N 2.95Å; N126-S128 VanDerWaalsContact O-N 3.13Å; N126-S128 PolarHBondContact OD1-N 3.44Å; N126-S128 PolarHBondContact OD1-OG 3.44Å
129	R	82.6	Confident	91.4	Very high	81 Å²	81	47.7 Å²	47.7	31%	0.306	25%	0.246	S	C	.	.	H	α-helix	trans	-113.6	-19.8	173.8	-68.8	-54.7	-169.3	-166.1	13.8	113.4	I102 D104 N126 G127	I102-R129 HydrophobicContact CB-CB 4.19Å; I102-R129 HydrophobicContact CG2-CB 4.36Å; D104-R129 VanDerWaalsContact CG-NH1 3.3Å; D104-R129 IonicContact OD2-CZ 2.72Å; D104-R129 VanDerWaalsContact OD2-CZ 3.3Å; D104-R129 IonicContact OD2-NH1 3.2Å; D104-R129 PolarHBondContact OD2-NH1 3.48Å; D104-R129 IonicContact OD2-NH2 3.32Å; D104-R129 PolarHBondContact OD2-NH2 2.69Å; D104-R129 VanDerWaalsContact OD2-NH2 3.17Å; N126-R129 PolarHBondContact O-N 2.89Å; G127-R129 PolarHBondContact O-N 2.76Å
130	T	86.8	Confident	91.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-89.7	-24.9	174.1	51.1	0	0	0	0	113.3	I102 I125 N126 G127 E132 L133 G153 P155 L158	I102-T130 HydrophobicContact CD1-CG2 3.76Å; I125-T130 HydrophobicContact CG2-CG2 3.73Å; N126-T130 PolarHBondContact O-N 2.79Å; N126-T130 VanDerWaalsContact O-N 3.15Å; N126-T130 PolarHBondContact O-OG1 3.2Å; G127-T130 WeakPolarHBondContact CA-OG1 3.29Å; G127-T130 PolarHBondContact O-N 2.89Å; T130-E132 PolarHBondContact O-N 2.92Å; T130-E132 VanDerWaalsContact O-N 3.11Å; T130-L133 HydrophobicContact CG2-CD1 4.45Å; T130-L133 WeakPolarHBondContact O-CB 3.33Å; T130-L133 PolarHBondContact O-N 2.82Å; T130-G153 WeakPolarHBondContact CG2-O 2.97Å; T130-G153 PolarHBondContact OG1-O 2.79Å; T130-P155 WeakPolarHBondContact OG1-CD 3.42Å; T130-L158 WeakPolarHBondContact O-CD2 3.47Å
131	T	86.9	Confident	91.4	Very high	78 Å²	78	44.3 Å²	44.3	48%	0.479	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-37.2	177.5	-66.8	0	0	0	0	113.6	G127 V134	G127-T131 WeakPolarHBondContact O-CB 3.37Å; G127-T131 PolarHBondContact O-N 3.39Å; G127-T131 PolarHBondContact O-OG1 2.85Å; T131-V134 WeakPolarHBondContact O-CG1 3.41Å
132	E	83.4	Confident	91.5	Very high	76 Å²	76	40.4 Å²	40.4	36%	0.355	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-18.4	-174.7	-63.8	169.8	162.3	0	0	112.9	A109 T130 V134	A109-E132 HydrophobicContact CB-CB 3.92Å; A109-E132 VanDerWaalsContact CB-O 3.23Å; A109-E132 WeakPolarHBondContact CB-O 3.29Å; T130-E132 PolarHBondContact O-N 2.92Å; T130-E132 VanDerWaalsContact O-N 3.11Å; E132-V134 PolarHBondContact O-N 3.31Å
133	L	89.2	Confident	91.6	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	22%	0.224	C	C	.	.			trans	-78.5	39.5	-175	-55.9	-177.4	0	0	0	112.8	I102 L105 L115 T130 S135 V136	I102-L133 HydrophobicContact CG2-CD1 4.2Å; L105-L133 HydrophobicContact CD1-CD2 3.91Å; L115-L133 HydrophobicContact CD2-CD1 4.08Å; L115-L133 HydrophobicContact CD2-CD2 4.03Å; T130-L133 HydrophobicContact CG2-CD1 4.45Å; T130-L133 WeakPolarHBondContact O-CB 3.33Å; T130-L133 PolarHBondContact O-N 2.82Å; L133-S135 VanDerWaalsContact C-N 3.27Å; L133-S135 PolarHBondContact O-N 3.38Å; L133-V136 HydrophobicContact CB-CB 4.22Å; L133-V136 HydrophobicContact CB-CG2 3.78Å; L133-V136 HydrophobicContact CD2-CG2 4.2Å; L133-V136 HydrophobicContact CG-CG2 4.46Å; L133-V136 PolarHBondContact O-N 3.11Å
134	V	90.2	Very high	91.9	Very high	63 Å²	63	34.9 Å²	34.9	38%	0.382	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.7	-169.2	-65.4	0	0	0	0	113.4	T131 E132 Q159	T131-V134 WeakPolarHBondContact O-CG1 3.41Å; E132-V134 PolarHBondContact O-N 3.31Å; V134-Q159 WeakPolarHBondContact O-CG 2.99Å; V134-Q159 PolarHBondContact O-N 2.71Å
135	S	93.6	Very high	92.2	Very high	42 Å²	42	33.8 Å²	33.8	29%	0.294	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-2	-177	-62	0	0	0	0	114.4	S110 V112 L133 E137	S110-S135 VanDerWaalsContact O-CB 3.22Å; S110-S135 WeakPolarHBondContact O-CB 3.33Å; S110-S135 PolarHBondContact O-OG 3.35Å; V112-S135 CarbonylContact O-C 3.49Å; V112-S135 VanDerWaalsContact O-C 3.27Å; L133-S135 VanDerWaalsContact C-N 3.27Å; L133-S135 PolarHBondContact O-N 3.38Å; S135-E137 PolarHBondContact O-N 2.69Å
136	V	96	Very high	92.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.185	C	C	.	.			trans	-72.3	116	-178.1	178.3	0	0	0	0	109.6	V112 L115 L133 T138 L139 Q159 I160	V112-V136 HydrophobicContact CG1-CG2 4.29Å; V112-V136 WeakPolarHBondContact O-CA 3.22Å; V112-V136 WeakPolarHBondContact O-CG2 3.31Å; V112-V136 PolarHBondContact O-N 3.02Å; L115-V136 HydrophobicContact CB-CG1 4.26Å; L133-V136 HydrophobicContact CB-CB 4.22Å; L133-V136 HydrophobicContact CB-CG2 3.78Å; L133-V136 HydrophobicContact CD2-CG2 4.2Å; L133-V136 HydrophobicContact CG-CG2 4.46Å; L133-V136 PolarHBondContact O-N 3.11Å; V136-T138 VanDerWaalsContact CG1-O 3.24Å; V136-T138 WeakPolarHBondContact CG1-O 3.41Å; V136-L139 HydrophobicContact CG1-CB 4.13Å; V136-Q159 CarbonylContact O-C 3.59Å; V136-Q159 VanDerWaalsContact O-C 3.29Å; V136-I160 VanDerWaalsContact O-CA 3.24Å; V136-I160 WeakPolarHBondContact O-CA 3.35Å; V136-I160 VanDerWaalsContact O-CG1 3.31Å; V136-I160 WeakPolarHBondContact O-CG1 3.45Å; V136-I160 PolarHBondContact O-N 3.23Å
137	E	97.6	Very high	92.7	Very high	54 Å²	54	32.6 Å²	32.6	25%	0.252	18%	0.184	S	C	.	.	S	Bend	trans	-94.2	-29.6	173.2	-60.4	-156.7	143.2	0	0	112.1	V113 S135 Q159 R161 D162	V113-E137 HydrophobicContact CG1-CB 4.01Å; V113-E137 HydrophobicContact CG1-CG 4.05Å; V113-E137 PolarHBondContact O-N 3.45Å; S135-E137 PolarHBondContact O-N 2.69Å; E137-Q159 HydrophobicContact CG-CB 4.44Å; E137-R161 HydrophobicContact CB-CG 4.15Å; E137-R161 HydrophobicContact CG-CG 4.46Å; E137-R161 PolarHBondContact O-N 3.18Å; E137-R161 IonicContact OE1-CZ 2.71Å; E137-R161 IonicContact OE1-NE 3.22Å; E137-R161 PolarHBondContact OE1-NE 2.85Å; E137-R161 IonicContact OE1-NH2 2.82Å; E137-R161 PolarHBondContact OE1-NH2 2.78Å; E137-R161 IonicContact OE2-CZ 2.69Å; E137-R161 VanDerWaalsContact OE2-CZ 3.25Å; E137-R161 IonicContact OE2-NE 3.41Å; E137-R161 PolarHBondContact OE2-NE 3.3Å; E137-R161 VanDerWaalsContact OE2-NE 3.09Å; E137-R161 IonicContact OE2-NH2 3.71Å; E137-R161 PolarHBondContact OE2-NH2 3.26Å; E137-D162 PolarHBondContact O-N 2.95Å
138	T	98.4	Very high	92.8	Very high	29 Å²	29	34.1 Å²	34.1	18%	0.178	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.7	177.7	-55	0	0	0	0	110.8	V113 L115 V136 D162	V113-T138 PolarHBondContact O-N 2.83Å; L115-T138 PolarHBondContact N-O 2.89Å; V136-T138 VanDerWaalsContact CG1-O 3.24Å; V136-T138 WeakPolarHBondContact CG1-O 3.41Å; T138-D162 HydrophobicContact CG2-CB 4.19Å
139	L	97.9	Very high	93	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	110.7	178.2	-179.6	58.9	0	0	0	111.1	L115 L117 V136 L141 F154 I160 D162 L163 Y164	L115-L139 HydrophobicContact CB-CD1 4.14Å; L115-L139 HydrophobicContact CD2-CD1 4Å; L115-L139 HydrophobicContact CG-CD1 4.1Å; L117-L139 HydrophobicContact CD1-CD1 4.36Å; V136-L139 HydrophobicContact CG1-CB 4.13Å; L139-L141 HydrophobicContact CD1-CD1 4.45Å; L139-L141 HydrophobicContact CD1-CG 4.21Å; L139-L141 HydrophobicContact CD2-CD1 3.9Å; L139-L141 HydrophobicContact CD2-CG 4.49Å; L139-L141 HydrophobicContact CG-CD1 4.03Å; L139-L141 HydrophobicContact CG-CG 4.1Å; L139-F154 HydrophobicContact CD2-CE1 4.24Å; L139-I160 HydrophobicContact CB-CD1 4.5Å; L139-I160 HydrophobicContact CB-CG2 4.48Å; L139-I160 HydrophobicContact CD2-CD1 3.91Å; L139-D162 PolarHBondContact N-O 2.87Å; L139-L163 HydrophobicContact CB-CD1 4.23Å; L139-L163 HydrophobicContact CD2-CD1 4.11Å; L139-L163 HydrophobicContact CG-CD1 4.22Å; L139-Y164 PolarHBondContact O-N 2.85Å
140	D	98.6	Very high	93	Very high	16 Å²	16	33.4 Å²	33.4	9%	0.086	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	105.8	176	-162.2	-22.3	0	0	0	112	L115 Y116 L117 H118 S142 Y164	L115-D140 PolarHBondContact O-N 3.09Å; Y116-D140 HydrophobicContact CD1-CB 3.93Å; L117-D140 CarbonylContact C-O 3.49Å; L117-D140 WeakPolarHBondContact CA-O 3.38Å; L117-D140 WeakPolarHBondContact CB-O 3.46Å; L117-D140 PolarHBondContact N-O 2.9Å; H118-D140 IonicContact CD2-OD2 2.67Å; H118-D140 PolarHBondContact CD2-OD2 2.83Å; H118-D140 PolarHBondContact N-O 2.95Å; D140-S142 WeakPolarHBondContact OD1-CA 3.32Å; D140-S142 WeakPolarHBondContact OD1-CB 3.24Å; D140-S142 PolarHBondContact OD1-N 2.99Å; D140-S142 PolarHBondContact OD1-OG 2.82Å; D140-Y164 HydrophobicContact CB-CD2 4.08Å
141	L	98.1	Very high	92.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.192	C	C	.	.			trans	-110.7	22.1	174.3	-70.6	166.7	0	0	0	111.3	I102 L117 I122 I125 L139 I146 Y164 L165 N168	I102-L141 HydrophobicContact CD1-CD1 4.09Å; I102-L141 HydrophobicContact CD1-CD2 4.19Å; I102-L141 HydrophobicContact CG1-CD2 4.02Å; L117-L141 HydrophobicContact CB-CD2 3.98Å; L117-L141 HydrophobicContact CD1-CD2 3.86Å; I122-L141 HydrophobicContact CD1-CD2 3.83Å; I125-L141 HydrophobicContact CD1-CD1 3.97Å; I125-L141 HydrophobicContact CG1-CD1 4.33Å; L139-L141 HydrophobicContact CD1-CD1 4.45Å; L139-L141 HydrophobicContact CD1-CG 4.21Å; L139-L141 HydrophobicContact CD2-CD1 3.9Å; L139-L141 HydrophobicContact CD2-CG 4.49Å; L139-L141 HydrophobicContact CG-CD1 4.03Å; L139-L141 HydrophobicContact CG-CG 4.1Å; L141-I146 HydrophobicContact CB-CD1 4.06Å; L141-Y164 CarbonylContact C-O 3.22Å; L141-Y164 WeakPolarHBondContact CA-O 3.33Å; L141-Y164 PolarHBondContact N-O 2.79Å; L141-L165 HydrophobicContact CB-CD2 3.81Å; L141-L165 HydrophobicContact CD1-CD2 4.13Å; L141-N168 PolarHBondContact O-ND2 2.97Å
142	S	98.6	Very high	92.4	Very high	10 Å²	10	35.3 Å²	35.3	7%	0.07	19%	0.191	C	C	.	.			trans	-70.2	162.3	179.9	68.4	0	0	0	0	112.7	H118 H119 D140 N144 Y164 S166	H118-S142 WeakPolarHBondContact CA-O 3.43Å; H118-S142 WeakPolarHBondContact CB-O 3.34Å; H118-S142 VanDerWaalsContact CB-OG 3.27Å; H118-S142 WeakPolarHBondContact CB-OG 3.43Å; H119-S142 PolarHBondContact N-O 2.89Å; H119-S142 VanDerWaalsContact N-O 3.13Å; D140-S142 WeakPolarHBondContact OD1-CA 3.32Å; D140-S142 WeakPolarHBondContact OD1-CB 3.24Å; D140-S142 PolarHBondContact OD1-N 2.99Å; D140-S142 PolarHBondContact OD1-OG 2.82Å; S142-N144 VanDerWaalsContact C-N 3.31Å; S142-N144 PolarHBondContact O-N 3.01Å; S142-N144 PolarHBondContact O-ND2 3.37Å; S142-Y164 PolarHBondContact N-O 2.91Å; S142-S166 CarbonylContact C-O 3.29Å; S142-S166 WeakPolarHBondContact CA-O 3.43Å; S142-S166 WeakPolarHBondContact CB-O 3.36Å
143	N	98.4	Very high	92.6	Very high	39 Å²	39	31.7 Å²	31.7	21%	0.209	18%	0.175	C	C	.	.	S	Bend	trans	54.8	45.7	176.6	-51.4	-81.6	0	0	0	112.4	H119 S166 N167	H119-N143 WeakPolarHBondContact CA-O 3.4Å; H119-N143 HydrophobicContact CB-CB 4.41Å; H119-N143 PolarHBondContact CE1-ND2 2.81Å; H119-N143 VanDerWaalsContact CE1-ND2 3.34Å; H119-N143 PolarHBondContact N-O 3.05Å; N143-S166 PolarHBondContact N-O 3.47Å; N143-N167 WeakPolarHBondContact CA-O 3.43Å; N143-N167 VanDerWaalsContact OD1-CB 3.3Å; N143-N167 WeakPolarHBondContact OD1-CB 3.26Å; N143-N167 PolarHBondContact OD1-ND2 2.91Å
144	N	98.1	Very high	92.8	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.032	18%	0.175	C	C	.	.	S	Bend	trans	-124.9	-173.4	-179.6	-91.1	-89.6	0	0	0	109.9	L117 N120 K121 I122 S142 I146 N168	L117-N144 PolarHBondContact O-ND2 3.02Å; N120-N144 WeakPolarHBondContact CA-OD1 3.43Å; N120-N144 WeakPolarHBondContact CB-OD1 3.22Å; N120-N144 PolarHBondContact O-OD1 2.01Å; K121-N144 PolarHBondContact N-OD1 2.9Å; I122-N144 HydrophobicContact CB-CB 4.4Å; I122-N144 WeakPolarHBondContact CB-OD1 3.39Å; I122-N144 WeakPolarHBondContact CG1-OD1 3.41Å; I122-N144 PolarHBondContact N-OD1 3.19Å; S142-N144 VanDerWaalsContact C-N 3.31Å; S142-N144 PolarHBondContact O-N 3.01Å; S142-N144 PolarHBondContact O-ND2 3.37Å; N144-I146 HydrophobicContact CB-CD1 4.44Å; N144-I146 HydrophobicContact CB-CG1 4.3Å; N144-N168 VanDerWaalsContact CA-OD1 3.31Å; N144-N168 WeakPolarHBondContact CA-OD1 3.29Å; N144-N168 WeakPolarHBondContact CB-OD1 3.19Å; N144-N168 PolarHBondContact N-OD1 2.88Å; N144-N168 WeakPolarHBondContact O-CA 3.34Å; N144-N168 PolarHBondContact O-OD1 3.27Å; N144-N168 VanDerWaalsContact O-OD1 3.07Å
145	D	97	Very high	92.8	Very high	47 Å²	47	30 Å²	30	25%	0.251	17%	0.165	S	C	.	.			trans	-100.7	13.1	-174.5	-100.9	14.4	0	0	0	114.1	I122 R123 T147 N168 K169	I122-D145 CarbonylContact O-C 3.22Å; I122-D145 VanDerWaalsContact O-C 3.32Å; I122-D145 VanDerWaalsContact O-CA 3.31Å; I122-D145 WeakPolarHBondContact O-CA 3.48Å; I122-D145 WeakPolarHBondContact O-CB 3.32Å; I122-D145 PolarHBondContact O-N 3.48Å; R123-D145 HydrophobicContact CG-CB 3.95Å; D145-T147 PolarHBondContact O-N 2.73Å; D145-N168 PolarHBondContact N-OD1 2.8Å; D145-K169 HydrophobicContact CB-CD 4.45Å; D145-K169 WeakPolarHBondContact OD1-CE 3.34Å; D145-K169 IonicContact OD1-NZ 3.97Å; D145-K169 PolarHBondContact OD1-NZ 2.7Å; D145-K169 IonicContact OD2-NZ 2.78Å; D145-K169 PolarHBondContact OD2-NZ 3.12Å
146	I	95.9	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.			trans	-63.7	124.9	-170.1	-55.3	169.5	0	0	0	111.2	I122 R123 I125 L141 N144 L165 N168 K169 I170	I122-I146 HydrophobicContact CG2-CD1 4.45Å; I122-I146 HydrophobicContact CG2-CG1 4.29Å; I122-I146 WeakPolarHBondContact O-CG1 3.32Å; I122-I146 PolarHBondContact O-N 2.81Å; R123-I146 WeakPolarHBondContact O-CA 3.47Å; I125-I146 HydrophobicContact CD1-CD1 4.22Å; I125-I146 HydrophobicContact CG1-CD1 4.02Å; I125-I146 HydrophobicContact CG1-CG2 4.32Å; L141-I146 HydrophobicContact CB-CD1 4.06Å; N144-I146 HydrophobicContact CB-CD1 4.44Å; N144-I146 HydrophobicContact CB-CG1 4.3Å; I146-L165 HydrophobicContact CD1-CD2 4Å; I146-N168 HydrophobicContact CB-CB 4.27Å; I146-N168 VanDerWaalsContact CB-OD1 3.3Å; I146-N168 WeakPolarHBondContact CB-OD1 3.24Å; I146-N168 WeakPolarHBondContact CG1-OD1 3.49Å; I146-N168 PolarHBondContact N-OD1 2.76Å; I146-K169 CarbonylContact O-C 3.44Å; I146-K169 VanDerWaalsContact O-CA 3.25Å; I146-K169 WeakPolarHBondContact O-CA 3.47Å; I146-K169 WeakPolarHBondContact O-CB 3.44Å; I146-K169 PolarHBondContact O-N 2.77Å; I146-I170 HydrophobicContact CB-CG1 4.48Å; I146-I170 HydrophobicContact CG2-CG1 4.22Å; I146-I170 WeakPolarHBondContact O-CG1 3.25Å; I146-I170 PolarHBondContact O-N 2.68Å
147	T	92.4	Very high	92.4	Very high	59 Å²	59	34.7 Å²	34.7	36%	0.362	21%	0.205	S	C	.	.			trans	-95.8	-27.6	-172.6	64.8	0	0	0	0	115.4	D145 K169 I170 S171	D145-T147 PolarHBondContact O-N 2.73Å; T147-K169 HydrophobicContact CG2-CB 4.36Å; T147-I170 CarbonylContact O-C 3.43Å; T147-I170 WeakPolarHBondContact O-CA 3.16Å; T147-S171 PolarHBondContact O-N 3.29Å
148	D	85.9	Confident	92.1	Very high	43 Å²	43	32.3 Å²	32.3	23%	0.23	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	152.9	-171.5	-57.4	-76.5	0	0	0	110.5	S171 T172	D148-S171 PolarHBondContact OD1-OG 2.14Å; D148-T172 PolarHBondContact OD1-OG1 2.95Å
149	L	87.8	Confident	92	Very high	4 Å²	4	35 Å²	35	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.1	169.9	-59.9	-178.3	0	0	0	109.6	I125 L165 I170 L173 Q174 A177 L178 L190	I125-L149 HydrophobicContact CD1-CD2 3.81Å; L149-L165 HydrophobicContact CD1-CD1 3.97Å; L149-L165 HydrophobicContact CD2-CD1 3.96Å; L149-L165 HydrophobicContact CD2-CD2 4.48Å; L149-I170 HydrophobicContact CD1-CD1 4.37Å; L149-I170 HydrophobicContact CD2-CD1 4.01Å; L149-I170 HydrophobicContact CG-CD1 4.11Å; L149-I170 HydrophobicContact CG-CG2 4.27Å; L149-L173 HydrophobicContact CD1-CD2 3.91Å; L149-Q174 VanDerWaalsContact O-CB 3.29Å; L149-Q174 WeakPolarHBondContact O-CB 3.28Å; L149-Q174 PolarHBondContact O-N 3.15Å; L149-A177 HydrophobicContact CB-CB 4.19Å; L149-L178 HydrophobicContact CD1-CD1 4.49Å; L149-L190 HydrophobicContact CD1-CD2 3.94Å
150	R	83.1	Confident	92	Very high	133 Å²	133	35 Å²	35	50%	0.502	21%	0.205	S	C	.	.			trans	-113.8	154.9	-174.4	-59.1	-178.8	179.2	-177.3	-1.1	112.2	D152 G153 Q174	R150-D152 WeakPolarHBondContact CB-OD1 3.43Å; R150-D152 PolarHBondContact O-N 2.95Å; R150-G153 PolarHBondContact O-N 3.1Å; R150-Q174 VanDerWaalsContact CA-OE1 3.3Å
151	G	76.6	Confident	91.9	Very high	31 Å²	31	39.4 Å²	39.4	32%	0.32	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.8	177.9	0	0	0	0	0	115.4
152	D	83.1	Confident	92	Very high	86 Å²	86	41 Å²	41	46%	0.46	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.2	178.6	61.8	-47.7	0	0	0	114.1	G127 R150 F154	G127-D152 WeakPolarHBondContact CA-O 3.4Å; G127-D152 PolarHBondContact N-O 3.24Å; G127-D152 VanDerWaalsContact N-O 3.07Å; R150-D152 WeakPolarHBondContact CB-OD1 3.43Å; R150-D152 PolarHBondContact O-N 2.95Å; D152-F154 PolarHBondContact O-N 3.28Å
153	G	87.3	Confident	91.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.01	23%	0.225	C	C	.	.	S	Bend	trans	-68.7	-30.1	-173.4	0	0	0	0	0	114.8	I125 T130 R150	I125-G153 WeakPolarHBondContact CG2-O 3.49Å; T130-G153 WeakPolarHBondContact CG2-O 2.97Å; T130-G153 PolarHBondContact OG1-O 2.79Å; R150-G153 PolarHBondContact O-N 3.1Å
154	F	93.4	Very high	92	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.013	22%	0.221	C	C	.	.	S	Bend	trans	-130.6	88.9	-177.4	-66.3	-75.3	0	0	0	110.7	I125 L139 D152 L158 I160 L163 L178 H180 L181	I125-F154 HydrophobicContact CD1-CE2 3.74Å; I125-F154 HydrophobicContact CD1-CZ 3.61Å; I125-F154 HydrophobicContact CG2-CE1 4.36Å; I125-F154 HydrophobicContact CG2-CE2 4.3Å; I125-F154 HydrophobicContact CG2-CZ 4.09Å; L139-F154 HydrophobicContact CD2-CE1 4.24Å; D152-F154 PolarHBondContact O-N 3.28Å; F154-L158 HydrophobicContact CD1-CD1 4.29Å; F154-I160 HydrophobicContact CD1-CD1 4.19Å; F154-I160 HydrophobicContact CE1-CD1 4.17Å; F154-L163 HydrophobicContact CE1-CD1 4.15Å; F154-L163 HydrophobicContact CE1-CD2 4.05Å; F154-L163 HydrophobicContact CE2-CD2 4.06Å; F154-L163 HydrophobicContact CZ-CD1 3.93Å; F154-L163 HydrophobicContact CZ-CD2 3.62Å; F154-L163 HydrophobicContact CZ-CG 4.43Å; F154-L178 HydrophobicContact CD2-CD2 3.64Å; F154-L178 HydrophobicContact CE2-CD2 3.74Å; F154-L178 HydrophobicContact CG-CD2 4.47Å; F154-H180 WeakPolarHBondContact O-CB 3.22Å; F154-H180 PolarHBondContact O-CD2 2.83Å; F154-L181 HydrophobicContact CB-CD1 4.17Å; F154-L181 HydrophobicContact CB-CD2 4.29Å; F154-L181 HydrophobicContact CB-CG 4.17Å; F154-L181 HydrophobicContact CD1-CD1 3.96Å; F154-L181 HydrophobicContact CE1-CD1 4.48Å; F154-L181 HydrophobicContact CG-CD1 3.96Å
155	P	91.2	Very high	92	Very high	28 Å²	28	39.8 Å²	39.8	18%	0.182	22%	0.22	C	C	.	.			trans	-69	165.4	179	28.1	-35.3	0	0	0	113	T130 L158	T130-P155 WeakPolarHBondContact OG1-CD 3.42Å; P155-L158 HydrophobicContact CG-CD1 4.38Å
156	S	90.8	Very high	92	Very high	93 Å²	93	38.4 Å²	38.4	65%	0.65	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	135	177	57.5	0	0	0	0	113
157	G	89.3	Confident	92.1	Very high	47 Å²	47	41.5 Å²	41.5	49%	0.485	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	121.5	-17.7	171.9	0	0	0	0	0	114.6	Q159	G157-Q159 PolarHBondContact O-NE2 3.16Å
158	L	93.3	Very high	92.4	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	22%	0.215	C	C	.	.			trans	-67.1	137	-178	-51.7	179.5	0	0	0	112.4	T130 F154 P155 I160 L181 T184	T130-L158 WeakPolarHBondContact O-CD2 3.47Å; F154-L158 HydrophobicContact CD1-CD1 4.29Å; P155-L158 HydrophobicContact CG-CD1 4.38Å; L158-I160 VanDerWaalsContact C-N 3.32Å; L158-I160 HydrophobicContact CB-CD1 4.29Å; L158-I160 HydrophobicContact CB-CG1 4.22Å; L158-I160 HydrophobicContact CD1-CD1 4.07Å; L158-I160 PolarHBondContact O-N 3.11Å; L158-L181 HydrophobicContact CB-CD2 3.98Å; L158-L181 HydrophobicContact CD1-CD2 4.27Å; L158-T184 PolarHBondContact O-OG1 3.02Å
159	Q	95	Very high	92.9	Very high	86 Å²	86	40.5 Å²	40.5	40%	0.402	22%	0.219	S	C	.	.			trans	-89	14.8	-179.9	-60.5	-50.2	-65.1	0	0	114.9	V134 V136 E137 G157 R161	V134-Q159 WeakPolarHBondContact O-CG 2.99Å; V134-Q159 PolarHBondContact O-N 2.71Å; V136-Q159 CarbonylContact O-C 3.59Å; V136-Q159 VanDerWaalsContact O-C 3.29Å; E137-Q159 HydrophobicContact CG-CB 4.44Å; G157-Q159 PolarHBondContact O-NE2 3.16Å; Q159-R161 WeakPolarHBondContact O-CG 3.49Å; Q159-R161 PolarHBondContact O-N 2.91Å; Q159-R161 VanDerWaalsContact O-N 3.15Å
160	I	97.2	Very high	93.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.218	C	C	.	.			trans	-57.3	118.5	-174.7	-56	170.1	0	0	0	111.2	V136 L139 F154 L158 L163 L181 T184 L185	V136-I160 VanDerWaalsContact O-CA 3.24Å; V136-I160 WeakPolarHBondContact O-CA 3.35Å; V136-I160 VanDerWaalsContact O-CG1 3.31Å; V136-I160 WeakPolarHBondContact O-CG1 3.45Å; V136-I160 PolarHBondContact O-N 3.23Å; L139-I160 HydrophobicContact CB-CD1 4.5Å; L139-I160 HydrophobicContact CB-CG2 4.48Å; L139-I160 HydrophobicContact CD2-CD1 3.91Å; F154-I160 HydrophobicContact CD1-CD1 4.19Å; F154-I160 HydrophobicContact CE1-CD1 4.17Å; L158-I160 VanDerWaalsContact C-N 3.32Å; L158-I160 HydrophobicContact CB-CD1 4.29Å; L158-I160 HydrophobicContact CB-CG1 4.22Å; L158-I160 HydrophobicContact CD1-CD1 4.07Å; L158-I160 PolarHBondContact O-N 3.11Å; I160-L163 HydrophobicContact CG2-CB 4.07Å; I160-L181 HydrophobicContact CB-CD2 4.46Å; I160-L181 HydrophobicContact CD1-CD2 4.4Å; I160-T184 CarbonylContact O-C 3.53Å; I160-T184 WeakPolarHBondContact O-CB 3.4Å; I160-T184 PolarHBondContact O-OG1 2.88Å; I160-L185 HydrophobicContact CG2-CD1 3.88Å; I160-L185 WeakPolarHBondContact O-CA 3.39Å; I160-L185 PolarHBondContact O-N 2.86Å
161	R	98.1	Very high	93.8	Very high	108 Å²	108	36.3 Å²	36.3	41%	0.408	21%	0.211	S	C	.	.			trans	-98.2	-40.8	174	-55.9	-174.2	-174	-166.4	14.1	111.3	E137 Q159 L185 Q186 V187	E137-R161 HydrophobicContact CB-CG 4.15Å; E137-R161 HydrophobicContact CG-CG 4.46Å; E137-R161 PolarHBondContact O-N 3.18Å; E137-R161 IonicContact OE1-CZ 2.71Å; E137-R161 IonicContact OE1-NE 3.22Å; E137-R161 PolarHBondContact OE1-NE 2.85Å; E137-R161 IonicContact OE1-NH2 2.82Å; E137-R161 PolarHBondContact OE1-NH2 2.78Å; E137-R161 IonicContact OE2-CZ 2.69Å; E137-R161 VanDerWaalsContact OE2-CZ 3.25Å; E137-R161 IonicContact OE2-NE 3.41Å; E137-R161 PolarHBondContact OE2-NE 3.3Å; E137-R161 VanDerWaalsContact OE2-NE 3.09Å; E137-R161 IonicContact OE2-NH2 3.71Å; E137-R161 PolarHBondContact OE2-NH2 3.26Å; Q159-R161 WeakPolarHBondContact O-CG 3.49Å; Q159-R161 PolarHBondContact O-N 2.91Å; Q159-R161 VanDerWaalsContact O-N 3.15Å; R161-L185 WeakPolarHBondContact O-CD1 3.31Å; R161-Q186 HydrophobicContact CB-CG 4.45Å; R161-Q186 PolarHBondContact O-N 3.08Å; R161-V187 PolarHBondContact O-N 2.83Å
162	D	98.6	Very high	94.2	Very high	33 Å²	33	38.3 Å²	38.3	18%	0.176	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	112.5	-175.6	-87	33.3	0	0	0	110.3	E137 T138 L139 Y164 V187	E137-D162 PolarHBondContact O-N 2.95Å; T138-D162 HydrophobicContact CG2-CB 4.19Å; L139-D162 PolarHBondContact N-O 2.87Å; D162-Y164 HydrophobicContact CB-CE1 4.01Å; D162-Y164 PolarHBondContact OD2-OH 2.84Å; D162-V187 WeakPolarHBondContact OD1-CB 3.38Å; D162-V187 WeakPolarHBondContact OD1-CG2 3.17Å
163	L	98.4	Very high	94.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	111.1	-179.6	-179.2	57	0	0	0	111	L139 F154 I160 L165 L178 L181 L185 V187 L188 R189	L139-L163 HydrophobicContact CB-CD1 4.23Å; L139-L163 HydrophobicContact CD2-CD1 4.11Å; L139-L163 HydrophobicContact CG-CD1 4.22Å; F154-L163 HydrophobicContact CE1-CD1 4.15Å; F154-L163 HydrophobicContact CE1-CD2 4.05Å; F154-L163 HydrophobicContact CE2-CD2 4.06Å; F154-L163 HydrophobicContact CZ-CD1 3.93Å; F154-L163 HydrophobicContact CZ-CD2 3.62Å; F154-L163 HydrophobicContact CZ-CG 4.43Å; I160-L163 HydrophobicContact CG2-CB 4.07Å; L163-L165 HydrophobicContact CD1-CD1 4.22Å; L163-L165 HydrophobicContact CD1-CG 4.14Å; L163-L165 HydrophobicContact CD2-CD1 3.84Å; L163-L165 HydrophobicContact CG-CD1 3.83Å; L163-L165 HydrophobicContact CG-CG 4.1Å; L163-L178 HydrophobicContact CD2-CD2 3.96Å; L163-L181 HydrophobicContact CD2-CD1 4.02Å; L163-L185 HydrophobicContact CB-CD1 3.72Å; L163-V187 PolarHBondContact N-O 2.86Å; L163-L188 HydrophobicContact CB-CD1 4.2Å; L163-L188 HydrophobicContact CD2-CD1 4.05Å; L163-L188 HydrophobicContact CG-CD1 4.13Å; L163-R189 PolarHBondContact O-N 2.79Å
164	Y	98.7	Very high	94.3	Very high	30 Å²	30	40.2 Å²	40.2	12%	0.118	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114	-179.8	-51.6	-25.3	0	0	0	110.2	L139 D140 L141 S142 D162 V187 R189	L139-Y164 PolarHBondContact O-N 2.85Å; D140-Y164 HydrophobicContact CB-CD2 4.08Å; L141-Y164 CarbonylContact C-O 3.22Å; L141-Y164 WeakPolarHBondContact CA-O 3.33Å; L141-Y164 PolarHBondContact N-O 2.79Å; S142-Y164 PolarHBondContact N-O 2.91Å; D162-Y164 HydrophobicContact CB-CE1 4.01Å; D162-Y164 PolarHBondContact OD2-OH 2.84Å; Y164-V187 HydrophobicContact CE1-CG1 3.99Å; Y164-R189 HydrophobicContact CD1-CB 4.04Å; Y164-R189 HydrophobicContact CD1-CG 3.68Å; Y164-R189 HydrophobicContact CE1-CG 4.07Å; Y164-R189 VanDerWaalsContact CE1-CZ 3.45Å; Y164-R189 VanDerWaalsContact CZ-NH1 3.3Å; Y164-R189 PolarHBondContact OH-NH2 2.86Å
165	L	98.1	Very high	94	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.249	C	C	.	.			trans	-123.2	21.8	-177.7	-74.8	165.2	0	0	0	111.2	I125 L141 I146 L149 L163 N168 I170 L188 R189 L190 N193	I125-L165 HydrophobicContact CD1-CD2 3.76Å; L141-L165 HydrophobicContact CB-CD2 3.81Å; L141-L165 HydrophobicContact CD1-CD2 4.13Å; I146-L165 HydrophobicContact CD1-CD2 4Å; L149-L165 HydrophobicContact CD1-CD1 3.97Å; L149-L165 HydrophobicContact CD2-CD1 3.96Å; L149-L165 HydrophobicContact CD2-CD2 4.48Å; L163-L165 HydrophobicContact CD1-CD1 4.22Å; L163-L165 HydrophobicContact CD1-CG 4.14Å; L163-L165 HydrophobicContact CD2-CD1 3.84Å; L163-L165 HydrophobicContact CG-CD1 3.83Å; L163-L165 HydrophobicContact CG-CG 4.1Å; L165-N168 PolarHBondContact O-ND2 3.01Å; L165-I170 HydrophobicContact CB-CD1 4.04Å; L165-L188 HydrophobicContact CD1-CD1 4.43Å; L165-R189 CarbonylContact C-O 3.1Å; L165-R189 VanDerWaalsContact C-O 3.3Å; L165-R189 WeakPolarHBondContact CA-O 3.35Å; L165-R189 PolarHBondContact N-O 3.4Å; L165-L190 HydrophobicContact CB-CD2 3.8Å; L165-L190 HydrophobicContact CD1-CD2 4.03Å; L165-N193 PolarHBondContact O-ND2 2.91Å
166	S	98.4	Very high	93.8	Very high	18 Å²	18	44.9 Å²	44.9	13%	0.126	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	152.8	-170.7	-66.1	0	0	0	0	112.8	S142 N143 N168 R189 S191	S142-S166 CarbonylContact C-O 3.29Å; S142-S166 WeakPolarHBondContact CA-O 3.43Å; S142-S166 WeakPolarHBondContact CB-O 3.36Å; N143-S166 PolarHBondContact N-O 3.47Å; S166-N168 VanDerWaalsContact C-N 3.29Å; S166-N168 PolarHBondContact O-N 3.43Å; S166-N168 PolarHBondContact O-ND2 2.93Å; S166-R189 PolarHBondContact N-O 2.69Å; S166-R189 VanDerWaalsContact N-O 3.07Å; S166-R189 VanDerWaalsContact OG-C 3.29Å; S166-R189 WeakPolarHBondContact OG-CB 3.36Å; S166-R189 PolarHBondContact OG-O 2.84Å; S166-S191 CarbonylContact C-O 3.59Å; S166-S191 WeakPolarHBondContact CA-O 3.2Å; S166-S191 VanDerWaalsContact CB-O 3.31Å; S166-S191 WeakPolarHBondContact CB-O 3.46Å; S166-S191 WeakPolarHBondContact OG-CB 3.33Å; S166-S191 PolarHBondContact OG-N 2.86Å
167	N	98.3	Very high	93.7	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	40.9	-179.9	-153.5	56.4	0	0	0	113	N143 S191 R192	N143-N167 WeakPolarHBondContact CA-O 3.43Å; N143-N167 VanDerWaalsContact OD1-CB 3.3Å; N143-N167 WeakPolarHBondContact OD1-CB 3.26Å; N143-N167 PolarHBondContact OD1-ND2 2.91Å; N167-S191 PolarHBondContact N-O 3.18Å; N167-R192 WeakPolarHBondContact CA-O 3.46Å; N167-R192 HydrophobicContact CB-CB 4.12Å; N167-R192 WeakPolarHBondContact OD1-CD 3.46Å
168	N	98.1	Very high	93.9	Very high	10 Å²	10	39 Å²	39	5%	0.053	20%	0.202	C	C	.	.	S	Bend	trans	-104.8	-168.8	172.2	-86.2	-82.7	0	0	0	110.2	L141 N144 D145 I146 L165 S166 I170 N193	L141-N168 PolarHBondContact O-ND2 2.97Å; N144-N168 VanDerWaalsContact CA-OD1 3.31Å; N144-N168 WeakPolarHBondContact CA-OD1 3.29Å; N144-N168 WeakPolarHBondContact CB-OD1 3.19Å; N144-N168 PolarHBondContact N-OD1 2.88Å; N144-N168 WeakPolarHBondContact O-CA 3.34Å; N144-N168 PolarHBondContact O-OD1 3.27Å; N144-N168 VanDerWaalsContact O-OD1 3.07Å; D145-N168 PolarHBondContact N-OD1 2.8Å; I146-N168 HydrophobicContact CB-CB 4.27Å; I146-N168 VanDerWaalsContact CB-OD1 3.3Å; I146-N168 WeakPolarHBondContact CB-OD1 3.24Å; I146-N168 WeakPolarHBondContact CG1-OD1 3.49Å; I146-N168 PolarHBondContact N-OD1 2.76Å; L165-N168 PolarHBondContact O-ND2 3.01Å; S166-N168 VanDerWaalsContact C-N 3.29Å; S166-N168 PolarHBondContact O-N 3.43Å; S166-N168 PolarHBondContact O-ND2 2.93Å; N168-I170 HydrophobicContact CB-CD1 4.22Å; N168-I170 HydrophobicContact CB-CG1 4.01Å; N168-N193 VanDerWaalsContact CA-OD1 3.27Å; N168-N193 WeakPolarHBondContact CA-OD1 3.33Å; N168-N193 WeakPolarHBondContact CB-OD1 3.48Å; N168-N193 PolarHBondContact N-OD1 3.13Å; N168-N193 PolarHBondContact O-OD1 3.48Å
169	K	96.9	Very high	93.8	Very high	70 Å²	70	41.4 Å²	41.4	30%	0.304	22%	0.215	S	C	.	.			trans	-102.1	13.2	178.1	-67.3	168.9	177.9	170	0	112.4	D145 I146 T147 S171	D145-K169 HydrophobicContact CB-CD 4.45Å; D145-K169 WeakPolarHBondContact OD1-CE 3.34Å; D145-K169 IonicContact OD1-NZ 3.97Å; D145-K169 PolarHBondContact OD1-NZ 2.7Å; D145-K169 IonicContact OD2-NZ 2.78Å; D145-K169 PolarHBondContact OD2-NZ 3.12Å; I146-K169 CarbonylContact O-C 3.44Å; I146-K169 VanDerWaalsContact O-CA 3.25Å; I146-K169 WeakPolarHBondContact O-CA 3.47Å; I146-K169 WeakPolarHBondContact O-CB 3.44Å; I146-K169 PolarHBondContact O-N 2.77Å; T147-K169 HydrophobicContact CG2-CB 4.36Å; K169-S171 PolarHBondContact O-N 2.64Å; K169-S171 VanDerWaalsContact O-N 3.16Å
170	I	95.9	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.			trans	-57.3	116.6	-168.5	-59.2	169.3	0	0	0	110.6	I146 T147 L149 L165 N168 T172 L173 L190 N193 R194 I195	I146-I170 HydrophobicContact CB-CG1 4.48Å; I146-I170 HydrophobicContact CG2-CG1 4.22Å; I146-I170 WeakPolarHBondContact O-CG1 3.25Å; I146-I170 PolarHBondContact O-N 2.68Å; T147-I170 CarbonylContact O-C 3.43Å; T147-I170 WeakPolarHBondContact O-CA 3.16Å; L149-I170 HydrophobicContact CD1-CD1 4.37Å; L149-I170 HydrophobicContact CD2-CD1 4.01Å; L149-I170 HydrophobicContact CG-CD1 4.11Å; L149-I170 HydrophobicContact CG-CG2 4.27Å; L165-I170 HydrophobicContact CB-CD1 4.04Å; N168-I170 HydrophobicContact CB-CD1 4.22Å; N168-I170 HydrophobicContact CB-CG1 4.01Å; I170-T172 WeakPolarHBondContact CG2-O 3.22Å; I170-L173 HydrophobicContact CG2-CD2 4.28Å; I170-L190 HydrophobicContact CD1-CD2 3.92Å; I170-N193 HydrophobicContact CB-CB 4.08Å; I170-N193 VanDerWaalsContact CB-OD1 3.29Å; I170-N193 WeakPolarHBondContact CB-OD1 3.41Å; I170-N193 WeakPolarHBondContact CG1-OD1 3.22Å; I170-N193 PolarHBondContact N-OD1 2.93Å; I170-R194 CarbonylContact O-C 3.54Å; I170-R194 VanDerWaalsContact O-CA 3.29Å; I170-R194 WeakPolarHBondContact O-CA 3.48Å; I170-R194 WeakPolarHBondContact O-CB 3.4Å; I170-R194 PolarHBondContact O-N 3.21Å; I170-I195 HydrophobicContact CG2-CD1 4.44Å; I170-I195 HydrophobicContact CG2-CG1 4.19Å; I170-I195 PolarHBondContact O-N 2.8Å
171	S	92.4	Very high	93.5	Very high	50 Å²	50	42 Å²	42	35%	0.35	22%	0.218	S	C	.	.			trans	-107.3	-36.6	-176.1	76.6	0	0	0	0	113	T147 D148 K169	T147-S171 PolarHBondContact O-N 3.29Å; D148-S171 PolarHBondContact OD1-OG 2.14Å; K169-S171 PolarHBondContact O-N 2.64Å; K169-S171 VanDerWaalsContact O-N 3.16Å
172	T	85.3	Confident	93.3	Very high	73 Å²	73	37.1 Å²	37.1	45%	0.448	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	148.3	177.7	68.8	0	0	0	0	111.9	D148 I170	D148-T172 PolarHBondContact OD1-OG1 2.95Å; I170-T172 WeakPolarHBondContact CG2-O 3.22Å
173	L	86.6	Confident	93.1	Very high	20 Å²	20	39.1 Å²	39.1	11%	0.105	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	104.1	166.1	-63.7	178.9	0	0	0	107.2	L149 I170 L175 L190 I195 I198 F203	L149-L173 HydrophobicContact CD1-CD2 3.91Å; I170-L173 HydrophobicContact CG2-CD2 4.28Å; L173-L175 PolarHBondContact O-N 3.02Å; L173-L190 HydrophobicContact CD2-CD1 4.18Å; L173-I195 HydrophobicContact CD1-CD1 4.19Å; L173-I195 HydrophobicContact CD1-CG2 4.18Å; L173-I195 HydrophobicContact CD2-CD1 4.05Å; L173-I195 HydrophobicContact CG-CD1 4.19Å; L173-I195 HydrophobicContact CG-CG1 4.43Å; L173-I195 HydrophobicContact CG-CG2 4.33Å; L173-I198 HydrophobicContact CD1-CG2 4.48Å; L173-F203 HydrophobicContact CD1-CE1 4.46Å; L173-F203 HydrophobicContact CD1-CZ 4.11Å
174	Q	86.6	Confident	93	Very high	106 Å²	106	39.7 Å²	39.7	50%	0.495	22%	0.221	S	C	.	.			trans	-68.6	131.9	174.3	-175.1	-178.1	2.1	0	0	109.5	L149 R150 G176 A177	L149-Q174 VanDerWaalsContact O-CB 3.29Å; L149-Q174 WeakPolarHBondContact O-CB 3.28Å; L149-Q174 PolarHBondContact O-N 3.15Å; R150-Q174 VanDerWaalsContact CA-OE1 3.3Å; Q174-G176 PolarHBondContact O-N 3.25Å; Q174-A177 HydrophobicContact CB-CB 4.22Å; Q174-A177 WeakPolarHBondContact O-CB 3.19Å; Q174-A177 PolarHBondContact O-N 3.19Å; Q174-A177 VanDerWaalsContact O-N 3.1Å
175	L	87.2	Confident	93	Very high	108 Å²	108	38.2 Å²	38.2	57%	0.565	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	128.5	174.4	-175.2	66.7	0	0	0	109.9	L173 R201	L173-L175 PolarHBondContact O-N 3.02Å; L175-R201 WeakPolarHBondContact CD1-O 3.39Å
176	G	85.8	Confident	93	Very high	21 Å²	21	41.6 Å²	41.6	22%	0.216	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-7.6	-178.5	0	0	0	0	0	116.1	Q174 L178 D179	Q174-G176 PolarHBondContact O-N 3.25Å; G176-L178 PolarHBondContact O-N 3.44Å; G176-D179 WeakPolarHBondContact CA-OD2 3.02Å; G176-D179 PolarHBondContact O-N 3.47Å; G176-D179 VanDerWaalsContact O-N 3.12Å
177	A	89.2	Confident	93	Very high	7 Å²	7	41.5 Å²	41.5	6%	0.058	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-7.2	-173.5	0	0	0	0	0	116.4	L149 Q174	L149-A177 HydrophobicContact CB-CB 4.19Å; Q174-A177 HydrophobicContact CB-CB 4.22Å; Q174-A177 WeakPolarHBondContact O-CB 3.19Å; Q174-A177 PolarHBondContact O-N 3.19Å; Q174-A177 VanDerWaalsContact O-N 3.1Å
178	L	93.2	Very high	93	Very high	10 Å²	10	38.4 Å²	38.4	5%	0.052	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-1.7	177.5	-62.1	172.2	0	0	0	112.9	L149 F154 L163 G176 H180 L181 L188 L205	L149-L178 HydrophobicContact CD1-CD1 4.49Å; F154-L178 HydrophobicContact CD2-CD2 3.64Å; F154-L178 HydrophobicContact CE2-CD2 3.74Å; F154-L178 HydrophobicContact CG-CD2 4.47Å; L163-L178 HydrophobicContact CD2-CD2 3.96Å; G176-L178 PolarHBondContact O-N 3.44Å; L178-H180 PolarHBondContact O-N 2.95Å; L178-L181 HydrophobicContact CD2-CD1 4.19Å; L178-L181 WeakPolarHBondContact O-CB 3.18Å; L178-L181 PolarHBondContact O-N 3.05Å; L178-L188 HydrophobicContact CD1-CD1 4.32Å; L178-L188 HydrophobicContact CD1-CD2 3.54Å; L178-L205 HydrophobicContact CB-CD1 4.45Å; L178-L205 HydrophobicContact CB-CD2 4.25Å; L178-L205 VanDerWaalsContact O-CD2 3.31Å; L178-L205 WeakPolarHBondContact O-CD2 3.48Å
179	D	91.5	Very high	93	Very high	54 Å²	54	41.6 Å²	41.6	29%	0.289	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-65.4	-27.7	-168.4	-73.6	-0.2	0	0	0	112.6	G176 L181 G182 Q204	G176-D179 WeakPolarHBondContact CA-OD2 3.02Å; G176-D179 PolarHBondContact O-N 3.47Å; G176-D179 VanDerWaalsContact O-N 3.12Å; D179-L181 PolarHBondContact O-N 2.84Å; D179-G182 PolarHBondContact O-N 2.87Å; D179-Q204 HydrophobicContact CB-CB 4.21Å; D179-Q204 WeakPolarHBondContact OD1-CB 3.48Å; D179-Q204 PolarHBondContact OD1-N 3.37Å; D179-Q204 WeakPolarHBondContact OD2-CG 3.35Å
180	H	92.3	Very high	93.1	Very high	99 Å²	99	38.2 Å²	38.2	46%	0.458	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-62.6	-18.6	171.8	-70.9	-46.6	0	0	0	114.2	F154 L178	F154-H180 WeakPolarHBondContact O-CB 3.22Å; F154-H180 PolarHBondContact O-CD2 2.83Å; L178-H180 PolarHBondContact O-N 2.95Å
181	L	94.8	Very high	93.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-93	-0.3	174.3	-51.2	179.3	0	0	0	112.7	F154 L158 I160 L163 L178 D179 S183 T184 L185	F154-L181 HydrophobicContact CB-CD1 4.17Å; F154-L181 HydrophobicContact CB-CD2 4.29Å; F154-L181 HydrophobicContact CB-CG 4.17Å; F154-L181 HydrophobicContact CD1-CD1 3.96Å; F154-L181 HydrophobicContact CE1-CD1 4.48Å; F154-L181 HydrophobicContact CG-CD1 3.96Å; L158-L181 HydrophobicContact CB-CD2 3.98Å; L158-L181 HydrophobicContact CD1-CD2 4.27Å; I160-L181 HydrophobicContact CB-CD2 4.46Å; I160-L181 HydrophobicContact CD1-CD2 4.4Å; L163-L181 HydrophobicContact CD2-CD1 4.02Å; L178-L181 HydrophobicContact CD2-CD1 4.19Å; L178-L181 WeakPolarHBondContact O-CB 3.18Å; L178-L181 PolarHBondContact O-N 3.05Å; D179-L181 PolarHBondContact O-N 2.84Å; L181-S183 PolarHBondContact O-N 3.15Å; L181-S183 VanDerWaalsContact O-N 3.09Å; L181-T184 PolarHBondContact O-N 2.82Å; L181-T184 PolarHBondContact O-OG1 3.14Å; L181-L185 HydrophobicContact CB-CB 4.04Å; L181-L185 HydrophobicContact CB-CD2 4.41Å; L181-L185 HydrophobicContact CD1-CD1 4.46Å; L181-L185 HydrophobicContact CD1-CD2 4.38Å; L181-L185 WeakPolarHBondContact O-CB 3.43Å; L181-L185 PolarHBondContact O-N 2.84Å
182	G	93.2	Very high	93.5	Very high	5 Å²	5	42 Å²	42	5%	0.052	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.3	-173	0	0	0	0	0	115.4	D179 Q204 P206	D179-G182 PolarHBondContact O-N 2.87Å; G182-Q204 WeakPolarHBondContact CA-O 3.32Å; G182-P206 WeakPolarHBondContact O-CD 3.45Å
183	S	94.3	Very high	94.1	Very high	75 Å²	75	39 Å²	39	52%	0.524	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-10.6	174.6	55.8	0	0	0	0	114	L181 R207	L181-S183 PolarHBondContact O-N 3.15Å; L181-S183 VanDerWaalsContact O-N 3.09Å; S183-R207 VanDerWaalsContact O-CD 3.27Å; S183-R207 WeakPolarHBondContact O-CD 3.47Å; S183-R207 PolarHBondContact O-NE 2.7Å; S183-R207 PolarHBondContact O-NH1 2.85Å
184	T	96.5	Very high	94.6	Very high	12 Å²	12	43.8 Å²	43.8	7%	0.074	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-39	-168.9	44.7	0	0	0	0	113.3	L158 I160 L181	L158-T184 PolarHBondContact O-OG1 3.02Å; I160-T184 CarbonylContact O-C 3.53Å; I160-T184 WeakPolarHBondContact O-CB 3.4Å; I160-T184 PolarHBondContact O-OG1 2.88Å; L181-T184 PolarHBondContact O-N 2.82Å; L181-T184 PolarHBondContact O-OG1 3.14Å
185	L	98.1	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.			trans	-67.5	131.2	-171	-158.6	70.5	0	0	0	113.5	I160 R161 L163 L181 L188 L205 R207 L208	I160-L185 HydrophobicContact CG2-CD1 3.88Å; I160-L185 WeakPolarHBondContact O-CA 3.39Å; I160-L185 PolarHBondContact O-N 2.86Å; R161-L185 WeakPolarHBondContact O-CD1 3.31Å; L163-L185 HydrophobicContact CB-CD1 3.72Å; L181-L185 HydrophobicContact CB-CB 4.04Å; L181-L185 HydrophobicContact CB-CD2 4.41Å; L181-L185 HydrophobicContact CD1-CD1 4.46Å; L181-L185 HydrophobicContact CD1-CD2 4.38Å; L181-L185 WeakPolarHBondContact O-CB 3.43Å; L181-L185 PolarHBondContact O-N 2.84Å; L185-L188 HydrophobicContact CD2-CB 4.24Å; L185-L188 HydrophobicContact CD2-CD2 4.48Å; L185-L205 HydrophobicContact CD2-CD1 4.08Å; L185-L205 HydrophobicContact CD2-CD2 4.3Å; L185-R207 CarbonylContact O-C 3.51Å; L185-R207 VanDerWaalsContact O-C 3.25Å; L185-L208 HydrophobicContact CB-CD1 4.41Å; L185-L208 HydrophobicContact CD2-CD1 4Å; L185-L208 HydrophobicContact CG-CD1 3.89Å; L185-L208 WeakPolarHBondContact O-CA 3.42Å; L185-L208 PolarHBondContact O-N 3.35Å
186	Q	98.3	Very high	95.3	Very high	70 Å²	70	36.2 Å²	36.2	33%	0.327	18%	0.183	S	C	.	.			trans	-119.1	-42.3	-178.6	-56.7	-171.9	25.5	0	0	111.6	R161 L208 T209 Q210	R161-Q186 HydrophobicContact CB-CG 4.45Å; R161-Q186 PolarHBondContact O-N 3.08Å; Q186-L208 WeakPolarHBondContact O-CD1 3.37Å; Q186-T209 PolarHBondContact O-N 3.32Å; Q186-T209 PolarHBondContact O-OG1 2.79Å; Q186-T209 VanDerWaalsContact O-OG1 3.14Å; Q186-Q210 PolarHBondContact O-N 2.83Å; Q186-Q210 VanDerWaalsContact O-N 3.09Å
187	V	98.8	Very high	95.5	Very high	17 Å²	17	41.5 Å²	41.5	10%	0.103	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.4	179.5	-173.6	0	0	0	0	111.1	R161 D162 L163 Y164 R189 Q210	R161-V187 PolarHBondContact O-N 2.83Å; D162-V187 WeakPolarHBondContact OD1-CB 3.38Å; D162-V187 WeakPolarHBondContact OD1-CG2 3.17Å; L163-V187 PolarHBondContact N-O 2.86Å; Y164-V187 HydrophobicContact CE1-CG1 3.99Å; V187-R189 HydrophobicContact CG1-CG 4.08Å; V187-Q210 HydrophobicContact CG1-CB 4.31Å; V187-Q210 HydrophobicContact CG1-CG 4.39Å; V187-Q210 HydrophobicContact CG2-CB 4.4Å
188	L	98.6	Very high	95.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.2	175.7	177.8	58.1	0	0	0	110.4	L163 L165 L178 L185 L190 F203 L205 L208 Q210 L211 E212	L163-L188 HydrophobicContact CB-CD1 4.2Å; L163-L188 HydrophobicContact CD2-CD1 4.05Å; L163-L188 HydrophobicContact CG-CD1 4.13Å; L165-L188 HydrophobicContact CD1-CD1 4.43Å; L178-L188 HydrophobicContact CD1-CD1 4.32Å; L178-L188 HydrophobicContact CD1-CD2 3.54Å; L185-L188 HydrophobicContact CD2-CB 4.24Å; L185-L188 HydrophobicContact CD2-CD2 4.48Å; L188-L190 HydrophobicContact CD1-CD1 4.44Å; L188-L190 HydrophobicContact CD1-CG 4.2Å; L188-L190 HydrophobicContact CD2-CD1 4.05Å; L188-L190 HydrophobicContact CG-CD1 4.15Å; L188-L190 HydrophobicContact CG-CG 4.21Å; L188-F203 HydrophobicContact CD2-CE1 4.3Å; L188-L205 HydrophobicContact CD2-CD1 4.17Å; L188-L208 HydrophobicContact CB-CD1 3.84Å; L188-L208 HydrophobicContact CB-CD2 4.35Å; L188-Q210 PolarHBondContact N-O 2.84Å; L188-L211 HydrophobicContact CB-CD1 4.09Å; L188-L211 HydrophobicContact CD2-CD1 3.85Å; L188-L211 HydrophobicContact CG-CD1 3.97Å; L188-E212 PolarHBondContact O-N 3.19Å
189	R	98.6	Very high	95.4	Very high	76 Å²	76	43.6 Å²	43.6	29%	0.287	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	96.4	-179.5	-56.2	-170.3	-173.3	142.4	6.1	112.6	L163 Y164 L165 S166 V187 E212	L163-R189 PolarHBondContact O-N 2.79Å; Y164-R189 HydrophobicContact CD1-CB 4.04Å; Y164-R189 HydrophobicContact CD1-CG 3.68Å; Y164-R189 HydrophobicContact CE1-CG 4.07Å; Y164-R189 VanDerWaalsContact CE1-CZ 3.45Å; Y164-R189 VanDerWaalsContact CZ-NH1 3.3Å; Y164-R189 PolarHBondContact OH-NH2 2.86Å; L165-R189 CarbonylContact C-O 3.1Å; L165-R189 VanDerWaalsContact C-O 3.3Å; L165-R189 WeakPolarHBondContact CA-O 3.35Å; L165-R189 PolarHBondContact N-O 3.4Å; S166-R189 PolarHBondContact N-O 2.69Å; S166-R189 VanDerWaalsContact N-O 3.07Å; S166-R189 VanDerWaalsContact OG-C 3.29Å; S166-R189 WeakPolarHBondContact OG-CB 3.36Å; S166-R189 PolarHBondContact OG-O 2.84Å; V187-R189 HydrophobicContact CG1-CG 4.08Å; R189-E212 HydrophobicContact CB-CB 4.43Å; R189-E212 WeakPolarHBondContact CD-OE2 3.48Å; R189-E212 HydrophobicContact CG-CB 4.44Å; R189-E212 HydrophobicContact CG-CG 4.01Å
190	L	98	Very high	95.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.221	C	C	.	.			trans	-98.6	17.5	173.9	-66.7	164.1	0	0	0	112.7	L149 L165 I170 L173 L188 N193 I195 E212 L213 N216	L149-L190 HydrophobicContact CD1-CD2 3.94Å; L165-L190 HydrophobicContact CB-CD2 3.8Å; L165-L190 HydrophobicContact CD1-CD2 4.03Å; I170-L190 HydrophobicContact CD1-CD2 3.92Å; L173-L190 HydrophobicContact CD2-CD1 4.18Å; L188-L190 HydrophobicContact CD1-CD1 4.44Å; L188-L190 HydrophobicContact CD1-CG 4.2Å; L188-L190 HydrophobicContact CD2-CD1 4.05Å; L188-L190 HydrophobicContact CG-CD1 4.15Å; L188-L190 HydrophobicContact CG-CG 4.21Å; L190-N193 PolarHBondContact O-ND2 3.46Å; L190-I195 HydrophobicContact CB-CD1 4.14Å; L190-I195 HydrophobicContact CD1-CD1 4.44Å; L190-E212 CarbonylContact C-O 3.34Å; L190-E212 VanDerWaalsContact CA-O 3.29Å; L190-E212 WeakPolarHBondContact CA-O 3.4Å; L190-E212 WeakPolarHBondContact CB-O 3.16Å; L190-E212 PolarHBondContact N-O 2.89Å; L190-L213 HydrophobicContact CB-CD2 3.99Å; L190-L213 HydrophobicContact CD1-CD2 3.98Å; L190-N216 PolarHBondContact O-ND2 2.92Å
191	S	98.4	Very high	95.2	Very high	8 Å²	8	46.1 Å²	46.1	6%	0.056	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	144.8	178.4	-65.5	0	0	0	0	113.4	S166 N167 N193 E212 N214	S166-S191 CarbonylContact C-O 3.59Å; S166-S191 WeakPolarHBondContact CA-O 3.2Å; S166-S191 VanDerWaalsContact CB-O 3.31Å; S166-S191 WeakPolarHBondContact CB-O 3.46Å; S166-S191 WeakPolarHBondContact OG-CB 3.33Å; S166-S191 PolarHBondContact OG-N 2.86Å; N167-S191 PolarHBondContact N-O 3.18Å; S191-N193 PolarHBondContact O-ND2 2.78Å; S191-E212 PolarHBondContact N-O 2.91Å; S191-E212 VanDerWaalsContact OG-CB 3.27Å; S191-E212 WeakPolarHBondContact OG-CB 3.33Å; S191-E212 PolarHBondContact OG-OE2 3.1Å; S191-E212 VanDerWaalsContact OG-OE2 3.06Å; S191-N214 CarbonylContact C-O 3.31Å; S191-N214 VanDerWaalsContact CA-O 3.26Å; S191-N214 WeakPolarHBondContact CA-O 3.38Å; S191-N214 WeakPolarHBondContact CB-ND2 3.46Å; S191-N214 PolarHBondContact OG-ND2 3.02Å
192	R	98.1	Very high	94.8	Very high	122 Å²	122	46.7 Å²	46.7	46%	0.46	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	42.1	177	-54	-177.7	-165.9	-171	8.5	114.9	N167 N214 R215	N167-R192 WeakPolarHBondContact CA-O 3.46Å; N167-R192 HydrophobicContact CB-CB 4.12Å; N167-R192 WeakPolarHBondContact OD1-CD 3.46Å; R192-N214 PolarHBondContact N-O 2.82Å; R192-R215 WeakPolarHBondContact CA-O 3.37Å; R192-R215 HydrophobicContact CB-CB 4.49Å; R192-R215 HydrophobicContact CG-CB 3.96Å; R192-R215 HydrophobicContact CG-CG 4.47Å
193	N	97.9	Very high	94.8	Very high	9 Å²	9	46.6 Å²	46.6	5%	0.048	22%	0.224	C	C	.	.	S	Bend	trans	-107.6	-164.5	173.8	-83.9	-72.5	0	0	0	111	L165 N168 I170 L190 S191 I195 N216	L165-N193 PolarHBondContact O-ND2 2.91Å; N168-N193 VanDerWaalsContact CA-OD1 3.27Å; N168-N193 WeakPolarHBondContact CA-OD1 3.33Å; N168-N193 WeakPolarHBondContact CB-OD1 3.48Å; N168-N193 PolarHBondContact N-OD1 3.13Å; N168-N193 PolarHBondContact O-OD1 3.48Å; I170-N193 HydrophobicContact CB-CB 4.08Å; I170-N193 VanDerWaalsContact CB-OD1 3.29Å; I170-N193 WeakPolarHBondContact CB-OD1 3.41Å; I170-N193 WeakPolarHBondContact CG1-OD1 3.22Å; I170-N193 PolarHBondContact N-OD1 2.93Å; L190-N193 PolarHBondContact O-ND2 3.46Å; S191-N193 PolarHBondContact O-ND2 2.78Å; N193-I195 HydrophobicContact CB-CD1 4.25Å; N193-I195 HydrophobicContact CB-CG1 4.23Å; N193-N216 WeakPolarHBondContact CA-OD1 3.33Å; N193-N216 WeakPolarHBondContact CB-OD1 3.14Å; N193-N216 PolarHBondContact N-OD1 2.8Å; N193-N216 PolarHBondContact O-OD1 2.91Å
194	R	96.8	Very high	94.7	Very high	121 Å²	121	46.9 Å²	46.9	46%	0.457	22%	0.217	S	C	.	.			trans	-112.3	11.7	-177.7	-59	-179.7	176.9	-168.9	-4.1	113	I170 S196 N216	I170-R194 CarbonylContact O-C 3.54Å; I170-R194 VanDerWaalsContact O-CA 3.29Å; I170-R194 WeakPolarHBondContact O-CA 3.48Å; I170-R194 WeakPolarHBondContact O-CB 3.4Å; I170-R194 PolarHBondContact O-N 3.21Å; R194-S196 PolarHBondContact O-N 3.32Å; R194-N216 PolarHBondContact N-OD1 2.89Å
195	I	95.6	Very high	94.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.214	C	C	.	.			trans	-59.5	120.1	-174.7	-57.1	164.3	0	0	0	109.4	I170 L173 L190 N193 Q197 I198 L213 N216 R217 I218	I170-I195 HydrophobicContact CG2-CD1 4.44Å; I170-I195 HydrophobicContact CG2-CG1 4.19Å; I170-I195 PolarHBondContact O-N 2.8Å; L173-I195 HydrophobicContact CD1-CD1 4.19Å; L173-I195 HydrophobicContact CD1-CG2 4.18Å; L173-I195 HydrophobicContact CD2-CD1 4.05Å; L173-I195 HydrophobicContact CG-CD1 4.19Å; L173-I195 HydrophobicContact CG-CG1 4.43Å; L173-I195 HydrophobicContact CG-CG2 4.33Å; L190-I195 HydrophobicContact CB-CD1 4.14Å; L190-I195 HydrophobicContact CD1-CD1 4.44Å; N193-I195 HydrophobicContact CB-CD1 4.25Å; N193-I195 HydrophobicContact CB-CG1 4.23Å; I195-Q197 VanDerWaalsContact CG2-O 3.3Å; I195-Q197 WeakPolarHBondContact CG2-O 3.18Å; I195-I198 HydrophobicContact CG2-CG1 4.39Å; I195-L213 HydrophobicContact CD1-CD2 4.02Å; I195-N216 HydrophobicContact CB-CB 4.28Å; I195-N216 WeakPolarHBondContact CB-OD1 3.39Å; I195-N216 WeakPolarHBondContact CG1-OD1 3.4Å; I195-N216 PolarHBondContact N-OD1 2.88Å; I195-N216 VanDerWaalsContact N-OD1 3.12Å; I195-R217 CarbonylContact O-C 3.57Å; I195-R217 VanDerWaalsContact O-C 3.29Å; I195-R217 WeakPolarHBondContact O-CA 3.29Å; I195-R217 PolarHBondContact O-N 3.31Å; I195-I218 HydrophobicContact CG2-CG1 4.42Å; I195-I218 PolarHBondContact O-N 3.17Å
196	S	92.7	Very high	94.6	Very high	54 Å²	54	49 Å²	49	38%	0.378	23%	0.231	S	C	.	.			trans	-101.6	-24.8	-177.1	54.6	0	0	0	0	114.1	R194 R217 I218 L219	R194-S196 PolarHBondContact O-N 3.32Å; S196-R217 WeakPolarHBondContact CA-O 3.35Å; S196-I218 WeakPolarHBondContact O-CA 3.18Å; S196-L219 PolarHBondContact O-N 3.32Å
197	Q	90.4	Very high	94.5	Very high	133 Å²	133	52.8 Å²	52.8	62%	0.621	24%	0.243	S	C	*	.			trans	-145.2	155.6	-179.2	-68.2	-179.7	-19.3	0	0	109.3	I195	I195-Q197 VanDerWaalsContact CG2-O 3.3Å; I195-Q197 WeakPolarHBondContact CG2-O 3.18Å
198	I	92.1	Very high	94.5	Very high	12 Å²	12	52 Å²	52	6%	0.062	24%	0.238	C	C	.	.			trans	-125.2	123.1	172.7	-53.2	175.3	0	0	0	107.2	L173 I195 A202 F203 L213 I218 I221 T225 F226	L173-I198 HydrophobicContact CD1-CG2 4.48Å; I195-I198 HydrophobicContact CG2-CG1 4.39Å; I198-A202 HydrophobicContact CG2-CB 3.58Å; I198-F203 HydrophobicContact CG2-CE2 3.87Å; I198-F203 HydrophobicContact CG2-CZ 4.25Å; I198-L213 HydrophobicContact CD1-CD1 3.66Å; I198-L213 HydrophobicContact CD1-CD2 4.39Å; I198-I218 HydrophobicContact CD1-CD1 3.8Å; I198-I218 HydrophobicContact CG1-CD1 4.27Å; I198-I221 HydrophobicContact CD1-CD1 4.4Å; I198-T225 HydrophobicContact CB-CG2 3.77Å; I198-T225 HydrophobicContact CG2-CG2 3.54Å; I198-F226 HydrophobicContact CD1-CE1 4.21Å; I198-F226 HydrophobicContact CD1-CZ 4.06Å
199	P	89	Confident	94.5	Very high	48 Å²	48	54 Å²	54	31%	0.312	25%	0.25	S	S	.	.			trans	-56.4	154.7	177.4	-26.2	34.2	0	0	0	113.7	R201 A202	P199-R201 PolarHBondContact O-N 3.01Å; P199-A202 HydrophobicContact CB-CB 4.15Å; P199-A202 HydrophobicContact CG-CB 4.42Å; P199-A202 VanDerWaalsContact O-CB 3.31Å; P199-A202 WeakPolarHBondContact O-CB 3.16Å; P199-A202 PolarHBondContact O-N 2.9Å
200	I	88.9	Confident	94.5	Very high	82 Å²	82	52.5 Å²	52.5	42%	0.421	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	132.9	165.4	-63.8	175.1	0	0	0	108.5	A202 E222 L224	I200-A202 VanDerWaalsContact C-N 3.3Å; I200-A202 PolarHBondContact O-N 2.99Å; I200-E222 HydrophobicContact CG1-CB 4.29Å; I200-L224 HydrophobicContact CG2-CB 4.1Å
201	R	89.4	Confident	94.5	Very high	125 Å²	125	52.5 Å²	52.5	47%	0.472	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	32.5	-176.3	-63	164.2	-179.3	166.4	3.6	115	L175 P199 F203 Q204 L224 T225 Q227	L175-R201 WeakPolarHBondContact CD1-O 3.39Å; P199-R201 PolarHBondContact O-N 3.01Å; R201-F203 PolarHBondContact O-N 2.96Å; R201-Q204 PolarHBondContact O-NE2 2.91Å; R201-L224 PolarHBondContact N-O 2.72Å; R201-L224 VanDerWaalsContact N-O 3.11Å; R201-T225 PolarHBondContact N-O 3.39Å; R201-Q227 HydrophobicContact CG-CB 3.99Å; R201-Q227 HydrophobicContact CG-CG 4.34Å
202	A	88.2	Confident	94.5	Very high	11 Å²	11	53.1 Å²	53.1	9%	0.091	25%	0.248	C	C	.	.			trans	-58.9	-12.1	-174	0	0	0	0	0	116.7	I198 P199 I200 T225	I198-A202 HydrophobicContact CG2-CB 3.58Å; P199-A202 HydrophobicContact CB-CB 4.15Å; P199-A202 HydrophobicContact CG-CB 4.42Å; P199-A202 VanDerWaalsContact O-CB 3.31Å; P199-A202 WeakPolarHBondContact O-CB 3.16Å; P199-A202 PolarHBondContact O-N 2.9Å; I200-A202 VanDerWaalsContact C-N 3.3Å; I200-A202 PolarHBondContact O-N 2.99Å; A202-T225 PolarHBondContact N-O 3Å
203	F	91.3	Very high	94.5	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.013	23%	0.226	C	C	.	.			trans	-140.4	110.8	-171.8	-50.1	-80.4	0	0	0	112.6	L173 L188 I198 R201 L205 L211 F226 G228 L229	L173-F203 HydrophobicContact CD1-CE1 4.46Å; L173-F203 HydrophobicContact CD1-CZ 4.11Å; L188-F203 HydrophobicContact CD2-CE1 4.3Å; I198-F203 HydrophobicContact CG2-CE2 3.87Å; I198-F203 HydrophobicContact CG2-CZ 4.25Å; R201-F203 PolarHBondContact O-N 2.96Å; F203-L205 VanDerWaalsContact C-N 3.29Å; F203-L205 HydrophobicContact CB-CD1 4.04Å; F203-L205 HydrophobicContact CB-CG 4.13Å; F203-L205 HydrophobicContact CD1-CD1 4.02Å; F203-L205 HydrophobicContact CG-CD1 4.44Å; F203-L205 PolarHBondContact O-N 2.95Å; F203-L211 HydrophobicContact CD2-CD2 4.46Å; F203-L211 HydrophobicContact CE2-CD2 4.05Å; F203-L211 HydrophobicContact CZ-CD2 4.21Å; F203-F226 HydrophobicContact CD2-CD1 4.28Å; F203-F226 HydrophobicContact CE2-CD1 4.08Å; F203-F226 HydrophobicContact CE2-CE1 4.08Å; F203-G228 WeakPolarHBondContact O-CA 3.43Å; F203-L229 HydrophobicContact CB-CD1 4.49Å; F203-L229 HydrophobicContact CB-CD2 3.55Å; F203-L229 HydrophobicContact CB-CG 4.13Å; F203-L229 HydrophobicContact CD2-CD1 4.15Å; F203-L229 HydrophobicContact CG-CD2 4.29Å
204	Q	93.3	Very high	94.6	Very high	81 Å²	81	47.6 Å²	47.6	38%	0.379	23%	0.228	S	C	.	.			trans	-91.8	61.1	167.2	-55.4	-51	-54.1	0	0	111.1	D179 G182 R201 P206 Q227	D179-Q204 HydrophobicContact CB-CB 4.21Å; D179-Q204 WeakPolarHBondContact OD1-CB 3.48Å; D179-Q204 PolarHBondContact OD1-N 3.37Å; D179-Q204 WeakPolarHBondContact OD2-CG 3.35Å; G182-Q204 WeakPolarHBondContact CA-O 3.32Å; R201-Q204 PolarHBondContact O-NE2 2.91Å; Q204-P206 WeakPolarHBondContact O-CD 3.32Å; Q204-Q227 PolarHBondContact NE2-O 3.32Å
205	L	95.7	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.			trans	-114.7	70.7	-174.6	-52.1	170.6	0	0	0	111.9	L178 L185 L188 F203 R207 L208 G228 L229	L178-L205 HydrophobicContact CB-CD1 4.45Å; L178-L205 HydrophobicContact CB-CD2 4.25Å; L178-L205 VanDerWaalsContact O-CD2 3.31Å; L178-L205 WeakPolarHBondContact O-CD2 3.48Å; L185-L205 HydrophobicContact CD2-CD1 4.08Å; L185-L205 HydrophobicContact CD2-CD2 4.3Å; L188-L205 HydrophobicContact CD2-CD1 4.17Å; F203-L205 VanDerWaalsContact C-N 3.29Å; F203-L205 HydrophobicContact CB-CD1 4.04Å; F203-L205 HydrophobicContact CB-CG 4.13Å; F203-L205 HydrophobicContact CD1-CD1 4.02Å; F203-L205 HydrophobicContact CG-CD1 4.44Å; F203-L205 PolarHBondContact O-N 2.95Å; L205-R207 PolarHBondContact O-N 3.47Å; L205-R207 VanDerWaalsContact O-N 3.15Å; L205-L208 HydrophobicContact CB-CB 3.89Å; L205-L208 HydrophobicContact CD1-CD1 4.45Å; L205-L208 HydrophobicContact CD1-CD2 4.09Å; L205-L208 WeakPolarHBondContact O-CB 3.33Å; L205-L208 PolarHBondContact O-N 2.84Å; L205-L208 VanDerWaalsContact O-N 3.08Å; L205-G228 CarbonylContact C-O 3.47Å; L205-L229 HydrophobicContact CB-CD2 3.69Å; L205-L229 HydrophobicContact CD1-CD2 4.42Å; L205-L229 HydrophobicContact CG-CD2 4.43Å
206	P	96	Very high	94.7	Very high	57 Å²	57	47.8 Å²	47.8	37%	0.37	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.4	-171.4	26.7	-37.1	0	0	0	115.3	G182 Q204 G228 S230 S231	G182-P206 WeakPolarHBondContact O-CD 3.45Å; Q204-P206 WeakPolarHBondContact O-CD 3.32Å; P206-G228 WeakPolarHBondContact CA-O 3.45Å; P206-S230 WeakPolarHBondContact CA-OG 3.45Å; P206-S230 VanDerWaalsContact CB-OG 3.31Å; P206-S230 WeakPolarHBondContact CB-OG 3.49Å; P206-S230 PolarHBondContact O-OG 2.8Å; P206-S230 VanDerWaalsContact O-OG 3.14Å; P206-S231 WeakPolarHBondContact O-CB 3.42Å; P206-S231 PolarHBondContact O-N 2.71Å; P206-S231 PolarHBondContact O-OG 2.03Å
207	R	97.1	Very high	94.9	Very high	150 Å²	150	52.4 Å²	52.4	57%	0.566	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-7.6	174	-71.5	-166.6	176.9	175.3	-10.8	114.8	S183 L185 L205 T209	S183-R207 VanDerWaalsContact O-CD 3.27Å; S183-R207 WeakPolarHBondContact O-CD 3.47Å; S183-R207 PolarHBondContact O-NE 2.7Å; S183-R207 PolarHBondContact O-NH1 2.85Å; L185-R207 CarbonylContact O-C 3.51Å; L185-R207 VanDerWaalsContact O-C 3.25Å; L205-R207 PolarHBondContact O-N 3.47Å; L205-R207 VanDerWaalsContact O-N 3.15Å; R207-T209 PolarHBondContact O-N 3.14Å
208	L	98.2	Very high	95.3	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.209	C	C	.	.			trans	-63.6	126.1	-178	-161.5	77.6	0	0	0	110.6	L185 Q186 L188 L205 L211 L229 S231 L232	L185-L208 HydrophobicContact CB-CD1 4.41Å; L185-L208 HydrophobicContact CD2-CD1 4Å; L185-L208 HydrophobicContact CG-CD1 3.89Å; L185-L208 WeakPolarHBondContact O-CA 3.42Å; L185-L208 PolarHBondContact O-N 3.35Å; Q186-L208 WeakPolarHBondContact O-CD1 3.37Å; L188-L208 HydrophobicContact CB-CD1 3.84Å; L188-L208 HydrophobicContact CB-CD2 4.35Å; L205-L208 HydrophobicContact CB-CB 3.89Å; L205-L208 HydrophobicContact CD1-CD1 4.45Å; L205-L208 HydrophobicContact CD1-CD2 4.09Å; L205-L208 WeakPolarHBondContact O-CB 3.33Å; L205-L208 PolarHBondContact O-N 2.84Å; L205-L208 VanDerWaalsContact O-N 3.08Å; L208-L211 HydrophobicContact CD2-CB 3.92Å; L208-L211 HydrophobicContact CD2-CD1 4.33Å; L208-L211 HydrophobicContact CD2-CD2 4.46Å; L208-L211 HydrophobicContact CD2-CG 4.47Å; L208-L229 HydrophobicContact CB-CD2 4.18Å; L208-L229 HydrophobicContact CD2-CD1 4.44Å; L208-L229 HydrophobicContact CD2-CD2 3.84Å; L208-S231 CarbonylContact O-C 3.25Å; L208-L232 HydrophobicContact CD2-CD1 4.09Å; L208-L232 HydrophobicContact CG-CD1 4.27Å; L208-L232 WeakPolarHBondContact O-CA 3.19Å; L208-L232 PolarHBondContact O-N 2.84Å
209	T	98.4	Very high	95.4	Very high	43 Å²	43	50.1 Å²	50.1	26%	0.264	23%	0.23	S	C	.	.			trans	-105	-30.8	179.3	57.3	0	0	0	0	112.2	Q186 R207 E233 V234	Q186-T209 PolarHBondContact O-N 3.32Å; Q186-T209 PolarHBondContact O-OG1 2.79Å; Q186-T209 VanDerWaalsContact O-OG1 3.14Å; R207-T209 PolarHBondContact O-N 3.14Å; T209-E233 PolarHBondContact O-N 3.28Å; T209-V234 PolarHBondContact O-N 3.13Å
210	Q	98.7	Very high	95.6	Very high	44 Å²	44	51.3 Å²	51.3	21%	0.206	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.6	178.9	178.9	169.6	-27.7	0	0	112.4	Q186 V187 L188 E212 V234	Q186-Q210 PolarHBondContact O-N 2.83Å; Q186-Q210 VanDerWaalsContact O-N 3.09Å; V187-Q210 HydrophobicContact CG1-CB 4.31Å; V187-Q210 HydrophobicContact CG1-CG 4.39Å; V187-Q210 HydrophobicContact CG2-CB 4.4Å; L188-Q210 PolarHBondContact N-O 2.84Å; Q210-E212 HydrophobicContact CG-CG 4.3Å; Q210-E212 PolarHBondContact NE2-OE1 2.83Å; Q210-V234 WeakPolarHBondContact CA-O 3.09Å; Q210-V234 HydrophobicContact CB-CB 4.36Å; Q210-V234 HydrophobicContact CG-CB 4.19Å; Q210-V234 HydrophobicContact CG-CG1 4.29Å
211	L	98.5	Very high	95.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.9	175.8	178.8	54.6	0	0	0	110.6	L188 F203 L208 L213 F226 L229 L232 V234 L235 K236	L188-L211 HydrophobicContact CB-CD1 4.09Å; L188-L211 HydrophobicContact CD2-CD1 3.85Å; L188-L211 HydrophobicContact CG-CD1 3.97Å; F203-L211 HydrophobicContact CD2-CD2 4.46Å; F203-L211 HydrophobicContact CE2-CD2 4.05Å; F203-L211 HydrophobicContact CZ-CD2 4.21Å; L208-L211 HydrophobicContact CD2-CB 3.92Å; L208-L211 HydrophobicContact CD2-CD1 4.33Å; L208-L211 HydrophobicContact CD2-CD2 4.46Å; L208-L211 HydrophobicContact CD2-CG 4.47Å; L211-L213 HydrophobicContact CD1-CD1 4.22Å; L211-L213 HydrophobicContact CD1-CG 4.21Å; L211-L213 HydrophobicContact CD2-CD1 3.81Å; L211-L213 HydrophobicContact CG-CD1 3.86Å; L211-L213 HydrophobicContact CG-CG 4.22Å; L211-F226 HydrophobicContact CD2-CD1 4.13Å; L211-F226 HydrophobicContact CD2-CE1 3.98Å; L211-L229 HydrophobicContact CD2-CD1 3.64Å; L211-L232 HydrophobicContact CB-CD1 3.8Å; L211-V234 PolarHBondContact N-O 3.32Å; L211-L235 HydrophobicContact CB-CD1 4.04Å; L211-L235 HydrophobicContact CD2-CD1 3.98Å; L211-L235 HydrophobicContact CG-CD1 4Å; L211-K236 PolarHBondContact O-N 3.43Å
212	E	98.6	Very high	95.9	Very high	21 Å²	21	45 Å²	45	10%	0.098	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.4	175.1	-44.9	-166.8	156.5	0	0	112.8	L188 R189 L190 S191 Q210 K236	L188-E212 PolarHBondContact O-N 3.19Å; R189-E212 HydrophobicContact CB-CB 4.43Å; R189-E212 WeakPolarHBondContact CD-OE2 3.48Å; R189-E212 HydrophobicContact CG-CB 4.44Å; R189-E212 HydrophobicContact CG-CG 4.01Å; L190-E212 CarbonylContact C-O 3.34Å; L190-E212 VanDerWaalsContact CA-O 3.29Å; L190-E212 WeakPolarHBondContact CA-O 3.4Å; L190-E212 WeakPolarHBondContact CB-O 3.16Å; L190-E212 PolarHBondContact N-O 2.89Å; S191-E212 PolarHBondContact N-O 2.91Å; S191-E212 VanDerWaalsContact OG-CB 3.27Å; S191-E212 WeakPolarHBondContact OG-CB 3.33Å; S191-E212 PolarHBondContact OG-OE2 3.1Å; S191-E212 VanDerWaalsContact OG-OE2 3.06Å; Q210-E212 HydrophobicContact CG-CG 4.3Å; Q210-E212 PolarHBondContact NE2-OE1 2.83Å; E212-K236 HydrophobicContact CB-CB 4.31Å; E212-K236 HydrophobicContact CG-CB 4.4Å; E212-K236 HydrophobicContact CG-CD 3.98Å; E212-K236 IonicContact OE1-NZ 3.13Å; E212-K236 PolarHBondContact OE1-NZ 2.84Å
213	L	98.3	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.211	C	C	.	.			trans	-124.6	10.8	177.8	-73.5	158	0	0	0	111.2	L190 I195 I198 L211 N216 I218 F226 K236 L237 N240	L190-L213 HydrophobicContact CB-CD2 3.99Å; L190-L213 HydrophobicContact CD1-CD2 3.98Å; I195-L213 HydrophobicContact CD1-CD2 4.02Å; I198-L213 HydrophobicContact CD1-CD1 3.66Å; I198-L213 HydrophobicContact CD1-CD2 4.39Å; L211-L213 HydrophobicContact CD1-CD1 4.22Å; L211-L213 HydrophobicContact CD1-CG 4.21Å; L211-L213 HydrophobicContact CD2-CD1 3.81Å; L211-L213 HydrophobicContact CG-CD1 3.86Å; L211-L213 HydrophobicContact CG-CG 4.22Å; L213-N216 WeakPolarHBondContact O-CB 3.25Å; L213-N216 PolarHBondContact O-ND2 2.81Å; L213-I218 HydrophobicContact CB-CD1 4.15Å; L213-F226 HydrophobicContact CD1-CE1 3.96Å; L213-F226 HydrophobicContact CD1-CZ 4.35Å; L213-K236 CarbonylContact C-O 3.38Å; L213-K236 WeakPolarHBondContact CA-O 3.26Å; L213-K236 PolarHBondContact N-O 2.91Å; L213-L237 HydrophobicContact CB-CD2 3.81Å; L213-L237 HydrophobicContact CD1-CD2 4.11Å; L213-N240 PolarHBondContact O-ND2 2.97Å
214	N	98.4	Very high	95.9	Very high	15 Å²	15	47.8 Å²	47.8	8%	0.08	22%	0.224	C	C	.	.			trans	-67.4	149.8	-177.3	57.1	-131.2	0	0	0	113.4	S191 R192 K236 Q238	S191-N214 CarbonylContact C-O 3.31Å; S191-N214 VanDerWaalsContact CA-O 3.26Å; S191-N214 WeakPolarHBondContact CA-O 3.38Å; S191-N214 WeakPolarHBondContact CB-ND2 3.46Å; S191-N214 PolarHBondContact OG-ND2 3.02Å; R192-N214 PolarHBondContact N-O 2.82Å; N214-K236 HydrophobicContact CB-CB 4.35Å; N214-K236 PolarHBondContact N-O 3.09Å; N214-K236 WeakPolarHBondContact OD1-CB 2.96Å; N214-Q238 CarbonylContact C-O 3.27Å; N214-Q238 WeakPolarHBondContact CA-O 3.44Å; N214-Q238 HydrophobicContact CB-CG 4.03Å; N214-Q238 WeakPolarHBondContact CB-O 3.34Å; N214-Q238 PolarHBondContact OD1-NE2 2.87Å
215	R	98.3	Very high	95.8	Very high	114 Å²	114	44 Å²	44	43%	0.43	21%	0.206	S	C	.	.	S	Bend	trans	61.5	39	-174.2	-52.6	179.4	-173.7	-158.8	6.9	113.2	R192 Q238 R239	R192-R215 WeakPolarHBondContact CA-O 3.37Å; R192-R215 HydrophobicContact CB-CB 4.49Å; R192-R215 HydrophobicContact CG-CB 3.96Å; R192-R215 HydrophobicContact CG-CG 4.47Å; R215-Q238 PolarHBondContact N-O 2.92Å; R215-R239 WeakPolarHBondContact CA-O 3.46Å; R215-R239 HydrophobicContact CG-CB 3.83Å; R215-R239 PolarHBondContact N-O 2.94Å
216	N	98.1	Very high	95.6	Very high	11 Å²	11	44 Å²	44	6%	0.059	21%	0.206	C	C	.	.	S	Bend	trans	-104.7	-158.9	168.7	-85.6	-79	0	0	0	109.8	L190 N193 R194 I195 L213 I218 N240	L190-N216 PolarHBondContact O-ND2 2.92Å; N193-N216 WeakPolarHBondContact CA-OD1 3.33Å; N193-N216 WeakPolarHBondContact CB-OD1 3.14Å; N193-N216 PolarHBondContact N-OD1 2.8Å; N193-N216 PolarHBondContact O-OD1 2.91Å; R194-N216 PolarHBondContact N-OD1 2.89Å; I195-N216 HydrophobicContact CB-CB 4.28Å; I195-N216 WeakPolarHBondContact CB-OD1 3.39Å; I195-N216 WeakPolarHBondContact CG1-OD1 3.4Å; I195-N216 PolarHBondContact N-OD1 2.88Å; I195-N216 VanDerWaalsContact N-OD1 3.12Å; L213-N216 WeakPolarHBondContact O-CB 3.25Å; L213-N216 PolarHBondContact O-ND2 2.81Å; N216-I218 HydrophobicContact CB-CD1 4.25Å; N216-I218 HydrophobicContact CB-CG1 4.19Å; N216-N240 WeakPolarHBondContact CA-OD1 3.33Å; N216-N240 WeakPolarHBondContact CB-OD1 3.33Å; N216-N240 PolarHBondContact N-OD1 3.29Å; N216-N240 PolarHBondContact O-OD1 3.32Å
217	R	97.1	Very high	95.3	Very high	150 Å²	150	43.6 Å²	43.6	57%	0.566	20%	0.199	S	C	*	.			trans	-121.3	24.3	-177.6	-60.9	178.8	174.5	-170	-7.2	112.1	I195 S196 L219 N240	I195-R217 CarbonylContact O-C 3.57Å; I195-R217 VanDerWaalsContact O-C 3.29Å; I195-R217 WeakPolarHBondContact O-CA 3.29Å; I195-R217 PolarHBondContact O-N 3.31Å; S196-R217 WeakPolarHBondContact CA-O 3.35Å; R217-L219 PolarHBondContact O-N 2.67Å; R217-N240 PolarHBondContact N-OD1 2.88Å
218	I	96.8	Very high	95	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.			trans	-66.5	124.5	-172.2	-57.2	161.2	0	0	0	109.6	I195 S196 I198 L213 N216 Q220 I221 L237 N240 S241 I242	I195-I218 HydrophobicContact CG2-CG1 4.42Å; I195-I218 PolarHBondContact O-N 3.17Å; S196-I218 WeakPolarHBondContact O-CA 3.18Å; I198-I218 HydrophobicContact CD1-CD1 3.8Å; I198-I218 HydrophobicContact CG1-CD1 4.27Å; L213-I218 HydrophobicContact CB-CD1 4.15Å; N216-I218 HydrophobicContact CB-CD1 4.25Å; N216-I218 HydrophobicContact CB-CG1 4.19Å; I218-Q220 WeakPolarHBondContact CG2-O 3.11Å; I218-I221 HydrophobicContact CG2-CD1 3.84Å; I218-L237 HydrophobicContact CD1-CD2 3.9Å; I218-N240 HydrophobicContact CB-CB 4.23Å; I218-N240 WeakPolarHBondContact CB-OD1 3Å; I218-N240 WeakPolarHBondContact CG1-OD1 3.16Å; I218-N240 PolarHBondContact N-OD1 2.88Å; I218-S241 CarbonylContact O-C 3.45Å; I218-S241 WeakPolarHBondContact O-CA 3.32Å; I218-S241 PolarHBondContact O-N 2.9Å; I218-I242 HydrophobicContact CB-CG1 4.27Å; I218-I242 HydrophobicContact CG2-CD1 4.49Å; I218-I242 HydrophobicContact CG2-CG1 4.13Å; I218-I242 WeakPolarHBondContact O-CG1 3.42Å; I218-I242 PolarHBondContact O-N 3.06Å; I218-I242 VanDerWaalsContact O-N 3.08Å
219	L	94.8	Very high	94.8	Very high	97 Å²	97	37.4 Å²	37.4	51%	0.508	18%	0.182	S	C	.	.			trans	-93.6	-32	-176.3	-65.3	171.5	0	0	0	113.8	S196 R217 I242 S243	S196-L219 PolarHBondContact O-N 3.32Å; R217-L219 PolarHBondContact O-N 2.67Å; L219-I242 WeakPolarHBondContact O-CA 3.23Å; L219-S243 PolarHBondContact O-N 3.1Å; L219-S243 PolarHBondContact O-OG 3.47Å
220	Q	93.9	Very high	94.5	Very high	74 Å²	74	37.8 Å²	37.8	35%	0.346	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.3	177.5	69.5	-173.4	16.3	0	0	111.2	I218 E222 K244	I218-Q220 WeakPolarHBondContact CG2-O 3.11Å; Q220-E222 HydrophobicContact CG-CG 4.34Å; Q220-E222 PolarHBondContact NE2-OE1 2.91Å; Q220-K244 VanDerWaalsContact CA-O 3.3Å; Q220-K244 WeakPolarHBondContact CA-O 2.95Å; Q220-K244 HydrophobicContact CB-CB 4.31Å
221	I	94.4	Very high	94.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.6	166.7	-54.3	-63.5	0	0	0	108.1	I198 I218 T225 F226 L237 I242 K244 L245 T246 A249	I198-I221 HydrophobicContact CD1-CD1 4.4Å; I218-I221 HydrophobicContact CG2-CD1 3.84Å; I221-T225 HydrophobicContact CG2-CG2 4.33Å; I221-F226 HydrophobicContact CD1-CE2 4.22Å; I221-F226 HydrophobicContact CD1-CZ 4.21Å; I221-F226 HydrophobicContact CG2-CD2 4.32Å; I221-F226 HydrophobicContact CG2-CE2 3.73Å; I221-L237 HydrophobicContact CD1-CD1 4.25Å; I221-L237 HydrophobicContact CD1-CD2 4.26Å; I221-L237 HydrophobicContact CG1-CD1 4.42Å; I221-I242 HydrophobicContact CD1-CD1 4.32Å; I221-I242 HydrophobicContact CG1-CD1 4.19Å; I221-K244 PolarHBondContact N-O 2.88Å; I221-K244 VanDerWaalsContact N-O 3.13Å; I221-L245 HydrophobicContact CB-CD2 3.87Å; I221-L245 HydrophobicContact CG1-CD2 3.79Å; I221-T246 PolarHBondContact O-N 3.34Å; I221-T246 PolarHBondContact O-OG1 2.73Å; I221-A249 HydrophobicContact CB-CB 4.25Å; I221-A249 HydrophobicContact CG2-CB 3.72Å
222	E	90.3	Very high	94.4	Very high	73 Å²	73	36.9 Å²	36.9	34%	0.341	19%	0.185	S	C	.	.			trans	-98.9	163.4	-177.9	-65.2	-174.4	-176	0	0	112.1	I200 Q220 L224 T225 T246 A249	I200-E222 HydrophobicContact CG1-CB 4.29Å; Q220-E222 HydrophobicContact CG-CG 4.34Å; Q220-E222 PolarHBondContact NE2-OE1 2.91Å; E222-L224 PolarHBondContact O-N 3.32Å; E222-T225 PolarHBondContact N-OG1 2.79Å; E222-T225 WeakPolarHBondContact O-CB 3.43Å; E222-T225 PolarHBondContact O-N 2.88Å; E222-T225 PolarHBondContact O-OG1 2.69Å; E222-T246 VanDerWaalsContact C-OG1 3.27Å; E222-T246 WeakPolarHBondContact CA-OG1 3.29Å; E222-A249 WeakPolarHBondContact O-CA 3.48Å
223	G	89.8	Confident	94.4	Very high	20 Å²	20	39 Å²	39	21%	0.206	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	134.2	179.9	0	0	0	0	0	110.6	T225 T246 D247	G223-T225 PolarHBondContact O-N 3.41Å; G223-T246 PolarHBondContact N-OG1 2.72Å; G223-D247 WeakPolarHBondContact CA-O 3.24Å
224	L	88.5	Confident	94.4	Very high	53 Å²	53	40.4 Å²	40.4	28%	0.277	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	13	-179.4	-40	173.4	0	0	0	115.1	I200 R201 E222 F226 Q227 G248 W251	I200-L224 HydrophobicContact CG2-CB 4.1Å; R201-L224 PolarHBondContact N-O 2.72Å; R201-L224 VanDerWaalsContact N-O 3.11Å; E222-L224 PolarHBondContact O-N 3.32Å; L224-F226 PolarHBondContact O-N 2.84Å; L224-Q227 HydrophobicContact CB-CB 4.07Å; L224-Q227 WeakPolarHBondContact O-CB 3.26Å; L224-Q227 PolarHBondContact O-N 3.49Å; L224-Q227 VanDerWaalsContact O-N 3.08Å; L224-G248 PolarHBondContact N-O 3.2Å; L224-W251 HydrophobicContact CD2-CB 4.12Å; L224-W251 HydrophobicContact CD2-CD2 3.86Å; L224-W251 HydrophobicContact CD2-CE3 3.38Å; L224-W251 HydrophobicContact CD2-CG 4.19Å; L224-W251 HydrophobicContact CD2-CZ3 4.08Å
225	T	91.4	Very high	94.4	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-45.1	174.8	-74.9	0	0	0	0	112.4	I198 R201 A202 I221 E222 G223	I198-T225 HydrophobicContact CB-CG2 3.77Å; I198-T225 HydrophobicContact CG2-CG2 3.54Å; R201-T225 PolarHBondContact N-O 3.39Å; A202-T225 PolarHBondContact N-O 3Å; I221-T225 HydrophobicContact CG2-CG2 4.33Å; E222-T225 PolarHBondContact N-OG1 2.79Å; E222-T225 WeakPolarHBondContact O-CB 3.43Å; E222-T225 PolarHBondContact O-N 2.88Å; E222-T225 PolarHBondContact O-OG1 2.69Å; G223-T225 PolarHBondContact O-N 3.41Å
226	F	93.1	Very high	94.4	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.3	-177.8	-59.2	-69.5	0	0	0	114.4	I198 F203 L211 L213 I221 L224 G228 L229 L235 L237 F250 L253	I198-F226 HydrophobicContact CD1-CE1 4.21Å; I198-F226 HydrophobicContact CD1-CZ 4.06Å; F203-F226 HydrophobicContact CD2-CD1 4.28Å; F203-F226 HydrophobicContact CE2-CD1 4.08Å; F203-F226 HydrophobicContact CE2-CE1 4.08Å; L211-F226 HydrophobicContact CD2-CD1 4.13Å; L211-F226 HydrophobicContact CD2-CE1 3.98Å; L213-F226 HydrophobicContact CD1-CE1 3.96Å; L213-F226 HydrophobicContact CD1-CZ 4.35Å; I221-F226 HydrophobicContact CD1-CE2 4.22Å; I221-F226 HydrophobicContact CD1-CZ 4.21Å; I221-F226 HydrophobicContact CG2-CD2 4.32Å; I221-F226 HydrophobicContact CG2-CE2 3.73Å; L224-F226 PolarHBondContact O-N 2.84Å; F226-G228 PolarHBondContact O-N 3.11Å; F226-G228 VanDerWaalsContact O-N 3.14Å; F226-L229 HydrophobicContact CB-CD1 4.15Å; F226-L229 HydrophobicContact CD1-CD1 3.89Å; F226-L229 HydrophobicContact CG-CD1 4.47Å; F226-L229 PolarHBondContact O-N 2.85Å; F226-L235 HydrophobicContact CD2-CD2 4.17Å; F226-L235 HydrophobicContact CE1-CD1 4.2Å; F226-L235 HydrophobicContact CE1-CD2 4.44Å; F226-L235 HydrophobicContact CE2-CD2 3.95Å; F226-L235 HydrophobicContact CZ-CD1 4.33Å; F226-L235 HydrophobicContact CZ-CD2 4.11Å; F226-L237 HydrophobicContact CE2-CD1 4.27Å; F226-L237 HydrophobicContact CZ-CD1 4.15Å; F226-L237 HydrophobicContact CZ-CD2 4.4Å; F226-F250 AromaticContact CD2-CD1 3.88Å; F226-F250 HydrophobicContact CD2-CD1 3.88Å; F226-F250 HydrophobicContact CD2-CE1 4.19Å; F226-F250 HydrophobicContact CE2-CD1 4.02Å; F226-F250 AromaticContact CE2-CE1 3.84Å; F226-F250 HydrophobicContact CE2-CE1 3.84Å; F226-L253 HydrophobicContact CB-CD1 3.91Å; F226-L253 HydrophobicContact CB-CD2 4.05Å; F226-L253 HydrophobicContact CB-CG 4.31Å; F226-L253 HydrophobicContact CG-CD1 4.38Å
227	Q	88.6	Confident	94.4	Very high	48 Å²	48	35.9 Å²	35.9	22%	0.224	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	115.3	177.7	179.1	-176.4	7.7	0	0	110.8	R201 Q204 L224 W251	R201-Q227 HydrophobicContact CG-CB 3.99Å; R201-Q227 HydrophobicContact CG-CG 4.34Å; Q204-Q227 PolarHBondContact NE2-O 3.32Å; L224-Q227 HydrophobicContact CB-CB 4.07Å; L224-Q227 WeakPolarHBondContact O-CB 3.26Å; L224-Q227 PolarHBondContact O-N 3.49Å; L224-Q227 VanDerWaalsContact O-N 3.08Å; Q227-W251 HydrophobicContact CG-CZ3 4.31Å
228	G	89.9	Confident	94.5	Very high	18 Å²	18	30.4 Å²	30.4	19%	0.186	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	132.6	-22.4	-176.3	0	0	0	0	0	112.4	F203 L205 P206 F226 S230	F203-G228 WeakPolarHBondContact O-CA 3.43Å; L205-G228 CarbonylContact C-O 3.47Å; P206-G228 WeakPolarHBondContact CA-O 3.45Å; F226-G228 PolarHBondContact O-N 3.11Å; F226-G228 VanDerWaalsContact O-N 3.14Å; G228-S230 VanDerWaalsContact C-N 3.27Å; G228-S230 PolarHBondContact O-N 3.37Å
229	L	95.1	Very high	94.6	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.186	C	C	.	.			trans	-84	53.9	-177.8	-55.7	-175.4	0	0	0	113.4	F203 L205 L208 L211 F226 S231 L232 L253	F203-L229 HydrophobicContact CB-CD1 4.49Å; F203-L229 HydrophobicContact CB-CD2 3.55Å; F203-L229 HydrophobicContact CB-CG 4.13Å; F203-L229 HydrophobicContact CD2-CD1 4.15Å; F203-L229 HydrophobicContact CG-CD2 4.29Å; L205-L229 HydrophobicContact CB-CD2 3.69Å; L205-L229 HydrophobicContact CD1-CD2 4.42Å; L205-L229 HydrophobicContact CG-CD2 4.43Å; L208-L229 HydrophobicContact CB-CD2 4.18Å; L208-L229 HydrophobicContact CD2-CD1 4.44Å; L208-L229 HydrophobicContact CD2-CD2 3.84Å; L211-L229 HydrophobicContact CD2-CD1 3.64Å; F226-L229 HydrophobicContact CB-CD1 4.15Å; F226-L229 HydrophobicContact CD1-CD1 3.89Å; F226-L229 HydrophobicContact CG-CD1 4.47Å; F226-L229 PolarHBondContact O-N 2.85Å; L229-S231 PolarHBondContact O-N 2.84Å; L229-L232 HydrophobicContact CB-CB 4.05Å; L229-L232 HydrophobicContact CB-CD2 4.41Å; L229-L232 HydrophobicContact CD1-CD1 4.46Å; L229-L232 HydrophobicContact CD1-CD2 4Å; L229-L232 WeakPolarHBondContact O-CB 3.41Å; L229-L232 PolarHBondContact O-N 2.96Å; L229-L232 VanDerWaalsContact O-N 3.1Å; L229-L253 HydrophobicContact CB-CD2 3.91Å
230	S	92.4	Very high	94.7	Very high	51 Å²	51	31.7 Å²	31.7	36%	0.357	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-6.5	-170.8	54.9	0	0	0	0	116.6	P206 G228 K255	P206-S230 WeakPolarHBondContact CA-OG 3.45Å; P206-S230 VanDerWaalsContact CB-OG 3.31Å; P206-S230 WeakPolarHBondContact CB-OG 3.49Å; P206-S230 PolarHBondContact O-OG 2.8Å; P206-S230 VanDerWaalsContact O-OG 3.14Å; G228-S230 VanDerWaalsContact C-N 3.27Å; G228-S230 PolarHBondContact O-N 3.37Å; S230-K255 WeakPolarHBondContact O-CE 3.34Å; S230-K255 PolarHBondContact O-NZ 2.71Å
231	S	96.6	Very high	94.9	Very high	24 Å²	24	31 Å²	31	17%	0.168	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	9.2	175.7	-58.4	0	0	0	0	114.1	P206 L208 L229 E233 K255	P206-S231 WeakPolarHBondContact O-CB 3.42Å; P206-S231 PolarHBondContact O-N 2.71Å; P206-S231 PolarHBondContact O-OG 2.03Å; L208-S231 CarbonylContact O-C 3.25Å; L229-S231 PolarHBondContact O-N 2.84Å; S231-E233 PolarHBondContact O-N 3.01Å; S231-K255 PolarHBondContact OG-NZ 2.81Å
232	L	98	Very high	95	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.168	C	C	.	.			trans	-66.3	125.4	-174.8	-161	73.7	0	0	0	110.9	L208 L211 L229 L235 L253 K255 M256	L208-L232 HydrophobicContact CD2-CD1 4.09Å; L208-L232 HydrophobicContact CG-CD1 4.27Å; L208-L232 WeakPolarHBondContact O-CA 3.19Å; L208-L232 PolarHBondContact O-N 2.84Å; L211-L232 HydrophobicContact CB-CD1 3.8Å; L229-L232 HydrophobicContact CB-CB 4.05Å; L229-L232 HydrophobicContact CB-CD2 4.41Å; L229-L232 HydrophobicContact CD1-CD1 4.46Å; L229-L232 HydrophobicContact CD1-CD2 4Å; L229-L232 WeakPolarHBondContact O-CB 3.41Å; L229-L232 PolarHBondContact O-N 2.96Å; L229-L232 VanDerWaalsContact O-N 3.1Å; L232-L235 HydrophobicContact CD2-CB 3.99Å; L232-L235 HydrophobicContact CD2-CD1 4.36Å; L232-L235 HydrophobicContact CD2-CD2 4.44Å; L232-L235 HydrophobicContact CD2-CG 4.49Å; L232-L253 HydrophobicContact CB-CD2 4.47Å; L232-L253 HydrophobicContact CD2-CD1 4.18Å; L232-L253 HydrophobicContact CD2-CD2 4.41Å; L232-K255 CarbonylContact O-C 3.57Å; L232-K255 VanDerWaalsContact O-C 3.27Å; L232-M256 WeakPolarHBondContact O-CA 3.18Å; L232-M256 PolarHBondContact O-N 3.38Å; L232-M256 VanDerWaalsContact O-N 3.1Å
233	E	98.3	Very high	95.2	Very high	66 Å²	66	30.2 Å²	30.2	31%	0.308	17%	0.171	S	C	.	.			trans	-106.2	-32.9	176.2	-55.2	-153.6	148.1	0	0	111.8	T209 S231 K257 V258	T209-E233 PolarHBondContact O-N 3.28Å; S231-E233 PolarHBondContact O-N 3.01Å; E233-K257 HydrophobicContact CB-CD 4.33Å; E233-K257 HydrophobicContact CB-CG 4.49Å; E233-K257 VanDerWaalsContact CD-CE 3.41Å; E233-K257 PolarHBondContact O-N 3.49Å; E233-K257 VanDerWaalsContact OE1-CE 3.22Å; E233-K257 WeakPolarHBondContact OE1-CE 3.45Å; E233-K257 IonicContact OE1-NZ 3.46Å; E233-K257 PolarHBondContact OE1-NZ 3.14Å; E233-K257 WeakPolarHBondContact OE2-CE 3.34Å; E233-K257 IonicContact OE2-NZ 3.18Å; E233-K257 PolarHBondContact OE2-NZ 3.15Å; E233-V258 PolarHBondContact O-N 2.89Å
234	V	98.7	Very high	95.3	Very high	29 Å²	29	35 Å²	35	18%	0.176	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.2	-174.6	-178.1	0	0	0	0	111	T209 Q210 L211 K236 V258	T209-V234 PolarHBondContact O-N 3.13Å; Q210-V234 WeakPolarHBondContact CA-O 3.09Å; Q210-V234 HydrophobicContact CB-CB 4.36Å; Q210-V234 HydrophobicContact CG-CB 4.19Å; Q210-V234 HydrophobicContact CG-CG1 4.29Å; L211-V234 PolarHBondContact N-O 3.32Å; V234-K236 HydrophobicContact CG1-CG 4.23Å; V234-V258 HydrophobicContact CG1-CB 4.43Å; V234-V258 HydrophobicContact CG2-CB 4.27Å; V234-V258 HydrophobicContact CG2-CG2 4.41Å
235	L	98.5	Very high	95.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.7	173.7	-178.7	54.9	0	0	0	110.9	L211 F226 L232 L237 F250 L253 M256 V258 L259 H260	L211-L235 HydrophobicContact CB-CD1 4.04Å; L211-L235 HydrophobicContact CD2-CD1 3.98Å; L211-L235 HydrophobicContact CG-CD1 4Å; F226-L235 HydrophobicContact CD2-CD2 4.17Å; F226-L235 HydrophobicContact CE1-CD1 4.2Å; F226-L235 HydrophobicContact CE1-CD2 4.44Å; F226-L235 HydrophobicContact CE2-CD2 3.95Å; F226-L235 HydrophobicContact CZ-CD1 4.33Å; F226-L235 HydrophobicContact CZ-CD2 4.11Å; L232-L235 HydrophobicContact CD2-CB 3.99Å; L232-L235 HydrophobicContact CD2-CD1 4.36Å; L232-L235 HydrophobicContact CD2-CD2 4.44Å; L232-L235 HydrophobicContact CD2-CG 4.49Å; L235-L237 HydrophobicContact CD1-CD1 4.43Å; L235-L237 HydrophobicContact CD1-CG 4.26Å; L235-L237 HydrophobicContact CD2-CD1 3.92Å; L235-L237 HydrophobicContact CG-CD1 4.02Å; L235-L237 HydrophobicContact CG-CG 4.17Å; L235-F250 HydrophobicContact CD2-CD1 3.9Å; L235-F250 HydrophobicContact CD2-CE1 3.78Å; L235-L253 HydrophobicContact CD2-CD1 4.28Å; L235-M256 HydrophobicContact CB-SD 3.58Å; L235-M256 VanDerWaalsContact CB-SD 3.58Å; L235-M256 HydrophobicContact CD2-SD 4.17Å; L235-V258 PolarHBondContact N-O 3.18Å; L235-L259 HydrophobicContact CB-CD1 4Å; L235-L259 HydrophobicContact CD2-CD1 3.97Å; L235-L259 HydrophobicContact CG-CD1 4.01Å; L235-H260 PolarHBondContact O-N 3Å
236	K	98.8	Very high	95.4	Very high	44 Å²	44	34.8 Å²	34.8	19%	0.191	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	105.1	-179.6	-67.6	-176.3	-162.9	167.1	0	112.5	L211 E212 L213 N214 V234 Q238 H260	L211-K236 PolarHBondContact O-N 3.43Å; E212-K236 HydrophobicContact CB-CB 4.31Å; E212-K236 HydrophobicContact CG-CB 4.4Å; E212-K236 HydrophobicContact CG-CD 3.98Å; E212-K236 IonicContact OE1-NZ 3.13Å; E212-K236 PolarHBondContact OE1-NZ 2.84Å; L213-K236 CarbonylContact C-O 3.38Å; L213-K236 WeakPolarHBondContact CA-O 3.26Å; L213-K236 PolarHBondContact N-O 2.91Å; N214-K236 HydrophobicContact CB-CB 4.35Å; N214-K236 PolarHBondContact N-O 3.09Å; N214-K236 WeakPolarHBondContact OD1-CB 2.96Å; V234-K236 HydrophobicContact CG1-CG 4.23Å; K236-Q238 VanDerWaalsContact CB-OE1 3.24Å; K236-H260 HydrophobicContact CG-CB 4.32Å
237	L	98.4	Very high	95.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.			trans	-118.1	6.8	-179.9	-73.6	166.8	0	0	0	113.1	L213 I218 I221 F226 L235 N240 I242 F250 H260 L261 N264	L213-L237 HydrophobicContact CB-CD2 3.81Å; L213-L237 HydrophobicContact CD1-CD2 4.11Å; I218-L237 HydrophobicContact CD1-CD2 3.9Å; I221-L237 HydrophobicContact CD1-CD1 4.25Å; I221-L237 HydrophobicContact CD1-CD2 4.26Å; I221-L237 HydrophobicContact CG1-CD1 4.42Å; F226-L237 HydrophobicContact CE2-CD1 4.27Å; F226-L237 HydrophobicContact CZ-CD1 4.15Å; F226-L237 HydrophobicContact CZ-CD2 4.4Å; L235-L237 HydrophobicContact CD1-CD1 4.43Å; L235-L237 HydrophobicContact CD1-CG 4.26Å; L235-L237 HydrophobicContact CD2-CD1 3.92Å; L235-L237 HydrophobicContact CG-CD1 4.02Å; L235-L237 HydrophobicContact CG-CG 4.17Å; L237-N240 PolarHBondContact O-ND2 2.85Å; L237-I242 HydrophobicContact CB-CD1 4.05Å; L237-I242 HydrophobicContact CD2-CD1 4.38Å; L237-F250 HydrophobicContact CD1-CE1 3.85Å; L237-F250 HydrophobicContact CD1-CZ 4.21Å; L237-H260 CarbonylContact C-O 3.39Å; L237-H260 WeakPolarHBondContact CA-O 3.34Å; L237-H260 WeakPolarHBondContact CB-O 3.27Å; L237-H260 PolarHBondContact N-O 2.8Å; L237-L261 HydrophobicContact CB-CD2 3.86Å; L237-L261 HydrophobicContact CD1-CD2 4.11Å; L237-N264 PolarHBondContact O-ND2 2.71Å; L237-N264 VanDerWaalsContact O-ND2 3.16Å
238	Q	98.4	Very high	95	Very high	35 Å²	35	37.8 Å²	37.8	16%	0.164	21%	0.207	C	C	.	.			trans	-66.1	152	-177	75.3	-73.7	9.6	0	0	113.8	N214 R215 K236 H260 E262	N214-Q238 CarbonylContact C-O 3.27Å; N214-Q238 WeakPolarHBondContact CA-O 3.44Å; N214-Q238 HydrophobicContact CB-CG 4.03Å; N214-Q238 WeakPolarHBondContact CB-O 3.34Å; N214-Q238 PolarHBondContact OD1-NE2 2.87Å; R215-Q238 PolarHBondContact N-O 2.92Å; K236-Q238 VanDerWaalsContact CB-OE1 3.24Å; Q238-H260 HydrophobicContact CB-CB 4.31Å; Q238-H260 HydrophobicContact CG-CB 4.44Å; Q238-H260 PolarHBondContact N-O 3.22Å; Q238-H260 VanDerWaalsContact OE1-CB 3.25Å; Q238-E262 CarbonylContact C-O 3.08Å; Q238-E262 WeakPolarHBondContact CA-O 3.3Å; Q238-E262 HydrophobicContact CB-CB 3.98Å; Q238-E262 WeakPolarHBondContact CB-O 3.42Å; Q238-E262 WeakPolarHBondContact CB-OE2 3.3Å
239	R	98.3	Very high	95.1	Very high	111 Å²	111	36.9 Å²	36.9	42%	0.419	20%	0.198	S	C	.	.	S	Bend	trans	57.1	47.5	-173.6	-63.2	-178.8	-178.7	-156.6	0.9	112.5	R215 E262 Y263	R215-R239 WeakPolarHBondContact CA-O 3.46Å; R215-R239 HydrophobicContact CG-CB 3.83Å; R215-R239 PolarHBondContact N-O 2.94Å; R239-E262 PolarHBondContact N-O 2.79Å; R239-Y263 WeakPolarHBondContact CA-O 3.4Å; R239-Y263 VanDerWaalsContact CG-CB 3.46Å; R239-Y263 HydrophobicContact CG-CD2 3.86Å; R239-Y263 HydrophobicContact CG-CG 3.78Å; R239-Y263 PolarHBondContact N-O 2.89Å
240	N	98.1	Very high	94.9	Very high	13 Å²	13	36.8 Å²	36.8	7%	0.07	20%	0.197	C	C	.	.	S	Bend	trans	-106.2	-150.4	166.8	-87.8	-80.1	0	0	0	108.6	L213 N216 R217 I218 L237 I242 Y263 N264	L213-N240 PolarHBondContact O-ND2 2.97Å; N216-N240 WeakPolarHBondContact CA-OD1 3.33Å; N216-N240 WeakPolarHBondContact CB-OD1 3.33Å; N216-N240 PolarHBondContact N-OD1 3.29Å; N216-N240 PolarHBondContact O-OD1 3.32Å; R217-N240 PolarHBondContact N-OD1 2.88Å; I218-N240 HydrophobicContact CB-CB 4.23Å; I218-N240 WeakPolarHBondContact CB-OD1 3Å; I218-N240 WeakPolarHBondContact CG1-OD1 3.16Å; I218-N240 PolarHBondContact N-OD1 2.88Å; L237-N240 PolarHBondContact O-ND2 2.85Å; N240-I242 HydrophobicContact CB-CD1 4.14Å; N240-I242 HydrophobicContact CB-CG1 3.87Å; N240-Y263 PolarHBondContact N-O 3.06Å; N240-N264 VanDerWaalsContact CA-OD1 3.31Å; N240-N264 WeakPolarHBondContact CA-OD1 3.36Å; N240-N264 WeakPolarHBondContact CB-OD1 3.48Å; N240-N264 PolarHBondContact N-OD1 3.39Å
241	S	96.8	Very high	94.7	Very high	60 Å²	60	38.5 Å²	38.5	42%	0.42	20%	0.196	S	C	.	.			trans	-131.6	33.5	173	-58.3	0	0	0	0	110.2	I218 S243 N264	I218-S241 CarbonylContact O-C 3.45Å; I218-S241 WeakPolarHBondContact O-CA 3.32Å; I218-S241 PolarHBondContact O-N 2.9Å; S241-S243 PolarHBondContact O-N 2.63Å; S241-S243 VanDerWaalsContact O-N 3.1Å; S241-N264 PolarHBondContact N-OD1 2.82Å
242	I	97.4	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.			trans	-68.2	110.7	-172.5	-56.6	170.7	0	0	0	108.3	I218 L219 I221 L237 N240 L245 L261 N264 N265 L266	I218-I242 HydrophobicContact CB-CG1 4.27Å; I218-I242 HydrophobicContact CG2-CD1 4.49Å; I218-I242 HydrophobicContact CG2-CG1 4.13Å; I218-I242 WeakPolarHBondContact O-CG1 3.42Å; I218-I242 PolarHBondContact O-N 3.06Å; I218-I242 VanDerWaalsContact O-N 3.08Å; L219-I242 WeakPolarHBondContact O-CA 3.23Å; I221-I242 HydrophobicContact CD1-CD1 4.32Å; I221-I242 HydrophobicContact CG1-CD1 4.19Å; L237-I242 HydrophobicContact CB-CD1 4.05Å; L237-I242 HydrophobicContact CD2-CD1 4.38Å; N240-I242 HydrophobicContact CB-CD1 4.14Å; N240-I242 HydrophobicContact CB-CG1 3.87Å; I242-L245 HydrophobicContact CG2-CD2 3.92Å; I242-L261 HydrophobicContact CD1-CD2 4.1Å; I242-N264 HydrophobicContact CB-CB 4.25Å; I242-N264 WeakPolarHBondContact CB-OD1 3.36Å; I242-N264 WeakPolarHBondContact CG1-OD1 3.44Å; I242-N264 PolarHBondContact N-OD1 2.92Å; I242-N265 CarbonylContact O-C 3.56Å; I242-N265 VanDerWaalsContact O-C 3.31Å; I242-N265 WeakPolarHBondContact O-CA 3.41Å; I242-N265 PolarHBondContact O-N 3.45Å; I242-L266 HydrophobicContact CG2-CD2 3.92Å; I242-L266 PolarHBondContact O-N 3.41Å
243	S	94.6	Very high	93.6	Very high	58 Å²	58	41.1 Å²	41.1	41%	0.406	21%	0.208	S	C	.	.			trans	-97.6	-21.3	175.1	60.1	0	0	0	0	112.8	L219 S241 N265	L219-S243 PolarHBondContact O-N 3.1Å; L219-S243 PolarHBondContact O-OG 3.47Å; S241-S243 PolarHBondContact O-N 2.63Å; S241-S243 VanDerWaalsContact O-N 3.1Å; S243-N265 WeakPolarHBondContact CA-O 3.37Å
244	K	90.9	Very high	93.2	Very high	121 Å²	121	40.2 Å²	40.2	53%	0.526	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134.8	-177.2	-168.3	174.4	-176.2	-179.5	0	112.4	Q220 I221	Q220-K244 VanDerWaalsContact CA-O 3.3Å; Q220-K244 WeakPolarHBondContact CA-O 2.95Å; Q220-K244 HydrophobicContact CB-CB 4.31Å; I221-K244 PolarHBondContact N-O 2.88Å; I221-K244 VanDerWaalsContact N-O 3.13Å
245	L	92.9	Very high	93	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.073	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.2	160.7	-56.8	170.7	0	0	0	106.3	I221 I242 A249 F250 L261 L266	I221-L245 HydrophobicContact CB-CD2 3.87Å; I221-L245 HydrophobicContact CG1-CD2 3.79Å; I242-L245 HydrophobicContact CG2-CD2 3.92Å; L245-A249 HydrophobicContact CB-CB 4.46Å; L245-F250 HydrophobicContact CD1-CE2 4.06Å; L245-F250 HydrophobicContact CD2-CE2 4.14Å; L245-F250 HydrophobicContact CD2-CZ 3.92Å; L245-L261 HydrophobicContact CD1-CD1 4.15Å; L245-L266 HydrophobicContact CD1-CD1 4.24Å; L245-L266 HydrophobicContact CD1-CD2 4.26Å; L245-L266 HydrophobicContact CG-CD2 3.95Å
246	T	89	Confident	92.9	Very high	35 Å²	35	43.3 Å²	43.3	22%	0.215	22%	0.22	C	C	.	.			trans	-87.2	169.7	172.9	70.3	0	0	0	0	111.3	I221 E222 G223 G248 A249 S273	I221-T246 PolarHBondContact O-N 3.34Å; I221-T246 PolarHBondContact O-OG1 2.73Å; E222-T246 VanDerWaalsContact C-OG1 3.27Å; E222-T246 WeakPolarHBondContact CA-OG1 3.29Å; G223-T246 PolarHBondContact N-OG1 2.72Å; T246-G248 PolarHBondContact O-N 2.85Å; T246-A249 WeakPolarHBondContact O-CB 3.44Å; T246-A249 PolarHBondContact O-N 2.88Å; T246-A249 VanDerWaalsContact O-N 3.15Å; T246-S273 WeakPolarHBondContact O-CA 3.38Å
247	D	88.1	Confident	92.9	Very high	100 Å²	100	45.1 Å²	45.1	54%	0.535	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	137.7	174.4	-57.9	-20.6	0	0	0	110.7	G223 A249 N270 G272	G223-D247 WeakPolarHBondContact CA-O 3.24Å; D247-A249 VanDerWaalsContact C-N 3.25Å; D247-A249 PolarHBondContact O-N 3.24Å; D247-N270 PolarHBondContact OD1-ND2 3.03Å; D247-G272 WeakPolarHBondContact OD1-CA 3.39Å
248	G	86.5	Confident	92.9	Very high	11 Å²	11	46 Å²	46	11%	0.113	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	15.5	-175.4	0	0	0	0	0	115.4	L224 T246 F250 W251 G272	L224-G248 PolarHBondContact N-O 3.2Å; T246-G248 PolarHBondContact O-N 2.85Å; G248-F250 PolarHBondContact O-N 3.07Å; G248-W251 VanDerWaalsContact O-CB 3.28Å; G248-W251 WeakPolarHBondContact O-CB 3.32Å; G248-W251 PolarHBondContact O-N 3.03Å; G248-W251 VanDerWaalsContact O-N 3.09Å; G248-G272 PolarHBondContact N-O 3.47Å
249	A	90.6	Very high	92.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-41.5	177.2	0	0	0	0	0	113.2	I221 E222 L245 T246 D247	I221-A249 HydrophobicContact CB-CB 4.25Å; I221-A249 HydrophobicContact CG2-CB 3.72Å; E222-A249 WeakPolarHBondContact O-CA 3.48Å; L245-A249 HydrophobicContact CB-CB 4.46Å; T246-A249 WeakPolarHBondContact O-CB 3.44Å; T246-A249 PolarHBondContact O-N 2.88Å; T246-A249 VanDerWaalsContact O-N 3.15Å; D247-A249 VanDerWaalsContact C-N 3.25Å; D247-A249 PolarHBondContact O-N 3.24Å
250	F	91.7	Very high	92.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	25.4	178.9	-51.9	-64.5	0	0	0	113.2	F226 L235 L237 L245 G248 L253 L259 L261 S273 L277	F226-F250 AromaticContact CD2-CD1 3.88Å; F226-F250 HydrophobicContact CD2-CD1 3.88Å; F226-F250 HydrophobicContact CD2-CE1 4.19Å; F226-F250 HydrophobicContact CE2-CD1 4.02Å; F226-F250 AromaticContact CE2-CE1 3.84Å; F226-F250 HydrophobicContact CE2-CE1 3.84Å; L235-F250 HydrophobicContact CD2-CD1 3.9Å; L235-F250 HydrophobicContact CD2-CE1 3.78Å; L237-F250 HydrophobicContact CD1-CE1 3.85Å; L237-F250 HydrophobicContact CD1-CZ 4.21Å; L245-F250 HydrophobicContact CD1-CE2 4.06Å; L245-F250 HydrophobicContact CD2-CE2 4.14Å; L245-F250 HydrophobicContact CD2-CZ 3.92Å; G248-F250 PolarHBondContact O-N 3.07Å; F250-L253 HydrophobicContact CB-CD1 4.09Å; F250-L253 HydrophobicContact CD1-CD1 4.26Å; F250-L253 WeakPolarHBondContact O-CB 3.49Å; F250-L253 WeakPolarHBondContact O-CG 3.12Å; F250-L253 PolarHBondContact O-N 2.86Å; F250-L259 HydrophobicContact CD2-CD2 4.13Å; F250-L259 HydrophobicContact CE1-CD1 4.22Å; F250-L259 HydrophobicContact CE2-CD2 3.82Å; F250-L259 HydrophobicContact CZ-CD1 4.25Å; F250-L259 HydrophobicContact CZ-CD2 4.04Å; F250-L261 HydrophobicContact CE2-CD1 4.35Å; F250-L261 HydrophobicContact CZ-CD1 4.25Å; F250-L261 HydrophobicContact CZ-CD2 4.48Å; F250-S273 WeakPolarHBondContact CD2-O 3.23Å; F250-L277 HydrophobicContact CB-CD1 4.06Å; F250-L277 HydrophobicContact CB-CD2 3.75Å; F250-L277 HydrophobicContact CB-CG 4.17Å; F250-L277 HydrophobicContact CD2-CD1 4.16Å; F250-L277 HydrophobicContact CG-CD1 4.38Å
251	W	87.4	Confident	92.9	Very high	87 Å²	87	40.1 Å²	40.1	33%	0.33	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	141.9	-175.3	-177.5	75	0	0	0	113	L224 Q227 G248 L253 Y275	L224-W251 HydrophobicContact CD2-CB 4.12Å; L224-W251 HydrophobicContact CD2-CD2 3.86Å; L224-W251 HydrophobicContact CD2-CE3 3.38Å; L224-W251 HydrophobicContact CD2-CG 4.19Å; L224-W251 HydrophobicContact CD2-CZ3 4.08Å; Q227-W251 HydrophobicContact CG-CZ3 4.31Å; G248-W251 VanDerWaalsContact O-CB 3.28Å; G248-W251 WeakPolarHBondContact O-CB 3.32Å; G248-W251 PolarHBondContact O-N 3.03Å; G248-W251 VanDerWaalsContact O-N 3.09Å; W251-L253 PolarHBondContact O-N 3.08Å; W251-Y275 AromaticContact CD1-CD1 3.57Å; W251-Y275 AromaticContact CD1-CE1 3.51Å; W251-Y275 AromaticContact NE1-CE1 3.65Å
252	N	80.9	Confident	93	Very high	76 Å²	76	38.5 Å²	38.5	41%	0.406	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	12.5	-177.8	-160.6	29.3	0	0	0	115.7	S254	N252-S254 PolarHBondContact O-N 2.76Å
253	L	91.6	Very high	93	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	22%	0.215	C	C	.	.			trans	-78.6	49.6	167.4	-58.5	-172	0	0	0	111.7	F226 L229 L232 L235 F250 W251 K255 M256 L277	F226-L253 HydrophobicContact CB-CD1 3.91Å; F226-L253 HydrophobicContact CB-CD2 4.05Å; F226-L253 HydrophobicContact CB-CG 4.31Å; F226-L253 HydrophobicContact CG-CD1 4.38Å; L229-L253 HydrophobicContact CB-CD2 3.91Å; L232-L253 HydrophobicContact CB-CD2 4.47Å; L232-L253 HydrophobicContact CD2-CD1 4.18Å; L232-L253 HydrophobicContact CD2-CD2 4.41Å; L235-L253 HydrophobicContact CD2-CD1 4.28Å; F250-L253 HydrophobicContact CB-CD1 4.09Å; F250-L253 HydrophobicContact CD1-CD1 4.26Å; F250-L253 WeakPolarHBondContact O-CB 3.49Å; F250-L253 WeakPolarHBondContact O-CG 3.12Å; F250-L253 PolarHBondContact O-N 2.86Å; W251-L253 PolarHBondContact O-N 3.08Å; L253-K255 PolarHBondContact O-N 3.42Å; L253-K255 VanDerWaalsContact O-N 3.15Å; L253-M256 HydrophobicContact CB-CB 4.12Å; L253-M256 HydrophobicContact CD1-CE 4.24Å; L253-M256 HydrophobicContact CD1-SD 4.04Å; L253-M256 VanDerWaalsContact O-CB 3.28Å; L253-M256 WeakPolarHBondContact O-CB 3.46Å; L253-M256 PolarHBondContact O-N 2.97Å; L253-L277 HydrophobicContact CB-CD2 4Å
254	S	89.7	Confident	93.2	Very high	48 Å²	48	41.4 Å²	41.4	34%	0.336	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.7	-167.8	57.8	0	0	0	0	115.1	N252 S279	N252-S254 PolarHBondContact O-N 2.76Å; S254-S279 WeakPolarHBondContact O-CB 3.49Å; S254-S279 PolarHBondContact O-OG 3.13Å
255	K	95.3	Very high	93.5	Very high	94 Å²	94	39.7 Å²	39.7	41%	0.409	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-5	171.4	-58.3	-165.8	-154.8	158.7	0	114.1	S230 S231 L232 L253 K257	S230-K255 WeakPolarHBondContact O-CE 3.34Å; S230-K255 PolarHBondContact O-NZ 2.71Å; S231-K255 PolarHBondContact OG-NZ 2.81Å; L232-K255 CarbonylContact O-C 3.57Å; L232-K255 VanDerWaalsContact O-C 3.27Å; L253-K255 PolarHBondContact O-N 3.42Å; L253-K255 VanDerWaalsContact O-N 3.15Å; K255-K257 PolarHBondContact O-N 2.94Å
256	M	96.1	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.			trans	-65.3	127.5	-173.9	-169.6	167.4	66.8	0	0	110.9	L232 L235 L253 L259 L277 S279 L280	L232-M256 WeakPolarHBondContact O-CA 3.18Å; L232-M256 PolarHBondContact O-N 3.38Å; L232-M256 VanDerWaalsContact O-N 3.1Å; L235-M256 HydrophobicContact CB-SD 3.58Å; L235-M256 VanDerWaalsContact CB-SD 3.58Å; L235-M256 HydrophobicContact CD2-SD 4.17Å; L253-M256 HydrophobicContact CB-CB 4.12Å; L253-M256 HydrophobicContact CD1-CE 4.24Å; L253-M256 HydrophobicContact CD1-SD 4.04Å; L253-M256 VanDerWaalsContact O-CB 3.28Å; L253-M256 WeakPolarHBondContact O-CB 3.46Å; L253-M256 PolarHBondContact O-N 2.97Å; M256-L259 HydrophobicContact CE-CB 4.05Å; M256-L259 HydrophobicContact CE-CD1 4.23Å; M256-L259 HydrophobicContact CE-CD2 3.97Å; M256-L259 HydrophobicContact CE-CG 4.31Å; M256-L259 HydrophobicContact SD-CB 4.47Å; M256-L259 HydrophobicContact SD-CD1 4.4Å; M256-L277 HydrophobicContact CE-CD1 3.78Å; M256-L277 HydrophobicContact CE-CD2 3.51Å; M256-L277 HydrophobicContact CE-CG 4.28Å; M256-S279 CarbonylContact O-C 3.48Å; M256-L280 HydrophobicContact CE-CD1 4.22Å; M256-L280 HydrophobicContact CG-CD1 4.36Å; M256-L280 VanDerWaalsContact O-CA 3.22Å; M256-L280 WeakPolarHBondContact O-CA 3.49Å; M256-L280 PolarHBondContact O-N 3.1Å; M256-L280 VanDerWaalsContact O-N 3.11Å
257	K	97.5	Very high	93.8	Very high	82 Å²	82	41.3 Å²	41.3	36%	0.357	21%	0.207	S	C	.	.			trans	-103.3	-39.7	-178.3	-60.7	174.6	-170.9	164.5	0	111.1	E233 K255 T281 Q282	E233-K257 HydrophobicContact CB-CD 4.33Å; E233-K257 HydrophobicContact CB-CG 4.49Å; E233-K257 VanDerWaalsContact CD-CE 3.41Å; E233-K257 PolarHBondContact O-N 3.49Å; E233-K257 VanDerWaalsContact OE1-CE 3.22Å; E233-K257 WeakPolarHBondContact OE1-CE 3.45Å; E233-K257 IonicContact OE1-NZ 3.46Å; E233-K257 PolarHBondContact OE1-NZ 3.14Å; E233-K257 WeakPolarHBondContact OE2-CE 3.34Å; E233-K257 IonicContact OE2-NZ 3.18Å; E233-K257 PolarHBondContact OE2-NZ 3.15Å; K255-K257 PolarHBondContact O-N 2.94Å; K257-T281 PolarHBondContact O-N 3.23Å; K257-T281 PolarHBondContact O-OG1 3.2Å; K257-Q282 PolarHBondContact O-N 3.08Å
258	V	98.6	Very high	93.9	Very high	18 Å²	18	40.1 Å²	40.1	11%	0.109	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.8	-172	-172.3	0	0	0	0	111.3	E233 V234 L235 Q282 F284	E233-V258 PolarHBondContact O-N 2.89Å; V234-V258 HydrophobicContact CG1-CB 4.43Å; V234-V258 HydrophobicContact CG2-CB 4.27Å; V234-V258 HydrophobicContact CG2-CG2 4.41Å; L235-V258 PolarHBondContact N-O 3.18Å; V258-Q282 HydrophobicContact CG1-CB 4.24Å; V258-Q282 HydrophobicContact CG2-CB 4.33Å; V258-F284 HydrophobicContact CG1-CD2 4.33Å; V258-F284 HydrophobicContact CG1-CE2 3.91Å
259	L	98.1	Very high	93.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	118.3	174.3	-179.8	57.7	0	0	0	110.9	L235 F250 M256 L261 L277 L280 Q282 L283 F284	L235-L259 HydrophobicContact CB-CD1 4Å; L235-L259 HydrophobicContact CD2-CD1 3.97Å; L235-L259 HydrophobicContact CG-CD1 4.01Å; F250-L259 HydrophobicContact CD2-CD2 4.13Å; F250-L259 HydrophobicContact CE1-CD1 4.22Å; F250-L259 HydrophobicContact CE2-CD2 3.82Å; F250-L259 HydrophobicContact CZ-CD1 4.25Å; F250-L259 HydrophobicContact CZ-CD2 4.04Å; M256-L259 HydrophobicContact CE-CB 4.05Å; M256-L259 HydrophobicContact CE-CD1 4.23Å; M256-L259 HydrophobicContact CE-CD2 3.97Å; M256-L259 HydrophobicContact CE-CG 4.31Å; M256-L259 HydrophobicContact SD-CB 4.47Å; M256-L259 HydrophobicContact SD-CD1 4.4Å; L259-L261 HydrophobicContact CD1-CD1 4.41Å; L259-L261 HydrophobicContact CD1-CG 4.23Å; L259-L261 HydrophobicContact CD2-CD1 3.82Å; L259-L261 HydrophobicContact CD2-CG 4.48Å; L259-L261 HydrophobicContact CG-CD1 3.98Å; L259-L261 HydrophobicContact CG-CG 4.12Å; L259-L277 HydrophobicContact CD2-CD1 4.25Å; L259-L280 HydrophobicContact CB-CD1 3.9Å; L259-Q282 PolarHBondContact N-O 2.98Å; L259-L283 HydrophobicContact CB-CD1 4.05Å; L259-L283 HydrophobicContact CD2-CD1 3.91Å; L259-L283 HydrophobicContact CG-CD1 4.04Å; L259-F284 PolarHBondContact O-N 3.21Å
260	H	98.7	Very high	93.2	Very high	35 Å²	35	42.2 Å²	42.2	16%	0.162	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	115.1	175.4	-73.1	-87.4	0	0	0	110.9	L235 K236 L237 Q238 E262 F284	L235-H260 PolarHBondContact O-N 3Å; K236-H260 HydrophobicContact CG-CB 4.32Å; L237-H260 CarbonylContact C-O 3.39Å; L237-H260 WeakPolarHBondContact CA-O 3.34Å; L237-H260 WeakPolarHBondContact CB-O 3.27Å; L237-H260 PolarHBondContact N-O 2.8Å; Q238-H260 HydrophobicContact CB-CB 4.31Å; Q238-H260 HydrophobicContact CG-CB 4.44Å; Q238-H260 PolarHBondContact N-O 3.22Å; Q238-H260 VanDerWaalsContact OE1-CB 3.25Å; H260-E262 VanDerWaalsContact C-OE2 3.24Å; H260-E262 WeakPolarHBondContact CA-OE2 3.34Å; H260-E262 WeakPolarHBondContact CB-OE2 3.35Å; H260-E262 IonicContact CE1-OE1 2.69Å; H260-E262 IonicContact CG-OE1 2.85Å; H260-E262 IonicContact CG-OE2 3.11Å; H260-E262 IonicContact ND1-OE1 3.09Å; H260-E262 PolarHBondContact ND1-OE1 2.72Å; H260-E262 IonicContact ND1-OE2 3.25Å; H260-E262 PolarHBondContact ND1-OE2 3.27Å; H260-F284 AromaticContact CE1-CD2 3.36Å; H260-F284 WeakPolarHBondContact CE1-CD2 3.33Å; H260-F284 AromaticContact CE1-CE2 3.55Å; H260-F284 AromaticContact CG-CD2 3.98Å; H260-F284 AromaticContact ND1-CD2 3.41Å; H260-F284 WeakPolarHBondContact ND1-CD2 3.42Å; H260-F284 AromaticContact ND1-CG 3.94Å; H260-F284 AromaticContact NE2-CD2 3.94Å; H260-F284 AromaticContact NE2-CE2 3.95Å
261	L	98.1	Very high	92.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.221	C	C	.	.			trans	-126.9	14.5	178.5	-77.8	167.8	0	0	0	112.1	L237 I242 L245 F250 L259 N264 L266 F284 L285 N288	L237-L261 HydrophobicContact CB-CD2 3.86Å; L237-L261 HydrophobicContact CD1-CD2 4.11Å; I242-L261 HydrophobicContact CD1-CD2 4.1Å; L245-L261 HydrophobicContact CD1-CD1 4.15Å; F250-L261 HydrophobicContact CE2-CD1 4.35Å; F250-L261 HydrophobicContact CZ-CD1 4.25Å; F250-L261 HydrophobicContact CZ-CD2 4.48Å; L259-L261 HydrophobicContact CD1-CD1 4.41Å; L259-L261 HydrophobicContact CD1-CG 4.23Å; L259-L261 HydrophobicContact CD2-CD1 3.82Å; L259-L261 HydrophobicContact CD2-CG 4.48Å; L259-L261 HydrophobicContact CG-CD1 3.98Å; L259-L261 HydrophobicContact CG-CG 4.12Å; L261-N264 PolarHBondContact O-ND2 3.41Å; L261-L266 HydrophobicContact CB-CD1 4.46Å; L261-L266 HydrophobicContact CD1-CD1 4.46Å; L261-F284 CarbonylContact C-O 3.04Å; L261-F284 WeakPolarHBondContact CA-O 3.2Å; L261-F284 PolarHBondContact N-O 3.05Å; L261-L285 HydrophobicContact CB-CD2 3.89Å; L261-L285 HydrophobicContact CD1-CD2 3.94Å; L261-N288 PolarHBondContact O-ND2 2.93Å
262	E	98.4	Very high	92.1	Very high	26 Å²	26	40.7 Å²	40.7	12%	0.121	21%	0.213	C	C	.	.			trans	-62	155.5	-177.9	-48.5	93.9	115.3	0	0	112.7	Q238 R239 H260 N264 F284 S286	Q238-E262 CarbonylContact C-O 3.08Å; Q238-E262 WeakPolarHBondContact CA-O 3.3Å; Q238-E262 HydrophobicContact CB-CB 3.98Å; Q238-E262 WeakPolarHBondContact CB-O 3.42Å; Q238-E262 WeakPolarHBondContact CB-OE2 3.3Å; R239-E262 PolarHBondContact N-O 2.79Å; H260-E262 VanDerWaalsContact C-OE2 3.24Å; H260-E262 WeakPolarHBondContact CA-OE2 3.34Å; H260-E262 WeakPolarHBondContact CB-OE2 3.35Å; H260-E262 IonicContact CE1-OE1 2.69Å; H260-E262 IonicContact CG-OE1 2.85Å; H260-E262 IonicContact CG-OE2 3.11Å; H260-E262 IonicContact ND1-OE1 3.09Å; H260-E262 PolarHBondContact ND1-OE1 2.72Å; H260-E262 IonicContact ND1-OE2 3.25Å; H260-E262 PolarHBondContact ND1-OE2 3.27Å; E262-N264 PolarHBondContact O-ND2 2.62Å; E262-F284 HydrophobicContact CG-CB 3.67Å; E262-F284 PolarHBondContact N-O 2.67Å; E262-F284 WeakPolarHBondContact OE2-CB 3.5Å; E262-S286 CarbonylContact C-O 3.18Å; E262-S286 WeakPolarHBondContact CA-O 3.49Å; E262-S286 VanDerWaalsContact CB-O 3.25Å; E262-S286 WeakPolarHBondContact CB-O 3.38Å; E262-S286 WeakPolarHBondContact CG-OG 3.1Å
263	Y	98.4	Very high	92.3	Very high	102 Å²	102	37.1 Å²	37.1	40%	0.4	19%	0.193	S	C	.	.	S	Bend	trans	53.3	57.4	179.2	-58.8	-84.3	0	0	0	111.9	R239 N240 S286 N287	R239-Y263 WeakPolarHBondContact CA-O 3.4Å; R239-Y263 VanDerWaalsContact CG-CB 3.46Å; R239-Y263 HydrophobicContact CG-CD2 3.86Å; R239-Y263 HydrophobicContact CG-CG 3.78Å; R239-Y263 PolarHBondContact N-O 2.89Å; N240-Y263 PolarHBondContact N-O 3.06Å; Y263-S286 PolarHBondContact N-O 3.01Å; Y263-N287 WeakPolarHBondContact CA-O 3.49Å; Y263-N287 HydrophobicContact CD1-CB 3.49Å; Y263-N287 VanDerWaalsContact CD1-CB 3.49Å; Y263-N287 HydrophobicContact CD2-CB 4.33Å; Y263-N287 HydrophobicContact CE1-CB 3.65Å; Y263-N287 WeakPolarHBondContact CE1-OD1 3.35Å; Y263-N287 HydrophobicContact CE2-CB 4.47Å; Y263-N287 HydrophobicContact CG-CB 3.84Å; Y263-N287 PolarHBondContact N-O 3.02Å
264	N	98.3	Very high	92.2	Very high	16 Å²	16	37 Å²	37	9%	0.086	19%	0.193	C	C	.	.	S	Bend	trans	-129.7	-170.9	173.2	-83.5	-68.3	0	0	0	108.9	L237 N240 S241 I242 L261 E262 L266 N287 N288	L237-N264 PolarHBondContact O-ND2 2.71Å; L237-N264 VanDerWaalsContact O-ND2 3.16Å; N240-N264 VanDerWaalsContact CA-OD1 3.31Å; N240-N264 WeakPolarHBondContact CA-OD1 3.36Å; N240-N264 WeakPolarHBondContact CB-OD1 3.48Å; N240-N264 PolarHBondContact N-OD1 3.39Å; S241-N264 PolarHBondContact N-OD1 2.82Å; I242-N264 HydrophobicContact CB-CB 4.25Å; I242-N264 WeakPolarHBondContact CB-OD1 3.36Å; I242-N264 WeakPolarHBondContact CG1-OD1 3.44Å; I242-N264 PolarHBondContact N-OD1 2.92Å; L261-N264 PolarHBondContact O-ND2 3.41Å; E262-N264 PolarHBondContact O-ND2 2.62Å; N264-L266 HydrophobicContact CB-CG 4.46Å; N264-N287 PolarHBondContact N-O 3.43Å; N264-N288 WeakPolarHBondContact CA-OD1 3.25Å; N264-N288 WeakPolarHBondContact CB-OD1 3.34Å; N264-N288 PolarHBondContact O-OD1 3.49Å
265	N	97.4	Very high	92	Very high	85 Å²	85	40.1 Å²	40.1	46%	0.455	20%	0.198	S	C	.	.			trans	-116.4	31.1	-175.5	-161.9	42.9	0	0	0	112.1	I242 S243 T267 N288	I242-N265 CarbonylContact O-C 3.56Å; I242-N265 VanDerWaalsContact O-C 3.31Å; I242-N265 WeakPolarHBondContact O-CA 3.41Å; I242-N265 PolarHBondContact O-N 3.45Å; S243-N265 WeakPolarHBondContact CA-O 3.37Å; N265-T267 PolarHBondContact O-N 3.09Å; N265-N288 PolarHBondContact N-OD1 3.28Å
266	L	95.8	Very high	91.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.189	C	C	.	.			trans	-71.2	127	-179.2	-60.1	173.6	0	0	0	110.3	I242 L245 L261 N264 L285 N288 S289 I290	I242-L266 HydrophobicContact CG2-CD2 3.92Å; I242-L266 PolarHBondContact O-N 3.41Å; L245-L266 HydrophobicContact CD1-CD1 4.24Å; L245-L266 HydrophobicContact CD1-CD2 4.26Å; L245-L266 HydrophobicContact CG-CD2 3.95Å; L261-L266 HydrophobicContact CB-CD1 4.46Å; L261-L266 HydrophobicContact CD1-CD1 4.46Å; N264-L266 HydrophobicContact CB-CG 4.46Å; L266-L285 HydrophobicContact CD1-CD2 3.96Å; L266-N288 HydrophobicContact CB-CB 4.29Å; L266-N288 WeakPolarHBondContact CB-OD1 3.28Å; L266-N288 WeakPolarHBondContact CG-OD1 3.2Å; L266-N288 PolarHBondContact N-OD1 3.41Å; L266-S289 CarbonylContact O-C 3.56Å; L266-S289 WeakPolarHBondContact O-CA 3.25Å; L266-S289 PolarHBondContact O-N 3.36Å; L266-I290 HydrophobicContact CB-CG1 4.33Å; L266-I290 WeakPolarHBondContact O-CG1 3.39Å; L266-I290 PolarHBondContact O-N 3.26Å; L266-I290 VanDerWaalsContact O-N 3.15Å
267	T	92.9	Very high	91.1	Very high	82 Å²	82	36.7 Å²	36.7	50%	0.503	19%	0.189	S	C	.	.	S	Bend	trans	-95.2	-19.5	175.6	52.2	0	0	0	0	113.4	N265 I290 A291	N265-T267 PolarHBondContact O-N 3.09Å; T267-I290 WeakPolarHBondContact O-CA 3.46Å; T267-A291 PolarHBondContact O-N 2.86Å; T267-A291 VanDerWaalsContact O-N 3.14Å
268	E	88.8	Confident	90.8	Very high	75 Å²	75	35.6 Å²	35.6	35%	0.35	19%	0.192	S	C	.	.			trans	-157.2	168.6	171.8	61.1	177.1	-149.8	0	0	111.1	R292	E268-R292 IonicContact OE1-NH2 2.65Å; E268-R292 IonicContact OE2-CZ 2.72Å; E268-R292 IonicContact OE2-NE 3.48Å; E268-R292 PolarHBondContact OE2-NE 2.71Å; E268-R292 IonicContact OE2-NH2 3.44Å; E268-R292 PolarHBondContact OE2-NH2 3.14Å
269	V	86.9	Confident	90.6	Very high	14 Å²	14	36.2 Å²	36.2	9%	0.085	20%	0.197	C	C	.	.			trans	-121.3	111.1	167.4	-179.7	0	0	0	0	107.1	L274 L285 I290	V269-L274 HydrophobicContact CG1-CD1 3.78Å; V269-L274 HydrophobicContact CG1-CD2 4.01Å; V269-L274 HydrophobicContact CG1-CG 3.77Å; V269-L285 HydrophobicContact CG2-CD1 3.94Å; V269-L285 HydrophobicContact CG2-CD2 3.98Å; V269-I290 HydrophobicContact CG2-CD1 4.07Å
270	N	76.3	Confident	90.5	Very high	42 Å²	42	36.2 Å²	36.2	23%	0.225	20%	0.197	C	C	.	.			trans	-85.2	166.1	-178.1	83.6	-14.6	0	0	0	111.5	D247 S273	D247-N270 PolarHBondContact OD1-ND2 3.03Å; N270-S273 PolarHBondContact O-OG 3.41Å; N270-S273 WeakPolarHBondContact OD1-CB 3.24Å; N270-S273 PolarHBondContact OD1-N 3.38Å; N270-S273 PolarHBondContact OD1-OG 2.98Å
271	S	75.9	Confident	90.5	Very high	40 Å²	40	36.5 Å²	36.5	28%	0.28	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-32	-175.1	52.8	0	0	0	0	114.5	F300	S271-F300 WeakPolarHBondContact O-CD2 3.38Å; S271-F300 WeakPolarHBondContact O-CE2 3.48Å
272	G	80.6	Confident	90.5	Very high	15 Å²	15	39.4 Å²	39.4	16%	0.155	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-29.8	177.3	0	0	0	0	0	114	D247 G248 L274 Y275	D247-G272 WeakPolarHBondContact OD1-CA 3.39Å; G248-G272 PolarHBondContact N-O 3.47Å; G272-L274 PolarHBondContact O-N 2.84Å; G272-Y275 WeakPolarHBondContact O-CB 3.42Å; G272-Y275 PolarHBondContact O-N 2.85Å
273	S	85.7	Confident	90.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-37.8	-178.7	63.9	0	0	0	0	113.6	T246 F250 N270 Y275	T246-S273 WeakPolarHBondContact O-CA 3.38Å; F250-S273 WeakPolarHBondContact CD2-O 3.23Å; N270-S273 PolarHBondContact O-OG 3.41Å; N270-S273 WeakPolarHBondContact OD1-CB 3.24Å; N270-S273 PolarHBondContact OD1-N 3.38Å; N270-S273 PolarHBondContact OD1-OG 2.98Å; S273-Y275 VanDerWaalsContact C-N 3.28Å; S273-Y275 PolarHBondContact O-N 3.17Å
274	L	88.3	Confident	90.4	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	4.6	177.9	-56.9	-176.2	0	0	0	113.6	V269 G272 G276 L277 W298 F300	V269-L274 HydrophobicContact CG1-CD1 3.78Å; V269-L274 HydrophobicContact CG1-CD2 4.01Å; V269-L274 HydrophobicContact CG1-CG 3.77Å; G272-L274 PolarHBondContact O-N 2.84Å; L274-G276 PolarHBondContact O-N 2.85Å; L274-L277 HydrophobicContact CB-CD1 4.49Å; L274-L277 HydrophobicContact CD2-CD1 4.09Å; L274-L277 WeakPolarHBondContact O-CB 3.27Å; L274-L277 WeakPolarHBondContact O-CG 3.43Å; L274-L277 PolarHBondContact O-N 2.84Å; L274-W298 HydrophobicContact CD1-CE3 3.99Å; L274-W298 HydrophobicContact CD1-CZ3 3.78Å; L274-F300 WeakPolarHBondContact O-CB 3.31Å
275	Y	86.9	Confident	90.4	Very high	113 Å²	113	33.6 Å²	33.6	44%	0.443	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	120.3	-175.7	-179.9	-118.6	0	0	0	112.3	W251 G272 S273 F300	W251-Y275 AromaticContact CD1-CD1 3.57Å; W251-Y275 AromaticContact CD1-CE1 3.51Å; W251-Y275 AromaticContact NE1-CE1 3.65Å; G272-Y275 WeakPolarHBondContact O-CB 3.42Å; G272-Y275 PolarHBondContact O-N 2.85Å; S273-Y275 VanDerWaalsContact C-N 3.28Å; S273-Y275 PolarHBondContact O-N 3.17Å; Y275-F300 AromaticContact CD2-CD1 3.78Å; Y275-F300 HydrophobicContact CD2-CD1 3.78Å; Y275-F300 HydrophobicContact CD2-CD2 4.28Å; Y275-F300 AromaticContact CD2-CE1 3.61Å; Y275-F300 HydrophobicContact CD2-CE1 3.61Å; Y275-F300 HydrophobicContact CD2-CE2 4.11Å; Y275-F300 HydrophobicContact CD2-CG 4.13Å; Y275-F300 AromaticContact CD2-CZ 3.78Å; Y275-F300 HydrophobicContact CD2-CZ 3.78Å; Y275-F300 HydrophobicContact CE2-CD1 4.28Å; Y275-F300 AromaticContact CE2-CE1 3.93Å; Y275-F300 HydrophobicContact CE2-CE1 3.93Å; Y275-F300 HydrophobicContact CE2-CZ 4.36Å
276	G	82	Confident	90.5	Very high	21 Å²	21	30.1 Å²	30.1	22%	0.216	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.8	-1.7	-179.6	0	0	0	0	0	115.5	L274 S278	L274-G276 PolarHBondContact O-N 2.85Å; G276-S278 PolarHBondContact O-N 3.2Å
277	L	90.1	Very high	90.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.182	C	C	.	.			trans	-85.3	46.1	-174.1	-60.1	-168.4	0	0	0	115	F250 L253 M256 L259 L274 S279 L280 F300	F250-L277 HydrophobicContact CB-CD1 4.06Å; F250-L277 HydrophobicContact CB-CD2 3.75Å; F250-L277 HydrophobicContact CB-CG 4.17Å; F250-L277 HydrophobicContact CD2-CD1 4.16Å; F250-L277 HydrophobicContact CG-CD1 4.38Å; L253-L277 HydrophobicContact CB-CD2 4Å; M256-L277 HydrophobicContact CE-CD1 3.78Å; M256-L277 HydrophobicContact CE-CD2 3.51Å; M256-L277 HydrophobicContact CE-CG 4.28Å; L259-L277 HydrophobicContact CD2-CD1 4.25Å; L274-L277 HydrophobicContact CB-CD1 4.49Å; L274-L277 HydrophobicContact CD2-CD1 4.09Å; L274-L277 WeakPolarHBondContact O-CB 3.27Å; L274-L277 WeakPolarHBondContact O-CG 3.43Å; L274-L277 PolarHBondContact O-N 2.84Å; L277-S279 PolarHBondContact O-N 3.44Å; L277-L280 HydrophobicContact CB-CB 4.22Å; L277-L280 HydrophobicContact CB-CD2 4.45Å; L277-L280 HydrophobicContact CD1-CD2 4.17Å; L277-L280 WeakPolarHBondContact O-CB 3.21Å; L277-L280 PolarHBondContact O-N 3.11Å; L277-F300 CarbonylContact C-O 3.54Å; L277-F300 VanDerWaalsContact C-O 3.22Å
278	S	89.8	Confident	90.8	Very high	59 Å²	59	28.6 Å²	28.6	41%	0.413	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-11.1	-170.4	57.3	0	0	0	0	116.5	G276 F300 R303	G276-S278 PolarHBondContact O-N 3.2Å; S278-F300 WeakPolarHBondContact CA-O 3.45Å; S278-F300 PolarHBondContact N-O 3.32Å; S278-R303 WeakPolarHBondContact O-CD 3.46Å
279	S	94.8	Very high	91.2	Very high	32 Å²	32	27.3 Å²	27.3	22%	0.224	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	6.8	-179.9	-55.9	0	0	0	0	113.7	S254 M256 L277 T281	S254-S279 WeakPolarHBondContact O-CB 3.49Å; S254-S279 PolarHBondContact O-OG 3.13Å; M256-S279 CarbonylContact O-C 3.48Å; L277-S279 PolarHBondContact O-N 3.44Å; S279-T281 PolarHBondContact O-N 3.43Å
280	L	96.3	Very high	91.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.158	C	C	.	.			trans	-65.9	124.7	-176.5	-167.5	72.9	0	0	0	110.6	M256 L259 L277 L283 C301 R303 L304	M256-L280 HydrophobicContact CE-CD1 4.22Å; M256-L280 HydrophobicContact CG-CD1 4.36Å; M256-L280 VanDerWaalsContact O-CA 3.22Å; M256-L280 WeakPolarHBondContact O-CA 3.49Å; M256-L280 PolarHBondContact O-N 3.1Å; M256-L280 VanDerWaalsContact O-N 3.11Å; L259-L280 HydrophobicContact CB-CD1 3.9Å; L277-L280 HydrophobicContact CB-CB 4.22Å; L277-L280 HydrophobicContact CB-CD2 4.45Å; L277-L280 HydrophobicContact CD1-CD2 4.17Å; L277-L280 WeakPolarHBondContact O-CB 3.21Å; L277-L280 PolarHBondContact O-N 3.11Å; L280-L283 HydrophobicContact CD2-CB 4.11Å; L280-L283 HydrophobicContact CD2-CD1 4.48Å; L280-L283 HydrophobicContact CD2-CD2 4.3Å; L280-C301 HydrophobicContact CB-CB 4.18Å; L280-C301 HydrophobicContact CD2-CB 4.17Å; L280-R303 CarbonylContact O-C 3.52Å; L280-R303 VanDerWaalsContact O-C 3.25Å; L280-L304 HydrophobicContact CD2-CD1 4.14Å; L280-L304 HydrophobicContact CG-CD1 4.08Å; L280-L304 VanDerWaalsContact O-CA 3.32Å; L280-L304 WeakPolarHBondContact O-CA 3.49Å; L280-L304 PolarHBondContact O-N 3.37Å
281	T	97.9	Very high	92.4	Very high	41 Å²	41	27 Å²	27	25%	0.252	17%	0.165	S	C	.	.			trans	-111.8	-24.5	179.3	57.8	0	0	0	0	112.9	K257 S279 R305 E306	K257-T281 PolarHBondContact O-N 3.23Å; K257-T281 PolarHBondContact O-OG1 3.2Å; S279-T281 PolarHBondContact O-N 3.43Å; T281-R305 WeakPolarHBondContact O-CA 3.03Å; T281-R305 PolarHBondContact O-N 2.9Å; T281-E306 PolarHBondContact O-N 2.87Å
282	Q	98.6	Very high	93.1	Very high	62 Å²	62	32.2 Å²	32.2	29%	0.29	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.5	177.4	-58.7	-175.8	-61.5	0	0	111.6	K257 V258 L259 F284 E306	K257-Q282 PolarHBondContact O-N 3.08Å; V258-Q282 HydrophobicContact CG1-CB 4.24Å; V258-Q282 HydrophobicContact CG2-CB 4.33Å; L259-Q282 PolarHBondContact N-O 2.98Å; Q282-F284 HydrophobicContact CB-CE2 3.73Å; Q282-F284 HydrophobicContact CB-CZ 3.95Å; Q282-F284 HydrophobicContact CG-CZ 4.43Å; Q282-E306 WeakPolarHBondContact CA-O 3.34Å; Q282-E306 HydrophobicContact CG-CB 4.13Å; Q282-E306 PolarHBondContact NE2-OE2 3.22Å
283	L	97.6	Very high	93.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	114.2	178.1	179	55.1	0	0	0	110.4	L259 L280 L285 W298 L304 E306 L307 N308	L259-L283 HydrophobicContact CB-CD1 4.05Å; L259-L283 HydrophobicContact CD2-CD1 3.91Å; L259-L283 HydrophobicContact CG-CD1 4.04Å; L280-L283 HydrophobicContact CD2-CB 4.11Å; L280-L283 HydrophobicContact CD2-CD1 4.48Å; L280-L283 HydrophobicContact CD2-CD2 4.3Å; L283-L285 HydrophobicContact CD1-CD1 4.34Å; L283-L285 HydrophobicContact CD1-CD2 4.49Å; L283-L285 HydrophobicContact CD1-CG 4.11Å; L283-L285 HydrophobicContact CD2-CD1 3.93Å; L283-L285 HydrophobicContact CG-CD1 3.91Å; L283-L285 HydrophobicContact CG-CG 4.06Å; L283-W298 HydrophobicContact CD2-CZ3 3.84Å; L283-L304 HydrophobicContact CB-CD1 3.67Å; L283-L304 HydrophobicContact CB-CD2 4.27Å; L283-E306 PolarHBondContact N-O 3.41Å; L283-L307 HydrophobicContact CB-CD1 4.25Å; L283-L307 HydrophobicContact CD2-CD1 4.12Å; L283-L307 HydrophobicContact CG-CD1 4.17Å; L283-N308 PolarHBondContact O-N 3.04Å
284	F	98.6	Very high	93.3	Very high	21 Å²	21	34.9 Å²	34.9	9%	0.092	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	109.1	-178.1	-55.2	-77.4	0	0	0	110.6	V258 L259 H260 L261 E262 Q282 E306 N308	V258-F284 HydrophobicContact CG1-CD2 4.33Å; V258-F284 HydrophobicContact CG1-CE2 3.91Å; L259-F284 PolarHBondContact O-N 3.21Å; H260-F284 AromaticContact CE1-CD2 3.36Å; H260-F284 WeakPolarHBondContact CE1-CD2 3.33Å; H260-F284 AromaticContact CE1-CE2 3.55Å; H260-F284 AromaticContact CG-CD2 3.98Å; H260-F284 AromaticContact ND1-CD2 3.41Å; H260-F284 WeakPolarHBondContact ND1-CD2 3.42Å; H260-F284 AromaticContact ND1-CG 3.94Å; H260-F284 AromaticContact NE2-CD2 3.94Å; H260-F284 AromaticContact NE2-CE2 3.95Å; L261-F284 CarbonylContact C-O 3.04Å; L261-F284 WeakPolarHBondContact CA-O 3.2Å; L261-F284 PolarHBondContact N-O 3.05Å; E262-F284 HydrophobicContact CG-CB 3.67Å; E262-F284 PolarHBondContact N-O 2.67Å; E262-F284 WeakPolarHBondContact OE2-CB 3.5Å; Q282-F284 HydrophobicContact CB-CE2 3.73Å; Q282-F284 HydrophobicContact CB-CZ 3.95Å; Q282-F284 HydrophobicContact CG-CZ 4.43Å; F284-E306 HydrophobicContact CE1-CG 4.27Å; F284-N308 HydrophobicContact CD1-CB 3.8Å
285	L	97.6	Very high	93	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.207	C	C	.	.			trans	-117.2	11.3	-178	-71.6	164.3	0	0	0	112.3	L261 L266 V269 L283 N288 I290 L307 N308 L309 N312	L261-L285 HydrophobicContact CB-CD2 3.89Å; L261-L285 HydrophobicContact CD1-CD2 3.94Å; L266-L285 HydrophobicContact CD1-CD2 3.96Å; V269-L285 HydrophobicContact CG2-CD1 3.94Å; V269-L285 HydrophobicContact CG2-CD2 3.98Å; L283-L285 HydrophobicContact CD1-CD1 4.34Å; L283-L285 HydrophobicContact CD1-CD2 4.49Å; L283-L285 HydrophobicContact CD1-CG 4.11Å; L283-L285 HydrophobicContact CD2-CD1 3.93Å; L283-L285 HydrophobicContact CG-CD1 3.91Å; L283-L285 HydrophobicContact CG-CG 4.06Å; L285-N288 PolarHBondContact O-ND2 3.47Å; L285-I290 HydrophobicContact CB-CD1 3.96Å; L285-I290 HydrophobicContact CD1-CD1 4.28Å; L285-I290 HydrophobicContact CD2-CD1 4.26Å; L285-I290 HydrophobicContact CG-CD1 4.41Å; L285-L307 HydrophobicContact CD1-CD1 4.35Å; L285-N308 CarbonylContact C-O 3.25Å; L285-N308 WeakPolarHBondContact CA-O 3.32Å; L285-N308 PolarHBondContact N-O 3.15Å; L285-L309 HydrophobicContact CB-CD2 3.85Å; L285-L309 HydrophobicContact CD1-CD2 3.84Å; L285-N312 PolarHBondContact O-ND2 3.4Å
286	S	98.3	Very high	92.7	Very high	12 Å²	12	35.6 Å²	35.6	8%	0.084	20%	0.204	C	C	.	.			trans	-65.5	152.6	-174.4	77.7	0	0	0	0	113.3	E262 Y263 N308 S310	E262-S286 CarbonylContact C-O 3.18Å; E262-S286 WeakPolarHBondContact CA-O 3.49Å; E262-S286 VanDerWaalsContact CB-O 3.25Å; E262-S286 WeakPolarHBondContact CB-O 3.38Å; E262-S286 WeakPolarHBondContact CG-OG 3.1Å; Y263-S286 PolarHBondContact N-O 3.01Å; S286-N308 PolarHBondContact N-O 3.09Å; S286-S310 CarbonylContact C-O 3.35Å; S286-S310 WeakPolarHBondContact CA-O 3.32Å; S286-S310 WeakPolarHBondContact CB-O 3.48Å
287	N	98.4	Very high	92.4	Very high	37 Å²	37	34.7 Å²	34.7	20%	0.198	20%	0.195	C	C	.	.	S	Bend	trans	59	57.6	-176.4	-59	-106.3	0	0	0	110.7	Y263 N264 S310 Y311	Y263-N287 WeakPolarHBondContact CA-O 3.49Å; Y263-N287 HydrophobicContact CD1-CB 3.49Å; Y263-N287 VanDerWaalsContact CD1-CB 3.49Å; Y263-N287 HydrophobicContact CD2-CB 4.33Å; Y263-N287 HydrophobicContact CE1-CB 3.65Å; Y263-N287 WeakPolarHBondContact CE1-OD1 3.35Å; Y263-N287 HydrophobicContact CE2-CB 4.47Å; Y263-N287 HydrophobicContact CG-CB 3.84Å; Y263-N287 PolarHBondContact N-O 3.02Å; N264-N287 PolarHBondContact N-O 3.43Å; N287-S310 PolarHBondContact N-O 3.22Å; N287-S310 VanDerWaalsContact N-O 3.16Å; N287-Y311 WeakPolarHBondContact CA-O 3.35Å; N287-Y311 PolarHBondContact N-O 3.36Å
288	N	98.2	Very high	92.3	Very high	13 Å²	13	35.1 Å²	35.1	7%	0.07	20%	0.196	C	C	.	.	S	Bend	trans	-127.8	-164.8	169.5	-84.7	-86.1	0	0	0	108.2	L261 N264 N265 L266 L285 I290 Y311 N312	L261-N288 PolarHBondContact O-ND2 2.93Å; N264-N288 WeakPolarHBondContact CA-OD1 3.25Å; N264-N288 WeakPolarHBondContact CB-OD1 3.34Å; N264-N288 PolarHBondContact O-OD1 3.49Å; N265-N288 PolarHBondContact N-OD1 3.28Å; L266-N288 HydrophobicContact CB-CB 4.29Å; L266-N288 WeakPolarHBondContact CB-OD1 3.28Å; L266-N288 WeakPolarHBondContact CG-OD1 3.2Å; L266-N288 PolarHBondContact N-OD1 3.41Å; L285-N288 PolarHBondContact O-ND2 3.47Å; N288-I290 HydrophobicContact CB-CD1 4.24Å; N288-I290 HydrophobicContact CB-CG1 4.07Å; N288-Y311 PolarHBondContact N-O 3.27Å; N288-N312 WeakPolarHBondContact CA-OD1 3.43Å; N288-N312 WeakPolarHBondContact CB-OD1 3.39Å; N288-N312 PolarHBondContact N-OD1 2.9Å; N288-N312 PolarHBondContact O-OD1 2.93Å
289	S	97.2	Very high	92.1	Very high	49 Å²	49	37.1 Å²	37.1	34%	0.343	20%	0.198	S	C	.	.			trans	-118.3	30.5	176.1	-62.3	0	0	0	0	112.1	L266 A291 N312	L266-S289 CarbonylContact O-C 3.56Å; L266-S289 WeakPolarHBondContact O-CA 3.25Å; L266-S289 PolarHBondContact O-N 3.36Å; S289-A291 PolarHBondContact O-N 3.43Å; S289-N312 PolarHBondContact N-OD1 3.41Å
290	I	95.8	Very high	91.7	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.015	20%	0.202	C	C	.	.			trans	-65.6	117	-174.1	-60.8	169.3	0	0	0	109.4	L266 T267 V269 L285 N288 R292 L309 N312 N313 L314	L266-I290 HydrophobicContact CB-CG1 4.33Å; L266-I290 WeakPolarHBondContact O-CG1 3.39Å; L266-I290 PolarHBondContact O-N 3.26Å; L266-I290 VanDerWaalsContact O-N 3.15Å; T267-I290 WeakPolarHBondContact O-CA 3.46Å; V269-I290 HydrophobicContact CG2-CD1 4.07Å; L285-I290 HydrophobicContact CB-CD1 3.96Å; L285-I290 HydrophobicContact CD1-CD1 4.28Å; L285-I290 HydrophobicContact CD2-CD1 4.26Å; L285-I290 HydrophobicContact CG-CD1 4.41Å; N288-I290 HydrophobicContact CB-CD1 4.24Å; N288-I290 HydrophobicContact CB-CG1 4.07Å; I290-R292 WeakPolarHBondContact CG2-O 3.41Å; I290-L309 HydrophobicContact CD1-CD2 3.82Å; I290-N312 HydrophobicContact CB-CB 4.31Å; I290-N312 VanDerWaalsContact CB-OD1 3.29Å; I290-N312 WeakPolarHBondContact CB-OD1 3.43Å; I290-N312 WeakPolarHBondContact CG1-OD1 3.42Å; I290-N312 PolarHBondContact N-OD1 3.33Å; I290-N313 CarbonylContact O-C 3.28Å; I290-N313 VanDerWaalsContact O-C 3.25Å; I290-N313 WeakPolarHBondContact O-CA 3.34Å; I290-N313 PolarHBondContact O-N 3.48Å; I290-L314 HydrophobicContact CG2-CD2 4.08Å; I290-L314 PolarHBondContact O-N 3.43Å
291	A	93.1	Very high	91.3	Very high	45 Å²	45	39.1 Å²	39.1	37%	0.372	20%	0.202	S	C	.	.			trans	-97.4	-18.6	-175.2	0	0	0	0	0	114	T267 S289	T267-A291 PolarHBondContact O-N 2.86Å; T267-A291 VanDerWaalsContact O-N 3.14Å; S289-A291 PolarHBondContact O-N 3.43Å
292	R	89.1	Confident	91	Very high	150 Å²	150	42.7 Å²	42.7	57%	0.566	22%	0.216	S	C	*	.			trans	-147.3	153.6	-177.8	62.8	-179.4	-176.9	162.4	-0.9	112.7	E268 I290	E268-R292 IonicContact OE1-NH2 2.65Å; E268-R292 IonicContact OE2-CZ 2.72Å; E268-R292 IonicContact OE2-NE 3.48Å; E268-R292 PolarHBondContact OE2-NE 2.71Å; E268-R292 IonicContact OE2-NH2 3.44Å; E268-R292 PolarHBondContact OE2-NH2 3.14Å; I290-R292 WeakPolarHBondContact CG2-O 3.41Å
293	I	88	Confident	90.8	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.128	23%	0.228	C	C	.	.			trans	-99.5	128.6	170.9	-64.9	177.4	0	0	0	108.3	W298 L309 L314 L317 L322 L333	I293-W298 HydrophobicContact CG2-CZ2 4.01Å; I293-W298 VanDerWaalsContact CG2-NE1 3.27Å; I293-L309 HydrophobicContact CD1-CD1 4.05Å; I293-L309 HydrophobicContact CG1-CD1 4.31Å; I293-L314 HydrophobicContact CD1-CD1 4.18Å; I293-L314 HydrophobicContact CG1-CD1 4.32Å; I293-L314 HydrophobicContact CG1-CD2 3.97Å; I293-L317 HydrophobicContact CD1-CD2 3.81Å; I293-L322 HydrophobicContact CD1-CD2 4.36Å; I293-L322 HydrophobicContact CG2-CD2 4.05Å; I293-L333 HydrophobicContact CD1-CD2 4.49Å
294	N	84.1	Confident	90.7	Very high	46 Å²	46	46.6 Å²	46.6	25%	0.246	23%	0.228	C	C	.	.			trans	-103.9	116.2	175.4	-176.4	-21.1	0	0	0	110.1	D296 G297 W298	N294-D296 VanDerWaalsContact C-N 3.25Å; N294-D296 PolarHBondContact O-N 2.89Å; N294-D296 PolarHBondContact OD1-N 3.32Å; N294-G297 PolarHBondContact O-N 2.98Å; N294-W298 PolarHBondContact O-NE1 2.96Å
295	P	81.7	Confident	90.7	Very high	60 Å²	60	52.2 Å²	52.2	39%	0.39	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.7	-176.6	23.9	-33.1	0	0	0	114.3	G297	P295-G297 VanDerWaalsContact C-N 3.34Å; P295-G297 PolarHBondContact O-N 3.3Å
296	D	80.2	Confident	90.7	Very high	71 Å²	71	53.6 Å²	53.6	38%	0.38	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-28.3	-176.4	-79.1	-41.1	0	0	0	113.4	N294 W298 K299	N294-D296 VanDerWaalsContact C-N 3.25Å; N294-D296 PolarHBondContact O-N 2.89Å; N294-D296 PolarHBondContact OD1-N 3.32Å; D296-W298 VanDerWaalsContact C-N 3.33Å; D296-W298 PolarHBondContact O-N 3.34Å; D296-K299 WeakPolarHBondContact O-CB 3.2Å; D296-K299 PolarHBondContact O-N 3.21Å; D296-K299 VanDerWaalsContact OD1-CE 3.25Å; D296-K299 WeakPolarHBondContact OD1-CE 3.42Å; D296-K299 IonicContact OD1-NZ 3.02Å; D296-K299 PolarHBondContact OD1-NZ 3.37Å
297	G	75.6	Confident	90.7	Very high	2 Å²	2	53 Å²	53	2%	0.021	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-71.2	-29.4	-178.7	0	0	0	0	0	113.9	N294 P295 K299	N294-G297 PolarHBondContact O-N 2.98Å; P295-G297 VanDerWaalsContact C-N 3.34Å; P295-G297 PolarHBondContact O-N 3.3Å; G297-K299 PolarHBondContact O-N 3.48Å
298	W	87.2	Confident	90.7	Very high	8 Å²	8	52.3 Å²	52.3	3%	0.03	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-69.9	-17.7	179	-52.2	136	0	0	0	113.3	L274 L283 I293 N294 D296 F300 C301 L307 S321 V324 L325	L274-W298 HydrophobicContact CD1-CE3 3.99Å; L274-W298 HydrophobicContact CD1-CZ3 3.78Å; L283-W298 HydrophobicContact CD2-CZ3 3.84Å; I293-W298 HydrophobicContact CG2-CZ2 4.01Å; I293-W298 VanDerWaalsContact CG2-NE1 3.27Å; N294-W298 PolarHBondContact O-NE1 2.96Å; D296-W298 VanDerWaalsContact C-N 3.33Å; D296-W298 PolarHBondContact O-N 3.34Å; W298-F300 PolarHBondContact O-N 2.72Å; W298-F300 VanDerWaalsContact O-N 3.12Å; W298-C301 PolarHBondContact O-N 2.99Å; W298-L307 HydrophobicContact CH2-CD1 4.18Å; W298-L307 HydrophobicContact CH2-CD2 4.17Å; W298-L307 HydrophobicContact CZ2-CD2 4.25Å; W298-L307 HydrophobicContact CZ3-CD1 4.42Å; W298-S321 VanDerWaalsContact CD1-O 3.27Å; W298-S321 PolarHBondContact NE1-O 2.99Å; W298-V324 HydrophobicContact CB-CG2 3.36Å; W298-L325 HydrophobicContact CB-CD1 4.31Å; W298-L325 HydrophobicContact CB-CD2 3.79Å; W298-L325 HydrophobicContact CB-CG 3.93Å; W298-L325 HydrophobicContact CD2-CD1 4.09Å; W298-L325 HydrophobicContact CE3-CD1 4.45Å; W298-L325 HydrophobicContact CG-CD1 3.99Å; W298-L325 HydrophobicContact CG-CD2 4.32Å; W298-L325 HydrophobicContact CG-CG 4.15Å
299	K	85.8	Confident	90.7	Very high	102 Å²	102	51.9 Å²	51.9	44%	0.443	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-58.6	-24.8	178.1	-68.3	176.6	173	171.8	0	113.2	D296 G297 Q302	D296-K299 WeakPolarHBondContact O-CB 3.2Å; D296-K299 PolarHBondContact O-N 3.21Å; D296-K299 VanDerWaalsContact OD1-CE 3.25Å; D296-K299 WeakPolarHBondContact OD1-CE 3.42Å; D296-K299 IonicContact OD1-NZ 3.02Å; D296-K299 PolarHBondContact OD1-NZ 3.37Å; G297-K299 PolarHBondContact O-N 3.48Å; K299-Q302 PolarHBondContact O-NE2 3.21Å
300	F	86.1	Confident	90.8	Very high	74 Å²	74	50.1 Å²	50.1	33%	0.325	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-95.6	-9.9	-177.1	-56	-58.3	0	0	0	114.9	S271 L274 Y275 L277 S278 W298	S271-F300 WeakPolarHBondContact O-CD2 3.38Å; S271-F300 WeakPolarHBondContact O-CE2 3.48Å; L274-F300 WeakPolarHBondContact O-CB 3.31Å; Y275-F300 AromaticContact CD2-CD1 3.78Å; Y275-F300 HydrophobicContact CD2-CD1 3.78Å; Y275-F300 HydrophobicContact CD2-CD2 4.28Å; Y275-F300 AromaticContact CD2-CE1 3.61Å; Y275-F300 HydrophobicContact CD2-CE1 3.61Å; Y275-F300 HydrophobicContact CD2-CE2 4.11Å; Y275-F300 HydrophobicContact CD2-CG 4.13Å; Y275-F300 AromaticContact CD2-CZ 3.78Å; Y275-F300 HydrophobicContact CD2-CZ 3.78Å; Y275-F300 HydrophobicContact CE2-CD1 4.28Å; Y275-F300 AromaticContact CE2-CE1 3.93Å; Y275-F300 HydrophobicContact CE2-CE1 3.93Å; Y275-F300 HydrophobicContact CE2-CZ 4.36Å; L277-F300 CarbonylContact C-O 3.54Å; L277-F300 VanDerWaalsContact C-O 3.22Å; S278-F300 WeakPolarHBondContact CA-O 3.45Å; S278-F300 PolarHBondContact N-O 3.32Å; W298-F300 PolarHBondContact O-N 2.72Å; W298-F300 VanDerWaalsContact O-N 3.12Å
301	C	88.3	Confident	90.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.254	C	S	.	.			trans	-129.5	40.3	-176.4	55	0	0	0	0	112.8	L280 W298 R303 L304	L280-C301 HydrophobicContact CB-CB 4.18Å; L280-C301 HydrophobicContact CD2-CB 4.17Å; W298-C301 PolarHBondContact O-N 2.99Å; C301-R303 PolarHBondContact O-N 3.22Å; C301-L304 VanDerWaalsContact O-CB 3.27Å; C301-L304 WeakPolarHBondContact O-CB 3.38Å; C301-L304 PolarHBondContact O-N 2.93Å
302	Q	90.9	Very high	91.1	Very high	115 Å²	115	54.3 Å²	54.3	54%	0.537	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.2	-174	-61.9	172.3	25.5	0	0	115.3	K299 L304	K299-Q302 PolarHBondContact O-NE2 3.21Å; Q302-L304 VanDerWaalsContact C-N 3.27Å; Q302-L304 PolarHBondContact O-N 3.48Å
303	R	94.4	Very high	91.5	Very high	144 Å²	144	51.1 Å²	51.1	54%	0.543	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5.4	176.3	-69.3	-176.9	174.6	153.6	-5.3	114.3	S278 L280 C301 R305	S278-R303 WeakPolarHBondContact O-CD 3.46Å; L280-R303 CarbonylContact O-C 3.52Å; L280-R303 VanDerWaalsContact O-C 3.25Å; C301-R303 PolarHBondContact O-N 3.22Å; R303-R305 PolarHBondContact O-N 3.35Å
304	L	96.4	Very high	91.9	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.229	C	C	.	.			trans	-61.9	123.1	-178.2	-166.5	70.9	0	0	0	110.5	L280 L283 C301 Q302 L307 L325 D327 L328	L280-L304 HydrophobicContact CD2-CD1 4.14Å; L280-L304 HydrophobicContact CG-CD1 4.08Å; L280-L304 VanDerWaalsContact O-CA 3.32Å; L280-L304 WeakPolarHBondContact O-CA 3.49Å; L280-L304 PolarHBondContact O-N 3.37Å; L283-L304 HydrophobicContact CB-CD1 3.67Å; L283-L304 HydrophobicContact CB-CD2 4.27Å; C301-L304 VanDerWaalsContact O-CB 3.27Å; C301-L304 WeakPolarHBondContact O-CB 3.38Å; C301-L304 PolarHBondContact O-N 2.93Å; Q302-L304 VanDerWaalsContact C-N 3.27Å; Q302-L304 PolarHBondContact O-N 3.48Å; L304-L307 HydrophobicContact CD2-CB 3.85Å; L304-L307 HydrophobicContact CD2-CD1 4.17Å; L304-L307 HydrophobicContact CD2-CD2 4.38Å; L304-L307 HydrophobicContact CD2-CG 4.35Å; L304-L325 HydrophobicContact CB-CD2 4.15Å; L304-L325 HydrophobicContact CD2-CD1 4.33Å; L304-L325 HydrophobicContact CD2-CD2 4.38Å; L304-D327 CarbonylContact O-C 3.4Å; L304-L328 HydrophobicContact CB-CD1 4.44Å; L304-L328 HydrophobicContact CD2-CD1 4.21Å; L304-L328 HydrophobicContact CG-CD1 4.08Å; L304-L328 WeakPolarHBondContact O-CA 3.26Å; L304-L328 PolarHBondContact O-N 3.18Å
305	R	97.9	Very high	92.3	Very high	140 Å²	140	50.9 Å²	50.9	53%	0.528	24%	0.236	S	C	.	.			trans	-101.8	-26.9	178.2	-65	-173.4	176.5	-169.1	-3.3	112.5	T281 R303 H329 T330	T281-R305 WeakPolarHBondContact O-CA 3.03Å; T281-R305 PolarHBondContact O-N 2.9Å; R303-R305 PolarHBondContact O-N 3.35Å; R305-H329 WeakPolarHBondContact O-CA 3.32Å; R305-H329 WeakPolarHBondContact O-CB 3.28Å; R305-H329 PolarHBondContact O-N 3.22Å; R305-T330 PolarHBondContact O-N 3.26Å
306	E	98.5	Very high	92.8	Very high	30 Å²	30	52.1 Å²	52.1	14%	0.14	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123.3	179.3	-174.2	169	-169.5	0	0	111.4	T281 Q282 L283 F284 T330 R332	T281-E306 PolarHBondContact O-N 2.87Å; Q282-E306 WeakPolarHBondContact CA-O 3.34Å; Q282-E306 HydrophobicContact CG-CB 4.13Å; Q282-E306 PolarHBondContact NE2-OE2 3.22Å; L283-E306 PolarHBondContact N-O 3.41Å; F284-E306 HydrophobicContact CE1-CG 4.27Å; E306-T330 WeakPolarHBondContact CA-O 3.3Å; E306-T330 HydrophobicContact CG-CG2 4.13Å; E306-R332 IonicContact OE1-CZ 3.2Å; E306-R332 IonicContact OE1-NH1 2.91Å; E306-R332 PolarHBondContact OE1-NH1 3.34Å; E306-R332 IonicContact OE1-NH2 2.67Å; E306-R332 PolarHBondContact OE1-NH2 3.12Å
307	L	97.9	Very high	93.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.7	174.9	179.5	55.4	0	0	0	109	L283 L285 W298 L304 L309 L322 L325 L328 T330 L331 R332	L283-L307 HydrophobicContact CB-CD1 4.25Å; L283-L307 HydrophobicContact CD2-CD1 4.12Å; L283-L307 HydrophobicContact CG-CD1 4.17Å; L285-L307 HydrophobicContact CD1-CD1 4.35Å; W298-L307 HydrophobicContact CH2-CD1 4.18Å; W298-L307 HydrophobicContact CH2-CD2 4.17Å; W298-L307 HydrophobicContact CZ2-CD2 4.25Å; W298-L307 HydrophobicContact CZ3-CD1 4.42Å; L304-L307 HydrophobicContact CD2-CB 3.85Å; L304-L307 HydrophobicContact CD2-CD1 4.17Å; L304-L307 HydrophobicContact CD2-CD2 4.38Å; L304-L307 HydrophobicContact CD2-CG 4.35Å; L307-L309 HydrophobicContact CD1-CD1 4.22Å; L307-L309 HydrophobicContact CD1-CG 4.11Å; L307-L309 HydrophobicContact CD2-CD1 3.9Å; L307-L309 HydrophobicContact CG-CD1 3.99Å; L307-L309 HydrophobicContact CG-CG 4.19Å; L307-L322 HydrophobicContact CD2-CD2 4.13Å; L307-L325 HydrophobicContact CD2-CD1 4.08Å; L307-L328 HydrophobicContact CB-CD1 3.88Å; L307-L328 HydrophobicContact CB-CD2 4.45Å; L307-T330 PolarHBondContact N-O 3.29Å; L307-L331 HydrophobicContact CB-CD1 4.13Å; L307-L331 HydrophobicContact CD2-CD1 4.06Å; L307-L331 HydrophobicContact CG-CD1 4.13Å; L307-R332 PolarHBondContact O-N 3.38Å
308	N	98.6	Very high	93.9	Very high	22 Å²	22	51.5 Å²	51.5	12%	0.118	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	103.2	178.5	-174.5	-2.4	0	0	0	111	L283 F284 L285 S286 S310 R332	L283-N308 PolarHBondContact O-N 3.04Å; F284-N308 HydrophobicContact CD1-CB 3.8Å; L285-N308 CarbonylContact C-O 3.25Å; L285-N308 WeakPolarHBondContact CA-O 3.32Å; L285-N308 PolarHBondContact N-O 3.15Å; S286-N308 PolarHBondContact N-O 3.09Å; N308-S310 WeakPolarHBondContact OD1-CB 3.38Å; N308-S310 PolarHBondContact OD1-N 3.03Å; N308-S310 PolarHBondContact OD1-OG 3.34Å; N308-R332 HydrophobicContact CB-CB 4.45Å
309	L	97.9	Very high	93.9	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.016	25%	0.252	C	S	.	.			trans	-110.5	12.8	177.2	-76.5	164.8	0	0	0	112.1	L285 I290 I293 L307 N312 L314 R332 L333 N336	L285-L309 HydrophobicContact CB-CD2 3.85Å; L285-L309 HydrophobicContact CD1-CD2 3.84Å; I290-L309 HydrophobicContact CD1-CD2 3.82Å; I293-L309 HydrophobicContact CD1-CD1 4.05Å; I293-L309 HydrophobicContact CG1-CD1 4.31Å; L307-L309 HydrophobicContact CD1-CD1 4.22Å; L307-L309 HydrophobicContact CD1-CG 4.11Å; L307-L309 HydrophobicContact CD2-CD1 3.9Å; L307-L309 HydrophobicContact CG-CD1 3.99Å; L307-L309 HydrophobicContact CG-CG 4.19Å; L309-N312 WeakPolarHBondContact O-CB 3.47Å; L309-N312 PolarHBondContact O-ND2 3.2Å; L309-L314 HydrophobicContact CB-CD1 4.27Å; L309-L314 HydrophobicContact CD1-CD1 4.48Å; L309-R332 CarbonylContact C-O 3.27Å; L309-R332 WeakPolarHBondContact CA-O 3.23Å; L309-R332 PolarHBondContact N-O 2.99Å; L309-L333 HydrophobicContact CB-CD2 3.82Å; L309-L333 HydrophobicContact CD1-CD2 4.12Å; L309-N336 PolarHBondContact O-ND2 3.08Å
310	S	98.5	Very high	93.9	Very high	12 Å²	12	52.8 Å²	52.8	8%	0.084	25%	0.245	C	C	.	.			trans	-61.8	155.9	177.3	-63.5	0	0	0	0	112.9	S286 N287 N308 N312 R332 G334	S286-S310 CarbonylContact C-O 3.35Å; S286-S310 WeakPolarHBondContact CA-O 3.32Å; S286-S310 WeakPolarHBondContact CB-O 3.48Å; N287-S310 PolarHBondContact N-O 3.22Å; N287-S310 VanDerWaalsContact N-O 3.16Å; N308-S310 WeakPolarHBondContact OD1-CB 3.38Å; N308-S310 PolarHBondContact OD1-N 3.03Å; N308-S310 PolarHBondContact OD1-OG 3.34Å; S310-N312 PolarHBondContact O-ND2 3.33Å; S310-R332 PolarHBondContact N-O 2.99Å; S310-R332 WeakPolarHBondContact OG-CB 3.29Å; S310-G334 CarbonylContact C-O 3.3Å; S310-G334 WeakPolarHBondContact CA-O 3.28Å; S310-G334 WeakPolarHBondContact CB-O 3.49Å; S310-G334 PolarHBondContact OG-N 3.44Å; S310-G334 VanDerWaalsContact OG-N 3.17Å; S310-G334 PolarHBondContact OG-O 2.95Å
311	Y	98.4	Very high	93.9	Very high	119 Å²	119	49.5 Å²	49.5	47%	0.467	23%	0.232	S	C	.	.	S	Bend	trans	55.1	62.1	-174.5	-57.7	-103	0	0	0	111.5	N287 N288 G334 R335	N287-Y311 WeakPolarHBondContact CA-O 3.35Å; N287-Y311 PolarHBondContact N-O 3.36Å; N288-Y311 PolarHBondContact N-O 3.27Å; Y311-G334 PolarHBondContact N-O 3.3Å; Y311-R335 WeakPolarHBondContact CA-O 3.15Å; Y311-R335 HydrophobicContact CD1-CB 4.19Å; Y311-R335 HydrophobicContact CD2-CB 4.48Å; Y311-R335 HydrophobicContact CE1-CG 4.49Å; Y311-R335 HydrophobicContact CG-CB 4.18Å; Y311-R335 PolarHBondContact N-O 3.33Å; Y311-R335 VanDerWaalsContact N-O 3.07Å; Y311-R335 PolarHBondContact OH-NE 3.43Å
312	N	98.4	Very high	94.1	Very high	17 Å²	17	49.6 Å²	49.6	9%	0.091	23%	0.232	C	C	.	.	S	Bend	trans	-139.9	-169.2	176	-87.3	-76.4	0	0	0	109.5	L285 N288 S289 I290 L309 S310 R335 N336	L285-N312 PolarHBondContact O-ND2 3.4Å; N288-N312 WeakPolarHBondContact CA-OD1 3.43Å; N288-N312 WeakPolarHBondContact CB-OD1 3.39Å; N288-N312 PolarHBondContact N-OD1 2.9Å; N288-N312 PolarHBondContact O-OD1 2.93Å; S289-N312 PolarHBondContact N-OD1 3.41Å; I290-N312 HydrophobicContact CB-CB 4.31Å; I290-N312 VanDerWaalsContact CB-OD1 3.29Å; I290-N312 WeakPolarHBondContact CB-OD1 3.43Å; I290-N312 WeakPolarHBondContact CG1-OD1 3.42Å; I290-N312 PolarHBondContact N-OD1 3.33Å; L309-N312 WeakPolarHBondContact O-CB 3.47Å; L309-N312 PolarHBondContact O-ND2 3.2Å; S310-N312 PolarHBondContact O-ND2 3.33Å; N312-R335 PolarHBondContact N-O 3.04Å; N312-N336 VanDerWaalsContact CA-OD1 3.28Å; N312-N336 WeakPolarHBondContact CA-OD1 3.33Å; N312-N336 WeakPolarHBondContact CB-OD1 3.29Å; N312-N336 PolarHBondContact O-OD1 3.23Å
313	N	97.3	Very high	94	Very high	84 Å²	84	46 Å²	46	45%	0.449	22%	0.222	S	C	.	.			trans	-114.2	28.2	-175.7	-163.1	38.2	0	0	0	112.8	I290 N336	I290-N313 CarbonylContact O-C 3.28Å; I290-N313 VanDerWaalsContact O-C 3.25Å; I290-N313 WeakPolarHBondContact O-CA 3.34Å; I290-N313 PolarHBondContact O-N 3.48Å; N313-N336 PolarHBondContact N-OD1 3.42Å
314	L	96.4	Very high	93.9	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.213	C	C	.	.			trans	-66.9	133.1	178.7	-60.9	173.9	0	0	0	110.2	I290 I293 L309 L333 N336 S337 I338	I290-L314 HydrophobicContact CG2-CD2 4.08Å; I290-L314 PolarHBondContact O-N 3.43Å; I293-L314 HydrophobicContact CD1-CD1 4.18Å; I293-L314 HydrophobicContact CG1-CD1 4.32Å; I293-L314 HydrophobicContact CG1-CD2 3.97Å; L309-L314 HydrophobicContact CB-CD1 4.27Å; L309-L314 HydrophobicContact CD1-CD1 4.48Å; L314-L333 HydrophobicContact CD1-CD2 3.5Å; L314-N336 HydrophobicContact CB-CB 4.09Å; L314-N336 VanDerWaalsContact CB-OD1 3.28Å; L314-N336 WeakPolarHBondContact CB-OD1 3.41Å; L314-N336 VanDerWaalsContact CG-OD1 3.32Å; L314-N336 WeakPolarHBondContact CG-OD1 3.43Å; L314-N336 PolarHBondContact N-OD1 3.16Å; L314-S337 CarbonylContact O-C 3.58Å; L314-S337 WeakPolarHBondContact O-CA 3.45Å; L314-S337 PolarHBondContact O-N 3.45Å; L314-I338 HydrophobicContact CB-CD1 4.2Å; L314-I338 HydrophobicContact CB-CG1 3.9Å; L314-I338 WeakPolarHBondContact O-CG1 3.22Å; L314-I338 PolarHBondContact O-N 3.47Å; L314-I338 VanDerWaalsContact O-N 3.1Å
315	T	93.1	Very high	93.7	Very high	65 Å²	65	41.9 Å²	41.9	40%	0.399	21%	0.213	S	C	.	.			trans	-111.5	-20.7	-178.4	54.7	0	0	0	0	114.6	S337 I338 S339	T315-S337 WeakPolarHBondContact CA-O 3.17Å; T315-I338 WeakPolarHBondContact O-CA 3.31Å; T315-S339 PolarHBondContact O-N 2.87Å; T315-S339 PolarHBondContact O-OG 3.27Å
316	R	91.3	Very high	93.5	Very high	86 Å²	86	36.6 Å²	36.6	33%	0.325	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.2	-177.2	65.3	-169.7	-74.3	151.5	-6.4	111.8	D318 H340 E530	R316-D318 IonicContact CZ-OD1 2.69Å; R316-D318 IonicContact NE-OD1 3.27Å; R316-D318 PolarHBondContact NE-OD1 2.98Å; R316-D318 IonicContact NE-OD2 2.73Å; R316-D318 PolarHBondContact NE-OD2 3.39Å; R316-D318 IonicContact NH2-OD1 2.78Å; R316-D318 PolarHBondContact NH2-OD1 3.06Å; R316-H340 CarbonylContact C-O 3.46Å; R316-H340 VanDerWaalsContact CA-O 3.25Å; R316-H340 WeakPolarHBondContact CA-O 3.31Å; R316-H340 HydrophobicContact CB-CB 4.39Å; R316-E530 IonicContact CZ-OE1 3.14Å; R316-E530 IonicContact NH1-OE1 2.85Å; R316-E530 PolarHBondContact NH1-OE1 3.32Å; R316-E530 IonicContact NH2-OE1 2.76Å; R316-E530 PolarHBondContact NH2-OE1 2.88Å
317	L	91.7	Very high	93.4	Very high	3 Å²	3	39 Å²	39	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.3	166.7	-59.5	175.3	0	0	0	109.5	I293 L333 I338 H340 I341 N342 A345 F346 L357	I293-L317 HydrophobicContact CD1-CD2 3.81Å; L317-L333 HydrophobicContact CD1-CD1 3.89Å; L317-L333 HydrophobicContact CD2-CD1 4.18Å; L317-I338 HydrophobicContact CD1-CD1 4.4Å; L317-I338 HydrophobicContact CD1-CG2 4.46Å; L317-I338 HydrophobicContact CD2-CD1 4.22Å; L317-I338 HydrophobicContact CG-CD1 4.28Å; L317-I338 HydrophobicContact CG-CG2 4.19Å; L317-H340 PolarHBondContact N-O 2.94Å; L317-I341 HydrophobicContact CB-CG2 4.23Å; L317-I341 HydrophobicContact CD1-CD1 4.06Å; L317-I341 HydrophobicContact CD1-CG1 4.05Å; L317-I341 HydrophobicContact CD1-CG2 4.26Å; L317-I341 HydrophobicContact CG-CG1 4.47Å; L317-N342 WeakPolarHBondContact O-CB 3.41Å; L317-N342 PolarHBondContact O-N 2.81Å; L317-A345 HydrophobicContact CB-CB 4.01Å; L317-F346 HydrophobicContact CD1-CE1 3.77Å; L317-F346 HydrophobicContact CD1-CZ 3.56Å; L317-L357 HydrophobicContact CD1-CD2 4.44Å
318	D	87.9	Confident	93.3	Very high	57 Å²	57	39 Å²	39	31%	0.305	22%	0.215	S	C	.	.			trans	-92.1	155.3	-174.3	-67.1	-69	0	0	0	113.1	R316 G320 S321 N342	R316-D318 IonicContact CZ-OD1 2.69Å; R316-D318 IonicContact NE-OD1 3.27Å; R316-D318 PolarHBondContact NE-OD1 2.98Å; R316-D318 IonicContact NE-OD2 2.73Å; R316-D318 PolarHBondContact NE-OD2 3.39Å; R316-D318 IonicContact NH2-OD1 2.78Å; R316-D318 PolarHBondContact NH2-OD1 3.06Å; D318-G320 PolarHBondContact O-N 2.96Å; D318-S321 VanDerWaalsContact O-CB 3.26Å; D318-S321 WeakPolarHBondContact O-CB 3.34Å; D318-S321 PolarHBondContact O-N 3.24Å; D318-S321 PolarHBondContact O-OG 3.17Å; D318-N342 PolarHBondContact OD1-ND2 3.33Å
319	E	87.2	Confident	93.3	Very high	107 Å²	107	40.6 Å²	40.6	50%	0.5	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	133	176.4	-172.3	178.9	179.9	0	0	110.1	S321 R347	E319-S321 PolarHBondContact O-N 3.18Å; E319-S321 VanDerWaalsContact O-N 3.08Å; E319-R347 IonicContact OE1-NH1 2.7Å; E319-R347 PolarHBondContact OE1-NH1 3Å
320	G	84	Confident	93.4	Very high	29 Å²	29	41.6 Å²	41.6	30%	0.299	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	-4.8	177	0	0	0	0	0	115.9	D318 L322 A323	D318-G320 PolarHBondContact O-N 2.96Å; G320-L322 PolarHBondContact O-N 2.91Å; G320-A323 WeakPolarHBondContact O-CB 3.33Å; G320-A323 PolarHBondContact O-N 3.36Å
321	S	87.9	Confident	93.4	Very high	6 Å²	6	41 Å²	41	4%	0.042	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.2	-175.3	58.4	0	0	0	0	115	W298 D318 E319	W298-S321 VanDerWaalsContact CD1-O 3.27Å; W298-S321 PolarHBondContact NE1-O 2.99Å; D318-S321 VanDerWaalsContact O-CB 3.26Å; D318-S321 WeakPolarHBondContact O-CB 3.34Å; D318-S321 PolarHBondContact O-N 3.24Å; D318-S321 PolarHBondContact O-OG 3.17Å; E319-S321 PolarHBondContact O-N 3.18Å; E319-S321 VanDerWaalsContact O-N 3.08Å
322	L	91.4	Very high	93.4	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	4.9	177.9	-64.2	168	0	0	0	113.6	I293 L307 G320 V324 L325 L331 L349	I293-L322 HydrophobicContact CD1-CD2 4.36Å; I293-L322 HydrophobicContact CG2-CD2 4.05Å; L307-L322 HydrophobicContact CD2-CD2 4.13Å; G320-L322 PolarHBondContact O-N 2.91Å; L322-V324 PolarHBondContact O-N 3.14Å; L322-L325 HydrophobicContact CD2-CD1 3.95Å; L322-L325 WeakPolarHBondContact O-CB 3.4Å; L322-L325 PolarHBondContact O-N 2.91Å; L322-L331 HydrophobicContact CD1-CD2 3.67Å; L322-L349 HydrophobicContact CB-CD1 4.28Å; L322-L349 HydrophobicContact CB-CD2 4.14Å; L322-L349 HydrophobicContact CD1-CD1 4.37Å; L322-L349 WeakPolarHBondContact O-CD2 3.13Å
323	A	90	Very high	93.4	Very high	41 Å²	41	37.7 Å²	37.7	34%	0.339	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.7	-163.3	0	0	0	0	0	116.2	G320 L325 R347	G320-A323 WeakPolarHBondContact O-CB 3.33Å; G320-A323 PolarHBondContact O-N 3.36Å; A323-L325 VanDerWaalsContact C-N 3.32Å; A323-R347 WeakPolarHBondContact CA-O 3.37Å; A323-R347 WeakPolarHBondContact CB-O 3.43Å
324	V	90.6	Very high	93.4	Very high	57 Å²	57	34 Å²	34	35%	0.345	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.6	178	-58.1	0	0	0	0	113.5	W298 L322 G326	W298-V324 HydrophobicContact CB-CG2 3.36Å; L322-V324 PolarHBondContact O-N 3.14Å; V324-G326 PolarHBondContact O-N 2.96Å; V324-G326 VanDerWaalsContact O-N 3.1Å
325	L	93.2	Very high	93.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.			trans	-87.1	53.1	179.9	-60.6	179.3	0	0	0	111.6	W298 L304 L307 L322 A323 D327 L328 L349	W298-L325 HydrophobicContact CB-CD1 4.31Å; W298-L325 HydrophobicContact CB-CD2 3.79Å; W298-L325 HydrophobicContact CB-CG 3.93Å; W298-L325 HydrophobicContact CD2-CD1 4.09Å; W298-L325 HydrophobicContact CE3-CD1 4.45Å; W298-L325 HydrophobicContact CG-CD1 3.99Å; W298-L325 HydrophobicContact CG-CD2 4.32Å; W298-L325 HydrophobicContact CG-CG 4.15Å; L304-L325 HydrophobicContact CB-CD2 4.15Å; L304-L325 HydrophobicContact CD2-CD1 4.33Å; L304-L325 HydrophobicContact CD2-CD2 4.38Å; L307-L325 HydrophobicContact CD2-CD1 4.08Å; L322-L325 HydrophobicContact CD2-CD1 3.95Å; L322-L325 WeakPolarHBondContact O-CB 3.4Å; L322-L325 PolarHBondContact O-N 2.91Å; A323-L325 VanDerWaalsContact C-N 3.32Å; L325-D327 PolarHBondContact O-N 2.99Å; L325-L328 HydrophobicContact CB-CB 4.12Å; L325-L328 HydrophobicContact CB-CD2 4.47Å; L325-L328 HydrophobicContact CD1-CD2 4.37Å; L325-L328 WeakPolarHBondContact O-CB 3.34Å; L325-L328 PolarHBondContact O-N 3.1Å; L325-L349 HydrophobicContact CB-CD2 3.91Å; L325-L349 VanDerWaalsContact O-CD2 3.32Å; L325-L349 WeakPolarHBondContact O-CD2 3.35Å
326	G	93.6	Very high	93.7	Very high	28 Å²	28	36.5 Å²	36.5	29%	0.289	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.9	-174	0	0	0	0	0	115	V324 A351	V324-G326 PolarHBondContact O-N 2.96Å; V324-G326 VanDerWaalsContact O-N 3.1Å; G326-A351 WeakPolarHBondContact O-CB 3.12Å; G326-A351 PolarHBondContact O-N 3.1Å
327	D	95.6	Very high	94	Very high	80 Å²	80	34.6 Å²	34.6	43%	0.428	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.1	177.8	-81	-4.1	0	0	0	113.9	L304 L325 H329	L304-D327 CarbonylContact O-C 3.4Å; L325-D327 PolarHBondContact O-N 2.99Å; D327-H329 PolarHBondContact O-CE1 2.79Å; D327-H329 PolarHBondContact O-N 3.18Å; D327-H329 PolarHBondContact O-ND1 3.09Å
328	L	97.5	Very high	94.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.			trans	-66.6	123.2	-174.8	-164.8	71.5	0	0	0	111.6	L304 L307 L325 L331 L349 A351 L352	L304-L328 HydrophobicContact CB-CD1 4.44Å; L304-L328 HydrophobicContact CD2-CD1 4.21Å; L304-L328 HydrophobicContact CG-CD1 4.08Å; L304-L328 WeakPolarHBondContact O-CA 3.26Å; L304-L328 PolarHBondContact O-N 3.18Å; L307-L328 HydrophobicContact CB-CD1 3.88Å; L307-L328 HydrophobicContact CB-CD2 4.45Å; L325-L328 HydrophobicContact CB-CB 4.12Å; L325-L328 HydrophobicContact CB-CD2 4.47Å; L325-L328 HydrophobicContact CD1-CD2 4.37Å; L325-L328 WeakPolarHBondContact O-CB 3.34Å; L325-L328 PolarHBondContact O-N 3.1Å; L328-L331 HydrophobicContact CD2-CB 4Å; L328-L331 HydrophobicContact CD2-CD1 4.31Å; L328-L331 HydrophobicContact CD2-CD2 4.42Å; L328-L331 HydrophobicContact CD2-CG 4.48Å; L328-L349 HydrophobicContact CB-CD2 4.28Å; L328-L349 HydrophobicContact CD2-CD2 4.16Å; L328-A351 CarbonylContact O-C 3.56Å; L328-L352 HydrophobicContact CB-CD1 4.48Å; L328-L352 HydrophobicContact CD2-CD1 4.16Å; L328-L352 HydrophobicContact CG-CD1 4.11Å; L328-L352 WeakPolarHBondContact O-CA 3.29Å; L328-L352 PolarHBondContact O-N 3.41Å
329	H	98.1	Very high	94.2	Very high	56 Å²	56	33.3 Å²	33.3	26%	0.259	19%	0.19	S	C	.	.			trans	-99.9	-36.1	179.8	-76.5	51.9	0	0	0	112.4	R305 D327 R353 V354	R305-H329 WeakPolarHBondContact O-CA 3.32Å; R305-H329 WeakPolarHBondContact O-CB 3.28Å; R305-H329 PolarHBondContact O-N 3.22Å; D327-H329 PolarHBondContact O-CE1 2.79Å; D327-H329 PolarHBondContact O-N 3.18Å; D327-H329 PolarHBondContact O-ND1 3.09Å; H329-R353 PolarHBondContact O-N 3.05Å; H329-V354 PolarHBondContact O-N 2.98Å
330	T	98.7	Very high	94.1	Very high	25 Å²	25	31.5 Å²	31.5	15%	0.153	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	122.6	-175.6	-60.3	0	0	0	0	110.3	R305 E306 L307 R332 V354	R305-T330 PolarHBondContact O-N 3.26Å; E306-T330 WeakPolarHBondContact CA-O 3.3Å; E306-T330 HydrophobicContact CG-CG2 4.13Å; L307-T330 PolarHBondContact N-O 3.29Å; T330-R332 HydrophobicContact CG2-CG 4.2Å; T330-V354 WeakPolarHBondContact CA-O 3.36Å; T330-V354 HydrophobicContact CG2-CB 4.24Å; T330-V354 HydrophobicContact CG2-CG1 4.28Å
331	L	98.4	Very high	94.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118.4	174.5	178.1	55.9	0	0	0	109.5	L307 L322 L328 L333 F346 L349 L352 V354 L355 E356	L307-L331 HydrophobicContact CB-CD1 4.13Å; L307-L331 HydrophobicContact CD2-CD1 4.06Å; L307-L331 HydrophobicContact CG-CD1 4.13Å; L322-L331 HydrophobicContact CD1-CD2 3.67Å; L328-L331 HydrophobicContact CD2-CB 4Å; L328-L331 HydrophobicContact CD2-CD1 4.31Å; L328-L331 HydrophobicContact CD2-CD2 4.42Å; L328-L331 HydrophobicContact CD2-CG 4.48Å; L331-L333 HydrophobicContact CD1-CD1 4.13Å; L331-L333 HydrophobicContact CD1-CG 4.06Å; L331-L333 HydrophobicContact CD2-CD1 3.87Å; L331-L333 HydrophobicContact CG-CD1 3.85Å; L331-L333 HydrophobicContact CG-CG 4.12Å; L331-F346 HydrophobicContact CD2-CD1 4.25Å; L331-F346 HydrophobicContact CD2-CE1 4.01Å; L331-L349 HydrophobicContact CD2-CD1 4.15Å; L331-L352 HydrophobicContact CB-CD1 3.81Å; L331-V354 PolarHBondContact N-O 2.62Å; L331-L355 HydrophobicContact CB-CD1 4.14Å; L331-L355 HydrophobicContact CD2-CD1 3.96Å; L331-L355 HydrophobicContact CG-CD1 4.02Å; L331-L355 WeakPolarHBondContact O-CA 3.25Å; L331-E356 PolarHBondContact O-N 3.08Å
332	R	98.8	Very high	94.2	Very high	65 Å²	65	31.2 Å²	31.2	25%	0.245	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.1	174.9	-52.3	-167.3	173.4	98.2	10.2	111.2	E306 L307 N308 L309 S310 T330 E356	E306-R332 IonicContact OE1-CZ 3.2Å; E306-R332 IonicContact OE1-NH1 2.91Å; E306-R332 PolarHBondContact OE1-NH1 3.34Å; E306-R332 IonicContact OE1-NH2 2.67Å; E306-R332 PolarHBondContact OE1-NH2 3.12Å; L307-R332 PolarHBondContact O-N 3.38Å; N308-R332 HydrophobicContact CB-CB 4.45Å; L309-R332 CarbonylContact C-O 3.27Å; L309-R332 WeakPolarHBondContact CA-O 3.23Å; L309-R332 PolarHBondContact N-O 2.99Å; S310-R332 PolarHBondContact N-O 2.99Å; S310-R332 WeakPolarHBondContact OG-CB 3.29Å; T330-R332 HydrophobicContact CG2-CG 4.2Å; R332-E356 HydrophobicContact CB-CB 4.43Å; R332-E356 WeakPolarHBondContact CD-OE2 3.28Å; R332-E356 HydrophobicContact CG-CB 4.32Å; R332-E356 HydrophobicContact CG-CG 4.3Å; R332-E356 VanDerWaalsContact CG-OE2 3.29Å; R332-E356 WeakPolarHBondContact CG-OE2 3.06Å; R332-E356 IonicContact NE-OE2 3.85Å; R332-E356 PolarHBondContact NE-OE2 2.88Å
333	L	98.3	Very high	93.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.			trans	-134.9	8.8	-176.5	-72.2	165.5	0	0	0	111.8	I293 L309 L314 L317 L331 N336 I338 F346 E356 L357 N360	I293-L333 HydrophobicContact CD1-CD2 4.49Å; L309-L333 HydrophobicContact CB-CD2 3.82Å; L309-L333 HydrophobicContact CD1-CD2 4.12Å; L314-L333 HydrophobicContact CD1-CD2 3.5Å; L317-L333 HydrophobicContact CD1-CD1 3.89Å; L317-L333 HydrophobicContact CD2-CD1 4.18Å; L331-L333 HydrophobicContact CD1-CD1 4.13Å; L331-L333 HydrophobicContact CD1-CG 4.06Å; L331-L333 HydrophobicContact CD2-CD1 3.87Å; L331-L333 HydrophobicContact CG-CD1 3.85Å; L331-L333 HydrophobicContact CG-CG 4.12Å; L333-N336 PolarHBondContact O-ND2 3.4Å; L333-I338 HydrophobicContact CB-CD1 4Å; L333-I338 HydrophobicContact CD2-CD1 4.29Å; L333-F346 HydrophobicContact CD1-CE1 4.47Å; L333-E356 CarbonylContact C-O 3.45Å; L333-E356 WeakPolarHBondContact CA-O 3.08Å; L333-E356 PolarHBondContact N-O 3.3Å; L333-L357 HydrophobicContact CB-CD2 3.8Å; L333-L357 HydrophobicContact CD1-CD2 3.94Å; L333-N360 PolarHBondContact O-ND2 2.84Å
334	G	97.9	Very high	93.6	Very high	7 Å²	7	33.2 Å²	33.2	7%	0.072	18%	0.177	C	C	.	.			trans	-67.9	151.3	-176.9	0	0	0	0	0	113.8	S310 Y311 E356 D358	S310-G334 CarbonylContact C-O 3.3Å; S310-G334 WeakPolarHBondContact CA-O 3.28Å; S310-G334 WeakPolarHBondContact CB-O 3.49Å; S310-G334 PolarHBondContact OG-N 3.44Å; S310-G334 VanDerWaalsContact OG-N 3.17Å; S310-G334 PolarHBondContact OG-O 2.95Å; Y311-G334 PolarHBondContact N-O 3.3Å; G334-E356 PolarHBondContact N-O 3.25Å; G334-D358 CarbonylContact C-O 3.4Å; G334-D358 VanDerWaalsContact C-O 3.31Å; G334-D358 WeakPolarHBondContact CA-O 3.42Å
335	R	98.3	Very high	93.5	Very high	108 Å²	108	30.6 Å²	30.6	41%	0.408	16%	0.161	S	C	.	.	S	Bend	trans	57.3	57.2	-172.5	-61.1	177.8	-172	-68.8	-5.6	111.6	Y311 N312 D358 H359	Y311-R335 WeakPolarHBondContact CA-O 3.15Å; Y311-R335 HydrophobicContact CD1-CB 4.19Å; Y311-R335 HydrophobicContact CD2-CB 4.48Å; Y311-R335 HydrophobicContact CE1-CG 4.49Å; Y311-R335 HydrophobicContact CG-CB 4.18Å; Y311-R335 PolarHBondContact N-O 3.33Å; Y311-R335 VanDerWaalsContact N-O 3.07Å; Y311-R335 PolarHBondContact OH-NE 3.43Å; N312-R335 PolarHBondContact N-O 3.04Å; R335-D358 PolarHBondContact N-O 3.03Å; R335-H359 WeakPolarHBondContact CA-O 3.5Å; R335-H359 HydrophobicContact CG-CB 3.57Å; R335-H359 PolarHBondContact N-O 2.93Å; R335-H359 PolarHBondContact NH1-CD2 3.26Å; R335-H359 PolarHBondContact NH2-CD2 3.34Å; R335-H359 PolarHBondContact NH2-CE1 3.33Å; R335-H359 PolarHBondContact NH2-NE2 2.87Å
336	N	98.3	Very high	93.4	Very high	11 Å²	11	30.6 Å²	30.6	6%	0.059	16%	0.162	C	C	.	.	S	Bend	trans	-123.1	-168.6	163.4	-80.8	-92.7	0	0	0	107.4	L309 N312 N313 L314 L333 I338 N360	L309-N336 PolarHBondContact O-ND2 3.08Å; N312-N336 VanDerWaalsContact CA-OD1 3.28Å; N312-N336 WeakPolarHBondContact CA-OD1 3.33Å; N312-N336 WeakPolarHBondContact CB-OD1 3.29Å; N312-N336 PolarHBondContact O-OD1 3.23Å; N313-N336 PolarHBondContact N-OD1 3.42Å; L314-N336 HydrophobicContact CB-CB 4.09Å; L314-N336 VanDerWaalsContact CB-OD1 3.28Å; L314-N336 WeakPolarHBondContact CB-OD1 3.41Å; L314-N336 VanDerWaalsContact CG-OD1 3.32Å; L314-N336 WeakPolarHBondContact CG-OD1 3.43Å; L314-N336 PolarHBondContact N-OD1 3.16Å; L333-N336 PolarHBondContact O-ND2 3.4Å; N336-I338 HydrophobicContact CB-CD1 4.12Å; N336-I338 HydrophobicContact CB-CG1 3.9Å; N336-N360 WeakPolarHBondContact CA-OD1 3.48Å; N336-N360 WeakPolarHBondContact CB-OD1 3.45Å; N336-N360 PolarHBondContact N-OD1 3.33Å; N336-N360 PolarHBondContact O-OD1 3.35Å
337	S	96.7	Very high	93.2	Very high	45 Å²	45	36.7 Å²	36.7	32%	0.315	18%	0.176	S	C	.	.			trans	-111.5	33.8	172.6	-72.2	0	0	0	0	111.8	L314 T315 S339 D361	L314-S337 CarbonylContact O-C 3.58Å; L314-S337 WeakPolarHBondContact O-CA 3.45Å; L314-S337 PolarHBondContact O-N 3.45Å; T315-S337 WeakPolarHBondContact CA-O 3.17Å; S337-S339 PolarHBondContact O-N 3.39Å; S337-D361 WeakPolarHBondContact CA-OD2 3.37Å; S337-D361 VanDerWaalsContact CB-OD2 3.24Å; S337-D361 WeakPolarHBondContact CB-OD2 3.18Å; S337-D361 PolarHBondContact OG-OD2 3.43Å
338	I	95.4	Very high	92.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.166	C	C	.	.			trans	-67.3	108.9	-175.7	-59.3	170	0	0	0	108.1	L314 T315 L317 L333 N336 I341 L357 N360 D361 I362	L314-I338 HydrophobicContact CB-CD1 4.2Å; L314-I338 HydrophobicContact CB-CG1 3.9Å; L314-I338 WeakPolarHBondContact O-CG1 3.22Å; L314-I338 PolarHBondContact O-N 3.47Å; L314-I338 VanDerWaalsContact O-N 3.1Å; T315-I338 WeakPolarHBondContact O-CA 3.31Å; L317-I338 HydrophobicContact CD1-CD1 4.4Å; L317-I338 HydrophobicContact CD1-CG2 4.46Å; L317-I338 HydrophobicContact CD2-CD1 4.22Å; L317-I338 HydrophobicContact CG-CD1 4.28Å; L317-I338 HydrophobicContact CG-CG2 4.19Å; L333-I338 HydrophobicContact CB-CD1 4Å; L333-I338 HydrophobicContact CD2-CD1 4.29Å; N336-I338 HydrophobicContact CB-CD1 4.12Å; N336-I338 HydrophobicContact CB-CG1 3.9Å; I338-I341 HydrophobicContact CG2-CD1 4.33Å; I338-I341 HydrophobicContact CG2-CG1 3.87Å; I338-L357 HydrophobicContact CD1-CD2 4.37Å; I338-N360 HydrophobicContact CB-CB 4.32Å; I338-N360 VanDerWaalsContact CB-OD1 3.29Å; I338-N360 WeakPolarHBondContact CB-OD1 3.36Å; I338-N360 WeakPolarHBondContact CG1-OD1 3.21Å; I338-N360 PolarHBondContact N-OD1 3.02Å; I338-D361 CarbonylContact O-C 3.49Å; I338-D361 VanDerWaalsContact O-C 3.29Å; I338-D361 WeakPolarHBondContact O-CA 3.16Å; I338-D361 PolarHBondContact O-N 3.03Å; I338-I362 HydrophobicContact CG2-CG1 4.46Å; I338-I362 WeakPolarHBondContact O-CG1 3.42Å; I338-I362 PolarHBondContact O-N 3.25Å; I338-I362 VanDerWaalsContact O-N 3.1Å
339	S	89.3	Confident	92.7	Very high	34 Å²	34	34 Å²	34	24%	0.238	17%	0.166	C	C	.	.			trans	-105.8	-24.6	179.2	39.7	0	0	0	0	112.1	T315 S337	T315-S339 PolarHBondContact O-N 2.87Å; T315-S339 PolarHBondContact O-OG 3.27Å; S337-S339 PolarHBondContact O-N 3.39Å
340	H	84.6	Confident	92.4	Very high	69 Å²	69	38.1 Å²	38.1	32%	0.319	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.9	-173.7	-58.6	76.3	0	0	0	110	R316 L317 Q529	R316-H340 CarbonylContact C-O 3.46Å; R316-H340 VanDerWaalsContact CA-O 3.25Å; R316-H340 WeakPolarHBondContact CA-O 3.31Å; R316-H340 HydrophobicContact CB-CB 4.39Å; L317-H340 PolarHBondContact N-O 2.94Å; H340-Q529 PolarHBondContact CD2-O 3.08Å
341	I	90.1	Very high	92.3	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.7	172.7	-55.7	-176.3	0	0	0	106.2	L317 I338 A345 F346 L357 I362 T365 A372	L317-I341 HydrophobicContact CB-CG2 4.23Å; L317-I341 HydrophobicContact CD1-CD1 4.06Å; L317-I341 HydrophobicContact CD1-CG1 4.05Å; L317-I341 HydrophobicContact CD1-CG2 4.26Å; L317-I341 HydrophobicContact CG-CG1 4.47Å; I338-I341 HydrophobicContact CG2-CD1 4.33Å; I338-I341 HydrophobicContact CG2-CG1 3.87Å; I341-A345 HydrophobicContact CG2-CB 3.74Å; I341-F346 HydrophobicContact CD1-CE2 4.44Å; I341-F346 HydrophobicContact CD1-CZ 4.37Å; I341-F346 HydrophobicContact CG2-CE2 3.86Å; I341-F346 HydrophobicContact CG2-CZ 4.25Å; I341-L357 HydrophobicContact CD1-CD1 4.11Å; I341-L357 HydrophobicContact CD1-CD2 4.38Å; I341-I362 HydrophobicContact CD1-CD1 3.92Å; I341-I362 HydrophobicContact CD1-CG1 4.43Å; I341-T365 HydrophobicContact CB-CG2 3.86Å; I341-T365 HydrophobicContact CD1-CG2 4.41Å; I341-T365 HydrophobicContact CG1-CG2 4.4Å; I341-A372 HydrophobicContact CB-CB 4.43Å; I341-A372 HydrophobicContact CG2-CB 3.97Å
342	N	84.4	Confident	92.2	Very high	25 Å²	25	37.7 Å²	37.7	13%	0.134	18%	0.182	C	C	.	.			trans	-73.3	154.2	-176.4	-73.5	-4	0	0	0	111.8	L317 D318 G344 A345	L317-N342 WeakPolarHBondContact O-CB 3.41Å; L317-N342 PolarHBondContact O-N 2.81Å; D318-N342 PolarHBondContact OD1-ND2 3.33Å; N342-G344 PolarHBondContact O-N 3.2Å; N342-A345 VanDerWaalsContact O-CB 3.23Å; N342-A345 WeakPolarHBondContact O-CB 3.46Å; N342-A345 PolarHBondContact O-N 3.12Å
343	E	83.4	Confident	92.2	Very high	76 Å²	76	40.7 Å²	40.7	36%	0.355	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	120.6	172.8	-164.6	170.9	156.3	0	0	108.8	N370 R578 K594	E343-N370 WeakPolarHBondContact CA-OD1 3.36Å; E343-N370 PolarHBondContact N-OD1 3.14Å; E343-R578 IonicContact OE2-NH1 2.71Å; E343-K594 IonicContact OE2-NZ 3.3Å; E343-K594 PolarHBondContact OE2-NZ 3.27Å
344	G	83.8	Confident	92.2	Very high	9 Å²	9	42.1 Å²	42.1	9%	0.093	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	16.2	-174	0	0	0	0	0	116.6	N342 F346 R347 G371	N342-G344 PolarHBondContact O-N 3.2Å; G344-F346 PolarHBondContact O-N 3.3Å; G344-R347 WeakPolarHBondContact O-CB 3.21Å; G344-R347 PolarHBondContact O-N 3.22Å; G344-G371 PolarHBondContact N-O 3.31Å
345	A	89.1	Confident	92.2	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.4	173.8	0	0	0	0	0	113.6	L317 I341 N342	L317-A345 HydrophobicContact CB-CB 4.01Å; I341-A345 HydrophobicContact CG2-CB 3.74Å; N342-A345 VanDerWaalsContact O-CB 3.23Å; N342-A345 WeakPolarHBondContact O-CB 3.46Å; N342-A345 PolarHBondContact O-N 3.12Å
346	F	91.1	Very high	92.2	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	5.6	176.5	-56.3	-60.7	0	0	0	114.2	L317 L331 L333 I341 G344 G348 L349 L355 L357 A372 F373 L376	L317-F346 HydrophobicContact CD1-CE1 3.77Å; L317-F346 HydrophobicContact CD1-CZ 3.56Å; L331-F346 HydrophobicContact CD2-CD1 4.25Å; L331-F346 HydrophobicContact CD2-CE1 4.01Å; L333-F346 HydrophobicContact CD1-CE1 4.47Å; I341-F346 HydrophobicContact CD1-CE2 4.44Å; I341-F346 HydrophobicContact CD1-CZ 4.37Å; I341-F346 HydrophobicContact CG2-CE2 3.86Å; I341-F346 HydrophobicContact CG2-CZ 4.25Å; G344-F346 PolarHBondContact O-N 3.3Å; F346-G348 PolarHBondContact O-N 3.1Å; F346-L349 HydrophobicContact CB-CD1 4.14Å; F346-L349 HydrophobicContact CD1-CD1 3.96Å; F346-L349 WeakPolarHBondContact O-CB 3.14Å; F346-L349 WeakPolarHBondContact O-CG 3.35Å; F346-L349 PolarHBondContact O-N 3.03Å; F346-L355 HydrophobicContact CD2-CD2 4.28Å; F346-L355 HydrophobicContact CE1-CD1 4.11Å; F346-L355 HydrophobicContact CE1-CD2 4.18Å; F346-L355 HydrophobicContact CE2-CD2 3.88Å; F346-L355 HydrophobicContact CZ-CD1 4.22Å; F346-L355 HydrophobicContact CZ-CD2 3.83Å; F346-L357 HydrophobicContact CZ-CD1 4.24Å; F346-A372 WeakPolarHBondContact CD2-O 3.48Å; F346-F373 AromaticContact CD2-CD1 3.96Å; F346-F373 HydrophobicContact CD2-CD1 3.96Å; F346-F373 HydrophobicContact CD2-CE1 4.39Å; F346-F373 AromaticContact CE2-CD1 3.82Å; F346-F373 HydrophobicContact CE2-CD1 3.82Å; F346-F373 AromaticContact CE2-CE1 3.78Å; F346-F373 HydrophobicContact CE2-CE1 3.78Å; F346-L376 HydrophobicContact CB-CD1 3.89Å; F346-L376 HydrophobicContact CB-CD2 3.9Å; F346-L376 HydrophobicContact CB-CG 3.96Å; F346-L376 HydrophobicContact CD2-CD1 3.94Å; F346-L376 HydrophobicContact CG-CD1 4.04Å
347	R	88.8	Confident	92.2	Very high	156 Å²	156	37.7 Å²	37.7	59%	0.589	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	121.6	-177.4	-174.4	-179.3	-176.1	-173.4	1.8	110.4	E319 A323 G344	E319-R347 IonicContact OE1-NH1 2.7Å; E319-R347 PolarHBondContact OE1-NH1 3Å; A323-R347 WeakPolarHBondContact CA-O 3.37Å; A323-R347 WeakPolarHBondContact CB-O 3.43Å; G344-R347 WeakPolarHBondContact O-CB 3.21Å; G344-R347 PolarHBondContact O-N 3.22Å
348	G	89.4	Confident	92.3	Very high	21 Å²	21	37.1 Å²	37.1	22%	0.216	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	109	-16.4	-178.7	0	0	0	0	0	114.6	F346 K350	F346-G348 PolarHBondContact O-N 3.1Å; G348-K350 PolarHBondContact O-N 3.49Å
349	L	93.9	Very high	92.4	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.19	C	C	.	.			trans	-76.4	52.6	179.3	-58.2	-177.8	0	0	0	113.2	L322 L325 L328 L331 F346 A351 L352 L376	L322-L349 HydrophobicContact CB-CD1 4.28Å; L322-L349 HydrophobicContact CB-CD2 4.14Å; L322-L349 HydrophobicContact CD1-CD1 4.37Å; L322-L349 WeakPolarHBondContact O-CD2 3.13Å; L325-L349 HydrophobicContact CB-CD2 3.91Å; L325-L349 VanDerWaalsContact O-CD2 3.32Å; L325-L349 WeakPolarHBondContact O-CD2 3.35Å; L328-L349 HydrophobicContact CB-CD2 4.28Å; L328-L349 HydrophobicContact CD2-CD2 4.16Å; L331-L349 HydrophobicContact CD2-CD1 4.15Å; F346-L349 HydrophobicContact CB-CD1 4.14Å; F346-L349 HydrophobicContact CD1-CD1 3.96Å; F346-L349 WeakPolarHBondContact O-CB 3.14Å; F346-L349 WeakPolarHBondContact O-CG 3.35Å; F346-L349 PolarHBondContact O-N 3.03Å; L349-A351 PolarHBondContact O-N 3.24Å; L349-L352 HydrophobicContact CB-CB 4.1Å; L349-L352 HydrophobicContact CB-CD2 4.48Å; L349-L352 HydrophobicContact CD1-CD2 4.15Å; L349-L352 VanDerWaalsContact O-CB 3.32Å; L349-L352 WeakPolarHBondContact O-CB 2.95Å; L349-L352 PolarHBondContact O-N 3.3Å; L349-L376 HydrophobicContact CB-CD2 4.05Å
350	K	91.8	Very high	92.8	Very high	144 Å²	144	38.7 Å²	38.7	63%	0.626	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-3	-170.9	-62	179.2	-175.9	-179.1	0	115.7	G348 K378	G348-K350 PolarHBondContact O-N 3.49Å; K350-K378 WeakPolarHBondContact O-CD 3.41Å; K350-K378 WeakPolarHBondContact O-CE 3.22Å; K350-K378 PolarHBondContact O-NZ 3.1Å
351	A	95.9	Very high	93.4	Very high	14 Å²	14	37.3 Å²	37.3	12%	0.116	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-1.3	175.3	0	0	0	0	0	113.5	G326 L328 L349 R353	G326-A351 WeakPolarHBondContact O-CB 3.12Å; G326-A351 PolarHBondContact O-N 3.1Å; L328-A351 CarbonylContact O-C 3.56Å; L349-A351 PolarHBondContact O-N 3.24Å; A351-R353 PolarHBondContact O-N 3.4Å
352	L	97.5	Very high	93.5	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.175	C	C	.	.			trans	-69	129.1	-170.5	-162.1	73	0	0	0	111.3	L328 L331 L349 L355 L376 K378 L379	L328-L352 HydrophobicContact CB-CD1 4.48Å; L328-L352 HydrophobicContact CD2-CD1 4.16Å; L328-L352 HydrophobicContact CG-CD1 4.11Å; L328-L352 WeakPolarHBondContact O-CA 3.29Å; L328-L352 PolarHBondContact O-N 3.41Å; L331-L352 HydrophobicContact CB-CD1 3.81Å; L349-L352 HydrophobicContact CB-CB 4.1Å; L349-L352 HydrophobicContact CB-CD2 4.48Å; L349-L352 HydrophobicContact CD1-CD2 4.15Å; L349-L352 VanDerWaalsContact O-CB 3.32Å; L349-L352 WeakPolarHBondContact O-CB 2.95Å; L349-L352 PolarHBondContact O-N 3.3Å; L352-L355 HydrophobicContact CD2-CB 4.19Å; L352-L355 HydrophobicContact CD2-CD2 4.48Å; L352-L376 HydrophobicContact CB-CD2 4.06Å; L352-L376 HydrophobicContact CD2-CD1 4.48Å; L352-L376 HydrophobicContact CD2-CD2 3.71Å; L352-K378 CarbonylContact O-C 3.29Å; L352-L379 HydrophobicContact CB-CD1 4.44Å; L352-L379 HydrophobicContact CD2-CD1 3.99Å; L352-L379 HydrophobicContact CG-CD1 3.95Å; L352-L379 WeakPolarHBondContact O-CA 3.11Å; L352-L379 PolarHBondContact O-N 3.17Å
353	R	97.8	Very high	93.7	Very high	129 Å²	129	37.7 Å²	37.7	49%	0.487	18%	0.181	S	C	.	.			trans	-117	-32	-179.2	-65	175.9	-175.6	-91.1	5.3	112.1	H329 A351 N380 K381	H329-R353 PolarHBondContact O-N 3.05Å; A351-R353 PolarHBondContact O-N 3.4Å; R353-N380 PolarHBondContact O-N 3.44Å; R353-K381 PolarHBondContact O-N 3.17Å
354	V	98.6	Very high	93.7	Very high	30 Å²	30	34.6 Å²	34.6	18%	0.182	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.6	-177.1	-179.9	0	0	0	0	110.2	H329 T330 L331 E356 K381	H329-V354 PolarHBondContact O-N 2.98Å; T330-V354 WeakPolarHBondContact CA-O 3.36Å; T330-V354 HydrophobicContact CG2-CB 4.24Å; T330-V354 HydrophobicContact CG2-CG1 4.28Å; L331-V354 PolarHBondContact N-O 2.62Å; V354-E356 HydrophobicContact CG1-CG 3.81Å; V354-K381 HydrophobicContact CG1-CD 4.15Å; V354-K381 HydrophobicContact CG2-CB 4.35Å
355	L	98.4	Very high	93.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	115.4	174.5	179.1	53.5	0	0	0	109.7	L331 F346 L352 L357 F373 L376 L379 K381 L382 T383	L331-L355 HydrophobicContact CB-CD1 4.14Å; L331-L355 HydrophobicContact CD2-CD1 3.96Å; L331-L355 HydrophobicContact CG-CD1 4.02Å; L331-L355 WeakPolarHBondContact O-CA 3.25Å; F346-L355 HydrophobicContact CD2-CD2 4.28Å; F346-L355 HydrophobicContact CE1-CD1 4.11Å; F346-L355 HydrophobicContact CE1-CD2 4.18Å; F346-L355 HydrophobicContact CE2-CD2 3.88Å; F346-L355 HydrophobicContact CZ-CD1 4.22Å; F346-L355 HydrophobicContact CZ-CD2 3.83Å; L352-L355 HydrophobicContact CD2-CB 4.19Å; L352-L355 HydrophobicContact CD2-CD2 4.48Å; L355-L357 HydrophobicContact CD1-CD1 4.18Å; L355-L357 HydrophobicContact CD1-CG 4.07Å; L355-L357 HydrophobicContact CD2-CD1 3.99Å; L355-L357 HydrophobicContact CG-CD1 3.9Å; L355-L357 HydrophobicContact CG-CG 4.16Å; L355-F373 HydrophobicContact CD2-CD1 4.1Å; L355-F373 HydrophobicContact CD2-CE1 3.97Å; L355-L376 HydrophobicContact CD2-CD1 4.01Å; L355-L379 HydrophobicContact CB-CD1 3.84Å; L355-L379 HydrophobicContact CB-CD2 4.23Å; L355-K381 PolarHBondContact N-O 3.33Å; L355-L382 HydrophobicContact CB-CD1 4.13Å; L355-L382 HydrophobicContact CD2-CD1 3.98Å; L355-L382 HydrophobicContact CG-CD1 3.93Å; L355-T383 PolarHBondContact O-N 2.68Å; L355-T383 VanDerWaalsContact O-N 3.13Å
356	E	98.6	Very high	93.8	Very high	33 Å²	33	34.4 Å²	34.4	15%	0.154	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	108.8	-177.9	-51.3	-171.9	154.7	0	0	110.5	L331 R332 L333 G334 V354 K381 T383	L331-E356 PolarHBondContact O-N 3.08Å; R332-E356 HydrophobicContact CB-CB 4.43Å; R332-E356 WeakPolarHBondContact CD-OE2 3.28Å; R332-E356 HydrophobicContact CG-CB 4.32Å; R332-E356 HydrophobicContact CG-CG 4.3Å; R332-E356 VanDerWaalsContact CG-OE2 3.29Å; R332-E356 WeakPolarHBondContact CG-OE2 3.06Å; R332-E356 IonicContact NE-OE2 3.85Å; R332-E356 PolarHBondContact NE-OE2 2.88Å; L333-E356 CarbonylContact C-O 3.45Å; L333-E356 WeakPolarHBondContact CA-O 3.08Å; L333-E356 PolarHBondContact N-O 3.3Å; G334-E356 PolarHBondContact N-O 3.25Å; V354-E356 HydrophobicContact CG1-CG 3.81Å; E356-K381 IonicContact OE1-NZ 3.36Å; E356-K381 PolarHBondContact OE1-NZ 3.16Å; E356-T383 HydrophobicContact CB-CG2 3.8Å; E356-T383 HydrophobicContact CG-CG2 3.77Å
357	L	98.1	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.			trans	-119.5	15.9	-176.3	-73.9	164.6	0	0	0	112.3	L317 L333 I338 I341 F346 L355 N360 I362 F373 L382 T383 L384 N387	L317-L357 HydrophobicContact CD1-CD2 4.44Å; L333-L357 HydrophobicContact CB-CD2 3.8Å; L333-L357 HydrophobicContact CD1-CD2 3.94Å; I338-L357 HydrophobicContact CD1-CD2 4.37Å; I341-L357 HydrophobicContact CD1-CD1 4.11Å; I341-L357 HydrophobicContact CD1-CD2 4.38Å; F346-L357 HydrophobicContact CZ-CD1 4.24Å; L355-L357 HydrophobicContact CD1-CD1 4.18Å; L355-L357 HydrophobicContact CD1-CG 4.07Å; L355-L357 HydrophobicContact CD2-CD1 3.99Å; L355-L357 HydrophobicContact CG-CD1 3.9Å; L355-L357 HydrophobicContact CG-CG 4.16Å; L357-N360 PolarHBondContact O-ND2 3.16Å; L357-I362 HydrophobicContact CB-CD1 3.91Å; L357-I362 HydrophobicContact CD1-CD1 4.27Å; L357-I362 HydrophobicContact CD2-CD1 4.23Å; L357-I362 HydrophobicContact CG-CD1 4.37Å; L357-F373 HydrophobicContact CD1-CE1 4.07Å; L357-F373 HydrophobicContact CD1-CZ 4.46Å; L357-L382 HydrophobicContact CD1-CD1 4.33Å; L357-T383 WeakPolarHBondContact CA-O 3.47Å; L357-T383 PolarHBondContact N-O 3.17Å; L357-L384 HydrophobicContact CB-CD2 3.73Å; L357-L384 HydrophobicContact CD1-CD2 3.95Å; L357-N387 PolarHBondContact O-ND2 2.86Å
358	D	98.3	Very high	93.1	Very high	32 Å²	32	27.7 Å²	27.7	17%	0.171	14%	0.142	C	C	.	.			trans	-59.4	150	-176.2	-51.4	-46.7	0	0	0	113.4	G334 R335 N360 T383 L384 F385	G334-D358 CarbonylContact C-O 3.4Å; G334-D358 VanDerWaalsContact C-O 3.31Å; G334-D358 WeakPolarHBondContact CA-O 3.42Å; R335-D358 PolarHBondContact N-O 3.03Å; D358-N360 PolarHBondContact O-ND2 2.94Å; D358-T383 VanDerWaalsContact OD1-CB 3.24Å; D358-T383 WeakPolarHBondContact OD1-CB 3.34Å; D358-T383 WeakPolarHBondContact OD1-CG2 3.06Å; D358-T383 PolarHBondContact OD1-OG1 3.12Å; D358-T383 WeakPolarHBondContact OD2-CG2 3.39Å; D358-T383 PolarHBondContact OD2-OG1 3.29Å; D358-L384 PolarHBondContact OD1-N 3.33Å; D358-F385 CarbonylContact C-O 3.18Å; D358-F385 WeakPolarHBondContact CA-O 3.42Å; D358-F385 HydrophobicContact CB-CB 4.18Å; D358-F385 VanDerWaalsContact OD1-CB 3.32Å; D358-F385 WeakPolarHBondContact OD1-CB 3.48Å; D358-F385 PolarHBondContact OD1-N 3.36Å
359	H	98.3	Very high	92	Very high	60 Å²	60	30.7 Å²	30.7	28%	0.278	16%	0.156	S	C	.	.	S	Bend	trans	54.1	58.7	177.4	-54.8	77.2	0	0	0	111.9	R335 F385 G386	R335-H359 WeakPolarHBondContact CA-O 3.5Å; R335-H359 HydrophobicContact CG-CB 3.57Å; R335-H359 PolarHBondContact N-O 2.93Å; R335-H359 PolarHBondContact NH1-CD2 3.26Å; R335-H359 PolarHBondContact NH2-CD2 3.34Å; R335-H359 PolarHBondContact NH2-CE1 3.33Å; R335-H359 PolarHBondContact NH2-NE2 2.87Å; H359-F385 AromaticContact CE1-CD1 3.48Å; H359-F385 VanDerWaalsContact CE1-CD1 3.48Å; H359-F385 WeakPolarHBondContact CE1-CD1 3.44Å; H359-F385 AromaticContact CE1-CE1 3.69Å; H359-F385 PolarHBondContact N-O 3.18Å; H359-F385 AromaticContact NE2-CE1 3.89Å; H359-G386 WeakPolarHBondContact CA-O 3.47Å
360	N	98.1	Very high	90.7	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.037	16%	0.157	C	C	.	.	S	Bend	trans	-127.8	-177.5	175	-87.5	-77.7	0	0	0	109.6	L333 N336 I338 L357 D358 I362 N387	L333-N360 PolarHBondContact O-ND2 2.84Å; N336-N360 WeakPolarHBondContact CA-OD1 3.48Å; N336-N360 WeakPolarHBondContact CB-OD1 3.45Å; N336-N360 PolarHBondContact N-OD1 3.33Å; N336-N360 PolarHBondContact O-OD1 3.35Å; I338-N360 HydrophobicContact CB-CB 4.32Å; I338-N360 VanDerWaalsContact CB-OD1 3.29Å; I338-N360 WeakPolarHBondContact CB-OD1 3.36Å; I338-N360 WeakPolarHBondContact CG1-OD1 3.21Å; I338-N360 PolarHBondContact N-OD1 3.02Å; L357-N360 PolarHBondContact O-ND2 3.16Å; D358-N360 PolarHBondContact O-ND2 2.94Å; N360-I362 VanDerWaalsContact C-N 3.35Å; N360-I362 HydrophobicContact CB-CD1 4.18Å; N360-I362 HydrophobicContact CB-CG1 4.01Å; N360-N387 WeakPolarHBondContact CA-OD1 3.43Å; N360-N387 WeakPolarHBondContact CB-OD1 3.41Å; N360-N387 PolarHBondContact N-OD1 3.2Å; N360-N387 PolarHBondContact O-OD1 2.99Å; N360-N387 VanDerWaalsContact O-OD1 3.08Å
361	D	95.7	Very high	90	Very high	40 Å²	40	25.2 Å²	25.2	21%	0.214	14%	0.139	C	C	.	.			trans	-94.5	15.9	-179.3	-70.6	-57.9	0	0	0	113.2	S337 I338 S363 K388	S337-D361 WeakPolarHBondContact CA-OD2 3.37Å; S337-D361 VanDerWaalsContact CB-OD2 3.24Å; S337-D361 WeakPolarHBondContact CB-OD2 3.18Å; S337-D361 PolarHBondContact OG-OD2 3.43Å; I338-D361 CarbonylContact O-C 3.49Å; I338-D361 VanDerWaalsContact O-C 3.29Å; I338-D361 WeakPolarHBondContact O-CA 3.16Å; I338-D361 PolarHBondContact O-N 3.03Å; D361-S363 PolarHBondContact O-N 2.84Å; D361-K388 HydrophobicContact CB-CD 4.36Å; D361-K388 WeakPolarHBondContact OD1-CE 3.43Å; D361-K388 IonicContact OD1-NZ 2.68Å; D361-K388 PolarHBondContact OD1-NZ 2.87Å
362	I	93.4	Very high	89.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.			trans	-66.4	130.1	-171.1	-54.2	168.2	0	0	0	110	I338 I341 L357 N360 I366 L384 N387 K388 I389	I338-I362 HydrophobicContact CG2-CG1 4.46Å; I338-I362 WeakPolarHBondContact O-CG1 3.42Å; I338-I362 PolarHBondContact O-N 3.25Å; I338-I362 VanDerWaalsContact O-N 3.1Å; I341-I362 HydrophobicContact CD1-CD1 3.92Å; I341-I362 HydrophobicContact CD1-CG1 4.43Å; L357-I362 HydrophobicContact CB-CD1 3.91Å; L357-I362 HydrophobicContact CD1-CD1 4.27Å; L357-I362 HydrophobicContact CD2-CD1 4.23Å; L357-I362 HydrophobicContact CG-CD1 4.37Å; N360-I362 VanDerWaalsContact C-N 3.35Å; N360-I362 HydrophobicContact CB-CD1 4.18Å; N360-I362 HydrophobicContact CB-CG1 4.01Å; I362-I366 HydrophobicContact CG2-CG1 4.21Å; I362-L384 HydrophobicContact CD1-CD2 3.68Å; I362-N387 HydrophobicContact CB-CB 4.41Å; I362-N387 WeakPolarHBondContact CB-OD1 3.4Å; I362-N387 VanDerWaalsContact CG1-OD1 3.31Å; I362-N387 WeakPolarHBondContact CG1-OD1 3.32Å; I362-N387 PolarHBondContact N-OD1 2.91Å; I362-N387 VanDerWaalsContact N-OD1 3.12Å; I362-K388 CarbonylContact O-C 3.52Å; I362-K388 WeakPolarHBondContact O-CA 3.34Å; I362-K388 PolarHBondContact O-N 3.01Å; I362-I389 PolarHBondContact O-N 3.2Å
363	S	88.6	Confident	89	Confident	36 Å²	36	24.6 Å²	24.6	25%	0.252	13%	0.134	S	C	.	.			trans	-144.4	-73	176	45.8	0	0	0	0	110.4	D361 T365 I366 E367 K388	D361-S363 PolarHBondContact O-N 2.84Å; S363-T365 VanDerWaalsContact C-N 3.26Å; S363-T365 PolarHBondContact O-N 3.36Å; S363-T365 VanDerWaalsContact O-N 3.09Å; S363-I366 PolarHBondContact O-N 3.02Å; S363-E367 PolarHBondContact O-N 2.8Å; S363-K388 WeakPolarHBondContact CB-O 3.47Å
364	G	81.9	Confident	88.4	Confident	11 Å²	11	20.5 Å²	20.5	11%	0.113	13%	0.127	C	C	.	.	H	α-helix	trans	-50.3	-39.6	-176.2	0	0	0	0	0	114.5	I366 E367 D368	G364-I366 PolarHBondContact O-N 2.82Å; G364-E367 PolarHBondContact O-N 3.01Å; G364-D368 VanDerWaalsContact O-CB 3.29Å; G364-D368 WeakPolarHBondContact O-CB 3.29Å; G364-D368 PolarHBondContact O-N 3.2Å
365	T	85.6	Confident	87.7	Confident	6 Å²	6	20.3 Å²	20.3	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-54.5	-25.2	177.7	-41.8	0	0	0	0	114.9	I341 S363 A372	I341-T365 HydrophobicContact CB-CG2 3.86Å; I341-T365 HydrophobicContact CD1-CG2 4.41Å; I341-T365 HydrophobicContact CG1-CG2 4.4Å; S363-T365 VanDerWaalsContact C-N 3.26Å; S363-T365 PolarHBondContact O-N 3.36Å; S363-T365 VanDerWaalsContact O-N 3.09Å; T365-A372 HydrophobicContact CG2-CB 3.45Å; T365-A372 VanDerWaalsContact CG2-CB 3.45Å
366	I	89.4	Confident	87.3	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-110	-26.3	-178.2	-50.3	-60.6	0	0	0	111.5	I362 S363 G364 F373 L384 I389 S391 V392 A393 A396 F397	I362-I366 HydrophobicContact CG2-CG1 4.21Å; S363-I366 PolarHBondContact O-N 3.02Å; G364-I366 PolarHBondContact O-N 2.82Å; I366-F373 HydrophobicContact CD1-CE2 3.61Å; I366-F373 HydrophobicContact CD1-CZ 4.08Å; I366-L384 HydrophobicContact CD1-CD1 3.92Å; I366-L384 HydrophobicContact CG1-CD1 4.4Å; I366-I389 HydrophobicContact CB-CD1 4.15Å; I366-I389 HydrophobicContact CB-CG1 4.11Å; I366-I389 HydrophobicContact CB-CG2 3.9Å; I366-I389 HydrophobicContact CG1-CD1 3.72Å; I366-I389 HydrophobicContact CG1-CG1 3.99Å; I366-I389 HydrophobicContact CG2-CD1 4.23Å; I366-I389 HydrophobicContact CG2-CG2 3.73Å; I366-S391 CarbonylContact C-O 3.6Å; I366-V392 HydrophobicContact CG2-CB 4.42Å; I366-V392 HydrophobicContact CG2-CG1 4.32Å; I366-V392 HydrophobicContact CG2-CG2 4.04Å; I366-A393 PolarHBondContact O-N 3.4Å; I366-A396 HydrophobicContact CG2-CB 4.16Å; I366-A396 WeakPolarHBondContact O-CB 3.06Å; I366-F397 HydrophobicContact CD1-CE1 4.04Å; I366-F397 HydrophobicContact CD1-CZ 4.46Å; I366-F397 HydrophobicContact CG2-CZ 4.05Å
367	E	85.7	Confident	86.8	Confident	13 Å²	13	23.5 Å²	23.5	6%	0.061	15%	0.15	C	C	.	.	H	α-helix	trans	-79.5	-23.8	174.7	-62.6	178.9	-143.3	0	0	112.8	S363 G364 K390 S391 S589 Y591	S363-E367 PolarHBondContact O-N 2.8Å; G364-E367 PolarHBondContact O-N 3.01Å; E367-K390 WeakPolarHBondContact OE1-CB 3.3Å; E367-K390 PolarHBondContact OE1-N 3.19Å; E367-S391 WeakPolarHBondContact CA-O 3.4Å; E367-S391 VanDerWaalsContact CG-O 3.22Å; E367-S391 WeakPolarHBondContact CG-O 3.43Å; E367-S589 VanDerWaalsContact OE2-CB 3.23Å; E367-S589 WeakPolarHBondContact OE2-CB 2.97Å; E367-S589 PolarHBondContact OE2-OG 2.96Å; E367-Y591 HydrophobicContact CB-CD2 4.34Å; E367-Y591 HydrophobicContact CB-CE2 3.44Å; E367-Y591 VanDerWaalsContact CB-CE2 3.44Å; E367-Y591 PolarHBondContact OE2-OH 2.91Å
368	D	79.3	Confident	86.7	Confident	4 Å²	4	28.9 Å²	28.9	2%	0.021	17%	0.173	C	C	.	.	S	Bend	trans	-97.4	-179.8	174	80.9	32.8	0	0	0	113	G364 N370 A393 R526 Y591	G364-D368 VanDerWaalsContact O-CB 3.29Å; G364-D368 WeakPolarHBondContact O-CB 3.29Å; G364-D368 PolarHBondContact O-N 3.2Å; D368-N370 VanDerWaalsContact OD1-CB 3.28Å; D368-N370 WeakPolarHBondContact OD1-CB 3.36Å; D368-N370 PolarHBondContact OD1-N 3.09Å; D368-N370 PolarHBondContact OD1-ND2 2.81Å; D368-A393 VanDerWaalsContact O-CB 3.25Å; D368-A393 WeakPolarHBondContact O-CB 3.45Å; D368-R526 IonicContact OD2-CZ 3.06Å; D368-R526 VanDerWaalsContact OD2-CZ 3.23Å; D368-R526 IonicContact OD2-NH1 3.23Å; D368-R526 PolarHBondContact OD2-NH1 2.88Å; D368-R526 IonicContact OD2-NH2 3.17Å; D368-R526 PolarHBondContact OD2-NH2 2.98Å; D368-Y591 HydrophobicContact CB-CD1 4.17Å; D368-Y591 HydrophobicContact CB-CG 4.15Å
369	T	67.9	Low	86.6	Confident	83 Å²	83	27.3 Å²	27.3	51%	0.509	17%	0.165	S	C	.	.			trans	-110.8	27.6	-178.8	51.6	0	0	0	0	113.4	A393 K395	T369-A393 HydrophobicContact CG2-CB 3.79Å; T369-K395 HydrophobicContact CG2-CB 4.05Å
370	N	65.9	Low	86.5	Confident	6 Å²	6	26.9 Å²	26.9	3%	0.032	17%	0.165	C	C	.	.			trans	-76.6	143.9	177.9	102.6	84.7	0	0	0	112.2	E343 D368 A372	E343-N370 WeakPolarHBondContact CA-OD1 3.36Å; E343-N370 PolarHBondContact N-OD1 3.14Å; D368-N370 VanDerWaalsContact OD1-CB 3.28Å; D368-N370 WeakPolarHBondContact OD1-CB 3.36Å; D368-N370 PolarHBondContact OD1-N 3.09Å; D368-N370 PolarHBondContact OD1-ND2 2.81Å; N370-A372 PolarHBondContact O-N 3.41Å; N370-A372 PolarHBondContact OD1-N 3.23Å
371	G	76.3	Confident	86.5	Confident	24 Å²	24	29.9 Å²	29.9	25%	0.247	18%	0.177	C	C	.	.			trans	-76.9	47.5	-177.7	0	0	0	0	0	114.5	G344 F373 A374	G344-G371 PolarHBondContact N-O 3.31Å; G371-F373 VanDerWaalsContact C-N 3.29Å; G371-F373 PolarHBondContact O-N 3.25Å; G371-A374 VanDerWaalsContact O-CB 3.3Å; G371-A374 WeakPolarHBondContact O-CB 3.47Å; G371-A374 PolarHBondContact O-N 2.81Å
372	A	84.4	Confident	86.7	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-41.4	-177.5	0	0	0	0	0	112.7	I341 F346 T365 N370	I341-A372 HydrophobicContact CB-CB 4.43Å; I341-A372 HydrophobicContact CG2-CB 3.97Å; F346-A372 WeakPolarHBondContact CD2-O 3.48Å; T365-A372 HydrophobicContact CG2-CB 3.45Å; T365-A372 VanDerWaalsContact CG2-CB 3.45Å; N370-A372 PolarHBondContact O-N 3.41Å; N370-A372 PolarHBondContact OD1-N 3.23Å
373	F	89.3	Confident	86.9	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.009	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	9.1	179.9	-54.5	-74.6	0	0	0	114.3	F346 L355 L357 I366 G371 G375 L376 L382 L384 A396 L400	F346-F373 AromaticContact CD2-CD1 3.96Å; F346-F373 HydrophobicContact CD2-CD1 3.96Å; F346-F373 HydrophobicContact CD2-CE1 4.39Å; F346-F373 AromaticContact CE2-CD1 3.82Å; F346-F373 HydrophobicContact CE2-CD1 3.82Å; F346-F373 AromaticContact CE2-CE1 3.78Å; F346-F373 HydrophobicContact CE2-CE1 3.78Å; L355-F373 HydrophobicContact CD2-CD1 4.1Å; L355-F373 HydrophobicContact CD2-CE1 3.97Å; L357-F373 HydrophobicContact CD1-CE1 4.07Å; L357-F373 HydrophobicContact CD1-CZ 4.46Å; I366-F373 HydrophobicContact CD1-CE2 3.61Å; I366-F373 HydrophobicContact CD1-CZ 4.08Å; G371-F373 VanDerWaalsContact C-N 3.29Å; G371-F373 PolarHBondContact O-N 3.25Å; F373-G375 PolarHBondContact O-N 3.21Å; F373-L376 HydrophobicContact CB-CD1 4.16Å; F373-L376 HydrophobicContact CD1-CD1 4.01Å; F373-L376 WeakPolarHBondContact O-CB 3.39Å; F373-L376 PolarHBondContact O-N 3.04Å; F373-L382 HydrophobicContact CE1-CD1 4.12Å; F373-L382 HydrophobicContact CE1-CD2 4.22Å; F373-L382 HydrophobicContact CZ-CD2 4.28Å; F373-L384 HydrophobicContact CZ-CD1 4.5Å; F373-A396 WeakPolarHBondContact CD2-O 3.1Å; F373-L400 HydrophobicContact CB-CD1 4.12Å; F373-L400 HydrophobicContact CB-CD2 4.05Å; F373-L400 HydrophobicContact CB-CG 4.08Å; F373-L400 HydrophobicContact CG-CD1 4.22Å
374	A	84.9	Confident	87.3	Confident	43 Å²	43	26.5 Å²	26.5	36%	0.355	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	132.5	-178.4	0	0	0	0	0	111.7	G371	G371-A374 VanDerWaalsContact O-CB 3.3Å; G371-A374 WeakPolarHBondContact O-CB 3.47Å; G371-A374 PolarHBondContact O-N 2.81Å
375	G	82.7	Confident	88.1	Confident	27 Å²	27	28.8 Å²	28.8	28%	0.278	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	13.6	-176.7	0	0	0	0	0	114.9	F373 D377	F373-G375 PolarHBondContact O-N 3.21Å; G375-D377 VanDerWaalsContact C-N 3.29Å; G375-D377 VanDerWaalsContact C-OD1 3.23Å; G375-D377 WeakPolarHBondContact CA-OD1 3.37Å; G375-D377 PolarHBondContact O-N 3.16Å
376	L	91.8	Very high	88.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.169	C	C	.	.			trans	-94.9	39.7	173.5	-71.2	-177	0	0	0	112.5	F346 L349 L352 L355 F373 K378 L379 G399 L400	F346-L376 HydrophobicContact CB-CD1 3.89Å; F346-L376 HydrophobicContact CB-CD2 3.9Å; F346-L376 HydrophobicContact CB-CG 3.96Å; F346-L376 HydrophobicContact CD2-CD1 3.94Å; F346-L376 HydrophobicContact CG-CD1 4.04Å; L349-L376 HydrophobicContact CB-CD2 4.05Å; L352-L376 HydrophobicContact CB-CD2 4.06Å; L352-L376 HydrophobicContact CD2-CD1 4.48Å; L352-L376 HydrophobicContact CD2-CD2 3.71Å; L355-L376 HydrophobicContact CD2-CD1 4.01Å; F373-L376 HydrophobicContact CB-CD1 4.16Å; F373-L376 HydrophobicContact CD1-CD1 4.01Å; F373-L376 WeakPolarHBondContact O-CB 3.39Å; F373-L376 PolarHBondContact O-N 3.04Å; L376-K378 PolarHBondContact O-N 3.07Å; L376-L379 HydrophobicContact CB-CB 4.27Å; L376-L379 HydrophobicContact CD1-CD2 4.25Å; L376-L379 WeakPolarHBondContact O-CB 3.05Å; L376-L379 PolarHBondContact O-N 2.98Å; L376-G399 CarbonylContact C-O 3.42Å; L376-L400 HydrophobicContact CB-CD2 3.75Å; L376-L400 HydrophobicContact CD1-CD2 4.41Å
377	D	88.3	Confident	89	Confident	98 Å²	98	29.8 Å²	29.8	52%	0.524	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	5.5	-169.9	-28	-36.2	0	0	0	116.4	G375 T402	G375-D377 VanDerWaalsContact C-N 3.29Å; G375-D377 VanDerWaalsContact C-OD1 3.23Å; G375-D377 WeakPolarHBondContact CA-OD1 3.37Å; G375-D377 PolarHBondContact O-N 3.16Å; D377-T402 VanDerWaalsContact O-CG2 3.3Å; D377-T402 WeakPolarHBondContact O-CG2 3.19Å
378	K	94.3	Very high	89.4	Confident	113 Å²	113	34.8 Å²	34.8	49%	0.491	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.3	7.3	176.2	-60.6	-172.5	-167.1	147.7	0	113.6	K350 L352 L376 N380 T402	K350-K378 WeakPolarHBondContact O-CD 3.41Å; K350-K378 WeakPolarHBondContact O-CE 3.22Å; K350-K378 PolarHBondContact O-NZ 3.1Å; L352-K378 CarbonylContact O-C 3.29Å; L376-K378 PolarHBondContact O-N 3.07Å; K378-N380 PolarHBondContact O-N 2.8Å; K378-T402 WeakPolarHBondContact CA-OG1 3.07Å
379	L	96.6	Very high	90	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.			trans	-64.8	131.3	-179.5	-160.1	72	0	0	0	109.5	L352 L355 L376 L382 L400 T402 L403	L352-L379 HydrophobicContact CB-CD1 4.44Å; L352-L379 HydrophobicContact CD2-CD1 3.99Å; L352-L379 HydrophobicContact CG-CD1 3.95Å; L352-L379 WeakPolarHBondContact O-CA 3.11Å; L352-L379 PolarHBondContact O-N 3.17Å; L355-L379 HydrophobicContact CB-CD1 3.84Å; L355-L379 HydrophobicContact CB-CD2 4.23Å; L376-L379 HydrophobicContact CB-CB 4.27Å; L376-L379 HydrophobicContact CD1-CD2 4.25Å; L376-L379 WeakPolarHBondContact O-CB 3.05Å; L376-L379 PolarHBondContact O-N 2.98Å; L379-L382 HydrophobicContact CD2-CB 3.95Å; L379-L400 HydrophobicContact CB-CD2 4.01Å; L379-L400 HydrophobicContact CD2-CD2 3.63Å; L379-L400 HydrophobicContact CG-CD2 4.47Å; L379-T402 PolarHBondContact N-OG1 2.95Å; L379-T402 CarbonylContact O-C 3.1Å; L379-T402 PolarHBondContact O-OG1 2.9Å; L379-L403 HydrophobicContact CB-CD1 4.14Å; L379-L403 HydrophobicContact CD2-CD1 3.87Å; L379-L403 HydrophobicContact CG-CD1 3.86Å; L379-L403 WeakPolarHBondContact O-CA 3.21Å; L379-L403 PolarHBondContact O-N 3.21Å
380	N	97.3	Very high	91.1	Very high	50 Å²	50	34.3 Å²	34.3	27%	0.267	18%	0.184	S	C	.	.			trans	-109.5	-40.3	-179.1	172.1	-84.8	0	0	0	110.7	R353 K378 E404 H405	R353-N380 PolarHBondContact O-N 3.44Å; K378-N380 PolarHBondContact O-N 2.8Å; N380-E404 VanDerWaalsContact ND2-CG 3.27Å; N380-E404 WeakPolarHBondContact ND2-CG 3.43Å; N380-E404 PolarHBondContact ND2-OE2 3.4Å; N380-E404 PolarHBondContact O-N 3.49Å; N380-H405 PolarHBondContact O-N 3.33Å
381	K	98.4	Very high	92.2	Very high	71 Å²	71	34.2 Å²	34.2	31%	0.309	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.9	178.5	-179.5	-173.3	171.5	-158.9	0	111.4	R353 V354 L355 E356 H405	R353-K381 PolarHBondContact O-N 3.17Å; V354-K381 HydrophobicContact CG1-CD 4.15Å; V354-K381 HydrophobicContact CG2-CB 4.35Å; L355-K381 PolarHBondContact N-O 3.33Å; E356-K381 IonicContact OE1-NZ 3.36Å; E356-K381 PolarHBondContact OE1-NZ 3.16Å; K381-H405 WeakPolarHBondContact CA-O 3.18Å; K381-H405 HydrophobicContact CB-CB 4.22Å; K381-H405 HydrophobicContact CG-CB 4.13Å
382	L	98.1	Very high	93	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.8	167.3	176.6	57.8	0	0	0	108.8	L355 L357 F373 L379 L384 F397 L400 L403 H405 L406 N407	L355-L382 HydrophobicContact CB-CD1 4.13Å; L355-L382 HydrophobicContact CD2-CD1 3.98Å; L355-L382 HydrophobicContact CG-CD1 3.93Å; L357-L382 HydrophobicContact CD1-CD1 4.33Å; F373-L382 HydrophobicContact CE1-CD1 4.12Å; F373-L382 HydrophobicContact CE1-CD2 4.22Å; F373-L382 HydrophobicContact CZ-CD2 4.28Å; L379-L382 HydrophobicContact CD2-CB 3.95Å; L382-L384 HydrophobicContact CD1-CD1 4.41Å; L382-L384 HydrophobicContact CD1-CG 4.23Å; L382-L384 HydrophobicContact CD2-CD1 4.03Å; L382-L384 HydrophobicContact CG-CD1 4.14Å; L382-L384 HydrophobicContact CG-CG 4.31Å; L382-F397 HydrophobicContact CD2-CD1 4.21Å; L382-F397 HydrophobicContact CD2-CE1 4.16Å; L382-L400 HydrophobicContact CD2-CD1 3.65Å; L382-L403 HydrophobicContact CB-CD1 3.92Å; L382-L403 HydrophobicContact CB-CD2 4.1Å; L382-H405 PolarHBondContact N-O 3.42Å; L382-L406 HydrophobicContact CB-CD1 4.14Å; L382-L406 HydrophobicContact CD2-CD1 3.99Å; L382-L406 HydrophobicContact CG-CD1 4.03Å; L382-L406 WeakPolarHBondContact O-CA 3.33Å; L382-N407 PolarHBondContact O-N 2.8Å
383	T	98.3	Very high	93.3	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.025	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.9	176.4	-171.5	0	0	0	0	110.2	L355 E356 L357 D358 N407	L355-T383 PolarHBondContact O-N 2.68Å; L355-T383 VanDerWaalsContact O-N 3.13Å; E356-T383 HydrophobicContact CB-CG2 3.8Å; E356-T383 HydrophobicContact CG-CG2 3.77Å; L357-T383 WeakPolarHBondContact CA-O 3.47Å; L357-T383 PolarHBondContact N-O 3.17Å; D358-T383 VanDerWaalsContact OD1-CB 3.24Å; D358-T383 WeakPolarHBondContact OD1-CB 3.34Å; D358-T383 WeakPolarHBondContact OD1-CG2 3.06Å; D358-T383 PolarHBondContact OD1-OG1 3.12Å; D358-T383 WeakPolarHBondContact OD2-CG2 3.39Å; D358-T383 PolarHBondContact OD2-OG1 3.29Å; T383-N407 WeakPolarHBondContact OG1-CB 3.04Å; T383-N407 PolarHBondContact OG1-ND2 3.02Å
384	L	97.8	Very high	93.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.			trans	-129.1	26.4	-174	-73	161.9	0	0	0	109.7	L357 D358 I362 I366 F373 L382 N387 I389 F397 N407 L408 N411	L357-L384 HydrophobicContact CB-CD2 3.73Å; L357-L384 HydrophobicContact CD1-CD2 3.95Å; D358-L384 PolarHBondContact OD1-N 3.33Å; I362-L384 HydrophobicContact CD1-CD2 3.68Å; I366-L384 HydrophobicContact CD1-CD1 3.92Å; I366-L384 HydrophobicContact CG1-CD1 4.4Å; F373-L384 HydrophobicContact CZ-CD1 4.5Å; L382-L384 HydrophobicContact CD1-CD1 4.41Å; L382-L384 HydrophobicContact CD1-CG 4.23Å; L382-L384 HydrophobicContact CD2-CD1 4.03Å; L382-L384 HydrophobicContact CG-CD1 4.14Å; L382-L384 HydrophobicContact CG-CG 4.31Å; L384-N387 VanDerWaalsContact C-ND2 3.34Å; L384-N387 WeakPolarHBondContact O-CB 3.44Å; L384-N387 PolarHBondContact O-ND2 2.98Å; L384-I389 HydrophobicContact CB-CD1 4.22Å; L384-I389 HydrophobicContact CD1-CD1 4.48Å; L384-F397 HydrophobicContact CD1-CE1 4.15Å; L384-N407 PolarHBondContact N-O 3.34Å; L384-L408 HydrophobicContact CB-CD2 4.1Å; L384-L408 HydrophobicContact CD1-CD2 3.96Å; L384-N411 PolarHBondContact O-ND2 2.94Å
385	F	97.9	Very high	93.3	Very high	59 Å²	59	42.4 Å²	42.4	26%	0.259	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	145.8	-176.2	178.3	-82.1	0	0	0	111.5	D358 H359 N387 G409 D410	D358-F385 CarbonylContact C-O 3.18Å; D358-F385 WeakPolarHBondContact CA-O 3.42Å; D358-F385 HydrophobicContact CB-CB 4.18Å; D358-F385 VanDerWaalsContact OD1-CB 3.32Å; D358-F385 WeakPolarHBondContact OD1-CB 3.48Å; D358-F385 PolarHBondContact OD1-N 3.36Å; H359-F385 AromaticContact CE1-CD1 3.48Å; H359-F385 VanDerWaalsContact CE1-CD1 3.48Å; H359-F385 WeakPolarHBondContact CE1-CD1 3.44Å; H359-F385 AromaticContact CE1-CE1 3.69Å; H359-F385 PolarHBondContact N-O 3.18Å; H359-F385 AromaticContact NE2-CE1 3.89Å; F385-N387 VanDerWaalsContact C-N 3.34Å; F385-N387 PolarHBondContact O-N 3.03Å; F385-N387 PolarHBondContact O-ND2 3.42Å; F385-G409 CarbonylContact C-O 3.49Å; F385-G409 VanDerWaalsContact CA-O 3.23Å; F385-G409 WeakPolarHBondContact CA-O 3.42Å; F385-G409 WeakPolarHBondContact CD2-O 3.43Å; F385-D410 HydrophobicContact CD1-CB 4.15Å; F385-D410 HydrophobicContact CD2-CB 4.11Å; F385-D410 HydrophobicContact CE1-CB 3.68Å; F385-D410 HydrophobicContact CE2-CB 3.64Å; F385-D410 HydrophobicContact CG-CB 4.35Å; F385-D410 HydrophobicContact CZ-CB 3.41Å; F385-D410 VanDerWaalsContact CZ-CB 3.41Å
386	G	97.1	Very high	93.6	Very high	16 Å²	16	41.2 Å²	41.2	17%	0.165	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	34.4	173	0	0	0	0	0	113.6	H359 G409 D410	H359-G386 WeakPolarHBondContact CA-O 3.47Å; G386-G409 PolarHBondContact N-O 2.95Å; G386-D410 WeakPolarHBondContact CA-O 3.45Å; G386-D410 PolarHBondContact N-O 3.35Å
387	N	97.3	Very high	93.5	Very high	11 Å²	11	41.4 Å²	41.4	6%	0.059	19%	0.194	C	C	.	.			trans	-106.2	-175.3	178.7	-86.7	-90.6	0	0	0	110.8	L357 N360 I362 L384 F385 I389 N411	L357-N387 PolarHBondContact O-ND2 2.86Å; N360-N387 WeakPolarHBondContact CA-OD1 3.43Å; N360-N387 WeakPolarHBondContact CB-OD1 3.41Å; N360-N387 PolarHBondContact N-OD1 3.2Å; N360-N387 PolarHBondContact O-OD1 2.99Å; N360-N387 VanDerWaalsContact O-OD1 3.08Å; I362-N387 HydrophobicContact CB-CB 4.41Å; I362-N387 WeakPolarHBondContact CB-OD1 3.4Å; I362-N387 VanDerWaalsContact CG1-OD1 3.31Å; I362-N387 WeakPolarHBondContact CG1-OD1 3.32Å; I362-N387 PolarHBondContact N-OD1 2.91Å; I362-N387 VanDerWaalsContact N-OD1 3.12Å; L384-N387 VanDerWaalsContact C-ND2 3.34Å; L384-N387 WeakPolarHBondContact O-CB 3.44Å; L384-N387 PolarHBondContact O-ND2 2.98Å; F385-N387 VanDerWaalsContact C-N 3.34Å; F385-N387 PolarHBondContact O-N 3.03Å; F385-N387 PolarHBondContact O-ND2 3.42Å; N387-I389 HydrophobicContact CB-CD1 4.32Å; N387-I389 HydrophobicContact CB-CG1 4.27Å; N387-N411 VanDerWaalsContact CA-OD1 3.3Å; N387-N411 WeakPolarHBondContact CA-OD1 3.26Å; N387-N411 WeakPolarHBondContact CB-OD1 3.27Å; N387-N411 PolarHBondContact N-ND2 3Å; N387-N411 PolarHBondContact N-OD1 3.39Å; N387-N411 PolarHBondContact O-OD1 3.33Å; N387-N411 VanDerWaalsContact O-OD1 3.09Å
388	K	93.3	Very high	93.4	Very high	119 Å²	119	38.1 Å²	38.1	52%	0.517	18%	0.181	S	C	.	.			trans	-100.5	20.8	-174.6	-68	-179.1	172.9	170.8	0	113.4	D361 I362 S363 K390	D361-K388 HydrophobicContact CB-CD 4.36Å; D361-K388 WeakPolarHBondContact OD1-CE 3.43Å; D361-K388 IonicContact OD1-NZ 2.68Å; D361-K388 PolarHBondContact OD1-NZ 2.87Å; I362-K388 CarbonylContact O-C 3.52Å; I362-K388 WeakPolarHBondContact O-CA 3.34Å; I362-K388 PolarHBondContact O-N 3.01Å; S363-K388 WeakPolarHBondContact CB-O 3.47Å; K388-K390 PolarHBondContact O-N 3.41Å
389	I	92.7	Very high	92.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.			trans	-70.1	116.1	-174.4	-54.6	163.8	0	0	0	110.5	I362 I366 L384 N387 S391 V392 L408 N411 A412 I413	I362-I389 PolarHBondContact O-N 3.2Å; I366-I389 HydrophobicContact CB-CD1 4.15Å; I366-I389 HydrophobicContact CB-CG1 4.11Å; I366-I389 HydrophobicContact CB-CG2 3.9Å; I366-I389 HydrophobicContact CG1-CD1 3.72Å; I366-I389 HydrophobicContact CG1-CG1 3.99Å; I366-I389 HydrophobicContact CG2-CD1 4.23Å; I366-I389 HydrophobicContact CG2-CG2 3.73Å; L384-I389 HydrophobicContact CB-CD1 4.22Å; L384-I389 HydrophobicContact CD1-CD1 4.48Å; N387-I389 HydrophobicContact CB-CD1 4.32Å; N387-I389 HydrophobicContact CB-CG1 4.27Å; I389-S391 VanDerWaalsContact CG2-O 3.29Å; I389-S391 WeakPolarHBondContact CG2-O 3.21Å; I389-V392 HydrophobicContact CG2-CG2 4.48Å; I389-L408 HydrophobicContact CD1-CD2 4.13Å; I389-N411 HydrophobicContact CB-CB 4.25Å; I389-N411 VanDerWaalsContact CB-OD1 3.27Å; I389-N411 WeakPolarHBondContact CB-OD1 3.44Å; I389-N411 WeakPolarHBondContact CD1-OD1 3.15Å; I389-N411 VanDerWaalsContact CG1-OD1 3.26Å; I389-N411 WeakPolarHBondContact CG1-OD1 3.29Å; I389-N411 PolarHBondContact N-OD1 2.91Å; I389-A412 CarbonylContact O-C 3.57Å; I389-I413 HydrophobicContact CG2-CG1 4.33Å; I389-I413 PolarHBondContact O-N 2.74Å
390	K	90.1	Very high	92.6	Very high	76 Å²	76	33.4 Å²	33.4	33%	0.33	16%	0.164	S	C	.	.			trans	-95.6	-20.2	175.3	-55.2	173.6	-167.3	164.2	0	113.7	E367 K388 R414	E367-K390 WeakPolarHBondContact OE1-CB 3.3Å; E367-K390 PolarHBondContact OE1-N 3.19Å; K388-K390 PolarHBondContact O-N 3.41Å; K390-R414 WeakPolarHBondContact O-CB 3.14Å; K390-R414 PolarHBondContact O-N 3.1Å
391	S	90.6	Very high	92.3	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	162.2	175.3	54.8	0	0	0	0	112.8	I366 E367 I389 S415 K489	I366-S391 CarbonylContact C-O 3.6Å; E367-S391 WeakPolarHBondContact CA-O 3.4Å; E367-S391 VanDerWaalsContact CG-O 3.22Å; E367-S391 WeakPolarHBondContact CG-O 3.43Å; I389-S391 VanDerWaalsContact CG2-O 3.29Å; I389-S391 WeakPolarHBondContact CG2-O 3.21Å; S391-S415 CarbonylContact C-O 3.56Å; S391-S415 WeakPolarHBondContact CA-O 3.39Å; S391-S415 WeakPolarHBondContact CB-O 3.46Å; S391-S415 VanDerWaalsContact CB-OG 3.31Å; S391-S415 WeakPolarHBondContact CB-OG 3.44Å; S391-K489 PolarHBondContact OG-NZ 3.09Å
392	V	92.8	Very high	92.1	Very high	2 Å²	2	33 Å²	33	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	119.3	-179.6	-179.1	0	0	0	0	109.6	I366 I389 A396 F397 L408 I413 S415 I416 Q417 A420 F421	I366-V392 HydrophobicContact CG2-CB 4.42Å; I366-V392 HydrophobicContact CG2-CG1 4.32Å; I366-V392 HydrophobicContact CG2-CG2 4.04Å; I389-V392 HydrophobicContact CG2-CG2 4.48Å; V392-A396 HydrophobicContact CG1-CB 4.35Å; V392-F397 HydrophobicContact CG1-CD2 4.3Å; V392-F397 HydrophobicContact CG1-CE2 3.59Å; V392-F397 HydrophobicContact CG1-CZ 4.35Å; V392-L408 HydrophobicContact CG2-CD1 4.44Å; V392-I413 HydrophobicContact CG2-CD1 4.35Å; V392-S415 PolarHBondContact N-O 3.1Å; V392-I416 HydrophobicContact CB-CB 4.35Å; V392-I416 HydrophobicContact CB-CG1 4.13Å; V392-I416 HydrophobicContact CB-CG2 4.01Å; V392-I416 HydrophobicContact CG1-CG2 4.33Å; V392-I416 HydrophobicContact CG2-CG1 4.06Å; V392-Q417 PolarHBondContact O-N 3.47Å; V392-A420 HydrophobicContact CG1-CB 4.01Å; V392-F421 HydrophobicContact CG1-CE1 4.43Å
393	A	89.9	Confident	92	Very high	4 Å²	4	33 Å²	33	3%	0.033	17%	0.165	C	C	.	.			trans	-81.5	152.5	176.6	0	0	0	0	0	112.8	I366 D368 T369 K395 A396	I366-A393 PolarHBondContact O-N 3.4Å; D368-A393 VanDerWaalsContact O-CB 3.25Å; D368-A393 WeakPolarHBondContact O-CB 3.45Å; T369-A393 HydrophobicContact CG2-CB 3.79Å; A393-K395 PolarHBondContact O-N 2.94Å; A393-A396 HydrophobicContact CB-CB 4.45Å; A393-A396 WeakPolarHBondContact O-CB 3.25Å; A393-A396 PolarHBondContact O-N 3.45Å
394	K	87.9	Confident	91.9	Very high	96 Å²	96	34.9 Å²	34.9	42%	0.417	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-21	-177.4	-173.9	174.2	-172.4	118.3	0	114.6	Q417 P418 D419	K394-Q417 HydrophobicContact CB-CB 4.12Å; K394-P418 WeakPolarHBondContact CD-O 3.11Å; K394-P418 WeakPolarHBondContact CE-O 3.16Å; K394-P418 WeakPolarHBondContact CG-O 3.29Å; K394-P418 PolarHBondContact NZ-O 3.47Å; K394-D419 IonicContact NZ-OD2 2.73Å; K394-D419 PolarHBondContact NZ-OD2 3Å
395	K	86.8	Confident	92	Very high	140 Å²	140	38.4 Å²	38.4	61%	0.609	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.3	3.1	179.3	-62.6	-176.7	179.2	177.8	0	114.4	T369 A393 F397 A398	T369-K395 HydrophobicContact CG2-CB 4.05Å; A393-K395 PolarHBondContact O-N 2.94Å; K395-F397 PolarHBondContact O-N 3.15Å; K395-F397 VanDerWaalsContact O-N 3.09Å; K395-A398 WeakPolarHBondContact O-CB 3.02Å; K395-A398 PolarHBondContact O-N 2.81Å
396	A	87.7	Confident	92	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.6	-175.6	0	0	0	0	0	113.7	I366 F373 V392 A393	I366-A396 HydrophobicContact CG2-CB 4.16Å; I366-A396 WeakPolarHBondContact O-CB 3.06Å; F373-A396 WeakPolarHBondContact CD2-O 3.1Å; V392-A396 HydrophobicContact CG1-CB 4.35Å; A393-A396 HydrophobicContact CB-CB 4.45Å; A393-A396 WeakPolarHBondContact O-CB 3.25Å; A393-A396 PolarHBondContact O-N 3.45Å
397	F	89.8	Confident	92	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.018	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	28.6	179.2	-54.2	-58.3	0	0	0	113.2	I366 L382 L384 V392 K395 L400 L406 L408 F421 M424	I366-F397 HydrophobicContact CD1-CE1 4.04Å; I366-F397 HydrophobicContact CD1-CZ 4.46Å; I366-F397 HydrophobicContact CG2-CZ 4.05Å; L382-F397 HydrophobicContact CD2-CD1 4.21Å; L382-F397 HydrophobicContact CD2-CE1 4.16Å; L384-F397 HydrophobicContact CD1-CE1 4.15Å; V392-F397 HydrophobicContact CG1-CD2 4.3Å; V392-F397 HydrophobicContact CG1-CE2 3.59Å; V392-F397 HydrophobicContact CG1-CZ 4.35Å; K395-F397 PolarHBondContact O-N 3.15Å; K395-F397 VanDerWaalsContact O-N 3.09Å; F397-L400 HydrophobicContact CB-CD1 4.1Å; F397-L400 HydrophobicContact CD1-CD1 3.95Å; F397-L400 HydrophobicContact CG-CD1 4.47Å; F397-L400 WeakPolarHBondContact O-CB 3.06Å; F397-L400 PolarHBondContact O-N 3.4Å; F397-L406 HydrophobicContact CD2-CD2 4.27Å; F397-L406 HydrophobicContact CE1-CD1 4.28Å; F397-L406 HydrophobicContact CE1-CD2 4.49Å; F397-L406 HydrophobicContact CE2-CD2 3.98Å; F397-L406 HydrophobicContact CZ-CD1 4.42Å; F397-L406 HydrophobicContact CZ-CD2 4.11Å; F397-L408 HydrophobicContact CE2-CD1 4.4Å; F397-L408 HydrophobicContact CZ-CD1 4.24Å; F397-L408 HydrophobicContact CZ-CD2 4.07Å; F397-F421 HydrophobicContact CD2-CD1 4.35Å; F397-F421 HydrophobicContact CD2-CE1 4.38Å; F397-F421 HydrophobicContact CE2-CD1 4.47Å; F397-F421 HydrophobicContact CE2-CE1 4.05Å; F397-M424 HydrophobicContact CB-CE 4.06Å; F397-M424 HydrophobicContact CB-SD 4.02Å; F397-M424 HydrophobicContact CD2-CE 3.85Å; F397-M424 HydrophobicContact CG-CE 4.14Å; F397-M424 HydrophobicContact CG-SD 4.36Å
398	A	86	Confident	92	Very high	30 Å²	30	35.8 Å²	35.8	25%	0.248	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	132.8	173.6	0	0	0	0	0	111.3	K395	K395-A398 WeakPolarHBondContact O-CB 3.02Å; K395-A398 PolarHBondContact O-N 2.81Å
399	G	83.8	Confident	92.1	Very high	13 Å²	13	30.2 Å²	30.2	13%	0.134	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	6.6	-173.1	0	0	0	0	0	114.5	L376 E401	L376-G399 CarbonylContact C-O 3.42Å; G399-E401 WeakPolarHBondContact CA-OE2 3.08Å; G399-E401 PolarHBondContact N-OE2 3.37Å
400	L	91.3	Very high	92.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.173	C	C	.	.			trans	-111.3	30.9	178.1	-59.4	-174.8	0	0	0	112.8	F373 L376 L379 L382 F397 T402 L403	F373-L400 HydrophobicContact CB-CD1 4.12Å; F373-L400 HydrophobicContact CB-CD2 4.05Å; F373-L400 HydrophobicContact CB-CG 4.08Å; F373-L400 HydrophobicContact CG-CD1 4.22Å; L376-L400 HydrophobicContact CB-CD2 3.75Å; L376-L400 HydrophobicContact CD1-CD2 4.41Å; L379-L400 HydrophobicContact CB-CD2 4.01Å; L379-L400 HydrophobicContact CD2-CD2 3.63Å; L379-L400 HydrophobicContact CG-CD2 4.47Å; L382-L400 HydrophobicContact CD2-CD1 3.65Å; F397-L400 HydrophobicContact CB-CD1 4.1Å; F397-L400 HydrophobicContact CD1-CD1 3.95Å; F397-L400 HydrophobicContact CG-CD1 4.47Å; F397-L400 WeakPolarHBondContact O-CB 3.06Å; F397-L400 PolarHBondContact O-N 3.4Å; L400-T402 PolarHBondContact O-N 2.77Å; L400-L403 HydrophobicContact CB-CB 4.3Å; L400-L403 HydrophobicContact CD1-CD2 4.48Å; L400-L403 VanDerWaalsContact O-CB 3.27Å; L400-L403 WeakPolarHBondContact O-CB 3.01Å; L400-L403 PolarHBondContact O-N 2.8Å
401	E	90.2	Very high	92.4	Very high	68 Å²	68	31 Å²	31	32%	0.318	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.7	-176.3	-75	70.5	-163.8	0	0	114.1	G399 R423	G399-E401 WeakPolarHBondContact CA-OE2 3.08Å; G399-E401 PolarHBondContact N-OE2 3.37Å; E401-R423 WeakPolarHBondContact CA-O 3.44Å; E401-R423 HydrophobicContact CG-CB 4.31Å; E401-R423 WeakPolarHBondContact OE1-CD 3.31Å; E401-R423 IonicContact OE1-CZ 2.63Å; E401-R423 IonicContact OE1-NE 2.69Å; E401-R423 IonicContact OE1-NH1 2.64Å; E401-R423 PolarHBondContact OE1-NH1 3.17Å
402	T	94.3	Very high	92.5	Very high	46 Å²	46	33.1 Å²	33.1	28%	0.282	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.8	178.8	57.8	0	0	0	0	115.3	D377 K378 L379 L400 E404	D377-T402 VanDerWaalsContact O-CG2 3.3Å; D377-T402 WeakPolarHBondContact O-CG2 3.19Å; K378-T402 WeakPolarHBondContact CA-OG1 3.07Å; L379-T402 PolarHBondContact N-OG1 2.95Å; L379-T402 CarbonylContact O-C 3.1Å; L379-T402 PolarHBondContact O-OG1 2.9Å; L400-T402 PolarHBondContact O-N 2.77Å; T402-E404 PolarHBondContact O-N 2.71Å
403	L	96.6	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.			trans	-66.2	132	-168.2	-160	77.1	0	0	0	112.5	L379 L382 L400 L406 M424 N426 L427	L379-L403 HydrophobicContact CB-CD1 4.14Å; L379-L403 HydrophobicContact CD2-CD1 3.87Å; L379-L403 HydrophobicContact CG-CD1 3.86Å; L379-L403 WeakPolarHBondContact O-CA 3.21Å; L379-L403 PolarHBondContact O-N 3.21Å; L382-L403 HydrophobicContact CB-CD1 3.92Å; L382-L403 HydrophobicContact CB-CD2 4.1Å; L400-L403 HydrophobicContact CB-CB 4.3Å; L400-L403 HydrophobicContact CD1-CD2 4.48Å; L400-L403 VanDerWaalsContact O-CB 3.27Å; L400-L403 WeakPolarHBondContact O-CB 3.01Å; L400-L403 PolarHBondContact O-N 2.8Å; L403-L406 HydrophobicContact CD2-CB 3.84Å; L403-L406 HydrophobicContact CD2-CD1 4.2Å; L403-L406 HydrophobicContact CD2-CG 4.41Å; L403-M424 HydrophobicContact CB-CG 4.31Å; L403-M424 HydrophobicContact CB-SD 4.17Å; L403-M424 HydrophobicContact CD2-SD 3.57Å; L403-M424 VanDerWaalsContact CD2-SD 3.57Å; L403-M424 HydrophobicContact CG-SD 4.5Å; L403-N426 CarbonylContact O-C 3.27Å; L403-N426 VanDerWaalsContact O-C 3.22Å; L403-L427 WeakPolarHBondContact O-CA 3.05Å; L403-L427 PolarHBondContact O-N 3.07Å
404	E	97.3	Very high	92.6	Very high	43 Å²	43	34.4 Å²	34.4	20%	0.201	18%	0.181	C	C	.	.			trans	-108.9	-29.1	180	-56.9	-164.8	155.5	0	0	112.8	N380 T402 N426 K428 S429	N380-E404 VanDerWaalsContact ND2-CG 3.27Å; N380-E404 WeakPolarHBondContact ND2-CG 3.43Å; N380-E404 PolarHBondContact ND2-OE2 3.4Å; N380-E404 PolarHBondContact O-N 3.49Å; T402-E404 PolarHBondContact O-N 2.71Å; E404-N426 WeakPolarHBondContact CA-O 2.96Å; E404-N426 HydrophobicContact CG-CB 4.18Å; E404-K428 HydrophobicContact CB-CD 4.29Å; E404-K428 VanDerWaalsContact CD-CE 3.43Å; E404-K428 PolarHBondContact O-N 2.79Å; E404-K428 WeakPolarHBondContact OE1-CE 3.47Å; E404-K428 IonicContact OE1-NZ 2.92Å; E404-K428 PolarHBondContact OE1-NZ 3.24Å; E404-K428 IonicContact OE2-NZ 2.63Å; E404-K428 PolarHBondContact OE2-NZ 2.98Å; E404-S429 PolarHBondContact O-N 2.03Å
405	H	98.1	Very high	92.8	Very high	74 Å²	74	30.5 Å²	30.5	34%	0.343	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	116.9	-178.5	-59.7	-84.5	0	0	0	110.8	N380 K381 L382 S429	N380-H405 PolarHBondContact O-N 3.33Å; K381-H405 WeakPolarHBondContact CA-O 3.18Å; K381-H405 HydrophobicContact CB-CB 4.22Å; K381-H405 HydrophobicContact CG-CB 4.13Å; L382-H405 PolarHBondContact N-O 3.42Å; H405-S429 WeakPolarHBondContact CA-O 3.21Å; H405-S429 VanDerWaalsContact ND1-CB 3.32Å; H405-S429 WeakPolarHBondContact ND1-CB 3.5Å
406	L	97.9	Very high	93.1	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	172.9	-179	55.7	0	0	0	110.2	L382 F397 L403 L408 F421 M424 L427 S429 L430 L431	L382-L406 HydrophobicContact CB-CD1 4.14Å; L382-L406 HydrophobicContact CD2-CD1 3.99Å; L382-L406 HydrophobicContact CG-CD1 4.03Å; L382-L406 WeakPolarHBondContact O-CA 3.33Å; F397-L406 HydrophobicContact CD2-CD2 4.27Å; F397-L406 HydrophobicContact CE1-CD1 4.28Å; F397-L406 HydrophobicContact CE1-CD2 4.49Å; F397-L406 HydrophobicContact CE2-CD2 3.98Å; F397-L406 HydrophobicContact CZ-CD1 4.42Å; F397-L406 HydrophobicContact CZ-CD2 4.11Å; L403-L406 HydrophobicContact CD2-CB 3.84Å; L403-L406 HydrophobicContact CD2-CD1 4.2Å; L403-L406 HydrophobicContact CD2-CG 4.41Å; L406-L408 HydrophobicContact CD1-CD2 4.31Å; L406-L408 HydrophobicContact CD1-CG 4.27Å; L406-L408 HydrophobicContact CD2-CD1 4.11Å; L406-L408 HydrophobicContact CD2-CG 4.43Å; L406-L408 HydrophobicContact CG-CD1 4.31Å; L406-L408 HydrophobicContact CG-CG 4.11Å; L406-F421 HydrophobicContact CD2-CE1 4.39Å; L406-M424 HydrophobicContact CD2-CE 3.77Å; L406-M424 HydrophobicContact CD2-SD 4.12Å; L406-L427 HydrophobicContact CB-CD1 3.86Å; L406-S429 PolarHBondContact N-O 2.8Å; L406-L430 HydrophobicContact CB-CD1 4.07Å; L406-L430 HydrophobicContact CD2-CD1 3.98Å; L406-L430 HydrophobicContact CG-CD1 3.99Å; L406-L430 CarbonylContact O-C 3.35Å; L406-L430 WeakPolarHBondContact O-CA 3.36Å; L406-L431 PolarHBondContact O-N 3.23Å
407	N	98.1	Very high	93.2	Very high	29 Å²	29	28.2 Å²	28.2	16%	0.155	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	115.6	176.3	178.9	14.1	0	0	0	111.3	L382 T383 L384 G409 L431	L382-N407 PolarHBondContact O-N 2.8Å; T383-N407 WeakPolarHBondContact OG1-CB 3.04Å; T383-N407 PolarHBondContact OG1-ND2 3.02Å; L384-N407 PolarHBondContact N-O 3.34Å; N407-G409 PolarHBondContact OD1-N 3.15Å; N407-L431 HydrophobicContact CB-CB 4.24Å; N407-L431 HydrophobicContact CB-CD1 4.26Å; N407-L431 WeakPolarHBondContact OD1-CB 3.48Å
408	L	97.3	Very high	93.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	18.9	177.4	-60.5	172.4	0	0	0	111	L384 I389 V392 F397 L406 N411 I413 F421 L430 L431 I432	L384-L408 HydrophobicContact CB-CD2 4.1Å; L384-L408 HydrophobicContact CD1-CD2 3.96Å; I389-L408 HydrophobicContact CD1-CD2 4.13Å; V392-L408 HydrophobicContact CG2-CD1 4.44Å; F397-L408 HydrophobicContact CE2-CD1 4.4Å; F397-L408 HydrophobicContact CZ-CD1 4.24Å; F397-L408 HydrophobicContact CZ-CD2 4.07Å; L406-L408 HydrophobicContact CD1-CD2 4.31Å; L406-L408 HydrophobicContact CD1-CG 4.27Å; L406-L408 HydrophobicContact CD2-CD1 4.11Å; L406-L408 HydrophobicContact CD2-CG 4.43Å; L406-L408 HydrophobicContact CG-CD1 4.31Å; L406-L408 HydrophobicContact CG-CG 4.11Å; L408-N411 PolarHBondContact O-ND2 3.15Å; L408-I413 HydrophobicContact CB-CD1 3.98Å; L408-I413 HydrophobicContact CD1-CD1 4.44Å; L408-F421 HydrophobicContact CD1-CE1 4.43Å; L408-L430 HydrophobicContact CD1-CD1 4.47Å; L408-L431 CarbonylContact C-O 3.29Å; L408-L431 WeakPolarHBondContact CA-O 3.16Å; L408-L431 PolarHBondContact N-O 2.95Å; L408-I432 HydrophobicContact CB-CG1 4.32Å
409	G	95.7	Very high	93.3	Very high	3 Å²	3	32.4 Å²	32.4	3%	0.031	18%	0.178	C	C	.	.			trans	-61.7	158.3	176.6	0	0	0	0	0	112.7	F385 G386 N407 N411 L431	F385-G409 CarbonylContact C-O 3.49Å; F385-G409 VanDerWaalsContact CA-O 3.23Å; F385-G409 WeakPolarHBondContact CA-O 3.42Å; F385-G409 WeakPolarHBondContact CD2-O 3.43Å; G386-G409 PolarHBondContact N-O 2.95Å; N407-G409 PolarHBondContact OD1-N 3.15Å; G409-N411 PolarHBondContact O-N 2.85Å; G409-N411 PolarHBondContact O-ND2 2.66Å; G409-L431 PolarHBondContact N-O 2.83Å
410	D	94.1	Very high	93.7	Very high	86 Å²	86	32 Å²	32	46%	0.46	17%	0.173	S	C	.	.	S	Bend	trans	52.2	40.3	179.7	-161.9	41.9	0	0	0	113.1	F385 G386	F385-D410 HydrophobicContact CD1-CB 4.15Å; F385-D410 HydrophobicContact CD2-CB 4.11Å; F385-D410 HydrophobicContact CE1-CB 3.68Å; F385-D410 HydrophobicContact CE2-CB 3.64Å; F385-D410 HydrophobicContact CG-CB 4.35Å; F385-D410 HydrophobicContact CZ-CB 3.41Å; F385-D410 VanDerWaalsContact CZ-CB 3.41Å; G386-D410 WeakPolarHBondContact CA-O 3.45Å; G386-D410 PolarHBondContact N-O 3.35Å
411	N	94.5	Very high	93.7	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.027	17%	0.173	C	C	.	.			trans	-122.9	137.6	170.5	-78.6	-99.8	0	0	0	107.9	L384 N387 I389 L408 G409 I413 S434	L384-N411 PolarHBondContact O-ND2 2.94Å; N387-N411 VanDerWaalsContact CA-OD1 3.3Å; N387-N411 WeakPolarHBondContact CA-OD1 3.26Å; N387-N411 WeakPolarHBondContact CB-OD1 3.27Å; N387-N411 PolarHBondContact N-ND2 3Å; N387-N411 PolarHBondContact N-OD1 3.39Å; N387-N411 PolarHBondContact O-OD1 3.33Å; N387-N411 VanDerWaalsContact O-OD1 3.09Å; I389-N411 HydrophobicContact CB-CB 4.25Å; I389-N411 VanDerWaalsContact CB-OD1 3.27Å; I389-N411 WeakPolarHBondContact CB-OD1 3.44Å; I389-N411 WeakPolarHBondContact CD1-OD1 3.15Å; I389-N411 VanDerWaalsContact CG1-OD1 3.26Å; I389-N411 WeakPolarHBondContact CG1-OD1 3.29Å; I389-N411 PolarHBondContact N-OD1 2.91Å; L408-N411 PolarHBondContact O-ND2 3.15Å; G409-N411 PolarHBondContact O-N 2.85Å; G409-N411 PolarHBondContact O-ND2 2.66Å; N411-I413 HydrophobicContact CB-CD1 4.08Å; N411-I413 HydrophobicContact CB-CG1 3.76Å; N411-I413 PolarHBondContact O-N 3.26Å; N411-S434 WeakPolarHBondContact O-CB 3.3Å
412	A	92.4	Very high	93.5	Very high	49 Å²	49	31.8 Å²	31.8	41%	0.405	18%	0.179	S	C	.	.			trans	-77.6	52	-179	0	0	0	0	0	112.5	I389 R414	I389-A412 CarbonylContact O-C 3.57Å; A412-R414 WeakPolarHBondContact O-CG 3.1Å; A412-R414 PolarHBondContact O-N 3.12Å
413	I	94.1	Very high	93.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.			trans	-66.8	127.3	-175.2	-58.7	177.6	0	0	0	109.6	I389 V392 L408 N411 I416 S434 F437	I389-I413 HydrophobicContact CG2-CG1 4.33Å; I389-I413 PolarHBondContact O-N 2.74Å; V392-I413 HydrophobicContact CG2-CD1 4.35Å; L408-I413 HydrophobicContact CB-CD1 3.98Å; L408-I413 HydrophobicContact CD1-CD1 4.44Å; N411-I413 HydrophobicContact CB-CD1 4.08Å; N411-I413 HydrophobicContact CB-CG1 3.76Å; N411-I413 PolarHBondContact O-N 3.26Å; I413-I416 HydrophobicContact CG2-CD1 4.09Å; I413-I416 HydrophobicContact CG2-CG1 3.74Å; I413-S434 PolarHBondContact N-OG 3Å; I413-S434 PolarHBondContact O-OG 3Å; I413-F437 HydrophobicContact CB-CZ 4.35Å; I413-F437 HydrophobicContact CG2-CE1 3.88Å; I413-F437 HydrophobicContact CG2-CZ 4.06Å
414	R	91.8	Very high	92.9	Very high	34 Å²	34	36.6 Å²	36.6	13%	0.128	19%	0.192	C	C	.	.			trans	-108.2	-35.2	-178.4	-52.3	-168.8	168.6	-111.5	13.6	112.8	K390 A412 S436 L438 H586 F587	K390-R414 WeakPolarHBondContact O-CB 3.14Å; K390-R414 PolarHBondContact O-N 3.1Å; A412-R414 WeakPolarHBondContact O-CG 3.1Å; A412-R414 PolarHBondContact O-N 3.12Å; R414-S436 WeakPolarHBondContact CA-O 3.31Å; R414-S436 WeakPolarHBondContact CG-O 3.17Å; R414-L438 HydrophobicContact CB-CG 4.45Å; R414-L438 WeakPolarHBondContact O-CB 3.22Å; R414-L438 PolarHBondContact O-N 3.11Å; R414-H586 PolarHBondContact NE-O 3.18Å; R414-H586 VanDerWaalsContact NE-O 3.16Å; R414-H586 PolarHBondContact NH1-CD2 3.5Å; R414-H586 PolarHBondContact NH1-NE2 3.41Å; R414-H586 PolarHBondContact NH1-O 3.47Å; R414-H586 PolarHBondContact NH2-CD2 2.84Å; R414-H586 PolarHBondContact NH2-CE1 2.97Å; R414-H586 PolarHBondContact NH2-NE2 3.3Å; R414-H586 PolarHBondContact NH2-O 3.07Å; R414-F587 WeakPolarHBondContact CD-O 3.35Å
415	S	90.8	Very high	92.6	Very high	14 Å²	14	45.1 Å²	45.1	10%	0.098	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	141.8	-177.9	36.7	0	0	0	0	111.7	S391 V392 K489	S391-S415 CarbonylContact C-O 3.56Å; S391-S415 WeakPolarHBondContact CA-O 3.39Å; S391-S415 WeakPolarHBondContact CB-O 3.46Å; S391-S415 VanDerWaalsContact CB-OG 3.31Å; S391-S415 WeakPolarHBondContact CB-OG 3.44Å; V392-S415 PolarHBondContact N-O 3.1Å; S415-K489 PolarHBondContact OG-NZ 3.35Å
416	I	93.2	Very high	92.4	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.8	175.6	-58.4	174.9	0	0	0	106.4	V392 I413 A420 F421 I432 F437 W445 L446	V392-I416 HydrophobicContact CB-CB 4.35Å; V392-I416 HydrophobicContact CB-CG1 4.13Å; V392-I416 HydrophobicContact CB-CG2 4.01Å; V392-I416 HydrophobicContact CG1-CG2 4.33Å; V392-I416 HydrophobicContact CG2-CG1 4.06Å; I413-I416 HydrophobicContact CG2-CD1 4.09Å; I413-I416 HydrophobicContact CG2-CG1 3.74Å; I416-A420 HydrophobicContact CG2-CB 4.01Å; I416-F421 HydrophobicContact CD1-CE2 4.46Å; I416-F421 HydrophobicContact CD1-CZ 4.12Å; I416-F421 HydrophobicContact CG2-CE1 4.4Å; I416-F421 HydrophobicContact CG2-CE2 3.98Å; I416-F421 HydrophobicContact CG2-CZ 3.78Å; I416-I432 HydrophobicContact CD1-CD1 4.08Å; I416-F437 HydrophobicContact CD1-CE1 3.89Å; I416-F437 HydrophobicContact CD1-CZ 4.07Å; I416-F437 HydrophobicContact CG1-CE1 4.13Å; I416-W445 HydrophobicContact CB-CZ2 4.35Å; I416-W445 HydrophobicContact CG2-CH2 4.17Å; I416-W445 HydrophobicContact CG2-CZ2 3.73Å; I416-W445 PolarHBondContact O-NE1 2.92Å; I416-L446 HydrophobicContact CD1-CD2 3.93Å
417	Q	90.8	Very high	92.3	Very high	92 Å²	92	46.2 Å²	46.2	43%	0.43	23%	0.231	S	C	.	.			trans	-66.4	145.9	-174.9	-73.3	-174.8	-24.6	0	0	112.2	V392 K394 D419 A420 W445	V392-Q417 PolarHBondContact O-N 3.47Å; K394-Q417 HydrophobicContact CB-CB 4.12Å; Q417-D419 PolarHBondContact O-N 3.18Å; Q417-A420 WeakPolarHBondContact O-CB 3.4Å; Q417-A420 PolarHBondContact O-N 2.97Å; Q417-A420 VanDerWaalsContact O-N 3.08Å; Q417-W445 VanDerWaalsContact O-CZ2 3.25Å; Q417-W445 WeakPolarHBondContact O-CZ2 3.41Å
418	P	90.6	Very high	92.1	Very high	43 Å²	43	51.2 Å²	51.2	28%	0.279	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	133.7	172.6	-29.1	34.9	0	0	0	113.3	K394 A420 W445	K394-P418 WeakPolarHBondContact CD-O 3.11Å; K394-P418 WeakPolarHBondContact CE-O 3.16Å; K394-P418 WeakPolarHBondContact CG-O 3.29Å; K394-P418 PolarHBondContact NZ-O 3.47Å; P418-A420 VanDerWaalsContact C-N 3.3Å; P418-A420 PolarHBondContact O-N 3.2Å; P418-W445 HydrophobicContact CB-CG 4.5Å
419	D	86.4	Confident	92.1	Very high	79 Å²	79	53 Å²	53	42%	0.422	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	11.4	-176.1	-48.3	-44.3	0	0	0	116.5	K394 Q417 F421 S422	K394-D419 IonicContact NZ-OD2 2.73Å; K394-D419 PolarHBondContact NZ-OD2 3Å; Q417-D419 PolarHBondContact O-N 3.18Å; D419-F421 PolarHBondContact O-N 3.18Å; D419-S422 VanDerWaalsContact O-CB 3.26Å; D419-S422 WeakPolarHBondContact O-CB 3.45Å; D419-S422 PolarHBondContact O-N 3.05Å; D419-S422 PolarHBondContact O-OG 3.46Å
420	A	91.4	Very high	92.2	Very high	5 Å²	5	53 Å²	53	4%	0.041	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.7	179.1	0	0	0	0	0	114.7	V392 I416 Q417 P418	V392-A420 HydrophobicContact CG1-CB 4.01Å; I416-A420 HydrophobicContact CG2-CB 4.01Å; Q417-A420 WeakPolarHBondContact O-CB 3.4Å; Q417-A420 PolarHBondContact O-N 2.97Å; Q417-A420 VanDerWaalsContact O-N 3.08Å; P418-A420 VanDerWaalsContact C-N 3.3Å; P418-A420 PolarHBondContact O-N 3.2Å
421	F	92.2	Very high	92.3	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-5.3	176.6	-51.6	-40.4	0	0	0	114.2	V392 F397 L406 L408 I416 D419 R423 M424 L430 I432 W445 L446 W449	V392-F421 HydrophobicContact CG1-CE1 4.43Å; F397-F421 HydrophobicContact CD2-CD1 4.35Å; F397-F421 HydrophobicContact CD2-CE1 4.38Å; F397-F421 HydrophobicContact CE2-CD1 4.47Å; F397-F421 HydrophobicContact CE2-CE1 4.05Å; L406-F421 HydrophobicContact CD2-CE1 4.39Å; L408-F421 HydrophobicContact CD1-CE1 4.43Å; I416-F421 HydrophobicContact CD1-CE2 4.46Å; I416-F421 HydrophobicContact CD1-CZ 4.12Å; I416-F421 HydrophobicContact CG2-CE1 4.4Å; I416-F421 HydrophobicContact CG2-CE2 3.98Å; I416-F421 HydrophobicContact CG2-CZ 3.78Å; D419-F421 PolarHBondContact O-N 3.18Å; F421-R423 PolarHBondContact O-N 2.82Å; F421-M424 HydrophobicContact CB-CE 3.99Å; F421-M424 HydrophobicContact CD1-CE 3.52Å; F421-M424 HydrophobicContact CE1-CE 4.45Å; F421-M424 HydrophobicContact CG-CE 4.17Å; F421-M424 PolarHBondContact O-N 2.92Å; F421-L430 HydrophobicContact CD2-CD2 4.05Å; F421-L430 HydrophobicContact CE2-CD2 3.78Å; F421-L430 HydrophobicContact CZ-CD2 4.15Å; F421-I432 HydrophobicContact CE2-CD1 4.48Å; F421-I432 HydrophobicContact CZ-CD1 4.27Å; F421-W445 AromaticContact CD2-CH2 3.81Å; F421-W445 HydrophobicContact CD2-CH2 3.81Å; F421-W445 HydrophobicContact CD2-CZ3 4.34Å; F421-W445 HydrophobicContact CE2-CH2 4.15Å; F421-L446 HydrophobicContact CD2-CD1 4.37Å; F421-L446 HydrophobicContact CE2-CD1 3.87Å; F421-W449 HydrophobicContact CB-CH2 3.42Å; F421-W449 VanDerWaalsContact CB-CH2 3.42Å; F421-W449 HydrophobicContact CB-CZ2 3.61Å; F421-W449 HydrophobicContact CB-CZ3 4.01Å; F421-W449 HydrophobicContact CD2-CE3 4.01Å; F421-W449 AromaticContact CD2-CH2 3.89Å; F421-W449 HydrophobicContact CD2-CH2 3.89Å; F421-W449 AromaticContact CD2-CZ3 3.53Å; F421-W449 HydrophobicContact CD2-CZ3 3.53Å; F421-W449 HydrophobicContact CE2-CZ3 4.42Å; F421-W449 HydrophobicContact CG-CH2 4.04Å; F421-W449 HydrophobicContact CG-CZ3 4.16Å
422	S	86.3	Confident	92.4	Very high	62 Å²	62	52.1 Å²	52.1	43%	0.434	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.6	-170.6	60.8	0	0	0	0	116.2	D419	D419-S422 VanDerWaalsContact O-CB 3.26Å; D419-S422 WeakPolarHBondContact O-CB 3.45Å; D419-S422 PolarHBondContact O-N 3.05Å; D419-S422 PolarHBondContact O-OG 3.46Å
423	R	87	Confident	92.5	Very high	139 Å²	139	54.9 Å²	54.9	53%	0.525	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-25.4	178.2	-76.6	176.9	168.2	-108.6	-0.5	113.4	E401 F421 R425	E401-R423 WeakPolarHBondContact CA-O 3.44Å; E401-R423 HydrophobicContact CG-CB 4.31Å; E401-R423 WeakPolarHBondContact OE1-CD 3.31Å; E401-R423 IonicContact OE1-CZ 2.63Å; E401-R423 IonicContact OE1-NE 2.69Å; E401-R423 IonicContact OE1-NH1 2.64Å; E401-R423 PolarHBondContact OE1-NH1 3.17Å; F421-R423 PolarHBondContact O-N 2.82Å; R423-R425 PolarHBondContact O-N 3.37Å
424	M	91.6	Very high	92.5	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.039	27%	0.266	C	S	.	.			trans	-83.9	65.1	-174.7	-63.1	-177.1	-74.9	0	0	110.6	F397 L403 L406 F421 N426 L427	F397-M424 HydrophobicContact CB-CE 4.06Å; F397-M424 HydrophobicContact CB-SD 4.02Å; F397-M424 HydrophobicContact CD2-CE 3.85Å; F397-M424 HydrophobicContact CG-CE 4.14Å; F397-M424 HydrophobicContact CG-SD 4.36Å; L403-M424 HydrophobicContact CB-CG 4.31Å; L403-M424 HydrophobicContact CB-SD 4.17Å; L403-M424 HydrophobicContact CD2-SD 3.57Å; L403-M424 VanDerWaalsContact CD2-SD 3.57Å; L403-M424 HydrophobicContact CG-SD 4.5Å; L406-M424 HydrophobicContact CD2-CE 3.77Å; L406-M424 HydrophobicContact CD2-SD 4.12Å; F421-M424 HydrophobicContact CB-CE 3.99Å; F421-M424 HydrophobicContact CD1-CE 3.52Å; F421-M424 HydrophobicContact CE1-CE 4.45Å; F421-M424 HydrophobicContact CG-CE 4.17Å; F421-M424 PolarHBondContact O-N 2.92Å; M424-N426 PolarHBondContact O-N 3.05Å; M424-N426 VanDerWaalsContact O-N 3.14Å; M424-L427 HydrophobicContact CB-CB 4.16Å; M424-L427 VanDerWaalsContact O-CB 3.25Å; M424-L427 WeakPolarHBondContact O-CB 3.02Å; M424-L427 PolarHBondContact O-N 3Å; M424-L427 VanDerWaalsContact O-N 3.14Å
425	R	89.9	Confident	92.6	Very high	222 Å²	222	59.2 Å²	59.2	84%	0.838	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.5	-174.4	-65.5	-178.9	179	-179.3	-1.4	114	R423	R423-R425 PolarHBondContact O-N 3.37Å
426	N	94.1	Very high	92.7	Very high	79 Å²	79	59.4 Å²	59.4	42%	0.422	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	5.7	-179.9	-64.1	-2.4	0	0	0	113.4	L403 E404 M424 K428	L403-N426 CarbonylContact O-C 3.27Å; L403-N426 VanDerWaalsContact O-C 3.22Å; E404-N426 WeakPolarHBondContact CA-O 2.96Å; E404-N426 HydrophobicContact CG-CB 4.18Å; M424-N426 PolarHBondContact O-N 3.05Å; M424-N426 VanDerWaalsContact O-N 3.14Å; N426-K428 PolarHBondContact O-N 3.27Å; N426-K428 VanDerWaalsContact O-N 3.14Å
427	L	95.3	Very high	92.7	Very high	19 Å²	19	59.3 Å²	59.3	10%	0.099	29%	0.29	C	S	.	.			trans	-68.1	110.4	-170.5	-167.5	67.5	0	0	0	112	L403 L406 M424 S429 L430 W449 L455	L403-L427 WeakPolarHBondContact O-CA 3.05Å; L403-L427 PolarHBondContact O-N 3.07Å; L406-L427 HydrophobicContact CB-CD1 3.86Å; M424-L427 HydrophobicContact CB-CB 4.16Å; M424-L427 VanDerWaalsContact O-CB 3.25Å; M424-L427 WeakPolarHBondContact O-CB 3.02Å; M424-L427 PolarHBondContact O-N 3Å; M424-L427 VanDerWaalsContact O-N 3.14Å; L427-S429 WeakPolarHBondContact CD1-O 3.45Å; L427-L430 HydrophobicContact CD2-CB 4.14Å; L427-L430 HydrophobicContact CD2-CD2 4.33Å; L427-W449 HydrophobicContact CD2-CH2 4.25Å; L427-L455 HydrophobicContact CD2-CD1 3.96Å; L427-L455 HydrophobicContact CG-CD1 4.33Å
428	K	94.9	Very high	92.8	Very high	133 Å²	133	55.1 Å²	55.1	58%	0.578	27%	0.27	S	S	*	.			trans	-97.9	-19	179.1	-62.5	168.7	-164.1	167.7	0	112.8	E404 N426	E404-K428 HydrophobicContact CB-CD 4.29Å; E404-K428 VanDerWaalsContact CD-CE 3.43Å; E404-K428 PolarHBondContact O-N 2.79Å; E404-K428 WeakPolarHBondContact OE1-CE 3.47Å; E404-K428 IonicContact OE1-NZ 2.92Å; E404-K428 PolarHBondContact OE1-NZ 3.24Å; E404-K428 IonicContact OE2-NZ 2.63Å; E404-K428 PolarHBondContact OE2-NZ 2.98Å; N426-K428 PolarHBondContact O-N 3.27Å; N426-K428 VanDerWaalsContact O-N 3.14Å
429	S	96.7	Very high	92.9	Very high	39 Å²	39	53 Å²	53	27%	0.273	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	122.6	-174.4	-173.4	0	0	0	0	110.6	E404 H405 L406 L427	E404-S429 PolarHBondContact O-N 2.03Å; H405-S429 WeakPolarHBondContact CA-O 3.21Å; H405-S429 VanDerWaalsContact ND1-CB 3.32Å; H405-S429 WeakPolarHBondContact ND1-CB 3.5Å; L406-S429 PolarHBondContact N-O 2.8Å; L427-S429 WeakPolarHBondContact CD1-O 3.45Å
430	L	97.2	Very high	93.1	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	113.5	175.3	176.4	54.6	0	0	0	108.1	L406 L408 F421 L427 I432 W449 L450 L455 G458	L406-L430 HydrophobicContact CB-CD1 4.07Å; L406-L430 HydrophobicContact CD2-CD1 3.98Å; L406-L430 HydrophobicContact CG-CD1 3.99Å; L406-L430 CarbonylContact O-C 3.35Å; L406-L430 WeakPolarHBondContact O-CA 3.36Å; L408-L430 HydrophobicContact CD1-CD1 4.47Å; F421-L430 HydrophobicContact CD2-CD2 4.05Å; F421-L430 HydrophobicContact CE2-CD2 3.78Å; F421-L430 HydrophobicContact CZ-CD2 4.15Å; L427-L430 HydrophobicContact CD2-CB 4.14Å; L427-L430 HydrophobicContact CD2-CD2 4.33Å; L430-I432 HydrophobicContact CD1-CD1 4.12Å; L430-I432 HydrophobicContact CD1-CG1 4.03Å; L430-I432 HydrophobicContact CD2-CD1 4.03Å; L430-I432 HydrophobicContact CG-CD1 4.01Å; L430-I432 HydrophobicContact CG-CG1 4.12Å; L430-W449 HydrophobicContact CD2-CZ3 4.07Å; L430-L450 HydrophobicContact CD2-CD2 3.79Å; L430-L455 HydrophobicContact CB-CB 4.38Å; L430-L455 HydrophobicContact CB-CD1 4.13Å; L430-L455 HydrophobicContact CB-CD2 4.25Å; L430-L455 HydrophobicContact CD2-CD1 4.35Å; L430-G458 CarbonylContact O-C 3.48Å; L430-G458 WeakPolarHBondContact O-CA 3.5Å
431	L	97.6	Very high	93	Very high	70 Å²	70	52 Å²	52	37%	0.366	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.1	175.3	-55.7	-177.9	0	0	0	109.7	L406 N407 L408 G409 G458	L406-L431 PolarHBondContact O-N 3.23Å; N407-L431 HydrophobicContact CB-CB 4.24Å; N407-L431 HydrophobicContact CB-CD1 4.26Å; N407-L431 WeakPolarHBondContact OD1-CB 3.48Å; L408-L431 CarbonylContact C-O 3.29Å; L408-L431 WeakPolarHBondContact CA-O 3.16Å; L408-L431 PolarHBondContact N-O 2.95Å; G409-L431 PolarHBondContact N-O 2.83Å; L431-G458 WeakPolarHBondContact CA-O 3.19Å
432	I	96.3	Very high	92.8	Very high	3 Å²	3	56 Å²	56	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	130.6	174.7	-64.4	173.5	0	0	0	107.5	L408 I416 F421 L430 F437 G458 V459 N460	L408-I432 HydrophobicContact CB-CG1 4.32Å; I416-I432 HydrophobicContact CD1-CD1 4.08Å; F421-I432 HydrophobicContact CE2-CD1 4.48Å; F421-I432 HydrophobicContact CZ-CD1 4.27Å; L430-I432 HydrophobicContact CD1-CD1 4.12Å; L430-I432 HydrophobicContact CD1-CG1 4.03Å; L430-I432 HydrophobicContact CD2-CD1 4.03Å; L430-I432 HydrophobicContact CG-CD1 4.01Å; L430-I432 HydrophobicContact CG-CG1 4.12Å; I432-F437 HydrophobicContact CG2-CE2 4.17Å; I432-F437 HydrophobicContact CG2-CZ 4Å; I432-G458 PolarHBondContact N-O 3.49Å; I432-V459 HydrophobicContact CB-CG1 4.2Å; I432-V459 HydrophobicContact CB-CG2 4.18Å; I432-V459 HydrophobicContact CD1-CG2 4.38Å; I432-V459 HydrophobicContact CG1-CG2 4.45Å; I432-V459 WeakPolarHBondContact O-CA 3.46Å; I432-N460 PolarHBondContact O-N 3.05Å
433	Q	94.8	Very high	93.1	Very high	107 Å²	107	53.1 Å²	53.1	50%	0.5	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	104.3	174.2	-179.3	176.5	-31.4	0	0	108.9	N460	Q433-N460 WeakPolarHBondContact CA-O 3.46Å
434	S	93.8	Very high	93.4	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.063	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	138.1	178.2	177.9	0	0	0	0	111.5	N411 I413 S436 N460 A461 T462	N411-S434 WeakPolarHBondContact O-CB 3.3Å; I413-S434 PolarHBondContact N-OG 3Å; I413-S434 PolarHBondContact O-OG 3Å; S434-S436 PolarHBondContact OG-N 3.04Å; S434-S436 VanDerWaalsContact OG-N 3.11Å; S434-N460 PolarHBondContact N-O 3.35Å; S434-A461 WeakPolarHBondContact O-CA 3.45Å; S434-T462 PolarHBondContact O-N 3.45Å; S434-T462 VanDerWaalsContact O-N 3.08Å
435	N	93.9	Very high	93.5	Very high	115 Å²	115	51.6 Å²	51.6	62%	0.615	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	19.1	172	66.6	-16.8	0	0	0	112.4	T462	N435-T462 CarbonylContact C-O 3.16Å; N435-T462 WeakPolarHBondContact CA-OG1 3.46Å; N435-T462 WeakPolarHBondContact CB-OG1 3.4Å
436	S	92.6	Very high	93.7	Very high	18 Å²	18	41 Å²	41	13%	0.126	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	11	-169.3	-63.4	0	0	0	0	113.8	R414 S434	R414-S436 WeakPolarHBondContact CA-O 3.31Å; R414-S436 WeakPolarHBondContact CG-O 3.17Å; S434-S436 PolarHBondContact OG-N 3.04Å; S434-S436 VanDerWaalsContact OG-N 3.11Å
437	F	93.8	Very high	93.7	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	138.9	-170.6	-82.5	-77	0	0	0	114.2	I413 I416 I432 L443 A461 T462 A464 H465	I413-F437 HydrophobicContact CB-CZ 4.35Å; I413-F437 HydrophobicContact CG2-CE1 3.88Å; I413-F437 HydrophobicContact CG2-CZ 4.06Å; I416-F437 HydrophobicContact CD1-CE1 3.89Å; I416-F437 HydrophobicContact CD1-CZ 4.07Å; I416-F437 HydrophobicContact CG1-CE1 4.13Å; I432-F437 HydrophobicContact CG2-CE2 4.17Å; I432-F437 HydrophobicContact CG2-CZ 4Å; F437-L443 HydrophobicContact CB-CD2 3.93Å; F437-L443 HydrophobicContact CD1-CD1 3.8Å; F437-L443 HydrophobicContact CD1-CD2 3.61Å; F437-L443 HydrophobicContact CD1-CG 4.4Å; F437-L443 HydrophobicContact CE1-CD1 3.93Å; F437-L443 HydrophobicContact CE1-CD2 4.39Å; F437-L443 HydrophobicContact CG-CD2 3.99Å; F437-A461 HydrophobicContact CD2-CB 3.8Å; F437-A461 HydrophobicContact CE2-CB 3.44Å; F437-A461 VanDerWaalsContact CE2-CB 3.44Å; F437-A461 HydrophobicContact CZ-CB 4.32Å; F437-T462 PolarHBondContact N-O 2.95Å; F437-A464 PolarHBondContact O-N 3.02Å; F437-H465 PolarHBondContact O-N 3Å
438	L	92	Very high	93.6	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	103.4	160.1	-67.1	170.9	0	0	0	107.6	R414 D440 L443 H465 P488 K489 F587	R414-L438 HydrophobicContact CB-CG 4.45Å; R414-L438 WeakPolarHBondContact O-CB 3.22Å; R414-L438 PolarHBondContact O-N 3.11Å; L438-D440 PolarHBondContact O-N 3.06Å; L438-D440 VanDerWaalsContact O-N 3.09Å; L438-L443 WeakPolarHBondContact O-CB 3.5Å; L438-L443 WeakPolarHBondContact O-CD2 3.2Å; L438-H465 HydrophobicContact CD2-CB 3.75Å; L438-P488 HydrophobicContact CD2-CG 4.07Å; L438-K489 HydrophobicContact CD1-CB 4.09Å; L438-F587 HydrophobicContact CD1-CB 4.41Å; L438-F587 HydrophobicContact CD2-CB 4.36Å; L438-F587 HydrophobicContact CD2-CD1 3.49Å; L438-F587 VanDerWaalsContact CD2-CD1 3.49Å; L438-F587 HydrophobicContact CD2-CE1 4.12Å; L438-F587 HydrophobicContact CD2-CG 4.25Å
439	C	93.3	Very high	93.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.			trans	-86.9	55.5	175.9	-66.8	0	0	0	0	110.6	C463 H465 L469 F482	C439-C463 HydrophobicContact CB-CB 3.81Å; C439-C463 WeakPolarHBondContact CB-SG 3.08Å; C439-C463 VanDerWaalsContact SG-CA 3.56Å; C439-C463 WeakPolarHBondContact SG-CB 3.39Å; C439-C463 CovalentContact SG-SG 2.02Å; C439-C463 PolarHBondContact SG-SG 3.33Å; C439-H465 WeakPolarHBondContact CB-O 3.35Å; C439-H465 PolarHBondContact N-O 3.03Å; C439-L469 HydrophobicContact CB-CD1 3.9Å; C439-F482 HydrophobicContact CB-CD1 3.95Å; C439-F482 HydrophobicContact CB-CE1 3.66Å
440	D	90.5	Very high	93.5	Very high	21 Å²	21	37 Å²	37	11%	0.112	18%	0.182	C	C	.	.	S	Bend	trans	-93.3	179.9	173.1	64.3	35.1	0	0	0	110.9	L438 Q442 L443 Q444 F482 V483	L438-D440 PolarHBondContact O-N 3.06Å; L438-D440 VanDerWaalsContact O-N 3.09Å; D440-Q442 PolarHBondContact O-N 2.94Å; D440-Q442 VanDerWaalsContact O-N 3.09Å; D440-Q442 WeakPolarHBondContact OD1-CA 3.27Å; D440-Q442 WeakPolarHBondContact OD1-CB 3.19Å; D440-Q442 PolarHBondContact OD1-N 3.03Å; D440-L443 PolarHBondContact O-N 3.38Å; D440-L443 PolarHBondContact OD1-N 2.97Å; D440-Q444 PolarHBondContact O-N 2.71Å; D440-F482 WeakPolarHBondContact O-CD1 3.32Å; D440-V483 CarbonylContact C-O 3.42Å; D440-V483 WeakPolarHBondContact CA-O 3.28Å; D440-V483 VanDerWaalsContact CB-O 3.31Å; D440-V483 WeakPolarHBondContact CB-O 3.15Å
441	C	89.3	Confident	93.3	Very high	41 Å²	41	43.1 Å²	43.1	28%	0.277	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.6	178.9	80.2	0	0	0	0	114.3	L443 Q444 F482 V483 C484	C441-L443 VanDerWaalsContact C-N 3.3Å; C441-Q444 WeakPolarHBondContact O-CB 3.39Å; C441-F482 VanDerWaalsContact CA-O 3.27Å; C441-F482 WeakPolarHBondContact CA-O 3.26Å; C441-F482 WeakPolarHBondContact CB-O 3.4Å; C441-F482 PolarHBondContact N-O 2.94Å; C441-V483 PolarHBondContact N-O 3.01Å; C441-C484 VanDerWaalsContact CA-SG 3.54Å; C441-C484 HydrophobicContact CB-CB 3.95Å; C441-C484 WeakPolarHBondContact CB-SG 3.12Å; C441-C484 PolarHBondContact N-SG 2.9Å; C441-C484 WeakPolarHBondContact SG-CB 3.09Å; C441-C484 CovalentContact SG-SG 2.03Å; C441-C484 PolarHBondContact SG-SG 2.93Å
442	Q	88.6	Confident	93	Very high	85 Å²	85	44.7 Å²	44.7	40%	0.397	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-19.9	175.6	-53.2	-64.1	-59.4	0	0	112.4	D440 W445	D440-Q442 PolarHBondContact O-N 2.94Å; D440-Q442 VanDerWaalsContact O-N 3.09Å; D440-Q442 WeakPolarHBondContact OD1-CA 3.27Å; D440-Q442 WeakPolarHBondContact OD1-CB 3.19Å; D440-Q442 PolarHBondContact OD1-N 3.03Å; Q442-W445 PolarHBondContact O-NE1 3.45Å
443	L	92.6	Very high	92.9	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-15.5	175.4	-157.2	71.2	0	0	0	113.3	F437 L438 D440 C441 W445 L446 P447 I474 F482	F437-L443 HydrophobicContact CB-CD2 3.93Å; F437-L443 HydrophobicContact CD1-CD1 3.8Å; F437-L443 HydrophobicContact CD1-CD2 3.61Å; F437-L443 HydrophobicContact CD1-CG 4.4Å; F437-L443 HydrophobicContact CE1-CD1 3.93Å; F437-L443 HydrophobicContact CE1-CD2 4.39Å; F437-L443 HydrophobicContact CG-CD2 3.99Å; L438-L443 WeakPolarHBondContact O-CB 3.5Å; L438-L443 WeakPolarHBondContact O-CD2 3.2Å; D440-L443 PolarHBondContact O-N 3.38Å; D440-L443 PolarHBondContact OD1-N 2.97Å; C441-L443 VanDerWaalsContact C-N 3.3Å; L443-W445 PolarHBondContact O-N 3.07Å; L443-L446 HydrophobicContact CD1-CB 4.32Å; L443-L446 HydrophobicContact CD1-CD2 3.7Å; L443-L446 HydrophobicContact CG-CB 4.42Å; L443-L446 HydrophobicContact CG-CD2 4.3Å; L443-L446 WeakPolarHBondContact O-CB 3.32Å; L443-L446 PolarHBondContact O-N 2.95Å; L443-P447 WeakPolarHBondContact O-CD 3.09Å; L443-I474 HydrophobicContact CD2-CG2 4.15Å; L443-F482 HydrophobicContact CB-CD1 4.41Å; L443-F482 HydrophobicContact CB-CE1 4.45Å; L443-F482 HydrophobicContact CD2-CE1 4.48Å
444	Q	92.7	Very high	92.8	Very high	69 Å²	69	46.5 Å²	46.5	32%	0.322	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-31.9	-174.8	-171	178.5	49.6	0	0	115.1	D440 C441 Q479 F482	D440-Q444 PolarHBondContact O-N 2.71Å; C441-Q444 WeakPolarHBondContact O-CB 3.39Å; Q444-Q479 HydrophobicContact CG-CG 4.39Å; Q444-Q479 PolarHBondContact NE2-O 3.3Å; Q444-Q479 PolarHBondContact O-NE2 3.19Å; Q444-F482 HydrophobicContact CB-CB 3.68Å; Q444-F482 HydrophobicContact CB-CG 4.13Å; Q444-F482 HydrophobicContact CG-CB 3.84Å; Q444-F482 HydrophobicContact CG-CG 4.32Å
445	W	93.8	Very high	92.9	Very high	46 Å²	46	46.5 Å²	46.5	17%	0.174	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-27.6	179.5	68.9	-81.9	0	0	0	113.7	I416 Q417 P418 F421 Q442 L443 W449	I416-W445 HydrophobicContact CB-CZ2 4.35Å; I416-W445 HydrophobicContact CG2-CH2 4.17Å; I416-W445 HydrophobicContact CG2-CZ2 3.73Å; I416-W445 PolarHBondContact O-NE1 2.92Å; Q417-W445 VanDerWaalsContact O-CZ2 3.25Å; Q417-W445 WeakPolarHBondContact O-CZ2 3.41Å; P418-W445 HydrophobicContact CB-CG 4.5Å; F421-W445 AromaticContact CD2-CH2 3.81Å; F421-W445 HydrophobicContact CD2-CH2 3.81Å; F421-W445 HydrophobicContact CD2-CZ3 4.34Å; F421-W445 HydrophobicContact CE2-CH2 4.15Å; Q442-W445 PolarHBondContact O-NE1 3.45Å; L443-W445 PolarHBondContact O-N 3.07Å; W445-W449 HydrophobicContact CE3-CB 3.75Å; W445-W449 AromaticContact CE3-CG 3.99Å; W445-W449 HydrophobicContact CE3-CG 3.99Å; W445-W449 HydrophobicContact CZ3-CB 3.96Å; W445-W449 AromaticContact CZ3-CD2 3.96Å; W445-W449 HydrophobicContact CZ3-CD2 3.96Å; W445-W449 HydrophobicContact CZ3-CE3 4.26Å; W445-W449 AromaticContact CZ3-CG 3.79Å; W445-W449 HydrophobicContact CZ3-CG 3.79Å; W445-W449 WeakPolarHBondContact O-CB 3.21Å; W445-W449 PolarHBondContact O-N 2.95Å
446	L	94.6	Very high	92.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.8	-46.5	-164.4	179.3	66.2	0	0	0	113.9	I416 F421 L443 F448 W449 L450 I474	I416-L446 HydrophobicContact CD1-CD2 3.93Å; F421-L446 HydrophobicContact CD2-CD1 4.37Å; F421-L446 HydrophobicContact CE2-CD1 3.87Å; L443-L446 HydrophobicContact CD1-CB 4.32Å; L443-L446 HydrophobicContact CD1-CD2 3.7Å; L443-L446 HydrophobicContact CG-CB 4.42Å; L443-L446 HydrophobicContact CG-CD2 4.3Å; L443-L446 WeakPolarHBondContact O-CB 3.32Å; L443-L446 PolarHBondContact O-N 2.95Å; L446-F448 VanDerWaalsContact C-N 3.33Å; L446-F448 PolarHBondContact O-N 2.9Å; L446-W449 PolarHBondContact O-N 2.8Å; L446-L450 HydrophobicContact CD1-CD1 3.88Å; L446-L450 HydrophobicContact CD1-CD2 4.44Å; L446-L450 HydrophobicContact CD1-CG 3.91Å; L446-L450 HydrophobicContact CG-CD1 3.81Å; L446-L450 HydrophobicContact CG-CG 4.29Å; L446-L450 WeakPolarHBondContact O-CB 3.36Å; L446-L450 VanDerWaalsContact O-CG 3.25Å; L446-L450 WeakPolarHBondContact O-CG 3.41Å; L446-L450 PolarHBondContact O-N 2.79Å; L446-I474 HydrophobicContact CD2-CD1 4.06Å; L446-I474 HydrophobicContact CG-CD1 4.36Å
447	P	94	Very high	92.7	Very high	12 Å²	12	49.8 Å²	49.8	8%	0.078	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-42	-178.7	-21.7	33.5	0	0	0	112.1	L443 H451 I474 F475 F482	L443-P447 WeakPolarHBondContact O-CD 3.09Å; P447-H451 WeakPolarHBondContact O-CB 3.4Å; P447-H451 PolarHBondContact O-N 3.02Å; P447-H451 VanDerWaalsContact O-N 3.08Å; P447-I474 WeakPolarHBondContact CB-O 3.19Å; P447-I474 HydrophobicContact CG-CB 4.12Å; P447-I474 HydrophobicContact CG-CD1 4.3Å; P447-I474 HydrophobicContact CG-CG1 4.25Å; P447-I474 WeakPolarHBondContact CG-O 3.04Å; P447-F475 HydrophobicContact CB-CD1 4.01Å; P447-F475 HydrophobicContact CB-CE1 4.4Å; P447-F482 HydrophobicContact CG-CZ 4.26Å
448	F	92.8	Very high	92.5	Very high	133 Å²	133	50.9 Å²	50.9	58%	0.583	27%	0.267	S	S	*	.	H	α-helix	trans	-66.5	-44.9	177.6	-177.9	-108.7	0	0	0	112.1	L446 L450 H451 I452	L446-F448 VanDerWaalsContact C-N 3.33Å; L446-F448 PolarHBondContact O-N 2.9Å; F448-L450 PolarHBondContact O-N 3.3Å; F448-H451 PolarHBondContact O-N 3.28Å; F448-I452 HydrophobicContact CD1-CD1 3.99Å; F448-I452 HydrophobicContact CE1-CD1 3.46Å; F448-I452 VanDerWaalsContact CE1-CD1 3.46Å; F448-I452 HydrophobicContact CE2-CD1 4.05Å; F448-I452 HydrophobicContact CG-CD1 4.5Å; F448-I452 HydrophobicContact CZ-CD1 3.51Å; F448-I452 PolarHBondContact O-N 3.03Å; F448-I452 VanDerWaalsContact O-N 3.08Å
449	W	94	Very high	92.6	Very high	42 Å²	42	51.3 Å²	51.3	16%	0.159	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-44.2	176.3	-177	89.3	0	0	0	111.9	F421 L427 L430 W445 L446 H451 I452 H453 L455	F421-W449 HydrophobicContact CB-CH2 3.42Å; F421-W449 VanDerWaalsContact CB-CH2 3.42Å; F421-W449 HydrophobicContact CB-CZ2 3.61Å; F421-W449 HydrophobicContact CB-CZ3 4.01Å; F421-W449 HydrophobicContact CD2-CE3 4.01Å; F421-W449 AromaticContact CD2-CH2 3.89Å; F421-W449 HydrophobicContact CD2-CH2 3.89Å; F421-W449 AromaticContact CD2-CZ3 3.53Å; F421-W449 HydrophobicContact CD2-CZ3 3.53Å; F421-W449 HydrophobicContact CE2-CZ3 4.42Å; F421-W449 HydrophobicContact CG-CH2 4.04Å; F421-W449 HydrophobicContact CG-CZ3 4.16Å; L427-W449 HydrophobicContact CD2-CH2 4.25Å; L430-W449 HydrophobicContact CD2-CZ3 4.07Å; W445-W449 HydrophobicContact CE3-CB 3.75Å; W445-W449 AromaticContact CE3-CG 3.99Å; W445-W449 HydrophobicContact CE3-CG 3.99Å; W445-W449 HydrophobicContact CZ3-CB 3.96Å; W445-W449 AromaticContact CZ3-CD2 3.96Å; W445-W449 HydrophobicContact CZ3-CD2 3.96Å; W445-W449 HydrophobicContact CZ3-CE3 4.26Å; W445-W449 AromaticContact CZ3-CG 3.79Å; W445-W449 HydrophobicContact CZ3-CG 3.79Å; W445-W449 WeakPolarHBondContact O-CB 3.21Å; W445-W449 PolarHBondContact O-N 2.95Å; L446-W449 PolarHBondContact O-N 2.8Å; W449-H451 VanDerWaalsContact C-N 3.35Å; W449-H451 PolarHBondContact O-N 2.87Å; W449-I452 PolarHBondContact O-N 3.34Å; W449-H453 AromaticContact CD1-CE1 3.55Å; W449-H453 AromaticContact CD1-ND1 3.83Å; W449-H453 AromaticContact CD2-ND1 3.83Å; W449-H453 AromaticContact CE2-CE1 3.6Å; W449-H453 AromaticContact CE2-ND1 3.58Å; W449-H453 AromaticContact CG-ND1 3.96Å; W449-H453 AromaticContact NE1-CE1 3.18Å; W449-H453 PolarHBondContact NE1-CE1 3.13Å; W449-H453 AromaticContact NE1-ND1 3.59Å; W449-H453 AromaticContact NE1-NE2 3.85Å; W449-H453 PolarHBondContact O-N 3.28Å; W449-H453 PolarHBondContact O-ND1 2.97Å; W449-L455 HydrophobicContact CH2-CD1 3.68Å; W449-L455 HydrophobicContact CZ3-CD1 3.68Å
450	L	94.5	Very high	92.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-42.1	176.9	-73.6	169.8	0	0	0	112.2	L430 L446 F448 H453 G454 L455 Q456 V459 I474 F475	L430-L450 HydrophobicContact CD2-CD2 3.79Å; L446-L450 HydrophobicContact CD1-CD1 3.88Å; L446-L450 HydrophobicContact CD1-CD2 4.44Å; L446-L450 HydrophobicContact CD1-CG 3.91Å; L446-L450 HydrophobicContact CG-CD1 3.81Å; L446-L450 HydrophobicContact CG-CG 4.29Å; L446-L450 WeakPolarHBondContact O-CB 3.36Å; L446-L450 VanDerWaalsContact O-CG 3.25Å; L446-L450 WeakPolarHBondContact O-CG 3.41Å; L446-L450 PolarHBondContact O-N 2.79Å; F448-L450 PolarHBondContact O-N 3.3Å; L450-H453 PolarHBondContact O-N 2.86Å; L450-G454 PolarHBondContact O-N 2.97Å; L450-G454 VanDerWaalsContact O-N 3.12Å; L450-L455 HydrophobicContact CD2-CB 3.81Å; L450-L455 PolarHBondContact O-N 2.96Å; L450-Q456 PolarHBondContact O-OE1 2.97Å; L450-V459 HydrophobicContact CD1-CB 4.26Å; L450-V459 HydrophobicContact CD1-CG1 3.93Å; L450-V459 HydrophobicContact CD1-CG2 3.99Å; L450-V459 HydrophobicContact CD2-CG2 3.91Å; L450-I474 HydrophobicContact CD1-CD1 4.3Å; L450-F475 HydrophobicContact CB-CE1 4.09Å; L450-F475 HydrophobicContact CD1-CE1 3.92Å; L450-F475 HydrophobicContact CD1-CZ 3.8Å
451	H	92.9	Very high	92.8	Very high	129 Å²	129	55.2 Å²	55.2	60%	0.597	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-46.8	178.6	-176.5	81.2	0	0	0	112.2	P447 F448 W449 H453 G454	P447-H451 WeakPolarHBondContact O-CB 3.4Å; P447-H451 PolarHBondContact O-N 3.02Å; P447-H451 VanDerWaalsContact O-N 3.08Å; F448-H451 PolarHBondContact O-N 3.28Å; W449-H451 VanDerWaalsContact C-N 3.35Å; W449-H451 PolarHBondContact O-N 2.87Å; H451-H453 VanDerWaalsContact C-N 3.27Å; H451-H453 PolarHBondContact O-N 3.46Å; H451-G454 PolarHBondContact O-N 2.68Å; H451-G454 VanDerWaalsContact O-N 3.14Å
452	I	93.2	Very high	93.1	Very high	104 Å²	104	54.8 Å²	54.8	53%	0.533	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-36.4	178.5	-75.5	177.2	0	0	0	112.2	F448 W449	F448-I452 HydrophobicContact CD1-CD1 3.99Å; F448-I452 HydrophobicContact CE1-CD1 3.46Å; F448-I452 VanDerWaalsContact CE1-CD1 3.46Å; F448-I452 HydrophobicContact CE2-CD1 4.05Å; F448-I452 HydrophobicContact CG-CD1 4.5Å; F448-I452 HydrophobicContact CZ-CD1 3.51Å; F448-I452 PolarHBondContact O-N 3.03Å; F448-I452 VanDerWaalsContact O-N 3.08Å; W449-I452 PolarHBondContact O-N 3.34Å
453	H	92.5	Very high	93.4	Very high	102 Å²	102	50.9 Å²	50.9	47%	0.472	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	1.6	-179.2	-62.2	80.3	0	0	0	113.4	W449 L450 H451 L455	W449-H453 AromaticContact CD1-CE1 3.55Å; W449-H453 AromaticContact CD1-ND1 3.83Å; W449-H453 AromaticContact CD2-ND1 3.83Å; W449-H453 AromaticContact CE2-CE1 3.6Å; W449-H453 AromaticContact CE2-ND1 3.58Å; W449-H453 AromaticContact CG-ND1 3.96Å; W449-H453 AromaticContact NE1-CE1 3.18Å; W449-H453 PolarHBondContact NE1-CE1 3.13Å; W449-H453 AromaticContact NE1-ND1 3.59Å; W449-H453 AromaticContact NE1-NE2 3.85Å; W449-H453 PolarHBondContact O-N 3.28Å; W449-H453 PolarHBondContact O-ND1 2.97Å; L450-H453 PolarHBondContact O-N 2.86Å; H451-H453 VanDerWaalsContact C-N 3.27Å; H451-H453 PolarHBondContact O-N 3.46Å; H453-L455 HydrophobicContact CB-CD1 3.89Å; H453-L455 HydrophobicContact CB-CG 3.98Å; H453-L455 PolarHBondContact O-N 3.18Å
454	G	94	Very high	93.4	Very high	45 Å²	45	52.3 Å²	52.3	46%	0.464	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	14.9	-179.8	0	0	0	0	0	115	L450 H451 Q456	L450-G454 PolarHBondContact O-N 2.97Å; L450-G454 VanDerWaalsContact O-N 3.12Å; H451-G454 PolarHBondContact O-N 2.68Å; H451-G454 VanDerWaalsContact O-N 3.14Å; G454-Q456 VanDerWaalsContact CA-OE1 3.28Å
455	L	95	Very high	93.3	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-86.9	-6.1	-170.2	-66.9	174.4	0	0	0	114	L427 L430 W449 L450 H453 V457 G458	L427-L455 HydrophobicContact CD2-CD1 3.96Å; L427-L455 HydrophobicContact CG-CD1 4.33Å; L430-L455 HydrophobicContact CB-CB 4.38Å; L430-L455 HydrophobicContact CB-CD1 4.13Å; L430-L455 HydrophobicContact CB-CD2 4.25Å; L430-L455 HydrophobicContact CD2-CD1 4.35Å; W449-L455 HydrophobicContact CH2-CD1 3.68Å; W449-L455 HydrophobicContact CZ3-CD1 3.68Å; L450-L455 HydrophobicContact CD2-CB 3.81Å; L450-L455 PolarHBondContact O-N 2.96Å; H453-L455 HydrophobicContact CB-CD1 3.89Å; H453-L455 HydrophobicContact CB-CG 3.98Å; H453-L455 PolarHBondContact O-N 3.18Å; L455-V457 PolarHBondContact O-N 2.99Å; L455-V457 VanDerWaalsContact O-N 3.08Å; L455-G458 PolarHBondContact O-N 2.61Å
456	Q	90.9	Very high	93.1	Very high	68 Å²	68	49.8 Å²	49.8	32%	0.318	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-56.7	-28.1	-174.5	67.7	-77.1	-4.4	0	0	114.5	L450 G454 G458 V459 F475	L450-Q456 PolarHBondContact O-OE1 2.97Å; G454-Q456 VanDerWaalsContact CA-OE1 3.28Å; Q456-G458 PolarHBondContact O-N 3.36Å; Q456-V459 PolarHBondContact O-N 3.21Å; Q456-V459 VanDerWaalsContact O-N 3.08Å; Q456-F475 HydrophobicContact CB-CE1 3.92Å; Q456-F475 HydrophobicContact CB-CZ 3.82Å
457	V	91	Very high	92.7	Very high	134 Å²	134	54.8 Å²	54.8	81%	0.812	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-64.1	-27.1	-177.2	-176.3	0	0	0	0	112.6	L455	L455-V457 PolarHBondContact O-N 2.99Å; L455-V457 VanDerWaalsContact O-N 3.08Å
458	G	89.6	Confident	92.6	Very high	24 Å²	24	59.2 Å²	59.2	25%	0.247	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-88.4	-2.5	176.9	0	0	0	0	0	114.8	L430 L431 I432 L455 Q456	L430-G458 CarbonylContact O-C 3.48Å; L430-G458 WeakPolarHBondContact O-CA 3.5Å; L431-G458 WeakPolarHBondContact CA-O 3.19Å; I432-G458 PolarHBondContact N-O 3.49Å; L455-G458 PolarHBondContact O-N 2.61Å; Q456-G458 PolarHBondContact O-N 3.36Å
459	V	94.8	Very high	92.6	Very high	13 Å²	13	53.5 Å²	53.5	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110.2	-168.1	178.3	0	0	0	0	111.2	I432 L450 Q456 A461 I474 F475	I432-V459 HydrophobicContact CB-CG1 4.2Å; I432-V459 HydrophobicContact CB-CG2 4.18Å; I432-V459 HydrophobicContact CD1-CG2 4.38Å; I432-V459 HydrophobicContact CG1-CG2 4.45Å; I432-V459 WeakPolarHBondContact O-CA 3.46Å; L450-V459 HydrophobicContact CD1-CB 4.26Å; L450-V459 HydrophobicContact CD1-CG1 3.93Å; L450-V459 HydrophobicContact CD1-CG2 3.99Å; L450-V459 HydrophobicContact CD2-CG2 3.91Å; Q456-V459 PolarHBondContact O-N 3.21Å; Q456-V459 VanDerWaalsContact O-N 3.08Å; V459-A461 HydrophobicContact CG1-CB 3.74Å; V459-I474 HydrophobicContact CG1-CD1 4.41Å; V459-F475 HydrophobicContact CB-CE2 4.27Å; V459-F475 HydrophobicContact CB-CZ 4.02Å; V459-F475 HydrophobicContact CG1-CE2 4.07Å; V459-F475 HydrophobicContact CG1-CZ 3.91Å
460	N	94.4	Very high	92.6	Very high	101 Å²	101	57.5 Å²	57.5	54%	0.54	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	93.4	168.1	-175.7	3	0	0	0	108.8	I432 Q433 S434	I432-N460 PolarHBondContact O-N 3.05Å; Q433-N460 WeakPolarHBondContact CA-O 3.46Å; S434-N460 PolarHBondContact N-O 3.35Å
461	A	94.4	Very high	92.5	Very high	1 Å²	1	60 Å²	60	1%	0.008	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	119.6	-172	0	0	0	0	0	110.9	S434 F437 V459 I474	S434-A461 WeakPolarHBondContact O-CA 3.45Å; F437-A461 HydrophobicContact CD2-CB 3.8Å; F437-A461 HydrophobicContact CE2-CB 3.44Å; F437-A461 VanDerWaalsContact CE2-CB 3.44Å; F437-A461 HydrophobicContact CZ-CB 4.32Å; V459-A461 HydrophobicContact CG1-CB 3.74Å; A461-I474 HydrophobicContact CB-CD1 3.58Å; A461-I474 HydrophobicContact CB-CG1 3.8Å; A461-I474 HydrophobicContact CB-CG2 4.02Å; A461-I474 PolarHBondContact O-N 3.01Å
462	T	95.3	Very high	92.7	Very high	33 Å²	33	56 Å²	56	20%	0.202	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	147.4	174.7	56.4	0	0	0	0	112.2	S434 N435 F437 T472	S434-T462 PolarHBondContact O-N 3.45Å; S434-T462 VanDerWaalsContact O-N 3.08Å; N435-T462 CarbonylContact C-O 3.16Å; N435-T462 WeakPolarHBondContact CA-OG1 3.46Å; N435-T462 WeakPolarHBondContact CB-OG1 3.4Å; F437-T462 PolarHBondContact N-O 2.95Å; T462-T472 VanDerWaalsContact CA-O 3.25Å; T462-T472 WeakPolarHBondContact CA-O 3.49Å; T462-T472 WeakPolarHBondContact CB-O 3.41Å
463	C	94.9	Very high	92.8	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	135.9	-178.5	-55.9	0	0	0	0	111.6	C439 L469 G471 T472	C439-C463 HydrophobicContact CB-CB 3.81Å; C439-C463 WeakPolarHBondContact CB-SG 3.08Å; C439-C463 VanDerWaalsContact SG-CA 3.56Å; C439-C463 WeakPolarHBondContact SG-CB 3.39Å; C439-C463 CovalentContact SG-SG 2.02Å; C439-C463 PolarHBondContact SG-SG 3.33Å; C463-L469 HydrophobicContact CB-CB 4.06Å; C463-L469 VanDerWaalsContact CB-O 3.31Å; C463-L469 WeakPolarHBondContact CB-O 3.49Å; C463-G471 PolarHBondContact O-N 2.55Å; C463-T472 PolarHBondContact N-O 3.17Å
464	A	92.4	Very high	92.9	Very high	31 Å²	31	47.3 Å²	47.3	26%	0.256	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-23.1	166.6	0	0	0	0	0	112.6	F437	F437-A464 PolarHBondContact O-N 3.02Å
465	H	89.4	Confident	92.9	Very high	35 Å²	35	49 Å²	49	16%	0.162	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.8	178.2	-159.4	-102.1	0	0	0	109.2	F437 L438 C439 D486 F587	F437-H465 PolarHBondContact O-N 3Å; L438-H465 HydrophobicContact CD2-CB 3.75Å; C439-H465 WeakPolarHBondContact CB-O 3.35Å; C439-H465 PolarHBondContact N-O 3.03Å; H465-D486 IonicContact CE1-OD2 3.42Å; H465-D486 PolarHBondContact CE1-OD2 3.02Å; H465-F587 HydrophobicContact CB-CE1 4.08Å; H465-F587 AromaticContact CD2-CE1 3.9Å; H465-F587 AromaticContact CG-CE1 3.9Å
466	P	89.7	Confident	92.9	Very high	27 Å²	27	55.5 Å²	55.5	18%	0.175	33%	0.326	C	S	.	.	S	Bend	cis	-60.8	162	-10.6	28.4	-36.9	0	0	0	112.8	S468 L469 Q470	P466-S468 WeakPolarHBondContact CG-OG 3.41Å; P466-S468 PolarHBondContact O-N 2.88Å; P466-S468 VanDerWaalsContact O-N 3.15Å; P466-L469 HydrophobicContact CG-CB 4.41Å; P466-L469 HydrophobicContact CG-CD1 4.08Å; P466-L469 HydrophobicContact CG-CG 4.14Å; P466-L469 PolarHBondContact O-N 2.8Å; P466-Q470 PolarHBondContact O-N 3.39Å
467	V	87.4	Confident	92.9	Very high	106 Å²	106	52.7 Å²	52.7	64%	0.642	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-57	-31.1	-179.4	-179	0	0	0	0	111.8	L469 Q470	V467-L469 PolarHBondContact O-N 2.98Å; V467-Q470 WeakPolarHBondContact O-CB 3.29Å; V467-Q470 PolarHBondContact O-N 3.38Å
468	S	90.8	Very high	93	Very high	104 Å²	104	50.3 Å²	50.3	73%	0.727	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-63.9	-18	174.8	48	0	0	0	0	115.2	P466	P466-S468 WeakPolarHBondContact CG-OG 3.41Å; P466-S468 PolarHBondContact O-N 2.88Å; P466-S468 VanDerWaalsContact O-N 3.15Å
469	L	93	Very high	92.9	Very high	13 Å²	13	53.1 Å²	53.1	7%	0.068	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-114	5.5	176.6	-63	179.6	0	0	0	112.5	C439 C463 P466 V467 G471 T472 A477	C439-L469 HydrophobicContact CB-CD1 3.9Å; C463-L469 HydrophobicContact CB-CB 4.06Å; C463-L469 VanDerWaalsContact CB-O 3.31Å; C463-L469 WeakPolarHBondContact CB-O 3.49Å; P466-L469 HydrophobicContact CG-CB 4.41Å; P466-L469 HydrophobicContact CG-CD1 4.08Å; P466-L469 HydrophobicContact CG-CG 4.14Å; P466-L469 PolarHBondContact O-N 2.8Å; V467-L469 PolarHBondContact O-N 2.98Å; L469-G471 PolarHBondContact O-N 2.87Å; L469-T472 VanDerWaalsContact O-CB 3.28Å; L469-T472 WeakPolarHBondContact O-CB 3.49Å; L469-T472 PolarHBondContact O-N 2.97Å; L469-T472 PolarHBondContact O-OG1 2.86Å; L469-A477 HydrophobicContact CD1-CB 4.4Å; L469-A477 HydrophobicContact CD2-CB 4.32Å
470	Q	94.1	Very high	92.6	Very high	127 Å²	127	59.5 Å²	59.5	59%	0.593	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	122.4	-169.4	-171.8	178.3	2	0	0	112.3	P466 V467 T472	P466-Q470 PolarHBondContact O-N 3.39Å; V467-Q470 WeakPolarHBondContact O-CB 3.29Å; V467-Q470 PolarHBondContact O-N 3.38Å; Q470-T472 VanDerWaalsContact C-N 3.34Å
471	G	93.8	Very high	92.4	Very high	53 Å²	53	56.3 Å²	56.3	55%	0.546	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-14.2	-177.3	0	0	0	0	0	115	C463 L469	C463-G471 PolarHBondContact O-N 2.55Å; L469-G471 PolarHBondContact O-N 2.87Å
472	T	95.2	Very high	92.3	Very high	45 Å²	45	56.4 Å²	56.4	28%	0.276	33%	0.329	S	S	.	.			trans	-69.3	145.5	177.8	-52	0	0	0	0	111.5	T462 C463 L469 Q470 E476 A477	T462-T472 VanDerWaalsContact CA-O 3.25Å; T462-T472 WeakPolarHBondContact CA-O 3.49Å; T462-T472 WeakPolarHBondContact CB-O 3.41Å; C463-T472 PolarHBondContact N-O 3.17Å; L469-T472 VanDerWaalsContact O-CB 3.28Å; L469-T472 WeakPolarHBondContact O-CB 3.49Å; L469-T472 PolarHBondContact O-N 2.97Å; L469-T472 PolarHBondContact O-OG1 2.86Å; Q470-T472 VanDerWaalsContact C-N 3.34Å; T472-E476 HydrophobicContact CG2-CB 3.97Å; T472-A477 HydrophobicContact CG2-CB 4.37Å
473	S	95.4	Very high	92	Very high	22 Å²	22	57.9 Å²	57.9	15%	0.154	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-67.6	141.6	171.6	179.7	0	0	0	0	111.4	F475 E476 A477	S473-F475 PolarHBondContact O-N 2.86Å; S473-F475 PolarHBondContact OG-N 3.4Å; S473-E476 VanDerWaalsContact CB-CD 3.47Å; S473-E476 WeakPolarHBondContact CB-OE2 3.29Å; S473-E476 PolarHBondContact N-OE2 3.25Å; S473-E476 PolarHBondContact O-N 3.08Å; S473-A477 PolarHBondContact O-N 3.43Å; S473-A477 VanDerWaalsContact O-N 3.07Å
474	I	95.3	Very high	91.5	Very high	1 Å²	1	60 Å²	60	1%	0.005	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.9	175.6	70.1	170.1	0	0	0	113	L443 L446 P447 L450 V459 A461	L443-I474 HydrophobicContact CD2-CG2 4.15Å; L446-I474 HydrophobicContact CD2-CD1 4.06Å; L446-I474 HydrophobicContact CG-CD1 4.36Å; P447-I474 WeakPolarHBondContact CB-O 3.19Å; P447-I474 HydrophobicContact CG-CB 4.12Å; P447-I474 HydrophobicContact CG-CD1 4.3Å; P447-I474 HydrophobicContact CG-CG1 4.25Å; P447-I474 WeakPolarHBondContact CG-O 3.04Å; L450-I474 HydrophobicContact CD1-CD1 4.3Å; V459-I474 HydrophobicContact CG1-CD1 4.41Å; A461-I474 HydrophobicContact CB-CD1 3.58Å; A461-I474 HydrophobicContact CB-CG1 3.8Å; A461-I474 HydrophobicContact CB-CG2 4.02Å; A461-I474 PolarHBondContact O-N 3.01Å
475	F	94.9	Very high	90.7	Very high	79 Å²	79	65.6 Å²	65.6	35%	0.346	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.3	176.2	-54	-70.9	0	0	0	113.7	P447 L450 Q456 V459 S473	P447-F475 HydrophobicContact CB-CD1 4.01Å; P447-F475 HydrophobicContact CB-CE1 4.4Å; L450-F475 HydrophobicContact CB-CE1 4.09Å; L450-F475 HydrophobicContact CD1-CE1 3.92Å; L450-F475 HydrophobicContact CD1-CZ 3.8Å; Q456-F475 HydrophobicContact CB-CE1 3.92Å; Q456-F475 HydrophobicContact CB-CZ 3.82Å; V459-F475 HydrophobicContact CB-CE2 4.27Å; V459-F475 HydrophobicContact CB-CZ 4.02Å; V459-F475 HydrophobicContact CG1-CE2 4.07Å; V459-F475 HydrophobicContact CG1-CZ 3.91Å; S473-F475 PolarHBondContact O-N 2.86Å; S473-F475 PolarHBondContact OG-N 3.4Å
476	E	93.5	Very high	90	Very high	146 Å²	146	66.7 Å²	66.7	68%	0.682	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-22.7	179.6	-66	166.1	168.3	0	0	111.9	T472 S473	T472-E476 HydrophobicContact CG2-CB 3.97Å; S473-E476 VanDerWaalsContact CB-CD 3.47Å; S473-E476 WeakPolarHBondContact CB-OE2 3.29Å; S473-E476 PolarHBondContact N-OE2 3.25Å; S473-E476 PolarHBondContact O-N 3.08Å
477	A	92.5	Very high	89.6	Confident	9 Å²	9	68.4 Å²	68.4	7%	0.074	39%	0.392	C	S	.	.	S	Bend	trans	-63.9	129.4	177.1	0	0	0	0	0	111.7	L469 T472 S473 Q479 F482	L469-A477 HydrophobicContact CD1-CB 4.4Å; L469-A477 HydrophobicContact CD2-CB 4.32Å; T472-A477 HydrophobicContact CG2-CB 4.37Å; S473-A477 PolarHBondContact O-N 3.43Å; S473-A477 VanDerWaalsContact O-N 3.07Å; A477-Q479 PolarHBondContact O-N 2.93Å; A477-F482 HydrophobicContact CB-CE2 3.76Å; A477-F482 HydrophobicContact CB-CZ 3.75Å
478	P	91.5	Very high	89.5	Confident	85 Å²	85	63.6 Å²	63.6	55%	0.552	36%	0.362	S	S	*	.			trans	-61.1	135.5	178	-24.8	34.3	0	0	0	112.6	N480 S481	P478-N480 PolarHBondContact O-N 2.65Å; P478-S481 WeakPolarHBondContact O-CB 3.38Å; P478-S481 PolarHBondContact O-N 3.47Å; P478-S481 PolarHBondContact O-OG 3.01Å
479	Q	87.6	Confident	89.3	Confident	83 Å²	83	60.4 Å²	60.4	39%	0.388	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-55.3	-30.2	-176.5	-163.6	66.9	1.4	0	0	113.8	Q444 A477 S481	Q444-Q479 HydrophobicContact CG-CG 4.39Å; Q444-Q479 PolarHBondContact NE2-O 3.3Å; Q444-Q479 PolarHBondContact O-NE2 3.19Å; A477-Q479 PolarHBondContact O-N 2.93Å; Q479-S481 VanDerWaalsContact C-N 3.34Å
480	N	89.5	Confident	89.2	Confident	147 Å²	147	59.9 Å²	59.9	79%	0.786	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-81.9	-6.1	179.1	-62.1	7.7	0	0	0	114	P478	P478-N480 PolarHBondContact O-N 2.65Å
481	S	90.9	Very high	88.9	Confident	33 Å²	33	58.3 Å²	58.3	23%	0.231	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-91.1	-9.7	177.9	64.6	0	0	0	0	113.9	P478 Q479 V483	P478-S481 WeakPolarHBondContact O-CB 3.38Å; P478-S481 PolarHBondContact O-N 3.47Å; P478-S481 PolarHBondContact O-OG 3.01Å; Q479-S481 VanDerWaalsContact C-N 3.34Å; S481-V483 VanDerWaalsContact C-N 3.33Å; S481-V483 PolarHBondContact O-N 3.35Å
482	F	91.5	Very high	88.8	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.018	31%	0.306	C	S	.	.			trans	-79.5	77.5	171.9	-66.4	-92.6	0	0	0	110.4	C439 D440 C441 L443 Q444 P447 A477	C439-F482 HydrophobicContact CB-CD1 3.95Å; C439-F482 HydrophobicContact CB-CE1 3.66Å; D440-F482 WeakPolarHBondContact O-CD1 3.32Å; C441-F482 VanDerWaalsContact CA-O 3.27Å; C441-F482 WeakPolarHBondContact CA-O 3.26Å; C441-F482 WeakPolarHBondContact CB-O 3.4Å; C441-F482 PolarHBondContact N-O 2.94Å; L443-F482 HydrophobicContact CB-CD1 4.41Å; L443-F482 HydrophobicContact CB-CE1 4.45Å; L443-F482 HydrophobicContact CD2-CE1 4.48Å; Q444-F482 HydrophobicContact CB-CB 3.68Å; Q444-F482 HydrophobicContact CB-CG 4.13Å; Q444-F482 HydrophobicContact CG-CB 3.84Å; Q444-F482 HydrophobicContact CG-CG 4.32Å; P447-F482 HydrophobicContact CG-CZ 4.26Å; A477-F482 HydrophobicContact CB-CE2 3.76Å; A477-F482 HydrophobicContact CB-CZ 3.75Å
483	V	88.9	Confident	88.7	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.388	31%	0.313	S	S	.	.			trans	-101.7	166.3	179.4	-66.1	0	0	0	0	112	D440 C441 S481 D485	D440-V483 CarbonylContact C-O 3.42Å; D440-V483 WeakPolarHBondContact CA-O 3.28Å; D440-V483 VanDerWaalsContact CB-O 3.31Å; D440-V483 WeakPolarHBondContact CB-O 3.15Å; C441-V483 PolarHBondContact N-O 3.01Å; S481-V483 VanDerWaalsContact C-N 3.33Å; S481-V483 PolarHBondContact O-N 3.35Å; V483-D485 WeakPolarHBondContact CG2-OD2 3.09Å
484	C	83.4	Confident	88.6	Confident	47 Å²	47	60.3 Å²	60.3	32%	0.318	33%	0.325	S	S	.	.			trans	-127.3	44.1	175.6	-75.1	0	0	0	0	110.7	C441 D486	C441-C484 VanDerWaalsContact CA-SG 3.54Å; C441-C484 HydrophobicContact CB-CB 3.95Å; C441-C484 WeakPolarHBondContact CB-SG 3.12Å; C441-C484 PolarHBondContact N-SG 2.9Å; C441-C484 WeakPolarHBondContact SG-CB 3.09Å; C441-C484 CovalentContact SG-SG 2.03Å; C441-C484 PolarHBondContact SG-SG 2.93Å; C484-D486 PolarHBondContact O-N 3.44Å
485	D	75.4	Confident	88.6	Confident	147 Å²	147	64.2 Å²	64.2	79%	0.786	34%	0.343	S	S	*	.	S	Bend	trans	-71.4	-14.6	179.7	-55.6	-28.6	0	0	0	111.8	V483	V483-D485 WeakPolarHBondContact CG2-OD2 3.09Å
486	D	76.6	Confident	88.6	Confident	58 Å²	58	60.7 Å²	60.7	31%	0.31	33%	0.328	S	S	.	.	S	Bend	trans	-126.1	164	173.1	81.3	-42	0	0	0	112.5	H465 C484 P488	H465-D486 IonicContact CE1-OD2 3.42Å; H465-D486 PolarHBondContact CE1-OD2 3.02Å; C484-D486 PolarHBondContact O-N 3.44Å; D486-P488 VanDerWaalsContact C-CD 3.4Å; D486-P488 WeakPolarHBondContact O-CD 3.41Å
487	L	81.2	Confident	88.6	Confident	63 Å²	63	61.2 Å²	61.2	33%	0.33	33%	0.331	S	S	.	.			trans	-120.5	68.2	178.8	-64	178.1	0	0	0	110.1	Q491 S515 S516	L487-Q491 HydrophobicContact CD2-CG 4.32Å; L487-S515 WeakPolarHBondContact O-CA 3.07Å; L487-S515 WeakPolarHBondContact O-CB 3.21Å; L487-S515 PolarHBondContact O-OG 3.26Å; L487-S516 VanDerWaalsContact C-OG 3.29Å; L487-S516 PolarHBondContact N-OG 3.14Å; L487-S516 PolarHBondContact O-N 3.33Å; L487-S516 PolarHBondContact O-OG 2.8Å
488	P	85.1	Confident	88.8	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.032	36%	0.357	C	S	.	.			trans	-72.5	-32.2	-171.2	28.5	-33.6	0	0	0	112.1	L438 D486 S515 N585 F587	L438-P488 HydrophobicContact CD2-CG 4.07Å; D486-P488 VanDerWaalsContact C-CD 3.4Å; D486-P488 WeakPolarHBondContact O-CD 3.41Å; P488-S515 PolarHBondContact O-OG 2.73Å; P488-N585 PolarHBondContact O-ND2 3.43Å; P488-F587 HydrophobicContact CB-CB 4.46Å; P488-F587 HydrophobicContact CB-CD1 4.3Å; P488-F587 HydrophobicContact CB-CD2 3.85Å; P488-F587 HydrophobicContact CB-CE2 4.11Å; P488-F587 HydrophobicContact CB-CG 3.94Å; P488-F587 HydrophobicContact CB-CZ 4.41Å; P488-F587 WeakPolarHBondContact O-CB 3.5Å; P488-F587 WeakPolarHBondContact O-CD2 3.15Å
489	K	86.7	Confident	88.8	Confident	38 Å²	38	64.1 Å²	64.1	17%	0.165	34%	0.341	C	S	.	.	S	Bend	trans	-87.8	137.8	169.2	-173.6	179.6	-176	-178.9	0	109.8	S391 S415 L438 F587 S589	S391-K489 PolarHBondContact OG-NZ 3.09Å; S415-K489 PolarHBondContact OG-NZ 3.35Å; L438-K489 HydrophobicContact CD1-CB 4.09Å; K489-F587 HydrophobicContact CB-CB 4.39Å; K489-S589 WeakPolarHBondContact CE-O 3.35Å; K489-S589 PolarHBondContact NZ-O 2.77Å
490	P	89.8	Confident	89	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	35%	0.349	C	S	.	.			trans	-67	138.8	-178.6	-18.3	32.4	0	0	0	112.6	A513 A514 I521 I583 N585 T590	P490-A513 HydrophobicContact CB-CB 4.2Å; P490-A514 WeakPolarHBondContact CA-O 3.31Å; P490-I521 HydrophobicContact CB-CD1 4.27Å; P490-I521 HydrophobicContact CG-CD1 3.55Å; P490-I583 HydrophobicContact CB-CG2 4.11Å; P490-I583 HydrophobicContact CG-CG2 4.38Å; P490-N585 HydrophobicContact CG-CB 4.36Å; P490-T590 HydrophobicContact CB-CG2 3.9Å; P490-T590 WeakPolarHBondContact O-CB 3.46Å; P490-T590 VanDerWaalsContact O-CG2 3.27Å; P490-T590 WeakPolarHBondContact O-CG2 3.47Å; P490-T590 PolarHBondContact O-OG1 2.91Å
491	Q	89.3	Confident	89.1	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.7	-179.1	-69.5	-80.8	1.3	0	0	109.4	L487 T493 A513 A514	L487-Q491 HydrophobicContact CD2-CG 4.32Å; Q491-T493 PolarHBondContact O-N 2.94Å; Q491-A513 CarbonylContact O-C 3.5Å; Q491-A513 WeakPolarHBondContact O-CA 3.45Å; Q491-A513 WeakPolarHBondContact O-CB 3.25Å; Q491-A514 PolarHBondContact N-O 2.98Å; Q491-A514 PolarHBondContact O-N 3.21Å
492	I	90.9	Very high	89.2	Confident	27 Å²	27	58.7 Å²	58.7	14%	0.138	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.9	-177.9	-64.5	177	0	0	0	110.2	V494 T512 A513 T590 S592	I492-V494 VanDerWaalsContact CG2-O 3.24Å; I492-V494 WeakPolarHBondContact CG2-O 3.39Å; I492-T512 CarbonylContact C-O 3.59Å; I492-T512 WeakPolarHBondContact CA-O 3.11Å; I492-T512 WeakPolarHBondContact CG2-O 3.27Å; I492-A513 HydrophobicContact CG1-CB 4.14Å; I492-T590 HydrophobicContact CD1-CG2 4Å; I492-T590 HydrophobicContact CG1-CG2 3.64Å; I492-S592 VanDerWaalsContact CD1-N 3.3Å
493	T	92.3	Very high	89.2	Confident	67 Å²	67	62.3 Å²	62.3	41%	0.411	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-30.5	179	52	0	0	0	0	112.5	Q491 T512 A514	Q491-T493 PolarHBondContact O-N 2.94Å; T493-T512 PolarHBondContact N-O 3.06Å; T493-T512 PolarHBondContact OG1-O 2.83Å; T493-A514 HydrophobicContact CG2-CB 4Å
494	V	94.1	Very high	89.3	Confident	67 Å²	67	61.3 Å²	61.3	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	124.9	175.9	-176.9	0	0	0	0	109.6	I492 T512	I492-V494 VanDerWaalsContact CG2-O 3.24Å; I492-V494 WeakPolarHBondContact CG2-O 3.39Å; V494-T512 PolarHBondContact N-O 3.21Å; V494-T512 VanDerWaalsContact N-O 3.13Å; V494-T512 PolarHBondContact O-N 2.02Å; V494-T512 VanDerWaalsContact O-N 3.09Å
495	Q	94.6	Very high	89.7	Confident	83 Å²	83	61.4 Å²	61.4	39%	0.388	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-94	149.1	179.3	-60.2	-64.8	-18.1	0	0	110.9	S592 S593	Q495-S592 VanDerWaalsContact OE1-CB 3.27Å; Q495-S593 PolarHBondContact OE1-OG 2.82Å
496	P	95.1	Very high	90.5	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.032	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-73.7	140.4	170.5	31	-32.3	0	0	0	110.9	L509 T510 W525 S592 A595	P496-L509 HydrophobicContact CB-CB 4.44Å; P496-T510 VanDerWaalsContact CA-O 3.26Å; P496-T510 WeakPolarHBondContact CA-O 3.35Å; P496-T510 WeakPolarHBondContact CB-O 3Å; P496-W525 HydrophobicContact CB-CH2 3.97Å; P496-W525 HydrophobicContact CB-CZ3 4.08Å; P496-W525 HydrophobicContact CG-CH2 4.39Å; P496-W525 HydrophobicContact CG-CZ3 4.26Å; P496-S592 VanDerWaalsContact CD-CB 3.47Å; P496-S592 WeakPolarHBondContact CG-OG 3.46Å; P496-A595 HydrophobicContact CB-CB 3.87Å; P496-A595 HydrophobicContact CG-CB 4.02Å
497	E	94.9	Very high	91.2	Very high	158 Å²	158	57.2 Å²	57.2	74%	0.738	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-95.2	151	-176.1	-60.9	-171.1	161.9	0	0	112.9	T499	E497-T499 PolarHBondContact O-N 3.2Å; E497-T499 PolarHBondContact O-OG1 3.11Å
498	N	95.3	Very high	91.8	Very high	119 Å²	119	62 Å²	62	64%	0.636	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-64.7	123.5	172.6	-67.1	-25.9	0	0	0	109.6	A595 Q596	N498-A595 WeakPolarHBondContact OD1-CA 3.38Å; N498-Q596 CarbonylContact C-O 3.56Å; N498-Q596 WeakPolarHBondContact CA-O 3.36Å; N498-Q596 PolarHBondContact OD1-N 2.98Å
499	T	92.9	Very high	92.2	Very high	35 Å²	35	61.9 Å²	61.9	22%	0.215	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.6	-175.8	-57.9	0	0	0	0	111	E497 V507 Q596 V597 V598	E497-T499 PolarHBondContact O-N 3.2Å; E497-T499 PolarHBondContact O-OG1 3.11Å; T499-V507 HydrophobicContact CG2-CG1 3.88Å; T499-V507 HydrophobicContact CG2-CG2 4.02Å; T499-Q596 PolarHBondContact N-O 2.84Å; T499-V597 WeakPolarHBondContact O-CA 3.42Å; T499-V598 PolarHBondContact O-N 3.05Å
500	V	91.6	Very high	92.6	Very high	92 Å²	92	62.5 Å²	62.5	56%	0.558	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	120.4	165.7	-179.7	0	0	0	0	107.2	V598 N600	V500-V598 HydrophobicContact CG2-CB 4.43Å; V500-N600 WeakPolarHBondContact CG1-ND2 3.33Å
501	T	91.4	Very high	92.8	Very high	17 Å²	17	62.5 Å²	62.5	10%	0.104	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	169.1	-176.2	-165.3	0	0	0	0	111.6	V507 A571 V598 V599 N600	T501-V507 VanDerWaalsContact CB-CG2 3.49Å; T501-V507 HydrophobicContact CG2-CG2 3.65Å; T501-V507 WeakPolarHBondContact OG1-CG2 3.29Å; T501-A571 HydrophobicContact CG2-CB 3.8Å; T501-V598 PolarHBondContact N-O 3.07Å; T501-V599 HydrophobicContact CG2-CB 4.38Å; T501-V599 HydrophobicContact CG2-CG2 3.74Å; T501-N600 PolarHBondContact O-N 2.95Å
502	V	91.8	Very high	93.1	Very high	41 Å²	41	58.4 Å²	58.4	25%	0.248	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.6	174	-175.2	0	0	0	0	109.3	G504 S505 N600 L602 A682	V502-G504 PolarHBondContact O-N 3.05Å; V502-S505 WeakPolarHBondContact O-CB 3.35Å; V502-S505 PolarHBondContact O-N 3.41Å; V502-S505 PolarHBondContact O-OG 2.99Å; V502-N600 CarbonylContact C-O 3.58Å; V502-N600 WeakPolarHBondContact CA-O 3.43Å; V502-L602 HydrophobicContact CG1-CB 4.04Å; V502-A682 HydrophobicContact CG2-CB 3.84Å
503	L	92.3	Very high	93.2	Very high	80 Å²	80	57.1 Å²	57.1	42%	0.419	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.3	124.5	177.6	-174.2	73.5	0	0	0	112.1	F573 V599 N600 V601	L503-F573 HydrophobicContact CD1-CD2 4.3Å; L503-F573 HydrophobicContact CD1-CE2 4.21Å; L503-V599 HydrophobicContact CB-CG1 4.11Å; L503-V599 HydrophobicContact CD1-CG1 3.9Å; L503-N600 PolarHBondContact N-O 3.06Å; L503-V601 HydrophobicContact CB-CG2 4.16Å; L503-V601 HydrophobicContact CD2-CG2 4.05Å
504	G	90.3	Very high	93.1	Very high	43 Å²	43	54.2 Å²	54.2	44%	0.443	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-0	-178.4	0	0	0	0	0	115.9	V502 R570 A571	V502-G504 PolarHBondContact O-N 3.05Å; G504-R570 WeakPolarHBondContact O-CA 3.03Å; G504-A571 PolarHBondContact N-O 3.09Å
505	S	91.5	Very high	93	Very high	49 Å²	49	51 Å²	51	34%	0.343	28%	0.277	S	S	.	.			trans	-86.4	152.9	173.3	-48.5	0	0	0	0	112	V502 A571	V502-S505 WeakPolarHBondContact O-CB 3.35Å; V502-S505 PolarHBondContact O-N 3.41Å; V502-S505 PolarHBondContact O-OG 2.99Å; S505-A571 WeakPolarHBondContact O-CB 3.31Å; S505-A571 PolarHBondContact O-N 3Å
506	D	92.3	Very high	92.6	Very high	110 Å²	110	49 Å²	49	59%	0.588	27%	0.271	S	S	*	.			trans	-83.2	135.7	175.7	-64.8	-18.3	0	0	0	111.2	L568 R569 R570	D506-L568 WeakPolarHBondContact CA-O 3.49Å; D506-R569 WeakPolarHBondContact OD1-CA 3.26Å; D506-R570 PolarHBondContact OD1-N 2.91Å
507	V	92.1	Very high	92	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.6	176.3	169.1	0	0	0	0	110.7	T499 T501 L509 H567 L568 A571	T499-V507 HydrophobicContact CG2-CG1 3.88Å; T499-V507 HydrophobicContact CG2-CG2 4.02Å; T501-V507 VanDerWaalsContact CB-CG2 3.49Å; T501-V507 HydrophobicContact CG2-CG2 3.65Å; T501-V507 WeakPolarHBondContact OG1-CG2 3.29Å; V507-L509 HydrophobicContact CG1-CD2 4.24Å; V507-L509 HydrophobicContact CG1-CG 4.35Å; V507-H567 WeakPolarHBondContact O-CA 3.36Å; V507-L568 HydrophobicContact CB-CB 4.21Å; V507-L568 HydrophobicContact CB-CD1 4.46Å; V507-L568 HydrophobicContact CG1-CD1 4.28Å; V507-L568 PolarHBondContact N-O 3.09Å; V507-L568 PolarHBondContact O-N 3Å; V507-A571 HydrophobicContact CG2-CB 4.41Å
508	R	93.3	Very high	91.4	Very high	164 Å²	164	47.8 Å²	47.8	62%	0.619	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	123	175.3	-71.2	-178.8	166.5	-169.5	-8.4	110.2	I565 L566 H567	R508-I565 HydrophobicContact CB-CG2 4.16Å; R508-I565 HydrophobicContact CG-CG2 4.35Å; R508-L566 WeakPolarHBondContact CA-O 3.27Å; R508-H567 VanDerWaalsContact CZ-CE1 3.42Å; R508-H567 PolarHBondContact NE-CE1 3.47Å; R508-H567 PolarHBondContact NE-ND1 3.02Å; R508-H567 PolarHBondContact NH2-CE1 3.08Å; R508-H567 VanDerWaalsContact NH2-CE1 3.29Å
509	L	94.4	Very high	90.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.9	171.7	-58.8	179.7	0	0	0	109.2	P496 V507 W525 I565 L566 Y579 V597	P496-L509 HydrophobicContact CB-CB 4.44Å; V507-L509 HydrophobicContact CG1-CD2 4.24Å; V507-L509 HydrophobicContact CG1-CG 4.35Å; L509-W525 HydrophobicContact CB-CH2 3.6Å; L509-W525 HydrophobicContact CB-CZ2 4.45Å; L509-W525 HydrophobicContact CB-CZ3 3.76Å; L509-W525 HydrophobicContact CD1-CZ3 4.21Å; L509-W525 WeakPolarHBondContact O-CH2 3.4Å; L509-W525 VanDerWaalsContact O-CZ2 3.25Å; L509-W525 WeakPolarHBondContact O-CZ2 3.48Å; L509-I565 WeakPolarHBondContact O-CA 3.18Å; L509-L566 HydrophobicContact CB-CB 4.49Å; L509-L566 PolarHBondContact N-O 2.76Å; L509-L566 PolarHBondContact O-N 3.42Å; L509-Y579 HydrophobicContact CD1-CD1 3.93Å; L509-Y579 HydrophobicContact CD1-CD2 4.09Å; L509-Y579 HydrophobicContact CD1-CG 3.57Å; L509-V597 HydrophobicContact CD1-CG2 4.01Å; L509-V597 HydrophobicContact CD2-CG2 4.37Å
510	T	94.3	Very high	90.7	Very high	52 Å²	52	46.9 Å²	46.9	32%	0.319	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	144.5	-177.8	-57.2	0	0	0	0	111	P496 T563 I565	P496-T510 VanDerWaalsContact CA-O 3.26Å; P496-T510 WeakPolarHBondContact CA-O 3.35Å; P496-T510 WeakPolarHBondContact CB-O 3Å; T510-T563 HydrophobicContact CG2-CG2 3.92Å; T510-I565 HydrophobicContact CG2-CG1 4.27Å
511	C	94.9	Very high	90.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	131.4	175.6	171.4	0	0	0	0	109.6	W525 T563 T564 C581	C511-W525 HydrophobicContact CB-CH2 3.93Å; C511-W525 HydrophobicContact CB-CZ2 3.76Å; C511-T563 CarbonylContact O-C 3.58Å; C511-T563 WeakPolarHBondContact O-CA 3.42Å; C511-T564 HydrophobicContact CB-CG2 3.85Å; C511-T564 PolarHBondContact N-O 3.02Å; C511-T564 PolarHBondContact O-N 2.95Å; C511-C581 HydrophobicContact CB-CB 3.37Å; C511-C581 WeakPolarHBondContact CB-SG 3.3Å; C511-C581 WeakPolarHBondContact SG-CB 3.22Å; C511-C581 CovalentContact SG-SG 2.03Å; C511-C581 PolarHBondContact SG-SG 2.81Å
512	T	94.1	Very high	90.6	Very high	10 Å²	10	47 Å²	47	6%	0.061	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.5	-179.8	-54.3	0	0	0	0	110.8	I492 T493 V494 E561 Y562 T563	I492-T512 CarbonylContact C-O 3.59Å; I492-T512 WeakPolarHBondContact CA-O 3.11Å; I492-T512 WeakPolarHBondContact CG2-O 3.27Å; T493-T512 PolarHBondContact N-O 3.06Å; T493-T512 PolarHBondContact OG1-O 2.83Å; V494-T512 PolarHBondContact N-O 3.21Å; V494-T512 VanDerWaalsContact N-O 3.13Å; V494-T512 PolarHBondContact O-N 2.02Å; V494-T512 VanDerWaalsContact O-N 3.09Å; T512-E561 HydrophobicContact CG2-CB 4.27Å; T512-Y562 CarbonylContact C-O 3.57Å; T512-Y562 VanDerWaalsContact CA-O 3.3Å; T512-Y562 WeakPolarHBondContact CA-O 3.41Å; T512-T563 VanDerWaalsContact CG2-OG1 3.27Å; T512-T563 WeakPolarHBondContact CG2-OG1 3.48Å; T512-T563 PolarHBondContact OG1-OG1 2.83Å
513	A	93.1	Very high	90.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.4	171.6	0	0	0	0	0	112.8	P490 Q491 I492 E561 Y562 I583	P490-A513 HydrophobicContact CB-CB 4.2Å; Q491-A513 CarbonylContact O-C 3.5Å; Q491-A513 WeakPolarHBondContact O-CA 3.45Å; Q491-A513 WeakPolarHBondContact O-CB 3.25Å; I492-A513 HydrophobicContact CG1-CB 4.14Å; A513-E561 WeakPolarHBondContact O-CA 3.48Å; A513-Y562 PolarHBondContact N-O 3.5Å; A513-Y562 PolarHBondContact O-N 3.22Å; A513-I583 HydrophobicContact CB-CB 4.46Å; A513-I583 HydrophobicContact CB-CD1 3.66Å; A513-I583 HydrophobicContact CB-CG2 4.29Å
514	A	91.8	Very high	90.5	Very high	6 Å²	6	44.8 Å²	44.8	5%	0.05	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	145.8	173.1	0	0	0	0	0	111.6	P490 Q491 T493 V559 M560 E561	P490-A514 WeakPolarHBondContact CA-O 3.31Å; Q491-A514 PolarHBondContact N-O 2.98Å; Q491-A514 PolarHBondContact O-N 3.21Å; T493-A514 HydrophobicContact CG2-CB 4Å; A514-V559 HydrophobicContact CB-CG1 3.87Å; A514-M560 CarbonylContact C-O 3.53Å; A514-M560 WeakPolarHBondContact CA-O 3.33Å; A514-E561 HydrophobicContact CB-CG 4.28Å
515	S	90.1	Very high	90.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	147.3	166.6	-174.7	0	0	0	0	111.2	L487 P488 S517 M560	L487-S515 WeakPolarHBondContact O-CA 3.07Å; L487-S515 WeakPolarHBondContact O-CB 3.21Å; L487-S515 PolarHBondContact O-OG 3.26Å; P488-S515 PolarHBondContact O-OG 2.73Å; S515-S517 VanDerWaalsContact C-N 3.34Å; S515-S517 PolarHBondContact OG-N 2.98Å; S515-S517 VanDerWaalsContact OG-N 3.14Å; S515-M560 PolarHBondContact N-O 3.14Å; S515-M560 PolarHBondContact O-N 3.03Å
516	S	86.9	Confident	90.4	Very high	39 Å²	39	41.2 Å²	41.2	27%	0.273	24%	0.236	S	C	.	.			trans	-86.9	-3.5	169.1	61.9	0	0	0	0	113.1	L487	L487-S516 VanDerWaalsContact C-OG 3.29Å; L487-S516 PolarHBondContact N-OG 3.14Å; L487-S516 PolarHBondContact O-N 3.33Å; L487-S516 PolarHBondContact O-OG 2.8Å
517	S	83.3	Confident	90.3	Very high	14 Å²	14	37.8 Å²	37.8	10%	0.098	22%	0.217	C	C	.	.			trans	-81.2	135.6	-174.7	-163.6	0	0	0	0	112.5	S515 S519 F587	S515-S517 VanDerWaalsContact C-N 3.34Å; S515-S517 PolarHBondContact OG-N 2.98Å; S515-S517 VanDerWaalsContact OG-N 3.14Å; S517-S519 PolarHBondContact O-N 3.35Å; S517-S519 WeakPolarHBondContact OG-CB 3.35Å; S517-S519 PolarHBondContact OG-N 3.45Å; S517-S519 VanDerWaalsContact OG-N 3.17Å; S517-S519 PolarHBondContact OG-OG 3.19Å; S517-F587 WeakPolarHBondContact OG-CE2 3.21Å
518	S	82	Confident	89.9	Confident	125 Å²	125	40.4 Å²	40.4	87%	0.874	23%	0.23	S	C	*	.			trans	-74	0	165	54.7	0	0	0	0	113.8
519	S	84.6	Confident	89	Confident	20 Å²	20	33.2 Å²	33.2	14%	0.14	20%	0.204	C	C	.	.	S	Bend	trans	-62.3	136.2	176.3	-61.7	0	0	0	0	111.4	S517 I521	S517-S519 PolarHBondContact O-N 3.35Å; S517-S519 WeakPolarHBondContact OG-CB 3.35Å; S517-S519 PolarHBondContact OG-N 3.45Å; S517-S519 VanDerWaalsContact OG-N 3.17Å; S517-S519 PolarHBondContact OG-OG 3.19Å; S519-I521 PolarHBondContact O-N 3.09Å
520	P	88.4	Confident	88.3	Confident	114 Å²	114	38.3 Å²	38.3	74%	0.74	23%	0.227	S	C	*	.	P	Polyproline II helix	trans	-52.6	129.3	174.3	-28.3	35.7	0	0	0	112.7	N585	P520-N585 WeakPolarHBondContact O-CB 3.24Å
521	I	90.2	Very high	87.9	Confident	27 Å²	27	40.3 Å²	40.3	14%	0.138	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-89.7	139.1	174	-70.2	-81.1	0	0	0	109.2	P490 S519 F523 Y562 I583 N585	P490-I521 HydrophobicContact CB-CD1 4.27Å; P490-I521 HydrophobicContact CG-CD1 3.55Å; S519-I521 PolarHBondContact O-N 3.09Å; I521-F523 HydrophobicContact CG2-CD1 4.27Å; I521-F523 HydrophobicContact CG2-CD2 4.22Å; I521-F523 HydrophobicContact CG2-CE1 3.85Å; I521-F523 HydrophobicContact CG2-CE2 3.77Å; I521-F523 HydrophobicContact CG2-CG 4.47Å; I521-F523 HydrophobicContact CG2-CZ 3.59Å; I521-Y562 HydrophobicContact CB-CD1 4.05Å; I521-Y562 HydrophobicContact CB-CE1 4.12Å; I521-Y562 HydrophobicContact CB-CG 4.42Å; I521-Y562 HydrophobicContact CD1-CD2 4.21Å; I521-Y562 HydrophobicContact CD1-CE2 4.25Å; I521-Y562 HydrophobicContact CG1-CD1 3.88Å; I521-Y562 HydrophobicContact CG1-CD2 3.93Å; I521-Y562 HydrophobicContact CG1-CE1 3.72Å; I521-Y562 HydrophobicContact CG1-CE2 3.77Å; I521-Y562 HydrophobicContact CG1-CG 3.97Å; I521-Y562 HydrophobicContact CG2-CD1 4.2Å; I521-Y562 HydrophobicContact CG2-CG 4.29Å; I521-I583 HydrophobicContact CD1-CG2 4.07Å; I521-I583 HydrophobicContact CG2-CG2 3.73Å; I521-N585 HydrophobicContact CD1-CB 3.89Å
522	T	91.6	Very high	87.5	Confident	85 Å²	85	42.6 Å²	42.6	52%	0.521	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139	170.2	52	0	0	0	0	109.1	T584	T522-T584 PolarHBondContact N-O 2.85Å; T522-T584 PolarHBondContact O-N 2.65Å; T522-T584 WeakPolarHBondContact OG1-CB 3.32Å; T522-T584 PolarHBondContact OG1-O 2.93Å
523	F	91.3	Very high	86.3	Confident	46 Å²	46	52.9 Å²	52.9	20%	0.202	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.5	179.6	-53	-90.5	0	0	0	108.8	I521 N539 Y562 T564 I583	I521-F523 HydrophobicContact CG2-CD1 4.27Å; I521-F523 HydrophobicContact CG2-CD2 4.22Å; I521-F523 HydrophobicContact CG2-CE1 3.85Å; I521-F523 HydrophobicContact CG2-CE2 3.77Å; I521-F523 HydrophobicContact CG2-CG 4.47Å; I521-F523 HydrophobicContact CG2-CZ 3.59Å; F523-N539 HydrophobicContact CD2-CB 3.84Å; F523-N539 HydrophobicContact CE2-CB 3.74Å; F523-N539 HydrophobicContact CG-CB 4.5Å; F523-N539 HydrophobicContact CZ-CB 4.3Å; F523-Y562 HydrophobicContact CZ-CD1 4.29Å; F523-T564 HydrophobicContact CB-CG2 4.47Å; F523-T564 HydrophobicContact CD1-CG2 3.79Å; F523-I583 HydrophobicContact CD1-CD1 4.09Å; F523-I583 HydrophobicContact CD1-CG1 3.98Å; F523-I583 HydrophobicContact CD1-CG2 4.48Å; F523-I583 HydrophobicContact CE1-CD1 4.17Å; F523-I583 HydrophobicContact CE1-CG1 4.46Å
524	A	90.8	Very high	84.7	Confident	28 Å²	28	61.8 Å²	61.8	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153	167.6	0	0	0	0	0	110.5	L531 I582	A524-L531 HydrophobicContact CB-CD1 3.85Å; A524-I582 PolarHBondContact N-O 3.01Å; A524-I582 PolarHBondContact O-N 2.72Å
525	W	91.4	Very high	83.1	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	143.9	171.9	-72.2	80.4	0	0	0	109.4	P496 L509 C511 L532 T564 L566 Q580 C581	P496-W525 HydrophobicContact CB-CH2 3.97Å; P496-W525 HydrophobicContact CB-CZ3 4.08Å; P496-W525 HydrophobicContact CG-CH2 4.39Å; P496-W525 HydrophobicContact CG-CZ3 4.26Å; L509-W525 HydrophobicContact CB-CH2 3.6Å; L509-W525 HydrophobicContact CB-CZ2 4.45Å; L509-W525 HydrophobicContact CB-CZ3 3.76Å; L509-W525 HydrophobicContact CD1-CZ3 4.21Å; L509-W525 WeakPolarHBondContact O-CH2 3.4Å; L509-W525 VanDerWaalsContact O-CZ2 3.25Å; L509-W525 WeakPolarHBondContact O-CZ2 3.48Å; C511-W525 HydrophobicContact CB-CH2 3.93Å; C511-W525 HydrophobicContact CB-CZ2 3.76Å; W525-L532 HydrophobicContact CB-CD1 3.99Å; W525-L532 WeakPolarHBondContact O-CB 3.48Å; W525-L532 PolarHBondContact O-N 3.35Å; W525-T564 HydrophobicContact CZ2-CG2 3.99Å; W525-T564 PolarHBondContact NE1-OG1 3.18Å; W525-T564 VanDerWaalsContact NE1-OG1 3.1Å; W525-L566 HydrophobicContact CB-CD2 4.1Å; W525-L566 HydrophobicContact CD2-CB 3.87Å; W525-L566 HydrophobicContact CD2-CD2 4Å; W525-L566 HydrophobicContact CE3-CB 4.35Å; W525-L566 HydrophobicContact CE3-CD2 4.05Å; W525-L566 HydrophobicContact CG-CB 4.15Å; W525-L566 HydrophobicContact CG-CD2 4.04Å; W525-L566 HydrophobicContact CZ2-CB 4.11Å; W525-Q580 WeakPolarHBondContact CA-O 3.21Å; W525-C581 HydrophobicContact CD2-CB 4.14Å; W525-C581 HydrophobicContact CE3-CB 4.06Å; W525-C581 HydrophobicContact CH2-CB 3.87Å; W525-C581 HydrophobicContact CZ2-CB 3.93Å; W525-C581 HydrophobicContact CZ3-CB 3.93Å
526	R	87.5	Confident	82.3	Confident	17 Å²	17	67.2 Å²	67.2	6%	0.064	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.6	169.1	64.9	175.7	-176.9	168.7	1.8	110.8	D368 Q529 E530 Y579 Q580 I582	D368-R526 IonicContact OD2-CZ 3.06Å; D368-R526 VanDerWaalsContact OD2-CZ 3.23Å; D368-R526 IonicContact OD2-NH1 3.23Å; D368-R526 PolarHBondContact OD2-NH1 2.88Å; D368-R526 IonicContact OD2-NH2 3.17Å; D368-R526 PolarHBondContact OD2-NH2 2.98Å; R526-Q529 VanDerWaalsContact NH1-OE1 3.11Å; R526-E530 CarbonylContact C-O 3.56Å; R526-E530 WeakPolarHBondContact CA-O 3.25Å; R526-E530 VanDerWaalsContact CB-O 3.23Å; R526-E530 WeakPolarHBondContact CB-O 3.12Å; R526-Y579 CarbonylContact O-C 3.57Å; R526-Y579 VanDerWaalsContact O-CA 3.29Å; R526-Y579 WeakPolarHBondContact O-CA 3.34Å; R526-Q580 HydrophobicContact CG-CB 4.02Å; R526-Q580 PolarHBondContact N-O 2.99Å; R526-Q580 PolarHBondContact O-N 2.88Å; R526-I582 HydrophobicContact CG-CD1 4.2Å
527	K	89.9	Confident	82	Confident	39 Å²	39	67.9 Å²	67.9	17%	0.17	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.5	173.2	-172.1	-159	-179.2	-151	0	108.2	Q529 E530 L532 A574 E576 Y579	K527-Q529 PolarHBondContact O-N 3.15Å; K527-Q529 VanDerWaalsContact O-N 3.11Å; K527-E530 PolarHBondContact N-O 3.21Å; K527-E530 PolarHBondContact O-N 3.03Å; K527-L532 HydrophobicContact CB-CD1 4.38Å; K527-L532 HydrophobicContact CB-CD2 3.81Å; K527-L532 HydrophobicContact CB-CG 4.2Å; K527-A574 PolarHBondContact NZ-O 3.39Å; K527-E576 WeakPolarHBondContact CE-O 3.2Å; K527-E576 PolarHBondContact NZ-O 3.32Å; K527-Y579 HydrophobicContact CB-CD1 4.25Å; K527-Y579 HydrophobicContact CB-CE1 4.05Å; K527-Y579 HydrophobicContact CD-CE1 4.31Å; K527-Y579 HydrophobicContact CD-CE2 4.11Å; K527-Y579 WeakPolarHBondContact CD-OH 3.36Å; K527-Y579 HydrophobicContact CG-CD1 4.34Å; K527-Y579 HydrophobicContact CG-CD2 4.21Å; K527-Y579 HydrophobicContact CG-CE1 3.96Å; K527-Y579 HydrophobicContact CG-CE2 3.78Å; K527-Y579 HydrophobicContact CG-CG 4.46Å
528	D	83.6	Confident	82.1	Confident	61 Å²	61	71.4 Å²	71.4	33%	0.326	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	39.5	178.2	-59.9	-56	0	0	0	114	E530 G577 R578	D528-E530 VanDerWaalsContact C-N 3.31Å; D528-E530 PolarHBondContact O-N 2.9Å; D528-G577 WeakPolarHBondContact OD2-CA 3.2Å; D528-R578 PolarHBondContact N-O 3.21Å; D528-R578 PolarHBondContact OD1-N 2.78Å
529	Q	74.2	Confident	82.2	Confident	13 Å²	13	69 Å²	69	6%	0.061	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-10.7	-174.9	-45.6	-50.4	-91.2	0	0	116.1	H340 R526 K527	H340-Q529 PolarHBondContact CD2-O 3.08Å; R526-Q529 VanDerWaalsContact NH1-OE1 3.11Å; K527-Q529 PolarHBondContact O-N 3.15Å; K527-Q529 VanDerWaalsContact O-N 3.11Å
530	E	80.9	Confident	82.3	Confident	108 Å²	108	71.9 Å²	71.9	51%	0.505	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.5	177.7	-63.2	-168.5	-159.7	0	0	113.2	R316 R526 K527 D528 L532	R316-E530 IonicContact CZ-OE1 3.14Å; R316-E530 IonicContact NH1-OE1 2.85Å; R316-E530 PolarHBondContact NH1-OE1 3.32Å; R316-E530 IonicContact NH2-OE1 2.76Å; R316-E530 PolarHBondContact NH2-OE1 2.88Å; R526-E530 CarbonylContact C-O 3.56Å; R526-E530 WeakPolarHBondContact CA-O 3.25Å; R526-E530 VanDerWaalsContact CB-O 3.23Å; R526-E530 WeakPolarHBondContact CB-O 3.12Å; K527-E530 PolarHBondContact N-O 3.21Å; K527-E530 PolarHBondContact O-N 3.03Å; D528-E530 VanDerWaalsContact C-N 3.31Å; D528-E530 PolarHBondContact O-N 2.9Å; E530-L532 PolarHBondContact O-N 3.31Å
531	L	84.5	Confident	81.8	Confident	94 Å²	94	69 Å²	69	49%	0.492	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.3	-179.4	-160.4	75.2	0	0	0	111.6	A524 R533 I582	A524-L531 HydrophobicContact CB-CD1 3.85Å; L531-R533 PolarHBondContact O-N 3.28Å; L531-I582 HydrophobicContact CD1-CD1 4.3Å
532	L	87	Confident	81.4	Confident	49 Å²	49	73 Å²	73	26%	0.257	37%	0.365	S	S	.	.			trans	-71.1	110.2	176.6	-63.5	177.1	0	0	0	109.5	W525 K527 E530 L566 Y579	W525-L532 HydrophobicContact CB-CD1 3.99Å; W525-L532 WeakPolarHBondContact O-CB 3.48Å; W525-L532 PolarHBondContact O-N 3.35Å; K527-L532 HydrophobicContact CB-CD1 4.38Å; K527-L532 HydrophobicContact CB-CD2 3.81Å; K527-L532 HydrophobicContact CB-CG 4.2Å; E530-L532 PolarHBondContact O-N 3.31Å; L532-L566 HydrophobicContact CD1-CD1 4.49Å; L532-L566 HydrophobicContact CD1-CD2 3.74Å; L532-Y579 HydrophobicContact CD1-CD1 4.09Å; L532-Y579 HydrophobicContact CD1-CE1 3.86Å
533	R	70.2	Confident	80.4	Confident	226 Å²	226	73.4 Å²	73.4	85%	0.853	37%	0.367	S	S	*	.	S	Bend	trans	-71	-36.8	-169	-66.8	-168.7	176.7	-141	-1.9	113.9	L531	L531-R533 PolarHBondContact O-N 3.28Å
534	H	58.1	Low	79.1	Confident	186 Å²	186	78.2 Å²	78.2	86%	0.861	38%	0.384	S	S	*	.	S	Bend	trans	-150.1	107.5	165.4	-71.5	-67.6	0	0	0	108.8
535	G	57.7	Low	77.3	Confident	31 Å²	31	82.9 Å²	82.9	32%	0.32	41%	0.409	S	S	.	.			trans	-100.2	166.5	159.4	0	0	0	0	0	110.1	M537	G535-M537 PolarHBondContact O-N 2.91Å
536	E	73.2	Confident	75.1	Confident	89 Å²	89	90.4 Å²	90.4	42%	0.416	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	98	161.6	-71.1	-168.5	-178.3	0	0	108.5	H567 R569	E536-H567 HydrophobicContact CB-CB 4.14Å; E536-H567 PolarHBondContact O-CD2 3.17Å; E536-H567 PolarHBondContact O-N 2.67Å; E536-R569 VanDerWaalsContact CD-NE 3.31Å; E536-R569 IonicContact OE1-CZ 3.93Å; E536-R569 VanDerWaalsContact OE1-CZ 3.23Å; E536-R569 IonicContact OE1-NE 3.38Å; E536-R569 PolarHBondContact OE1-NE 3.13Å; E536-R569 IonicContact OE1-NH2 2.69Å; E536-R569 PolarHBondContact OE1-NH2 3.37Å; E536-R569 VanDerWaalsContact OE1-NH2 3.12Å; E536-R569 IonicContact OE2-CZ 3.87Å; E536-R569 IonicContact OE2-NE 3.6Å; E536-R569 PolarHBondContact OE2-NE 2.71Å; E536-R569 IonicContact OE2-NH2 3.35Å; E536-R569 PolarHBondContact OE2-NH2 3.15Å
537	M	82.6	Confident	73	Confident	54 Å²	54	92.4 Å²	92.4	27%	0.266	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.1	-177.8	-65.3	175.3	-63.8	0	0	109.2	G535 I565 L566	G535-M537 PolarHBondContact O-N 2.91Å; M537-I565 WeakPolarHBondContact CA-O 3.36Å; M537-L566 HydrophobicContact CG-CD1 3.85Å
538	E	84.4	Confident	70.7	Confident	88 Å²	88	98.9 Å²	98.9	41%	0.411	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.3	170.5	-67.7	179.1	153.1	0	0	108.9	F540 T564 I565 H567	E538-F540 HydrophobicContact CB-CE2 3.58Å; E538-F540 HydrophobicContact CB-CZ 3.75Å; E538-T564 CarbonylContact O-C 3.32Å; E538-T564 WeakPolarHBondContact O-CA 3.2Å; E538-I565 PolarHBondContact N-O 3.23Å; E538-I565 PolarHBondContact O-N 2.94Å; E538-H567 WeakPolarHBondContact CG-NE2 3.36Å; E538-H567 IonicContact OE1-NE2 2.92Å; E538-H567 IonicContact OE2-CE1 3.38Å; E538-H567 PolarHBondContact OE2-CE1 3.34Å; E538-H567 IonicContact OE2-NE2 3.71Å; E538-H567 PolarHBondContact OE2-NE2 3.11Å
539	N	84.8	Confident	68.4	Low	75 Å²	75	101.2 Å²	101.2	40%	0.401	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.8	-175.9	-60.3	-48.3	0	0	0	109.9	F523 T563 T564	F523-N539 HydrophobicContact CD2-CB 3.84Å; F523-N539 HydrophobicContact CE2-CB 3.74Å; F523-N539 HydrophobicContact CG-CB 4.5Å; F523-N539 HydrophobicContact CZ-CB 4.3Å; N539-T563 CarbonylContact C-O 3.52Å; N539-T563 WeakPolarHBondContact CA-O 3.23Å; N539-T564 WeakPolarHBondContact OD1-CB 3.41Å; N539-T564 PolarHBondContact OD1-OG1 2.93Å
540	F	85.3	Confident	66.8	Low	80 Å²	80	105.4 Å²	105.4	35%	0.351	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.1	149	-173.9	-52.2	-88.9	0	0	0	110.4	E538 Y562 T563 I565	E538-F540 HydrophobicContact CB-CE2 3.58Å; E538-F540 HydrophobicContact CB-CZ 3.75Å; F540-Y562 WeakPolarHBondContact O-CA 3.46Å; F540-T563 PolarHBondContact N-O 3.31Å; F540-T563 PolarHBondContact O-N 2.78Å; F540-I565 HydrophobicContact CE2-CD1 3.93Å; F540-I565 HydrophobicContact CE2-CG1 4.27Å
541	A	79.6	Confident	64.8	Low	53 Å²	53	107.9 Å²	107.9	44%	0.438	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.5	126.3	173	0	0	0	0	0	109.3	M560 E561 Y562	A541-M560 HydrophobicContact CB-CE 4.43Å; A541-E561 WeakPolarHBondContact CA-O 3.42Å; A541-Y562 HydrophobicContact CB-CD1 3.71Å; A541-Y562 HydrophobicContact CB-CE1 3.8Å
542	H	80.5	Confident	62.3	Low	112 Å²	112	108.4 Å²	108.4	52%	0.519	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.4	145.1	-176.1	-60.4	-46.6	0	0	0	110.6	E561	H542-E561 PolarHBondContact N-O 2.84Å; H542-E561 PolarHBondContact O-N 3.34Å
543	V	71.1	Confident	59.9	Low	93 Å²	93	111.8 Å²	111.8	56%	0.564	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.3	131.1	171.7	-177.2	0	0	0	0	107.8	T545 M560	V543-T545 VanDerWaalsContact C-N 3.33Å; V543-T545 PolarHBondContact O-N 3Å; V543-M560 HydrophobicContact CB-SD 4.31Å; V543-M560 HydrophobicContact CG2-CE 4.21Å; V543-M560 HydrophobicContact CG2-SD 3.77Å
544	R	64.5	Low	58.3	Low	147 Å²	147	105.9 Å²	105.9	56%	0.555	61%	0.609	S	S	*	*			trans	-73.3	85.6	177	-164.4	-175.9	-144.9	-135	-0.6	110.6	Q546 V559 E561	R544-Q546 PolarHBondContact O-N 3.42Å; R544-V559 WeakPolarHBondContact CB-O 3.34Å; R544-V559 PolarHBondContact N-O 3.07Å; R544-E561 HydrophobicContact CB-CG 4.29Å; R544-E561 HydrophobicContact CG-CG 4.28Å; R544-E561 IonicContact CZ-OE1 2.66Å; R544-E561 IonicContact NE-OE1 2.77Å; R544-E561 PolarHBondContact NE-OE1 3.01Å; R544-E561 IonicContact NH2-OE1 2.69Å; R544-E561 PolarHBondContact NH2-OE1 2.8Å
545	T	52.2	Low	57.4	Low	125 Å²	125	104.5 Å²	104.5	77%	0.767	61%	0.606	S	S	*	*			trans	-65	106.7	170.7	50.3	0	0	0	0	109	V543 G547	V543-T545 VanDerWaalsContact C-N 3.33Å; V543-T545 PolarHBondContact O-N 3Å; T545-G547 PolarHBondContact O-N 3.09Å
546	Q	46.3	Very low	56.5	Low	158 Å²	158	108.4 Å²	108.4	74%	0.738	64%	0.635	S	S	*	*			trans	-60.2	124.2	175.8	-170.2	170.7	-3.7	0	0	109	R544	R544-Q546 PolarHBondContact O-N 3.42Å
547	G	43.2	Very low	55.4	Low	59 Å²	59	106.4 Å²	106.4	61%	0.608	64%	0.638	S	S	*	*			trans	-66.7	159.6	-175.6	0	0	0	0	0	113.1	T545 T549	T545-G547 PolarHBondContact O-N 3.09Å; G547-T549 PolarHBondContact O-N 2.81Å
548	D	40	Very low	54.5	Low	176 Å²	176	106.5 Å²	106.5	94%	0.941	65%	0.653	S	S	*	*	S	Bend	trans	-61.8	90.5	-171.6	-66.3	-70	0	0	0	114.3
549	T	35.9	Very low	54.4	Low	110 Å²	110	104.2 Å²	104.2	68%	0.675	65%	0.645	S	S	*	*			trans	-129.4	101.2	152	55.9	0	0	0	0	108.7	G547 D551	G547-T549 PolarHBondContact O-N 2.81Å; T549-D551 PolarHBondContact O-N 3.02Å
550	A	41.1	Very low	54.4	Low	101 Å²	101	102.9 Å²	102.9	84%	0.835	64%	0.637	S	S	*	*			trans	-72.5	90	175.1	0	0	0	0	0	110.3
551	D	38	Very low	54.6	Low	160 Å²	160	101.5 Å²	101.5	86%	0.856	63%	0.632	S	S	*	*			trans	-177.7	71	149.9	-94.6	-22.5	0	0	0	110.9	T549	T549-D551 PolarHBondContact O-N 3.02Å
552	T	31.8	Very low	55.2	Low	105 Å²	105	100.3 Å²	100.3	64%	0.644	62%	0.616	S	S	*	*	S	Bend	trans	-160.9	139	159.6	-3.1	0	0	0	0	110.3
553	P	38.4	Very low	55.8	Low	120 Å²	120	96.2 Å²	96.2	78%	0.779	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-65.3	136.3	174.4	-20.3	33.2	0	0	0	111.4	I555	P553-I555 PolarHBondContact O-N 3.03Å
554	A	34.8	Very low	56.9	Low	101 Å²	101	91.8 Å²	91.8	84%	0.835	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-64	117.8	-178	0	0	0	0	0	111.9	A556	A554-A556 PolarHBondContact O-N 2.82Å
555	I	40.8	Very low	58.3	Low	157 Å²	157	86 Å²	86	81%	0.805	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-71.4	117.6	169.2	-62	177	0	0	0	107.9	P553 G557	P553-I555 PolarHBondContact O-N 3.03Å; I555-G557 PolarHBondContact O-N 2.98Å
556	A	38.9	Very low	60.2	Low	114 Å²	114	80.1 Å²	80.1	94%	0.942	52%	0.516	S	S	*	.	S	Bend	trans	-75.3	69.5	179.9	0	0	0	0	0	111.8	A554	A554-A556 PolarHBondContact O-N 2.82Å
557	G	50.3	Low	62.4	Low	46 Å²	46	73.5 Å²	73.5	47%	0.474	49%	0.485	S	S	.	.			trans	-165.2	81.3	-178.8	0	0	0	0	0	110.9	I555 V559	I555-G557 PolarHBondContact O-N 2.98Å; G557-V559 PolarHBondContact O-N 2.81Å; G557-V559 VanDerWaalsContact O-N 3.1Å
558	G	63.8	Low	64.7	Low	56 Å²	56	71.4 Å²	71.4	58%	0.577	46%	0.46	S	S	*	.			trans	-64.3	108.9	-173.4	0	0	0	0	0	113	M560	G558-M560 PolarHBondContact O-N 2.94Å
559	V	80.8	Confident	67.1	Low	40 Å²	40	70.8 Å²	70.8	24%	0.242	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-68	126.8	169.7	178.9	0	0	0	0	109	A514 R544 G557	A514-V559 HydrophobicContact CB-CG1 3.87Å; R544-V559 WeakPolarHBondContact CB-O 3.34Å; R544-V559 PolarHBondContact N-O 3.07Å; G557-V559 PolarHBondContact O-N 2.81Å; G557-V559 VanDerWaalsContact O-N 3.1Å
560	M	85.2	Confident	69.7	Low	48 Å²	48	74.6 Å²	74.6	24%	0.236	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.5	176	-65.9	-61.1	-61.3	0	0	109.8	A514 S515 A541 V543 G558 Y562	A514-M560 CarbonylContact C-O 3.53Å; A514-M560 WeakPolarHBondContact CA-O 3.33Å; S515-M560 PolarHBondContact N-O 3.14Å; S515-M560 PolarHBondContact O-N 3.03Å; A541-M560 HydrophobicContact CB-CE 4.43Å; V543-M560 HydrophobicContact CB-SD 4.31Å; V543-M560 HydrophobicContact CG2-CE 4.21Å; V543-M560 HydrophobicContact CG2-SD 3.77Å; G558-M560 PolarHBondContact O-N 2.94Å; M560-Y562 HydrophobicContact CB-CD2 4.23Å; M560-Y562 HydrophobicContact CB-CE1 4.45Å; M560-Y562 HydrophobicContact CB-CE2 3.41Å; M560-Y562 VanDerWaalsContact CB-CE2 3.41Å; M560-Y562 WeakPolarHBondContact CB-OH 3.38Å
561	E	90.3	Very high	72.1	Confident	51 Å²	51	69.8 Å²	69.8	24%	0.238	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.9	168.4	-73.7	-174.2	161.3	0	0	110.1	T512 A513 A514 A541 H542 R544	T512-E561 HydrophobicContact CG2-CB 4.27Å; A513-E561 WeakPolarHBondContact O-CA 3.48Å; A514-E561 HydrophobicContact CB-CG 4.28Å; A541-E561 WeakPolarHBondContact CA-O 3.42Å; H542-E561 PolarHBondContact N-O 2.84Å; H542-E561 PolarHBondContact O-N 3.34Å; R544-E561 HydrophobicContact CB-CG 4.29Å; R544-E561 HydrophobicContact CG-CG 4.28Å; R544-E561 IonicContact CZ-OE1 2.66Å; R544-E561 IonicContact NE-OE1 2.77Å; R544-E561 PolarHBondContact NE-OE1 3.01Å; R544-E561 IonicContact NH2-OE1 2.69Å; R544-E561 PolarHBondContact NH2-OE1 2.8Å
562	Y	92.1	Very high	74.8	Confident	28 Å²	28	65 Å²	65	11%	0.11	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	113.3	-173.3	-64.5	-82.6	0	0	0	109.2	T512 A513 I521 F523 F540 A541 M560	T512-Y562 CarbonylContact C-O 3.57Å; T512-Y562 VanDerWaalsContact CA-O 3.3Å; T512-Y562 WeakPolarHBondContact CA-O 3.41Å; A513-Y562 PolarHBondContact N-O 3.5Å; A513-Y562 PolarHBondContact O-N 3.22Å; I521-Y562 HydrophobicContact CB-CD1 4.05Å; I521-Y562 HydrophobicContact CB-CE1 4.12Å; I521-Y562 HydrophobicContact CB-CG 4.42Å; I521-Y562 HydrophobicContact CD1-CD2 4.21Å; I521-Y562 HydrophobicContact CD1-CE2 4.25Å; I521-Y562 HydrophobicContact CG1-CD1 3.88Å; I521-Y562 HydrophobicContact CG1-CD2 3.93Å; I521-Y562 HydrophobicContact CG1-CE1 3.72Å; I521-Y562 HydrophobicContact CG1-CE2 3.77Å; I521-Y562 HydrophobicContact CG1-CG 3.97Å; I521-Y562 HydrophobicContact CG2-CD1 4.2Å; I521-Y562 HydrophobicContact CG2-CG 4.29Å; F523-Y562 HydrophobicContact CZ-CD1 4.29Å; F540-Y562 WeakPolarHBondContact O-CA 3.46Å; A541-Y562 HydrophobicContact CB-CD1 3.71Å; A541-Y562 HydrophobicContact CB-CE1 3.8Å; M560-Y562 HydrophobicContact CB-CD2 4.23Å; M560-Y562 HydrophobicContact CB-CE1 4.45Å; M560-Y562 HydrophobicContact CB-CE2 3.41Å; M560-Y562 VanDerWaalsContact CB-CE2 3.41Å; M560-Y562 WeakPolarHBondContact CB-OH 3.38Å
563	T	92.9	Very high	77.6	Confident	25 Å²	25	64.9 Å²	64.9	15%	0.153	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.2	-177.4	-62	0	0	0	0	110.5	T510 C511 T512 N539 F540 I565	T510-T563 HydrophobicContact CG2-CG2 3.92Å; C511-T563 CarbonylContact O-C 3.58Å; C511-T563 WeakPolarHBondContact O-CA 3.42Å; T512-T563 VanDerWaalsContact CG2-OG1 3.27Å; T512-T563 WeakPolarHBondContact CG2-OG1 3.48Å; T512-T563 PolarHBondContact OG1-OG1 2.83Å; N539-T563 CarbonylContact C-O 3.52Å; N539-T563 WeakPolarHBondContact CA-O 3.23Å; F540-T563 PolarHBondContact N-O 3.31Å; F540-T563 PolarHBondContact O-N 2.78Å; T563-I565 HydrophobicContact CG2-CG1 4.16Å
564	T	93.5	Very high	80	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.7	168.2	-178.2	0	0	0	0	109.9	C511 F523 W525 E538 N539 I583	C511-T564 HydrophobicContact CB-CG2 3.85Å; C511-T564 PolarHBondContact N-O 3.02Å; C511-T564 PolarHBondContact O-N 2.95Å; F523-T564 HydrophobicContact CB-CG2 4.47Å; F523-T564 HydrophobicContact CD1-CG2 3.79Å; W525-T564 HydrophobicContact CZ2-CG2 3.99Å; W525-T564 PolarHBondContact NE1-OG1 3.18Å; W525-T564 VanDerWaalsContact NE1-OG1 3.1Å; E538-T564 CarbonylContact O-C 3.32Å; E538-T564 WeakPolarHBondContact O-CA 3.2Å; N539-T564 WeakPolarHBondContact OD1-CB 3.41Å; N539-T564 PolarHBondContact OD1-OG1 2.93Å; T564-I583 HydrophobicContact CG2-CD1 4.43Å
565	I	93.7	Very high	82.7	Confident	26 Å²	26	59.7 Å²	59.7	13%	0.133	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.1	176.4	-52.3	-179.2	0	0	0	108	R508 L509 T510 M537 E538 F540 T563 H567	R508-I565 HydrophobicContact CB-CG2 4.16Å; R508-I565 HydrophobicContact CG-CG2 4.35Å; L509-I565 WeakPolarHBondContact O-CA 3.18Å; T510-I565 HydrophobicContact CG2-CG1 4.27Å; M537-I565 WeakPolarHBondContact CA-O 3.36Å; E538-I565 PolarHBondContact N-O 3.23Å; E538-I565 PolarHBondContact O-N 2.94Å; F540-I565 HydrophobicContact CE2-CD1 3.93Å; F540-I565 HydrophobicContact CE2-CG1 4.27Å; T563-I565 HydrophobicContact CG2-CG1 4.16Å; I565-H567 PolarHBondContact O-CD2 2.9Å
566	L	93.5	Very high	85.2	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.6	170.1	176.9	65.2	0	0	0	109.3	R508 L509 W525 L532 M537 L568 Y579	R508-L566 WeakPolarHBondContact CA-O 3.27Å; L509-L566 HydrophobicContact CB-CB 4.49Å; L509-L566 PolarHBondContact N-O 2.76Å; L509-L566 PolarHBondContact O-N 3.42Å; W525-L566 HydrophobicContact CB-CD2 4.1Å; W525-L566 HydrophobicContact CD2-CB 3.87Å; W525-L566 HydrophobicContact CD2-CD2 4Å; W525-L566 HydrophobicContact CE3-CB 4.35Å; W525-L566 HydrophobicContact CE3-CD2 4.05Å; W525-L566 HydrophobicContact CG-CB 4.15Å; W525-L566 HydrophobicContact CG-CD2 4.04Å; W525-L566 HydrophobicContact CZ2-CB 4.11Å; L532-L566 HydrophobicContact CD1-CD1 4.49Å; L532-L566 HydrophobicContact CD1-CD2 3.74Å; M537-L566 HydrophobicContact CG-CD1 3.85Å; L566-L568 HydrophobicContact CD2-CD2 4.16Å; L566-L568 HydrophobicContact CG-CD2 4.15Å; L566-Y579 HydrophobicContact CD2-CD1 3.57Å; L566-Y579 HydrophobicContact CD2-CE1 3.76Å
567	H	92.2	Very high	87.7	Confident	20 Å²	20	49.8 Å²	49.8	9%	0.093	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123	174.7	-54.9	-104.4	0	0	0	109.6	V507 R508 E536 E538 I565	V507-H567 WeakPolarHBondContact O-CA 3.36Å; R508-H567 VanDerWaalsContact CZ-CE1 3.42Å; R508-H567 PolarHBondContact NE-CE1 3.47Å; R508-H567 PolarHBondContact NE-ND1 3.02Å; R508-H567 PolarHBondContact NH2-CE1 3.08Å; R508-H567 VanDerWaalsContact NH2-CE1 3.29Å; E536-H567 HydrophobicContact CB-CB 4.14Å; E536-H567 PolarHBondContact O-CD2 3.17Å; E536-H567 PolarHBondContact O-N 2.67Å; E538-H567 WeakPolarHBondContact CG-NE2 3.36Å; E538-H567 IonicContact OE1-NE2 2.92Å; E538-H567 IonicContact OE2-CE1 3.38Å; E538-H567 PolarHBondContact OE2-CE1 3.34Å; E538-H567 IonicContact OE2-NE2 3.71Å; E538-H567 PolarHBondContact OE2-NE2 3.11Å; I565-H567 PolarHBondContact O-CD2 2.9Å
568	L	90.9	Very high	89.7	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	94.5	171	-53.6	173.2	0	0	0	107	D506 V507 L566 Y579 V597	D506-L568 WeakPolarHBondContact CA-O 3.49Å; V507-L568 HydrophobicContact CB-CB 4.21Å; V507-L568 HydrophobicContact CB-CD1 4.46Å; V507-L568 HydrophobicContact CG1-CD1 4.28Å; V507-L568 PolarHBondContact N-O 3.09Å; V507-L568 PolarHBondContact O-N 3Å; L566-L568 HydrophobicContact CD2-CD2 4.16Å; L566-L568 HydrophobicContact CG-CD2 4.15Å; L568-Y579 HydrophobicContact CD1-CE1 3.99Å; L568-Y579 HydrophobicContact CD1-CE2 4.22Å; L568-Y579 HydrophobicContact CD2-CE1 4Å; L568-V597 HydrophobicContact CD1-CG2 4.39Å
569	R	90.2	Very high	91.1	Very high	162 Å²	162	49.9 Å²	49.9	61%	0.611	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	136	-179.2	-64.3	-164	-163.1	-179.2	12.9	111.2	D506 E536	D506-R569 WeakPolarHBondContact OD1-CA 3.26Å; E536-R569 VanDerWaalsContact CD-NE 3.31Å; E536-R569 IonicContact OE1-CZ 3.93Å; E536-R569 VanDerWaalsContact OE1-CZ 3.23Å; E536-R569 IonicContact OE1-NE 3.38Å; E536-R569 PolarHBondContact OE1-NE 3.13Å; E536-R569 IonicContact OE1-NH2 2.69Å; E536-R569 PolarHBondContact OE1-NH2 3.37Å; E536-R569 VanDerWaalsContact OE1-NH2 3.12Å; E536-R569 IonicContact OE2-CZ 3.87Å; E536-R569 IonicContact OE2-NE 3.6Å; E536-R569 PolarHBondContact OE2-NE 2.71Å; E536-R569 IonicContact OE2-NH2 3.35Å; E536-R569 PolarHBondContact OE2-NH2 3.15Å
570	R	91.1	Very high	91.6	Very high	190 Å²	190	48.3 Å²	48.3	72%	0.717	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	56.3	178.8	-60.2	178.2	175.2	176.9	-2.9	113.1	G504 D506 T572	G504-R570 WeakPolarHBondContact O-CA 3.03Å; D506-R570 PolarHBondContact OD1-N 2.91Å; R570-T572 WeakPolarHBondContact O-CG2 3Å; R570-T572 PolarHBondContact O-N 2.9Å
571	A	91.6	Very high	92	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.			trans	-45.8	130.7	-171.8	0	0	0	0	0	113.4	T501 G504 S505 V507 V599	T501-A571 HydrophobicContact CG2-CB 3.8Å; G504-A571 PolarHBondContact N-O 3.09Å; S505-A571 WeakPolarHBondContact O-CB 3.31Å; S505-A571 PolarHBondContact O-N 3Å; V507-A571 HydrophobicContact CG2-CB 4.41Å; A571-V599 HydrophobicContact CB-CG2 4.18Å
572	T	93.4	Very high	92	Very high	61 Å²	61	44.5 Å²	44.5	37%	0.374	21%	0.209	S	C	.	.			trans	-116.2	168.7	-178.3	71.6	0	0	0	0	110.6	R570 A574 D575 V599	R570-T572 WeakPolarHBondContact O-CG2 3Å; R570-T572 PolarHBondContact O-N 2.9Å; T572-A574 PolarHBondContact O-N 3.03Å; T572-A574 VanDerWaalsContact O-N 3.08Å; T572-A574 WeakPolarHBondContact OG1-CB 3.31Å; T572-A574 PolarHBondContact OG1-N 2.87Å; T572-D575 WeakPolarHBondContact CA-OD2 3.44Å; T572-D575 WeakPolarHBondContact CB-OD2 3.28Å; T572-D575 PolarHBondContact N-OD2 2.76Å; T572-D575 WeakPolarHBondContact O-CA 3.4Å; T572-D575 WeakPolarHBondContact O-CB 3.34Å; T572-D575 PolarHBondContact O-N 2.84Å; T572-D575 PolarHBondContact OG1-OD2 3.38Å; T572-V599 WeakPolarHBondContact O-CG2 3.13Å
573	F	91	Very high	92	Very high	102 Å²	102	43.1 Å²	43.1	45%	0.447	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-57.9	-22.2	170.7	-62.7	-69.9	0	0	0	113.6	L503 D575 E576 V599 V601	L503-F573 HydrophobicContact CD1-CD2 4.3Å; L503-F573 HydrophobicContact CD1-CE2 4.21Å; F573-D575 PolarHBondContact O-N 2.93Å; F573-E576 PolarHBondContact O-N 2.81Å; F573-V599 HydrophobicContact CD1-CB 4.49Å; F573-V599 WeakPolarHBondContact CE1-O 3.33Å; F573-V601 HydrophobicContact CE1-CG2 4.45Å; F573-V601 HydrophobicContact CE2-CG2 4.36Å; F573-V601 HydrophobicContact CZ-CG2 3.62Å
574	A	89.8	Confident	91.9	Very high	77 Å²	77	43 Å²	43	64%	0.636	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-71.4	-12.2	173.2	0	0	0	0	0	113.1	K527 T572	K527-A574 PolarHBondContact NZ-O 3.39Å; T572-A574 PolarHBondContact O-N 3.03Å; T572-A574 VanDerWaalsContact O-N 3.08Å; T572-A574 WeakPolarHBondContact OG1-CB 3.31Å; T572-A574 PolarHBondContact OG1-N 2.87Å
575	D	91.3	Very high	91.7	Very high	34 Å²	34	43.5 Å²	43.5	18%	0.182	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-95.6	-4.6	175.5	-55.9	-76.3	0	0	0	113	T572 F573 G577 Y579	T572-D575 WeakPolarHBondContact CA-OD2 3.44Å; T572-D575 WeakPolarHBondContact CB-OD2 3.28Å; T572-D575 PolarHBondContact N-OD2 2.76Å; T572-D575 WeakPolarHBondContact O-CA 3.4Å; T572-D575 WeakPolarHBondContact O-CB 3.34Å; T572-D575 PolarHBondContact O-N 2.84Å; T572-D575 PolarHBondContact OG1-OD2 3.38Å; F573-D575 PolarHBondContact O-N 2.93Å; D575-G577 PolarHBondContact O-N 3.05Å; D575-Y579 VanDerWaalsContact O-CE2 3.26Å; D575-Y579 WeakPolarHBondContact O-CE2 3.39Å; D575-Y579 PolarHBondContact O-OH 3.07Å
576	E	92.6	Very high	91.3	Very high	59 Å²	59	48 Å²	48	28%	0.276	23%	0.226	S	C	.	.			trans	-69.1	130.3	173.4	-68.5	-162.6	117.6	0	0	111.6	K527 F573 V598 V599	K527-E576 WeakPolarHBondContact CE-O 3.2Å; K527-E576 PolarHBondContact NZ-O 3.32Å; F573-E576 PolarHBondContact O-N 2.81Å; E576-V598 WeakPolarHBondContact OE1-CG1 3.3Å; E576-V599 HydrophobicContact CG-CB 3.73Å; E576-V599 HydrophobicContact CG-CG2 3.73Å; E576-V599 PolarHBondContact OE1-N 3.03Å
577	G	91.9	Very high	90.9	Very high	5 Å²	5	49.6 Å²	49.6	5%	0.052	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-177.1	180	0	0	0	0	0	115.7	D528 D575 Q596 V597	D528-G577 WeakPolarHBondContact OD2-CA 3.2Å; D575-G577 PolarHBondContact O-N 3.05Å; G577-Q596 PolarHBondContact O-NE2 2.87Å; G577-V597 PolarHBondContact N-O 2.93Å; G577-V597 VanDerWaalsContact N-O 3.14Å; G577-V597 PolarHBondContact O-N 2.86Å
578	R	91.8	Very high	90.5	Very high	99 Å²	99	48.6 Å²	48.6	37%	0.374	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	101	179.6	-71.5	-178	-75.9	171.4	-5.6	111.3	E343 D528 K594 A595	E343-R578 IonicContact OE2-NH1 2.71Å; D528-R578 PolarHBondContact N-O 3.21Å; D528-R578 PolarHBondContact OD1-N 2.78Å; R578-K594 HydrophobicContact CB-CB 4.41Å; R578-A595 CarbonylContact C-O 3.52Å; R578-A595 WeakPolarHBondContact CA-O 3.46Å
579	Y	93.3	Very high	90.4	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	145.6	177.4	-70.5	-101.9	0	0	0	111.3	L509 R526 K527 L532 L566 L568 D575 K594 A595 V597	L509-Y579 HydrophobicContact CD1-CD1 3.93Å; L509-Y579 HydrophobicContact CD1-CD2 4.09Å; L509-Y579 HydrophobicContact CD1-CG 3.57Å; R526-Y579 CarbonylContact O-C 3.57Å; R526-Y579 VanDerWaalsContact O-CA 3.29Å; R526-Y579 WeakPolarHBondContact O-CA 3.34Å; K527-Y579 HydrophobicContact CB-CD1 4.25Å; K527-Y579 HydrophobicContact CB-CE1 4.05Å; K527-Y579 HydrophobicContact CD-CE1 4.31Å; K527-Y579 HydrophobicContact CD-CE2 4.11Å; K527-Y579 WeakPolarHBondContact CD-OH 3.36Å; K527-Y579 HydrophobicContact CG-CD1 4.34Å; K527-Y579 HydrophobicContact CG-CD2 4.21Å; K527-Y579 HydrophobicContact CG-CE1 3.96Å; K527-Y579 HydrophobicContact CG-CE2 3.78Å; K527-Y579 HydrophobicContact CG-CG 4.46Å; L532-Y579 HydrophobicContact CD1-CD1 4.09Å; L532-Y579 HydrophobicContact CD1-CE1 3.86Å; L566-Y579 HydrophobicContact CD2-CD1 3.57Å; L566-Y579 HydrophobicContact CD2-CE1 3.76Å; L568-Y579 HydrophobicContact CD1-CE1 3.99Å; L568-Y579 HydrophobicContact CD1-CE2 4.22Å; L568-Y579 HydrophobicContact CD2-CE1 4Å; D575-Y579 VanDerWaalsContact O-CE2 3.26Å; D575-Y579 WeakPolarHBondContact O-CE2 3.39Å; D575-Y579 PolarHBondContact O-OH 3.07Å; Y579-K594 CarbonylContact O-C 3.39Å; Y579-K594 WeakPolarHBondContact O-CA 3.13Å; Y579-A595 PolarHBondContact N-O 3.01Å; Y579-A595 PolarHBondContact O-N 3.03Å; Y579-V597 HydrophobicContact CD2-CB 4.07Å; Y579-V597 HydrophobicContact CD2-CG2 3.54Å; Y579-V597 HydrophobicContact CE2-CB 3.88Å; Y579-V597 HydrophobicContact CE2-CG2 3.68Å; Y579-V597 HydrophobicContact CG-CG2 4.44Å
580	Q	91.8	Very high	90.3	Very high	7 Å²	7	41.5 Å²	41.5	3%	0.033	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.6	171.2	-163.7	-163.1	47.8	0	0	110.5	W525 R526 S592	W525-Q580 WeakPolarHBondContact CA-O 3.21Å; R526-Q580 HydrophobicContact CG-CB 4.02Å; R526-Q580 PolarHBondContact N-O 2.99Å; R526-Q580 PolarHBondContact O-N 2.88Å; Q580-S592 WeakPolarHBondContact CG-O 3.31Å; Q580-S592 WeakPolarHBondContact CG-OG 3.35Å; Q580-S592 PolarHBondContact NE2-O 3.06Å
581	C	93	Very high	90.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	141.3	172.6	166.5	0	0	0	0	110.8	C511 W525 S592	C511-C581 HydrophobicContact CB-CB 3.37Å; C511-C581 WeakPolarHBondContact CB-SG 3.3Å; C511-C581 WeakPolarHBondContact SG-CB 3.22Å; C511-C581 CovalentContact SG-SG 2.03Å; C511-C581 PolarHBondContact SG-SG 2.81Å; W525-C581 HydrophobicContact CD2-CB 4.14Å; W525-C581 HydrophobicContact CE3-CB 4.06Å; W525-C581 HydrophobicContact CH2-CB 3.87Å; W525-C581 HydrophobicContact CZ2-CB 3.93Å; W525-C581 HydrophobicContact CZ3-CB 3.93Å; C581-S592 PolarHBondContact N-OG 3.29Å; C581-S592 PolarHBondContact O-N 3.06Å
582	I	91.3	Very high	90.2	Very high	19 Å²	19	34.8 Å²	34.8	10%	0.097	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.4	176.1	-47.1	174.9	0	0	0	107.9	A524 R526 L531 T590 Y591	A524-I582 PolarHBondContact N-O 3.01Å; A524-I582 PolarHBondContact O-N 2.72Å; R526-I582 HydrophobicContact CG-CD1 4.2Å; L531-I582 HydrophobicContact CD1-CD1 4.3Å; I582-T590 WeakPolarHBondContact CA-O 3.42Å; I582-Y591 HydrophobicContact CB-CD1 4.45Å; I582-Y591 HydrophobicContact CB-CE1 4.46Å; I582-Y591 HydrophobicContact CD1-CD1 4.2Å; I582-Y591 HydrophobicContact CD1-CE1 3.88Å; I582-Y591 HydrophobicContact CG1-CD1 3.83Å; I582-Y591 HydrophobicContact CG1-CE1 3.95Å; I582-Y591 HydrophobicContact CG2-CD1 4.05Å; I582-Y591 HydrophobicContact CG2-CE1 3.73Å
583	I	91.6	Very high	90.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.1	177.8	-58.6	-176.6	0	0	0	108.1	P490 A513 I521 F523 T564 S589 T590	P490-I583 HydrophobicContact CB-CG2 4.11Å; P490-I583 HydrophobicContact CG-CG2 4.38Å; A513-I583 HydrophobicContact CB-CB 4.46Å; A513-I583 HydrophobicContact CB-CD1 3.66Å; A513-I583 HydrophobicContact CB-CG2 4.29Å; I521-I583 HydrophobicContact CD1-CG2 4.07Å; I521-I583 HydrophobicContact CG2-CG2 3.73Å; F523-I583 HydrophobicContact CD1-CD1 4.09Å; F523-I583 HydrophobicContact CD1-CG1 3.98Å; F523-I583 HydrophobicContact CD1-CG2 4.48Å; F523-I583 HydrophobicContact CE1-CD1 4.17Å; F523-I583 HydrophobicContact CE1-CG1 4.46Å; T564-I583 HydrophobicContact CG2-CD1 4.43Å; I583-S589 CarbonylContact O-C 3.45Å; I583-T590 HydrophobicContact CB-CG2 3.92Å; I583-T590 PolarHBondContact N-O 3.48Å; I583-T590 WeakPolarHBondContact O-CG2 3.5Å; I583-T590 PolarHBondContact O-N 3.05Å
584	T	90.3	Very high	90	Very high	22 Å²	22	32.1 Å²	32.1	14%	0.135	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	133.6	-169.9	-55.6	0	0	0	0	111.8	T522 G588 S589	T522-T584 PolarHBondContact N-O 2.85Å; T522-T584 PolarHBondContact O-N 2.65Å; T522-T584 WeakPolarHBondContact OG1-CB 3.32Å; T522-T584 PolarHBondContact OG1-O 2.93Å; T584-G588 WeakPolarHBondContact CA-O 3.2Å; T584-S589 WeakPolarHBondContact OG1-CB 3.38Å
585	N	89.4	Confident	90.2	Very high	11 Å²	11	28.4 Å²	28.4	6%	0.059	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	-166.4	164.1	71.7	9	0	0	0	110.4	P488 P490 P520 I521 F587 G588	P488-N585 PolarHBondContact O-ND2 3.43Å; P490-N585 HydrophobicContact CG-CB 4.36Å; P520-N585 WeakPolarHBondContact O-CB 3.24Å; I521-N585 HydrophobicContact CD1-CB 3.89Å; N585-F587 VanDerWaalsContact C-N 3.28Å; N585-F587 PolarHBondContact O-N 3Å; N585-F587 WeakPolarHBondContact OD1-CA 3.32Å; N585-F587 WeakPolarHBondContact OD1-CB 3.38Å; N585-F587 PolarHBondContact OD1-N 2.9Å; N585-G588 PolarHBondContact N-O 2.8Å; N585-G588 VanDerWaalsContact N-O 3.09Å; N585-G588 PolarHBondContact O-N 3.04Å; N585-G588 PolarHBondContact OD1-N 2.93Å
586	H	85.9	Confident	90.4	Very high	121 Å²	121	30.2 Å²	30.2	56%	0.56	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.5	177.7	-173.2	93.3	0	0	0	113.2	R414	R414-H586 PolarHBondContact NE-O 3.18Å; R414-H586 VanDerWaalsContact NE-O 3.16Å; R414-H586 PolarHBondContact NH1-CD2 3.5Å; R414-H586 PolarHBondContact NH1-NE2 3.41Å; R414-H586 PolarHBondContact NH1-O 3.47Å; R414-H586 PolarHBondContact NH2-CD2 2.84Å; R414-H586 PolarHBondContact NH2-CE1 2.97Å; R414-H586 PolarHBondContact NH2-NE2 3.3Å; R414-H586 PolarHBondContact NH2-O 3.07Å
587	F	84.4	Confident	90.5	Very high	33 Å²	33	27.4 Å²	27.4	15%	0.145	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.7	-176	-66.3	-71.3	0	0	0	113.9	R414 L438 H465 P488 K489 S517 N585	R414-F587 WeakPolarHBondContact CD-O 3.35Å; L438-F587 HydrophobicContact CD1-CB 4.41Å; L438-F587 HydrophobicContact CD2-CB 4.36Å; L438-F587 HydrophobicContact CD2-CD1 3.49Å; L438-F587 VanDerWaalsContact CD2-CD1 3.49Å; L438-F587 HydrophobicContact CD2-CE1 4.12Å; L438-F587 HydrophobicContact CD2-CG 4.25Å; H465-F587 HydrophobicContact CB-CE1 4.08Å; H465-F587 AromaticContact CD2-CE1 3.9Å; H465-F587 AromaticContact CG-CE1 3.9Å; P488-F587 HydrophobicContact CB-CB 4.46Å; P488-F587 HydrophobicContact CB-CD1 4.3Å; P488-F587 HydrophobicContact CB-CD2 3.85Å; P488-F587 HydrophobicContact CB-CE2 4.11Å; P488-F587 HydrophobicContact CB-CG 3.94Å; P488-F587 HydrophobicContact CB-CZ 4.41Å; P488-F587 WeakPolarHBondContact O-CB 3.5Å; P488-F587 WeakPolarHBondContact O-CD2 3.15Å; K489-F587 HydrophobicContact CB-CB 4.39Å; S517-F587 WeakPolarHBondContact OG-CE2 3.21Å; N585-F587 VanDerWaalsContact C-N 3.28Å; N585-F587 PolarHBondContact O-N 3Å; N585-F587 WeakPolarHBondContact OD1-CA 3.32Å; N585-F587 WeakPolarHBondContact OD1-CB 3.38Å; N585-F587 PolarHBondContact OD1-N 2.9Å
588	G	84.7	Confident	90.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.4	179.7	166.2	0	0	0	0	0	114.4	T584 N585	T584-G588 WeakPolarHBondContact CA-O 3.2Å; N585-G588 PolarHBondContact N-O 2.8Å; N585-G588 VanDerWaalsContact N-O 3.09Å; N585-G588 PolarHBondContact O-N 3.04Å; N585-G588 PolarHBondContact OD1-N 2.93Å
589	S	87.3	Confident	90.7	Very high	5 Å²	5	24.4 Å²	24.4	4%	0.035	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	148.2	175.3	-18.9	0	0	0	0	110.2	E367 K489 I583 T584	E367-S589 VanDerWaalsContact OE2-CB 3.23Å; E367-S589 WeakPolarHBondContact OE2-CB 2.97Å; E367-S589 PolarHBondContact OE2-OG 2.96Å; K489-S589 WeakPolarHBondContact CE-O 3.35Å; K489-S589 PolarHBondContact NZ-O 2.77Å; I583-S589 CarbonylContact O-C 3.45Å; T584-S589 WeakPolarHBondContact OG1-CB 3.38Å
590	T	88	Confident	90.7	Very high	23 Å²	23	24.5 Å²	24.5	14%	0.141	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149	171	-166	0	0	0	0	110.1	P490 I492 I582 I583	P490-T590 HydrophobicContact CB-CG2 3.9Å; P490-T590 WeakPolarHBondContact O-CB 3.46Å; P490-T590 VanDerWaalsContact O-CG2 3.27Å; P490-T590 WeakPolarHBondContact O-CG2 3.47Å; P490-T590 PolarHBondContact O-OG1 2.91Å; I492-T590 HydrophobicContact CD1-CG2 4Å; I492-T590 HydrophobicContact CG1-CG2 3.64Å; I582-T590 WeakPolarHBondContact CA-O 3.42Å; I583-T590 HydrophobicContact CB-CG2 3.92Å; I583-T590 PolarHBondContact N-O 3.48Å; I583-T590 WeakPolarHBondContact O-CG2 3.5Å; I583-T590 PolarHBondContact O-N 3.05Å
591	Y	90	Very high	90.8	Very high	41 Å²	41	26 Å²	26	16%	0.161	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.1	-163.5	-62.8	-97	0	0	0	110.9	E367 D368 I582	E367-Y591 HydrophobicContact CB-CD2 4.34Å; E367-Y591 HydrophobicContact CB-CE2 3.44Å; E367-Y591 VanDerWaalsContact CB-CE2 3.44Å; E367-Y591 PolarHBondContact OE2-OH 2.91Å; D368-Y591 HydrophobicContact CB-CD1 4.17Å; D368-Y591 HydrophobicContact CB-CG 4.15Å; I582-Y591 HydrophobicContact CB-CD1 4.45Å; I582-Y591 HydrophobicContact CB-CE1 4.46Å; I582-Y591 HydrophobicContact CD1-CD1 4.2Å; I582-Y591 HydrophobicContact CD1-CE1 3.88Å; I582-Y591 HydrophobicContact CG1-CD1 3.83Å; I582-Y591 HydrophobicContact CG1-CE1 3.95Å; I582-Y591 HydrophobicContact CG2-CD1 4.05Å; I582-Y591 HydrophobicContact CG2-CE1 3.73Å
592	S	91.8	Very high	90.6	Very high	7 Å²	7	29.7 Å²	29.7	5%	0.049	16%	0.155	C	C	.	.			trans	-74.6	176.7	-178	74.7	0	0	0	0	113.3	I492 Q495 P496 Q580 C581	I492-S592 VanDerWaalsContact CD1-N 3.3Å; Q495-S592 VanDerWaalsContact OE1-CB 3.27Å; P496-S592 VanDerWaalsContact CD-CB 3.47Å; P496-S592 WeakPolarHBondContact CG-OG 3.46Å; Q580-S592 WeakPolarHBondContact CG-O 3.31Å; Q580-S592 WeakPolarHBondContact CG-OG 3.35Å; Q580-S592 PolarHBondContact NE2-O 3.06Å; C581-S592 PolarHBondContact N-OG 3.29Å; C581-S592 PolarHBondContact O-N 3.06Å
593	S	89.9	Confident	90.7	Very high	55 Å²	55	29 Å²	29	39%	0.385	15%	0.151	S	C	.	.			trans	-58.2	151.9	155.9	47.7	0	0	0	0	110.8	Q495 A595	Q495-S593 PolarHBondContact OE1-OG 2.82Å; S593-A595 PolarHBondContact O-N 2.91Å
594	K	89.8	Confident	90.8	Very high	52 Å²	52	31.1 Å²	31.1	23%	0.226	17%	0.166	C	C	.	.			trans	-78.2	110.6	171.2	-60.5	-174.8	-172.1	-171.9	0	108.4	E343 R578 Y579	E343-K594 IonicContact OE2-NZ 3.3Å; E343-K594 PolarHBondContact OE2-NZ 3.27Å; R578-K594 HydrophobicContact CB-CB 4.41Å; Y579-K594 CarbonylContact O-C 3.39Å; Y579-K594 WeakPolarHBondContact O-CA 3.13Å
595	A	94.3	Very high	90.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.4	174.7	0	0	0	0	0	110.4	P496 N498 R578 Y579 S593	P496-A595 HydrophobicContact CB-CB 3.87Å; P496-A595 HydrophobicContact CG-CB 4.02Å; N498-A595 WeakPolarHBondContact OD1-CA 3.38Å; R578-A595 CarbonylContact C-O 3.52Å; R578-A595 WeakPolarHBondContact CA-O 3.46Å; Y579-A595 PolarHBondContact N-O 3.01Å; Y579-A595 PolarHBondContact O-N 3.03Å; S593-A595 PolarHBondContact O-N 2.91Å
596	Q	94.7	Very high	91	Very high	71 Å²	71	37.4 Å²	37.4	33%	0.332	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.8	173.2	-177.7	67.7	52.3	0	0	110.2	N498 T499 G577 V598	N498-Q596 CarbonylContact C-O 3.56Å; N498-Q596 WeakPolarHBondContact CA-O 3.36Å; N498-Q596 PolarHBondContact OD1-N 2.98Å; T499-Q596 PolarHBondContact N-O 2.84Å; G577-Q596 PolarHBondContact O-NE2 2.87Å; Q596-V598 HydrophobicContact CG-CG2 3.78Å
597	V	94.6	Very high	91.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134	163.8	178.2	0	0	0	0	108.9	T499 L509 L568 G577 Y579 V599	T499-V597 WeakPolarHBondContact O-CA 3.42Å; L509-V597 HydrophobicContact CD1-CG2 4.01Å; L509-V597 HydrophobicContact CD2-CG2 4.37Å; L568-V597 HydrophobicContact CD1-CG2 4.39Å; G577-V597 PolarHBondContact N-O 2.93Å; G577-V597 VanDerWaalsContact N-O 3.14Å; G577-V597 PolarHBondContact O-N 2.86Å; Y579-V597 HydrophobicContact CD2-CB 4.07Å; Y579-V597 HydrophobicContact CD2-CG2 3.54Å; Y579-V597 HydrophobicContact CE2-CB 3.88Å; Y579-V597 HydrophobicContact CE2-CG2 3.68Å; Y579-V597 HydrophobicContact CG-CG2 4.44Å; V597-V599 HydrophobicContact CG1-CG2 4.41Å
598	V	93.6	Very high	91.4	Very high	42 Å²	42	36.1 Å²	36.1	26%	0.255	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.2	175.1	-172.6	0	0	0	0	108.8	T499 V500 T501 E576 Q596	T499-V598 PolarHBondContact O-N 3.05Å; V500-V598 HydrophobicContact CG2-CB 4.43Å; T501-V598 PolarHBondContact N-O 3.07Å; E576-V598 WeakPolarHBondContact OE1-CG1 3.3Å; Q596-V598 HydrophobicContact CG-CG2 3.78Å
599	V	94.1	Very high	91.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	100.4	-175.1	-179.4	0	0	0	0	109.2	T501 L503 A571 T572 F573 E576 V597	T501-V599 HydrophobicContact CG2-CB 4.38Å; T501-V599 HydrophobicContact CG2-CG2 3.74Å; L503-V599 HydrophobicContact CB-CG1 4.11Å; L503-V599 HydrophobicContact CD1-CG1 3.9Å; A571-V599 HydrophobicContact CB-CG2 4.18Å; T572-V599 WeakPolarHBondContact O-CG2 3.13Å; F573-V599 HydrophobicContact CD1-CB 4.49Å; F573-V599 WeakPolarHBondContact CE1-O 3.33Å; E576-V599 HydrophobicContact CG-CB 3.73Å; E576-V599 HydrophobicContact CG-CG2 3.73Å; E576-V599 PolarHBondContact OE1-N 3.03Å; V597-V599 HydrophobicContact CG1-CG2 4.41Å
600	N	94	Very high	91.9	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.027	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	157.7	179.4	-68.4	-15.9	0	0	0	111	V500 T501 V502 L503 H629 T681 A682	V500-N600 WeakPolarHBondContact CG1-ND2 3.33Å; T501-N600 PolarHBondContact O-N 2.95Å; V502-N600 CarbonylContact C-O 3.58Å; V502-N600 WeakPolarHBondContact CA-O 3.43Å; L503-N600 PolarHBondContact N-O 3.06Å; N600-H629 CarbonylContact C-O 3.47Å; N600-H629 WeakPolarHBondContact CA-O 3.09Å; N600-H629 WeakPolarHBondContact CB-O 3.37Å; N600-T681 PolarHBondContact ND2-OG1 3Å; N600-A682 HydrophobicContact CB-CB 3.63Å
601	V	93.1	Very high	92.2	Very high	38 Å²	38	50.5 Å²	50.5	23%	0.23	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.7	170.8	177.8	0	0	0	0	108.2	L503 F573 H629 N680	L503-V601 HydrophobicContact CB-CG2 4.16Å; L503-V601 HydrophobicContact CD2-CG2 4.05Å; F573-V601 HydrophobicContact CE1-CG2 4.45Å; F573-V601 HydrophobicContact CE2-CG2 4.36Å; F573-V601 HydrophobicContact CZ-CG2 3.62Å; V601-H629 HydrophobicContact CB-CB 3.99Å; V601-H629 HydrophobicContact CG2-CB 4.13Å; V601-H629 PolarHBondContact N-O 3.17Å; V601-H629 PolarHBondContact O-N 3.47Å; V601-H629 VanDerWaalsContact O-N 3.14Å; V601-N680 PolarHBondContact O-ND2 2.67Å
602	L	90.8	Very high	92.2	Very high	79 Å²	79	49.6 Å²	49.6	41%	0.414	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	141.9	177.8	-167.4	138.4	0	0	0	110	V502 S604 A682 V685	V502-L602 HydrophobicContact CG1-CB 4.04Å; L602-S604 PolarHBondContact O-N 2.86Å; L602-A682 HydrophobicContact CB-CB 4.15Å; L602-V685 HydrophobicContact CD2-CG1 4Å
603	P	93.4	Very high	92.3	Very high	4 Å²	4	53.3 Å²	53.3	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	133.9	-169.8	-20.5	33.2	0	0	0	113	E627 P632 A678 N680 V685	P603-E627 CarbonylContact C-O 3.21Å; P603-E627 WeakPolarHBondContact CA-O 3.31Å; P603-P632 HydrophobicContact CB-CB 3.88Å; P603-P632 HydrophobicContact CB-CG 4.23Å; P603-P632 HydrophobicContact CG-CB 3.95Å; P603-A678 HydrophobicContact CB-CB 4.27Å; P603-N680 WeakPolarHBondContact CD-OD1 3.36Å; P603-N680 HydrophobicContact CG-CB 4.26Å; P603-V685 HydrophobicContact CB-CG2 4.13Å; P603-V685 WeakPolarHBondContact O-CG1 3.45Å; P603-V685 WeakPolarHBondContact O-CG2 3.25Å
604	S	93.4	Very high	92.4	Very high	45 Å²	45	52.3 Å²	52.3	32%	0.315	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.2	173.6	35.5	0	0	0	0	110.7	L602 L606 A626 E627	L602-S604 PolarHBondContact O-N 2.86Å; S604-L606 PolarHBondContact O-N 3.02Å; S604-A626 CarbonylContact O-C 3.34Å; S604-A626 WeakPolarHBondContact O-CA 3.47Å; S604-A626 WeakPolarHBondContact O-CB 3.31Å; S604-E627 PolarHBondContact N-O 2.81Å; S604-E627 PolarHBondContact O-N 2.92Å; S604-E627 WeakPolarHBondContact OG-CG 3.17Å; S604-E627 PolarHBondContact OG-OE1 2.87Å
605	F	92.5	Very high	92.4	Very high	55 Å²	55	55.3 Å²	55.3	24%	0.241	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.2	178	-72.7	-62.6	0	0	0	111.5	T608 C624 A625 A626 A678 V685 A687	F605-T608 HydrophobicContact CB-CG2 3.67Å; F605-T608 HydrophobicContact CD1-CG2 4.25Å; F605-T608 HydrophobicContact CD2-CG2 3.74Å; F605-T608 HydrophobicContact CE2-CG2 4.42Å; F605-T608 HydrophobicContact CG-CG2 3.65Å; F605-C624 VanDerWaalsContact CE1-SG 3.51Å; F605-A625 CarbonylContact C-O 3.47Å; F605-A625 WeakPolarHBondContact CA-O 3.12Å; F605-A626 HydrophobicContact CD1-CB 4.12Å; F605-A678 HydrophobicContact CE1-CB 3.9Å; F605-A678 HydrophobicContact CZ-CB 4.4Å; F605-V685 HydrophobicContact CD2-CB 4.45Å; F605-V685 HydrophobicContact CD2-CG2 3.93Å; F605-V685 HydrophobicContact CE1-CG2 4.21Å; F605-V685 HydrophobicContact CE2-CB 3.86Å; F605-V685 HydrophobicContact CE2-CG2 3.53Å; F605-V685 HydrophobicContact CG-CG2 4.44Å; F605-V685 HydrophobicContact CZ-CB 4.3Å; F605-V685 HydrophobicContact CZ-CG2 3.69Å; F605-A687 HydrophobicContact CD2-CB 4.26Å; F605-A687 HydrophobicContact CE2-CB 3.67Å; F605-A687 HydrophobicContact CZ-CB 3.84Å
606	L	89.7	Confident	92.2	Very high	110 Å²	110	57.5 Å²	57.5	58%	0.576	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	-36.1	165.1	-64.4	175.9	0	0	0	111.1	S604 A625 E627	S604-L606 PolarHBondContact O-N 3.02Å; L606-A625 HydrophobicContact CB-CB 4.01Å; L606-A625 PolarHBondContact N-O 3.14Å; L606-E627 HydrophobicContact CD1-CB 4.14Å; L606-E627 HydrophobicContact CD2-CB 4.41Å; L606-E627 HydrophobicContact CD2-CG 4.25Å; L606-E627 HydrophobicContact CG-CB 4.19Å; L606-E627 HydrophobicContact CG-CG 4.35Å
607	K	88.8	Confident	91.9	Very high	67 Å²	67	56.1 Å²	56.1	29%	0.291	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.6	173.7	-54.9	173.3	-168	167.7	0	108.7	E623 C624 A625 D658	K607-E623 HydrophobicContact CB-CB 4.25Å; K607-E623 HydrophobicContact CD-CB 4.02Å; K607-C624 WeakPolarHBondContact O-CA 3.43Å; K607-A625 HydrophobicContact CB-CB 3.84Å; K607-A625 HydrophobicContact CD-CB 3.88Å; K607-A625 HydrophobicContact CG-CB 3.81Å; K607-A625 PolarHBondContact N-O 2.93Å; K607-A625 PolarHBondContact O-N 3.39Å; K607-D658 PolarHBondContact NZ-O 2.72Å
608	T	91.8	Very high	91.6	Very high	59 Å²	59	61.2 Å²	61.2	36%	0.362	32%	0.318	S	S	.	.			trans	-110.6	152.8	168	51.7	0	0	0	0	110.4	F605 E623 A687	F605-T608 HydrophobicContact CB-CG2 3.67Å; F605-T608 HydrophobicContact CD1-CG2 4.25Å; F605-T608 HydrophobicContact CD2-CG2 3.74Å; F605-T608 HydrophobicContact CE2-CG2 4.42Å; F605-T608 HydrophobicContact CG-CG2 3.65Å; T608-E623 CarbonylContact C-O 3.56Å; T608-A687 HydrophobicContact CG2-CB 3.66Å
609	P	91.3	Very high	91.4	Very high	8 Å²	8	62.9 Å²	62.9	5%	0.052	33%	0.328	C	S	.	.			trans	-64	156.7	172.2	28.7	-35.8	0	0	0	110.4	L622 E623 W636 C676 A687 A689	P609-L622 HydrophobicContact CB-CD2 4.47Å; P609-E623 VanDerWaalsContact CA-O 3.24Å; P609-E623 WeakPolarHBondContact CA-O 3.36Å; P609-E623 WeakPolarHBondContact CD-O 3.42Å; P609-W636 HydrophobicContact CB-CH2 3.92Å; P609-W636 HydrophobicContact CB-CZ3 3.99Å; P609-W636 HydrophobicContact CG-CH2 4.26Å; P609-W636 HydrophobicContact CG-CZ3 4.13Å; P609-C676 HydrophobicContact CG-CB 4.2Å; P609-A687 HydrophobicContact CG-CB 4.46Å; P609-A689 HydrophobicContact CB-CB 3.69Å; P609-A689 HydrophobicContact CG-CB 4.16Å
610	R	91.4	Very high	91.1	Very high	200 Å²	200	62.9 Å²	62.9	76%	0.755	33%	0.329	S	S	*	.			trans	-132.2	146.2	-177.6	-60	-175.9	-176.7	-172.5	1.1	110.4	S612 A689	R610-S612 PolarHBondContact O-N 3.36Å; R610-A689 VanDerWaalsContact C-CB 3.42Å
611	D	94.3	Very high	90.8	Very high	123 Å²	123	67.7 Å²	67.7	66%	0.658	35%	0.346	S	S	*	.			trans	-53.1	134.1	174.4	-64.9	-33.4	0	0	0	110.2	T690	D611-T690 WeakPolarHBondContact CA-O 3.27Å; D611-T690 WeakPolarHBondContact OD1-CB 3.35Å; D611-T690 PolarHBondContact OD1-N 3.48Å; D611-T690 PolarHBondContact OD1-OG1 3.44Å
612	S	89.9	Confident	90.6	Very high	21 Å²	21	66 Å²	66	15%	0.147	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.3	-174.3	56.6	0	0	0	0	111.2	R610 T690 L691 I692	R610-S612 PolarHBondContact O-N 3.36Å; S612-T690 PolarHBondContact N-O 3.31Å; S612-L691 WeakPolarHBondContact OG-CD1 3.47Å; S612-I692 PolarHBondContact O-N 3.44Å
613	T	92.6	Very high	90.4	Very high	85 Å²	85	65.1 Å²	65.1	52%	0.521	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	108.9	-179.8	-58.7	0	0	0	0	108.4	I692 L694	T613-I692 CarbonylContact C-O 3.5Å; T613-I692 WeakPolarHBondContact CA-O 3.39Å; T613-I692 HydrophobicContact CG2-CB 4.28Å; T613-I692 HydrophobicContact CG2-CG2 4.19Å; T613-L694 HydrophobicContact CG2-CD1 3.45Å; T613-L694 VanDerWaalsContact CG2-CD1 3.45Å; T613-L694 HydrophobicContact CG2-CD2 4.18Å; T613-L694 HydrophobicContact CG2-CG 3.6Å
614	I	91.6	Very high	90.1	Very high	34 Å²	34	65 Å²	65	17%	0.174	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.5	-165.9	-56	-63.1	0	0	0	109.2	H618 A620 V666 L691 I692 V693 L694	I614-H618 HydrophobicContact CG2-CB 3.92Å; I614-A620 HydrophobicContact CG1-CB 3.97Å; I614-V666 HydrophobicContact CG2-CB 4.27Å; I614-V666 HydrophobicContact CG2-CG1 4.45Å; I614-V666 HydrophobicContact CG2-CG2 4.16Å; I614-L691 HydrophobicContact CB-CD1 4.31Å; I614-L691 HydrophobicContact CG1-CD1 3.81Å; I614-I692 PolarHBondContact N-O 2.99Å; I614-V693 CarbonylContact O-C 3.38Å; I614-V693 WeakPolarHBondContact O-CA 3.5Å; I614-L694 PolarHBondContact O-N 3.22Å
615	R	90.8	Very high	89.8	Confident	116 Å²	116	63 Å²	63	44%	0.438	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	146.4	174.5	-67.1	-175.6	-178.4	-138.5	-1.3	110.6	G617 H618 L694 L773	R615-G617 PolarHBondContact O-N 3.29Å; R615-H618 VanDerWaalsContact O-CB 3.29Å; R615-H618 WeakPolarHBondContact O-CB 3.33Å; R615-H618 PolarHBondContact O-N 2.66Å; R615-H618 VanDerWaalsContact O-N 3.1Å; R615-H618 PolarHBondContact O-ND1 3.04Å; R615-L694 CarbonylContact C-O 3.5Å; R615-L694 VanDerWaalsContact CA-O 3.24Å; R615-L694 WeakPolarHBondContact CA-O 3.42Å; R615-L773 HydrophobicContact CG-CD1 4.48Å
616	T	90.8	Very high	89.7	Confident	46 Å²	46	61 Å²	61	28%	0.282	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	141.1	172.5	-53.8	0	0	0	0	110.9	H618 V666 L694 E695	T616-H618 PolarHBondContact O-N 2.69Å; T616-H618 PolarHBondContact O-ND1 3.15Å; T616-V666 CarbonylContact C-O 3.5Å; T616-V666 VanDerWaalsContact CA-O 3.29Å; T616-V666 WeakPolarHBondContact CA-O 3.45Å; T616-L694 PolarHBondContact N-O 3.27Å; T616-L694 PolarHBondContact OG1-O 3.43Å; T616-E695 WeakPolarHBondContact OG1-CB 3.29Å
617	G	86.8	Confident	89.8	Confident	41 Å²	41	60.6 Å²	60.6	42%	0.423	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-4.5	-178.4	0	0	0	0	0	115.8	R615 D665 V666	R615-G617 PolarHBondContact O-N 3.29Å; G617-D665 WeakPolarHBondContact CA-OD1 3.39Å; G617-V666 PolarHBondContact N-O 3.32Å
618	H	89.3	Confident	89.9	Confident	108 Å²	108	58.5 Å²	58.5	50%	0.5	30%	0.302	S	S	.	.	S	Bend	trans	-92.8	175.4	175	-62.1	54.5	0	0	0	110.9	I614 R615 T616 D665 V666	I614-H618 HydrophobicContact CG2-CB 3.92Å; R615-H618 VanDerWaalsContact O-CB 3.29Å; R615-H618 WeakPolarHBondContact O-CB 3.33Å; R615-H618 PolarHBondContact O-N 2.66Å; R615-H618 VanDerWaalsContact O-N 3.1Å; R615-H618 PolarHBondContact O-ND1 3.04Å; T616-H618 PolarHBondContact O-N 2.69Å; T616-H618 PolarHBondContact O-ND1 3.15Å; H618-D665 PolarHBondContact O-N 3.32Å; H618-V666 WeakPolarHBondContact O-CB 3.5Å; H618-V666 WeakPolarHBondContact O-CG2 3.27Å; H618-V666 PolarHBondContact O-N 3.11Å
619	T	88.9	Confident	89.7	Confident	76 Å²	76	60 Å²	60	47%	0.466	30%	0.304	S	S	.	.			trans	-98.6	127.4	179.5	-55.7	0	0	0	0	111.5	F662 I663 T664	T619-F662 HydrophobicContact CG2-CB 4.17Å; T619-F662 HydrophobicContact CG2-CD1 4.09Å; T619-I663 CarbonylContact C-O 3.47Å; T619-I663 WeakPolarHBondContact CA-O 3.4Å; T619-I663 WeakPolarHBondContact CG2-O 3.27Å; T619-T664 HydrophobicContact CG2-CG2 4.22Å
620	A	88.5	Confident	89.8	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	145.4	165.6	0	0	0	0	0	110.6	I614 F662 I663 V666 L691	I614-A620 HydrophobicContact CG1-CB 3.97Å; A620-F662 VanDerWaalsContact O-CA 3.24Å; A620-F662 WeakPolarHBondContact O-CA 3.22Å; A620-I663 HydrophobicContact CB-CB 4.29Å; A620-I663 PolarHBondContact N-O 3.16Å; A620-I663 PolarHBondContact O-N 3.3Å; A620-V666 HydrophobicContact CB-CG2 3.78Å; A620-L691 HydrophobicContact CB-CD1 3.98Å; A620-L691 HydrophobicContact CB-CD2 4.27Å
621	R	88.1	Confident	89.6	Confident	105 Å²	105	56.7 Å²	56.7	40%	0.396	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.2	174.4	179.3	177.6	169.5	111.4	-12.7	109.1	E623 V660 F662	R621-E623 HydrophobicContact CG-CG 4.35Å; R621-E623 IonicContact CZ-OE1 2.93Å; R621-E623 IonicContact NE-OE1 2.65Å; R621-E623 PolarHBondContact NE-OE1 2.78Å; R621-E623 IonicContact NH2-OE1 2.75Å; R621-E623 PolarHBondContact NH2-OE1 2.78Å; R621-V660 HydrophobicContact CG-CG1 3.58Å; R621-F662 HydrophobicContact CB-CD1 3.9Å; R621-F662 HydrophobicContact CB-CE1 4.1Å; R621-F662 HydrophobicContact CG-CD1 3.99Å; R621-F662 HydrophobicContact CG-CE1 3.81Å; R621-F662 HydrophobicContact CG-CZ 4.5Å
622	L	87.6	Confident	89.4	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119	174.7	-64.6	175.1	0	0	0	108.3	P609 W636 F661 Y674	P609-L622 HydrophobicContact CB-CD2 4.47Å; L622-W636 HydrophobicContact CB-CH2 3.71Å; L622-W636 HydrophobicContact CB-CZ2 4.43Å; L622-W636 HydrophobicContact CB-CZ3 4.12Å; L622-W636 HydrophobicContact CD1-CZ3 4.32Å; L622-F661 HydrophobicContact CB-CD1 4.18Å; L622-F661 HydrophobicContact CD1-CD1 4.08Å; L622-F661 HydrophobicContact CD1-CE1 4.09Å; L622-F661 PolarHBondContact N-O 2.99Å; L622-F661 PolarHBondContact O-N 3.06Å; L622-F661 VanDerWaalsContact O-O 3.09Å; L622-Y674 HydrophobicContact CD1-CD1 3.59Å; L622-Y674 HydrophobicContact CD1-CD2 4.18Å; L622-Y674 HydrophobicContact CD1-CE1 4.2Å; L622-Y674 HydrophobicContact CD1-CG 3.58Å
623	E	86	Confident	89.5	Confident	59 Å²	59	58.2 Å²	58.2	28%	0.276	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.3	179.7	-46.1	-166.7	146	0	0	109.5	K607 T608 P609 R621 V660	K607-E623 HydrophobicContact CB-CB 4.25Å; K607-E623 HydrophobicContact CD-CB 4.02Å; T608-E623 CarbonylContact C-O 3.56Å; P609-E623 VanDerWaalsContact CA-O 3.24Å; P609-E623 WeakPolarHBondContact CA-O 3.36Å; P609-E623 WeakPolarHBondContact CD-O 3.42Å; R621-E623 HydrophobicContact CG-CG 4.35Å; R621-E623 IonicContact CZ-OE1 2.93Å; R621-E623 IonicContact NE-OE1 2.65Å; R621-E623 PolarHBondContact NE-OE1 2.78Å; R621-E623 IonicContact NH2-OE1 2.75Å; R621-E623 PolarHBondContact NH2-OE1 2.78Å; E623-V660 HydrophobicContact CB-CG2 4.23Å; E623-V660 HydrophobicContact CG-CG1 4.47Å; E623-V660 HydrophobicContact CG-CG2 3.96Å
624	C	88.2	Confident	89.3	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	31%	0.307	C	S	.	.			trans	-154.7	103.5	168.5	-171.1	0	0	0	0	111.1	F605 K607 W636 D659 C676	F605-C624 VanDerWaalsContact CE1-SG 3.51Å; K607-C624 WeakPolarHBondContact O-CA 3.43Å; C624-W636 HydrophobicContact CB-CH2 3.61Å; C624-W636 HydrophobicContact CB-CZ2 3.31Å; C624-D659 PolarHBondContact N-O 2.95Å; C624-D659 WeakPolarHBondContact O-CB 3.48Å; C624-C676 HydrophobicContact CB-CB 3.64Å; C624-C676 WeakPolarHBondContact CB-SG 3.33Å; C624-C676 WeakPolarHBondContact SG-CB 3.18Å; C624-C676 CovalentContact SG-SG 2.01Å; C624-C676 PolarHBondContact SG-SG 2.96Å
625	A	87.4	Confident	89.1	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.033	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.8	-176.6	0	0	0	0	0	109.5	F605 L606 K607 D659	F605-A625 CarbonylContact C-O 3.47Å; F605-A625 WeakPolarHBondContact CA-O 3.12Å; L606-A625 HydrophobicContact CB-CB 4.01Å; L606-A625 PolarHBondContact N-O 3.14Å; K607-A625 HydrophobicContact CB-CB 3.84Å; K607-A625 HydrophobicContact CD-CB 3.88Å; K607-A625 HydrophobicContact CG-CB 3.81Å; K607-A625 PolarHBondContact N-O 2.93Å; K607-A625 PolarHBondContact O-N 3.39Å; A625-D659 VanDerWaalsContact CA-OD2 3.28Å; A625-D659 WeakPolarHBondContact CA-OD2 3.11Å; A625-D659 HydrophobicContact CB-CB 3.43Å; A625-D659 VanDerWaalsContact CB-CB 3.43Å; A625-D659 VanDerWaalsContact CB-OD2 3.22Å; A625-D659 WeakPolarHBondContact CB-OD2 3.25Å
626	A	89.8	Confident	89.1	Confident	12 Å²	12	54 Å²	54	10%	0.099	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	139.4	177	0	0	0	0	0	112	S604 F605 P632 I634 A678	S604-A626 CarbonylContact O-C 3.34Å; S604-A626 WeakPolarHBondContact O-CA 3.47Å; S604-A626 WeakPolarHBondContact O-CB 3.31Å; F605-A626 HydrophobicContact CD1-CB 4.12Å; A626-P632 HydrophobicContact CB-CG 3.76Å; A626-P632 WeakPolarHBondContact O-CG 3.22Å; A626-I634 HydrophobicContact CB-CD1 3.96Å; A626-A678 HydrophobicContact CB-CB 3.49Å; A626-A678 VanDerWaalsContact CB-CB 3.49Å
627	E	91.6	Very high	89.1	Confident	102 Å²	102	55.5 Å²	55.5	48%	0.477	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	166	169.2	69.5	-169.9	165.5	0	0	110.2	P603 S604 L606	P603-E627 CarbonylContact C-O 3.21Å; P603-E627 WeakPolarHBondContact CA-O 3.31Å; S604-E627 PolarHBondContact N-O 2.81Å; S604-E627 PolarHBondContact O-N 2.92Å; S604-E627 WeakPolarHBondContact OG-CG 3.17Å; S604-E627 PolarHBondContact OG-OE1 2.87Å; L606-E627 HydrophobicContact CD1-CB 4.14Å; L606-E627 HydrophobicContact CD2-CB 4.41Å; L606-E627 HydrophobicContact CD2-CG 4.25Å; L606-E627 HydrophobicContact CG-CB 4.19Å; L606-E627 HydrophobicContact CG-CG 4.35Å
628	G	90.4	Very high	89.4	Confident	24 Å²	24	54.5 Å²	54.5	25%	0.247	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.2	169	178.6	0	0	0	0	0	111.4	P630	G628-P630 CarbonylContact C-O 3.55Å; G628-P630 VanDerWaalsContact C-O 3.28Å; G628-P630 CarbonylContact O-C 3.52Å
629	H	88.3	Confident	89.5	Confident	89 Å²	89	54 Å²	54	41%	0.412	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.1	177.5	-166.3	-104	0	0	0	110.7	N600 V601	N600-H629 CarbonylContact C-O 3.47Å; N600-H629 WeakPolarHBondContact CA-O 3.09Å; N600-H629 WeakPolarHBondContact CB-O 3.37Å; V601-H629 HydrophobicContact CB-CB 3.99Å; V601-H629 HydrophobicContact CG2-CB 4.13Å; V601-H629 PolarHBondContact N-O 3.17Å; V601-H629 PolarHBondContact O-N 3.47Å; V601-H629 VanDerWaalsContact O-N 3.14Å
630	P	92.5	Very high	89.3	Confident	57 Å²	57	53.2 Å²	53.2	37%	0.37	30%	0.302	S	S	.	.	S	Bend	cis	-57.1	162	-9.2	-21.6	34.2	0	0	0	112.6	G628 N680 T681	G628-P630 CarbonylContact C-O 3.55Å; G628-P630 VanDerWaalsContact C-O 3.28Å; G628-P630 CarbonylContact O-C 3.52Å; P630-N680 WeakPolarHBondContact O-CB 3.34Å; P630-N680 PolarHBondContact O-ND2 2.68Å; P630-T681 WeakPolarHBondContact CD-OG1 3.41Å
631	A	88.5	Confident	89.3	Confident	83 Å²	83	54.7 Å²	54.7	69%	0.686	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-54.1	132.3	179.7	0	0	0	0	0	111.2
632	P	90.7	Very high	89.2	Confident	20 Å²	20	55.1 Å²	55.1	13%	0.13	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-74.9	145.1	-175.7	30.8	-35.2	0	0	0	112.4	P603 A626 A678 K679 N680	P603-P632 HydrophobicContact CB-CB 3.88Å; P603-P632 HydrophobicContact CB-CG 4.23Å; P603-P632 HydrophobicContact CG-CB 3.95Å; A626-P632 HydrophobicContact CB-CG 3.76Å; A626-P632 WeakPolarHBondContact O-CG 3.22Å; P632-A678 HydrophobicContact CB-CB 4.27Å; P632-K679 CarbonylContact C-O 3.54Å; P632-K679 WeakPolarHBondContact CA-O 3.5Å; P632-N680 HydrophobicContact CB-CB 4.5Å
633	Q	90.6	Very high	89.1	Confident	156 Å²	156	60.2 Å²	60.2	73%	0.729	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	129.2	168.5	-65.7	179.3	-10.7	0	0	109.2	A678 K679	Q633-A678 WeakPolarHBondContact O-CA 3.32Å; Q633-K679 PolarHBondContact N-O 2.82Å; Q633-K679 PolarHBondContact O-N 3.23Å
634	I	88	Confident	89.2	Confident	52 Å²	52	58.4 Å²	58.4	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	129.6	175.4	-56.9	-58	0	0	0	109.7	A626 A678	A626-I634 HydrophobicContact CB-CD1 3.96Å; I634-A678 HydrophobicContact CD1-CB 3.66Å
635	A	89	Confident	89.2	Confident	56 Å²	56	59.1 Å²	59.1	46%	0.463	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.7	173.3	0	0	0	0	0	110.6	C676 T677	A635-C676 CarbonylContact O-C 3.58Å; A635-T677 PolarHBondContact N-O 2.98Å; A635-T677 PolarHBondContact O-N 2.81Å
636	W	89.4	Confident	89	Confident	39 Å²	39	59 Å²	59	15%	0.148	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148	179.1	-68.4	89.4	0	0	0	111.7	P609 L622 C624 F644 F661 S675 C676	P609-W636 HydrophobicContact CB-CH2 3.92Å; P609-W636 HydrophobicContact CB-CZ3 3.99Å; P609-W636 HydrophobicContact CG-CH2 4.26Å; P609-W636 HydrophobicContact CG-CZ3 4.13Å; L622-W636 HydrophobicContact CB-CH2 3.71Å; L622-W636 HydrophobicContact CB-CZ2 4.43Å; L622-W636 HydrophobicContact CB-CZ3 4.12Å; L622-W636 HydrophobicContact CD1-CZ3 4.32Å; C624-W636 HydrophobicContact CB-CH2 3.61Å; C624-W636 HydrophobicContact CB-CZ2 3.31Å; W636-F644 HydrophobicContact CB-CZ 4Å; W636-F661 HydrophobicContact CZ2-CB 4.17Å; W636-S675 CarbonylContact C-O 3.59Å; W636-S675 WeakPolarHBondContact CA-O 3.36Å; W636-C676 HydrophobicContact CD2-CB 4.18Å; W636-C676 HydrophobicContact CE3-CB 3.88Å; W636-C676 HydrophobicContact CH2-CB 4.03Å; W636-C676 HydrophobicContact CZ2-CB 4.31Å; W636-C676 HydrophobicContact CZ3-CB 3.8Å
637	Q	91.9	Very high	88.7	Confident	76 Å²	76	60.4 Å²	60.4	36%	0.355	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.6	171	-70.2	177	-27.6	0	0	109.9	G641 T642 Y674 S675	Q637-G641 CarbonylContact C-O 3.49Å; Q637-G641 WeakPolarHBondContact CA-O 3.36Å; Q637-G641 VanDerWaalsContact CB-O 3.25Å; Q637-G641 WeakPolarHBondContact CB-O 3.2Å; Q637-T642 HydrophobicContact CG-CG2 4.43Å; Q637-Y674 WeakPolarHBondContact O-CA 3.44Å; Q637-S675 PolarHBondContact N-O 2.81Å; Q637-S675 PolarHBondContact O-N 3.21Å
638	K	91.9	Very high	88.3	Confident	20 Å²	20	63.3 Å²	63.3	9%	0.087	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.7	170.9	-177.1	-176.7	-172.2	-69.4	0	109	G640 G641 F644 D670 M671 V673 Y674	K638-G640 PolarHBondContact O-N 3.03Å; K638-G640 VanDerWaalsContact O-N 3.09Å; K638-G641 PolarHBondContact N-O 3.31Å; K638-G641 WeakPolarHBondContact O-CA 3.3Å; K638-G641 PolarHBondContact O-N 3Å; K638-F644 HydrophobicContact CB-CD1 3.86Å; K638-F644 HydrophobicContact CB-CE1 3.65Å; K638-F644 HydrophobicContact CB-CZ 4.25Å; K638-F644 HydrophobicContact CD-CD1 4.45Å; K638-D670 WeakPolarHBondContact CE-O 3.38Å; K638-M671 WeakPolarHBondContact CE-O 3.34Å; K638-M671 PolarHBondContact NZ-O 2.85Å; K638-V673 CarbonylContact C-O 3.25Å; K638-V673 WeakPolarHBondContact CA-O 3.35Å; K638-Y674 HydrophobicContact CB-CE1 4.43Å; K638-Y674 HydrophobicContact CD-CE1 4.42Å; K638-Y674 HydrophobicContact CD-CE2 4.2Å; K638-Y674 WeakPolarHBondContact CE-OH 3.36Å; K638-Y674 HydrophobicContact CG-CE1 4.45Å; K638-Y674 HydrophobicContact CG-CE2 4.17Å
639	D	92.1	Very high	88.1	Confident	99 Å²	99	65.9 Å²	65.9	53%	0.529	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	33	179.3	-55.3	-50.5	0	0	0	113.5	G641 G672 V673	D639-G641 VanDerWaalsContact C-N 3.3Å; D639-G641 PolarHBondContact O-N 2.9Å; D639-G672 WeakPolarHBondContact OD1-CA 3.46Å; D639-V673 PolarHBondContact N-O 3.19Å; D639-V673 PolarHBondContact OD1-N 2.86Å
640	G	85.4	Confident	87.9	Confident	58 Å²	58	71.7 Å²	71.7	60%	0.598	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-5	-176.4	0	0	0	0	0	115.6	K638	K638-G640 PolarHBondContact O-N 3.03Å; K638-G640 VanDerWaalsContact O-N 3.09Å
641	G	88	Confident	87.7	Confident	32 Å²	32	69.7 Å²	69.7	33%	0.33	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-107	-179.8	176.8	0	0	0	0	0	113.9	Q637 K638 D639	Q637-G641 CarbonylContact C-O 3.49Å; Q637-G641 WeakPolarHBondContact CA-O 3.36Å; Q637-G641 VanDerWaalsContact CB-O 3.25Å; Q637-G641 WeakPolarHBondContact CB-O 3.2Å; K638-G641 PolarHBondContact N-O 3.31Å; K638-G641 WeakPolarHBondContact O-CA 3.3Å; K638-G641 PolarHBondContact O-N 3Å; D639-G641 VanDerWaalsContact C-N 3.3Å; D639-G641 PolarHBondContact O-N 2.9Å
642	T	85.2	Confident	87.5	Confident	115 Å²	115	68.1 Å²	68.1	71%	0.706	36%	0.36	S	S	*	.	S	Bend	trans	-111.3	14.4	174.9	61.3	0	0	0	0	112.9	Q637 F644	Q637-T642 HydrophobicContact CG-CG2 4.43Å; T642-F644 WeakPolarHBondContact O-CD2 3.37Å
643	D	85.6	Confident	86.9	Confident	111 Å²	111	72.2 Å²	72.2	59%	0.594	38%	0.377	S	S	*	.			trans	-88.6	135.4	171.7	-170.7	19.6	0	0	0	110.1
644	F	89.3	Confident	85.9	Confident	20 Å²	20	69.1 Å²	69.1	9%	0.088	37%	0.369	C	S	.	.			trans	-138.8	106.8	-175.3	-69.5	-88.1	0	0	0	107.7	W636 K638 T642 A646 A647 R648 M652 Y674	W636-F644 HydrophobicContact CB-CZ 4Å; K638-F644 HydrophobicContact CB-CD1 3.86Å; K638-F644 HydrophobicContact CB-CE1 3.65Å; K638-F644 HydrophobicContact CB-CZ 4.25Å; K638-F644 HydrophobicContact CD-CD1 4.45Å; T642-F644 WeakPolarHBondContact O-CD2 3.37Å; F644-A646 VanDerWaalsContact C-N 3.31Å; F644-A646 PolarHBondContact O-N 3.14Å; F644-A647 HydrophobicContact CB-CB 3.63Å; F644-A647 WeakPolarHBondContact O-CA 3.44Å; F644-A647 VanDerWaalsContact O-CB 3.29Å; F644-A647 WeakPolarHBondContact O-CB 3.33Å; F644-A647 PolarHBondContact O-N 3.43Å; F644-R648 PolarHBondContact O-N 3.01Å; F644-M652 HydrophobicContact CB-SD 4.42Å; F644-M652 HydrophobicContact CD1-CE 4.13Å; F644-M652 HydrophobicContact CD2-CE 4.46Å; F644-M652 HydrophobicContact CE1-CE 4.22Å; F644-M652 HydrophobicContact CG-CE 4.25Å; F644-M652 HydrophobicContact CG-SD 4.43Å; F644-M652 HydrophobicContact CZ-CE 4.42Å; F644-Y674 AromaticContact CD1-CE1 3.89Å; F644-Y674 HydrophobicContact CD1-CE1 3.89Å; F644-Y674 HydrophobicContact CE1-CD1 4Å; F644-Y674 AromaticContact CE1-CE1 3.72Å; F644-Y674 HydrophobicContact CE1-CE1 3.72Å
645	P	87.1	Confident	85	Confident	17 Å²	17	70.8 Å²	70.8	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-54.3	-46.4	-179.7	-28.4	36.1	0	0	0	112.6	A647 R648 E649 E669	P645-A647 PolarHBondContact O-N 2.82Å; P645-R648 PolarHBondContact O-N 2.87Å; P645-E649 PolarHBondContact O-N 3.19Å; P645-E649 VanDerWaalsContact O-N 3.16Å; P645-E669 HydrophobicContact CB-CB 4.39Å; P645-E669 HydrophobicContact CB-CG 3.99Å; P645-E669 HydrophobicContact CG-CB 4.43Å
646	A	84	Confident	83.7	Confident	2 Å²	2	73 Å²	73	2%	0.017	39%	0.387	C	S	.	.	H	α-helix	trans	-54.5	-30.3	171	0	0	0	0	0	115.2	F644 R650 R651 M652 I663 D670	F644-A646 VanDerWaalsContact C-N 3.31Å; F644-A646 PolarHBondContact O-N 3.14Å; A646-R650 PolarHBondContact O-N 3.14Å; A646-R650 VanDerWaalsContact O-N 3.11Å; A646-R651 HydrophobicContact CB-CB 4Å; A646-R651 WeakPolarHBondContact O-CA 3.33Å; A646-R651 PolarHBondContact O-N 3.14Å; A646-M652 HydrophobicContact CB-CB 4.38Å; A646-M652 PolarHBondContact O-N 3.34Å; A646-M652 VanDerWaalsContact O-N 3.1Å; A646-I663 HydrophobicContact CB-CG1 4.24Å; A646-I663 HydrophobicContact CB-CG2 3.75Å; A646-D670 WeakPolarHBondContact CB-OD1 3.39Å; A646-D670 PolarHBondContact N-OD1 3.38Å
647	A	82.7	Confident	82.2	Confident	41 Å²	41	78.9 Å²	78.9	34%	0.339	42%	0.421	S	S	.	.	H	α-helix	trans	-73.8	-45.8	178.6	0	0	0	0	0	111.5	F644 P645 E649 R650 M652	F644-A647 HydrophobicContact CB-CB 3.63Å; F644-A647 WeakPolarHBondContact O-CA 3.44Å; F644-A647 VanDerWaalsContact O-CB 3.29Å; F644-A647 WeakPolarHBondContact O-CB 3.33Å; F644-A647 PolarHBondContact O-N 3.43Å; P645-A647 PolarHBondContact O-N 2.82Å; A647-E649 PolarHBondContact O-N 3.15Å; A647-R650 PolarHBondContact O-N 2.9Å; A647-M652 HydrophobicContact CB-CB 4.06Å; A647-M652 HydrophobicContact CB-CG 4.35Å; A647-M652 HydrophobicContact CB-SD 3.53Å; A647-M652 VanDerWaalsContact CB-SD 3.53Å
648	R	84.6	Confident	80.6	Confident	163 Å²	163	78.4 Å²	78.4	62%	0.615	42%	0.421	S	S	*	.	H	α-helix	trans	-56.2	-36.4	174.3	-175.6	177.2	66	-146.4	-0.9	111.5	F644 P645	F644-R648 PolarHBondContact O-N 3.01Å; P645-R648 PolarHBondContact O-N 2.87Å
649	E	86	Confident	79.5	Confident	77 Å²	77	80.3 Å²	80.3	36%	0.36	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	2.8	178.5	-61.5	-167.3	131.3	0	0	114.9	P645 A647 R651 K667	P645-E649 PolarHBondContact O-N 3.19Å; P645-E649 VanDerWaalsContact O-N 3.16Å; A647-E649 PolarHBondContact O-N 3.15Å; E649-R651 HydrophobicContact CB-CG 4.21Å; E649-R651 PolarHBondContact O-N 2.94Å; E649-R651 IonicContact OE2-CZ 3.11Å; E649-R651 VanDerWaalsContact OE2-CZ 3.27Å; E649-R651 IonicContact OE2-NE 2.71Å; E649-R651 PolarHBondContact OE2-NE 2.9Å; E649-R651 IonicContact OE2-NH2 2.68Å; E649-R651 PolarHBondContact OE2-NH2 2.82Å; E649-K667 IonicContact OE1-NZ 2.71Å; E649-K667 PolarHBondContact OE1-NZ 3.08Å; E649-K667 WeakPolarHBondContact OE2-CE 3.37Å; E649-K667 IonicContact OE2-NZ 3.16Å; E649-K667 PolarHBondContact OE2-NZ 3.4Å
650	R	83.4	Confident	78.4	Confident	211 Å²	211	75.7 Å²	75.7	80%	0.796	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	23.5	-177.1	-51.1	-177.5	-179.1	-168.3	-0.5	115	A646 A647 M652 H653	A646-R650 PolarHBondContact O-N 3.14Å; A646-R650 VanDerWaalsContact O-N 3.11Å; A647-R650 PolarHBondContact O-N 2.9Å; R650-M652 VanDerWaalsContact C-N 3.29Å; R650-H653 PolarHBondContact O-CE1 3.42Å
651	R	88.4	Confident	78	Confident	15 Å²	15	73 Å²	73	6%	0.057	38%	0.379	C	S	.	.			trans	-81.8	-9.4	168.6	-68.3	-171	-60.7	100.7	0.7	112.7	A646 E649 H653 I663 T664 D665 E669 D670	A646-R651 HydrophobicContact CB-CB 4Å; A646-R651 WeakPolarHBondContact O-CA 3.33Å; A646-R651 PolarHBondContact O-N 3.14Å; E649-R651 HydrophobicContact CB-CG 4.21Å; E649-R651 PolarHBondContact O-N 2.94Å; E649-R651 IonicContact OE2-CZ 3.11Å; E649-R651 VanDerWaalsContact OE2-CZ 3.27Å; E649-R651 IonicContact OE2-NE 2.71Å; E649-R651 PolarHBondContact OE2-NE 2.9Å; E649-R651 IonicContact OE2-NH2 2.68Å; E649-R651 PolarHBondContact OE2-NH2 2.82Å; R651-H653 PolarHBondContact O-CD2 2.6Å; R651-H653 VanDerWaalsContact O-CD2 3.28Å; R651-H653 PolarHBondContact O-NE2 3.18Å; R651-I663 WeakPolarHBondContact O-CA 3.38Å; R651-T664 WeakPolarHBondContact CB-O 3.41Å; R651-T664 PolarHBondContact NH1-O 3.08Å; R651-T664 PolarHBondContact O-N 3.48Å; R651-T664 PolarHBondContact O-OG1 3.21Å; R651-D665 WeakPolarHBondContact CD-O 3.32Å; R651-D665 PolarHBondContact NH1-O 3.08Å; R651-E669 IonicContact NH2-OE1 2.61Å; R651-E669 PolarHBondContact NH2-OE1 3.08Å; R651-D670 IonicContact CZ-OD1 3.89Å; R651-D670 IonicContact CZ-OD2 3.56Å; R651-D670 IonicContact NH1-OD1 3.4Å; R651-D670 IonicContact NH1-OD2 3.8Å; R651-D670 PolarHBondContact NH1-OD2 3.13Å; R651-D670 IonicContact NH2-OD1 3.75Å; R651-D670 PolarHBondContact NH2-OD1 3.47Å; R651-D670 IonicContact NH2-OD2 2.86Å; R651-D670 PolarHBondContact NH2-OD2 2.9Å
652	M	84.1	Confident	77.8	Confident	50 Å²	50	73.5 Å²	73.5	25%	0.246	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118.2	178.4	-163.7	-171.8	-167.3	0	0	111.4	F644 A646 A647 R650 F661	F644-M652 HydrophobicContact CB-SD 4.42Å; F644-M652 HydrophobicContact CD1-CE 4.13Å; F644-M652 HydrophobicContact CD2-CE 4.46Å; F644-M652 HydrophobicContact CE1-CE 4.22Å; F644-M652 HydrophobicContact CG-CE 4.25Å; F644-M652 HydrophobicContact CG-SD 4.43Å; F644-M652 HydrophobicContact CZ-CE 4.42Å; A646-M652 HydrophobicContact CB-CB 4.38Å; A646-M652 PolarHBondContact O-N 3.34Å; A646-M652 VanDerWaalsContact O-N 3.1Å; A647-M652 HydrophobicContact CB-CB 4.06Å; A647-M652 HydrophobicContact CB-CG 4.35Å; A647-M652 HydrophobicContact CB-SD 3.53Å; A647-M652 VanDerWaalsContact CB-SD 3.53Å; R650-M652 VanDerWaalsContact C-N 3.29Å; M652-F661 HydrophobicContact CB-CE2 4.13Å; M652-F661 HydrophobicContact CE-CD1 4.48Å; M652-F661 HydrophobicContact CE-CD2 4.02Å; M652-F661 HydrophobicContact CE-CE1 4.03Å; M652-F661 HydrophobicContact CE-CE2 3.63Å; M652-F661 HydrophobicContact CE-CG 4.49Å; M652-F661 HydrophobicContact CE-CZ 3.59Å; M652-F661 HydrophobicContact CG-CD2 4.01Å; M652-F661 HydrophobicContact CG-CE2 3.09Å; M652-F661 HydrophobicContact CG-CZ 3.53Å; M652-F661 HydrophobicContact SD-CE2 4.22Å; M652-F661 HydrophobicContact SD-CZ 4.39Å
653	H	78.4	Confident	78	Confident	106 Å²	106	68.1 Å²	68.1	49%	0.491	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.1	178.7	-49.4	-79.7	0	0	0	111.5	R650 R651 F661 F662 T664	R650-H653 PolarHBondContact O-CE1 3.42Å; R651-H653 PolarHBondContact O-CD2 2.6Å; R651-H653 VanDerWaalsContact O-CD2 3.28Å; R651-H653 PolarHBondContact O-NE2 3.18Å; H653-F661 WeakPolarHBondContact O-CD2 3.44Å; H653-F662 PolarHBondContact N-O 3.45Å; H653-F662 PolarHBondContact O-N 3.16Å; H653-T664 VanDerWaalsContact NE2-CB 3.26Å; H653-T664 WeakPolarHBondContact NE2-CB 3.22Å; H653-T664 VanDerWaalsContact NE2-CG2 3.33Å; H653-T664 WeakPolarHBondContact NE2-CG2 3.17Å; H653-T664 PolarHBondContact NE2-OG1 3.46Å
654	V	70	Confident	78.1	Confident	92 Å²	92	65 Å²	65	56%	0.558	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	132	176	-180	0	0	0	0	108.9	F661	V654-F661 HydrophobicContact CG2-CB 4.48Å; V654-F661 HydrophobicContact CG2-CD2 3.91Å
655	M	68.9	Low	78	Confident	86 Å²	86	67.8 Å²	67.8	42%	0.424	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	107.9	169.2	-86.2	173.1	49.3	0	0	109.2	D657 D658 V660 F662	M655-D657 VanDerWaalsContact C-N 3.32Å; M655-D657 PolarHBondContact O-N 2.79Å; M655-D658 HydrophobicContact CB-CB 4.2Å; M655-D658 HydrophobicContact CE-CB 3.8Å; M655-D658 PolarHBondContact O-N 3.41Å; M655-V660 PolarHBondContact N-O 3.17Å; M655-F662 HydrophobicContact CG-CE2 4.41Å; M655-F662 HydrophobicContact SD-CE2 3.78Å; M655-F662 HydrophobicContact SD-CZ 4.35Å
656	P	60.3	Low	78.3	Confident	104 Å²	104	67 Å²	67	68%	0.675	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.3	-175.1	-23.8	35	0	0	0	114.2	D658	P656-D658 VanDerWaalsContact C-N 3.31Å; P656-D658 PolarHBondContact O-N 2.87Å
657	D	58.5	Low	78.6	Confident	161 Å²	161	69.7 Å²	69.7	86%	0.861	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13	-173	-49.1	-65	0	0	0	113.8	M655	M655-D657 VanDerWaalsContact C-N 3.32Å; M655-D657 PolarHBondContact O-N 2.79Å
658	D	59.2	Low	78.9	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.353	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-10.1	-167	-140.2	30.6	0	0	0	112.7	K607 M655 P656 V660	K607-D658 PolarHBondContact NZ-O 2.72Å; M655-D658 HydrophobicContact CB-CB 4.2Å; M655-D658 HydrophobicContact CE-CB 3.8Å; M655-D658 PolarHBondContact O-N 3.41Å; P656-D658 VanDerWaalsContact C-N 3.31Å; P656-D658 PolarHBondContact O-N 2.87Å; D658-V660 VanDerWaalsContact C-N 3.34Å; D658-V660 HydrophobicContact CB-CG2 4.38Å; D658-V660 WeakPolarHBondContact O-CG2 3.48Å
659	D	67.8	Low	79.2	Confident	60 Å²	60	66.8 Å²	66.8	32%	0.321	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	42.9	-171.2	-84.1	-28.8	0	0	0	113.1	C624 A625	C624-D659 PolarHBondContact N-O 2.95Å; C624-D659 WeakPolarHBondContact O-CB 3.48Å; A625-D659 VanDerWaalsContact CA-OD2 3.28Å; A625-D659 WeakPolarHBondContact CA-OD2 3.11Å; A625-D659 HydrophobicContact CB-CB 3.43Å; A625-D659 VanDerWaalsContact CB-CB 3.43Å; A625-D659 VanDerWaalsContact CB-OD2 3.22Å; A625-D659 WeakPolarHBondContact CB-OD2 3.25Å
660	V	69.5	Low	79.5	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.018	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.4	-176.8	-177.8	0	0	0	0	112.6	R621 E623 M655 D658 F662	R621-V660 HydrophobicContact CG-CG1 3.58Å; E623-V660 HydrophobicContact CB-CG2 4.23Å; E623-V660 HydrophobicContact CG-CG1 4.47Å; E623-V660 HydrophobicContact CG-CG2 3.96Å; M655-V660 PolarHBondContact N-O 3.17Å; D658-V660 VanDerWaalsContact C-N 3.34Å; D658-V660 HydrophobicContact CB-CG2 4.38Å; D658-V660 WeakPolarHBondContact O-CG2 3.48Å; V660-F662 HydrophobicContact CB-CE2 4.19Å; V660-F662 HydrophobicContact CG1-CD2 3.95Å; V660-F662 HydrophobicContact CG1-CE1 4.21Å; V660-F662 HydrophobicContact CG1-CE2 3.58Å; V660-F662 HydrophobicContact CG1-CG 4.43Å; V660-F662 HydrophobicContact CG1-CZ 3.76Å
661	F	76.1	Confident	79.9	Confident	2 Å²	2	57 Å²	57	1%	0.009	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.4	174.2	165.3	-123.8	0	0	0	110.4	L622 W636 M652 H653 V654 I663 Y674	L622-F661 HydrophobicContact CB-CD1 4.18Å; L622-F661 HydrophobicContact CD1-CD1 4.08Å; L622-F661 HydrophobicContact CD1-CE1 4.09Å; L622-F661 PolarHBondContact N-O 2.99Å; L622-F661 PolarHBondContact O-N 3.06Å; L622-F661 VanDerWaalsContact O-O 3.09Å; W636-F661 HydrophobicContact CZ2-CB 4.17Å; M652-F661 HydrophobicContact CB-CE2 4.13Å; M652-F661 HydrophobicContact CE-CD1 4.48Å; M652-F661 HydrophobicContact CE-CD2 4.02Å; M652-F661 HydrophobicContact CE-CE1 4.03Å; M652-F661 HydrophobicContact CE-CE2 3.63Å; M652-F661 HydrophobicContact CE-CG 4.49Å; M652-F661 HydrophobicContact CE-CZ 3.59Å; M652-F661 HydrophobicContact CG-CD2 4.01Å; M652-F661 HydrophobicContact CG-CE2 3.09Å; M652-F661 HydrophobicContact CG-CZ 3.53Å; M652-F661 HydrophobicContact SD-CE2 4.22Å; M652-F661 HydrophobicContact SD-CZ 4.39Å; H653-F661 WeakPolarHBondContact O-CD2 3.44Å; V654-F661 HydrophobicContact CG2-CB 4.48Å; V654-F661 HydrophobicContact CG2-CD2 3.91Å; F661-I663 HydrophobicContact CE1-CD1 4.29Å; F661-I663 HydrophobicContact CE1-CG1 4Å; F661-I663 HydrophobicContact CE2-CG1 4.17Å; F661-I663 HydrophobicContact CZ-CD1 4.04Å; F661-I663 HydrophobicContact CZ-CG1 3.38Å; F661-Y674 HydrophobicContact CE1-CD1 4.27Å; F661-Y674 HydrophobicContact CE1-CE1 4.03Å
662	F	83.9	Confident	80.1	Confident	42 Å²	42	56.8 Å²	56.8	18%	0.184	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.1	178.8	-55.4	-101.8	0	0	0	112.6	T619 A620 R621 H653 M655 V660	T619-F662 HydrophobicContact CG2-CB 4.17Å; T619-F662 HydrophobicContact CG2-CD1 4.09Å; A620-F662 VanDerWaalsContact O-CA 3.24Å; A620-F662 WeakPolarHBondContact O-CA 3.22Å; R621-F662 HydrophobicContact CB-CD1 3.9Å; R621-F662 HydrophobicContact CB-CE1 4.1Å; R621-F662 HydrophobicContact CG-CD1 3.99Å; R621-F662 HydrophobicContact CG-CE1 3.81Å; R621-F662 HydrophobicContact CG-CZ 4.5Å; H653-F662 PolarHBondContact N-O 3.45Å; H653-F662 PolarHBondContact O-N 3.16Å; M655-F662 HydrophobicContact CG-CE2 4.41Å; M655-F662 HydrophobicContact SD-CE2 3.78Å; M655-F662 HydrophobicContact SD-CZ 4.35Å; V660-F662 HydrophobicContact CB-CE2 4.19Å; V660-F662 HydrophobicContact CG1-CD2 3.95Å; V660-F662 HydrophobicContact CG1-CE1 4.21Å; V660-F662 HydrophobicContact CG1-CE2 3.58Å; V660-F662 HydrophobicContact CG1-CG 4.43Å; V660-F662 HydrophobicContact CG1-CZ 3.76Å
663	I	89.5	Confident	80.6	Confident	1 Å²	1	57 Å²	57	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114.1	164.2	-58.3	169.6	0	0	0	107.3	T619 A620 A646 R651 F661 V666 D670 Y674 L691	T619-I663 CarbonylContact C-O 3.47Å; T619-I663 WeakPolarHBondContact CA-O 3.4Å; T619-I663 WeakPolarHBondContact CG2-O 3.27Å; A620-I663 HydrophobicContact CB-CB 4.29Å; A620-I663 PolarHBondContact N-O 3.16Å; A620-I663 PolarHBondContact O-N 3.3Å; A646-I663 HydrophobicContact CB-CG1 4.24Å; A646-I663 HydrophobicContact CB-CG2 3.75Å; R651-I663 WeakPolarHBondContact O-CA 3.38Å; F661-I663 HydrophobicContact CE1-CD1 4.29Å; F661-I663 HydrophobicContact CE1-CG1 4Å; F661-I663 HydrophobicContact CE2-CG1 4.17Å; F661-I663 HydrophobicContact CZ-CD1 4.04Å; F661-I663 HydrophobicContact CZ-CG1 3.38Å; I663-V666 HydrophobicContact CB-CG2 3.92Å; I663-V666 HydrophobicContact CG2-CG2 3.66Å; I663-V666 WeakPolarHBondContact O-CG2 3.47Å; I663-D670 HydrophobicContact CD1-CB 4.29Å; I663-Y674 HydrophobicContact CD1-CE1 4.17Å; I663-Y674 WeakPolarHBondContact CD1-OH 3.37Å; I663-L691 HydrophobicContact CD1-CD2 3.8Å
664	T	87.8	Confident	81.3	Confident	45 Å²	45	52 Å²	52	28%	0.276	29%	0.285	S	S	.	.	S	Bend	trans	-83.4	153.4	168.8	51.3	0	0	0	0	110.6	T619 R651 H653 V666	T619-T664 HydrophobicContact CG2-CG2 4.22Å; R651-T664 WeakPolarHBondContact CB-O 3.41Å; R651-T664 PolarHBondContact NH1-O 3.08Å; R651-T664 PolarHBondContact O-N 3.48Å; R651-T664 PolarHBondContact O-OG1 3.21Å; H653-T664 VanDerWaalsContact NE2-CB 3.26Å; H653-T664 WeakPolarHBondContact NE2-CB 3.22Å; H653-T664 VanDerWaalsContact NE2-CG2 3.33Å; H653-T664 WeakPolarHBondContact NE2-CG2 3.17Å; H653-T664 PolarHBondContact NE2-OG1 3.46Å; T664-V666 PolarHBondContact O-N 2.93Å
665	D	88.2	Confident	82.4	Confident	80 Å²	80	48.3 Å²	48.3	43%	0.428	26%	0.264	S	S	.	.	S	Bend	trans	50.6	57.1	177.9	-178.8	47	0	0	0	111.5	G617 H618 R651 K667	G617-D665 WeakPolarHBondContact CA-OD1 3.39Å; H618-D665 PolarHBondContact O-N 3.32Å; R651-D665 WeakPolarHBondContact CD-O 3.32Å; R651-D665 PolarHBondContact NH1-O 3.08Å; D665-K667 PolarHBondContact O-N 3.49Å
666	V	92.3	Very high	83.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.244	C	C	.	.			trans	-61.4	132.9	-176	171.4	0	0	0	0	110.6	I614 T616 G617 H618 A620 I663 T664 D670 V693	I614-V666 HydrophobicContact CG2-CB 4.27Å; I614-V666 HydrophobicContact CG2-CG1 4.45Å; I614-V666 HydrophobicContact CG2-CG2 4.16Å; T616-V666 CarbonylContact C-O 3.5Å; T616-V666 VanDerWaalsContact CA-O 3.29Å; T616-V666 WeakPolarHBondContact CA-O 3.45Å; G617-V666 PolarHBondContact N-O 3.32Å; H618-V666 WeakPolarHBondContact O-CB 3.5Å; H618-V666 WeakPolarHBondContact O-CG2 3.27Å; H618-V666 PolarHBondContact O-N 3.11Å; A620-V666 HydrophobicContact CB-CG2 3.78Å; I663-V666 HydrophobicContact CB-CG2 3.92Å; I663-V666 HydrophobicContact CG2-CG2 3.66Å; I663-V666 WeakPolarHBondContact O-CG2 3.47Å; T664-V666 PolarHBondContact O-N 2.93Å; V666-D670 HydrophobicContact CG1-CB 4.44Å; V666-V693 HydrophobicContact CG1-CB 4.31Å; V666-V693 HydrophobicContact CG1-CG1 3.87Å; V666-V693 HydrophobicContact CG1-CG2 3.46Å; V666-V693 VanDerWaalsContact CG1-CG2 3.46Å
667	K	91.4	Very high	85.1	Confident	59 Å²	59	40.8 Å²	40.8	26%	0.257	22%	0.221	S	C	.	.			trans	-115.3	158.3	179.8	-63.8	-177	-178.2	177.1	0	111.2	E649 D665 E669 D670	E649-K667 IonicContact OE1-NZ 2.71Å; E649-K667 PolarHBondContact OE1-NZ 3.08Å; E649-K667 WeakPolarHBondContact OE2-CE 3.37Å; E649-K667 IonicContact OE2-NZ 3.16Å; E649-K667 PolarHBondContact OE2-NZ 3.4Å; D665-K667 PolarHBondContact O-N 3.49Å; K667-E669 HydrophobicContact CB-CG 3.78Å; K667-E669 HydrophobicContact CD-CG 4.44Å; K667-E669 PolarHBondContact O-N 3.44Å; K667-E669 VanDerWaalsContact O-N 3.09Å; K667-D670 PolarHBondContact N-OD2 3.26Å; K667-D670 WeakPolarHBondContact O-CB 3.31Å; K667-D670 PolarHBondContact O-N 3.34Å
668	P	89	Confident	86.7	Confident	64 Å²	64	33.1 Å²	33.1	42%	0.416	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-54.4	-29.4	176.6	-28.5	36.4	0	0	0	114.9	D670 M671	P668-D670 VanDerWaalsContact C-N 3.27Å; P668-D670 PolarHBondContact O-N 2.63Å; P668-M671 VanDerWaalsContact O-CB 3.22Å; P668-M671 WeakPolarHBondContact O-CB 3.24Å; P668-M671 PolarHBondContact O-N 2.69Å
669	E	90.4	Very high	88.4	Confident	79 Å²	79	36 Å²	36	37%	0.369	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-67.9	-18.9	175.2	55.4	168.9	-161.9	0	0	114.7	P645 R651 K667 M671	P645-E669 HydrophobicContact CB-CB 4.39Å; P645-E669 HydrophobicContact CB-CG 3.99Å; P645-E669 HydrophobicContact CG-CB 4.43Å; R651-E669 IonicContact NH2-OE1 2.61Å; R651-E669 PolarHBondContact NH2-OE1 3.08Å; K667-E669 HydrophobicContact CB-CG 3.78Å; K667-E669 HydrophobicContact CD-CG 4.44Å; K667-E669 PolarHBondContact O-N 3.44Å; K667-E669 VanDerWaalsContact O-N 3.09Å; E669-M671 VanDerWaalsContact C-N 3.26Å; E669-M671 PolarHBondContact O-N 3.09Å
670	D	91.6	Very high	89.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-78.6	-11	175.4	-55	-46.1	0	0	0	112.1	K638 A646 R651 I663 V666 K667 P668 G672 Y674 L691	K638-D670 WeakPolarHBondContact CE-O 3.38Å; A646-D670 WeakPolarHBondContact CB-OD1 3.39Å; A646-D670 PolarHBondContact N-OD1 3.38Å; R651-D670 IonicContact CZ-OD1 3.89Å; R651-D670 IonicContact CZ-OD2 3.56Å; R651-D670 IonicContact NH1-OD1 3.4Å; R651-D670 IonicContact NH1-OD2 3.8Å; R651-D670 PolarHBondContact NH1-OD2 3.13Å; R651-D670 IonicContact NH2-OD1 3.75Å; R651-D670 PolarHBondContact NH2-OD1 3.47Å; R651-D670 IonicContact NH2-OD2 2.86Å; R651-D670 PolarHBondContact NH2-OD2 2.9Å; I663-D670 HydrophobicContact CD1-CB 4.29Å; V666-D670 HydrophobicContact CG1-CB 4.44Å; K667-D670 PolarHBondContact N-OD2 3.26Å; K667-D670 WeakPolarHBondContact O-CB 3.31Å; K667-D670 PolarHBondContact O-N 3.34Å; P668-D670 VanDerWaalsContact C-N 3.27Å; P668-D670 PolarHBondContact O-N 2.63Å; D670-G672 PolarHBondContact O-N 3.24Å; D670-Y674 WeakPolarHBondContact O-CE2 3.27Å; D670-Y674 PolarHBondContact O-OH 3.31Å; D670-Y674 VanDerWaalsContact O-OH 3.11Å; D670-L691 HydrophobicContact CB-CD2 4.25Å
671	M	92.2	Very high	90.5	Very high	83 Å²	83	38.7 Å²	38.7	41%	0.409	21%	0.208	S	C	.	.			trans	-58.1	133.8	175.9	-174.2	-175.7	-68.4	0	0	110.9	K638 P668 E669 L691 I692 V693	K638-M671 WeakPolarHBondContact CE-O 3.34Å; K638-M671 PolarHBondContact NZ-O 2.85Å; P668-M671 VanDerWaalsContact O-CB 3.22Å; P668-M671 WeakPolarHBondContact O-CB 3.24Å; P668-M671 PolarHBondContact O-N 2.69Å; E669-M671 VanDerWaalsContact C-N 3.26Å; E669-M671 PolarHBondContact O-N 3.09Å; M671-L691 WeakPolarHBondContact CA-O 3.39Å; M671-L691 VanDerWaalsContact CG-O 3.31Å; M671-L691 WeakPolarHBondContact CG-O 3.17Å; M671-I692 HydrophobicContact CE-CG2 4.36Å; M671-V693 HydrophobicContact CB-CG2 4.24Å; M671-V693 HydrophobicContact CE-CB 4.33Å; M671-V693 WeakPolarHBondContact CE-O 3.25Å
672	G	92.9	Very high	91.1	Very high	10 Å²	10	39.6 Å²	39.6	10%	0.103	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-177.7	-179.8	0	0	0	0	0	113.9	D639 D670 L691	D639-G672 WeakPolarHBondContact OD1-CA 3.46Å; D670-G672 PolarHBondContact O-N 3.24Å; G672-L691 PolarHBondContact N-O 3.23Å; G672-L691 PolarHBondContact O-N 3.32Å
673	V	95.3	Very high	91.4	Very high	54 Å²	54	38.6 Å²	38.6	33%	0.327	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118	174.3	-178.6	0	0	0	0	109.6	K638 D639 N688 A689	K638-V673 CarbonylContact C-O 3.25Å; K638-V673 WeakPolarHBondContact CA-O 3.35Å; D639-V673 PolarHBondContact N-O 3.19Å; D639-V673 PolarHBondContact OD1-N 2.86Å; V673-N688 HydrophobicContact CG1-CB 4.11Å; V673-A689 CarbonylContact C-O 3.34Å; V673-A689 WeakPolarHBondContact CA-O 3.11Å
674	Y	93.2	Very high	91.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119	175.8	-74.7	-104.2	0	0	0	109.6	L622 Q637 K638 F644 F661 I663 D670 N688 A689 L691	L622-Y674 HydrophobicContact CD1-CD1 3.59Å; L622-Y674 HydrophobicContact CD1-CD2 4.18Å; L622-Y674 HydrophobicContact CD1-CE1 4.2Å; L622-Y674 HydrophobicContact CD1-CG 3.58Å; Q637-Y674 WeakPolarHBondContact O-CA 3.44Å; K638-Y674 HydrophobicContact CB-CE1 4.43Å; K638-Y674 HydrophobicContact CD-CE1 4.42Å; K638-Y674 HydrophobicContact CD-CE2 4.2Å; K638-Y674 WeakPolarHBondContact CE-OH 3.36Å; K638-Y674 HydrophobicContact CG-CE1 4.45Å; K638-Y674 HydrophobicContact CG-CE2 4.17Å; F644-Y674 AromaticContact CD1-CE1 3.89Å; F644-Y674 HydrophobicContact CD1-CE1 3.89Å; F644-Y674 HydrophobicContact CE1-CD1 4Å; F644-Y674 AromaticContact CE1-CE1 3.72Å; F644-Y674 HydrophobicContact CE1-CE1 3.72Å; F661-Y674 HydrophobicContact CE1-CD1 4.27Å; F661-Y674 HydrophobicContact CE1-CE1 4.03Å; I663-Y674 HydrophobicContact CD1-CE1 4.17Å; I663-Y674 WeakPolarHBondContact CD1-OH 3.37Å; D670-Y674 WeakPolarHBondContact O-CE2 3.27Å; D670-Y674 PolarHBondContact O-OH 3.31Å; D670-Y674 VanDerWaalsContact O-OH 3.11Å; Y674-N688 CarbonylContact O-C 3.11Å; Y674-N688 WeakPolarHBondContact O-CA 3.25Å; Y674-A689 PolarHBondContact N-O 3.32Å; Y674-A689 PolarHBondContact O-N 2.85Å; Y674-L691 HydrophobicContact CD2-CB 4Å; Y674-L691 HydrophobicContact CE2-CB 3.84Å; Y674-L691 HydrophobicContact CE2-CD2 3.97Å
675	S	93.3	Very high	91.9	Very high	15 Å²	15	41.5 Å²	41.5	11%	0.105	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.8	177.6	-57.2	0	0	0	0	109.8	W636 Q637 N688	W636-S675 CarbonylContact C-O 3.59Å; W636-S675 WeakPolarHBondContact CA-O 3.36Å; Q637-S675 PolarHBondContact N-O 2.81Å; Q637-S675 PolarHBondContact O-N 3.21Å; S675-N688 WeakPolarHBondContact CB-OD1 3.35Å; S675-N688 PolarHBondContact OG-OD1 3.25Å
676	C	91.8	Very high	92.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	140.2	167	179.3	0	0	0	0	110.1	P609 C624 A635 W636 S686 A687	P609-C676 HydrophobicContact CG-CB 4.2Å; C624-C676 HydrophobicContact CB-CB 3.64Å; C624-C676 WeakPolarHBondContact CB-SG 3.33Å; C624-C676 WeakPolarHBondContact SG-CB 3.18Å; C624-C676 CovalentContact SG-SG 2.01Å; C624-C676 PolarHBondContact SG-SG 2.96Å; A635-C676 CarbonylContact O-C 3.58Å; W636-C676 HydrophobicContact CD2-CB 4.18Å; W636-C676 HydrophobicContact CE3-CB 3.88Å; W636-C676 HydrophobicContact CH2-CB 4.03Å; W636-C676 HydrophobicContact CZ2-CB 4.31Å; W636-C676 HydrophobicContact CZ3-CB 3.8Å; C676-S686 CarbonylContact O-C 3.59Å; C676-S686 WeakPolarHBondContact O-CA 3.38Å; C676-S686 WeakPolarHBondContact O-CB 3.49Å; C676-A687 PolarHBondContact N-O 2.91Å; C676-A687 PolarHBondContact O-N 2.83Å
677	T	93.4	Very high	92.3	Very high	33 Å²	33	42.3 Å²	42.3	20%	0.202	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.7	175.7	-59.7	0	0	0	0	109.9	A635 T684 V685	A635-T677 PolarHBondContact N-O 2.98Å; A635-T677 PolarHBondContact O-N 2.81Å; T677-T684 HydrophobicContact CG2-CG2 3.31Å; T677-V685 CarbonylContact C-O 3.37Å; T677-V685 WeakPolarHBondContact CA-O 3.33Å
678	A	92.9	Very high	92.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125	175.1	0	0	0	0	0	110.1	P603 F605 A626 P632 Q633 I634 T684 V685	P603-A678 HydrophobicContact CB-CB 4.27Å; F605-A678 HydrophobicContact CE1-CB 3.9Å; F605-A678 HydrophobicContact CZ-CB 4.4Å; A626-A678 HydrophobicContact CB-CB 3.49Å; A626-A678 VanDerWaalsContact CB-CB 3.49Å; P632-A678 HydrophobicContact CB-CB 4.27Å; Q633-A678 WeakPolarHBondContact O-CA 3.32Å; I634-A678 HydrophobicContact CD1-CB 3.66Å; A678-T684 VanDerWaalsContact O-CA 3.31Å; A678-T684 WeakPolarHBondContact O-CA 3.13Å; A678-V685 HydrophobicContact CB-CG2 4.01Å; A678-V685 PolarHBondContact N-O 2.64Å; A678-V685 PolarHBondContact O-N 3.42Å
679	K	93.6	Very high	92.7	Very high	125 Å²	125	41.2 Å²	41.2	54%	0.543	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	135.8	-171.6	175.6	166.5	-177.1	177.7	0	113.5	P632 Q633 T684	P632-K679 CarbonylContact C-O 3.54Å; P632-K679 WeakPolarHBondContact CA-O 3.5Å; Q633-K679 PolarHBondContact N-O 2.82Å; Q633-K679 PolarHBondContact O-N 3.23Å; K679-T684 HydrophobicContact CB-CG2 4.14Å; K679-T684 WeakPolarHBondContact CD-OG1 3.49Å; K679-T684 VanDerWaalsContact CG-OG1 3.29Å; K679-T684 WeakPolarHBondContact CG-OG1 3.32Å
680	N	92.4	Very high	92.9	Very high	20 Å²	20	40 Å²	40	11%	0.107	24%	0.239	C	C	.	.			trans	-138	-162.9	165.8	72.2	4.5	0	0	0	110.9	V601 P603 P630 P632 A682 G683	V601-N680 PolarHBondContact O-ND2 2.67Å; P603-N680 WeakPolarHBondContact CD-OD1 3.36Å; P603-N680 HydrophobicContact CG-CB 4.26Å; P630-N680 WeakPolarHBondContact O-CB 3.34Å; P630-N680 PolarHBondContact O-ND2 2.68Å; P632-N680 HydrophobicContact CB-CB 4.5Å; N680-A682 WeakPolarHBondContact OD1-CA 3.27Å; N680-A682 WeakPolarHBondContact OD1-CB 3.08Å; N680-A682 PolarHBondContact OD1-N 2.73Å; N680-G683 PolarHBondContact N-O 3.32Å; N680-G683 PolarHBondContact OD1-N 2.69Å; N680-G683 VanDerWaalsContact OD1-N 3.15Å
681	T	89.8	Confident	93	Very high	101 Å²	101	40 Å²	40	62%	0.62	24%	0.239	S	C	*	.	S	Bend	trans	-79.5	-9.3	178.3	46	0	0	0	0	115.2	N600 P630	N600-T681 PolarHBondContact ND2-OG1 3Å; P630-T681 WeakPolarHBondContact CD-OG1 3.41Å
682	A	87.4	Confident	93	Very high	21 Å²	21	39.5 Å²	39.5	17%	0.174	24%	0.237	C	C	.	.	S	Bend	trans	-88.4	-30.8	170	0	0	0	0	0	112.9	V502 N600 L602 N680	V502-A682 HydrophobicContact CG2-CB 3.84Å; N600-A682 HydrophobicContact CB-CB 3.63Å; L602-A682 HydrophobicContact CB-CB 4.15Å; N680-A682 WeakPolarHBondContact OD1-CA 3.27Å; N680-A682 WeakPolarHBondContact OD1-CB 3.08Å; N680-A682 PolarHBondContact OD1-N 2.73Å
683	G	89.9	Confident	93	Very high	20 Å²	20	39 Å²	39	21%	0.206	23%	0.232	C	C	.	.			trans	172.3	-159.4	-177.3	0	0	0	0	0	114.7	N680	N680-G683 PolarHBondContact N-O 3.32Å; N680-G683 PolarHBondContact OD1-N 2.69Å; N680-G683 VanDerWaalsContact OD1-N 3.15Å
684	T	93.8	Very high	92.9	Very high	71 Å²	71	38.2 Å²	38.2	44%	0.436	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	138.3	-177.2	-59	0	0	0	0	109.6	T677 A678 K679	T677-T684 HydrophobicContact CG2-CG2 3.31Å; A678-T684 VanDerWaalsContact O-CA 3.31Å; A678-T684 WeakPolarHBondContact O-CA 3.13Å; K679-T684 HydrophobicContact CB-CG2 4.14Å; K679-T684 WeakPolarHBondContact CD-OG1 3.49Å; K679-T684 VanDerWaalsContact CG-OG1 3.29Å; K679-T684 WeakPolarHBondContact CG-OG1 3.32Å
685	V	94.4	Very high	92.7	Very high	36 Å²	36	40.1 Å²	40.1	22%	0.218	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150.5	172.5	-63.4	0	0	0	0	109.6	L602 P603 F605 T677 A678	L602-V685 HydrophobicContact CD2-CG1 4Å; P603-V685 HydrophobicContact CB-CG2 4.13Å; P603-V685 WeakPolarHBondContact O-CG1 3.45Å; P603-V685 WeakPolarHBondContact O-CG2 3.25Å; F605-V685 HydrophobicContact CD2-CB 4.45Å; F605-V685 HydrophobicContact CD2-CG2 3.93Å; F605-V685 HydrophobicContact CE1-CG2 4.21Å; F605-V685 HydrophobicContact CE2-CB 3.86Å; F605-V685 HydrophobicContact CE2-CG2 3.53Å; F605-V685 HydrophobicContact CG-CG2 4.44Å; F605-V685 HydrophobicContact CZ-CB 4.3Å; F605-V685 HydrophobicContact CZ-CG2 3.69Å; T677-V685 CarbonylContact C-O 3.37Å; T677-V685 WeakPolarHBondContact CA-O 3.33Å; A678-V685 HydrophobicContact CB-CG2 4.01Å; A678-V685 PolarHBondContact N-O 2.64Å; A678-V685 PolarHBondContact O-N 3.42Å
686	S	94.4	Very high	92.5	Very high	81 Å²	81	42.7 Å²	42.7	57%	0.566	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	151.2	179.6	55.3	0	0	0	0	112.3	C676	C676-S686 CarbonylContact O-C 3.59Å; C676-S686 WeakPolarHBondContact O-CA 3.38Å; C676-S686 WeakPolarHBondContact O-CB 3.49Å
687	A	94.3	Very high	92.5	Very high	16 Å²	16	42.9 Å²	42.9	13%	0.132	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	138.9	179.7	0	0	0	0	0	110.2	F605 T608 P609 C676	F605-A687 HydrophobicContact CD2-CB 4.26Å; F605-A687 HydrophobicContact CE2-CB 3.67Å; F605-A687 HydrophobicContact CZ-CB 3.84Å; T608-A687 HydrophobicContact CG2-CB 3.66Å; P609-A687 HydrophobicContact CG-CB 4.46Å; C676-A687 PolarHBondContact N-O 2.91Å; C676-A687 PolarHBondContact O-N 2.83Å
688	N	94.8	Very high	92.3	Very high	100 Å²	100	44.1 Å²	44.1	54%	0.535	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	151.7	-171.9	-60.2	-4.1	0	0	0	111.4	V673 Y674 S675	V673-N688 HydrophobicContact CG1-CB 4.11Å; Y674-N688 CarbonylContact O-C 3.11Å; Y674-N688 WeakPolarHBondContact O-CA 3.25Å; S675-N688 WeakPolarHBondContact CB-OD1 3.35Å; S675-N688 PolarHBondContact OG-OD1 3.25Å
689	A	94	Very high	92.2	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.5	170.1	0	0	0	0	0	111.7	P609 R610 V673 Y674	P609-A689 HydrophobicContact CB-CB 3.69Å; P609-A689 HydrophobicContact CG-CB 4.16Å; R610-A689 VanDerWaalsContact C-CB 3.42Å; V673-A689 CarbonylContact C-O 3.34Å; V673-A689 WeakPolarHBondContact CA-O 3.11Å; Y674-A689 PolarHBondContact N-O 3.32Å; Y674-A689 PolarHBondContact O-N 2.85Å
690	T	95.1	Very high	91.9	Very high	54 Å²	54	42.4 Å²	42.4	33%	0.331	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.7	179.9	-40.3	0	0	0	0	110.4	D611 S612 I692	D611-T690 WeakPolarHBondContact CA-O 3.27Å; D611-T690 WeakPolarHBondContact OD1-CB 3.35Å; D611-T690 PolarHBondContact OD1-N 3.48Å; D611-T690 PolarHBondContact OD1-OG1 3.44Å; S612-T690 PolarHBondContact N-O 3.31Å; T690-I692 HydrophobicContact CG2-CG1 4.2Å
691	L	93.8	Very high	91.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.3	168.6	176.9	59.2	0	0	0	109.3	S612 I614 A620 I663 D670 M671 G672 Y674 V693	S612-L691 WeakPolarHBondContact OG-CD1 3.47Å; I614-L691 HydrophobicContact CB-CD1 4.31Å; I614-L691 HydrophobicContact CG1-CD1 3.81Å; A620-L691 HydrophobicContact CB-CD1 3.98Å; A620-L691 HydrophobicContact CB-CD2 4.27Å; I663-L691 HydrophobicContact CD1-CD2 3.8Å; D670-L691 HydrophobicContact CB-CD2 4.25Å; M671-L691 WeakPolarHBondContact CA-O 3.39Å; M671-L691 VanDerWaalsContact CG-O 3.31Å; M671-L691 WeakPolarHBondContact CG-O 3.17Å; G672-L691 PolarHBondContact N-O 3.23Å; G672-L691 PolarHBondContact O-N 3.32Å; Y674-L691 HydrophobicContact CD2-CB 4Å; Y674-L691 HydrophobicContact CE2-CB 3.84Å; Y674-L691 HydrophobicContact CE2-CD2 3.97Å; L691-V693 HydrophobicContact CG-CG2 4.4Å
692	I	92.8	Very high	91.6	Very high	71 Å²	71	48.8 Å²	48.8	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.3	175.3	-58.5	177.3	0	0	0	108.9	S612 T613 I614 M671 T690 L694	S612-I692 PolarHBondContact O-N 3.44Å; T613-I692 CarbonylContact C-O 3.5Å; T613-I692 WeakPolarHBondContact CA-O 3.39Å; T613-I692 HydrophobicContact CG2-CB 4.28Å; T613-I692 HydrophobicContact CG2-CG2 4.19Å; I614-I692 PolarHBondContact N-O 2.99Å; M671-I692 HydrophobicContact CE-CG2 4.36Å; T690-I692 HydrophobicContact CG2-CG1 4.2Å; I692-L694 HydrophobicContact CG2-CD2 4.12Å
693	V	93.3	Very high	91.7	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.8	-179.8	-171.7	0	0	0	0	110.8	I614 V666 M671 L691 S723	I614-V693 CarbonylContact O-C 3.38Å; I614-V693 WeakPolarHBondContact O-CA 3.5Å; V666-V693 HydrophobicContact CG1-CB 4.31Å; V666-V693 HydrophobicContact CG1-CG1 3.87Å; V666-V693 HydrophobicContact CG1-CG2 3.46Å; V666-V693 VanDerWaalsContact CG1-CG2 3.46Å; M671-V693 HydrophobicContact CB-CG2 4.24Å; M671-V693 HydrophobicContact CE-CB 4.33Å; M671-V693 WeakPolarHBondContact CE-O 3.25Å; L691-V693 HydrophobicContact CG-CG2 4.4Å; V693-S723 PolarHBondContact O-OG 2.67Å
694	L	91.6	Very high	91.8	Very high	37 Å²	37	52.5 Å²	52.5	19%	0.194	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.6	179.3	-56.3	-173.5	0	0	0	110.8	T613 I614 R615 T616 I692 S723 L773	T613-L694 HydrophobicContact CG2-CD1 3.45Å; T613-L694 VanDerWaalsContact CG2-CD1 3.45Å; T613-L694 HydrophobicContact CG2-CD2 4.18Å; T613-L694 HydrophobicContact CG2-CG 3.6Å; I614-L694 PolarHBondContact O-N 3.22Å; R615-L694 CarbonylContact C-O 3.5Å; R615-L694 VanDerWaalsContact CA-O 3.24Å; R615-L694 WeakPolarHBondContact CA-O 3.42Å; T616-L694 PolarHBondContact N-O 3.27Å; T616-L694 PolarHBondContact OG1-O 3.43Å; I692-L694 HydrophobicContact CG2-CD2 4.12Å; L694-S723 CarbonylContact C-O 3.5Å; L694-S723 VanDerWaalsContact CA-O 3.28Å; L694-S723 WeakPolarHBondContact CA-O 3.33Å; L694-S723 WeakPolarHBondContact CB-O 3.43Å; L694-L773 HydrophobicContact CB-CD1 3.7Å; L694-L773 HydrophobicContact CB-CD2 4.23Å; L694-L773 HydrophobicContact CB-CG 4.44Å; L694-L773 HydrophobicContact CD1-CD2 4.09Å
695	E	90.6	Very high	91.7	Very high	39 Å²	39	54.3 Å²	54.3	18%	0.182	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	138	-171.1	-175	176.2	-108.9	0	0	110.5	T616 H698 S723 N771 L773	T616-E695 WeakPolarHBondContact OG1-CB 3.29Å; E695-H698 IonicContact OE1-CE1 3.63Å; E695-H698 IonicContact OE2-CE1 3.71Å; E695-H698 PolarHBondContact OE2-CE1 3.46Å; E695-H698 IonicContact OE2-ND1 3.68Å; E695-S723 PolarHBondContact N-O 2.97Å; E695-S723 PolarHBondContact O-N 3.2Å; E695-S723 VanDerWaalsContact O-O 3.12Å; E695-N771 PolarHBondContact O-ND2 3.29Å; E695-L773 VanDerWaalsContact C-CD1 3.41Å; E695-L773 WeakPolarHBondContact O-CD1 3.42Å
696	T	89.1	Confident	91.6	Very high	70 Å²	70	57.2 Å²	57.2	43%	0.429	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	154.8	178.7	37.5	0	0	0	0	111.6	H698 L773	T696-H698 PolarHBondContact O-N 2.99Å; T696-H698 PolarHBondContact O-ND1 2.92Å; T696-L773 HydrophobicContact CG2-CB 3.81Å; T696-L773 HydrophobicContact CG2-CD1 4.38Å
697	P	91	Very high	91.3	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.019	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	124	172.9	-17.1	32.6	0	0	0	108.5	L721 P726 M769 N771 E776	P697-L721 WeakPolarHBondContact CA-O 3.39Å; P697-P726 HydrophobicContact CB-CB 3.77Å; P697-P726 HydrophobicContact CB-CG 4.35Å; P697-P726 HydrophobicContact CG-CB 4.13Å; P697-M769 HydrophobicContact CB-CB 3.84Å; P697-M769 WeakPolarHBondContact CB-O 3.41Å; P697-N771 VanDerWaalsContact CD-OD1 3.31Å; P697-N771 WeakPolarHBondContact CD-OD1 3.4Å; P697-N771 HydrophobicContact CG-CB 3.97Å; P697-E776 WeakPolarHBondContact O-CB 3.22Å
698	H	88.8	Confident	91.1	Very high	59 Å²	59	57.2 Å²	57.2	27%	0.273	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.3	174.1	71.4	-87.4	0	0	0	111	E695 T696 A720 L721 E776	E695-H698 IonicContact OE1-CE1 3.63Å; E695-H698 IonicContact OE2-CE1 3.71Å; E695-H698 PolarHBondContact OE2-CE1 3.46Å; E695-H698 IonicContact OE2-ND1 3.68Å; T696-H698 PolarHBondContact O-N 2.99Å; T696-H698 PolarHBondContact O-ND1 2.92Å; H698-A720 WeakPolarHBondContact O-CA 3.35Å; H698-L721 PolarHBondContact N-O 3.2Å; H698-L721 PolarHBondContact O-N 3.14Å; H698-E776 VanDerWaalsContact CA-OE1 3.31Å; H698-E776 WeakPolarHBondContact CA-OE1 3.36Å
699	L	90.5	Very high	90.7	Very high	36 Å²	36	53 Å²	53	19%	0.188	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	125.1	179.9	-167.6	74.4	0	0	0	112.2	Q701 M703 M769 E776 A778	L699-Q701 WeakPolarHBondContact CD2-O 3.41Å; L699-Q701 WeakPolarHBondContact CG-O 3.17Å; L699-M703 HydrophobicContact CD1-CG 4.29Å; L699-M703 HydrophobicContact CD2-CG 4.03Å; L699-M769 HydrophobicContact CB-CE 4.18Å; L699-M769 HydrophobicContact CB-SD 4.27Å; L699-M769 HydrophobicContact CD1-CE 4.4Å; L699-M769 HydrophobicContact CD1-SD 3.94Å; L699-E776 PolarHBondContact N-OE1 2.85Å; L699-E776 VanDerWaalsContact N-OE1 3.16Å; L699-A778 HydrophobicContact CD1-CB 4.19Å; L699-A778 HydrophobicContact CD2-CB 3.72Å; L699-A778 HydrophobicContact CG-CB 4.43Å
700	A	87.8	Confident	90.4	Very high	53 Å²	53	56.4 Å²	56.4	44%	0.438	30%	0.301	S	S	.	.	S	Bend	trans	-79.4	-18.6	-179	0	0	0	0	0	114.5	K719 L721	A700-K719 HydrophobicContact CB-CB 4.08Å; A700-K719 WeakPolarHBondContact CB-O 3.24Å; A700-K719 PolarHBondContact N-O 2.92Å; A700-L721 HydrophobicContact CB-CD1 3.59Å; A700-L721 HydrophobicContact CB-CG 3.88Å
701	Q	86.3	Confident	89.9	Confident	84 Å²	84	56 Å²	56	39%	0.393	31%	0.308	S	S	.	.	S	Bend	trans	-156.3	129	177.1	179.9	-176.9	-6	0	0	108.2	L699 K719	L699-Q701 WeakPolarHBondContact CD2-O 3.41Å; L699-Q701 WeakPolarHBondContact CG-O 3.17Å; Q701-K719 HydrophobicContact CB-CD 4.23Å
702	E	89.1	Confident	89.7	Confident	171 Å²	171	60.5 Å²	60.5	80%	0.799	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-51.4	142.8	178.7	-66.5	-170.5	156.3	0	0	112.7	E704	E702-E704 PolarHBondContact O-N 3.36Å
703	M	91.3	Very high	89.6	Confident	19 Å²	19	61.5 Å²	61.5	9%	0.094	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-78	116.9	-179.1	-65.8	-174.2	56.4	0	0	109.5	L699 Q717 C718 W730 C767 A778 H779	L699-M703 HydrophobicContact CD1-CG 4.29Å; L699-M703 HydrophobicContact CD2-CG 4.03Å; M703-Q717 WeakPolarHBondContact CG-O 3.45Å; M703-C718 HydrophobicContact SD-CB 4.18Å; M703-W730 HydrophobicContact CE-CH2 3.6Å; M703-W730 HydrophobicContact CE-CZ3 3.54Å; M703-C767 HydrophobicContact CE-CB 4.16Å; M703-C767 HydrophobicContact SD-CB 3.61Å; M703-A778 HydrophobicContact CG-CB 3.94Å; M703-A778 VanDerWaalsContact SD-C 3.55Å; M703-A778 HydrophobicContact SD-CB 3.41Å; M703-A778 WeakPolarHBondContact SD-CB 3.3Å; M703-H779 WeakPolarHBondContact CB-O 3.37Å
704	E	90.9	Very high	89.5	Confident	100 Å²	100	62 Å²	62	47%	0.467	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-73.2	134.9	178.9	-67.3	169.5	-153.7	0	0	111.6	E702 R706 S780	E702-E704 PolarHBondContact O-N 3.36Å; E704-R706 IonicContact OE2-CZ 3.73Å; E704-R706 IonicContact OE2-NH1 2.83Å; E704-R706 PolarHBondContact OE2-NH1 3.36Å; E704-R706 IonicContact OE2-NH2 3.28Å; E704-R706 PolarHBondContact OE2-NH2 3.23Å; E704-S780 PolarHBondContact O-OG 2.91Å
705	D	92.1	Very high	89.5	Confident	109 Å²	109	62.1 Å²	62.1	58%	0.583	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-63.5	150.5	165.5	-77.7	-5.7	0	0	0	110.8	Q781	D705-Q781 WeakPolarHBondContact OD1-CB 3.43Å; D705-Q781 PolarHBondContact OD1-N 2.03Å
706	R	91.9	Very high	89.6	Confident	97 Å²	97	60.3 Å²	60.3	37%	0.366	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.1	-177.1	-67.7	-64	-175.9	-131.4	-2.2	112.1	E704 V714 L716 Q781 L782 A783	E704-R706 IonicContact OE2-CZ 3.73Å; E704-R706 IonicContact OE2-NH1 2.83Å; E704-R706 PolarHBondContact OE2-NH1 3.36Å; E704-R706 IonicContact OE2-NH2 3.28Å; E704-R706 PolarHBondContact OE2-NH2 3.23Å; R706-V714 HydrophobicContact CB-CG2 3.74Å; R706-V714 HydrophobicContact CG-CG2 3.85Å; R706-L716 HydrophobicContact CB-CD2 4.16Å; R706-L716 HydrophobicContact CG-CD2 3.7Å; R706-Q781 PolarHBondContact N-O 2.82Å; R706-L782 HydrophobicContact CB-CD1 3.93Å; R706-L782 WeakPolarHBondContact O-CA 3.49Å; R706-A783 PolarHBondContact O-N 3.39Å
707	S	88.4	Confident	89.8	Confident	85 Å²	85	61.1 Å²	61.1	59%	0.594	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.2	162.2	-174.3	0	0	0	0	108.7	A783	S707-A783 WeakPolarHBondContact CA-O 3.02Å
708	V	90.8	Very high	89.8	Confident	13 Å²	13	61 Å²	61	8%	0.079	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	147.8	-178.4	65.4	0	0	0	0	110.1	D712 V714 A757 L782 A783 V784 T785	V708-D712 HydrophobicContact CG2-CB 3.5Å; V708-D712 VanDerWaalsContact CG2-CB 3.5Å; V708-V714 HydrophobicContact CB-CB 4.12Å; V708-V714 HydrophobicContact CG1-CB 4.2Å; V708-V714 HydrophobicContact CG1-CG1 4.28Å; V708-V714 HydrophobicContact CG2-CB 4.12Å; V708-A757 HydrophobicContact CG1-CB 3.61Å; V708-A757 HydrophobicContact CG2-CB 4.24Å; V708-L782 HydrophobicContact CG1-CD1 3.85Å; V708-A783 PolarHBondContact N-O 2.04Å; V708-V784 HydrophobicContact CG1-CG1 4.48Å; V708-V784 HydrophobicContact CG1-CG2 3.91Å; V708-V784 CarbonylContact O-C 3.43Å; V708-V784 VanDerWaalsContact O-CA 3.3Å; V708-V784 WeakPolarHBondContact O-CA 3.44Å; V708-T785 PolarHBondContact O-N 3.44Å; V708-T785 PolarHBondContact O-OG1 3.36Å
709	A	86.3	Confident	89.9	Confident	12 Å²	12	61.5 Å²	61.5	10%	0.099	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	153.2	174.7	0	0	0	0	0	111.2	G711 D712 T785	A709-G711 PolarHBondContact O-N 2.87Å; A709-D712 PolarHBondContact O-N 3.5Å; A709-D712 VanDerWaalsContact O-N 3.12Å; A709-T785 WeakPolarHBondContact CA-O 3.37Å
710	V	88.1	Confident	89.9	Confident	71 Å²	71	60 Å²	60	43%	0.43	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	121.4	171.5	176.1	0	0	0	0	109.8	A757 P759 V784 T785 Q786	V710-A757 CarbonylContact C-O 3.54Å; V710-A757 WeakPolarHBondContact CA-O 3.33Å; V710-P759 HydrophobicContact CG2-CG 4.24Å; V710-V784 HydrophobicContact CB-CG1 4.48Å; V710-V784 HydrophobicContact CG2-CG1 3.67Å; V710-T785 PolarHBondContact N-O 3.04Å; V710-Q786 HydrophobicContact CG2-CG 4.09Å
711	G	84.7	Confident	90	Very high	46 Å²	46	61.8 Å²	61.8	47%	0.474	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	-15.7	-178.6	0	0	0	0	0	115.4	A709 A756 A757	A709-G711 PolarHBondContact O-N 2.87Å; G711-A756 WeakPolarHBondContact O-CA 3.23Å; G711-A757 PolarHBondContact N-O 2.94Å
712	D	89.3	Confident	90.1	Very high	94 Å²	94	58.5 Å²	58.5	50%	0.503	33%	0.325	S	S	.	.			trans	-80.8	169.4	177.2	-81.2	-20.7	0	0	0	112.4	V708 A709 A756 A757	V708-D712 HydrophobicContact CG2-CB 3.5Å; V708-D712 VanDerWaalsContact CG2-CB 3.5Å; A709-D712 PolarHBondContact O-N 3.5Å; A709-D712 VanDerWaalsContact O-N 3.12Å; D712-A756 PolarHBondContact O-N 2.82Å; D712-A757 WeakPolarHBondContact O-CB 3.5Å; D712-A757 PolarHBondContact O-N 3.17Å
713	T	89	Confident	90.1	Very high	93 Å²	93	51.8 Å²	51.8	57%	0.571	30%	0.297	S	S	*	.			trans	-103.8	132.9	177.3	-61.4	0	0	0	0	110.7	V753 I754	T713-V753 HydrophobicContact CG2-CG1 3.5Å; T713-I754 WeakPolarHBondContact CA-O 3.22Å
714	V	92.3	Very high	90	Very high	10 Å²	10	53.3 Å²	53.3	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.7	178.2	62.6	0	0	0	0	111.4	R706 V708 L716 V753 I754 L782	R706-V714 HydrophobicContact CB-CG2 3.74Å; R706-V714 HydrophobicContact CG-CG2 3.85Å; V708-V714 HydrophobicContact CB-CB 4.12Å; V708-V714 HydrophobicContact CG1-CB 4.2Å; V708-V714 HydrophobicContact CG1-CG1 4.28Å; V708-V714 HydrophobicContact CG2-CB 4.12Å; V714-L716 HydrophobicContact CG2-CD2 4.26Å; V714-V753 CarbonylContact O-C 3.31Å; V714-V753 WeakPolarHBondContact O-CA 3.27Å; V714-I754 HydrophobicContact CG1-CB 3.85Å; V714-I754 HydrophobicContact CG1-CD1 4.35Å; V714-I754 HydrophobicContact CG1-CG1 4.38Å; V714-I754 PolarHBondContact N-O 3Å; V714-I754 PolarHBondContact O-N 3.24Å; V714-L782 HydrophobicContact CB-CD1 4.45Å; V714-L782 HydrophobicContact CG1-CD1 4.07Å; V714-L782 HydrophobicContact CG1-CD2 3.87Å; V714-L782 HydrophobicContact CG2-CD1 3.96Å
715	A	91.9	Very high	89.9	Confident	40 Å²	40	54 Å²	54	33%	0.331	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.7	175.5	0	0	0	0	0	111	L751 L752 V753	A715-L751 HydrophobicContact CB-CD1 4.24Å; A715-L752 CarbonylContact C-O 3.58Å; A715-L752 WeakPolarHBondContact CA-O 3.2Å; A715-V753 HydrophobicContact CB-CG2 4.09Å
716	L	92.5	Very high	89.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.6	177	-54.3	-177.9	0	0	0	108.5	R706 V714 W730 L752 Y765	R706-L716 HydrophobicContact CB-CD2 4.16Å; R706-L716 HydrophobicContact CG-CD2 3.7Å; V714-L716 HydrophobicContact CG2-CD2 4.26Å; L716-W730 HydrophobicContact CB-CH2 3.74Å; L716-W730 HydrophobicContact CB-CZ3 3.83Å; L716-W730 HydrophobicContact CD1-CZ3 4.35Å; L716-W730 WeakPolarHBondContact O-CH2 3.2Å; L716-L752 HydrophobicContact CD1-CD2 4.38Å; L716-L752 PolarHBondContact N-O 2.93Å; L716-L752 PolarHBondContact O-N 3.34Å; L716-Y765 HydrophobicContact CD1-CD1 3.72Å; L716-Y765 HydrophobicContact CD1-CD2 3.74Å; L716-Y765 HydrophobicContact CD1-CE1 4.32Å; L716-Y765 HydrophobicContact CD1-CE2 4.36Å; L716-Y765 HydrophobicContact CD1-CG 3.39Å
717	Q	92.9	Very high	89.9	Confident	86 Å²	86	53.1 Å²	53.1	40%	0.402	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.4	-173.7	-177.4	159.2	78	0	0	111.3	M703 K719 L751	M703-Q717 WeakPolarHBondContact CG-O 3.45Å; Q717-K719 HydrophobicContact CG-CD 4.24Å; Q717-K719 HydrophobicContact CG-CG 3.99Å; Q717-L751 HydrophobicContact CB-CD1 3.73Å; Q717-L751 HydrophobicContact CG-CD1 4.18Å
718	C	91.4	Very high	90.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.285	C	S	.	.			trans	-133.8	87.3	174	-178.3	0	0	0	0	109.1	M703 A720 I728 W730 Q750 C767	M703-C718 HydrophobicContact SD-CB 4.18Å; C718-A720 PolarHBondContact O-N 2.95Å; C718-I728 WeakPolarHBondContact O-CD1 3.5Å; C718-W730 HydrophobicContact CB-CH2 3.93Å; C718-W730 HydrophobicContact CB-CZ2 3.66Å; C718-Q750 CarbonylContact C-O 3.5Å; C718-Q750 PolarHBondContact N-O 2.82Å; C718-Q750 WeakPolarHBondContact O-CA 3.37Å; C718-Q750 WeakPolarHBondContact O-CB 3.45Å; C718-Q750 WeakPolarHBondContact O-CG 3.36Å; C718-C767 HydrophobicContact CB-CB 3.6Å; C718-C767 WeakPolarHBondContact CB-SG 3.29Å; C718-C767 WeakPolarHBondContact SG-CB 3.08Å; C718-C767 CovalentContact SG-SG 2.02Å; C718-C767 PolarHBondContact SG-SG 2.87Å
719	K	90.9	Very high	90.2	Very high	71 Å²	71	50.5 Å²	50.5	31%	0.309	29%	0.293	S	S	.	.			trans	-79.2	94.3	175.3	-74.2	155.9	165.2	150.4	0	108.9	A700 Q701 Q717	A700-K719 HydrophobicContact CB-CB 4.08Å; A700-K719 WeakPolarHBondContact CB-O 3.24Å; A700-K719 PolarHBondContact N-O 2.92Å; Q701-K719 HydrophobicContact CB-CD 4.23Å; Q717-K719 HydrophobicContact CG-CD 4.24Å; Q717-K719 HydrophobicContact CG-CG 3.99Å
720	A	90.8	Very high	90.5	Very high	3 Å²	3	50.4 Å²	50.4	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	137.3	177.5	0	0	0	0	0	112	H698 C718 P726 I728 Q750 M769	H698-A720 WeakPolarHBondContact O-CA 3.35Å; C718-A720 PolarHBondContact O-N 2.95Å; A720-P726 HydrophobicContact CB-CG 3.6Å; A720-I728 HydrophobicContact CB-CD1 3.7Å; A720-I728 HydrophobicContact CB-CG1 4.09Å; A720-Q750 PolarHBondContact O-NE2 3.12Å; A720-M769 HydrophobicContact CB-CB 4.22Å; A720-M769 HydrophobicContact CB-CG 3.73Å; A720-M769 HydrophobicContact CB-SD 3.52Å; A720-M769 VanDerWaalsContact CB-SD 3.52Å
721	L	89.4	Confident	90.7	Very high	91 Å²	91	48 Å²	48	48%	0.476	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	169.7	171.1	-71.5	173.2	0	0	0	110.5	P697 H698 A700	P697-L721 WeakPolarHBondContact CA-O 3.39Å; H698-L721 PolarHBondContact N-O 3.2Å; H698-L721 PolarHBondContact O-N 3.14Å; A700-L721 HydrophobicContact CB-CD1 3.59Å; A700-L721 HydrophobicContact CB-CG 3.88Å
722	G	88.3	Confident	91	Very high	15 Å²	15	49.3 Å²	49.3	16%	0.155	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.9	161.7	-178.5	0	0	0	0	0	112.5	P724 P725	G722-P724 CarbonylContact C-O 3.47Å; G722-P724 CarbonylContact O-C 3.41Å; G722-P725 WeakPolarHBondContact O-CA 3.23Å
723	S	88.4	Confident	90.9	Very high	30 Å²	30	48.6 Å²	48.6	21%	0.21	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	108.6	-176.9	174.9	0	0	0	0	109.4	V693 L694 E695	V693-S723 PolarHBondContact O-OG 2.67Å; L694-S723 CarbonylContact C-O 3.5Å; L694-S723 VanDerWaalsContact CA-O 3.28Å; L694-S723 WeakPolarHBondContact CA-O 3.33Å; L694-S723 WeakPolarHBondContact CB-O 3.43Å; E695-S723 PolarHBondContact N-O 2.97Å; E695-S723 PolarHBondContact O-N 3.2Å; E695-S723 VanDerWaalsContact O-O 3.12Å
724	P	89	Confident	90.7	Very high	51 Å²	51	49 Å²	49	33%	0.331	26%	0.26	S	S	.	.	S	Bend	cis	-66.9	159.4	1.9	-19.2	33.7	0	0	0	113.7	G722 N771 T772	G722-P724 CarbonylContact C-O 3.47Å; G722-P724 CarbonylContact O-C 3.41Å; P724-N771 WeakPolarHBondContact O-CB 3.44Å; P724-N771 PolarHBondContact O-ND2 3.19Å; P724-T772 VanDerWaalsContact CD-OG1 3.32Å; P724-T772 WeakPolarHBondContact CD-OG1 3.48Å
725	P	88.6	Confident	90.4	Very high	116 Å²	116	54.6 Å²	54.6	75%	0.753	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-53.8	131.7	179.3	-28.3	36.1	0	0	0	112.9	G722	G722-P725 WeakPolarHBondContact O-CA 3.23Å
726	P	91.8	Very high	90.2	Very high	19 Å²	19	57.2 Å²	57.2	12%	0.123	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-78.7	139.3	-172.1	31	-36.9	0	0	0	113.8	P697 A720 S770 N771	P697-P726 HydrophobicContact CB-CB 3.77Å; P697-P726 HydrophobicContact CB-CG 4.35Å; P697-P726 HydrophobicContact CG-CB 4.13Å; A720-P726 HydrophobicContact CB-CG 3.6Å; P726-S770 CarbonylContact C-O 3.57Å; P726-S770 VanDerWaalsContact CA-O 3.3Å; P726-S770 WeakPolarHBondContact CA-O 3.36Å; P726-N771 HydrophobicContact CB-CB 4.4Å
727	R	92.9	Very high	90	Very high	168 Å²	168	58 Å²	58	63%	0.634	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.6	168.5	179.5	179.1	179.5	-80.6	-3.5	109.5	T729 S770	R727-T729 PolarHBondContact NH1-OG1 3.36Å; R727-T729 VanDerWaalsContact NH1-OG1 3.12Å; R727-S770 PolarHBondContact N-O 2.78Å; R727-S770 PolarHBondContact O-N 3.08Å; R727-S770 PolarHBondContact O-OG 3.17Å
728	I	93	Very high	89.5	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.4	179.6	-64.6	175	0	0	0	111.6	C718 A720 N749 Q750 C767 L768 M769	C718-I728 WeakPolarHBondContact O-CD1 3.5Å; A720-I728 HydrophobicContact CB-CD1 3.7Å; A720-I728 HydrophobicContact CB-CG1 4.09Å; I728-N749 HydrophobicContact CB-CB 4Å; I728-N749 HydrophobicContact CG2-CB 3.97Å; I728-N749 WeakPolarHBondContact CG2-O 3.35Å; I728-N749 PolarHBondContact O-ND2 3.3Å; I728-Q750 HydrophobicContact CD1-CB 4.33Å; I728-Q750 HydrophobicContact CD1-CG 3.54Å; I728-C767 VanDerWaalsContact CG2-SG 3.53Å; I728-L768 WeakPolarHBondContact CA-O 3.38Å; I728-M769 HydrophobicContact CG1-CG 4.3Å
729	T	92	Very high	89	Confident	40 Å²	40	68.3 Å²	68.3	25%	0.245	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.1	171.6	-50.5	0	0	0	0	109.3	R727 L768	R727-T729 PolarHBondContact NH1-OG1 3.36Å; R727-T729 VanDerWaalsContact NH1-OG1 3.12Å; T729-L768 PolarHBondContact N-O 3.44Å; T729-L768 WeakPolarHBondContact O-CB 3.48Å; T729-L768 PolarHBondContact O-N 2.95Å
730	W	93.3	Very high	88.7	Confident	10 Å²	10	67.3 Å²	67.3	4%	0.038	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.6	176.9	-70.9	82.9	0	0	0	111.6	M703 L716 C718 L737 F745 N749 L752 Y765	M703-W730 HydrophobicContact CE-CH2 3.6Å; M703-W730 HydrophobicContact CE-CZ3 3.54Å; L716-W730 HydrophobicContact CB-CH2 3.74Å; L716-W730 HydrophobicContact CB-CZ3 3.83Å; L716-W730 HydrophobicContact CD1-CZ3 4.35Å; L716-W730 WeakPolarHBondContact O-CH2 3.2Å; C718-W730 HydrophobicContact CB-CH2 3.93Å; C718-W730 HydrophobicContact CB-CZ2 3.66Å; W730-L737 HydrophobicContact CB-CB 4.19Å; W730-L737 HydrophobicContact CB-CD2 3.88Å; W730-L737 WeakPolarHBondContact O-CB 3.27Å; W730-L737 PolarHBondContact O-N 3.22Å; W730-F745 HydrophobicContact CB-CE1 4.2Å; W730-F745 AromaticContact CD1-CD1 3.86Å; W730-F745 AromaticContact CD1-CE1 3.61Å; W730-F745 AromaticContact CG-CE1 3.96Å; W730-F745 HydrophobicContact CG-CE1 3.96Å; W730-N749 PolarHBondContact NE1-O 3.48Å; W730-L752 HydrophobicContact CD2-CB 3.93Å; W730-L752 HydrophobicContact CD2-CD2 3.95Å; W730-L752 HydrophobicContact CE3-CB 4.26Å; W730-L752 HydrophobicContact CE3-CD2 3.79Å; W730-L752 HydrophobicContact CG-CB 4.44Å; W730-L752 HydrophobicContact CG-CD2 4.3Å; W730-L752 HydrophobicContact CH2-CB 4.23Å; W730-L752 HydrophobicContact CZ2-CB 3.89Å; W730-L752 HydrophobicContact CZ3-CB 4.39Å; W730-L752 HydrophobicContact CZ3-CD2 4.3Å; W730-Y765 HydrophobicContact CE3-CD1 4.47Å
731	L	92.9	Very high	88.4	Confident	22 Å²	22	74.4 Å²	74.4	12%	0.115	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.4	173.4	-57.3	145.6	0	0	0	108.3	Q735 P736 Y765 T766 L768	L731-Q735 CarbonylContact C-O 3.44Å; L731-Q735 WeakPolarHBondContact CA-O 3.4Å; L731-Q735 WeakPolarHBondContact CB-O 3.26Å; L731-P736 HydrophobicContact CD2-CG 4.39Å; L731-Y765 WeakPolarHBondContact O-CA 3.48Å; L731-T766 HydrophobicContact CD1-CG2 3.92Å; L731-T766 PolarHBondContact N-O 2.62Å; L731-T766 PolarHBondContact O-N 3.14Å; L731-L768 HydrophobicContact CD1-CB 4.05Å
732	R	91.1	Very high	88.3	Confident	73 Å²	73	73.6 Å²	73.6	28%	0.275	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.5	167.7	-169.3	-176.7	83.5	177.6	14	108.4	D734 Q735 L737 E760 D761 Y765	R732-D734 PolarHBondContact O-N 3.25Å; R732-Q735 PolarHBondContact N-O 3.34Å; R732-Q735 PolarHBondContact O-N 3.05Å; R732-L737 HydrophobicContact CB-CD1 4.05Å; R732-E760 PolarHBondContact NH1-O 2.73Å; R732-E760 PolarHBondContact NH2-O 3.01Å; R732-D761 IonicContact NH1-OD1 2.95Å; R732-Y765 HydrophobicContact CB-CD1 4.37Å; R732-Y765 HydrophobicContact CB-CE1 4.19Å; R732-Y765 WeakPolarHBondContact CD-OH 3.45Å; R732-Y765 HydrophobicContact CG-CD1 4.38Å; R732-Y765 HydrophobicContact CG-CD2 4.24Å; R732-Y765 HydrophobicContact CG-CE1 4.05Å; R732-Y765 HydrophobicContact CG-CE2 3.85Å; R732-Y765 HydrophobicContact CG-CG 4.48Å
733	D	86.6	Confident	88.5	Confident	79 Å²	79	73.7 Å²	73.7	42%	0.422	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	48.1	-177	-48.7	-50.8	0	0	0	111.6	Q735 G763 R764	D733-Q735 PolarHBondContact O-N 3.15Å; D733-G763 WeakPolarHBondContact OD1-CA 3.2Å; D733-R764 PolarHBondContact N-O 3.15Å; D733-R764 PolarHBondContact OD1-N 3.01Å
734	D	83.7	Confident	88.5	Confident	101 Å²	101	79.2 Å²	79.2	54%	0.54	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	2.4	-176	-57	-40.4	0	0	0	117.3	R732 R764	R732-D734 PolarHBondContact O-N 3.25Å; D734-R764 IonicContact OD1-CZ 3.68Å; D734-R764 IonicContact OD1-NH1 3.91Å; D734-R764 PolarHBondContact OD1-NH1 3.3Å; D734-R764 IonicContact OD1-NH2 2.73Å; D734-R764 PolarHBondContact OD1-NH2 2.64Å; D734-R764 VanDerWaalsContact OD1-NH2 3.16Å; D734-R764 IonicContact OD2-CZ 2.85Å; D734-R764 IonicContact OD2-NH1 2.71Å; D734-R764 IonicContact OD2-NH2 3.28Å; D734-R764 PolarHBondContact OD2-NH2 2.87Å
735	Q	86.6	Confident	88.6	Confident	128 Å²	128	80.1 Å²	80.1	60%	0.598	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	151.8	171	-61.6	-162.3	22.6	0	0	112.2	L731 R732 D733 L737	L731-Q735 CarbonylContact C-O 3.44Å; L731-Q735 WeakPolarHBondContact CA-O 3.4Å; L731-Q735 WeakPolarHBondContact CB-O 3.26Å; R732-Q735 PolarHBondContact N-O 3.34Å; R732-Q735 PolarHBondContact O-N 3.05Å; D733-Q735 PolarHBondContact O-N 3.15Å; Q735-L737 PolarHBondContact O-N 2.99Å
736	P	87.6	Confident	88.5	Confident	94 Å²	94	77 Å²	77	61%	0.61	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.7	123.6	172.5	-26.6	35.8	0	0	0	111.4	L731 R738	L731-P736 HydrophobicContact CD2-CG 4.39Å; P736-R738 PolarHBondContact O-N 2.77Å
737	L	88.8	Confident	88.1	Confident	18 Å²	18	82.4 Å²	82.4	9%	0.094	41%	0.408	C	S	.	.			trans	-64.2	109.8	179.6	176.3	61.4	0	0	0	108.6	W730 R732 Q735 P739 F745 L752 Y765	W730-L737 HydrophobicContact CB-CB 4.19Å; W730-L737 HydrophobicContact CB-CD2 3.88Å; W730-L737 WeakPolarHBondContact O-CB 3.27Å; W730-L737 PolarHBondContact O-N 3.22Å; R732-L737 HydrophobicContact CB-CD1 4.05Å; Q735-L737 PolarHBondContact O-N 2.99Å; L737-P739 VanDerWaalsContact O-CD 3.24Å; L737-P739 WeakPolarHBondContact O-CD 3.17Å; L737-F745 HydrophobicContact CD2-CE1 4.33Å; L737-F745 HydrophobicContact CD2-CZ 4.03Å; L737-L752 HydrophobicContact CD2-CD1 4.25Å; L737-L752 HydrophobicContact CD2-CD2 3.4Å; L737-L752 VanDerWaalsContact CD2-CD2 3.4Å; L737-L752 HydrophobicContact CD2-CG 4.47Å; L737-Y765 HydrophobicContact CD1-CE1 4.06Å; L737-Y765 HydrophobicContact CD2-CD1 4.3Å; L737-Y765 HydrophobicContact CD2-CE1 3.97Å
738	R	83.4	Confident	87.5	Confident	205 Å²	205	77 Å²	77	77%	0.774	41%	0.405	S	S	*	.			trans	-71.8	115.4	177.2	-63.6	-176.4	-176.5	-176.9	1.8	108.3	P736	P736-R738 PolarHBondContact O-N 2.77Å
739	P	80	Confident	87.4	Confident	98 Å²	98	79.8 Å²	79.8	64%	0.636	42%	0.419	S	S	*	.			trans	-62.7	146.2	177.6	-21	34.5	0	0	0	110.6	L737 F745	L737-P739 VanDerWaalsContact O-CD 3.24Å; L737-P739 WeakPolarHBondContact O-CD 3.17Å; P739-F745 HydrophobicContact CB-CE2 4.41Å; P739-F745 HydrophobicContact CG-CE2 4.44Å
740	S	84.5	Confident	87.3	Confident	51 Å²	51	81.6 Å²	81.6	36%	0.357	43%	0.425	S	S	.	.			trans	-138.8	171.9	170	68	0	0	0	0	108.6	R742 H743	S740-R742 PolarHBondContact O-N 2.58Å; S740-H743 PolarHBondContact O-N 3.11Å; S740-H743 PolarHBondContact OG-ND1 3.32Å
741	D	85.1	Confident	87.2	Confident	152 Å²	152	83 Å²	83	81%	0.813	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-9.9	-177.6	-48.2	-45.1	0	0	0	114.1	Y744	D741-Y744 PolarHBondContact O-OH 3.36Å
742	R	87.6	Confident	87.1	Confident	74 Å²	74	82 Å²	82	28%	0.279	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-9.4	173.9	-59.9	-166.2	-60.2	106.1	1.4	114.3	S740 I754 G755 A756 D761	S740-R742 PolarHBondContact O-N 2.58Å; R742-I754 CarbonylContact O-C 3.59Å; R742-I754 WeakPolarHBondContact O-CA 3.43Å; R742-G755 WeakPolarHBondContact CD-O 3.31Å; R742-G755 PolarHBondContact NH1-O 3.31Å; R742-G755 VanDerWaalsContact NH1-O 3.09Å; R742-G755 PolarHBondContact O-N 3.43Å; R742-A756 PolarHBondContact NH1-O 3.36Å; R742-D761 IonicContact CZ-OD1 2.83Å; R742-D761 IonicContact CZ-OD2 2.89Å; R742-D761 VanDerWaalsContact CZ-OD2 3.28Å; R742-D761 IonicContact NH1-OD1 3.29Å; R742-D761 IonicContact NH1-OD2 2.62Å; R742-D761 PolarHBondContact NH1-OD2 2.83Å; R742-D761 VanDerWaalsContact NH2-CG 3.3Å; R742-D761 IonicContact NH2-OD1 3.43Å; R742-D761 PolarHBondContact NH2-OD1 3.26Å; R742-D761 IonicContact NH2-OD2 2.67Å; R742-D761 PolarHBondContact NH2-OD2 3.25Å
743	H	91.2	Very high	87.1	Confident	17 Å²	17	80.2 Å²	80.2	8%	0.079	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.9	-176.4	-69.3	85.2	0	0	0	111.3	S740 F745 L752 V753	S740-H743 PolarHBondContact O-N 3.11Å; S740-H743 PolarHBondContact OG-ND1 3.32Å; H743-F745 HydrophobicContact CB-CE2 4.19Å; H743-F745 HydrophobicContact CB-CZ 4.48Å; H743-L752 HydrophobicContact CB-CD1 4.23Å; H743-V753 WeakPolarHBondContact CA-O 3.07Å
744	Y	89.3	Confident	87.4	Confident	145 Å²	145	76.4 Å²	76.4	57%	0.569	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	137	177.1	-49.4	-77.9	0	0	0	110.7	D741 V753	D741-Y744 PolarHBondContact O-OH 3.36Å; Y744-V753 PolarHBondContact N-O 3.1Å; Y744-V753 PolarHBondContact O-N 2.91Å
745	F	90.1	Very high	87.6	Confident	70 Å²	70	72.1 Å²	72.1	31%	0.307	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	142	179	-58.8	-88.3	0	0	0	110.5	W730 L737 P739 H743 L751 L752	W730-F745 HydrophobicContact CB-CE1 4.2Å; W730-F745 AromaticContact CD1-CD1 3.86Å; W730-F745 AromaticContact CD1-CE1 3.61Å; W730-F745 AromaticContact CG-CE1 3.96Å; W730-F745 HydrophobicContact CG-CE1 3.96Å; L737-F745 HydrophobicContact CD2-CE1 4.33Å; L737-F745 HydrophobicContact CD2-CZ 4.03Å; P739-F745 HydrophobicContact CB-CE2 4.41Å; P739-F745 HydrophobicContact CG-CE2 4.44Å; H743-F745 HydrophobicContact CB-CE2 4.19Å; H743-F745 HydrophobicContact CB-CZ 4.48Å; F745-L751 WeakPolarHBondContact CA-O 3.28Å; F745-L752 HydrophobicContact CD1-CB 4.13Å; F745-L752 HydrophobicContact CD1-CD1 4.03Å; F745-L752 HydrophobicContact CE1-CB 4.03Å; F745-L752 HydrophobicContact CE1-CD1 3.51Å; F745-L752 HydrophobicContact CE1-CD2 4.37Å; F745-L752 HydrophobicContact CE1-CG 4.15Å; F745-L752 HydrophobicContact CE2-CD1 4.42Å; F745-L752 HydrophobicContact CZ-CD1 3.74Å
746	T	87.8	Confident	87.6	Confident	51 Å²	51	68.5 Å²	68.5	31%	0.313	38%	0.377	S	S	.	.			trans	-73.3	160.4	168.8	49.4	0	0	0	0	111.7	G748 N749 L751	T746-G748 PolarHBondContact O-N 3.15Å; T746-N749 WeakPolarHBondContact O-CA 3.49Å; T746-N749 PolarHBondContact O-N 2.94Å; T746-L751 HydrophobicContact CG2-CB 3.71Å; T746-L751 HydrophobicContact CG2-CD2 4Å; T746-L751 HydrophobicContact CG2-CG 4.48Å; T746-L751 PolarHBondContact N-O 3.2Å; T746-L751 VanDerWaalsContact N-O 3.11Å; T746-L751 WeakPolarHBondContact OG1-CB 3.3Å; T746-L751 PolarHBondContact OG1-N 3.22Å
747	P	82	Confident	87.5	Confident	133 Å²	133	64.1 Å²	64.1	86%	0.864	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-50.3	131.1	166.4	-26.7	35.8	0	0	0	111.3	N749	P747-N749 VanDerWaalsContact C-N 3.28Å; P747-N749 PolarHBondContact O-N 2.84Å
748	G	81.9	Confident	87.5	Confident	54 Å²	54	64.6 Å²	64.6	56%	0.557	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	78.8	1.9	-173	0	0	0	0	0	115.3	T746 Q750	T746-G748 PolarHBondContact O-N 3.15Å; G748-Q750 PolarHBondContact O-N 2.92Å
749	N	90	Very high	87.5	Confident	60 Å²	60	58.6 Å²	58.6	32%	0.321	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	59.7	18.5	178.6	-56.2	-18.9	0	0	0	115.6	I728 W730 T746 P747 L751	I728-N749 HydrophobicContact CB-CB 4Å; I728-N749 HydrophobicContact CG2-CB 3.97Å; I728-N749 WeakPolarHBondContact CG2-O 3.35Å; I728-N749 PolarHBondContact O-ND2 3.3Å; W730-N749 PolarHBondContact NE1-O 3.48Å; T746-N749 WeakPolarHBondContact O-CA 3.49Å; T746-N749 PolarHBondContact O-N 2.94Å; P747-N749 VanDerWaalsContact C-N 3.28Å; P747-N749 PolarHBondContact O-N 2.84Å; N749-L751 PolarHBondContact O-N 2.91Å
750	Q	89.5	Confident	87.7	Confident	78 Å²	78	61.3 Å²	61.3	36%	0.364	35%	0.345	S	S	.	.			trans	-70.1	-11.7	-178.7	-73.6	-164.5	3.2	0	0	114.8	C718 A720 I728 G748	C718-Q750 CarbonylContact C-O 3.5Å; C718-Q750 PolarHBondContact N-O 2.82Å; C718-Q750 WeakPolarHBondContact O-CA 3.37Å; C718-Q750 WeakPolarHBondContact O-CB 3.45Å; C718-Q750 WeakPolarHBondContact O-CG 3.36Å; A720-Q750 PolarHBondContact O-NE2 3.12Å; I728-Q750 HydrophobicContact CD1-CB 4.33Å; I728-Q750 HydrophobicContact CD1-CG 3.54Å; G748-Q750 PolarHBondContact O-N 2.92Å
751	L	90.8	Very high	87.9	Confident	40 Å²	40	59 Å²	59	21%	0.209	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.3	174.4	-170.9	77	0	0	0	108.6	A715 Q717 F745 T746 N749 V753	A715-L751 HydrophobicContact CB-CD1 4.24Å; Q717-L751 HydrophobicContact CB-CD1 3.73Å; Q717-L751 HydrophobicContact CG-CD1 4.18Å; F745-L751 WeakPolarHBondContact CA-O 3.28Å; T746-L751 HydrophobicContact CG2-CB 3.71Å; T746-L751 HydrophobicContact CG2-CD2 4Å; T746-L751 HydrophobicContact CG2-CG 4.48Å; T746-L751 PolarHBondContact N-O 3.2Å; T746-L751 VanDerWaalsContact N-O 3.11Å; T746-L751 WeakPolarHBondContact OG1-CB 3.3Å; T746-L751 PolarHBondContact OG1-N 3.22Å; N749-L751 PolarHBondContact O-N 2.91Å; L751-V753 HydrophobicContact CD2-CG2 3.84Å; L751-V753 HydrophobicContact CG-CG2 4.1Å
752	L	92	Very high	88.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.6	167.7	161.9	60.9	0	0	0	108.4	A715 L716 W730 L737 H743 F745 I754 Y765	A715-L752 CarbonylContact C-O 3.58Å; A715-L752 WeakPolarHBondContact CA-O 3.2Å; L716-L752 HydrophobicContact CD1-CD2 4.38Å; L716-L752 PolarHBondContact N-O 2.93Å; L716-L752 PolarHBondContact O-N 3.34Å; W730-L752 HydrophobicContact CD2-CB 3.93Å; W730-L752 HydrophobicContact CD2-CD2 3.95Å; W730-L752 HydrophobicContact CE3-CB 4.26Å; W730-L752 HydrophobicContact CE3-CD2 3.79Å; W730-L752 HydrophobicContact CG-CB 4.44Å; W730-L752 HydrophobicContact CG-CD2 4.3Å; W730-L752 HydrophobicContact CH2-CB 4.23Å; W730-L752 HydrophobicContact CZ2-CB 3.89Å; W730-L752 HydrophobicContact CZ3-CB 4.39Å; W730-L752 HydrophobicContact CZ3-CD2 4.3Å; L737-L752 HydrophobicContact CD2-CD1 4.25Å; L737-L752 HydrophobicContact CD2-CD2 3.4Å; L737-L752 VanDerWaalsContact CD2-CD2 3.4Å; L737-L752 HydrophobicContact CD2-CG 4.47Å; H743-L752 HydrophobicContact CB-CD1 4.23Å; F745-L752 HydrophobicContact CD1-CB 4.13Å; F745-L752 HydrophobicContact CD1-CD1 4.03Å; F745-L752 HydrophobicContact CE1-CB 4.03Å; F745-L752 HydrophobicContact CE1-CD1 3.51Å; F745-L752 HydrophobicContact CE1-CD2 4.37Å; F745-L752 HydrophobicContact CE1-CG 4.15Å; F745-L752 HydrophobicContact CE2-CD1 4.42Å; F745-L752 HydrophobicContact CZ-CD1 3.74Å; L752-I754 HydrophobicContact CD1-CG1 4.09Å; L752-I754 HydrophobicContact CD2-CD1 4.33Å; L752-I754 HydrophobicContact CD2-CG1 4.4Å; L752-I754 HydrophobicContact CG-CG1 4.09Å; L752-Y765 HydrophobicContact CD2-CD1 3.71Å; L752-Y765 HydrophobicContact CD2-CE1 3.8Å
753	V	91.3	Very high	88.2	Confident	36 Å²	36	50.5 Å²	50.5	22%	0.218	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.1	174.7	-175.9	0	0	0	0	108.8	T713 V714 A715 H743 Y744 L751	T713-V753 HydrophobicContact CG2-CG1 3.5Å; V714-V753 CarbonylContact O-C 3.31Å; V714-V753 WeakPolarHBondContact O-CA 3.27Å; A715-V753 HydrophobicContact CB-CG2 4.09Å; H743-V753 WeakPolarHBondContact CA-O 3.07Å; Y744-V753 PolarHBondContact N-O 3.1Å; Y744-V753 PolarHBondContact O-N 2.91Å; L751-V753 HydrophobicContact CD2-CG2 3.84Å; L751-V753 HydrophobicContact CG-CG2 4.1Å
754	I	91.9	Very high	88.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	108.7	179.7	-49.8	175	0	0	0	107.7	T713 V714 R742 L752 D761 Y765 L782	T713-I754 WeakPolarHBondContact CA-O 3.22Å; V714-I754 HydrophobicContact CG1-CB 3.85Å; V714-I754 HydrophobicContact CG1-CD1 4.35Å; V714-I754 HydrophobicContact CG1-CG1 4.38Å; V714-I754 PolarHBondContact N-O 3Å; V714-I754 PolarHBondContact O-N 3.24Å; R742-I754 CarbonylContact O-C 3.59Å; R742-I754 WeakPolarHBondContact O-CA 3.43Å; L752-I754 HydrophobicContact CD1-CG1 4.09Å; L752-I754 HydrophobicContact CD2-CD1 4.33Å; L752-I754 HydrophobicContact CD2-CG1 4.4Å; L752-I754 HydrophobicContact CG-CG1 4.09Å; I754-D761 HydrophobicContact CG2-CB 4.47Å; I754-Y765 HydrophobicContact CD1-CE1 3.71Å; I754-Y765 HydrophobicContact CD1-CE2 4.31Å; I754-Y765 VanDerWaalsContact CD1-OH 3.31Å; I754-Y765 WeakPolarHBondContact CD1-OH 3.09Å; I754-L782 HydrophobicContact CD1-CD2 3.87Å
755	G	87.3	Confident	88.6	Confident	11 Å²	11	46.4 Å²	46.4	11%	0.113	28%	0.279	C	S	.	.	S	Bend	trans	-80.8	145.2	177.7	0	0	0	0	0	112.5	R742	R742-G755 WeakPolarHBondContact CD-O 3.31Å; R742-G755 PolarHBondContact NH1-O 3.31Å; R742-G755 VanDerWaalsContact NH1-O 3.09Å; R742-G755 PolarHBondContact O-N 3.43Å
756	A	86.6	Confident	88.8	Confident	52 Å²	52	43 Å²	43	43%	0.43	26%	0.264	S	S	.	.	S	Bend	trans	47.3	65.5	178.8	0	0	0	0	0	112.7	G711 D712 R742 S758	G711-A756 WeakPolarHBondContact O-CA 3.23Å; D712-A756 PolarHBondContact O-N 2.82Å; R742-A756 PolarHBondContact NH1-O 3.36Å; A756-S758 PolarHBondContact O-N 3.03Å
757	A	86.8	Confident	89	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	25%	0.249	C	C	.	.			trans	-56.4	131.5	-175.3	0	0	0	0	0	111.8	V708 V710 G711 D712 V784	V708-A757 HydrophobicContact CG1-CB 3.61Å; V708-A757 HydrophobicContact CG2-CB 4.24Å; V710-A757 CarbonylContact C-O 3.54Å; V710-A757 WeakPolarHBondContact CA-O 3.33Å; G711-A757 PolarHBondContact N-O 2.94Å; D712-A757 WeakPolarHBondContact O-CB 3.5Å; D712-A757 PolarHBondContact O-N 3.17Å; A757-V784 HydrophobicContact CB-CG1 4.4Å; A757-V784 HydrophobicContact CB-CG2 4.44Å
758	S	87.4	Confident	89.6	Confident	27 Å²	27	35.9 Å²	35.9	19%	0.189	22%	0.216	C	C	.	.			trans	-115.5	161.4	179.9	71.3	0	0	0	0	110.4	A756 E760 D761 V784	A756-S758 PolarHBondContact O-N 3.03Å; S758-E760 PolarHBondContact O-N 3.42Å; S758-E760 VanDerWaalsContact O-N 3.07Å; S758-E760 PolarHBondContact OG-N 2.68Å; S758-D761 WeakPolarHBondContact CB-OD2 3.34Å; S758-D761 PolarHBondContact N-OD2 3.04Å; S758-D761 WeakPolarHBondContact O-CB 3.48Å; S758-D761 PolarHBondContact O-N 3.35Å; S758-D761 PolarHBondContact OG-OD2 3.03Å; S758-V784 WeakPolarHBondContact O-CG2 3.39Å
759	P	84.5	Confident	90.1	Very high	79 Å²	79	33.3 Å²	33.3	51%	0.513	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-56.6	-23.6	174.2	-26	36.1	0	0	0	114	V710 D761 A762	V710-P759 HydrophobicContact CG2-CG 4.24Å; P759-D761 VanDerWaalsContact C-N 3.26Å; P759-D761 PolarHBondContact O-N 3.09Å; P759-A762 PolarHBondContact O-N 3.41Å
760	E	84.9	Confident	90.2	Very high	155 Å²	155	31.8 Å²	31.8	72%	0.724	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-77.6	-6.2	176.1	-59.7	-179.6	-166	0	0	114	R732 S758	R732-E760 PolarHBondContact NH1-O 2.73Å; R732-E760 PolarHBondContact NH2-O 3.01Å; S758-E760 PolarHBondContact O-N 3.42Å; S758-E760 VanDerWaalsContact O-N 3.07Å; S758-E760 PolarHBondContact OG-N 2.68Å
761	D	87.1	Confident	90.3	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.011	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-95.8	-9.1	173.9	-53.3	-56.4	0	0	0	112.5	R732 R742 I754 S758 P759 Y765 L782	R732-D761 IonicContact NH1-OD1 2.95Å; R742-D761 IonicContact CZ-OD1 2.83Å; R742-D761 IonicContact CZ-OD2 2.89Å; R742-D761 VanDerWaalsContact CZ-OD2 3.28Å; R742-D761 IonicContact NH1-OD1 3.29Å; R742-D761 IonicContact NH1-OD2 2.62Å; R742-D761 PolarHBondContact NH1-OD2 2.83Å; R742-D761 VanDerWaalsContact NH2-CG 3.3Å; R742-D761 IonicContact NH2-OD1 3.43Å; R742-D761 PolarHBondContact NH2-OD1 3.26Å; R742-D761 IonicContact NH2-OD2 2.67Å; R742-D761 PolarHBondContact NH2-OD2 3.25Å; I754-D761 HydrophobicContact CG2-CB 4.47Å; S758-D761 WeakPolarHBondContact CB-OD2 3.34Å; S758-D761 PolarHBondContact N-OD2 3.04Å; S758-D761 WeakPolarHBondContact O-CB 3.48Å; S758-D761 PolarHBondContact O-N 3.35Å; S758-D761 PolarHBondContact OG-OD2 3.03Å; P759-D761 VanDerWaalsContact C-N 3.26Å; P759-D761 PolarHBondContact O-N 3.09Å; D761-Y765 VanDerWaalsContact O-CE2 3.32Å; D761-Y765 WeakPolarHBondContact O-CE2 3.06Å; D761-Y765 PolarHBondContact O-OH 3.33Å; D761-L782 HydrophobicContact CB-CD2 4.46Å; D761-L782 WeakPolarHBondContact O-CD2 3.44Å
762	A	89.2	Confident	90.3	Very high	42 Å²	42	32.8 Å²	32.8	35%	0.347	20%	0.196	S	C	.	.			trans	-67.9	132.9	171.5	0	0	0	0	0	110.4	P759 L782 V784	P759-A762 PolarHBondContact O-N 3.41Å; A762-L782 WeakPolarHBondContact CA-O 3.48Å; A762-V784 HydrophobicContact CB-CB 4.4Å; A762-V784 HydrophobicContact CB-CG2 4.09Å
763	G	90.8	Very high	90	Very high	7 Å²	7	34.2 Å²	34.2	7%	0.072	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.7	174.8	-174.1	0	0	0	0	0	112.7	D733 Q781 L782	D733-G763 WeakPolarHBondContact OD1-CA 3.2Å; G763-Q781 VanDerWaalsContact C-NE2 3.3Å; G763-Q781 PolarHBondContact O-NE2 2.81Å; G763-L782 PolarHBondContact N-O 3.33Å; G763-L782 VanDerWaalsContact N-O 3.09Å; G763-L782 PolarHBondContact O-N 3.15Å
764	R	93.9	Very high	89.8	Confident	75 Å²	75	33.8 Å²	33.8	28%	0.283	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	108.4	175.2	179	170.6	51.1	78.5	2.2	109.8	D733 D734 T766 H779	D733-R764 PolarHBondContact N-O 3.15Å; D733-R764 PolarHBondContact OD1-N 3.01Å; D734-R764 IonicContact OD1-CZ 3.68Å; D734-R764 IonicContact OD1-NH1 3.91Å; D734-R764 PolarHBondContact OD1-NH1 3.3Å; D734-R764 IonicContact OD1-NH2 2.73Å; D734-R764 PolarHBondContact OD1-NH2 2.64Å; D734-R764 VanDerWaalsContact OD1-NH2 3.16Å; D734-R764 IonicContact OD2-CZ 2.85Å; D734-R764 IonicContact OD2-NH1 2.71Å; D734-R764 IonicContact OD2-NH2 3.28Å; D734-R764 PolarHBondContact OD2-NH2 2.87Å; R764-T766 PolarHBondContact NH1-OG1 2.94Å; R764-T766 VanDerWaalsContact NH1-OG1 3.13Å; R764-H779 HydrophobicContact CG-CB 4.41Å
765	Y	94.3	Very high	89.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.6	171.7	-74.1	-101.5	0	0	0	109.4	L716 W730 L731 R732 L737 L752 I754 D761 H779 S780 L782	L716-Y765 HydrophobicContact CD1-CD1 3.72Å; L716-Y765 HydrophobicContact CD1-CD2 3.74Å; L716-Y765 HydrophobicContact CD1-CE1 4.32Å; L716-Y765 HydrophobicContact CD1-CE2 4.36Å; L716-Y765 HydrophobicContact CD1-CG 3.39Å; W730-Y765 HydrophobicContact CE3-CD1 4.47Å; L731-Y765 WeakPolarHBondContact O-CA 3.48Å; R732-Y765 HydrophobicContact CB-CD1 4.37Å; R732-Y765 HydrophobicContact CB-CE1 4.19Å; R732-Y765 WeakPolarHBondContact CD-OH 3.45Å; R732-Y765 HydrophobicContact CG-CD1 4.38Å; R732-Y765 HydrophobicContact CG-CD2 4.24Å; R732-Y765 HydrophobicContact CG-CE1 4.05Å; R732-Y765 HydrophobicContact CG-CE2 3.85Å; R732-Y765 HydrophobicContact CG-CG 4.48Å; L737-Y765 HydrophobicContact CD1-CE1 4.06Å; L737-Y765 HydrophobicContact CD2-CD1 4.3Å; L737-Y765 HydrophobicContact CD2-CE1 3.97Å; L752-Y765 HydrophobicContact CD2-CD1 3.71Å; L752-Y765 HydrophobicContact CD2-CE1 3.8Å; I754-Y765 HydrophobicContact CD1-CE1 3.71Å; I754-Y765 HydrophobicContact CD1-CE2 4.31Å; I754-Y765 VanDerWaalsContact CD1-OH 3.31Å; I754-Y765 WeakPolarHBondContact CD1-OH 3.09Å; D761-Y765 VanDerWaalsContact O-CE2 3.32Å; D761-Y765 WeakPolarHBondContact O-CE2 3.06Å; D761-Y765 PolarHBondContact O-OH 3.33Å; Y765-H779 WeakPolarHBondContact O-CA 3.41Å; Y765-S780 PolarHBondContact N-O 3.46Å; Y765-S780 PolarHBondContact O-N 2.79Å; Y765-L782 HydrophobicContact CD2-CB 3.91Å; Y765-L782 HydrophobicContact CD2-CD2 4.46Å; Y765-L782 HydrophobicContact CE2-CB 3.85Å; Y765-L782 HydrophobicContact CE2-CD2 3.79Å; Y765-L782 HydrophobicContact CE2-CG 4.44Å
766	T	93.8	Very high	90	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.9	179.2	-58.9	0	0	0	0	109.9	L731 R764 R777 A778 H779	L731-T766 HydrophobicContact CD1-CG2 3.92Å; L731-T766 PolarHBondContact N-O 2.62Å; L731-T766 PolarHBondContact O-N 3.14Å; R764-T766 PolarHBondContact NH1-OG1 2.94Å; R764-T766 VanDerWaalsContact NH1-OG1 3.13Å; T766-R777 HydrophobicContact CG2-CB 4.11Å; T766-R777 HydrophobicContact CG2-CG 4.15Å; T766-A778 CarbonylContact C-O 3.59Å; T766-A778 VanDerWaalsContact CA-O 3.27Å; T766-A778 WeakPolarHBondContact CA-O 3.27Å; T766-H779 VanDerWaalsContact CG2-CE1 3.45Å; T766-H779 WeakPolarHBondContact CG2-CE1 3.37Å; T766-H779 WeakPolarHBondContact CG2-ND1 3.37Å; T766-H779 PolarHBondContact OG1-CE1 3.49Å; T766-H779 PolarHBondContact OG1-ND1 3.14Å
767	C	93.4	Very high	90.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.8	170.8	-178.4	0	0	0	0	109.3	M703 C718 I728 R777 A778	M703-C767 HydrophobicContact CE-CB 4.16Å; M703-C767 HydrophobicContact SD-CB 3.61Å; C718-C767 HydrophobicContact CB-CB 3.6Å; C718-C767 WeakPolarHBondContact CB-SG 3.29Å; C718-C767 WeakPolarHBondContact SG-CB 3.08Å; C718-C767 CovalentContact SG-SG 2.02Å; C718-C767 PolarHBondContact SG-SG 2.87Å; I728-C767 VanDerWaalsContact CG2-SG 3.53Å; C767-R777 VanDerWaalsContact O-CA 3.31Å; C767-R777 WeakPolarHBondContact O-CA 3.07Å; C767-A778 PolarHBondContact N-O 3.43Å; C767-A778 PolarHBondContact O-N 3.43Å
768	L	93.2	Very high	90.6	Very high	34 Å²	34	45.2 Å²	45.2	18%	0.178	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.7	175.3	-173	73.2	0	0	0	109.1	I728 T729 L731 T775 R777	I728-L768 WeakPolarHBondContact CA-O 3.38Å; T729-L768 PolarHBondContact N-O 3.44Å; T729-L768 WeakPolarHBondContact O-CB 3.48Å; T729-L768 PolarHBondContact O-N 2.95Å; L731-L768 HydrophobicContact CD1-CB 4.05Å; L768-T775 HydrophobicContact CD1-CG2 3.42Å; L768-T775 VanDerWaalsContact CD1-CG2 3.42Å; L768-T775 HydrophobicContact CG-CG2 3.81Å; L768-R777 HydrophobicContact CD1-CG 3.55Å
769	M	94.1	Very high	90.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.9	-172.9	-58	169.9	-79.5	0	0	109.2	P697 L699 A720 I728 T775 E776 A778	P697-M769 HydrophobicContact CB-CB 3.84Å; P697-M769 WeakPolarHBondContact CB-O 3.41Å; L699-M769 HydrophobicContact CB-CE 4.18Å; L699-M769 HydrophobicContact CB-SD 4.27Å; L699-M769 HydrophobicContact CD1-CE 4.4Å; L699-M769 HydrophobicContact CD1-SD 3.94Å; A720-M769 HydrophobicContact CB-CB 4.22Å; A720-M769 HydrophobicContact CB-CG 3.73Å; A720-M769 HydrophobicContact CB-SD 3.52Å; A720-M769 VanDerWaalsContact CB-SD 3.52Å; I728-M769 HydrophobicContact CG1-CG 4.3Å; M769-T775 CarbonylContact O-C 3.54Å; M769-T775 WeakPolarHBondContact O-CA 3.03Å; M769-E776 HydrophobicContact CE-CB 3.95Å; M769-E776 HydrophobicContact CE-CG 3.8Å; M769-E776 PolarHBondContact N-O 3.25Å; M769-E776 PolarHBondContact O-N 2.91Å; M769-A778 HydrophobicContact CE-CB 3.88Å
770	S	91.6	Very high	91.3	Very high	27 Å²	27	44.6 Å²	44.6	19%	0.189	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.3	-167.9	58.1	0	0	0	0	113.9	P726 R727 T775	P726-S770 CarbonylContact C-O 3.57Å; P726-S770 VanDerWaalsContact CA-O 3.3Å; P726-S770 WeakPolarHBondContact CA-O 3.36Å; R727-S770 PolarHBondContact N-O 2.78Å; R727-S770 PolarHBondContact O-N 3.08Å; R727-S770 PolarHBondContact O-OG 3.17Å; S770-T775 VanDerWaalsContact CB-OG1 3.29Å; S770-T775 WeakPolarHBondContact CB-OG1 3.42Å
771	N	92.4	Very high	91.7	Very high	28 Å²	28	41.3 Å²	41.3	15%	0.15	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	-171.9	170.1	81.7	3.3	0	0	0	111	E695 P697 P724 P726 L773 G774	E695-N771 PolarHBondContact O-ND2 3.29Å; P697-N771 VanDerWaalsContact CD-OD1 3.31Å; P697-N771 WeakPolarHBondContact CD-OD1 3.4Å; P697-N771 HydrophobicContact CG-CB 3.97Å; P724-N771 WeakPolarHBondContact O-CB 3.44Å; P724-N771 PolarHBondContact O-ND2 3.19Å; P726-N771 HydrophobicContact CB-CB 4.4Å; N771-L773 PolarHBondContact O-N 2.6Å; N771-L773 WeakPolarHBondContact OD1-CB 3.48Å; N771-L773 PolarHBondContact OD1-N 2.9Å; N771-G774 PolarHBondContact N-O 2.97Å; N771-G774 VanDerWaalsContact N-O 3.1Å; N771-G774 PolarHBondContact O-N 3.14Å; N771-G774 VanDerWaalsContact O-O 3.12Å; N771-G774 PolarHBondContact OD1-N 2.67Å
772	T	88.8	Confident	91.9	Very high	112 Å²	112	41.2 Å²	41.2	69%	0.687	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-11.2	-177.4	50.8	0	0	0	0	115	P724	P724-T772 VanDerWaalsContact CD-OG1 3.32Å; P724-T772 WeakPolarHBondContact CD-OG1 3.48Å
773	L	86.8	Confident	91.9	Very high	29 Å²	29	41.2 Å²	41.2	15%	0.152	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-23.2	-179.5	-52.2	-174.3	0	0	0	114	R615 L694 E695 T696 N771	R615-L773 HydrophobicContact CG-CD1 4.48Å; L694-L773 HydrophobicContact CB-CD1 3.7Å; L694-L773 HydrophobicContact CB-CD2 4.23Å; L694-L773 HydrophobicContact CB-CG 4.44Å; L694-L773 HydrophobicContact CD1-CD2 4.09Å; E695-L773 VanDerWaalsContact C-CD1 3.41Å; E695-L773 WeakPolarHBondContact O-CD1 3.42Å; T696-L773 HydrophobicContact CG2-CB 3.81Å; T696-L773 HydrophobicContact CG2-CD1 4.38Å; N771-L773 PolarHBondContact O-N 2.6Å; N771-L773 WeakPolarHBondContact OD1-CB 3.48Å; N771-L773 PolarHBondContact OD1-N 2.9Å
774	G	87.6	Confident	91.8	Very high	27 Å²	27	42.1 Å²	42.1	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-169.9	-172.9	0	0	0	0	0	114.5	N771	N771-G774 PolarHBondContact N-O 2.97Å; N771-G774 VanDerWaalsContact N-O 3.1Å; N771-G774 PolarHBondContact O-N 3.14Å; N771-G774 VanDerWaalsContact O-O 3.12Å; N771-G774 PolarHBondContact OD1-N 2.67Å
775	T	90.6	Very high	91.3	Very high	75 Å²	75	41.8 Å²	41.8	46%	0.46	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	123.4	177	-66	0	0	0	0	110.9	L768 M769 S770	L768-T775 HydrophobicContact CD1-CG2 3.42Å; L768-T775 VanDerWaalsContact CD1-CG2 3.42Å; L768-T775 HydrophobicContact CG-CG2 3.81Å; M769-T775 CarbonylContact O-C 3.54Å; M769-T775 WeakPolarHBondContact O-CA 3.03Å; S770-T775 VanDerWaalsContact CB-OG1 3.29Å; S770-T775 WeakPolarHBondContact CB-OG1 3.42Å
776	E	92.7	Very high	90	Very high	74 Å²	74	49.5 Å²	49.5	35%	0.346	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	161.8	-179.9	-172.2	172.9	105.1	0	0	111.1	P697 H698 L699 M769	P697-E776 WeakPolarHBondContact O-CB 3.22Å; H698-E776 VanDerWaalsContact CA-OE1 3.31Å; H698-E776 WeakPolarHBondContact CA-OE1 3.36Å; L699-E776 PolarHBondContact N-OE1 2.85Å; L699-E776 VanDerWaalsContact N-OE1 3.16Å; M769-E776 HydrophobicContact CE-CB 3.95Å; M769-E776 HydrophobicContact CE-CG 3.8Å; M769-E776 PolarHBondContact N-O 3.25Å; M769-E776 PolarHBondContact O-N 2.91Å
777	R	92.6	Very high	87.9	Confident	146 Å²	146	57.6 Å²	57.6	55%	0.551	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.2	175.4	-71.7	174.6	-174.4	73.9	-1.2	110.8	T766 C767 L768	T766-R777 HydrophobicContact CG2-CB 4.11Å; T766-R777 HydrophobicContact CG2-CG 4.15Å; C767-R777 VanDerWaalsContact O-CA 3.31Å; C767-R777 WeakPolarHBondContact O-CA 3.07Å; L768-R777 HydrophobicContact CD1-CG 3.55Å
778	A	92	Very high	85.4	Confident	11 Å²	11	69.1 Å²	69.1	9%	0.091	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	155	168.9	0	0	0	0	0	110.1	L699 M703 T766 C767 M769	L699-A778 HydrophobicContact CD1-CB 4.19Å; L699-A778 HydrophobicContact CD2-CB 3.72Å; L699-A778 HydrophobicContact CG-CB 4.43Å; M703-A778 HydrophobicContact CG-CB 3.94Å; M703-A778 VanDerWaalsContact SD-C 3.55Å; M703-A778 HydrophobicContact SD-CB 3.41Å; M703-A778 WeakPolarHBondContact SD-CB 3.3Å; T766-A778 CarbonylContact C-O 3.59Å; T766-A778 VanDerWaalsContact CA-O 3.27Å; T766-A778 WeakPolarHBondContact CA-O 3.27Å; C767-A778 PolarHBondContact N-O 3.43Å; C767-A778 PolarHBondContact O-N 3.43Å; M769-A778 HydrophobicContact CE-CB 3.88Å
779	H	93.5	Very high	82.8	Confident	90 Å²	90	70.8 Å²	70.8	42%	0.417	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.4	-169.3	-55.2	-63.5	0	0	0	112	M703 R764 Y765 T766	M703-H779 WeakPolarHBondContact CB-O 3.37Å; R764-H779 HydrophobicContact CG-CB 4.41Å; Y765-H779 WeakPolarHBondContact O-CA 3.41Å; T766-H779 VanDerWaalsContact CG2-CE1 3.45Å; T766-H779 WeakPolarHBondContact CG2-CE1 3.37Å; T766-H779 WeakPolarHBondContact CG2-ND1 3.37Å; T766-H779 PolarHBondContact OG1-CE1 3.49Å; T766-H779 PolarHBondContact OG1-ND1 3.14Å
780	S	93.4	Very high	79.9	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.014	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	134.7	167.1	167.1	0	0	0	0	109.1	E704 Y765	E704-S780 PolarHBondContact O-OG 2.91Å; Y765-S780 PolarHBondContact N-O 3.46Å; Y765-S780 PolarHBondContact O-N 2.79Å
781	Q	93.2	Very high	76.9	Confident	86 Å²	86	82.4 Å²	82.4	40%	0.402	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.5	173.2	-172.1	61.5	48	0	0	109.8	D705 R706 G763	D705-Q781 WeakPolarHBondContact OD1-CB 3.43Å; D705-Q781 PolarHBondContact OD1-N 2.03Å; R706-Q781 PolarHBondContact N-O 2.82Å; G763-Q781 VanDerWaalsContact C-NE2 3.3Å; G763-Q781 PolarHBondContact O-NE2 2.81Å
782	L	92.6	Very high	74.1	Confident	0 Å²	0	85 Å²	85	0%	0	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.1	169.4	-176.8	53.2	0	0	0	109.7	R706 V708 V714 I754 D761 A762 G763 Y765 V784	R706-L782 HydrophobicContact CB-CD1 3.93Å; R706-L782 WeakPolarHBondContact O-CA 3.49Å; V708-L782 HydrophobicContact CG1-CD1 3.85Å; V714-L782 HydrophobicContact CB-CD1 4.45Å; V714-L782 HydrophobicContact CG1-CD1 4.07Å; V714-L782 HydrophobicContact CG1-CD2 3.87Å; V714-L782 HydrophobicContact CG2-CD1 3.96Å; I754-L782 HydrophobicContact CD1-CD2 3.87Å; D761-L782 HydrophobicContact CB-CD2 4.46Å; D761-L782 WeakPolarHBondContact O-CD2 3.44Å; A762-L782 WeakPolarHBondContact CA-O 3.48Å; G763-L782 PolarHBondContact N-O 3.33Å; G763-L782 VanDerWaalsContact N-O 3.09Å; G763-L782 PolarHBondContact O-N 3.15Å; Y765-L782 HydrophobicContact CD2-CB 3.91Å; Y765-L782 HydrophobicContact CD2-CD2 4.46Å; Y765-L782 HydrophobicContact CE2-CB 3.85Å; Y765-L782 HydrophobicContact CE2-CD2 3.79Å; Y765-L782 HydrophobicContact CE2-CG 4.44Å; L782-V784 HydrophobicContact CG-CG2 4.34Å
783	A	89.5	Confident	71.5	Confident	43 Å²	43	88.4 Å²	88.4	36%	0.355	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.3	169.5	0	0	0	0	0	109.9	R706 S707 V708	R706-A783 PolarHBondContact O-N 3.39Å; S707-A783 WeakPolarHBondContact CA-O 3.02Å; V708-A783 PolarHBondContact N-O 2.04Å
784	V	87.6	Confident	68.9	Low	26 Å²	26	95.9 Å²	95.9	16%	0.158	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.2	179.5	-174.6	0	0	0	0	109.5	V708 V710 A757 S758 A762 L782	V708-V784 HydrophobicContact CG1-CG1 4.48Å; V708-V784 HydrophobicContact CG1-CG2 3.91Å; V708-V784 CarbonylContact O-C 3.43Å; V708-V784 VanDerWaalsContact O-CA 3.3Å; V708-V784 WeakPolarHBondContact O-CA 3.44Å; V710-V784 HydrophobicContact CB-CG1 4.48Å; V710-V784 HydrophobicContact CG2-CG1 3.67Å; A757-V784 HydrophobicContact CB-CG1 4.4Å; A757-V784 HydrophobicContact CB-CG2 4.44Å; S758-V784 WeakPolarHBondContact O-CG2 3.39Å; A762-V784 HydrophobicContact CB-CB 4.4Å; A762-V784 HydrophobicContact CB-CG2 4.09Å; L782-V784 HydrophobicContact CG-CG2 4.34Å
785	T	83.2	Confident	66.2	Low	68 Å²	68	99.4 Å²	99.4	42%	0.417	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	141	-170.5	55.6	0	0	0	0	112.7	V708 A709 V710	V708-T785 PolarHBondContact O-N 3.44Å; V708-T785 PolarHBondContact O-OG1 3.36Å; A709-T785 WeakPolarHBondContact CA-O 3.37Å; V710-T785 PolarHBondContact N-O 3.04Å
786	Q	68	Low	63.4	Low	161 Å²	161	99.9 Å²	99.9	75%	0.752	56%	0.56	S	S	*	*			trans	-89	128.5	174.3	-70	-175.2	-3.2	0	0	110.8	V710 R788	V710-Q786 HydrophobicContact CG2-CG 4.09Å; Q786-R788 PolarHBondContact O-N 3.02Å; Q786-R788 VanDerWaalsContact O-N 3.15Å
787	H	48.3	Very low	60.6	Low	171 Å²	171	99.9 Å²	99.9	79%	0.792	58%	0.58	S	S	*	*			trans	-70.3	108	173.4	-106.7	-62	0	0	0	111.3
788	R	41.6	Very low	57.8	Low	242 Å²	242	100.5 Å²	100.5	91%	0.913	59%	0.594	S	S	*	*			trans	-87.8	139.8	148.8	-75.5	-175	171.4	-176.9	-2.3	108.2	Q786	Q786-R788 PolarHBondContact O-N 3.02Å; Q786-R788 VanDerWaalsContact O-N 3.15Å
789	G	38	Very low	55.1	Low	68 Å²	68	104 Å²	104	70%	0.701	62%	0.623	S	S	*	*			trans	-104.3	-163.5	-170.7	0	0	0	0	0	115.1
790	V	33.4	Very low	52.7	Low	150 Å²	150	106.7 Å²	106.7	91%	0.909	64%	0.639	S	S	*	*			trans	95	129.1	-177.7	-172.3	0	0	0	0	115.2
791	C	30	Very low	50.1	Low	121 Å²	121	114.2 Å²	114.2	82%	0.818	68%	0.677	S	S	*	*			trans	-62.4	177.2	-173	-47.1	0	0	0	0	114.8
792	A	32	Very low	47.2	Very low	83 Å²	83	113.4 Å²	113.4	69%	0.686	69%	0.692	S	S	*	*			cis	-158.5	164.5	21.7	0	0	0	0	0	115.1
793	Q	34.5	Very low	44.8	Very low	184 Å²	184	121 Å²	121	86%	0.86	73%	0.731	S	S	*	*			trans	27.6	139.1	143.5	-63	179.8	-7	0	0	120
794	Q	32.6	Very low	42.3	Very low	185 Å²	185	126.3 Å²	126.3	86%	0.864	75%	0.752	S	S	*	*			cis	-135.6	178.3	15.5	-59	175.7	-31.5	0	0	109.4
795	A	30.4	Very low	39.9	Very low	101 Å²	101	131.4 Å²	131.4	84%	0.835	78%	0.783	S	S	*	*			cis	-140.5	171.4	8	0	0	0	0	0	111
796	G	32.4	Very low	37.8	Very low	85 Å²	85	135.2 Å²	135.2	88%	0.876	80%	0.799	S	S	*	*			trans	-98.4	168.5	-162.9	0	0	0	0	0	117.9
797	G	33.4	Very low	36.2	Very low	74 Å²	74	132 Å²	132	76%	0.763	80%	0.8	S	S	*	*			trans	174.6	91	174.3	0	0	0	0	0	112.7
798	N	34.6	Very low	35.5	Very low	160 Å²	160	130 Å²	130	86%	0.856	80%	0.799	S	S	*	*			trans	-66.8	138.3	177.2	-66.4	-10.7	0	0	0	110.3
799	A	35.3	Very low	35.3	Very low	85 Å²	85	124.7 Å²	124.7	70%	0.702	79%	0.794	S	S	*	*				65.5	136.9	63.2	0	0	0	0	0	112.5
800	I	41.9	Very low	35.3	Very low	145 Å²	145	127.3 Å²	127.3	74%	0.744	80%	0.796	S	S	*	*			cis	-166.8	159.2	13	-142.2	170.7	0	0	0	112.9
801	I	38.7	Very low	35.6	Very low	160 Å²	160	126 Å²	126	82%	0.821	79%	0.793	S	S	*	*			trans	55	143.5	156.2	-70.5	156.3	0	0	0	122.3
802	G	33.4	Very low	36.5	Very low	69 Å²	69	128 Å²	128	71%	0.711	79%	0.794	S	S	*	*			trans	166.3	109.7	150.3	0	0	0	0	0	116.4
803	I	42.8	Very low	36.9	Very low	160 Å²	160	130.6 Å²	130.6	82%	0.821	80%	0.802	S	S	*	*			trans	-136.1	139	168	-62.8	178.4	0	0	0	108.9
804	I	36.5	Very low	37.3	Very low	155 Å²	155	127.5 Å²	127.5	80%	0.795	80%	0.795	S	S	*	*			trans	-130.9	141.2	175.1	-63.9	177.2	0	0	0	109.1	I806	I804-I806 HydrophobicContact CG2-CG1 4.35Å
805	V	36.3	Very low	38	Very low	132 Å²	132	124.4 Å²	124.4	80%	0.8	79%	0.789	S	S	*	*			trans	-115.2	139	174.9	177.8	0	0	0	0	108.8
806	I	39.1	Very low	38.7	Very low	149 Å²	149	125.2 Å²	125.2	76%	0.764	79%	0.788	S	S	*	*			trans	-128.5	137.9	172.8	-59.8	179.4	0	0	0	108.2	I804	I804-I806 HydrophobicContact CG2-CG1 4.35Å
807	A	34.3	Very low	39.1	Very low	92 Å²	92	129.2 Å²	129.2	76%	0.76	79%	0.789	S	S	*	*			trans	-119.7	145	174.9	0	0	0	0	0	110.2
808	V	34.3	Very low	39.2	Very low	130 Å²	130	131.8 Å²	131.8	79%	0.788	79%	0.789	S	S	*	*			trans	-138.1	140.1	172.8	-178.8	0	0	0	0	108.1
809	V	37.1	Very low	39.3	Very low	131 Å²	131	135.1 Å²	135.1	79%	0.794	79%	0.79	S	S	*	*			trans	-135.6	130.3	-178.8	175.3	0	0	0	0	109.4
810	T	38.3	Very low	39.3	Very low	123 Å²	123	136.5 Å²	136.5	76%	0.755	79%	0.79	S	S	*	*			trans	-146.2	125.7	161.2	48.9	0	0	0	0	111.8
811	S	39.1	Very low	39	Very low	121 Å²	121	135 Å²	135	85%	0.846	79%	0.791	S	S	*	*			trans	72.5	144.3	155.8	-54.7	0	0	0	0	119.3
812	I	48.8	Very low	38.9	Very low	163 Å²	163	134.5 Å²	134.5	84%	0.836	79%	0.788	S	S	*	*			trans	-117.1	123.1	-172.2	-63.5	164.3	0	0	0	109.8
813	V	41.3	Very low	39.1	Very low	139 Å²	139	138.4 Å²	138.4	84%	0.842	79%	0.791	S	S	*	*			trans	-142.5	132	138.5	-174.8	0	0	0	0	109.4
814	V	42.4	Very low	38.6	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.715	79%	0.787	S	S	*	*	S	Bend	trans	-23.9	132.6	159.7	172.2	0	0	0	0	114.7
815	T	47.2	Very low	38.4	Very low	120 Å²	120	141.2 Å²	141.2	74%	0.736	79%	0.79	S	S	*	*	S	Bend	cis	-158.6	116	-5.1	21.2	0	0	0	0	110.4
816	S	45.2	Very low	38.1	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	78%	0.783	S	S	*	*			trans	166.3	115.3	145.5	-80	0	0	0	0	109.1
817	L	40.8	Very low	37.7	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	79%	0.791	S	S	*	*			trans	-103.9	114.9	-179.5	-73.1	171	0	0	0	110.9
818	V	36.5	Very low	37.4	Very low	129 Å²	129	150 Å²	150	78%	0.782	80%	0.798	S	S	*	*			trans	-98.1	127.1	171.3	-179.7	0	0	0	0	109	V820	V818-V820 HydrophobicContact CG1-CG2 4.31Å
819	W	36	Very low	37.2	Very low	230 Å²	230	151.2 Å²	151.2	87%	0.871	79%	0.792	S	S	*	*			trans	-90.1	130.1	173.6	-74.3	73.9	0	0	0	110.3
820	V	34.8	Very low	36.7	Very low	114 Å²	114	150.6 Å²	150.6	69%	0.691	79%	0.794	S	S	*	*			trans	-122.6	111.6	175.8	-177.8	0	0	0	0	109.1	V818 I822	V818-V820 HydrophobicContact CG1-CG2 4.31Å; V820-I822 HydrophobicContact CG1-CG1 4.12Å
821	C	36.1	Very low	36.4	Very low	113 Å²	113	151.3 Å²	151.3	76%	0.764	79%	0.788	S	S	*	*			trans	-102.7	104.7	175.4	-65.4	0	0	0	0	109.9
822	I	37.5	Very low	35.8	Very low	150 Å²	150	154.1 Å²	154.1	77%	0.769	79%	0.788	S	S	*	*			trans	-87	118.5	174.4	-57.4	178.8	0	0	0	108.7	V820	V820-I822 HydrophobicContact CG1-CG1 4.12Å
823	I	37.8	Very low	34.7	Very low	150 Å²	150	151.9 Å²	151.9	77%	0.769	79%	0.786	S	S	*	*			trans	-100	124.9	170.3	-60.2	177.4	0	0	0	108.1
824	Y	32.2	Very low	34	Very low	189 Å²	189	149.9 Å²	149.9	74%	0.741	78%	0.778	S	S	*	*			trans	-111.6	123.6	-179.2	-167.7	-115.9	0	0	0	110.1	T826	Y824-T826 HydrophobicContact CD1-CG2 4.29Å; Y824-T826 HydrophobicContact CE1-CG2 3.44Å; Y824-T826 VanDerWaalsContact CE1-CG2 3.44Å
825	Q	30.4	Very low	33.4	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	78%	0.781	S	S	*	*			trans	-118.3	112.1	170.1	-76.6	-165.8	-0.9	0	0	110.2
826	T	30.7	Very low	32.4	Very low	104 Å²	104	151 Å²	151	64%	0.638	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-92.3	120	169.5	24	0	0	0	0	111	Y824	Y824-T826 HydrophobicContact CD1-CG2 4.29Å; Y824-T826 HydrophobicContact CE1-CG2 3.44Å; Y824-T826 VanDerWaalsContact CE1-CG2 3.44Å
827	R	30.8	Very low	31.5	Very low	251 Å²	251	152.3 Å²	152.3	95%	0.947	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-82.6	137.4	151.8	-82.5	-173.3	168.4	-168.1	-3.2	108.7
828	K	28.6	Very low	31	Very low	204 Å²	204	151.1 Å²	151.1	89%	0.887	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-102	148.7	178.1	-168.2	177.6	177	-173.4	0	111.2
829	K	30.7	Very low	30.6	Very low	155 Å²	155	152.2 Å²	152.2	67%	0.674	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-47.2	150.1	177.6	-73.1	172.9	156.3	-172.5	0	116.4	E831	K829-E831 HydrophobicContact CB-CB 4.08Å; K829-E831 HydrophobicContact CD-CB 4.23Å; K829-E831 WeakPolarHBondContact CD-OE1 3.3Å; K829-E831 WeakPolarHBondContact CE-OE1 3.01Å; K829-E831 IonicContact NZ-OE1 3.2Å; K829-E831 PolarHBondContact NZ-OE1 2.9Å
830	S	25.6	Very low	30.2	Very low	118 Å²	118	149.1 Å²	149.1	83%	0.825	78%	0.779	S	S	*	*				-128.3	135	108.1	53.5	0	0	0	0	107
831	E	32.4	Very low	30	Very low	137 Å²	137	148.8 Å²	148.8	64%	0.64	78%	0.777	S	S	*	*			cis	76.7	112.6	14.9	-163.1	165	-97.3	0	0	116.4	K829	K829-E831 HydrophobicContact CB-CB 4.08Å; K829-E831 HydrophobicContact CD-CB 4.23Å; K829-E831 WeakPolarHBondContact CD-OE1 3.3Å; K829-E831 WeakPolarHBondContact CE-OE1 3.01Å; K829-E831 IonicContact NZ-OE1 3.2Å; K829-E831 PolarHBondContact NZ-OE1 2.9Å
832	E	26.9	Very low	29.5	Very low	181 Å²	181	150.3 Å²	150.3	85%	0.846	78%	0.776	S	S	*	*			trans	-159.8	138.3	139.4	-118.5	178.2	-165.9	0	0	111.6
833	C	25.6	Very low	29.2	Very low	116 Å²	116	149.4 Å²	149.4	78%	0.784	78%	0.777	S	S	*	*			trans	47	143.1	153.8	-64.8	0	0	0	0	122.9
834	S	26.5	Very low	29.8	Very low	97 Å²	97	147.4 Å²	147.4	68%	0.678	77%	0.774	S	S	*	*			cis	-171.1	139.5	-7.7	49.2	0	0	0	0	113
835	V	29.4	Very low	30.8	Very low	130 Å²	130	143.2 Å²	143.2	79%	0.788	77%	0.77	S	S	*	*			trans	47.4	122.7	137.9	-172.9	0	0	0	0	118.3
836	T	25.7	Very low	30.8	Very low	130 Å²	130	140.9 Å²	140.9	80%	0.798	76%	0.764	S	S	*	*				-148.4	164.8	77.8	45	0	0	0	0	116.7
837	N	27.1	Very low	30.7	Very low	147 Å²	147	142 Å²	142	79%	0.786	77%	0.77	S	S	*	*			trans	-66.8	174.2	169.1	-49.7	-25.3	0	0	0	111.3
838	T	30.6	Very low	31.5	Very low	143 Å²	143	135 Å²	135	88%	0.877	76%	0.757	S	S	*	*			cis	-146.9	177.9	49.8	48.4	0	0	0	0	116.4
839	D	27.2	Very low	31.8	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	75%	0.747	S	S	*	*			trans	-86.6	-165.2	-170	-147.8	-32.9	0	0	0	114
840	E	27.7	Very low	31.9	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	75%	0.754	S	S	*	*			trans	91.1	85.7	159.1	-73.8	-178	-161.3	0	0	121.3
841	T	29.8	Very low	32.2	Very low	107 Å²	107	134 Å²	134	66%	0.656	75%	0.752	S	S	*	*				60.5	128.5	114.2	54	0	0	0	0	125.1
842	I	27.4	Very low	32.3	Very low	145 Å²	145	131.9 Å²	131.9	74%	0.744	75%	0.752	S	S	*	*				87.8	103.8	127.9	-69.9	170.1	0	0	0	121.1
843	V	29.9	Very low	32.7	Very low	131 Å²	131	128.1 Å²	128.1	79%	0.794	75%	0.746	S	S	*	*			trans	75.7	148.5	130.3	175.3	0	0	0	0	120.3
844	P	50.9	Low	32.9	Very low	108 Å²	108	132.2 Å²	132.2	70%	0.701	75%	0.754	S	S	*	*			trans	-109.1	-158.3	-165.7	42.1	-25.6	0	0	0	111.8
845	P	53.4	Low	33	Very low	100 Å²	100	130.6 Å²	130.6	65%	0.649	75%	0.752	S	S	*	*			cis	-146.9	-170	7.6	45.4	-23.7	0	0	0	119.5
846	D	30.5	Very low	33	Very low	137 Å²	137	131.2 Å²	131.2	73%	0.733	76%	0.757	S	S	*	*			trans	77.7	113.3	145	-66.6	-24.2	0	0	0	125.6
847	V	27.7	Very low	33	Very low	127 Å²	127	132.7 Å²	132.7	77%	0.77	76%	0.758	S	S	*	*				55.7	141.7	114.2	173	0	0	0	0	120.7
848	P	48.8	Very low	33.1	Very low	105 Å²	105	130.2 Å²	130.2	68%	0.682	75%	0.753	S	S	*	*			cis	-146.5	-171.3	-25.6	42.3	-21.5	0	0	0	117.8
849	S	33.5	Very low	33	Very low	96 Å²	96	130.1 Å²	130.1	67%	0.671	74%	0.742	S	S	*	*			trans	98.8	148.6	137.7	75.7	0	0	0	0	126.3
850	Y	32.9	Very low	33.1	Very low	209 Å²	209	132.2 Å²	132.2	82%	0.82	74%	0.739	S	S	*	*			trans	98.7	131.2	150.2	-78.9	-60.9	0	0	0	127.1
851	L	32.7	Very low	33.3	Very low	149 Å²	149	132 Å²	132	78%	0.78	74%	0.738	S	S	*	*			trans	83.8	116.8	135.8	-81.5	164.3	0	0	0	128.7
852	S	33.4	Very low	33.4	Very low	93 Å²	93	131.7 Å²	131.7	65%	0.65	73%	0.732	S	S	*	*				66.7	110.5	124	68.1	0	0	0	0	129.2
853	S	35.3	Very low	34.1	Very low	102 Å²	102	132.9 Å²	132.9	71%	0.713	74%	0.737	S	S	*	*				56.9	134.8	116.6	72.9	0	0	0	0	128.4
854	Q	30.6	Very low	34	Very low	203 Å²	203	132 Å²	132	95%	0.949	74%	0.735	S	S	*	*			trans	61.5	150.5	149.6	-64.6	-179.3	9.2	0	0	120.7
855	G	29	Very low	33.1	Very low	63 Å²	63	134.6 Å²	134.6	65%	0.649	74%	0.741	S	S	*	*			cis	161.1	124	-15.6	0	0	0	0	0	116.7
856	T	28.1	Very low	32.2	Very low	143 Å²	143	141 Å²	141	88%	0.877	75%	0.752	S	S	*	*			trans	57.9	157.3	159.5	55	0	0	0	0	120.1
857	L	27	Very low	32.2	Very low	160 Å²	160	140.1 Å²	140.1	84%	0.838	75%	0.752	S	S	*	*			cis	-162.8	141.4	9	-136.1	165.9	0	0	0	110.9
858	S	28.6	Very low	32.2	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	76%	0.755	S	S	*	*			trans	-169.3	155.8	148.2	-157.4	0	0	0	0	113.2
859	E	29.6	Very low	31.3	Very low	141 Å²	141	142.5 Å²	142.5	66%	0.659	76%	0.763	S	S	*	*			trans	8.5	155.2	152.8	-68.6	-168.1	123.4	0	0	122
860	R	28.4	Very low	31	Very low	196 Å²	196	141.9 Å²	141.9	74%	0.74	77%	0.772	S	S	*	*			cis	-175.5	144.4	-14.5	-117.1	178.3	173.7	152.8	-10.1	105.7
861	Q	32	Very low	30.7	Very low	163 Å²	163	136 Å²	136	76%	0.762	78%	0.775	S	S	*	*			trans	60.4	155.1	165.1	-58	-170.1	-96.4	0	0	117.9
862	D	31	Very low	30.7	Very low	100 Å²	100	132.5 Å²	132.5	54%	0.535	78%	0.775	S	S	.	*			cis	-152.4	133.1	-32.3	-99.1	-23	0	0	0	107.8
863	M	43.3	Very low	31.2	Very low	170 Å²	170	134.5 Å²	134.5	84%	0.837	79%	0.786	S	S	*	*			cis	-150.6	85.6	-16.6	-152.5	-169.7	-64.8	0	0	105.8
864	C	28.2	Very low	31.2	Very low	112 Å²	112	137.1 Å²	137.1	76%	0.757	79%	0.787	S	S	*	*			trans	-147.4	163.6	-133.6	-131.8	0	0	0	0	117.2
865	I	32.2	Very low	32	Very low	163 Å²	163	133.3 Å²	133.3	84%	0.836	78%	0.78	S	S	*	*			trans	84.2	149.8	153	-71.4	163.4	0	0	0	119.3
866	R	33.6	Very low	32.1	Very low	233 Å²	233	137.2 Å²	137.2	88%	0.879	79%	0.786	S	S	*	*			trans	-97.5	179.6	178.7	-72.1	168.8	153.6	173.6	-8.5	111
867	V	29.8	Very low	32	Very low	119 Å²	119	133.6 Å²	133.6	72%	0.721	78%	0.776	S	S	*	*			trans	124.1	118.7	141.7	176.9	0	0	0	0	116
868	E	27.8	Very low	32	Very low	180 Å²	180	134.7 Å²	134.7	84%	0.841	78%	0.777	S	S	*	*			trans	49.1	133.7	144.8	-64.2	166.6	-176.6	0	0	126.2
869	A	29.8	Very low	32.3	Very low	102 Å²	102	136.4 Å²	136.4	84%	0.843	78%	0.783	S	S	*	*				70.1	124.5	129.5	0	0	0	0	0	124.8
870	G	27.7	Very low	32.2	Very low	84 Å²	84	136.3 Å²	136.3	87%	0.866	79%	0.792	S	S	*	*				115.2	133.1	118.8	0	0	0	0	0	120.4
871	G	27.6	Very low	32.3	Very low	85 Å²	85	134.4 Å²	134.4	88%	0.876	80%	0.796	S	S	*	*			trans	113.6	138.3	149.5	0	0	0	0	0	119.5
872	G	31.8	Very low	32	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	80%	0.8	S	S	*	*			trans	-101.2	-158.8	156.7	0	0	0	0	0	111
873	P	43.1	Very low	32	Very low	134 Å²	134	132.7 Å²	132.7	87%	0.87	82%	0.816	S	S	*	*			cis	-142	-164	22.8	43.7	-23.8	0	0	0	115.8
874	Q	36.6	Very low	31.2	Very low	158 Å²	158	128 Å²	128	74%	0.738	81%	0.812	S	S	*	*			trans	-94.4	167	167.9	-141.1	177.8	15.2	0	0	110.8
875	P	47.9	Very low	31.3	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	82%	0.816	S	S	*	*				-155.1	-165.2	91.1	41.5	-20.7	0	0	0	116.3
876	N	29.3	Very low	31.2	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	82%	0.816	S	S	*	*			trans	-99.5	170.8	-168.8	-47.6	-53.8	0	0	0	115.3
877	G	27.2	Very low	31	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	81%	0.813	S	S	*	*			trans	170.3	111.9	154.7	0	0	0	0	0	120
878	H	26.6	Very low	31	Very low	184 Å²	184	123.3 Å²	123.3	85%	0.852	82%	0.818	S	S	*	*			trans	54.7	101.5	148.1	-69.5	-79.4	0	0	0	124.5
879	V	35.4	Very low	31.1	Very low	130 Å²	130	121.3 Å²	121.3	79%	0.788	82%	0.818	S	S	*	*				18.6	120.6	115.2	-174.3	0	0	0	0	119.7
880	V	27.4	Very low	31	Very low	139 Å²	139	121.6 Å²	121.6	84%	0.842	81%	0.809	S	S	*	*			trans	-148.3	146.8	135.2	-172.5	0	0	0	0	108.7
881	D	29.5	Very low	30.8	Very low	156 Å²	156	124 Å²	124	83%	0.834	81%	0.811	S	S	*	*			trans	-70.9	144.8	172.6	-71.7	-70.7	0	0	0	114.1
882	A	27.4	Very low	30.9	Very low	102 Å²	102	125.5 Å²	125.5	84%	0.843	80%	0.803	S	S	*	*			trans	-165.6	139.9	141.1	0	0	0	0	0	112.9
883	S	29.7	Very low	30.8	Very low	125 Å²	125	129.3 Å²	129.3	87%	0.874	81%	0.805	S	S	*	*			trans	-68.9	149.7	173.2	53.6	0	0	0	0	114.8
884	G	27.5	Very low	29.9	Very low	72 Å²	72	129 Å²	129	74%	0.742	81%	0.805	S	S	*	*			trans	171.1	93.8	161.1	0	0	0	0	0	118.7
885	F	29.4	Very low	29.5	Very low	193 Å²	193	128.3 Å²	128.3	85%	0.846	80%	0.804	S	S	*	*			trans	30.6	133.8	144.1	-80.5	-90.5	0	0	0	124.3
886	D	30.7	Very low	28.6	Very low	156 Å²	156	130.2 Å²	130.2	83%	0.834	80%	0.802	S	S	*	*			trans	59	156.5	139	-73.7	-10.4	0	0	0	123.3
887	G	28.8	Very low	28.6	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	81%	0.811	S	S	*	*			trans	121.2	80.9	151.3	0	0	0	0	0	116.6
888	A	31	Very low	28.7	Very low	101 Å²	101	130.8 Å²	130.8	84%	0.835	81%	0.81	S	S	*	*			trans	-89	141.6	156.7	0	0	0	0	0	110
889	V	28.7	Very low	28.8	Very low	138 Å²	138	129.9 Å²	129.9	84%	0.836	81%	0.812	S	S	*	*			trans	-163.8	128.2	153.8	127.1	0	0	0	0	112.9
890	V	27.1	Very low	28.5	Very low	108 Å²	108	127.4 Å²	127.4	66%	0.655	80%	0.8	S	S	*	*			trans	20.3	137.6	142.3	-170.3	0	0	0	0	121.2	T892	V890-T892 HydrophobicContact CG1-CG2 3.8Å
891	C	25	Very low	28.4	Very low	135 Å²	135	131.5 Å²	131.5	91%	0.912	80%	0.802	S	S	*	*			trans	-125	146.1	144.7	-78.1	0	0	0	0	110.2
892	T	28.9	Very low	28.4	Very low	116 Å²	116	128.3 Å²	128.3	71%	0.712	79%	0.792	S	S	*	*			trans	-142.3	137.4	179.9	42.6	0	0	0	0	112.4	V890	V890-T892 HydrophobicContact CG1-CG2 3.8Å
893	D	28.9	Very low	28.4	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	79%	0.787	S	S	*	*			trans	23.7	131.4	153.8	-56.2	-25.2	0	0	0	123.2
894	C	26	Very low	28.3	Very low	127 Å²	127	131 Å²	131	86%	0.858	78%	0.782	S	S	*	*			trans	-154	114.1	133.4	-91	0	0	0	0	107.1
895	M	27.4	Very low	28.3	Very low	145 Å²	145	132.5 Å²	132.5	71%	0.714	79%	0.788	S	S	*	*				95.1	104.2	67.4	-82.4	-67.6	-71.2	0	0	113.9
896	E	29.4	Very low	28.2	Very low	162 Å²	162	126.3 Å²	126.3	76%	0.757	78%	0.779	S	S	*	*			trans	47.4	127.5	145.9	-59.8	-172	141.4	0	0	123.5
897	T	29.5	Very low	28.3	Very low	158 Å²	158	129.2 Å²	129.2	97%	0.969	78%	0.78	S	S	*	*				-162.6	162	121.3	9.8	0	0	0	0	109.6
898	G	27.5	Very low	28.2	Very low	65 Å²	65	132.8 Å²	132.8	67%	0.67	78%	0.779	S	S	*	*			trans	-168.2	-164.6	-175.7	0	0	0	0	0	115.2
899	N	30.2	Very low	28.1	Very low	166 Å²	166	132.4 Å²	132.4	89%	0.888	77%	0.767	S	S	*	*			trans	68.5	153.9	-176.9	-70.4	-23.1	0	0	0	116.4
900	S	27.8	Very low	28.1	Very low	77 Å²	77	133 Å²	133	54%	0.538	76%	0.76	S	S	.	*			cis	-177.4	153	-22.8	56.7	0	0	0	0	110.8
901	Y	26.6	Very low	28.3	Very low	225 Å²	225	130.7 Å²	130.7	88%	0.882	76%	0.758	S	S	*	*			trans	62.3	159.3	161.7	-64.7	-63.3	0	0	0	117.3
902	S	28	Very low	28.6	Very low	90 Å²	90	134.8 Å²	134.8	63%	0.629	76%	0.756	S	S	*	*			cis	-166	164.6	-19.9	51.2	0	0	0	0	112.3
903	N	28.3	Very low	28.5	Very low	135 Å²	135	132.3 Å²	132.3	72%	0.722	75%	0.754	S	S	*	*			trans	71.6	112.2	152.1	-70.3	22.9	0	0	0	123.4
904	D	28.1	Very low	28.7	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	76%	0.758	S	S	*	*				83.4	148.7	119.3	-73.2	-47.1	0	0	0	125.3
905	A	27.9	Very low	29.3	Very low	105 Å²	105	131.8 Å²	131.8	87%	0.868	75%	0.754	S	S	*	*			trans	69.5	122.2	168.7	0	0	0	0	0	118.6
906	G	27.4	Very low	29.3	Very low	63 Å²	63	137.1 Å²	137.1	65%	0.649	77%	0.767	S	S	*	*			cis	167.6	151	-10.8	0	0	0	0	0	114.6
907	Y	32.1	Very low	29.3	Very low	217 Å²	217	133.1 Å²	133.1	85%	0.851	77%	0.769	S	S	*	*			trans	51.7	127.2	164.7	-66.3	-89	0	0	0	118.3
908	L	27.2	Very low	29.3	Very low	153 Å²	153	130.8 Å²	130.8	80%	0.801	77%	0.766	S	S	*	*				-152.5	137.3	66.7	-87.8	163.8	0	0	0	114.2
909	T	28.7	Very low	29.5	Very low	94 Å²	94	136.5 Å²	136.5	58%	0.577	78%	0.775	S	S	*	*			trans	14.9	147.6	136.5	58.1	0	0	0	0	121.1
910	H	28.8	Very low	29.3	Very low	150 Å²	150	140 Å²	140	69%	0.694	78%	0.778	S	S	*	*			cis	-157.5	155	6.8	-125.8	-60.4	0	0	0	110.6	Y912	H910-Y912 AromaticContact CE1-CE2 3.47Å; H910-Y912 VanDerWaalsContact CE1-CE2 3.47Å; H910-Y912 WeakPolarHBondContact CE1-CE2 3.05Å; H910-Y912 AromaticContact ND1-CE2 3.72Å
911	G	30.6	Very low	29.3	Very low	59 Å²	59	146.6 Å²	146.6	61%	0.608	79%	0.791	S	S	*	*			trans	-145.9	175.5	158.6	0	0	0	0	0	109.6
912	Y	30.4	Very low	29.5	Very low	221 Å²	221	143.2 Å²	143.2	87%	0.867	78%	0.783	S	S	*	*			trans	-151.1	141.4	168.5	-97.7	-64	0	0	0	114	H910	H910-Y912 AromaticContact CE1-CE2 3.47Å; H910-Y912 VanDerWaalsContact CE1-CE2 3.47Å; H910-Y912 WeakPolarHBondContact CE1-CE2 3.05Å; H910-Y912 AromaticContact ND1-CE2 3.72Å
913	G	26.7	Very low	29.5	Very low	65 Å²	65	146 Å²	146	67%	0.67	79%	0.786	S	S	*	*			trans	-151.5	138	163.6	0	0	0	0	0	110.6
914	L	33.5	Very low	29.5	Very low	175 Å²	175	146.1 Å²	146.1	92%	0.916	78%	0.782	S	S	*	*			trans	66.6	115.1	162.1	-60.4	172.7	0	0	0	120.9
915	A	38.6	Very low	29.6	Very low	95 Å²	95	146 Å²	146	79%	0.785	78%	0.777	S	S	*	*				68.3	125.9	127.6	0	0	0	0	0	122
916	R	28.8	Very low	29.6	Very low	257 Å²	257	148.1 Å²	148.1	97%	0.97	77%	0.769	S	S	*	*			trans	-148.9	151.9	143	-103.3	-179.1	-177.4	-171.6	0	109.5
917	G	29	Very low	29.6	Very low	79 Å²	79	152.5 Å²	152.5	81%	0.814	78%	0.776	S	S	*	*			trans	-117	175.4	173.4	0	0	0	0	0	112.1
918	A	28.5	Very low	29.1	Very low	108 Å²	108	144.7 Å²	144.7	89%	0.893	76%	0.762	S	S	*	*			trans	-150.9	159.9	173	0	0	0	0	0	111
919	E	31.7	Very low	29.9	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	76%	0.762	S	S	*	*			trans	-87.5	158.2	-175.9	-52	161.5	107.9	0	0	112.3
920	Y	26.7	Very low	30.6	Very low	239 Å²	239	143.7 Å²	143.7	94%	0.937	77%	0.766	S	S	*	*			trans	-156.7	165.3	149	-123.7	-84.2	0	0	0	113
921	R	27.8	Very low	30.5	Very low	215 Å²	215	147 Å²	147	81%	0.811	77%	0.772	S	S	*	*			trans	-106.2	149.5	-169.6	-71.7	179.9	175.6	164.4	-1.2	115.3
922	Q	30.2	Very low	30.3	Very low	155 Å²	155	154.4 Å²	154.4	72%	0.724	78%	0.784	S	S	*	*			trans	58.2	127.2	140.8	-77.1	-176.7	-29.9	0	0	122.6
923	Q	27.8	Very low	30.1	Very low	148 Å²	148	149.3 Å²	149.3	69%	0.692	78%	0.781	S	S	*	*			trans	67.1	146.9	141.6	-63.6	-172.8	18.4	0	0	117.6
924	Q	28.8	Very low	30.1	Very low	137 Å²	137	154.7 Å²	154.7	64%	0.64	79%	0.788	S	S	*	*			cis	-162.4	147.7	24.8	-144.3	170.6	75.5	0	0	111.4
925	Q	30.5	Very low	29.6	Very low	145 Å²	145	151.3 Å²	151.3	68%	0.678	78%	0.778	S	S	*	*			trans	59.7	147.9	147.1	-82.7	178.6	50	0	0	120.1
926	Q	27.3	Very low	29	Very low	150 Å²	150	154.1 Å²	154.1	70%	0.701	78%	0.78	S	S	*	*			cis	-152.2	166.9	4.5	-102.3	174.8	50.3	0	0	106.3
927	L	27.1	Very low	28.9	Very low	154 Å²	154	150.4 Å²	150.4	81%	0.806	78%	0.778	S	S	*	*			cis	-157.2	-162	-4.1	-130	173.6	0	0	0	109.3
928	G	22.9	Very low	28.7	Very low	53 Å²	53	150.2 Å²	150.2	55%	0.546	78%	0.776	S	S	.	*			trans	-152.3	-151.6	161.8	0	0	0	0	0	108.2
929	P	44.1	Very low	28.8	Very low	125 Å²	125	153 Å²	153	81%	0.812	77%	0.771	S	S	*	*			cis	-128.7	-135.1	-14.2	39.6	-17.7	0	0	0	108.6
930	P	42.3	Very low	29.1	Very low	101 Å²	101	150.3 Å²	150.3	66%	0.656	77%	0.77	S	S	*	*			cis	-137.5	177.9	-25.8	38.5	-19.4	0	0	0	117.2
931	R	27	Very low	29.2	Very low	219 Å²	219	148.9 Å²	148.9	83%	0.826	76%	0.762	S	S	*	*			trans	77.2	113.9	137.6	-87.1	168	-172.8	-149.5	1.9	124.6
932	Y	26.7	Very low	29.4	Very low	216 Å²	216	145.4 Å²	145.4	85%	0.847	76%	0.76	S	S	*	*				69.7	149.7	112.6	-96.4	-101.5	0	0	0	125.3
933	S	26.7	Very low	29.3	Very low	114 Å²	114	144 Å²	144	80%	0.797	76%	0.762	S	S	*	*			trans	96.1	162.9	141.3	68.8	0	0	0	0	121.8
934	Q	26.2	Very low	29.3	Very low	177 Å²	177	140.6 Å²	140.6	83%	0.827	77%	0.767	S	S	*	*			trans	-105.7	172.1	-157.5	-57.7	160.3	-82.8	0	0	113.9
935	C	22.7	Very low	29.3	Very low	105 Å²	105	138.9 Å²	138.9	71%	0.709	77%	0.77	S	S	*	*			trans	75.9	115	145	-75.4	0	0	0	0	122
936	N	26	Very low	29.3	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	78%	0.777	S	S	*	*				67.9	156	129	-84.3	5	0	0	0	123.2
937	L	27	Very low	29.4	Very low	179 Å²	179	137.2 Å²	137.2	94%	0.937	78%	0.776	S	S	*	*			trans	80.5	134.8	164.7	-66.8	163.6	0	0	0	118.9
938	G	23.7	Very low	29.5	Very low	75 Å²	75	136 Å²	136	77%	0.773	78%	0.781	S	S	*	*			trans	123.6	101	151.8	0	0	0	0	0	117.6
939	E	31.1	Very low	29.7	Very low	168 Å²	168	138 Å²	138	79%	0.785	79%	0.792	S	S	*	*			trans	-74.5	164.5	145.9	-59.5	-172.6	148.3	0	0	109.2
940	P	39.3	Very low	29.9	Very low	129 Å²	129	137.2 Å²	137.2	84%	0.838	79%	0.787	S	S	*	*				-141.3	-179.9	93.7	37.4	-22.3	0	0	0	115.1
941	R	28.6	Very low	29.2	Very low	208 Å²	208	139.5 Å²	139.5	79%	0.785	79%	0.793	S	S	*	*			trans	-89.1	166.4	-175.2	-55.8	168.1	-179.9	168.9	-2.8	113.1
942	D	30.4	Very low	29.1	Very low	142 Å²	142	134 Å²	134	76%	0.759	79%	0.787	S	S	*	*				161.9	153.5	125.8	-84	-9.4	0	0	0	111
943	T	29	Very low	29.2	Very low	125 Å²	125	131.8 Å²	131.8	77%	0.767	79%	0.79	S	S	*	*			cis	-159.6	143.5	-0.2	10.4	0	0	0	0	112
944	G	27.3	Very low	29.1	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	79%	0.79	S	S	*	*			trans	65.3	171.5	155.1	0	0	0	0	0	119.2
945	S	30.4	Very low	29.6	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	79%	0.792	S	S	*	*			cis	176.3	141.6	-20.8	54.9	0	0	0	0	106.1
946	H	29.4	Very low	30.7	Very low	176 Å²	176	129.7 Å²	129.7	82%	0.815	80%	0.799	S	S	*	*			cis	-161.7	140.9	35.7	-95.2	-78.3	0	0	0	107.1
947	A	29.5	Very low	31.1	Very low	84 Å²	84	134.9 Å²	134.9	69%	0.694	81%	0.807	S	S	*	*				83.3	143.6	80.8	0	0	0	0	0	117.5
948	S	28.3	Very low	31.3	Very low	129 Å²	129	129.6 Å²	129.6	90%	0.902	80%	0.796	S	S	*	*			trans	89.4	147.8	167.6	-54.3	0	0	0	0	120.5
949	A	27.3	Very low	31.6	Very low	93 Å²	93	133 Å²	133	77%	0.769	80%	0.797	S	S	*	*			trans	-148.9	-160.6	-179.3	0	0	0	0	0	108.1
950	P	50.2	Low	31.7	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	80%	0.799	S	S	*	*			cis	-136.6	-162	-14.5	36	-12.8	0	0	0	114.4
951	L	26.6	Very low	31.3	Very low	149 Å²	149	137.3 Å²	137.3	78%	0.78	79%	0.794	S	S	*	*			trans	85.2	116.6	153.8	-68.9	164.1	0	0	0	123.7
952	C	24.5	Very low	31.4	Very low	104 Å²	104	132.8 Å²	132.8	70%	0.703	79%	0.785	S	S	*	*			trans	67.4	133.7	131.9	-70.8	0	0	0	0	126.2
953	N	28.6	Very low	31.3	Very low	169 Å²	169	131.2 Å²	131.2	90%	0.904	78%	0.781	S	S	*	*			trans	72	136.1	147.6	-70.2	-4.6	0	0	0	122
954	G	25.7	Very low	31.3	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	78%	0.784	S	S	*	*			trans	145.3	121	154.3	0	0	0	0	0	116.2
955	T	36.4	Very low	31.2	Very low	140 Å²	140	138.8 Å²	138.8	86%	0.859	79%	0.787	S	S	*	*			trans	-123.5	156	163.5	52.1	0	0	0	0	110.6
956	P	45.3	Very low	31.1	Very low	134 Å²	134	138.7 Å²	138.7	87%	0.87	79%	0.786	S	S	*	*			trans	-130.5	175.7	152	34	-19.4	0	0	0	114
957	R	34.6	Very low	31	Very low	261 Å²	261	135.1 Å²	135.1	99%	0.985	79%	0.787	S	S	*	*			trans	-123.4	157.3	-171.6	-86.9	176.3	159	-178.1	-5.2	113.1
958	G	31.8	Very low	31.2	Very low	69 Å²	69	137.5 Å²	137.5	71%	0.711	79%	0.793	S	S	*	*			trans	153.7	135.6	158.8	0	0	0	0	0	111.4
959	N	29.3	Very low	31.8	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	79%	0.785	S	S	*	*			cis	-149.1	159	13.4	-109.7	-40.8	0	0	0	113
960	R	33.4	Very low	31.8	Very low	221 Å²	221	141 Å²	141	83%	0.834	79%	0.786	S	S	*	*			trans	11.5	142.8	148.3	-63.6	172.3	172.6	180	-3.5	119.1
961	K	31.4	Very low	30.8	Very low	166 Å²	166	141.9 Å²	141.9	72%	0.722	79%	0.785	S	S	*	*			cis	-160.8	-172.9	13.5	-126.8	170	161.2	-79	0	107.3
962	D	29.8	Very low	30.9	Very low	112 Å²	112	142 Å²	142	60%	0.599	78%	0.781	S	S	*	*			cis	-153.1	-150.5	9.4	-138.6	-25	0	0	0	113.8
963	T	28.9	Very low	31.1	Very low	110 Å²	110	142.5 Å²	142.5	68%	0.675	78%	0.777	S	S	*	*			trans	-77.6	154.6	-178.6	48	0	0	0	0	115.7
964	Q	28.9	Very low	31.1	Very low	178 Å²	178	139.6 Å²	139.6	83%	0.832	77%	0.765	S	S	*	*			cis	103.3	113.6	12.7	-173.5	-175.2	10.6	0	0	116.2
965	E	25.7	Very low	31.2	Very low	182 Å²	182	142.4 Å²	142.4	85%	0.85	76%	0.761	S	S	*	*			trans	174.9	138.2	148.4	-93.9	-175.7	169.2	0	0	105.6
966	S	27.3	Very low	30.8	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	75%	0.746	S	S	*	*			cis	110.1	113.5	15.7	73.5	0	0	0	0	113.7
967	A	27	Very low	30	Very low	101 Å²	101	144.3 Å²	144.3	84%	0.835	74%	0.74	S	S	*	*			trans	168.8	157.1	145.4	0	0	0	0	0	113.5
968	V	34.3	Very low	29.8	Very low	133 Å²	133	136.2 Å²	136.2	81%	0.806	72%	0.723	S	S	*	*			trans	-137.2	127.8	164.8	171.9	0	0	0	0	109.6
969	P	40.5	Very low	29.9	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	72%	0.723	S	S	*	*			trans	-120.3	142.1	139.6	2.5	19.6	0	0	0	110
970	K	28	Very low	30.1	Very low	182 Å²	182	138.8 Å²	138.8	79%	0.791	72%	0.715	S	S	*	*				77.1	105.8	55.1	-79.4	-168.5	172.4	-176	0	116
971	N	28.5	Very low	30.1	Very low	129 Å²	129	134.8 Å²	134.8	69%	0.69	71%	0.706	S	S	*	*			trans	52.7	158.1	131.9	-61.3	25.1	0	0	0	123.6
972	H	28.4	Very low	30.4	Very low	151 Å²	151	136.3 Å²	136.3	70%	0.699	71%	0.707	S	S	*	*			trans	73.3	139.4	158.4	-64.7	-63.4	0	0	0	116.8
973	D	29.8	Very low	30.6	Very low	114 Å²	114	140.3 Å²	140.3	61%	0.61	72%	0.72	S	S	*	*			cis	-136.9	154.6	-13.1	-95.7	-43.4	0	0	0	108.6
974	T	27.7	Very low	30.9	Very low	109 Å²	109	139.8 Å²	139.8	67%	0.669	73%	0.726	S	S	*	*				68	150.3	52.4	-23.4	0	0	0	0	114
975	I	27.4	Very low	31.1	Very low	137 Å²	137	134.8 Å²	134.8	70%	0.703	72%	0.722	S	S	*	*			trans	76.4	133	161.5	-77.9	154.5	0	0	0	117.6
976	E	28.1	Very low	31.7	Very low	119 Å²	119	138.1 Å²	138.1	56%	0.556	73%	0.727	S	S	*	*			cis	-174.8	165.5	-23.8	-128.7	-173.3	143	0	0	112
977	R	29.3	Very low	32	Very low	194 Å²	194	137.9 Å²	137.9	73%	0.732	73%	0.731	S	S	*	*			trans	68	161.4	150.7	-71.5	172.5	-161.9	168.4	20.2	117.6
978	S	31.3	Very low	32.2	Very low	92 Å²	92	136 Å²	136	64%	0.643	72%	0.721	S	S	*	*			cis	-146.3	140.3	17.5	61.1	0	0	0	0	115.9
979	H	33.2	Very low	32.4	Very low	151 Å²	151	138.7 Å²	138.7	70%	0.699	73%	0.725	S	S	*	*			trans	57.2	151.4	144.1	-60.1	-50.7	0	0	0	121
980	D	32.4	Very low	32	Very low	118 Å²	118	139.1 Å²	139.1	63%	0.631	73%	0.726	S	S	*	*			cis	-155.3	142.9	-21.2	-102.1	-7.3	0	0	0	106.1
981	E	34.8	Very low	32.2	Very low	137 Å²	137	135.8 Å²	135.8	64%	0.64	73%	0.725	S	S	*	*				43	140.8	89.6	-68.3	-150.4	149.3	0	0	115.4
982	R	36.3	Very low	32.4	Very low	198 Å²	198	134.5 Å²	134.5	75%	0.747	73%	0.732	S	S	*	*			cis	-168.3	139.3	30.6	-149.6	175.7	-105.7	-176.3	-6.2	110.3
983	K	35.4	Very low	32.4	Very low	197 Å²	197	131 Å²	131	86%	0.857	74%	0.737	S	S	*	*				163.3	144.5	93.5	-86.9	167.8	-178.7	169.4	0	106.9
984	A	35.5	Very low	33.9	Very low	98 Å²	98	131.5 Å²	131.5	81%	0.81	75%	0.746	S	S	*	*			cis	-148.7	-174	-2.5	0	0	0	0	0	107.9
985	G	31.8	Very low	35.3	Very low	73 Å²	73	131.3 Å²	131.3	75%	0.753	75%	0.747	S	S	*	*			cis	93.2	129.1	19.9	0	0	0	0	0	111.1
986	R	38.1	Very low	35.7	Very low	253 Å²	253	129.5 Å²	129.5	96%	0.955	75%	0.747	S	S	*	*			cis	-159.5	175.2	15.6	-113.6	-177.8	168.8	178.5	-4	108
987	A	33.8	Very low	36	Very low	95 Å²	95	131.7 Å²	131.7	79%	0.785	76%	0.757	S	S	*	*			cis	-165.5	175.5	-6	0	0	0	0	0	107.1
988	G	32	Very low	36.1	Very low	61 Å²	61	128.6 Å²	128.6	63%	0.629	76%	0.755	S	S	*	*			cis	151.9	135.4	-8.1	0	0	0	0	0	113.5
989	H	38.5	Very low	36	Very low	191 Å²	191	131.1 Å²	131.1	88%	0.884	76%	0.761	S	S	*	*			trans	75	155.1	176.8	-48	-61.3	0	0	0	117.2
990	T	32.3	Very low	35.8	Very low	123 Å²	123	128 Å²	128	76%	0.755	76%	0.757	S	S	*	*			cis	-142.4	156.9	16.5	45.7	0	0	0	0	113.6
991	S	31.5	Very low	35.7	Very low	111 Å²	111	131 Å²	131	78%	0.776	76%	0.764	S	S	*	*			trans	34.4	161.3	147	58.8	0	0	0	0	124.5
992	A	32.8	Very low	35.5	Very low	102 Å²	102	132.5 Å²	132.5	84%	0.843	77%	0.771	S	S	*	*			cis	177	153.1	-28.7	0	0	0	0	0	109.2
993	G	28.1	Very low	35.1	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	77%	0.773	S	S	*	*			trans	112.4	131.1	160	0	0	0	0	0	119.5
994	P	60.7	Low	35.8	Very low	125 Å²	125	126.5 Å²	126.5	81%	0.812	76%	0.763	S	S	*	*			trans	-124.1	-155.9	170.3	44.8	-31.4	0	0	0	111.6
995	P	58.5	Low	35.5	Very low	105 Å²	105	126.9 Å²	126.9	68%	0.682	76%	0.755	S	S	*	*			cis	-132.4	-174.6	-38.9	28.6	-5.7	0	0	0	115.2
996	S	34.9	Very low	35.4	Very low	100 Å²	100	132 Å²	132	70%	0.699	76%	0.757	S	S	*	*			trans	77.2	145.3	133.5	61.6	0	0	0	0	126.7
997	Q	34.6	Very low	34.9	Very low	164 Å²	164	127.6 Å²	127.6	77%	0.766	75%	0.751	S	S	*	*			trans	85.9	117.8	149.3	-74.8	-163.7	-80.8	0	0	124.8
998	D	30.9	Very low	35.5	Very low	129 Å²	129	128.7 Å²	128.7	69%	0.69	75%	0.75	S	S	*	*				61.9	161.8	122	-59.3	-31.1	0	0	0	126.3
999	D	29.9	Very low	35.2	Very low	145 Å²	145	129.9 Å²	129.9	78%	0.775	76%	0.762	S	S	*	*			trans	78.3	86.9	158.6	-77	-19.3	0	0	0	124.6
1000	S	29.4	Very low	34.6	Very low	87 Å²	87	124 Å²	124	61%	0.608	75%	0.753	S	S	*	*				78.8	152.2	106	85.7	0	0	0	0	124.8
1001	F	29.5	Very low	34.3	Very low	181 Å²	181	124.8 Å²	124.8	79%	0.794	76%	0.758	S	S	*	*			trans	75.9	142.1	150.9	-86	-72.3	0	0	0	124.8
1002	H	30.2	Very low	34.2	Very low	168 Å²	168	125.1 Å²	125.1	78%	0.778	76%	0.76	S	S	*	*			trans	77.5	100.3	153.6	-76.6	-60.6	0	0	0	123.9
1003	E	28.4	Very low	34.3	Very low	171 Å²	171	131.7 Å²	131.7	80%	0.799	76%	0.763	S	S	*	*			trans	-57.5	176.5	136.6	-115	-162.1	159.1	0	0	112.9
1004	P	51.4	Low	35	Very low	97 Å²	97	133.5 Å²	133.5	63%	0.63	76%	0.761	S	S	*	*			cis	-141.6	-164.4	-2.8	24.4	2.9	0	0	0	116.1
1005	V	29	Very low	33.5	Very low	106 Å²	106	138.5 Å²	138.5	64%	0.642	76%	0.764	S	S	*	*			trans	105.3	112.9	145.2	-171.1	0	0	0	0	120.9
1006	K	28.6	Very low	32.2	Very low	182 Å²	182	138.5 Å²	138.5	79%	0.791	76%	0.762	S	S	*	*			trans	60.2	129	153.9	-65.1	165.4	-168.4	170.2	0	118.8
1007	L	28.8	Very low	31.9	Very low	160 Å²	160	140.3 Å²	140.3	84%	0.838	76%	0.764	S	S	*	*				63.6	144.3	53.2	-66.5	176.2	0	0	0	115.1
1008	P	45.9	Very low	31.8	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	76%	0.76	S	S	*	*			cis	-138	160.5	-17.2	38.8	-21.7	0	0	0	116.1
1009	G	25.5	Very low	31.7	Very low	86 Å²	86	138 Å²	138	89%	0.887	76%	0.761	S	S	*	*			trans	74.5	163.1	162	0	0	0	0	0	116.8
1010	G	25.8	Very low	31.6	Very low	67 Å²	67	136 Å²	136	69%	0.691	76%	0.757	S	S	*	*			cis	179.2	155.1	-8.7	0	0	0	0	0	113.8
1011	T	26.2	Very low	31.7	Very low	141 Å²	141	140 Å²	140	87%	0.865	77%	0.766	S	S	*	*			trans	58.9	137.4	159.6	50.8	0	0	0	0	122.6
1012	S	28.6	Very low	32.9	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	76%	0.76	S	S	*	*			trans	98.4	112.1	148	74.8	0	0	0	0	120.9
1013	R	35	Very low	33.1	Very low	239 Å²	239	134.1 Å²	134.1	90%	0.902	75%	0.75	S	S	*	*			trans	-78.2	165.1	146.8	-58.8	172.6	172	175.2	-5.6	109
1014	P	43.6	Very low	33.1	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	75%	0.747	S	S	*	*				-150	-173.4	96.6	38.7	-21.3	0	0	0	115
1015	R	28.5	Very low	32	Very low	230 Å²	230	136.6 Å²	136.6	87%	0.868	75%	0.75	S	S	*	*			trans	80.4	141.4	178.1	-58.1	-172.2	172.8	-179.9	-3.2	115.3
1016	T	31	Very low	32	Very low	105 Å²	105	139.8 Å²	139.8	64%	0.644	76%	0.757	S	S	*	*			cis	-159	154.9	-8.3	10.4	0	0	0	0	109.4
1017	D	29.7	Very low	32	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	76%	0.757	S	S	*	*			trans	61.4	145.7	154.2	-49	-19	0	0	0	117.7
1018	T	32	Very low	32	Very low	113 Å²	113	137.7 Å²	137.7	69%	0.693	76%	0.76	S	S	*	*			cis	-165.9	174.1	-10.4	22	0	0	0	0	105.7
1019	D	29.3	Very low	31.2	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	76%	0.762	S	S	*	*			cis	-163.5	164.7	-5.3	-103.6	-30.8	0	0	0	106.5
1020	C	26.7	Very low	32.9	Very low	102 Å²	102	140 Å²	140	69%	0.689	75%	0.75	S	S	*	*			cis	-167.3	149.4	-40.7	-114.7	0	0	0	0	111
1021	E	33.2	Very low	33.1	Very low	172 Å²	172	144.6 Å²	144.6	80%	0.804	76%	0.759	S	S	*	*			trans	60.2	164.5	152.4	-82.5	-165.8	168.7	0	0	123.1
1022	P	53.5	Low	33.2	Very low	103 Å²	103	141.6 Å²	141.6	67%	0.669	76%	0.755	S	S	*	*			cis	-131.2	148.1	-17	25.8	-5	0	0	0	116.6
1023	E	34	Very low	33.2	Very low	122 Å²	122	145.1 Å²	145.1	57%	0.57	76%	0.758	S	S	*	*			trans	41.7	162.2	136.8	-63.5	-146.7	121.5	0	0	123.3	R1025	E1023-R1025 IonicContact OE1-CZ 2.68Å; E1023-R1025 VanDerWaalsContact OE1-CZ 3.29Å; E1023-R1025 IonicContact OE1-NE 3.12Å; E1023-R1025 PolarHBondContact OE1-NE 3.33Å; E1023-R1025 IonicContact OE1-NH2 3.21Å; E1023-R1025 PolarHBondContact OE1-NH2 3.4Å
1024	L	28.5	Very low	33	Very low	139 Å²	139	137.7 Å²	137.7	73%	0.728	75%	0.748	S	S	*	*			cis	-131.8	146.2	12.7	-90.5	89.2	0	0	0	113.8
1025	R	29.1	Very low	32.3	Very low	182 Å²	182	140.3 Å²	140.3	69%	0.687	76%	0.755	S	S	*	*				22.5	148.5	121.6	-47	-180	-169.5	-141.4	-2.4	118.8	E1023	E1023-R1025 IonicContact OE1-CZ 2.68Å; E1023-R1025 VanDerWaalsContact OE1-CZ 3.29Å; E1023-R1025 IonicContact OE1-NE 3.12Å; E1023-R1025 PolarHBondContact OE1-NE 3.33Å; E1023-R1025 IonicContact OE1-NH2 3.21Å; E1023-R1025 PolarHBondContact OE1-NH2 3.4Å
1026	Q	29.3	Very low	32.3	Very low	172 Å²	172	140.3 Å²	140.3	80%	0.804	76%	0.755	S	S	*	*			cis	-160.1	171.8	32.3	-148.8	158.8	14.9	0	0	114.7
1027	T	28.3	Very low	32.3	Very low	127 Å²	127	140.1 Å²	140.1	78%	0.779	76%	0.764	S	S	*	*			trans	-60.3	154.6	-174.5	49.5	0	0	0	0	118.6
1028	L	28.3	Very low	32.2	Very low	171 Å²	171	137.5 Å²	137.5	90%	0.895	76%	0.762	S	S	*	*			trans	-158	147.7	150	-114.2	172.8	0	0	0	115.4
1029	L	28.5	Very low	32.1	Very low	155 Å²	155	140.7 Å²	140.7	81%	0.812	77%	0.769	S	S	*	*			trans	-160.3	158.2	167.8	-87.3	173.3	0	0	0	106.6
1030	P	62.5	Low	32.1	Very low	97 Å²	97	140 Å²	140	63%	0.63	77%	0.765	S	S	*	*			cis	-129.4	-160.7	-38.6	38.3	-20.5	0	0	0	111.5
1031	N	29.6	Very low	32.2	Very low	164 Å²	164	142.9 Å²	142.9	88%	0.877	77%	0.768	S	S	*	*			trans	76.8	150.8	168.5	-52.1	-28.1	0	0	0	118.5
1032	G	27.1	Very low	31.9	Very low	77 Å²	77	140.7 Å²	140.7	79%	0.794	77%	0.772	S	S	*	*			trans	159.8	112.5	169	0	0	0	0	0	115.4
1033	H	30.4	Very low	30.8	Very low	193 Å²	193	140.2 Å²	140.2	89%	0.894	78%	0.777	S	S	*	*			trans	-83.8	142.4	-172.2	-95.1	-112.2	0	0	0	116.7
1034	A	29.8	Very low	31.3	Very low	83 Å²	83	140.1 Å²	140.1	69%	0.686	79%	0.787	S	S	*	*				57.2	131.4	129.6	0	0	0	0	0	124.4
1035	L	28.9	Very low	31.2	Very low	169 Å²	169	142.1 Å²	142.1	89%	0.885	80%	0.797	S	S	*	*			trans	169.1	129.2	136.3	-89.1	158.9	0	0	0	106
1036	R	29.3	Very low	31.3	Very low	230 Å²	230	145 Å²	145	87%	0.868	81%	0.808	S	S	*	*			cis	98.8	105.6	28.3	-158.7	-173.1	-157.7	-160.6	7.7	113
1037	A	30	Very low	31.6	Very low	101 Å²	101	148.4 Å²	148.4	84%	0.835	81%	0.814	S	S	*	*			trans	68.4	151.2	167.4	0	0	0	0	0	117.5
1038	A	28.5	Very low	31.7	Very low	84 Å²	84	146.7 Å²	146.7	69%	0.694	81%	0.812	S	S	*	*			cis	-164.1	166.6	-16.1	0	0	0	0	0	112.3
1039	Q	30	Very low	32	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	80%	0.802	S	S	*	*			trans	67.2	139.9	153	-81.2	175	-44.4	0	0	123.5
1040	N	27.8	Very low	32.2	Very low	116 Å²	116	147.4 Å²	147.4	62%	0.62	83%	0.825	S	S	*	*			trans	57.9	116.7	147.4	-72.9	43.3	0	0	0	124.2
1041	E	29.3	Very low	30.7	Very low	163 Å²	163	150 Å²	150	76%	0.762	84%	0.835	S	S	*	*				74.5	150.2	122	-65.2	177.7	131.5	0	0	123
1042	S	28.1	Very low	30.7	Very low	127 Å²	127	149.2 Å²	149.2	89%	0.888	83%	0.833	S	S	*	*			trans	70.4	148.9	172.4	75.2	0	0	0	0	117.8
1043	A	29.4	Very low	30.9	Very low	93 Å²	93	153.2 Å²	153.2	77%	0.769	84%	0.835	S	S	*	*			trans	-133.7	-170.8	-179.3	0	0	0	0	0	107.2
1044	P	44.9	Very low	31	Very low	120 Å²	120	150.9 Å²	150.9	78%	0.779	83%	0.832	S	S	*	*			cis	-122.5	169.3	-20.3	38.7	-26	0	0	0	111.9
1045	L	26.2	Very low	31	Very low	180 Å²	180	155.1 Å²	155.1	94%	0.942	84%	0.841	S	S	*	*			trans	-129.7	154	161.6	-97.5	170.4	0	0	0	112.2
1046	R	30.4	Very low	31.2	Very low	243 Å²	243	154.2 Å²	154.2	92%	0.917	84%	0.838	S	S	*	*			trans	-92.5	164	-163.9	-73.1	178.4	170	178.9	-3.8	113.6
1047	R	35.6	Very low	31.3	Very low	244 Å²	244	148.8 Å²	148.8	92%	0.921	84%	0.836	S	S	*	*			trans	-38.2	135.5	169	-59.7	171.6	176.3	166.4	-3.9	114.6
1048	A	31	Very low	31.4	Very low	91 Å²	91	152.5 Å²	152.5	75%	0.752	84%	0.836	S	S	*	*				-131.6	136.6	110.1	0	0	0	0	0	105.9
1049	S	34.9	Very low	31.7	Very low	96 Å²	96	158.2 Å²	158.2	67%	0.671	85%	0.848	S	S	*	*			cis	66.5	75.7	41.8	80.8	0	0	0	0	113.2
1050	D	32.4	Very low	31.8	Very low	245 Å²	245	156.2 Å²	156.2	100%	1.31	85%	0.848	S	S	*	*				-132.6	0	99	-79.5	-38	0	0	0	109.2

Retrieved 1,050 of 1,050 residues in 696.1 ms (Link to these results)

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